A0A5K4FCC0_SCHMA Loading...

Putative transient receptor potential cation channel,subfamily m, member

AlphaFold DB , UniProt , Accession A0A5K4FCC0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,380 aa.

						>A0A5K4FCC0_SCHMA|A0A5K4FCC0
MSITDNNSTTSEGKRIVAAKIAGAVSSGGSPARVINAFIQVKDYQGLDKYLSKHKVPTDILTASLQSACMRSDSEAVGTFAKHGGNVNHTDQFGTTLLHFAMRGGGDENVIKALVAHGLEYHSWRSAGMPLLHWSCSTGLINLVEYLVEHGTASLQEADENGRLPIHVAAVFGQPVILSYLIRVLSTRLHPLNIPAQFLPALNEDNECSLEEEEAEDDVNNKQNQNPFHCKLSVTAKDSSEGFKANVMKTVAAANYLDMNHWTPLHHASCEDAVNHYYDCIKILLDNGADPMLPTSQGKTALDLAYAAGRSQMLVDVLPKKQLIALLMLIDDIVPLKVRKRLSEEEKLKERTGLGGMTACEPYAVMSAKREPSPGLSADMHKRSRKGYSFIRRLADKMDTTDVSKGQLGNFTKTVKVDSTNIMSIWRKILLNDNVELLETLRDSMAWRQSKSNTSTLPMDFSKISDSITMPTDHISLDDFETAQQISLKQMSELFSDCYENGTGVFTHVQGAFQENLKAHDFRTVLQSMSGLLTFKSLSTNKIVILRPMHRSLLFLAIICGRFRVVEQLIRMRQFDVLPAAVLVTLILRRLHKEPTFPQQMLGELITFADRLEAIAVDVLNLVFLKDNTPEKMICRSMLNAPLRTFGGISLIDLCAKAKCTNVLSLSCCQRLLDERWHGVLICLPIWMRWTCKFFPVAGLFYFEYRTKKELKRAELIRSITASAASGGKVTPNLLSDSTSRTDVKSSGHIITKVFPATPQLTNNPLVTKRTKTTKVQNTISVHSSQGPKPHVGIYERMSNQFGWTSSPRLHFVTGVYLSPSMKFCLHSLFHLLFLMLFSVVCVYNLHFSCSRMEIVSLSYVLGYAFEELRQLILEASRDGFSDYLRDGWNWIDVFAITLTSIGFCTRMNVVNKHGSEFEEAHDVILYTTRNLYMLGLNLFYMRTLHITSISPIIGPRLKMMADMLRKDLIPLLIVFAIFIISYGVWFQGLIYPNSFYETHGQRQKKHLMNITELSRQRDMQRLGVLMSFSELFRRAFYSIFEVSIVLEEETCEDNKYCGSELGFNTVIFFVLVLYVGIVNIILINLLIALFSNTVSRIDQKSTAHWLAGRYKMVKEYSERTLLPPPFNTLCIIYELFRCFYIGTSQCFCKNIKFPFGRNKKLFKTESNDDLEEQENESPDEENSNLKKHLTRENQLIKIKEENNRRIKLLMGESDDRGKLYKQEIDAVLKFILIQSFALQNSRQTLGTGVSFRGPYTSQNASSSDGTTTSESIQLRNNQIDSRLERIEAILEKVVDRVNQIKITDTLSSQATPTIRSPVPIRMPSVKLTHAPTDVQFIPTKIPTSKELFQQLNEESQSETETNAHSLTSKLPSIKIQKSS
					

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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	27.3	Very low	39.2	Very low	242 Å²	242	115.7 Å²	115.7	100%	1.192	66%	0.658	S	S	*	*				0	86.4	0	-94.7	171.6	166.1	0	0	107.5	I3	M1-I3 PolarHBondContact O-N 3.37Å
2	S	27	Very low	41	Very low	95 Å²	95	117.1 Å²	117.1	66%	0.664	66%	0.655	S	S	*	*			trans	-65.3	110.2	172.3	45	0	0	0	0	108.2	T4	S2-T4 PolarHBondContact O-N 3.33Å
3	I	33.4	Very low	42.6	Very low	171 Å²	171	110.8 Å²	110.8	88%	0.877	63%	0.632	S	S	*	*			trans	-67.6	83.7	151.6	-62.5	172.2	0	0	0	104	M1 D5	M1-I3 PolarHBondContact O-N 3.37Å; I3-D5 PolarHBondContact O-N 3.31Å; I3-D5 VanDerWaalsContact O-N 3.09Å
4	T	32.1	Very low	43.8	Very low	98 Å²	98	111 Å²	111	60%	0.601	62%	0.622	S	S	*	*			trans	-64.2	105.6	174.6	43	0	0	0	0	107.9	S2 N6	S2-T4 PolarHBondContact O-N 3.33Å; T4-N6 PolarHBondContact O-N 3.4Å
5	D	35.8	Very low	45	Very low	122 Å²	122	111.7 Å²	111.7	65%	0.652	61%	0.611	S	S	*	*				49.3	57.1	129.1	-61.2	-32.4	0	0	0	118	I3	I3-D5 PolarHBondContact O-N 3.31Å; I3-D5 VanDerWaalsContact O-N 3.09Å
6	N	34.2	Very low	46.4	Very low	144 Å²	144	111.4 Å²	111.4	77%	0.77	61%	0.607	S	S	*	*	S	Bend	trans	-81.9	11.5	149.9	-83.1	-13.5	0	0	0	112.6	T4	T4-N6 PolarHBondContact O-N 3.4Å
7	N	42	Very low	47.5	Very low	110 Å²	110	109.7 Å²	109.7	59%	0.588	60%	0.601	S	S	*	*			trans	-87.6	-19.5	-178.8	-85.9	-18.2	0	0	0	114.6	T9 T10 S11	N7-T9 PolarHBondContact O-N 3.4Å; N7-T10 PolarHBondContact O-N 3.11Å; N7-T10 VanDerWaalsContact O-N 3.08Å; N7-T10 PolarHBondContact O-OG1 3.22Å; N7-S11 PolarHBondContact O-N 2.92Å
8	S	44.7	Very low	48.4	Very low	77 Å²	77	103.7 Å²	103.7	54%	0.538	57%	0.569	S	S	.	*	H	α-helix	trans	-61.3	-43.2	-174.6	58.3	0	0	0	0	112.3	T10 S11 E12	S8-T10 VanDerWaalsContact C-N 3.28Å; S8-T10 PolarHBondContact O-N 3.26Å; S8-S11 PolarHBondContact O-N 3.19Å; S8-S11 VanDerWaalsContact O-N 3.12Å; S8-S11 PolarHBondContact O-OG 3.21Å; S8-E12 PolarHBondContact O-N 2.83Å
9	T	46.5	Very low	49.2	Very low	109 Å²	109	101.2 Å²	101.2	67%	0.669	56%	0.563	S	S	*	*	H	α-helix	trans	-65.2	-30.6	176.2	57.4	0	0	0	0	112.6	N7 G13	N7-T9 PolarHBondContact O-N 3.4Å; T9-G13 PolarHBondContact O-N 2.76Å
10	T	53.7	Low	50	Low	55 Å²	55	103.8 Å²	103.8	34%	0.337	57%	0.568	S	S	.	*	H	α-helix	trans	-74.3	-28.5	175.2	76.9	0	0	0	0	112.4	N7 S8 K14	N7-T10 PolarHBondContact O-N 3.11Å; N7-T10 VanDerWaalsContact O-N 3.08Å; N7-T10 PolarHBondContact O-OG1 3.22Å; S8-T10 VanDerWaalsContact C-N 3.28Å; S8-T10 PolarHBondContact O-N 3.26Å; T10-K14 WeakPolarHBondContact O-CB 3.32Å; T10-K14 WeakPolarHBondContact O-CD 3.38Å; T10-K14 WeakPolarHBondContact O-CG 3.25Å; T10-K14 PolarHBondContact O-N 3.21Å
11	S	54.6	Low	50.6	Low	50 Å²	50	102.2 Å²	102.2	35%	0.35	56%	0.558	S	S	.	*	H	α-helix	trans	-69.9	-42.1	-177.7	77.9	0	0	0	0	112.1	N7 S8 K14 R15	N7-S11 PolarHBondContact O-N 2.92Å; S8-S11 PolarHBondContact O-N 3.19Å; S8-S11 VanDerWaalsContact O-N 3.12Å; S8-S11 PolarHBondContact O-OG 3.21Å; S11-K14 PolarHBondContact O-N 2.77Å; S11-R15 WeakPolarHBondContact O-CG 3.37Å; S11-R15 PolarHBondContact O-N 3.48Å
12	E	61.1	Low	52.2	Low	132 Å²	132	91.9 Å²	91.9	62%	0.617	51%	0.511	S	S	*	.	H	α-helix	trans	-71.3	-40.7	179.2	-167.4	156.6	-162.7	0	0	111.2	S8 K14 R15 I16	S8-E12 PolarHBondContact O-N 2.83Å; E12-K14 VanDerWaalsContact C-N 3.32Å; E12-K14 PolarHBondContact O-N 3.33Å; E12-R15 PolarHBondContact O-N 3.45Å; E12-I16 HydrophobicContact CG-CD1 4.49Å; E12-I16 WeakPolarHBondContact O-CG1 3.34Å; E12-I16 PolarHBondContact O-N 3.34Å
13	G	61.7	Low	53.8	Low	35 Å²	35	89.9 Å²	89.9	36%	0.361	51%	0.505	S	S	.	.	H	α-helix	trans	-57.5	-43.2	170.2	0	0	0	0	0	112.5	T9 I16 V17	T9-G13 PolarHBondContact O-N 2.76Å; G13-I16 PolarHBondContact O-N 3.08Å; G13-V17 VanDerWaalsContact O-CG2 3.3Å; G13-V17 WeakPolarHBondContact O-CG2 3.34Å; G13-V17 PolarHBondContact O-N 3.47Å
14	K	59	Low	55	Low	114 Å²	114	85.4 Å²	85.4	50%	0.496	49%	0.494	S	S	.	.	H	α-helix	trans	-66.3	-37.9	175.7	-74.9	168.7	-175.9	172.5	0	112.6	T10 S11 E12 V17 A18 V41	T10-K14 WeakPolarHBondContact O-CB 3.32Å; T10-K14 WeakPolarHBondContact O-CD 3.38Å; T10-K14 WeakPolarHBondContact O-CG 3.25Å; T10-K14 PolarHBondContact O-N 3.21Å; S11-K14 PolarHBondContact O-N 2.77Å; E12-K14 VanDerWaalsContact C-N 3.32Å; E12-K14 PolarHBondContact O-N 3.33Å; K14-V17 PolarHBondContact O-N 2.9Å; K14-A18 PolarHBondContact O-N 3.02Å; K14-V41 HydrophobicContact CB-CG1 3.86Å; K14-V41 HydrophobicContact CB-CG2 4.08Å
15	R	62.1	Low	55.9	Low	121 Å²	121	82.9 Å²	82.9	46%	0.457	48%	0.478	S	S	.	.	H	α-helix	trans	-63.2	-43.4	173.9	-75.3	178.5	-176.4	-179.4	-1	111.8	S11 E12 V17 A18 A19 V41 D43	S11-R15 WeakPolarHBondContact O-CG 3.37Å; S11-R15 PolarHBondContact O-N 3.48Å; E12-R15 PolarHBondContact O-N 3.45Å; R15-V17 VanDerWaalsContact C-N 3.31Å; R15-V17 PolarHBondContact O-N 3.2Å; R15-A18 PolarHBondContact O-N 2.94Å; R15-A19 WeakPolarHBondContact O-CB 3.43Å; R15-A19 PolarHBondContact O-N 3.5Å; R15-V41 HydrophobicContact CG-CG1 3.88Å; R15-D43 HydrophobicContact CG-CB 4.27Å
16	I	66.7	Low	56.6	Low	107 Å²	107	82.6 Å²	82.6	55%	0.549	49%	0.486	S	S	.	.	H	α-helix	trans	-62.1	-41.4	174.5	-65.3	165	0	0	0	110.2	E12 G13 A19 K20	E12-I16 HydrophobicContact CG-CD1 4.49Å; E12-I16 WeakPolarHBondContact O-CG1 3.34Å; E12-I16 PolarHBondContact O-N 3.34Å; G13-I16 PolarHBondContact O-N 3.08Å; I16-A19 PolarHBondContact O-N 2.83Å; I16-K20 WeakPolarHBondContact O-CB 3.37Å; I16-K20 PolarHBondContact O-N 3.42Å
17	V	66.1	Low	57.2	Low	83 Å²	83	81.4 Å²	81.4	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-63.9	-44.7	175.7	172.2	0	0	0	0	111.4	G13 K14 R15 K20 I21	G13-V17 VanDerWaalsContact O-CG2 3.3Å; G13-V17 WeakPolarHBondContact O-CG2 3.34Å; G13-V17 PolarHBondContact O-N 3.47Å; K14-V17 PolarHBondContact O-N 2.9Å; R15-V17 VanDerWaalsContact C-N 3.31Å; R15-V17 PolarHBondContact O-N 3.2Å; V17-K20 CarbonylContact O-C 3.56Å; V17-K20 PolarHBondContact O-N 3.25Å; V17-I21 HydrophobicContact CG1-CD1 3.81Å; V17-I21 HydrophobicContact CG1-CG1 4.35Å; V17-I21 VanDerWaalsContact O-CG1 3.22Å; V17-I21 WeakPolarHBondContact O-CG1 3.38Å; V17-I21 PolarHBondContact O-N 2.75Å
18	A	63	Low	57.6	Low	2 Å²	2	79.7 Å²	79.7	2%	0.017	50%	0.498	C	S	.	.	H	α-helix	trans	-62.7	-44.6	176.6	0	0	0	0	0	112.2	K14 R15 K20 I21 A22 F38 V41	K14-A18 PolarHBondContact O-N 3.02Å; R15-A18 PolarHBondContact O-N 2.94Å; A18-K20 VanDerWaalsContact C-N 3.31Å; A18-K20 PolarHBondContact O-N 3Å; A18-I21 PolarHBondContact O-N 3.05Å; A18-A22 PolarHBondContact O-N 3.14Å; A18-F38 HydrophobicContact CB-CD1 4.33Å; A18-F38 HydrophobicContact CB-CE1 4.35Å; A18-V41 HydrophobicContact CB-CG2 4.11Å
19	A	64.2	Low	58.1	Low	55 Å²	55	77.6 Å²	77.6	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-63.9	-36.1	174	0	0	0	0	0	112.2	R15 I16 A22 G23	R15-A19 WeakPolarHBondContact O-CB 3.43Å; R15-A19 PolarHBondContact O-N 3.5Å; I16-A19 PolarHBondContact O-N 2.83Å; A19-A22 PolarHBondContact O-N 3.3Å; A19-G23 PolarHBondContact O-N 3.42Å
20	K	65.3	Low	59.2	Low	154 Å²	154	75 Å²	75	67%	0.67	47%	0.474	S	S	*	.	H	α-helix	trans	-70.5	-36.4	175.3	-168.8	172.6	-174.1	177.2	0	111.8	I16 V17 A18 G23 A24	I16-K20 WeakPolarHBondContact O-CB 3.37Å; I16-K20 PolarHBondContact O-N 3.42Å; V17-K20 CarbonylContact O-C 3.56Å; V17-K20 PolarHBondContact O-N 3.25Å; A18-K20 VanDerWaalsContact C-N 3.31Å; A18-K20 PolarHBondContact O-N 3Å; K20-G23 PolarHBondContact O-N 3.34Å; K20-A24 WeakPolarHBondContact O-CB 3.19Å; K20-A24 PolarHBondContact O-N 2.83Å
21	I	62.8	Low	60.2	Low	71 Å²	71	74.5 Å²	74.5	36%	0.364	47%	0.472	S	S	.	.	H	α-helix	trans	-63.5	-45.6	170.4	-68.6	163	0	0	0	109.3	V17 A18 G23 A24 V25 A37	V17-I21 HydrophobicContact CG1-CD1 3.81Å; V17-I21 HydrophobicContact CG1-CG1 4.35Å; V17-I21 VanDerWaalsContact O-CG1 3.22Å; V17-I21 WeakPolarHBondContact O-CG1 3.38Å; V17-I21 PolarHBondContact O-N 2.75Å; A18-I21 PolarHBondContact O-N 3.05Å; I21-G23 VanDerWaalsContact C-N 3.31Å; I21-G23 PolarHBondContact O-N 3.39Å; I21-A24 PolarHBondContact O-N 3.38Å; I21-V25 WeakPolarHBondContact O-CB 3.2Å; I21-V25 WeakPolarHBondContact O-CG2 3.23Å; I21-V25 PolarHBondContact O-N 3.1Å; I21-A37 HydrophobicContact CD1-CB 4.47Å
22	A	59.7	Low	61.2	Low	25 Å²	25	73.9 Å²	73.9	21%	0.207	47%	0.47	C	S	.	.	H	α-helix	trans	-61.6	-38.5	175.9	0	0	0	0	0	112.4	A18 A19 V34 F38	A18-A22 PolarHBondContact O-N 3.14Å; A19-A22 PolarHBondContact O-N 3.3Å; A22-V34 HydrophobicContact CB-CG1 3.78Å; A22-F38 HydrophobicContact CB-CE2 4.06Å; A22-F38 HydrophobicContact CB-CZ 4.04Å
23	G	61	Low	61.9	Low	52 Å²	52	76.6 Å²	76.6	54%	0.536	48%	0.475	S	S	.	.	H	α-helix	trans	-76.9	-35.8	178.9	0	0	0	0	0	114.8	A19 K20 I21 V25	A19-G23 PolarHBondContact O-N 3.42Å; K20-G23 PolarHBondContact O-N 3.34Å; I21-G23 VanDerWaalsContact C-N 3.31Å; I21-G23 PolarHBondContact O-N 3.39Å; G23-V25 PolarHBondContact O-N 3.21Å
24	A	57.7	Low	62.7	Low	78 Å²	78	75 Å²	75	65%	0.645	46%	0.458	S	S	*	.	H	α-helix	trans	-72.7	-11.2	179.1	0	0	0	0	0	113.2	K20 I21 S26	K20-A24 WeakPolarHBondContact O-CB 3.19Å; K20-A24 PolarHBondContact O-N 2.83Å; I21-A24 PolarHBondContact O-N 3.38Å; A24-S26 VanDerWaalsContact C-N 3.28Å; A24-S26 PolarHBondContact O-N 3.24Å
25	V	52.5	Low	63.8	Low	44 Å²	44	69.6 Å²	69.6	27%	0.267	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	9.9	-174.7	163.3	0	0	0	0	113.2	I21 G23 S27 G28 V34	I21-V25 WeakPolarHBondContact O-CB 3.2Å; I21-V25 WeakPolarHBondContact O-CG2 3.23Å; I21-V25 PolarHBondContact O-N 3.1Å; G23-V25 PolarHBondContact O-N 3.21Å; V25-S27 PolarHBondContact O-N 3.08Å; V25-G28 PolarHBondContact O-N 2.94Å; V25-V34 HydrophobicContact CB-CG2 4.41Å; V25-V34 HydrophobicContact CG1-CG2 4.06Å; V25-V34 HydrophobicContact CG2-CG2 4.29Å
26	S	50.7	Low	64.6	Low	116 Å²	116	68 Å²	68	81%	0.811	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	4.7	-177.2	66.6	0	0	0	0	116.5	A24	A24-S26 VanDerWaalsContact C-N 3.28Å; A24-S26 PolarHBondContact O-N 3.24Å
27	S	46.3	Very low	65.2	Low	119 Å²	119	63.5 Å²	63.5	83%	0.832	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.3	29	174.5	75	0	0	0	0	116.4	V25	V25-S27 PolarHBondContact O-N 3.08Å
28	G	50.2	Low	65.9	Low	75 Å²	75	60.1 Å²	60.1	77%	0.773	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	127.3	25.7	163.3	0	0	0	0	0	117.8	V25	V25-G28 PolarHBondContact O-N 2.94Å
29	G	54.6	Low	66.7	Low	32 Å²	32	60.3 Å²	60.3	33%	0.33	39%	0.393	S	S	.	.			trans	-73	141.9	167.7	0	0	0	0	0	111.7
30	S	71.3	Confident	67.4	Low	54 Å²	54	65.4 Å²	65.4	38%	0.378	41%	0.407	S	S	.	.			trans	-62.6	130.2	-179.9	59.3	0	0	0	0	111.4	A32 R33	S30-A32 PolarHBondContact O-N 3.03Å; S30-R33 PolarHBondContact O-N 3.11Å; S30-R33 WeakPolarHBondContact OG-CG 3.41Å
31	P	74.2	Confident	68.1	Low	45 Å²	45	59.9 Å²	59.9	29%	0.292	39%	0.386	S	S	.	.	H	α-helix	trans	-51	-33.6	176.8	-29	34.5	0	0	0	113.4	R33 V34 I35 V56 I60	P31-R33 VanDerWaalsContact C-N 3.32Å; P31-R33 PolarHBondContact O-N 2.9Å; P31-V34 PolarHBondContact O-N 3.22Å; P31-I35 WeakPolarHBondContact O-CG1 3.43Å; P31-I35 PolarHBondContact O-N 2.76Å; P31-V56 HydrophobicContact CB-CG1 4.36Å; P31-I60 HydrophobicContact CB-CD1 4.43Å
32	A	75.3	Confident	68.9	Low	38 Å²	38	63.4 Å²	63.4	31%	0.314	40%	0.399	S	S	.	.	H	α-helix	trans	-58	-36.8	175.7	0	0	0	0	0	113.8	S30 N36 I60	S30-A32 PolarHBondContact O-N 3.03Å; A32-N36 WeakPolarHBondContact O-CB 3.42Å; A32-N36 PolarHBondContact O-N 3.24Å; A32-I60 HydrophobicContact CB-CG2 4.26Å
33	R	76.5	Confident	70	Confident	189 Å²	189	63.3 Å²	63.3	71%	0.713	40%	0.395	S	S	*	.	H	α-helix	trans	-68.6	-38.8	177.3	-78.7	179.2	-177	177	3.4	111.8	S30 P31 A37	S30-R33 PolarHBondContact O-N 3.11Å; S30-R33 WeakPolarHBondContact OG-CG 3.41Å; P31-R33 VanDerWaalsContact C-N 3.32Å; P31-R33 PolarHBondContact O-N 2.9Å; R33-A37 WeakPolarHBondContact O-CB 3.4Å; R33-A37 PolarHBondContact O-N 2.94Å
34	V	78.4	Confident	71.1	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.012	38%	0.375	C	S	.	.	H	α-helix	trans	-67.6	-45.8	178.7	-179.7	0	0	0	0	110.3	A22 V25 P31 N36 A37 F38 Y50	A22-V34 HydrophobicContact CB-CG1 3.78Å; V25-V34 HydrophobicContact CB-CG2 4.41Å; V25-V34 HydrophobicContact CG1-CG2 4.06Å; V25-V34 HydrophobicContact CG2-CG2 4.29Å; P31-V34 PolarHBondContact O-N 3.22Å; V34-N36 PolarHBondContact O-N 3.39Å; V34-A37 WeakPolarHBondContact O-CB 3.45Å; V34-A37 PolarHBondContact O-N 2.78Å; V34-F38 HydrophobicContact CG1-CD2 3.94Å; V34-F38 HydrophobicContact CG1-CE2 3.6Å; V34-F38 VanDerWaalsContact O-CD2 3.27Å; V34-F38 WeakPolarHBondContact O-CD2 3.35Å; V34-F38 PolarHBondContact O-N 2.96Å; V34-F38 VanDerWaalsContact O-N 3.13Å; V34-Y50 HydrophobicContact CB-CE1 4.49Å; V34-Y50 HydrophobicContact CG1-CD1 4.45Å; V34-Y50 HydrophobicContact CG1-CD2 4.15Å; V34-Y50 HydrophobicContact CG1-CE1 4.05Å; V34-Y50 HydrophobicContact CG1-CE2 3.72Å; V34-Y50 HydrophobicContact CG1-CG 4.5Å
35	I	81.6	Confident	72.3	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-58.6	-48.7	175.7	-66.6	167.4	0	0	0	110.6	P31 A37 F38 I39 L47 Y50 L51 V56 I60 F80	P31-I35 WeakPolarHBondContact O-CG1 3.43Å; P31-I35 PolarHBondContact O-N 2.76Å; I35-A37 VanDerWaalsContact C-N 3.27Å; I35-A37 PolarHBondContact O-N 2.88Å; I35-F38 PolarHBondContact O-N 3.1Å; I35-F38 VanDerWaalsContact O-N 3.17Å; I35-I39 HydrophobicContact CG2-CD1 3.89Å; I35-I39 HydrophobicContact CG2-CG1 4.42Å; I35-I39 WeakPolarHBondContact O-CG1 3.16Å; I35-I39 PolarHBondContact O-N 2.81Å; I35-L47 HydrophobicContact CG1-CD1 4.39Å; I35-L47 HydrophobicContact CG2-CD1 4.33Å; I35-Y50 HydrophobicContact CG1-CE1 4.48Å; I35-L51 HydrophobicContact CD1-CD2 4.43Å; I35-V56 HydrophobicContact CD1-CG1 4.09Å; I35-I60 HydrophobicContact CD1-CG2 4.01Å; I35-F80 HydrophobicContact CG2-CE1 3.77Å; I35-F80 HydrophobicContact CG2-CZ 3.55Å
36	N	78	Confident	73.7	Confident	86 Å²	86	65.1 Å²	65.1	46%	0.46	38%	0.377	S	S	.	.	H	α-helix	trans	-61.1	-33.7	177.4	-85.6	-17.9	0	0	0	113.2	A32 V34 Q40	A32-N36 WeakPolarHBondContact O-CB 3.42Å; A32-N36 PolarHBondContact O-N 3.24Å; V34-N36 PolarHBondContact O-N 3.39Å; N36-Q40 WeakPolarHBondContact O-CB 3.29Å; N36-Q40 WeakPolarHBondContact O-CG 3.21Å; N36-Q40 PolarHBondContact O-N 3.31Å
37	A	79.8	Confident	75.2	Confident	14 Å²	14	59.6 Å²	59.6	12%	0.116	34%	0.339	C	S	.	.	H	α-helix	trans	-65.3	-43.8	175.3	0	0	0	0	0	111.8	I21 R33 V34 I35 Q40 V41	I21-A37 HydrophobicContact CD1-CB 4.47Å; R33-A37 WeakPolarHBondContact O-CB 3.4Å; R33-A37 PolarHBondContact O-N 2.94Å; V34-A37 WeakPolarHBondContact O-CB 3.45Å; V34-A37 PolarHBondContact O-N 2.78Å; I35-A37 VanDerWaalsContact C-N 3.27Å; I35-A37 PolarHBondContact O-N 2.88Å; A37-Q40 PolarHBondContact O-N 3.46Å; A37-V41 WeakPolarHBondContact O-CG2 3.14Å; A37-V41 PolarHBondContact O-N 2.85Å
38	F	81	Confident	77	Confident	11 Å²	11	56.2 Å²	56.2	5%	0.048	31%	0.312	C	S	.	.	H	α-helix	trans	-64.8	-41.4	175.9	-76.6	-66.7	0	0	0	112.6	A18 A22 V34 I35 Q40 V41 K42 D43 L47 Y50	A18-F38 HydrophobicContact CB-CD1 4.33Å; A18-F38 HydrophobicContact CB-CE1 4.35Å; A22-F38 HydrophobicContact CB-CE2 4.06Å; A22-F38 HydrophobicContact CB-CZ 4.04Å; V34-F38 HydrophobicContact CG1-CD2 3.94Å; V34-F38 HydrophobicContact CG1-CE2 3.6Å; V34-F38 VanDerWaalsContact O-CD2 3.27Å; V34-F38 WeakPolarHBondContact O-CD2 3.35Å; V34-F38 PolarHBondContact O-N 2.96Å; V34-F38 VanDerWaalsContact O-N 3.13Å; I35-F38 PolarHBondContact O-N 3.1Å; I35-F38 VanDerWaalsContact O-N 3.17Å; F38-Q40 PolarHBondContact O-N 3.09Å; F38-V41 PolarHBondContact O-N 3.23Å; F38-K42 PolarHBondContact O-N 3.09Å; F38-D43 HydrophobicContact CD1-CB 4.31Å; F38-D43 PolarHBondContact O-N 3.22Å; F38-L47 HydrophobicContact CB-CB 4.06Å; F38-L47 HydrophobicContact CB-CD1 4.04Å; F38-L47 HydrophobicContact CB-CG 4.5Å; F38-L47 HydrophobicContact CD2-CD1 4.23Å; F38-L47 HydrophobicContact CG-CB 4.34Å; F38-L47 HydrophobicContact CG-CD1 4.4Å; F38-Y50 HydrophobicContact CE2-CD2 4.28Å; F38-Y50 HydrophobicContact CE2-CG 4.06Å
39	I	79.3	Confident	78.5	Confident	7 Å²	7	60.1 Å²	60.1	4%	0.036	31%	0.307	C	S	.	.	H	α-helix	trans	-62.1	-43.1	175.6	-62.7	168.3	0	0	0	110.8	I35 V41 K42 F80	I35-I39 HydrophobicContact CG2-CD1 3.89Å; I35-I39 HydrophobicContact CG2-CG1 4.42Å; I35-I39 WeakPolarHBondContact O-CG1 3.16Å; I35-I39 PolarHBondContact O-N 2.81Å; I39-V41 VanDerWaalsContact C-N 3.26Å; I39-V41 PolarHBondContact O-N 3.18Å; I39-K42 PolarHBondContact O-N 3.27Å; I39-K42 VanDerWaalsContact O-N 3.16Å; I39-F80 HydrophobicContact CD1-CE2 3.97Å; I39-F80 HydrophobicContact CD1-CZ 3.8Å; I39-F80 HydrophobicContact CG1-CE2 4.4Å; I39-F80 HydrophobicContact CG1-CZ 4.15Å
40	Q	78.8	Confident	79.9	Confident	161 Å²	161	60.1 Å²	60.1	75%	0.752	30%	0.297	S	S	*	.	H	α-helix	trans	-63.5	-31.5	179	-80.6	-174.2	0.1	0	0	113.1	N36 A37 F38	N36-Q40 WeakPolarHBondContact O-CB 3.29Å; N36-Q40 WeakPolarHBondContact O-CG 3.21Å; N36-Q40 PolarHBondContact O-N 3.31Å; A37-Q40 PolarHBondContact O-N 3.46Å; F38-Q40 PolarHBondContact O-N 3.09Å
41	V	80.8	Confident	80.4	Confident	38 Å²	38	58.3 Å²	58.3	23%	0.23	28%	0.283	C	S	.	.	H	α-helix	trans	-89	-8.2	178.4	-179.3	0	0	0	0	112.4	K14 R15 A18 A37 F38 I39 D43	K14-V41 HydrophobicContact CB-CG1 3.86Å; K14-V41 HydrophobicContact CB-CG2 4.08Å; R15-V41 HydrophobicContact CG-CG1 3.88Å; A18-V41 HydrophobicContact CB-CG2 4.11Å; A37-V41 WeakPolarHBondContact O-CG2 3.14Å; A37-V41 PolarHBondContact O-N 2.85Å; F38-V41 PolarHBondContact O-N 3.23Å; I39-V41 VanDerWaalsContact C-N 3.26Å; I39-V41 PolarHBondContact O-N 3.18Å; V41-D43 VanDerWaalsContact C-N 3.28Å; V41-D43 HydrophobicContact CG1-CB 4.44Å; V41-D43 PolarHBondContact O-N 3.06Å
42	K	79.5	Confident	80.9	Confident	145 Å²	145	60.1 Å²	60.1	63%	0.63	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	40.5	-173.7	-58.6	-170.1	173.5	-168	0	113	F38 I39 Y44	F38-K42 PolarHBondContact O-N 3.09Å; I39-K42 PolarHBondContact O-N 3.27Å; I39-K42 VanDerWaalsContact O-N 3.16Å; K42-Y44 HydrophobicContact CB-CE2 3.96Å
43	D	83.4	Confident	81.2	Confident	23 Å²	23	66.4 Å²	66.4	12%	0.123	32%	0.317	C	S	.	.			trans	-102.1	78.7	176.3	-175	9.7	0	0	0	110.9	R15 F38 V41 Q45 G46 L47	R15-D43 HydrophobicContact CG-CB 4.27Å; F38-D43 HydrophobicContact CD1-CB 4.31Å; F38-D43 PolarHBondContact O-N 3.22Å; V41-D43 VanDerWaalsContact C-N 3.28Å; V41-D43 HydrophobicContact CG1-CB 4.44Å; V41-D43 PolarHBondContact O-N 3.06Å; D43-Q45 VanDerWaalsContact C-N 3.35Å; D43-G46 PolarHBondContact O-N 2.98Å; D43-G46 PolarHBondContact OD1-N 2.84Å; D43-L47 WeakPolarHBondContact O-CB 3.4Å; D43-L47 PolarHBondContact O-N 3.22Å
44	Y	83.5	Confident	81.3	Confident	27 Å²	27	61.5 Å²	61.5	11%	0.106	30%	0.302	C	S	.	.	H	α-helix	trans	-73.9	-25	-176.5	-48.5	-71.3	0	0	0	113.1	K42 L47 D48 D73 E75 A76	K42-Y44 HydrophobicContact CB-CE2 3.96Å; Y44-L47 PolarHBondContact O-N 3.44Å; Y44-D48 VanDerWaalsContact O-CB 3.32Å; Y44-D48 WeakPolarHBondContact O-CB 3.33Å; Y44-D48 PolarHBondContact O-N 2.88Å; Y44-D73 WeakPolarHBondContact CE1-OD2 3.38Å; Y44-D73 PolarHBondContact OH-OD1 3.44Å; Y44-D73 PolarHBondContact OH-OD2 2.93Å; Y44-E75 HydrophobicContact CD1-CB 4.37Å; Y44-E75 HydrophobicContact CD2-CB 3.8Å; Y44-E75 WeakPolarHBondContact CD2-OE2 3.44Å; Y44-E75 HydrophobicContact CE2-CB 3.98Å; Y44-E75 WeakPolarHBondContact CE2-OE2 3.27Å; Y44-E75 HydrophobicContact CG-CB 4Å; Y44-A76 HydrophobicContact CD1-CB 4.18Å; Y44-A76 HydrophobicContact CE1-CB 3.79Å
45	Q	82.5	Confident	81.3	Confident	167 Å²	167	71.7 Å²	71.7	78%	0.78	35%	0.347	S	S	*	.	H	α-helix	trans	-69.4	-43.8	172.2	-67.5	-177.7	-0.9	0	0	110.8	D43 L47 D48 K49	D43-Q45 VanDerWaalsContact C-N 3.35Å; Q45-L47 VanDerWaalsContact C-N 3.32Å; Q45-D48 PolarHBondContact O-N 3.35Å; Q45-K49 WeakPolarHBondContact O-CB 3.43Å; Q45-K49 PolarHBondContact O-N 3.36Å
46	G	81.2	Confident	81.2	Confident	18 Å²	18	72.9 Å²	72.9	19%	0.186	35%	0.354	C	S	.	.	H	α-helix	trans	-60.7	-41.7	171.9	0	0	0	0	0	112.2	D43 K49 Y50	D43-G46 PolarHBondContact O-N 2.98Å; D43-G46 PolarHBondContact OD1-N 2.84Å; G46-K49 PolarHBondContact O-N 3.04Å; G46-Y50 WeakPolarHBondContact O-CB 3.44Å; G46-Y50 PolarHBondContact O-N 2.89Å
47	L	82.9	Confident	81.4	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-64	-47	175.8	-175.9	61.7	0	0	0	112.7	I35 F38 D43 Y44 Q45 K49 Y50 L51 F80	I35-L47 HydrophobicContact CG1-CD1 4.39Å; I35-L47 HydrophobicContact CG2-CD1 4.33Å; F38-L47 HydrophobicContact CB-CB 4.06Å; F38-L47 HydrophobicContact CB-CD1 4.04Å; F38-L47 HydrophobicContact CB-CG 4.5Å; F38-L47 HydrophobicContact CD2-CD1 4.23Å; F38-L47 HydrophobicContact CG-CB 4.34Å; F38-L47 HydrophobicContact CG-CD1 4.4Å; D43-L47 WeakPolarHBondContact O-CB 3.4Å; D43-L47 PolarHBondContact O-N 3.22Å; Y44-L47 PolarHBondContact O-N 3.44Å; Q45-L47 VanDerWaalsContact C-N 3.32Å; L47-K49 VanDerWaalsContact C-N 3.3Å; L47-K49 PolarHBondContact O-N 3.27Å; L47-Y50 PolarHBondContact O-N 2.96Å; L47-Y50 VanDerWaalsContact O-N 3.15Å; L47-L51 HydrophobicContact CD1-CD1 4.12Å; L47-L51 HydrophobicContact CD1-CG 4.15Å; L47-L51 HydrophobicContact CG-CD1 4.01Å; L47-L51 HydrophobicContact CG-CG 4.42Å; L47-L51 WeakPolarHBondContact O-CG 3.44Å; L47-L51 PolarHBondContact O-N 3.02Å; L47-F80 HydrophobicContact CD1-CE1 4.27Å; L47-F80 HydrophobicContact CD2-CE1 3.81Å; L47-F80 HydrophobicContact CD2-CE2 4.4Å; L47-F80 HydrophobicContact CD2-CZ 3.66Å; L47-F80 HydrophobicContact CG-CE1 4.37Å
48	D	83.6	Confident	81.6	Confident	49 Å²	49	75.5 Å²	75.5	26%	0.262	37%	0.373	S	S	.	.	H	α-helix	trans	-58.3	-44	176.3	-173.1	52.4	0	0	0	110.6	Y44 Q45 S52 T79 K82 H83	Y44-D48 VanDerWaalsContact O-CB 3.32Å; Y44-D48 WeakPolarHBondContact O-CB 3.33Å; Y44-D48 PolarHBondContact O-N 2.88Å; Q45-D48 PolarHBondContact O-N 3.35Å; D48-S52 VanDerWaalsContact O-CB 3.31Å; D48-S52 WeakPolarHBondContact O-CB 3.49Å; D48-S52 PolarHBondContact O-N 3.32Å; D48-S52 PolarHBondContact O-OG 2.9Å; D48-T79 HydrophobicContact CB-CG2 4.46Å; D48-K82 IonicContact OD1-NZ 2.68Å; D48-K82 IonicContact OD2-NZ 3.72Å; D48-H83 PolarHBondContact O-NE2 3.28Å; D48-H83 IonicContact OD1-CD2 2.79Å; D48-H83 IonicContact OD1-CE1 3.29Å; D48-H83 IonicContact OD1-NE2 3.83Å; D48-H83 PolarHBondContact OD1-NE2 3.5Å
49	K	83	Confident	81.7	Confident	157 Å²	157	80.7 Å²	80.7	68%	0.683	40%	0.401	S	S	*	.	H	α-helix	trans	-64.5	-40.7	175.2	-168.4	175	-176.4	176.1	0	112.3	Q45 G46 L47 S52 K53	Q45-K49 WeakPolarHBondContact O-CB 3.43Å; Q45-K49 PolarHBondContact O-N 3.36Å; G46-K49 PolarHBondContact O-N 3.04Å; L47-K49 VanDerWaalsContact C-N 3.3Å; L47-K49 PolarHBondContact O-N 3.27Å; K49-S52 PolarHBondContact O-OG 3.49Å; K49-K53 PolarHBondContact O-N 3.2Å
50	Y	82.6	Confident	82	Confident	32 Å²	32	82.5 Å²	82.5	13%	0.125	41%	0.41	C	S	.	.	H	α-helix	trans	-64.9	-49.3	177	177.6	-96.2	0	0	0	111.8	V34 I35 F38 G46 L47 S52 K53 H54 V56	V34-Y50 HydrophobicContact CB-CE1 4.49Å; V34-Y50 HydrophobicContact CG1-CD1 4.45Å; V34-Y50 HydrophobicContact CG1-CD2 4.15Å; V34-Y50 HydrophobicContact CG1-CE1 4.05Å; V34-Y50 HydrophobicContact CG1-CE2 3.72Å; V34-Y50 HydrophobicContact CG1-CG 4.5Å; I35-Y50 HydrophobicContact CG1-CE1 4.48Å; F38-Y50 HydrophobicContact CE2-CD2 4.28Å; F38-Y50 HydrophobicContact CE2-CG 4.06Å; G46-Y50 WeakPolarHBondContact O-CB 3.44Å; G46-Y50 PolarHBondContact O-N 2.89Å; L47-Y50 PolarHBondContact O-N 2.96Å; L47-Y50 VanDerWaalsContact O-N 3.15Å; Y50-S52 VanDerWaalsContact C-N 3.31Å; Y50-S52 PolarHBondContact O-N 3.31Å; Y50-K53 PolarHBondContact O-N 2.81Å; Y50-K53 VanDerWaalsContact O-N 3.12Å; Y50-H54 AromaticContact CD2-CD2 3.38Å; Y50-H54 WeakPolarHBondContact CD2-CD2 3.46Å; Y50-H54 HydrophobicContact CE1-CB 4.35Å; Y50-H54 HydrophobicContact CE2-CB 4.37Å; Y50-H54 AromaticContact CE2-CD2 3.3Å; Y50-H54 WeakPolarHBondContact CE2-CD2 3.16Å; Y50-H54 AromaticContact CE2-CG 3.85Å; Y50-H54 AromaticContact CE2-NE2 3.82Å; Y50-H54 AromaticContact CZ-CD2 3.96Å; Y50-H54 WeakPolarHBondContact O-CB 3.26Å; Y50-H54 PolarHBondContact O-CD2 3.12Å; Y50-H54 PolarHBondContact O-N 3.49Å; Y50-V56 HydrophobicContact CE1-CG2 4.37Å
51	L	83.4	Confident	82.3	Confident	15 Å²	15	75.2 Å²	75.2	8%	0.079	38%	0.377	C	S	.	.	H	α-helix	trans	-65	-34.3	179	-66.8	174.9	0	0	0	112.1	I35 L47 K53 V56 L61 F80 H83	I35-L51 HydrophobicContact CD1-CD2 4.43Å; L47-L51 HydrophobicContact CD1-CD1 4.12Å; L47-L51 HydrophobicContact CD1-CG 4.15Å; L47-L51 HydrophobicContact CG-CD1 4.01Å; L47-L51 HydrophobicContact CG-CG 4.42Å; L47-L51 WeakPolarHBondContact O-CG 3.44Å; L47-L51 PolarHBondContact O-N 3.02Å; L51-K53 VanDerWaalsContact C-N 3.26Å; L51-K53 PolarHBondContact O-N 2.99Å; L51-V56 HydrophobicContact CD2-CB 4.49Å; L51-V56 HydrophobicContact CD2-CG2 3.9Å; L51-L61 HydrophobicContact CD1-CD1 4.31Å; L51-L61 HydrophobicContact CD2-CD1 4.43Å; L51-F80 HydrophobicContact CD1-CD1 3.81Å; L51-F80 HydrophobicContact CD1-CE1 3.95Å; L51-H83 HydrophobicContact CB-CB 4.31Å; L51-H83 HydrophobicContact CD1-CB 4.3Å
52	S	83.2	Confident	82.6	Confident	84 Å²	84	74 Å²	74	59%	0.587	37%	0.369	S	S	*	.	H	α-helix	trans	-64.6	-28.9	174	75.4	0	0	0	0	113.5	D48 K49 Y50	D48-S52 VanDerWaalsContact O-CB 3.31Å; D48-S52 WeakPolarHBondContact O-CB 3.49Å; D48-S52 PolarHBondContact O-N 3.32Å; D48-S52 PolarHBondContact O-OG 2.9Å; K49-S52 PolarHBondContact O-OG 3.49Å; Y50-S52 VanDerWaalsContact C-N 3.31Å; Y50-S52 PolarHBondContact O-N 3.31Å
53	K	81.3	Confident	83	Confident	169 Å²	169	69.2 Å²	69.2	74%	0.735	36%	0.357	S	S	*	.	H	α-helix	trans	-95.4	-33	-176.1	-170.2	177.7	-179.4	-176.5	0	112.8	K49 Y50 L51	K49-K53 PolarHBondContact O-N 3.2Å; Y50-K53 PolarHBondContact O-N 2.81Å; Y50-K53 VanDerWaalsContact O-N 3.12Å; L51-K53 VanDerWaalsContact C-N 3.26Å; L51-K53 PolarHBondContact O-N 2.99Å
54	H	79.1	Confident	83.1	Confident	86 Å²	86	68.5 Å²	68.5	40%	0.398	35%	0.354	S	S	.	.	S	Bend	trans	-111.2	122.6	-173.7	-67	-78.5	0	0	0	110.9	Y50 V56	Y50-H54 AromaticContact CD2-CD2 3.38Å; Y50-H54 WeakPolarHBondContact CD2-CD2 3.46Å; Y50-H54 HydrophobicContact CE1-CB 4.35Å; Y50-H54 HydrophobicContact CE2-CB 4.37Å; Y50-H54 AromaticContact CE2-CD2 3.3Å; Y50-H54 WeakPolarHBondContact CE2-CD2 3.16Å; Y50-H54 AromaticContact CE2-CG 3.85Å; Y50-H54 AromaticContact CE2-NE2 3.82Å; Y50-H54 AromaticContact CZ-CD2 3.96Å; Y50-H54 WeakPolarHBondContact O-CB 3.26Å; Y50-H54 PolarHBondContact O-CD2 3.12Å; Y50-H54 PolarHBondContact O-N 3.49Å; H54-V56 PolarHBondContact O-N 2.89Å
55	K	78.1	Confident	83.4	Confident	217 Å²	217	67.2 Å²	67.2	94%	0.943	35%	0.349	S	S	*	.			trans	-75	94.9	176.8	-160.3	175	-174.1	180	0	109.8
56	V	80.2	Confident	83.6	Confident	24 Å²	24	61.4 Å²	61.4	15%	0.145	32%	0.321	C	S	.	.			trans	-85.9	138.1	177.4	-177.7	0	0	0	0	109.5	P31 I35 Y50 L51 H54 I60	P31-V56 HydrophobicContact CB-CG1 4.36Å; I35-V56 HydrophobicContact CD1-CG1 4.09Å; Y50-V56 HydrophobicContact CE1-CG2 4.37Å; L51-V56 HydrophobicContact CD2-CB 4.49Å; L51-V56 HydrophobicContact CD2-CG2 3.9Å; H54-V56 PolarHBondContact O-N 2.89Å; V56-I60 HydrophobicContact CG1-CB 3.93Å; V56-I60 HydrophobicContact CG1-CG2 4.01Å
57	P	82.7	Confident	83.8	Confident	69 Å²	69	62.8 Å²	62.8	45%	0.448	33%	0.328	S	S	.	.			trans	-54.7	138.6	171.8	-24.7	32.6	0	0	0	112.1	D59 I60 L61	P57-D59 PolarHBondContact O-N 2.92Å; P57-I60 HydrophobicContact CB-CD1 4.39Å; P57-I60 HydrophobicContact CB-CG1 4.37Å; P57-I60 HydrophobicContact CG-CD1 4.09Å; P57-I60 PolarHBondContact O-N 2.96Å; P57-I60 VanDerWaalsContact O-N 3.12Å; P57-L61 PolarHBondContact O-N 2.82Å
58	T	83.8	Confident	84	Confident	86 Å²	86	62.9 Å²	62.9	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-55.6	-36.1	179.9	44.6	0	0	0	0	112.4	I60 L61 T62	T58-I60 VanDerWaalsContact C-N 3.31Å; T58-I60 PolarHBondContact O-N 3.3Å; T58-L61 CarbonylContact O-C 3.33Å; T58-L61 WeakPolarHBondContact O-CA 3.19Å; T58-L61 WeakPolarHBondContact O-CB 3.46Å; T58-L61 PolarHBondContact O-N 3.48Å; T58-L61 VanDerWaalsContact O-N 3.09Å; T58-T62 WeakPolarHBondContact O-CG2 3.43Å; T58-T62 PolarHBondContact O-N 3.27Å; T58-T62 PolarHBondContact O-OG1 2.97Å
59	D	83.7	Confident	84.2	Confident	121 Å²	121	60.5 Å²	60.5	65%	0.647	32%	0.316	S	S	*	.	H	α-helix	trans	-66.2	-32.8	-178.3	-53.3	-18.7	0	0	0	112.7	P57 T62 A63	P57-D59 PolarHBondContact O-N 2.92Å; D59-T62 WeakPolarHBondContact CA-OG1 3.33Å; D59-T62 PolarHBondContact O-OG1 3.07Å; D59-A63 VanDerWaalsContact O-CB 3.31Å; D59-A63 WeakPolarHBondContact O-CB 3.45Å; D59-A63 PolarHBondContact O-N 3.31Å; D59-A63 VanDerWaalsContact O-N 3.12Å
60	I	84.8	Confident	84.4	Confident	45 Å²	45	57 Å²	57	23%	0.231	30%	0.303	C	S	.	.	H	α-helix	trans	-74.3	-37.5	174.7	-60	179	0	0	0	109.5	P31 A32 I35 V56 P57 T58 S64	P31-I60 HydrophobicContact CB-CD1 4.43Å; A32-I60 HydrophobicContact CB-CG2 4.26Å; I35-I60 HydrophobicContact CD1-CG2 4.01Å; V56-I60 HydrophobicContact CG1-CB 3.93Å; V56-I60 HydrophobicContact CG1-CG2 4.01Å; P57-I60 HydrophobicContact CB-CD1 4.39Å; P57-I60 HydrophobicContact CB-CG1 4.37Å; P57-I60 HydrophobicContact CG-CD1 4.09Å; P57-I60 PolarHBondContact O-N 2.96Å; P57-I60 VanDerWaalsContact O-N 3.12Å; T58-I60 VanDerWaalsContact C-N 3.31Å; T58-I60 PolarHBondContact O-N 3.3Å; I60-S64 VanDerWaalsContact O-CB 3.31Å; I60-S64 WeakPolarHBondContact O-CB 3.5Å; I60-S64 PolarHBondContact O-N 3.47Å; I60-S64 PolarHBondContact O-OG 3Å
61	L	86.2	Confident	84.5	Confident	8 Å²	8	63 Å²	63	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-67.1	-41.9	178.6	-169.8	62.9	0	0	0	111.5	L51 P57 T58 S64 L65 F80 H83 G84	L51-L61 HydrophobicContact CD1-CD1 4.31Å; L51-L61 HydrophobicContact CD2-CD1 4.43Å; P57-L61 PolarHBondContact O-N 2.82Å; T58-L61 CarbonylContact O-C 3.33Å; T58-L61 WeakPolarHBondContact O-CA 3.19Å; T58-L61 WeakPolarHBondContact O-CB 3.46Å; T58-L61 PolarHBondContact O-N 3.48Å; T58-L61 VanDerWaalsContact O-N 3.09Å; L61-S64 PolarHBondContact O-N 3.45Å; L61-L65 VanDerWaalsContact O-CB 3.29Å; L61-L65 WeakPolarHBondContact O-CB 3.3Å; L61-L65 PolarHBondContact O-N 3.08Å; L61-F80 HydrophobicContact CD1-CB 4.08Å; L61-F80 HydrophobicContact CD1-CD1 3.37Å; L61-F80 HydrophobicContact CD1-CE1 4.16Å; L61-F80 HydrophobicContact CD1-CG 4.1Å; L61-H83 HydrophobicContact CD2-CB 4.24Å; L61-H83 VanDerWaalsContact CD2-O 3.23Å; L61-H83 WeakPolarHBondContact CD2-O 3.22Å; L61-G84 VanDerWaalsContact CD2-C 3.5Å
62	T	87.2	Confident	84.6	Confident	11 Å²	11	63.3 Å²	63.3	7%	0.067	33%	0.329	C	S	.	.	H	α-helix	trans	-66.3	-44	175	53	0	0	0	0	111.9	T58 D59 S64 L65 Q66 N86	T58-T62 WeakPolarHBondContact O-CG2 3.43Å; T58-T62 PolarHBondContact O-N 3.27Å; T58-T62 PolarHBondContact O-OG1 2.97Å; D59-T62 WeakPolarHBondContact CA-OG1 3.33Å; D59-T62 PolarHBondContact O-OG1 3.07Å; T62-S64 VanDerWaalsContact C-N 3.28Å; T62-S64 PolarHBondContact O-N 3.29Å; T62-L65 WeakPolarHBondContact O-CB 3.3Å; T62-L65 PolarHBondContact O-N 3.46Å; T62-Q66 WeakPolarHBondContact O-CB 3.29Å; T62-Q66 PolarHBondContact O-N 3.4Å; T62-N86 HydrophobicContact CG2-CB 3.47Å; T62-N86 VanDerWaalsContact CG2-CB 3.47Å; T62-N86 VanDerWaalsContact CG2-N 3.34Å
63	A	86.7	Confident	84.7	Confident	45 Å²	45	60.3 Å²	60.3	37%	0.372	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-36.7	174.7	0	0	0	0	0	112.2	D59 S67	D59-A63 VanDerWaalsContact O-CB 3.31Å; D59-A63 WeakPolarHBondContact O-CB 3.45Å; D59-A63 PolarHBondContact O-N 3.31Å; D59-A63 VanDerWaalsContact O-N 3.12Å; A63-S67 WeakPolarHBondContact O-CB 3.38Å; A63-S67 PolarHBondContact O-N 3.02Å; A63-S67 PolarHBondContact O-OG 3.37Å
64	S	86.7	Confident	84.9	Confident	9 Å²	9	54.2 Å²	54.2	6%	0.063	29%	0.285	C	S	.	.	H	α-helix	trans	-70.1	-40.3	175.1	-56.6	0	0	0	0	111.6	I60 L61 T62 S67 A68	I60-S64 VanDerWaalsContact O-CB 3.31Å; I60-S64 WeakPolarHBondContact O-CB 3.5Å; I60-S64 PolarHBondContact O-N 3.47Å; I60-S64 PolarHBondContact O-OG 3Å; L61-S64 PolarHBondContact O-N 3.45Å; T62-S64 VanDerWaalsContact C-N 3.28Å; T62-S64 PolarHBondContact O-N 3.29Å; S64-S67 WeakPolarHBondContact O-CB 3.47Å; S64-S67 PolarHBondContact O-N 3.35Å; S64-A68 WeakPolarHBondContact O-CB 3.47Å; S64-A68 PolarHBondContact O-N 3.47Å
65	L	88.3	Confident	85.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.8	-43.4	174.6	-179.5	64.1	0	0	0	111.5	L61 T62 S67 A68 C69 V77 F80 V87 L97	L61-L65 VanDerWaalsContact O-CB 3.29Å; L61-L65 WeakPolarHBondContact O-CB 3.3Å; L61-L65 PolarHBondContact O-N 3.08Å; T62-L65 WeakPolarHBondContact O-CB 3.3Å; T62-L65 PolarHBondContact O-N 3.46Å; L65-S67 VanDerWaalsContact C-N 3.34Å; L65-S67 PolarHBondContact O-N 3.29Å; L65-A68 WeakPolarHBondContact O-CB 3.48Å; L65-A68 PolarHBondContact O-N 3.49Å; L65-C69 PolarHBondContact O-N 3.11Å; L65-C69 PolarHBondContact O-SG 3.16Å; L65-V77 HydrophobicContact CD1-CB 4.23Å; L65-V77 HydrophobicContact CD1-CG1 3.97Å; L65-V77 HydrophobicContact CD1-CG2 4.27Å; L65-F80 HydrophobicContact CB-CB 4.05Å; L65-F80 HydrophobicContact CD1-CB 3.82Å; L65-F80 HydrophobicContact CG-CB 4.46Å; L65-V87 HydrophobicContact CD2-CG2 4.49Å; L65-L97 HydrophobicContact CB-CD2 4.49Å; L65-L97 HydrophobicContact CD1-CD2 4.48Å; L65-L97 HydrophobicContact CD2-CD2 3.37Å; L65-L97 HydrophobicContact CG-CD2 3.49Å; L65-L97 VanDerWaalsContact CG-CD2 3.49Å
66	Q	87.5	Confident	85.6	Confident	44 Å²	44	45.4 Å²	45.4	21%	0.206	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-45.2	173.1	-177.4	-172.6	-6.2	0	0	111.4	T62 A68 C69 M70 F100	T62-Q66 WeakPolarHBondContact O-CB 3.29Å; T62-Q66 PolarHBondContact O-N 3.4Å; Q66-A68 VanDerWaalsContact C-N 3.33Å; Q66-A68 PolarHBondContact O-N 2.94Å; Q66-C69 PolarHBondContact O-N 2.65Å; Q66-M70 PolarHBondContact O-N 3.41Å; Q66-F100 HydrophobicContact CG-CB 4.31Å; Q66-F100 HydrophobicContact CG-CD1 3.97Å; Q66-F100 HydrophobicContact CG-CD2 3.71Å; Q66-F100 HydrophobicContact CG-CE1 4.25Å; Q66-F100 HydrophobicContact CG-CE2 3.99Å; Q66-F100 HydrophobicContact CG-CG 3.7Å; Q66-F100 HydrophobicContact CG-CZ 4.27Å
67	S	86	Confident	85.9	Confident	47 Å²	47	44.3 Å²	44.3	33%	0.329	24%	0.241	S	C	.	.	H	α-helix	trans	-64.3	-37.5	176.7	-60.6	0	0	0	0	112.2	A63 S64 L65 R71	A63-S67 WeakPolarHBondContact O-CB 3.38Å; A63-S67 PolarHBondContact O-N 3.02Å; A63-S67 PolarHBondContact O-OG 3.37Å; S64-S67 WeakPolarHBondContact O-CB 3.47Å; S64-S67 PolarHBondContact O-N 3.35Å; L65-S67 VanDerWaalsContact C-N 3.34Å; L65-S67 PolarHBondContact O-N 3.29Å; S67-R71 WeakPolarHBondContact O-CB 3.38Å; S67-R71 WeakPolarHBondContact O-CD 3.29Å; S67-R71 VanDerWaalsContact O-CG 3.23Å; S67-R71 WeakPolarHBondContact O-CG 3.46Å; S67-R71 PolarHBondContact O-N 3.47Å; S67-R71 VanDerWaalsContact O-N 3.17Å
68	A	86.9	Confident	86	Confident	2 Å²	2	41.9 Å²	41.9	2%	0.017	23%	0.229	C	C	.	.	H	α-helix	trans	-66.3	-40	175	0	0	0	0	0	111.9	S64 L65 Q66 R71 S72 D73 A76 V77 F80	S64-A68 WeakPolarHBondContact O-CB 3.47Å; S64-A68 PolarHBondContact O-N 3.47Å; L65-A68 WeakPolarHBondContact O-CB 3.48Å; L65-A68 PolarHBondContact O-N 3.49Å; Q66-A68 VanDerWaalsContact C-N 3.33Å; Q66-A68 PolarHBondContact O-N 2.94Å; A68-R71 PolarHBondContact O-N 3.23Å; A68-S72 PolarHBondContact O-N 3.27Å; A68-S72 VanDerWaalsContact O-N 3.16Å; A68-D73 PolarHBondContact O-N 3.15Å; A68-A76 HydrophobicContact CB-CB 3.77Å; A68-V77 HydrophobicContact CB-CG2 3.78Å; A68-F80 HydrophobicContact CB-CD2 4.02Å; A68-F80 HydrophobicContact CB-CE2 4.12Å
69	C	87.8	Confident	86.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.3	-46	174.8	-66.3	0	0	0	0	111.8	L65 Q66 R71 S72 F100 A101	L65-C69 PolarHBondContact O-N 3.11Å; L65-C69 PolarHBondContact O-SG 3.16Å; Q66-C69 PolarHBondContact O-N 2.65Å; C69-R71 PolarHBondContact O-N 2.94Å; C69-S72 PolarHBondContact O-N 3.3Å; C69-S72 VanDerWaalsContact O-N 3.1Å; C69-F100 HydrophobicContact CB-CB 4.27Å; C69-A101 HydrophobicContact CB-CB 4.17Å
70	M	86.8	Confident	86.3	Confident	83 Å²	83	33 Å²	33	41%	0.409	18%	0.178	S	C	.	.	H	α-helix	trans	-65.8	-26	177.4	-71.2	-163.5	-57.3	0	0	113.8	Q66 S72 F100 G104	Q66-M70 PolarHBondContact O-N 3.41Å; M70-S72 VanDerWaalsContact C-N 3.29Å; M70-F100 HydrophobicContact CG-CB 3.8Å; M70-F100 HydrophobicContact CG-CD1 3.78Å; M70-F100 HydrophobicContact CG-CG 4.23Å; M70-F100 HydrophobicContact SD-CD1 3.76Å; M70-F100 HydrophobicContact SD-CE1 4.4Å; M70-G104 WeakPolarHBondContact O-CA 3.17Å
71	R	84.7	Confident	86.3	Confident	158 Å²	158	31.3 Å²	31.3	60%	0.596	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-1.2	177.1	-69	170.5	64.6	87.4	2.1	112.6	S67 A68 C69 D73	S67-R71 WeakPolarHBondContact O-CB 3.38Å; S67-R71 WeakPolarHBondContact O-CD 3.29Å; S67-R71 VanDerWaalsContact O-CG 3.23Å; S67-R71 WeakPolarHBondContact O-CG 3.46Å; S67-R71 PolarHBondContact O-N 3.47Å; S67-R71 VanDerWaalsContact O-N 3.17Å; A68-R71 PolarHBondContact O-N 3.23Å; C69-R71 PolarHBondContact O-N 2.94Å; R71-D73 VanDerWaalsContact C-N 3.29Å; R71-D73 PolarHBondContact O-N 3.42Å
72	S	84.2	Confident	86.2	Confident	21 Å²	21	37.4 Å²	37.4	15%	0.147	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	41.3	-175.9	-55.2	0	0	0	0	113.8	A68 C69 M70 S74 G104 D107	A68-S72 PolarHBondContact O-N 3.27Å; A68-S72 VanDerWaalsContact O-N 3.16Å; C69-S72 PolarHBondContact O-N 3.3Å; C69-S72 VanDerWaalsContact O-N 3.1Å; M70-S72 VanDerWaalsContact C-N 3.29Å; S72-S74 PolarHBondContact O-N 2.89Å; S72-G104 PolarHBondContact OG-O 3.11Å; S72-D107 WeakPolarHBondContact CB-OD2 3.33Å
73	D	86.2	Confident	86.1	Confident	21 Å²	21	39.6 Å²	39.6	11%	0.112	21%	0.207	C	C	.	.			trans	-98.1	90.9	-177.1	-168.9	-17.2	0	0	0	111.3	Y44 A68 R71 E75 A76 V77	Y44-D73 WeakPolarHBondContact CE1-OD2 3.38Å; Y44-D73 PolarHBondContact OH-OD1 3.44Å; Y44-D73 PolarHBondContact OH-OD2 2.93Å; A68-D73 PolarHBondContact O-N 3.15Å; R71-D73 VanDerWaalsContact C-N 3.29Å; R71-D73 PolarHBondContact O-N 3.42Å; D73-E75 PolarHBondContact O-N 2.89Å; D73-A76 HydrophobicContact CB-CB 3.86Å; D73-A76 VanDerWaalsContact CG-CB 3.42Å; D73-A76 PolarHBondContact O-N 3.46Å; D73-A76 PolarHBondContact OD1-N 2.97Å; D73-V77 VanDerWaalsContact O-CG2 3.31Å; D73-V77 WeakPolarHBondContact O-CG2 3.49Å; D73-V77 PolarHBondContact O-N 3.35Å
74	S	85	Confident	86	Confident	41 Å²	41	39.7 Å²	39.7	29%	0.287	21%	0.212	S	C	.	.	H	α-helix	trans	-61.1	-36.7	-174.1	63.7	0	0	0	0	114.4	S72 V77 G78	S72-S74 PolarHBondContact O-N 2.89Å; S74-V77 PolarHBondContact O-N 2.97Å; S74-G78 PolarHBondContact O-N 3.26Å
75	E	85.9	Confident	85.8	Confident	119 Å²	119	39.5 Å²	39.5	56%	0.556	21%	0.211	S	C	*	.	H	α-helix	trans	-71.9	-41.6	179.1	-66	-173.9	-174.1	0	0	110.8	Y44 D73 V77 G78 T79	Y44-E75 HydrophobicContact CD1-CB 4.37Å; Y44-E75 HydrophobicContact CD2-CB 3.8Å; Y44-E75 WeakPolarHBondContact CD2-OE2 3.44Å; Y44-E75 HydrophobicContact CE2-CB 3.98Å; Y44-E75 WeakPolarHBondContact CE2-OE2 3.27Å; Y44-E75 HydrophobicContact CG-CB 4Å; D73-E75 PolarHBondContact O-N 2.89Å; E75-V77 PolarHBondContact O-N 2.96Å; E75-G78 PolarHBondContact O-N 3.45Å; E75-T79 WeakPolarHBondContact O-CG2 3.48Å; E75-T79 PolarHBondContact O-N 3.24Å; E75-T79 PolarHBondContact O-OG1 3.39Å
76	A	85.9	Confident	85.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-44.9	173	0	0	0	0	0	111.7	Y44 A68 D73 G78 T79 F80	Y44-A76 HydrophobicContact CD1-CB 4.18Å; Y44-A76 HydrophobicContact CE1-CB 3.79Å; A68-A76 HydrophobicContact CB-CB 3.77Å; D73-A76 HydrophobicContact CB-CB 3.86Å; D73-A76 VanDerWaalsContact CG-CB 3.42Å; D73-A76 PolarHBondContact O-N 3.46Å; D73-A76 PolarHBondContact OD1-N 2.97Å; A76-G78 VanDerWaalsContact C-N 3.34Å; A76-G78 PolarHBondContact O-N 3.14Å; A76-T79 PolarHBondContact O-N 3.5Å; A76-T79 PolarHBondContact O-OG1 3.13Å; A76-F80 HydrophobicContact CB-CD2 4.31Å; A76-F80 HydrophobicContact CB-CE2 4.09Å; A76-F80 WeakPolarHBondContact O-CD2 3.29Å; A76-F80 WeakPolarHBondContact O-CG 3.31Å; A76-F80 PolarHBondContact O-N 3.13Å
77	V	86.7	Confident	85.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.7	-45.7	177.5	168.8	0	0	0	0	110.9	L65 A68 D73 S74 E75 F80 A81 V110 A113 L114	L65-V77 HydrophobicContact CD1-CB 4.23Å; L65-V77 HydrophobicContact CD1-CG1 3.97Å; L65-V77 HydrophobicContact CD1-CG2 4.27Å; A68-V77 HydrophobicContact CB-CG2 3.78Å; D73-V77 VanDerWaalsContact O-CG2 3.31Å; D73-V77 WeakPolarHBondContact O-CG2 3.49Å; D73-V77 PolarHBondContact O-N 3.35Å; S74-V77 PolarHBondContact O-N 2.97Å; E75-V77 PolarHBondContact O-N 2.96Å; V77-F80 PolarHBondContact O-N 2.97Å; V77-A81 WeakPolarHBondContact O-CB 3.16Å; V77-A81 PolarHBondContact O-N 2.99Å; V77-V110 HydrophobicContact CG1-CG1 4.47Å; V77-V110 HydrophobicContact CG2-CG1 4.1Å; V77-A113 HydrophobicContact CG1-CB 4.07Å; V77-L114 HydrophobicContact CG1-CD2 3.71Å; V77-L114 HydrophobicContact CG1-CG 3.93Å
78	G	84.7	Confident	85.7	Confident	19 Å²	19	42.1 Å²	42.1	20%	0.196	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-45	175.8	0	0	0	0	0	113.1	S74 E75 A76 K82	S74-G78 PolarHBondContact O-N 3.26Å; E75-G78 PolarHBondContact O-N 3.45Å; A76-G78 VanDerWaalsContact C-N 3.34Å; A76-G78 PolarHBondContact O-N 3.14Å; G78-K82 WeakPolarHBondContact O-CB 3.5Å; G78-K82 PolarHBondContact O-N 3.49Å
79	T	86.3	Confident	85.5	Confident	19 Å²	19	44.7 Å²	44.7	12%	0.117	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-45.1	178	56.6	0	0	0	0	112.5	D48 E75 A76 K82 H83	D48-T79 HydrophobicContact CB-CG2 4.46Å; E75-T79 WeakPolarHBondContact O-CG2 3.48Å; E75-T79 PolarHBondContact O-N 3.24Å; E75-T79 PolarHBondContact O-OG1 3.39Å; A76-T79 PolarHBondContact O-N 3.5Å; A76-T79 PolarHBondContact O-OG1 3.13Å; T79-K82 PolarHBondContact O-N 2.83Å; T79-H83 PolarHBondContact O-CD2 3.16Å; T79-H83 VanDerWaalsContact O-CD2 3.22Å; T79-H83 PolarHBondContact O-N 3.03Å
80	F	87.7	Confident	85.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.6	-39.4	180	-68.6	-46.9	0	0	0	112.8	I35 I39 L47 L51 L61 L65 A68 A76 V77 H83 G85	I35-F80 HydrophobicContact CG2-CE1 3.77Å; I35-F80 HydrophobicContact CG2-CZ 3.55Å; I39-F80 HydrophobicContact CD1-CE2 3.97Å; I39-F80 HydrophobicContact CD1-CZ 3.8Å; I39-F80 HydrophobicContact CG1-CE2 4.4Å; I39-F80 HydrophobicContact CG1-CZ 4.15Å; L47-F80 HydrophobicContact CD1-CE1 4.27Å; L47-F80 HydrophobicContact CD2-CE1 3.81Å; L47-F80 HydrophobicContact CD2-CE2 4.4Å; L47-F80 HydrophobicContact CD2-CZ 3.66Å; L47-F80 HydrophobicContact CG-CE1 4.37Å; L51-F80 HydrophobicContact CD1-CD1 3.81Å; L51-F80 HydrophobicContact CD1-CE1 3.95Å; L61-F80 HydrophobicContact CD1-CB 4.08Å; L61-F80 HydrophobicContact CD1-CD1 3.37Å; L61-F80 HydrophobicContact CD1-CE1 4.16Å; L61-F80 HydrophobicContact CD1-CG 4.1Å; L65-F80 HydrophobicContact CB-CB 4.05Å; L65-F80 HydrophobicContact CD1-CB 3.82Å; L65-F80 HydrophobicContact CG-CB 4.46Å; A68-F80 HydrophobicContact CB-CD2 4.02Å; A68-F80 HydrophobicContact CB-CE2 4.12Å; A76-F80 HydrophobicContact CB-CD2 4.31Å; A76-F80 HydrophobicContact CB-CE2 4.09Å; A76-F80 WeakPolarHBondContact O-CD2 3.29Å; A76-F80 WeakPolarHBondContact O-CG 3.31Å; A76-F80 PolarHBondContact O-N 3.13Å; V77-F80 PolarHBondContact O-N 2.97Å; F80-H83 PolarHBondContact O-N 3.19Å; F80-G85 PolarHBondContact O-N 3.27Å
81	A	84.3	Confident	85.1	Confident	10 Å²	10	46 Å²	46	8%	0.083	25%	0.247	C	C	.	.	H	α-helix	trans	-64.3	-42.5	175.4	0	0	0	0	0	111.4	V77 H83 G84 V87 H117	V77-A81 WeakPolarHBondContact O-CB 3.16Å; V77-A81 PolarHBondContact O-N 2.99Å; A81-H83 VanDerWaalsContact C-N 3.29Å; A81-H83 PolarHBondContact O-N 3.46Å; A81-G84 PolarHBondContact O-N 2.76Å; A81-V87 HydrophobicContact CB-CG2 4.02Å; A81-H117 HydrophobicContact CB-CB 3.85Å
82	K	85.2	Confident	84.9	Confident	137 Å²	137	46.8 Å²	46.8	60%	0.596	26%	0.257	S	S	*	.	H	α-helix	trans	-59.9	-34.2	176.6	-176	-175.1	174.7	-162.4	0	113.6	D48 G78 T79 G84	D48-K82 IonicContact OD1-NZ 2.68Å; D48-K82 IonicContact OD2-NZ 3.72Å; G78-K82 WeakPolarHBondContact O-CB 3.5Å; G78-K82 PolarHBondContact O-N 3.49Å; T79-K82 PolarHBondContact O-N 2.83Å; K82-G84 VanDerWaalsContact C-N 3.3Å; K82-G84 PolarHBondContact O-N 3.27Å
83	H	85.3	Confident	84.6	Confident	57 Å²	57	53.3 Å²	53.3	26%	0.264	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	13.7	179.9	-77	-71.5	0	0	0	114.4	D48 L51 L61 T79 F80 A81	D48-H83 PolarHBondContact O-NE2 3.28Å; D48-H83 IonicContact OD1-CD2 2.79Å; D48-H83 IonicContact OD1-CE1 3.29Å; D48-H83 IonicContact OD1-NE2 3.83Å; D48-H83 PolarHBondContact OD1-NE2 3.5Å; L51-H83 HydrophobicContact CB-CB 4.31Å; L51-H83 HydrophobicContact CD1-CB 4.3Å; L61-H83 HydrophobicContact CD2-CB 4.24Å; L61-H83 VanDerWaalsContact CD2-O 3.23Å; L61-H83 WeakPolarHBondContact CD2-O 3.22Å; T79-H83 PolarHBondContact O-CD2 3.16Å; T79-H83 VanDerWaalsContact O-CD2 3.22Å; T79-H83 PolarHBondContact O-N 3.03Å; F80-H83 PolarHBondContact O-N 3.19Å; A81-H83 VanDerWaalsContact C-N 3.29Å; A81-H83 PolarHBondContact O-N 3.46Å
84	G	83.4	Confident	84.2	Confident	46 Å²	46	54.6 Å²	54.6	47%	0.474	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.7	21.9	174.7	0	0	0	0	0	114.8	L61 A81 K82 N86	L61-G84 VanDerWaalsContact CD2-C 3.5Å; A81-G84 PolarHBondContact O-N 2.76Å; K82-G84 VanDerWaalsContact C-N 3.3Å; K82-G84 PolarHBondContact O-N 3.27Å; G84-N86 PolarHBondContact O-N 3.3Å
85	G	84	Confident	84.1	Confident	5 Å²	5	54.3 Å²	54.3	5%	0.052	30%	0.298	C	S	.	.			trans	-62.4	127.7	168.6	0	0	0	0	0	109.4	F80 V87	F80-G85 PolarHBondContact O-N 3.27Å; G85-V87 PolarHBondContact O-N 3.25Å
86	N	86.5	Confident	84.1	Confident	80 Å²	80	49.8 Å²	49.8	43%	0.428	28%	0.278	S	S	.	.			trans	-66.2	101.6	176.9	-176.2	1.9	0	0	0	110	T62 G84 N88 H89	T62-N86 HydrophobicContact CG2-CB 3.47Å; T62-N86 VanDerWaalsContact CG2-CB 3.47Å; T62-N86 VanDerWaalsContact CG2-N 3.34Å; G84-N86 PolarHBondContact O-N 3.3Å; N86-N88 VanDerWaalsContact C-N 3.27Å; N86-N88 PolarHBondContact O-N 3.19Å; N86-N88 PolarHBondContact OD1-N 3.37Å; N86-N88 VanDerWaalsContact OD1-N 3.08Å; N86-H89 HydrophobicContact CB-CB 4.23Å; N86-H89 WeakPolarHBondContact O-CB 3.36Å; N86-H89 PolarHBondContact O-N 2.86Å; N86-H89 PolarHBondContact OD1-N 3.37Å
87	V	86	Confident	84.1	Confident	11 Å²	11	49.8 Å²	49.8	7%	0.067	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-30.4	-179.8	-176.2	0	0	0	0	111.4	L65 A81 G85 H89 L114 H117 L119	L65-V87 HydrophobicContact CD2-CG2 4.49Å; A81-V87 HydrophobicContact CB-CG2 4.02Å; G85-V87 PolarHBondContact O-N 3.25Å; V87-H89 VanDerWaalsContact C-N 3.3Å; V87-H89 PolarHBondContact O-N 3.04Å; V87-L114 HydrophobicContact CG1-CB 4.32Å; V87-L114 HydrophobicContact CG1-CD2 3.91Å; V87-H117 HydrophobicContact CG2-CB 3.98Å; V87-L119 HydrophobicContact CG1-CB 3.67Å; V87-L119 HydrophobicContact CG1-CD1 3.81Å; V87-L119 HydrophobicContact CG1-CG 4.35Å; V87-L119 WeakPolarHBondContact O-CD1 3.28Å
88	N	85.7	Confident	84.1	Confident	55 Å²	55	49.8 Å²	49.8	29%	0.294	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	23.2	179.3	-64.1	-23.1	0	0	0	112.4	N86 T90 G118 L119 E120	N86-N88 VanDerWaalsContact C-N 3.27Å; N86-N88 PolarHBondContact O-N 3.19Å; N86-N88 PolarHBondContact OD1-N 3.37Å; N86-N88 VanDerWaalsContact OD1-N 3.08Å; N88-T90 PolarHBondContact O-N 3.01Å; N88-G118 PolarHBondContact ND2-O 3.11Å; N88-G118 PolarHBondContact OD1-O 3.29Å; N88-L119 WeakPolarHBondContact OD1-CA 3.45Å; N88-E120 WeakPolarHBondContact ND2-CG 3.08Å; N88-E120 PolarHBondContact ND2-OE1 2.66Å; N88-E120 PolarHBondContact OD1-N 3.33Å
89	H	83.6	Confident	84	Confident	56 Å²	56	52.1 Å²	52.1	26%	0.259	28%	0.284	S	S	.	.			trans	-66.8	133.5	175.5	178.1	69.9	0	0	0	111.2	N86 V87 L97	N86-H89 HydrophobicContact CB-CB 4.23Å; N86-H89 WeakPolarHBondContact O-CB 3.36Å; N86-H89 PolarHBondContact O-N 2.86Å; N86-H89 PolarHBondContact OD1-N 3.37Å; V87-H89 VanDerWaalsContact C-N 3.3Å; V87-H89 PolarHBondContact O-N 3.04Å; H89-L97 HydrophobicContact CB-CD1 3.65Å; H89-L97 WeakPolarHBondContact O-CD1 3.17Å; H89-L97 PolarHBondContact O-N 2.99Å
90	T	83.2	Confident	83.9	Confident	74 Å²	74	52.5 Å²	52.5	45%	0.454	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-116.4	133.5	171.5	54.3	0	0	0	0	109.1	N88 T95 T96	N88-T90 PolarHBondContact O-N 3.01Å; T90-T95 WeakPolarHBondContact CA-O 3.45Å; T90-T96 HydrophobicContact CG2-CG2 3.92Å
91	D	82.6	Confident	83.8	Confident	38 Å²	38	52.6 Å²	52.6	20%	0.203	29%	0.285	C	S	.	.			trans	-74.4	179.2	172.9	78.2	-9.8	0	0	0	112	F93 G94 T95	D91-F93 PolarHBondContact O-N 3.3Å; D91-F93 WeakPolarHBondContact OD1-CA 3.4Å; D91-F93 WeakPolarHBondContact OD1-CB 3.17Å; D91-F93 PolarHBondContact OD1-N 3.28Å; D91-F93 WeakPolarHBondContact OD2-CD2 3.46Å; D91-G94 PolarHBondContact O-N 3.08Å; D91-G94 PolarHBondContact OD1-N 3.17Å; D91-T95 PolarHBondContact N-O 3.46Å; D91-T95 VanDerWaalsContact N-O 3.14Å; D91-T95 WeakPolarHBondContact OD1-CB 3.39Å; D91-T95 PolarHBondContact OD1-N 3.04Å; D91-T95 PolarHBondContact OD1-OG1 2.92Å; D91-T95 PolarHBondContact OD2-OG1 2.99Å
92	Q	80.5	Confident	83.8	Confident	174 Å²	174	53.7 Å²	53.7	81%	0.813	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-15.5	178.3	67.1	-174.3	-6.8	0	0	114.4
93	F	78.2	Confident	83.6	Confident	157 Å²	157	57.5 Å²	57.5	69%	0.689	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	4.9	176.6	-56.7	-69.4	0	0	0	112.1	D91 T95	D91-F93 PolarHBondContact O-N 3.3Å; D91-F93 WeakPolarHBondContact OD1-CA 3.4Å; D91-F93 WeakPolarHBondContact OD1-CB 3.17Å; D91-F93 PolarHBondContact OD1-N 3.28Å; D91-F93 WeakPolarHBondContact OD2-CD2 3.46Å; F93-T95 HydrophobicContact CB-CG2 4.17Å; F93-T95 PolarHBondContact O-N 2.99Å
94	G	78.2	Confident	83.2	Confident	48 Å²	48	56 Å²	56	50%	0.495	30%	0.3	S	S	.	.			trans	73.8	12.9	-175.9	0	0	0	0	0	113.5	D91 T96	D91-G94 PolarHBondContact O-N 3.08Å; D91-G94 PolarHBondContact OD1-N 3.17Å; G94-T96 PolarHBondContact O-N 3.3Å
95	T	82	Confident	82.9	Confident	36 Å²	36	56.6 Å²	56.6	22%	0.221	31%	0.306	C	S	.	.			trans	-77.8	116.9	178.9	69.7	0	0	0	0	109.9	T90 D91 F93 F100	T90-T95 WeakPolarHBondContact CA-O 3.45Å; D91-T95 PolarHBondContact N-O 3.46Å; D91-T95 VanDerWaalsContact N-O 3.14Å; D91-T95 WeakPolarHBondContact OD1-CB 3.39Å; D91-T95 PolarHBondContact OD1-N 3.04Å; D91-T95 PolarHBondContact OD1-OG1 2.92Å; D91-T95 PolarHBondContact OD2-OG1 2.99Å; F93-T95 HydrophobicContact CB-CG2 4.17Å; F93-T95 PolarHBondContact O-N 2.99Å; T95-F100 VanDerWaalsContact OG1-CE2 3.28Å; T95-F100 WeakPolarHBondContact OG1-CE2 3.4Å; T95-F100 VanDerWaalsContact OG1-CZ 3.27Å; T95-F100 WeakPolarHBondContact OG1-CZ 3.11Å
96	T	86.2	Confident	82.6	Confident	23 Å²	23	56.6 Å²	56.6	14%	0.141	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-72.1	160.8	175.4	61.2	0	0	0	0	111.6	T90 G94 L98 H99	T90-T96 HydrophobicContact CG2-CG2 3.92Å; G94-T96 PolarHBondContact O-N 3.3Å; T96-L98 PolarHBondContact O-N 3.34Å; T96-L98 VanDerWaalsContact O-N 3.07Å; T96-H99 PolarHBondContact N-ND1 3.39Å; T96-H99 WeakPolarHBondContact O-CB 3.34Å; T96-H99 PolarHBondContact O-N 2.86Å; T96-H99 PolarHBondContact OG1-ND1 3Å
97	L	85.7	Confident	82.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-51.4	-32.8	172.6	-102.2	75.2	0	0	0	114	L65 H89 H99 F100 A101 L114	L65-L97 HydrophobicContact CB-CD2 4.49Å; L65-L97 HydrophobicContact CD1-CD2 4.48Å; L65-L97 HydrophobicContact CD2-CD2 3.37Å; L65-L97 HydrophobicContact CG-CD2 3.49Å; L65-L97 VanDerWaalsContact CG-CD2 3.49Å; H89-L97 HydrophobicContact CB-CD1 3.65Å; H89-L97 WeakPolarHBondContact O-CD1 3.17Å; H89-L97 PolarHBondContact O-N 2.99Å; L97-H99 VanDerWaalsContact C-N 3.28Å; L97-H99 PolarHBondContact O-N 2.97Å; L97-F100 WeakPolarHBondContact O-CB 3.23Å; L97-F100 PolarHBondContact O-N 3.47Å; L97-F100 VanDerWaalsContact O-N 3.12Å; L97-A101 PolarHBondContact O-N 2.87Å; L97-L114 HydrophobicContact CD2-CD2 4.04Å
98	L	85.9	Confident	82.4	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-36	176.8	-168.1	59.2	0	0	0	112	T96 F100 A101 M102 I111 L119 W124 L131	T96-L98 PolarHBondContact O-N 3.34Å; T96-L98 VanDerWaalsContact O-N 3.07Å; L98-F100 VanDerWaalsContact C-N 3.31Å; L98-F100 PolarHBondContact O-N 3.02Å; L98-A101 PolarHBondContact O-N 3.18Å; L98-M102 HydrophobicContact CD1-CE 3.69Å; L98-M102 HydrophobicContact CG-CE 4.13Å; L98-M102 VanDerWaalsContact O-CG 3.25Å; L98-M102 WeakPolarHBondContact O-CG 3.26Å; L98-M102 PolarHBondContact O-N 2.91Å; L98-I111 HydrophobicContact CD1-CG1 4.09Å; L98-I111 HydrophobicContact CD1-CG2 4.15Å; L98-L119 HydrophobicContact CB-CD2 4.19Å; L98-L119 HydrophobicContact CD1-CD2 4.03Å; L98-L119 HydrophobicContact CD2-CD2 4.28Å; L98-L119 HydrophobicContact CG-CD2 4.41Å; L98-W124 HydrophobicContact CB-CG 4.5Å; L98-W124 HydrophobicContact CD2-CB 3.99Å; L98-W124 HydrophobicContact CD2-CD2 3.57Å; L98-W124 HydrophobicContact CD2-CE3 4.09Å; L98-W124 HydrophobicContact CD2-CG 3.53Å; L98-W124 HydrophobicContact CG-CD2 4.23Å; L98-W124 HydrophobicContact CG-CG 4.28Å; L98-L131 HydrophobicContact CD2-CD1 4.12Å; L98-L131 HydrophobicContact CD2-CD2 4Å
99	H	83.8	Confident	82.5	Confident	68 Å²	68	59.5 Å²	59.5	32%	0.315	32%	0.32	S	S	.	.	H	α-helix	trans	-61.8	-39.3	174.1	-71.3	90	0	0	0	112.1	T96 L97 M102 R103 W124	T96-H99 PolarHBondContact N-ND1 3.39Å; T96-H99 WeakPolarHBondContact O-CB 3.34Å; T96-H99 PolarHBondContact O-N 2.86Å; T96-H99 PolarHBondContact OG1-ND1 3Å; L97-H99 VanDerWaalsContact C-N 3.28Å; L97-H99 PolarHBondContact O-N 2.97Å; H99-M102 PolarHBondContact O-N 3.18Å; H99-R103 WeakPolarHBondContact O-CB 3.45Å; H99-R103 PolarHBondContact O-N 3.47Å; H99-W124 AromaticContact CD2-NE1 3.67Å; H99-W124 AromaticContact CE1-CD1 3.24Å; H99-W124 AromaticContact CE1-NE1 3.27Å; H99-W124 PolarHBondContact CE1-NE1 3.24Å; H99-W124 VanDerWaalsContact CE1-NE1 3.27Å; H99-W124 AromaticContact CG-NE1 3.65Å; H99-W124 AromaticContact ND1-CD1 3.48Å; H99-W124 AromaticContact ND1-NE1 3.38Å; H99-W124 PolarHBondContact ND1-NE1 3.4Å; H99-W124 AromaticContact NE2-CD1 3.81Å; H99-W124 AromaticContact NE2-NE1 3.42Å; H99-W124 PolarHBondContact NE2-NE1 3.45Å
100	F	84.6	Confident	82.7	Confident	27 Å²	27	56.9 Å²	56.9	12%	0.118	31%	0.308	C	S	.	.	H	α-helix	trans	-68.5	-40.1	176.6	-67.3	-71.5	0	0	0	111.9	Q66 C69 M70 T95 L97 L98 R103 G104	Q66-F100 HydrophobicContact CG-CB 4.31Å; Q66-F100 HydrophobicContact CG-CD1 3.97Å; Q66-F100 HydrophobicContact CG-CD2 3.71Å; Q66-F100 HydrophobicContact CG-CE1 4.25Å; Q66-F100 HydrophobicContact CG-CE2 3.99Å; Q66-F100 HydrophobicContact CG-CG 3.7Å; Q66-F100 HydrophobicContact CG-CZ 4.27Å; C69-F100 HydrophobicContact CB-CB 4.27Å; M70-F100 HydrophobicContact CG-CB 3.8Å; M70-F100 HydrophobicContact CG-CD1 3.78Å; M70-F100 HydrophobicContact CG-CG 4.23Å; M70-F100 HydrophobicContact SD-CD1 3.76Å; M70-F100 HydrophobicContact SD-CE1 4.4Å; T95-F100 VanDerWaalsContact OG1-CE2 3.28Å; T95-F100 WeakPolarHBondContact OG1-CE2 3.4Å; T95-F100 VanDerWaalsContact OG1-CZ 3.27Å; T95-F100 WeakPolarHBondContact OG1-CZ 3.11Å; L97-F100 WeakPolarHBondContact O-CB 3.23Å; L97-F100 PolarHBondContact O-N 3.47Å; L97-F100 VanDerWaalsContact O-N 3.12Å; L98-F100 VanDerWaalsContact C-N 3.31Å; L98-F100 PolarHBondContact O-N 3.02Å; F100-R103 PolarHBondContact O-N 3.39Å; F100-G104 PolarHBondContact O-N 3.31Å
101	A	85.8	Confident	82.9	Confident	2 Å²	2	53.3 Å²	53.3	2%	0.017	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-43.5	173.9	0	0	0	0	0	112	C69 L97 L98 R103 G104 G106 V110 L114	C69-A101 HydrophobicContact CB-CB 4.17Å; L97-A101 PolarHBondContact O-N 2.87Å; L98-A101 PolarHBondContact O-N 3.18Å; A101-R103 PolarHBondContact O-N 3.43Å; A101-G104 PolarHBondContact O-N 3.31Å; A101-G106 PolarHBondContact O-N 2.77Å; A101-V110 HydrophobicContact CB-CG1 3.96Å; A101-L114 HydrophobicContact CB-CD1 4.18Å
102	M	84.4	Confident	83.1	Confident	33 Å²	33	53.8 Å²	53.8	16%	0.163	29%	0.286	C	S	.	.	H	α-helix	trans	-65.3	-38.3	176.4	-65.1	-59.1	167.1	0	0	112.2	L98 H99 G104 G105 I111 W124 L131 W134	L98-M102 HydrophobicContact CD1-CE 3.69Å; L98-M102 HydrophobicContact CG-CE 4.13Å; L98-M102 VanDerWaalsContact O-CG 3.25Å; L98-M102 WeakPolarHBondContact O-CG 3.26Å; L98-M102 PolarHBondContact O-N 2.91Å; H99-M102 PolarHBondContact O-N 3.18Å; M102-G104 VanDerWaalsContact C-N 3.25Å; M102-G104 PolarHBondContact O-N 3.26Å; M102-G105 PolarHBondContact O-N 3.17Å; M102-I111 HydrophobicContact CE-CD1 3.31Å; M102-I111 HydrophobicContact CE-CG1 3.96Å; M102-I111 HydrophobicContact SD-CD1 4.19Å; M102-W124 HydrophobicContact CE-CH2 4.36Å; M102-W124 HydrophobicContact CG-CH2 4.3Å; M102-W124 HydrophobicContact CG-CZ2 3.8Å; M102-L131 HydrophobicContact CE-CD1 3.65Å; M102-W134 HydrophobicContact CE-CD2 4.3Å; M102-W134 HydrophobicContact CE-CE3 3.82Å; M102-W134 HydrophobicContact CE-CH2 3.98Å; M102-W134 HydrophobicContact CE-CZ2 4.42Å; M102-W134 HydrophobicContact CE-CZ3 3.64Å; M102-W134 HydrophobicContact SD-CD2 4.17Å; M102-W134 HydrophobicContact SD-CE3 4.07Å; M102-W134 HydrophobicContact SD-CH2 3.33Å; M102-W134 WeakPolarHBondContact SD-CH2 3.25Å; M102-W134 HydrophobicContact SD-CZ2 3.41Å; M102-W134 WeakPolarHBondContact SD-CZ2 3.39Å; M102-W134 HydrophobicContact SD-CZ3 3.66Å
103	R	80.3	Confident	83.3	Confident	216 Å²	216	46.3 Å²	46.3	82%	0.815	25%	0.254	S	S	*	.	H	α-helix	trans	-68.2	-24.7	176.3	-171	155.9	176	79.5	-1.9	113.2	H99 F100 A101 G105	H99-R103 WeakPolarHBondContact O-CB 3.45Å; H99-R103 PolarHBondContact O-N 3.47Å; F100-R103 PolarHBondContact O-N 3.39Å; A101-R103 PolarHBondContact O-N 3.43Å; R103-G105 VanDerWaalsContact C-N 3.31Å
104	G	76.5	Confident	83.8	Confident	27 Å²	27	38.9 Å²	38.9	28%	0.278	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-7.7	174.9	0	0	0	0	0	115.2	M70 S72 F100 A101 M102	M70-G104 WeakPolarHBondContact O-CA 3.17Å; S72-G104 PolarHBondContact OG-O 3.11Å; F100-G104 PolarHBondContact O-N 3.31Å; A101-G104 PolarHBondContact O-N 3.31Å; M102-G104 VanDerWaalsContact C-N 3.25Å; M102-G104 PolarHBondContact O-N 3.26Å
105	G	77.1	Confident	84.1	Confident	58 Å²	58	37.6 Å²	37.6	60%	0.598	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	129.7	-12.6	-177.2	0	0	0	0	0	114	M102 R103	M102-G105 PolarHBondContact O-N 3.17Å; R103-G105 VanDerWaalsContact C-N 3.31Å
106	G	77	Confident	84.3	Confident	5 Å²	5	38.9 Å²	38.9	5%	0.052	22%	0.219	C	C	.	.			trans	71.6	36.1	177.7	0	0	0	0	0	113.5	A101 E108	A101-G106 PolarHBondContact O-N 2.77Å; G106-E108 PolarHBondContact O-N 3.48Å
107	D	84.1	Confident	84.2	Confident	77 Å²	77	41.6 Å²	41.6	41%	0.412	23%	0.23	S	C	.	.			trans	-59.8	124	-179.1	-80.7	12	0	0	0	111.6	S72 N109 V110 I111	S72-D107 WeakPolarHBondContact CB-OD2 3.33Å; D107-N109 VanDerWaalsContact C-N 3.28Å; D107-N109 PolarHBondContact O-N 2.91Å; D107-V110 HydrophobicContact CB-CB 4.33Å; D107-V110 HydrophobicContact CB-CG2 3.95Å; D107-V110 WeakPolarHBondContact O-CB 3.4Å; D107-V110 PolarHBondContact O-N 2.88Å; D107-V110 VanDerWaalsContact O-N 3.08Å; D107-I111 PolarHBondContact O-N 2.8Å
108	E	85.5	Confident	84.1	Confident	28 Å²	28	43.9 Å²	43.9	13%	0.131	25%	0.253	C	S	.	.	H	α-helix	trans	-54.1	-43.4	-179.1	170.5	-174.7	147.6	0	0	112.8	G106 V110 I111 K112 N142 L143	G106-E108 PolarHBondContact O-N 3.48Å; E108-V110 VanDerWaalsContact C-N 3.25Å; E108-V110 PolarHBondContact O-N 3.43Å; E108-I111 PolarHBondContact O-N 3.2Å; E108-K112 HydrophobicContact CG-CD 3.99Å; E108-K112 HydrophobicContact CG-CG 4.3Å; E108-K112 WeakPolarHBondContact O-CB 3.1Å; E108-K112 WeakPolarHBondContact O-CG 3.3Å; E108-K112 PolarHBondContact O-N 3.43Å; E108-K112 WeakPolarHBondContact OE1-CE 3.25Å; E108-K112 IonicContact OE1-NZ 3.44Å; E108-K112 PolarHBondContact OE1-NZ 2.92Å; E108-N142 VanDerWaalsContact CD-CB 3.42Å; E108-N142 WeakPolarHBondContact OE1-CB 3.46Å; E108-N142 WeakPolarHBondContact OE2-CB 3.3Å; E108-L143 HydrophobicContact CG-CB 3.85Å; E108-L143 HydrophobicContact CG-CD1 4.28Å
109	N	87.9	Confident	84.1	Confident	101 Å²	101	44.2 Å²	44.2	54%	0.54	26%	0.255	S	S	.	.	H	α-helix	trans	-63.9	-33.3	-177.8	-67.9	-25.4	0	0	0	112	D107 A113	D107-N109 VanDerWaalsContact C-N 3.28Å; D107-N109 PolarHBondContact O-N 2.91Å; N109-A113 VanDerWaalsContact O-CB 3.32Å; N109-A113 WeakPolarHBondContact O-CB 3.19Å; N109-A113 PolarHBondContact O-N 3.04Å
110	V	87.6	Confident	84	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-69.2	-45.4	176.2	173.8	0	0	0	0	110	V77 A101 D107 E108 A113 L114	V77-V110 HydrophobicContact CG1-CG1 4.47Å; V77-V110 HydrophobicContact CG2-CG1 4.1Å; A101-V110 HydrophobicContact CB-CG1 3.96Å; D107-V110 HydrophobicContact CB-CB 4.33Å; D107-V110 HydrophobicContact CB-CG2 3.95Å; D107-V110 WeakPolarHBondContact O-CB 3.4Å; D107-V110 PolarHBondContact O-N 2.88Å; D107-V110 VanDerWaalsContact O-N 3.08Å; E108-V110 VanDerWaalsContact C-N 3.25Å; E108-V110 PolarHBondContact O-N 3.43Å; V110-A113 PolarHBondContact O-N 2.93Å; V110-L114 HydrophobicContact CG1-CD1 4.16Å; V110-L114 WeakPolarHBondContact O-CG 3.35Å; V110-L114 PolarHBondContact O-N 2.95Å
111	I	87.4	Confident	84	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.7	-44.5	178.6	-58.5	161.6	0	0	0	110.1	L98 M102 D107 E108 A113 L114 V115 L131 W134 L143	L98-I111 HydrophobicContact CD1-CG1 4.09Å; L98-I111 HydrophobicContact CD1-CG2 4.15Å; M102-I111 HydrophobicContact CE-CD1 3.31Å; M102-I111 HydrophobicContact CE-CG1 3.96Å; M102-I111 HydrophobicContact SD-CD1 4.19Å; D107-I111 PolarHBondContact O-N 2.8Å; E108-I111 PolarHBondContact O-N 3.2Å; I111-A113 VanDerWaalsContact C-N 3.33Å; I111-A113 PolarHBondContact O-N 3.46Å; I111-L114 PolarHBondContact O-N 3.04Å; I111-V115 HydrophobicContact CG2-CG2 4.28Å; I111-V115 VanDerWaalsContact O-CG2 3.3Å; I111-V115 WeakPolarHBondContact O-CG2 3.4Å; I111-V115 PolarHBondContact O-N 3.47Å; I111-L131 HydrophobicContact CG2-CD2 4.16Å; I111-W134 HydrophobicContact CD1-CZ3 4.07Å; I111-L143 HydrophobicContact CB-CD1 4.1Å; I111-L143 HydrophobicContact CD1-CD2 3.77Å; I111-L143 HydrophobicContact CG2-CD1 3.82Å; I111-L143 HydrophobicContact CG2-CD2 4.36Å
112	K	86.2	Confident	83.5	Confident	48 Å²	48	51.2 Å²	51.2	21%	0.209	29%	0.287	C	S	.	.	H	α-helix	trans	-56.9	-46	173.7	-75.6	-178.9	170.2	-178.5	0	112	E108 V115 A116 N142 L143 Y146	E108-K112 HydrophobicContact CG-CD 3.99Å; E108-K112 HydrophobicContact CG-CG 4.3Å; E108-K112 WeakPolarHBondContact O-CB 3.1Å; E108-K112 WeakPolarHBondContact O-CG 3.3Å; E108-K112 PolarHBondContact O-N 3.43Å; E108-K112 WeakPolarHBondContact OE1-CE 3.25Å; E108-K112 IonicContact OE1-NZ 3.44Å; E108-K112 PolarHBondContact OE1-NZ 2.92Å; K112-V115 PolarHBondContact O-N 2.83Å; K112-A116 VanDerWaalsContact O-CB 3.27Å; K112-A116 WeakPolarHBondContact O-CB 3.25Å; K112-A116 PolarHBondContact O-N 3.49Å; K112-N142 WeakPolarHBondContact CE-O 3.43Å; K112-N142 PolarHBondContact NZ-O 2.81Å; K112-L143 HydrophobicContact CG-CD1 4.17Å; K112-Y146 HydrophobicContact CB-CE1 4.39Å; K112-Y146 HydrophobicContact CD-CD2 4.45Å; K112-Y146 HydrophobicContact CD-CG 4.26Å; K112-Y146 HydrophobicContact CG-CD1 3.86Å; K112-Y146 HydrophobicContact CG-CD2 4.46Å; K112-Y146 HydrophobicContact CG-CE1 4.21Å; K112-Y146 HydrophobicContact CG-CG 3.99Å
113	A	85.9	Confident	83	Confident	17 Å²	17	54.2 Å²	54.2	14%	0.14	31%	0.311	C	S	.	.	H	α-helix	trans	-61.4	-44	177.2	0	0	0	0	0	111.6	V77 N109 V110 I111 A116 H117	V77-A113 HydrophobicContact CG1-CB 4.07Å; N109-A113 VanDerWaalsContact O-CB 3.32Å; N109-A113 WeakPolarHBondContact O-CB 3.19Å; N109-A113 PolarHBondContact O-N 3.04Å; V110-A113 PolarHBondContact O-N 2.93Å; I111-A113 VanDerWaalsContact C-N 3.33Å; I111-A113 PolarHBondContact O-N 3.46Å; A113-A116 PolarHBondContact O-N 2.95Å; A113-H117 PolarHBondContact O-N 3.18Å; A113-H117 PolarHBondContact O-ND1 3.06Å
114	L	86.9	Confident	83	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-47	177.1	-67.7	168.9	0	0	0	111.7	V77 V87 L97 A101 V110 I111 A116 H117 G118 L119	V77-L114 HydrophobicContact CG1-CD2 3.71Å; V77-L114 HydrophobicContact CG1-CG 3.93Å; V87-L114 HydrophobicContact CG1-CB 4.32Å; V87-L114 HydrophobicContact CG1-CD2 3.91Å; L97-L114 HydrophobicContact CD2-CD2 4.04Å; A101-L114 HydrophobicContact CB-CD1 4.18Å; V110-L114 HydrophobicContact CG1-CD1 4.16Å; V110-L114 WeakPolarHBondContact O-CG 3.35Å; V110-L114 PolarHBondContact O-N 2.95Å; I111-L114 PolarHBondContact O-N 3.04Å; L114-A116 PolarHBondContact O-N 3.06Å; L114-H117 CarbonylContact O-C 3.54Å; L114-H117 PolarHBondContact O-N 2.9Å; L114-H117 VanDerWaalsContact O-N 3.11Å; L114-G118 PolarHBondContact O-N 2.83Å; L114-L119 HydrophobicContact CB-CB 3.99Å; L114-L119 HydrophobicContact CB-CD2 3.79Å; L114-L119 HydrophobicContact CB-CG 4.33Å; L114-L119 HydrophobicContact CD1-CD2 4.39Å; L114-L119 VanDerWaalsContact O-CB 3.25Å; L114-L119 WeakPolarHBondContact O-CB 3.3Å; L114-L119 PolarHBondContact O-N 3.39Å; L114-L119 VanDerWaalsContact O-N 3.1Å
115	V	85.8	Confident	83.3	Confident	21 Å²	21	47.2 Å²	47.2	13%	0.127	28%	0.276	C	S	.	.	H	α-helix	trans	-62.5	-41.5	178.7	174.4	0	0	0	0	111.3	I111 K112 H117 G118 L119 Y121 Y146 L147	I111-V115 HydrophobicContact CG2-CG2 4.28Å; I111-V115 VanDerWaalsContact O-CG2 3.3Å; I111-V115 WeakPolarHBondContact O-CG2 3.4Å; I111-V115 PolarHBondContact O-N 3.47Å; K112-V115 PolarHBondContact O-N 2.83Å; V115-H117 PolarHBondContact O-N 3.09Å; V115-G118 PolarHBondContact O-N 3.45Å; V115-L119 HydrophobicContact CG2-CD2 4.36Å; V115-Y121 HydrophobicContact CG1-CE1 4.05Å; V115-Y121 HydrophobicContact CG2-CD1 3.93Å; V115-Y121 HydrophobicContact CG2-CE1 4.04Å; V115-Y146 HydrophobicContact CB-CE1 4.12Å; V115-Y146 HydrophobicContact CG1-CE1 3.88Å; V115-L147 HydrophobicContact CG2-CD2 4.38Å
116	A	84.8	Confident	83.2	Confident	64 Å²	64	46.6 Å²	46.6	53%	0.529	26%	0.263	S	S	.	.	H	α-helix	trans	-60.1	-26.2	175.8	0	0	0	0	0	113.4	K112 A113 L114	K112-A116 VanDerWaalsContact O-CB 3.27Å; K112-A116 WeakPolarHBondContact O-CB 3.25Å; K112-A116 PolarHBondContact O-N 3.49Å; A113-A116 PolarHBondContact O-N 2.95Å; L114-A116 PolarHBondContact O-N 3.06Å
117	H	85.6	Confident	83.1	Confident	79 Å²	79	50.7 Å²	50.7	37%	0.366	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	19.1	178.1	-65.2	82.3	0	0	0	113.1	A81 V87 A113 L114 V115	A81-H117 HydrophobicContact CB-CB 3.85Å; V87-H117 HydrophobicContact CG2-CB 3.98Å; A113-H117 PolarHBondContact O-N 3.18Å; A113-H117 PolarHBondContact O-ND1 3.06Å; L114-H117 CarbonylContact O-C 3.54Å; L114-H117 PolarHBondContact O-N 2.9Å; L114-H117 VanDerWaalsContact O-N 3.11Å; V115-H117 PolarHBondContact O-N 3.09Å
118	G	84	Confident	82.8	Confident	48 Å²	48	47.3 Å²	47.3	50%	0.495	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	27.1	171.7	0	0	0	0	0	115.4	N88 L114 V115 E120	N88-G118 PolarHBondContact ND2-O 3.11Å; N88-G118 PolarHBondContact OD1-O 3.29Å; L114-G118 PolarHBondContact O-N 2.83Å; V115-G118 PolarHBondContact O-N 3.45Å; G118-E120 PolarHBondContact O-N 2.95Å
119	L	84.4	Confident	82.8	Confident	9 Å²	9	47 Å²	47	5%	0.047	28%	0.279	C	S	.	.			trans	-58.6	120.1	171.9	-179.2	75.3	0	0	0	111.3	V87 N88 L98 L114 V115 Y121	V87-L119 HydrophobicContact CG1-CB 3.67Å; V87-L119 HydrophobicContact CG1-CD1 3.81Å; V87-L119 HydrophobicContact CG1-CG 4.35Å; V87-L119 WeakPolarHBondContact O-CD1 3.28Å; N88-L119 WeakPolarHBondContact OD1-CA 3.45Å; L98-L119 HydrophobicContact CB-CD2 4.19Å; L98-L119 HydrophobicContact CD1-CD2 4.03Å; L98-L119 HydrophobicContact CD2-CD2 4.28Å; L98-L119 HydrophobicContact CG-CD2 4.41Å; L114-L119 HydrophobicContact CB-CB 3.99Å; L114-L119 HydrophobicContact CB-CD2 3.79Å; L114-L119 HydrophobicContact CB-CG 4.33Å; L114-L119 HydrophobicContact CD1-CD2 4.39Å; L114-L119 VanDerWaalsContact O-CB 3.25Å; L114-L119 WeakPolarHBondContact O-CB 3.3Å; L114-L119 PolarHBondContact O-N 3.39Å; L114-L119 VanDerWaalsContact O-N 3.1Å; V115-L119 HydrophobicContact CG2-CD2 4.36Å; L119-Y121 WeakPolarHBondContact O-CD1 3.17Å; L119-Y121 PolarHBondContact O-N 2.84Å
120	E	82.8	Confident	82.7	Confident	130 Å²	130	42.4 Å²	42.4	61%	0.607	25%	0.254	S	S	*	.			trans	-81.8	94.9	172.3	-73	171.8	-151.3	0	0	110.4	N88 G118	N88-E120 WeakPolarHBondContact ND2-CG 3.08Å; N88-E120 PolarHBondContact ND2-OE1 2.66Å; N88-E120 PolarHBondContact OD1-N 3.33Å; G118-E120 PolarHBondContact O-N 2.95Å
121	Y	82.9	Confident	82.7	Confident	15 Å²	15	42.5 Å²	42.5	6%	0.059	25%	0.254	C	S	.	.			trans	-98	-0.8	-178.6	61	-95.7	0	0	0	114.5	V115 L119 S123 W124 L131 L147 T152 A153	V115-Y121 HydrophobicContact CG1-CE1 4.05Å; V115-Y121 HydrophobicContact CG2-CD1 3.93Å; V115-Y121 HydrophobicContact CG2-CE1 4.04Å; L119-Y121 WeakPolarHBondContact O-CD1 3.17Å; L119-Y121 PolarHBondContact O-N 2.84Å; Y121-S123 VanDerWaalsContact C-N 3.28Å; Y121-S123 PolarHBondContact O-N 3.33Å; Y121-W124 WeakPolarHBondContact O-CB 3.3Å; Y121-W124 PolarHBondContact O-N 2.72Å; Y121-L131 HydrophobicContact CD1-CD2 4.32Å; Y121-L131 HydrophobicContact CD2-CB 4.13Å; Y121-L131 HydrophobicContact CD2-CD2 3.9Å; Y121-L131 HydrophobicContact CG-CD2 3.77Å; Y121-L147 HydrophobicContact CE1-CD2 4.24Å; Y121-L147 HydrophobicContact CE2-CD2 4.44Å; Y121-T152 PolarHBondContact OH-N 3.28Å; Y121-A153 HydrophobicContact CE2-CB 4.18Å; Y121-A153 PolarHBondContact OH-N 2.83Å
122	H	76.4	Confident	82.8	Confident	98 Å²	98	42.7 Å²	42.7	45%	0.454	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-35.7	-175.2	-57.7	76.6	0	0	0	112.8	W124 R125 T152	H122-W124 VanDerWaalsContact C-N 3.34Å; H122-R125 PolarHBondContact O-NH1 3.17Å; H122-T152 PolarHBondContact CE1-OG1 2.8Å; H122-T152 PolarHBondContact NE2-OG1 2.9Å
123	S	74.2	Confident	83	Confident	96 Å²	96	40.4 Å²	40.4	67%	0.671	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-8.7	177.1	57.7	0	0	0	0	113.6	Y121	Y121-S123 VanDerWaalsContact C-N 3.28Å; Y121-S123 PolarHBondContact O-N 3.33Å
124	W	80.3	Confident	83.1	Confident	5 Å²	5	41.5 Å²	41.5	2%	0.019	25%	0.246	C	C	.	.			trans	-77.7	133.2	-175.7	-175.3	86.4	0	0	0	111.8	L98 H99 M102 Y121 H122 S126 L131 W134	L98-W124 HydrophobicContact CB-CG 4.5Å; L98-W124 HydrophobicContact CD2-CB 3.99Å; L98-W124 HydrophobicContact CD2-CD2 3.57Å; L98-W124 HydrophobicContact CD2-CE3 4.09Å; L98-W124 HydrophobicContact CD2-CG 3.53Å; L98-W124 HydrophobicContact CG-CD2 4.23Å; L98-W124 HydrophobicContact CG-CG 4.28Å; H99-W124 AromaticContact CD2-NE1 3.67Å; H99-W124 AromaticContact CE1-CD1 3.24Å; H99-W124 AromaticContact CE1-NE1 3.27Å; H99-W124 PolarHBondContact CE1-NE1 3.24Å; H99-W124 VanDerWaalsContact CE1-NE1 3.27Å; H99-W124 AromaticContact CG-NE1 3.65Å; H99-W124 AromaticContact ND1-CD1 3.48Å; H99-W124 AromaticContact ND1-NE1 3.38Å; H99-W124 PolarHBondContact ND1-NE1 3.4Å; H99-W124 AromaticContact NE2-CD1 3.81Å; H99-W124 AromaticContact NE2-NE1 3.42Å; H99-W124 PolarHBondContact NE2-NE1 3.45Å; M102-W124 HydrophobicContact CE-CH2 4.36Å; M102-W124 HydrophobicContact CG-CH2 4.3Å; M102-W124 HydrophobicContact CG-CZ2 3.8Å; Y121-W124 WeakPolarHBondContact O-CB 3.3Å; Y121-W124 PolarHBondContact O-N 2.72Å; H122-W124 VanDerWaalsContact C-N 3.34Å; W124-S126 VanDerWaalsContact CZ2-CB 3.46Å; W124-L131 HydrophobicContact CE3-CB 4.04Å; W124-L131 HydrophobicContact CE3-CD1 4.4Å; W124-L131 HydrophobicContact CZ3-CB 4.25Å; W124-L131 HydrophobicContact CZ3-CD1 4.1Å; W124-W134 HydrophobicContact CH2-CB 4.36Å; W124-W134 HydrophobicContact CH2-CG 4.19Å; W124-W134 HydrophobicContact CZ3-CB 4.16Å; W124-W134 HydrophobicContact CZ3-CG 4.47Å
125	R	81.2	Confident	83.2	Confident	91 Å²	91	41.5 Å²	41.5	34%	0.343	25%	0.246	S	C	.	.			trans	-137.4	134.2	173.7	-62.3	-66.3	-178.4	-85.1	-4.3	110	H122 M129 E157	H122-R125 PolarHBondContact O-NH1 3.17Å; R125-M129 WeakPolarHBondContact CA-O 3.39Å; R125-E157 IonicContact CZ-OE1 3.76Å; R125-E157 IonicContact NH1-OE1 3.59Å; R125-E157 IonicContact NH2-OE1 3.99Å; R125-E157 PolarHBondContact NH2-OE1 3.37Å
126	S	77	Confident	83.4	Confident	46 Å²	46	40.5 Å²	40.5	32%	0.322	24%	0.24	S	C	.	.	B	Isolated β-bridge	trans	-119.7	119.7	167.4	-174.2	0	0	0	0	109.7	W124 G128 M129	W124-S126 VanDerWaalsContact CZ2-CB 3.46Å; S126-G128 PolarHBondContact O-N 2.98Å; S126-M129 PolarHBondContact N-O 3.27Å; S126-M129 VanDerWaalsContact N-O 3.09Å; S126-M129 WeakPolarHBondContact O-CB 3.44Å; S126-M129 PolarHBondContact O-N 3.02Å
127	A	73.5	Confident	83.6	Confident	90 Å²	90	38.3 Å²	38.3	74%	0.744	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	40.2	-170.4	0	0	0	0	0	112.5	M129	A127-M129 VanDerWaalsContact C-N 3.27Å; A127-M129 PolarHBondContact O-N 3.47Å
128	G	78.3	Confident	83.6	Confident	6 Å²	6	37.5 Å²	37.5	6%	0.062	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	-2.2	-179.2	0	0	0	0	0	116.7	S126 E160	S126-G128 PolarHBondContact O-N 2.98Å; G128-E160 VanDerWaalsContact CA-CG 3.48Å; G128-E160 WeakPolarHBondContact CA-OE1 3.37Å; G128-E160 WeakPolarHBondContact CA-OE2 3.38Å; G128-E160 PolarHBondContact O-N 3.19Å
129	M	85.2	Confident	83.7	Confident	22 Å²	22	36.5 Å²	36.5	11%	0.108	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-93.8	131.1	-178.2	-65.5	-172.2	-66.4	0	0	111.7	R125 S126 A127 H133 D159	R125-M129 WeakPolarHBondContact CA-O 3.39Å; S126-M129 PolarHBondContact N-O 3.27Å; S126-M129 VanDerWaalsContact N-O 3.09Å; S126-M129 WeakPolarHBondContact O-CB 3.44Å; S126-M129 PolarHBondContact O-N 3.02Å; A127-M129 VanDerWaalsContact C-N 3.27Å; A127-M129 PolarHBondContact O-N 3.47Å; M129-H133 HydrophobicContact CB-CB 4.03Å; M129-H133 HydrophobicContact CG-CB 4.44Å; M129-D159 HydrophobicContact CG-CB 4.31Å
130	P	86.9	Confident	83.8	Confident	4 Å²	4	38.1 Å²	38.1	3%	0.026	22%	0.22	C	C	.	.			trans	-59.3	162.3	164.8	-20.7	31.4	0	0	0	111.9	L132 H133 W134 E157	P130-L132 VanDerWaalsContact C-N 3.27Å; P130-L132 PolarHBondContact O-N 2.97Å; P130-H133 PolarHBondContact O-N 3.33Å; P130-H133 VanDerWaalsContact O-N 3.14Å; P130-W134 PolarHBondContact O-N 3.3Å; P130-E157 HydrophobicContact CG-CG 4.07Å
131	L	86.8	Confident	84.1	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-57.5	-38.9	-178	-178.8	58.5	0	0	0	112.8	L98 M102 I111 Y121 W124 W134 S135 L147	L98-L131 HydrophobicContact CD2-CD1 4.12Å; L98-L131 HydrophobicContact CD2-CD2 4Å; M102-L131 HydrophobicContact CE-CD1 3.65Å; I111-L131 HydrophobicContact CG2-CD2 4.16Å; Y121-L131 HydrophobicContact CD1-CD2 4.32Å; Y121-L131 HydrophobicContact CD2-CB 4.13Å; Y121-L131 HydrophobicContact CD2-CD2 3.9Å; Y121-L131 HydrophobicContact CG-CD2 3.77Å; W124-L131 HydrophobicContact CE3-CB 4.04Å; W124-L131 HydrophobicContact CE3-CD1 4.4Å; W124-L131 HydrophobicContact CZ3-CB 4.25Å; W124-L131 HydrophobicContact CZ3-CD1 4.1Å; L131-W134 HydrophobicContact CD1-CE3 4.27Å; L131-W134 PolarHBondContact O-N 2.69Å; L131-S135 PolarHBondContact O-N 3.48Å; L131-S135 PolarHBondContact O-OG 3.4Å; L131-L147 HydrophobicContact CD2-CD1 4.23Å; L131-L147 HydrophobicContact CD2-CD2 4.17Å; L131-L147 HydrophobicContact CG-CD1 4.01Å
132	L	89.8	Confident	84.3	Confident	5 Å²	5	36.9 Å²	36.9	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-63.5	-45.4	177.9	-174.7	60.6	0	0	0	111.3	P130 W134 S135 C136 V144 L147 V148 A153 L155 P165	P130-L132 VanDerWaalsContact C-N 3.27Å; P130-L132 PolarHBondContact O-N 2.97Å; L132-W134 PolarHBondContact O-N 2.95Å; L132-S135 PolarHBondContact O-N 3.42Å; L132-S135 PolarHBondContact O-OG 2.76Å; L132-C136 PolarHBondContact O-N 2.81Å; L132-C136 PolarHBondContact O-SG 2.81Å; L132-V144 HydrophobicContact CD1-CG1 4.16Å; L132-L147 HydrophobicContact CD1-CB 4.23Å; L132-L147 HydrophobicContact CD1-CD1 4.37Å; L132-V148 HydrophobicContact CD1-CG2 3.99Å; L132-V148 HydrophobicContact CD2-CG2 4.45Å; L132-A153 HydrophobicContact CB-CB 4.46Å; L132-A153 HydrophobicContact CD2-CB 4.25Å; L132-L155 HydrophobicContact CD2-CD2 4.17Å; L132-P165 HydrophobicContact CD2-CB 4.3Å; L132-P165 HydrophobicContact CD2-CG 3.7Å; L132-P165 HydrophobicContact CG-CB 4.33Å; L132-P165 HydrophobicContact CG-CG 4.06Å
133	H	90.6	Very high	84.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.9	-41.5	176.4	-60.8	60.6	0	0	0	111.6	M129 P130 S135 C136 S137 E157 R163 V168	M129-H133 HydrophobicContact CB-CB 4.03Å; M129-H133 HydrophobicContact CG-CB 4.44Å; P130-H133 PolarHBondContact O-N 3.33Å; P130-H133 VanDerWaalsContact O-N 3.14Å; H133-S135 VanDerWaalsContact C-N 3.34Å; H133-S135 PolarHBondContact O-N 3.21Å; H133-C136 CarbonylContact O-C 3.53Å; H133-C136 WeakPolarHBondContact O-CB 3.19Å; H133-C136 PolarHBondContact O-N 3.03Å; H133-C136 VanDerWaalsContact O-N 3.15Å; H133-S137 PolarHBondContact O-N 3.31Å; H133-E157 PolarHBondContact CE1-O 2.96Å; H133-E157 PolarHBondContact NE2-O 2.88Å; H133-R163 PolarHBondContact CD2-O 3.28Å; H133-R163 VanDerWaalsContact CD2-O 3.27Å; H133-R163 PolarHBondContact NE2-O 3.43Å; H133-V168 HydrophobicContact CB-CG2 4.23Å; H133-V168 WeakPolarHBondContact O-CG1 3.46Å
134	W	88.2	Confident	85.5	Confident	39 Å²	39	27.6 Å²	27.6	15%	0.148	16%	0.164	C	C	.	.	H	α-helix	trans	-58.6	-46.7	175.2	-179.3	86.1	0	0	0	111.1	M102 I111 W124 P130 L131 L132 C136 S137 T138 L140 L143	M102-W134 HydrophobicContact CE-CD2 4.3Å; M102-W134 HydrophobicContact CE-CE3 3.82Å; M102-W134 HydrophobicContact CE-CH2 3.98Å; M102-W134 HydrophobicContact CE-CZ2 4.42Å; M102-W134 HydrophobicContact CE-CZ3 3.64Å; M102-W134 HydrophobicContact SD-CD2 4.17Å; M102-W134 HydrophobicContact SD-CE3 4.07Å; M102-W134 HydrophobicContact SD-CH2 3.33Å; M102-W134 WeakPolarHBondContact SD-CH2 3.25Å; M102-W134 HydrophobicContact SD-CZ2 3.41Å; M102-W134 WeakPolarHBondContact SD-CZ2 3.39Å; M102-W134 HydrophobicContact SD-CZ3 3.66Å; I111-W134 HydrophobicContact CD1-CZ3 4.07Å; W124-W134 HydrophobicContact CH2-CB 4.36Å; W124-W134 HydrophobicContact CH2-CG 4.19Å; W124-W134 HydrophobicContact CZ3-CB 4.16Å; W124-W134 HydrophobicContact CZ3-CG 4.47Å; P130-W134 PolarHBondContact O-N 3.3Å; L131-W134 HydrophobicContact CD1-CE3 4.27Å; L131-W134 PolarHBondContact O-N 2.69Å; L132-W134 PolarHBondContact O-N 2.95Å; W134-C136 VanDerWaalsContact C-N 3.28Å; W134-C136 PolarHBondContact O-N 3.21Å; W134-S137 PolarHBondContact O-N 2.92Å; W134-S137 PolarHBondContact O-OG 3.38Å; W134-T138 HydrophobicContact CD2-CG2 4.14Å; W134-T138 HydrophobicContact CH2-CG2 4.13Å; W134-T138 HydrophobicContact CZ2-CG2 3.65Å; W134-T138 PolarHBondContact O-N 3.38Å; W134-T138 PolarHBondContact O-OG1 2.89Å; W134-L140 HydrophobicContact CH2-CD1 3.84Å; W134-L140 HydrophobicContact CZ3-CD1 3.55Å; W134-L143 HydrophobicContact CZ3-CD2 4.29Å
135	S	88.1	Confident	85.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-32.4	176.7	66.2	0	0	0	0	113.3	L131 L132 H133 T138 G139 L140 V144	L131-S135 PolarHBondContact O-N 3.48Å; L131-S135 PolarHBondContact O-OG 3.4Å; L132-S135 PolarHBondContact O-N 3.42Å; L132-S135 PolarHBondContact O-OG 2.76Å; H133-S135 VanDerWaalsContact C-N 3.34Å; H133-S135 PolarHBondContact O-N 3.21Å; S135-T138 PolarHBondContact O-OG1 3.26Å; S135-G139 PolarHBondContact O-N 2.83Å; S135-G139 VanDerWaalsContact O-N 3.15Å; S135-L140 PolarHBondContact O-N 3.36Å; S135-L140 VanDerWaalsContact O-N 3.16Å; S135-V144 VanDerWaalsContact OG-CG2 3.23Å; S135-V144 WeakPolarHBondContact OG-CG2 3.44Å
136	C	90.2	Very high	86	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-72.4	-26.8	172.1	-64.1	0	0	0	0	112.9	L132 H133 W134 V168 Q174 I177	L132-C136 PolarHBondContact O-N 2.81Å; L132-C136 PolarHBondContact O-SG 2.81Å; H133-C136 CarbonylContact O-C 3.53Å; H133-C136 WeakPolarHBondContact O-CB 3.19Å; H133-C136 PolarHBondContact O-N 3.03Å; H133-C136 VanDerWaalsContact O-N 3.15Å; W134-C136 VanDerWaalsContact C-N 3.28Å; W134-C136 PolarHBondContact O-N 3.21Å; C136-V168 HydrophobicContact CB-CB 4.46Å; C136-V168 HydrophobicContact CB-CG1 4.12Å; C136-Q174 WeakPolarHBondContact O-CG 3.29Å; C136-I177 HydrophobicContact CB-CG2 4.33Å
137	S	88.9	Confident	86.4	Confident	18 Å²	18	26.3 Å²	26.3	13%	0.126	16%	0.155	C	C	.	.	H	α-helix	trans	-77.4	-38.2	175.8	74.3	0	0	0	0	112	H133 W134 Q174	H133-S137 PolarHBondContact O-N 3.31Å; W134-S137 PolarHBondContact O-N 2.92Å; W134-S137 PolarHBondContact O-OG 3.38Å; S137-Q174 PolarHBondContact O-NE2 2.71Å
138	T	85.5	Confident	87	Confident	63 Å²	63	22.5 Å²	22.5	39%	0.387	12%	0.123	S	C	.	.	H	α-helix	trans	-83.8	-18.9	-176.2	53.1	0	0	0	0	113.9	W134 S135	W134-T138 HydrophobicContact CD2-CG2 4.14Å; W134-T138 HydrophobicContact CH2-CG2 4.13Å; W134-T138 HydrophobicContact CZ2-CG2 3.65Å; W134-T138 PolarHBondContact O-N 3.38Å; W134-T138 PolarHBondContact O-OG1 2.89Å; S135-T138 PolarHBondContact O-OG1 3.26Å
139	G	85.5	Confident	87.2	Confident	26 Å²	26	28 Å²	28	27%	0.268	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.9	20	178.2	0	0	0	0	0	114.7	S135 I141 Q174	S135-G139 PolarHBondContact O-N 2.83Å; S135-G139 VanDerWaalsContact O-N 3.15Å; G139-I141 PolarHBondContact O-N 3.23Å; G139-Q174 VanDerWaalsContact CA-OE1 3.26Å
140	L	87.3	Confident	86.8	Confident	43 Å²	43	33.1 Å²	33.1	23%	0.225	17%	0.17	C	C	.	.			trans	-83.4	77.2	-177.8	-63.2	172.1	0	0	0	111.6	W134 S135 N142 L143 V144	W134-L140 HydrophobicContact CH2-CD1 3.84Å; W134-L140 HydrophobicContact CZ3-CD1 3.55Å; S135-L140 PolarHBondContact O-N 3.36Å; S135-L140 VanDerWaalsContact O-N 3.16Å; L140-N142 PolarHBondContact O-N 3.41Å; L140-L143 HydrophobicContact CB-CB 3.82Å; L140-L143 HydrophobicContact CB-CD2 4.4Å; L140-L143 HydrophobicContact CD1-CD2 3.94Å; L140-L143 WeakPolarHBondContact O-CB 3.29Å; L140-L143 PolarHBondContact O-N 3.32Å; L140-L143 VanDerWaalsContact O-N 3.14Å; L140-V144 WeakPolarHBondContact O-CG2 3.44Å; L140-V144 PolarHBondContact O-N 3.26Å
141	I	89	Confident	85.6	Confident	36 Å²	36	33.9 Å²	33.9	19%	0.185	18%	0.178	C	C	.	.	H	α-helix	trans	-56.2	-47.7	-176	-177.4	61.2	0	0	0	113.2	G139 L143 V144 E145 V176 I177 Y180	G139-I141 PolarHBondContact O-N 3.23Å; I141-L143 PolarHBondContact O-N 2.78Å; I141-V144 WeakPolarHBondContact O-CB 3.42Å; I141-V144 PolarHBondContact O-N 3.03Å; I141-E145 HydrophobicContact CD1-CG 4.19Å; I141-E145 HydrophobicContact CG1-CG 4.31Å; I141-E145 WeakPolarHBondContact O-CG 3.4Å; I141-E145 PolarHBondContact O-N 3.24Å; I141-V176 HydrophobicContact CD1-CG1 4.25Å; I141-V176 HydrophobicContact CG1-CG1 4.11Å; I141-I177 HydrophobicContact CB-CG1 4.23Å; I141-I177 HydrophobicContact CD1-CG1 3.91Å; I141-Y180 HydrophobicContact CD1-CG 4.25Å
142	N	86.7	Confident	84.7	Confident	83 Å²	83	38.4 Å²	38.4	44%	0.444	21%	0.207	S	C	.	.	H	α-helix	trans	-66.8	-25.3	-177.1	-63.1	-23.6	0	0	0	111.6	E108 K112 L140 Y146	E108-N142 VanDerWaalsContact CD-CB 3.42Å; E108-N142 WeakPolarHBondContact OE1-CB 3.46Å; E108-N142 WeakPolarHBondContact OE2-CB 3.3Å; K112-N142 WeakPolarHBondContact CE-O 3.43Å; K112-N142 PolarHBondContact NZ-O 2.81Å; L140-N142 PolarHBondContact O-N 3.41Å; N142-Y146 WeakPolarHBondContact O-CB 3.33Å; N142-Y146 PolarHBondContact O-N 3.11Å
143	L	87.2	Confident	84.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-73.4	-44.5	170.9	-172.2	56.3	0	0	0	111.1	E108 I111 K112 W134 L140 I141 Y146 L147	E108-L143 HydrophobicContact CG-CB 3.85Å; E108-L143 HydrophobicContact CG-CD1 4.28Å; I111-L143 HydrophobicContact CB-CD1 4.1Å; I111-L143 HydrophobicContact CD1-CD2 3.77Å; I111-L143 HydrophobicContact CG2-CD1 3.82Å; I111-L143 HydrophobicContact CG2-CD2 4.36Å; K112-L143 HydrophobicContact CG-CD1 4.17Å; W134-L143 HydrophobicContact CZ3-CD2 4.29Å; L140-L143 HydrophobicContact CB-CB 3.82Å; L140-L143 HydrophobicContact CB-CD2 4.4Å; L140-L143 HydrophobicContact CD1-CD2 3.94Å; L140-L143 WeakPolarHBondContact O-CB 3.29Å; L140-L143 PolarHBondContact O-N 3.32Å; L140-L143 VanDerWaalsContact O-N 3.14Å; I141-L143 PolarHBondContact O-N 2.78Å; L143-Y146 PolarHBondContact O-N 3.47Å; L143-L147 HydrophobicContact CD1-CD1 4.3Å; L143-L147 HydrophobicContact CD1-CG 4.27Å; L143-L147 HydrophobicContact CG-CD1 3.99Å; L143-L147 HydrophobicContact CG-CG 4.39Å; L143-L147 WeakPolarHBondContact O-CB 3.35Å; L143-L147 VanDerWaalsContact O-CG 3.3Å; L143-L147 WeakPolarHBondContact O-CG 3.42Å; L143-L147 PolarHBondContact O-N 3.48Å
144	V	89.3	Confident	83.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.6	-48	176.4	173.3	0	0	0	0	110.6	L132 S135 L140 I141 Y146 L147 V148 I177 Y180 L181	L132-V144 HydrophobicContact CD1-CG1 4.16Å; S135-V144 VanDerWaalsContact OG-CG2 3.23Å; S135-V144 WeakPolarHBondContact OG-CG2 3.44Å; L140-V144 WeakPolarHBondContact O-CG2 3.44Å; L140-V144 PolarHBondContact O-N 3.26Å; I141-V144 WeakPolarHBondContact O-CB 3.42Å; I141-V144 PolarHBondContact O-N 3.03Å; V144-Y146 VanDerWaalsContact C-N 3.33Å; V144-Y146 PolarHBondContact O-N 3.48Å; V144-L147 PolarHBondContact O-N 2.94Å; V144-V148 HydrophobicContact CG1-CG2 4.27Å; V144-V148 WeakPolarHBondContact O-CB 3.29Å; V144-V148 VanDerWaalsContact O-CG2 3.23Å; V144-V148 WeakPolarHBondContact O-CG2 3.45Å; V144-V148 PolarHBondContact O-N 3.37Å; V144-I177 HydrophobicContact CG1-CG2 4.36Å; V144-I177 HydrophobicContact CG2-CD1 4.19Å; V144-I177 HydrophobicContact CG2-CG2 4.3Å; V144-Y180 HydrophobicContact CG1-CD1 4.05Å; V144-Y180 HydrophobicContact CG1-CE1 4.02Å; V144-L181 HydrophobicContact CG1-CD2 4.42Å
145	E	87.6	Confident	83.4	Confident	65 Å²	65	40.8 Å²	40.8	30%	0.304	23%	0.229	S	C	.	.	H	α-helix	trans	-56.7	-48.8	176.7	-71.9	-178.2	167.2	0	0	110.8	I141 L147 V148 E149 Y180	I141-E145 HydrophobicContact CD1-CG 4.19Å; I141-E145 HydrophobicContact CG1-CG 4.31Å; I141-E145 WeakPolarHBondContact O-CG 3.4Å; I141-E145 PolarHBondContact O-N 3.24Å; E145-L147 PolarHBondContact O-N 3.02Å; E145-V148 PolarHBondContact O-N 3.46Å; E145-E149 VanDerWaalsContact O-CB 3.3Å; E145-E149 WeakPolarHBondContact O-CB 3.28Å; E145-E149 WeakPolarHBondContact O-CG 3.49Å; E145-E149 PolarHBondContact O-N 3.4Å; E145-Y180 HydrophobicContact CG-CD2 4.08Å; E145-Y180 HydrophobicContact CG-CE1 4.22Å; E145-Y180 HydrophobicContact CG-CE2 3.7Å
146	Y	84.6	Confident	83.1	Confident	49 Å²	49	43.5 Å²	43.5	19%	0.192	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-44.2	178.6	-174.5	-95.3	0	0	0	113	K112 V115 N142 L143 V144 V148 H150 G151	K112-Y146 HydrophobicContact CB-CE1 4.39Å; K112-Y146 HydrophobicContact CD-CD2 4.45Å; K112-Y146 HydrophobicContact CD-CG 4.26Å; K112-Y146 HydrophobicContact CG-CD1 3.86Å; K112-Y146 HydrophobicContact CG-CD2 4.46Å; K112-Y146 HydrophobicContact CG-CE1 4.21Å; K112-Y146 HydrophobicContact CG-CG 3.99Å; V115-Y146 HydrophobicContact CB-CE1 4.12Å; V115-Y146 HydrophobicContact CG1-CE1 3.88Å; N142-Y146 WeakPolarHBondContact O-CB 3.33Å; N142-Y146 PolarHBondContact O-N 3.11Å; L143-Y146 PolarHBondContact O-N 3.47Å; V144-Y146 VanDerWaalsContact C-N 3.33Å; V144-Y146 PolarHBondContact O-N 3.48Å; Y146-V148 VanDerWaalsContact C-N 3.31Å; Y146-V148 PolarHBondContact O-N 3.46Å; Y146-H150 HydrophobicContact CD2-CB 4.31Å; Y146-H150 HydrophobicContact CE2-CB 4.14Å; Y146-H150 AromaticContact CE2-CD2 3.84Å; Y146-H150 WeakPolarHBondContact O-CA 3.34Å; Y146-H150 WeakPolarHBondContact O-CB 3.3Å; Y146-H150 PolarHBondContact O-N 2.9Å; Y146-G151 PolarHBondContact O-N 3.08Å
147	L	86.2	Confident	82.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.8	-31.9	179	-72.4	173.5	0	0	0	112.8	V115 Y121 L131 L132 L143 V144 E145 G151 A153	V115-L147 HydrophobicContact CG2-CD2 4.38Å; Y121-L147 HydrophobicContact CE1-CD2 4.24Å; Y121-L147 HydrophobicContact CE2-CD2 4.44Å; L131-L147 HydrophobicContact CD2-CD1 4.23Å; L131-L147 HydrophobicContact CD2-CD2 4.17Å; L131-L147 HydrophobicContact CG-CD1 4.01Å; L132-L147 HydrophobicContact CD1-CB 4.23Å; L132-L147 HydrophobicContact CD1-CD1 4.37Å; L143-L147 HydrophobicContact CD1-CD1 4.3Å; L143-L147 HydrophobicContact CD1-CG 4.27Å; L143-L147 HydrophobicContact CG-CD1 3.99Å; L143-L147 HydrophobicContact CG-CG 4.39Å; L143-L147 WeakPolarHBondContact O-CB 3.35Å; L143-L147 VanDerWaalsContact O-CG 3.3Å; L143-L147 WeakPolarHBondContact O-CG 3.42Å; L143-L147 PolarHBondContact O-N 3.48Å; V144-L147 PolarHBondContact O-N 2.94Å; E145-L147 PolarHBondContact O-N 3.02Å; L147-G151 CarbonylContact O-C 3.5Å; L147-G151 WeakPolarHBondContact O-CA 3.48Å; L147-G151 PolarHBondContact O-N 3.43Å; L147-A153 HydrophobicContact CB-CB 4.3Å
148	V	85.5	Confident	82.6	Confident	10 Å²	10	47.1 Å²	47.1	6%	0.061	26%	0.263	C	S	.	.	H	α-helix	trans	-84	-36.7	-179.1	170.8	0	0	0	0	112.2	L132 V144 E145 Y146 L155 Y180 V184	L132-V148 HydrophobicContact CD1-CG2 3.99Å; L132-V148 HydrophobicContact CD2-CG2 4.45Å; V144-V148 HydrophobicContact CG1-CG2 4.27Å; V144-V148 WeakPolarHBondContact O-CB 3.29Å; V144-V148 VanDerWaalsContact O-CG2 3.23Å; V144-V148 WeakPolarHBondContact O-CG2 3.45Å; V144-V148 PolarHBondContact O-N 3.37Å; E145-V148 PolarHBondContact O-N 3.46Å; Y146-V148 VanDerWaalsContact C-N 3.31Å; Y146-V148 PolarHBondContact O-N 3.46Å; V148-L155 HydrophobicContact CG2-CD2 4.08Å; V148-Y180 HydrophobicContact CB-CE1 4.31Å; V148-Y180 HydrophobicContact CG1-CE1 4.3Å; V148-Y180 HydrophobicContact CG2-CE1 4.38Å; V148-V184 HydrophobicContact CG1-CG1 3.82Å; V148-V184 HydrophobicContact CG1-CG2 4.28Å
149	E	82.6	Confident	82.6	Confident	121 Å²	121	44.6 Å²	44.6	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-85.1	-41.8	-178.8	-68.4	-175.6	168.9	0	0	112.8	E145	E145-E149 VanDerWaalsContact O-CB 3.3Å; E145-E149 WeakPolarHBondContact O-CB 3.28Å; E145-E149 WeakPolarHBondContact O-CG 3.49Å; E145-E149 PolarHBondContact O-N 3.4Å
150	H	75.9	Confident	82.5	Confident	131 Å²	131	50.6 Å²	50.6	61%	0.606	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	-20.9	-172.8	-62.3	39	0	0	0	112.6	Y146	Y146-H150 HydrophobicContact CD2-CB 4.31Å; Y146-H150 HydrophobicContact CE2-CB 4.14Å; Y146-H150 AromaticContact CE2-CD2 3.84Å; Y146-H150 WeakPolarHBondContact O-CA 3.34Å; Y146-H150 WeakPolarHBondContact O-CB 3.3Å; Y146-H150 PolarHBondContact O-N 2.9Å
151	G	62.8	Low	82.3	Confident	19 Å²	19	53 Å²	53	20%	0.196	28%	0.281	C	S	.	.	S	Bend	trans	-88.9	159.4	-179.9	0	0	0	0	0	113.4	Y146 L147 A153	Y146-G151 PolarHBondContact O-N 3.08Å; L147-G151 CarbonylContact O-C 3.5Å; L147-G151 WeakPolarHBondContact O-CA 3.48Å; L147-G151 PolarHBondContact O-N 3.43Å; G151-A153 PolarHBondContact O-N 2.92Å
152	T	67.8	Low	82.2	Confident	99 Å²	99	51.8 Å²	51.8	61%	0.607	28%	0.277	S	S	*	.			trans	-81.6	18.3	171.4	50.7	0	0	0	0	112.3	Y121 H122 S154	Y121-T152 PolarHBondContact OH-N 3.28Å; H122-T152 PolarHBondContact CE1-OG1 2.8Å; H122-T152 PolarHBondContact NE2-OG1 2.9Å; T152-S154 PolarHBondContact O-N 3.4Å
153	A	76.8	Confident	82.4	Confident	19 Å²	19	49.2 Å²	49.2	16%	0.157	26%	0.261	C	S	.	.			trans	-69.6	120	-174.8	0	0	0	0	0	110.7	Y121 L132 L147 G151 L155	Y121-A153 HydrophobicContact CE2-CB 4.18Å; Y121-A153 PolarHBondContact OH-N 2.83Å; L132-A153 HydrophobicContact CB-CB 4.46Å; L132-A153 HydrophobicContact CD2-CB 4.25Å; L147-A153 HydrophobicContact CB-CB 4.3Å; G151-A153 PolarHBondContact O-N 2.92Å; A153-L155 PolarHBondContact O-N 3.09Å
154	S	80.3	Confident	82.6	Confident	58 Å²	58	49.5 Å²	49.5	41%	0.406	26%	0.263	S	S	.	.			trans	-73.4	127.5	176.3	-180	0	0	0	0	110.8	T152 Q156	T152-S154 PolarHBondContact O-N 3.4Å; S154-Q156 PolarHBondContact O-N 3.02Å; S154-Q156 PolarHBondContact OG-N 2.79Å
155	L	83.1	Confident	82.7	Confident	16 Å²	16	49.7 Å²	49.7	8%	0.084	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.8	171.8	-70.2	159.9	0	0	0	112.5	L132 V148 A153 L164 P165 L181 V184 L185	L132-L155 HydrophobicContact CD2-CD2 4.17Å; V148-L155 HydrophobicContact CG2-CD2 4.08Å; A153-L155 PolarHBondContact O-N 3.09Å; L155-L164 WeakPolarHBondContact O-CD2 3.48Å; L155-P165 WeakPolarHBondContact O-CD 3.2Å; L155-L181 HydrophobicContact CD2-CD2 4.03Å; L155-V184 HydrophobicContact CD1-CG1 3.62Å; L155-L185 HydrophobicContact CB-CD2 4.22Å; L155-L185 HydrophobicContact CD1-CD2 4.47Å
156	Q	82.5	Confident	82.9	Confident	58 Å²	58	46.6 Å²	46.6	27%	0.271	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-4.2	-176.5	-57.7	-57.8	-23.2	0	0	113.1	S154 A158 L164 N193	S154-Q156 PolarHBondContact O-N 3.02Å; S154-Q156 PolarHBondContact OG-N 2.79Å; Q156-A158 PolarHBondContact O-N 2.86Å; Q156-L164 VanDerWaalsContact CA-CD2 3.5Å; Q156-N193 PolarHBondContact OE1-ND2 3.12Å
157	E	81.9	Confident	83.3	Confident	61 Å²	61	44.3 Å²	44.3	29%	0.285	24%	0.24	S	C	.	.			trans	-69.6	128.4	176.8	-168.9	170.9	-156.9	0	0	110	R125 P130 H133	R125-E157 IonicContact CZ-OE1 3.76Å; R125-E157 IonicContact NH1-OE1 3.59Å; R125-E157 IonicContact NH2-OE1 3.99Å; R125-E157 PolarHBondContact NH2-OE1 3.37Å; P130-E157 HydrophobicContact CG-CG 4.07Å; H133-E157 PolarHBondContact CE1-O 2.96Å; H133-E157 PolarHBondContact NE2-O 2.88Å
158	A	86	Confident	83.6	Confident	33 Å²	33	44.3 Å²	44.3	27%	0.273	24%	0.24	S	C	.	.			trans	-90.4	145.5	176.8	0	0	0	0	0	110.7	Q156 R163 M259	Q156-A158 PolarHBondContact O-N 2.86Å; A158-R163 WeakPolarHBondContact CA-O 3.39Å; A158-M259 HydrophobicContact CB-CG 3.92Å
159	D	86.4	Confident	83.9	Confident	9 Å²	9	43.8 Å²	43.8	5%	0.048	24%	0.237	C	C	.	.			trans	-72.7	177	166.1	74.2	-0.1	0	0	0	111.5	M129 N161 G162 R163	M129-D159 HydrophobicContact CG-CB 4.31Å; D159-N161 PolarHBondContact O-N 3.27Å; D159-N161 WeakPolarHBondContact OD1-CA 3.41Å; D159-N161 WeakPolarHBondContact OD1-CB 3.29Å; D159-N161 PolarHBondContact OD1-N 3.47Å; D159-G162 PolarHBondContact O-N 3.13Å; D159-G162 PolarHBondContact OD1-N 3.1Å; D159-G162 VanDerWaalsContact OD1-N 3.11Å; D159-R163 PolarHBondContact N-O 3Å; D159-R163 WeakPolarHBondContact OD1-CA 3.34Å; D159-R163 VanDerWaalsContact OD1-CB 3.29Å; D159-R163 WeakPolarHBondContact OD1-CB 3.41Å; D159-R163 PolarHBondContact OD1-N 3.11Å; D159-R163 IonicContact OD1-NE 3.67Å; D159-R163 IonicContact OD2-CZ 3.53Å; D159-R163 VanDerWaalsContact OD2-CZ 3.23Å; D159-R163 IonicContact OD2-NE 3.64Å; D159-R163 PolarHBondContact OD2-NE 3.14Å; D159-R163 IonicContact OD2-NH2 2.72Å; D159-R163 PolarHBondContact OD2-NH2 3.49Å
160	E	84.2	Confident	84.3	Confident	153 Å²	153	38 Å²	38	72%	0.715	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-21.2	176.1	-80	-178.7	-173.9	0	0	114.4	G128 G162	G128-E160 VanDerWaalsContact CA-CG 3.48Å; G128-E160 WeakPolarHBondContact CA-OE1 3.37Å; G128-E160 WeakPolarHBondContact CA-OE2 3.38Å; G128-E160 PolarHBondContact O-N 3.19Å; E160-G162 VanDerWaalsContact C-N 3.31Å
161	N	82.8	Confident	85	Confident	94 Å²	94	32 Å²	32	50%	0.503	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	4.4	175.8	-63.7	-44.6	0	0	0	112.6	D159 R163 N260	D159-N161 PolarHBondContact O-N 3.27Å; D159-N161 WeakPolarHBondContact OD1-CA 3.41Å; D159-N161 WeakPolarHBondContact OD1-CB 3.29Å; D159-N161 PolarHBondContact OD1-N 3.47Å; N161-R163 VanDerWaalsContact C-N 3.3Å; N161-R163 HydrophobicContact CB-CG 4.11Å; N161-R163 PolarHBondContact ND2-NH2 3.25Å; N161-N260 PolarHBondContact O-ND2 3.4Å
162	G	86.2	Confident	86.3	Confident	10 Å²	10	34.1 Å²	34.1	10%	0.103	19%	0.187	C	C	.	.	S	Bend	trans	79.5	9	-177.7	0	0	0	0	0	114.2	D159 E160 D258 M259	D159-G162 PolarHBondContact O-N 3.13Å; D159-G162 PolarHBondContact OD1-N 3.1Å; D159-G162 VanDerWaalsContact OD1-N 3.11Å; E160-G162 VanDerWaalsContact C-N 3.31Å; G162-D258 WeakPolarHBondContact O-CB 3.44Å; G162-M259 WeakPolarHBondContact O-CG 3.46Å; G162-M259 PolarHBondContact O-N 3.09Å
163	R	90.4	Very high	87.2	Confident	28 Å²	28	29.5 Å²	29.5	11%	0.106	16%	0.159	C	C	.	.			trans	-88.7	133.4	-173.9	-59.8	177.5	-61.3	-169.4	1.8	111.2	H133 A158 D159 N161 H167 V168	H133-R163 PolarHBondContact CD2-O 3.28Å; H133-R163 VanDerWaalsContact CD2-O 3.27Å; H133-R163 PolarHBondContact NE2-O 3.43Å; A158-R163 WeakPolarHBondContact CA-O 3.39Å; D159-R163 PolarHBondContact N-O 3Å; D159-R163 WeakPolarHBondContact OD1-CA 3.34Å; D159-R163 VanDerWaalsContact OD1-CB 3.29Å; D159-R163 WeakPolarHBondContact OD1-CB 3.41Å; D159-R163 PolarHBondContact OD1-N 3.11Å; D159-R163 IonicContact OD1-NE 3.67Å; D159-R163 IonicContact OD2-CZ 3.53Å; D159-R163 VanDerWaalsContact OD2-CZ 3.23Å; D159-R163 IonicContact OD2-NE 3.64Å; D159-R163 PolarHBondContact OD2-NE 3.14Å; D159-R163 IonicContact OD2-NH2 2.72Å; D159-R163 PolarHBondContact OD2-NH2 3.49Å; N161-R163 VanDerWaalsContact C-N 3.3Å; N161-R163 HydrophobicContact CB-CG 4.11Å; N161-R163 PolarHBondContact ND2-NH2 3.25Å; R163-H167 HydrophobicContact CB-CB 3.93Å; R163-H167 HydrophobicContact CG-CB 4.36Å; R163-V168 HydrophobicContact CB-CG2 4.07Å
164	L	91.3	Very high	88	Confident	7 Å²	7	30.8 Å²	30.8	4%	0.037	16%	0.162	C	C	.	.			trans	-78.7	164.7	167.9	-62.9	131.1	0	0	0	111.4	L155 Q156 I166 H167 V168 L257	L155-L164 WeakPolarHBondContact O-CD2 3.48Å; Q156-L164 VanDerWaalsContact CA-CD2 3.5Å; L164-I166 HydrophobicContact CB-CG2 4.25Å; L164-I166 PolarHBondContact O-N 3.38Å; L164-I166 VanDerWaalsContact O-N 3.13Å; L164-H167 WeakPolarHBondContact CB-ND1 3.42Å; L164-H167 VanDerWaalsContact CD1-CE1 3.5Å; L164-H167 WeakPolarHBondContact CD1-CE1 3.28Å; L164-H167 PolarHBondContact N-ND1 3.12Å; L164-H167 WeakPolarHBondContact O-CB 3.25Å; L164-H167 PolarHBondContact O-N 3.02Å; L164-V168 PolarHBondContact O-N 3.39Å; L164-V168 VanDerWaalsContact O-N 3.14Å; L164-L257 VanDerWaalsContact CD1-O 3.28Å; L164-L257 WeakPolarHBondContact CD1-O 3.29Å
165	P	91.6	Very high	88.5	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.019	15%	0.151	C	C	.	.	H	α-helix	trans	-53.7	-36.4	179.9	-27.8	35.1	0	0	0	114.2	L132 L155 H167 V168 A169 L181	L132-P165 HydrophobicContact CD2-CB 4.3Å; L132-P165 HydrophobicContact CD2-CG 3.7Å; L132-P165 HydrophobicContact CG-CB 4.33Å; L132-P165 HydrophobicContact CG-CG 4.06Å; L155-P165 WeakPolarHBondContact O-CD 3.2Å; P165-H167 VanDerWaalsContact C-N 3.31Å; P165-H167 PolarHBondContact O-N 3.02Å; P165-V168 PolarHBondContact O-N 3.33Å; P165-A169 PolarHBondContact O-N 3.16Å; P165-L181 HydrophobicContact CB-CD1 4.05Å; P165-L181 HydrophobicContact CB-CD2 4.47Å
166	I	93	Very high	88.8	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-62.9	-36.4	176.8	-169.2	174.6	0	0	0	112.3	L164 A170 L178 I182 L185 A253 P264	L164-I166 HydrophobicContact CB-CG2 4.25Å; L164-I166 PolarHBondContact O-N 3.38Å; L164-I166 VanDerWaalsContact O-N 3.13Å; I166-A170 PolarHBondContact O-N 3.42Å; I166-L178 HydrophobicContact CG1-CD1 3.68Å; I166-I182 HydrophobicContact CD1-CG1 3.92Å; I166-L185 HydrophobicContact CB-CD1 3.86Å; I166-L185 HydrophobicContact CD1-CD1 3.81Å; I166-L185 HydrophobicContact CG1-CD1 4.32Å; I166-L185 HydrophobicContact CG2-CD1 4.06Å; I166-A253 WeakPolarHBondContact CD1-O 3.4Å; I166-P264 HydrophobicContact CD1-CG 3.87Å; I166-P264 HydrophobicContact CG1-CB 4.34Å; I166-P264 HydrophobicContact CG1-CG 3.9Å; I166-P264 HydrophobicContact CG2-CG 4.17Å
167	H	93.1	Very high	89.3	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-72	-41.8	177.2	-58.4	104.4	0	0	0	110.9	R163 L164 P165 A169 A170 V171 Y256 D258 W262 P264 H267	R163-H167 HydrophobicContact CB-CB 3.93Å; R163-H167 HydrophobicContact CG-CB 4.36Å; L164-H167 WeakPolarHBondContact CB-ND1 3.42Å; L164-H167 VanDerWaalsContact CD1-CE1 3.5Å; L164-H167 WeakPolarHBondContact CD1-CE1 3.28Å; L164-H167 PolarHBondContact N-ND1 3.12Å; L164-H167 WeakPolarHBondContact O-CB 3.25Å; L164-H167 PolarHBondContact O-N 3.02Å; P165-H167 VanDerWaalsContact C-N 3.31Å; P165-H167 PolarHBondContact O-N 3.02Å; H167-A169 PolarHBondContact O-N 3.32Å; H167-A170 WeakPolarHBondContact O-CB 3.25Å; H167-A170 PolarHBondContact O-N 3.35Å; H167-A170 VanDerWaalsContact O-N 3.14Å; H167-V171 WeakPolarHBondContact O-CG2 3.5Å; H167-V171 PolarHBondContact O-N 3.41Å; H167-Y256 PolarHBondContact NE2-O 2.76Å; H167-Y256 VanDerWaalsContact NE2-O 3.11Å; H167-D258 PolarHBondContact CE1-N 3.49Å; H167-W262 PolarHBondContact NE2-O 3.01Å; H167-P264 WeakPolarHBondContact NE2-CD 3.47Å; H167-H267 AromaticContact CD2-CD2 3.58Å; H167-H267 AromaticContact CG-CD2 3.95Å
168	V	91	Very high	89.8	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-45.7	175.9	177.2	0	0	0	0	110.8	H133 C136 R163 L164 P165 A170 V171 F172	H133-V168 HydrophobicContact CB-CG2 4.23Å; H133-V168 WeakPolarHBondContact O-CG1 3.46Å; C136-V168 HydrophobicContact CB-CB 4.46Å; C136-V168 HydrophobicContact CB-CG1 4.12Å; R163-V168 HydrophobicContact CB-CG2 4.07Å; L164-V168 PolarHBondContact O-N 3.39Å; L164-V168 VanDerWaalsContact O-N 3.14Å; P165-V168 PolarHBondContact O-N 3.33Å; V168-A170 PolarHBondContact O-N 3.45Å; V168-V171 PolarHBondContact O-N 3.07Å; V168-F172 HydrophobicContact CG1-CD2 3.54Å; V168-F172 HydrophobicContact CG1-CE2 3.8Å; V168-F172 WeakPolarHBondContact O-CD2 3.35Å; V168-F172 PolarHBondContact O-N 3.32Å
169	A	92.2	Very high	90	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.2	-33.6	175.6	0	0	0	0	0	112.8	P165 H167 G173 Q174 I177 L178 L181	P165-A169 PolarHBondContact O-N 3.16Å; H167-A169 PolarHBondContact O-N 3.32Å; A169-G173 PolarHBondContact O-N 2.94Å; A169-Q174 HydrophobicContact CB-CB 4.43Å; A169-Q174 PolarHBondContact O-N 3.19Å; A169-I177 HydrophobicContact CB-CG2 4.11Å; A169-L178 HydrophobicContact CB-CB 4.25Å; A169-L178 HydrophobicContact CB-CD1 4.24Å; A169-L181 HydrophobicContact CB-CD1 4.11Å
170	A	91.8	Very high	90.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.9	-42.6	176.1	0	0	0	0	0	112.8	I166 H167 V168 L178 P264 H267 A268 L284	I166-A170 PolarHBondContact O-N 3.42Å; H167-A170 WeakPolarHBondContact O-CB 3.25Å; H167-A170 PolarHBondContact O-N 3.35Å; H167-A170 VanDerWaalsContact O-N 3.14Å; V168-A170 PolarHBondContact O-N 3.45Å; A170-L178 HydrophobicContact CB-CD1 4.47Å; A170-P264 HydrophobicContact CB-CB 4.08Å; A170-P264 WeakPolarHBondContact CB-O 3.48Å; A170-H267 HydrophobicContact CB-CB 4.32Å; A170-A268 HydrophobicContact CB-CB 4.28Å; A170-L284 HydrophobicContact CB-CD1 4.46Å
171	V	90.4	Very high	90.6	Very high	4 Å²	4	21.1 Å²	21.1	2%	0.024	12%	0.117	C	C	.	.	H	α-helix	trans	-66.7	-49.8	176.1	179	0	0	0	0	111	H167 V168 G173 H267 D272 A273 V274	H167-V171 WeakPolarHBondContact O-CG2 3.5Å; H167-V171 PolarHBondContact O-N 3.41Å; V168-V171 PolarHBondContact O-N 3.07Å; V171-G173 PolarHBondContact O-N 3.46Å; V171-H267 HydrophobicContact CG2-CB 3.55Å; V171-H267 VanDerWaalsContact CG2-ND1 3.31Å; V171-H267 WeakPolarHBondContact CG2-ND1 3.45Å; V171-D272 HydrophobicContact CG1-CB 4.27Å; V171-D272 WeakPolarHBondContact CG1-O 3.23Å; V171-A273 CarbonylContact O-C 3.54Å; V171-A273 WeakPolarHBondContact O-CA 3.34Å; V171-V274 PolarHBondContact O-N 3.31Å
172	F	89	Confident	91	Very high	63 Å²	63	16.8 Å²	16.8	28%	0.276	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	1.4	-176.8	-71.5	-81.2	0	0	0	113.7	V168 Q174 V274	V168-F172 HydrophobicContact CG1-CD2 3.54Å; V168-F172 HydrophobicContact CG1-CE2 3.8Å; V168-F172 WeakPolarHBondContact O-CD2 3.35Å; V168-F172 PolarHBondContact O-N 3.32Å; F172-Q174 HydrophobicContact CB-CG 4.49Å; F172-V274 HydrophobicContact CD1-CG2 4.25Å
173	G	88.2	Confident	91	Very high	2 Å²	2	23.4 Å²	23.4	2%	0.021	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	64	50.6	174	0	0	0	0	0	113.6	A169 V171 P175 N275 C280	A169-G173 PolarHBondContact O-N 2.94Å; V171-G173 PolarHBondContact O-N 3.46Å; G173-P175 WeakPolarHBondContact O-CD 3.48Å; G173-N275 VanDerWaalsContact CA-O 3.25Å; G173-N275 WeakPolarHBondContact CA-O 3.47Å; G173-C280 VanDerWaalsContact CA-SG 3.6Å
174	Q	92.5	Very high	90.9	Very high	47 Å²	47	22.7 Å²	22.7	22%	0.22	12%	0.115	C	C	.	.			trans	-103.8	83.7	178.2	-63	-65	-14.6	0	0	111.2	C136 S137 G139 A169 F172 V176 I177 L178	C136-Q174 WeakPolarHBondContact O-CG 3.29Å; S137-Q174 PolarHBondContact O-NE2 2.71Å; G139-Q174 VanDerWaalsContact CA-OE1 3.26Å; A169-Q174 HydrophobicContact CB-CB 4.43Å; A169-Q174 PolarHBondContact O-N 3.19Å; F172-Q174 HydrophobicContact CB-CG 4.49Å; Q174-V176 PolarHBondContact O-N 2.83Å; Q174-I177 HydrophobicContact CB-CB 4.03Å; Q174-I177 HydrophobicContact CB-CD1 4.11Å; Q174-I177 HydrophobicContact CB-CG1 4.29Å; Q174-I177 HydrophobicContact CG-CD1 4.32Å; Q174-I177 PolarHBondContact O-N 3.48Å; Q174-L178 VanDerWaalsContact O-CB 3.29Å; Q174-L178 WeakPolarHBondContact O-CB 3.33Å; Q174-L178 PolarHBondContact O-N 2.97Å
175	P	90.1	Very high	90.6	Very high	28 Å²	28	22.7 Å²	22.7	18%	0.182	12%	0.115	C	C	.	.	H	α-helix	trans	-63.7	-38.5	-171.1	23.4	-34.3	0	0	0	113.3	G173 L178 S179 D279 I283	G173-P175 WeakPolarHBondContact O-CD 3.48Å; P175-L178 PolarHBondContact O-N 3.13Å; P175-S179 PolarHBondContact O-N 3.19Å; P175-D279 HydrophobicContact CB-CB 4Å; P175-D279 HydrophobicContact CG-CB 4.27Å; P175-I283 HydrophobicContact CB-CD1 3.39Å; P175-I283 WeakPolarHBondContact O-CD1 3.44Å
176	V	90.8	Very high	90.3	Very high	89 Å²	89	23.3 Å²	23.3	54%	0.539	12%	0.119	S	C	.	.	H	α-helix	trans	-66.1	-47.7	-179.4	-177.2	0	0	0	0	110.5	I141 Q174 L178 S179 Y180	I141-V176 HydrophobicContact CD1-CG1 4.25Å; I141-V176 HydrophobicContact CG1-CG1 4.11Å; Q174-V176 PolarHBondContact O-N 2.83Å; V176-L178 VanDerWaalsContact C-N 3.33Å; V176-L178 PolarHBondContact O-N 3.34Å; V176-S179 PolarHBondContact O-N 3.49Å; V176-S179 PolarHBondContact O-OG 3.43Å; V176-Y180 PolarHBondContact O-N 3.35Å; V176-Y180 VanDerWaalsContact O-N 3.07Å
177	I	91.8	Very high	89.7	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-42.1	177	-62.1	178.5	0	0	0	110.4	C136 I141 V144 A169 Q174 S179 Y180 L181	C136-I177 HydrophobicContact CB-CG2 4.33Å; I141-I177 HydrophobicContact CB-CG1 4.23Å; I141-I177 HydrophobicContact CD1-CG1 3.91Å; V144-I177 HydrophobicContact CG1-CG2 4.36Å; V144-I177 HydrophobicContact CG2-CD1 4.19Å; V144-I177 HydrophobicContact CG2-CG2 4.3Å; A169-I177 HydrophobicContact CB-CG2 4.11Å; Q174-I177 HydrophobicContact CB-CB 4.03Å; Q174-I177 HydrophobicContact CB-CD1 4.11Å; Q174-I177 HydrophobicContact CB-CG1 4.29Å; Q174-I177 HydrophobicContact CG-CD1 4.32Å; Q174-I177 PolarHBondContact O-N 3.48Å; I177-S179 VanDerWaalsContact C-N 3.34Å; I177-S179 PolarHBondContact O-N 2.97Å; I177-Y180 WeakPolarHBondContact O-CB 3.24Å; I177-Y180 PolarHBondContact O-N 2.86Å; I177-L181 HydrophobicContact CG2-CD1 3.78Å; I177-L181 HydrophobicContact CG2-CG 4.08Å; I177-L181 WeakPolarHBondContact O-CB 3.41Å; I177-L181 WeakPolarHBondContact O-CG 3.49Å; I177-L181 PolarHBondContact O-N 2.93Å
178	L	92.7	Very high	89.1	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.2	-45	178	-172.9	61.3	0	0	0	111.7	I166 A169 A170 Q174 P175 V176 Y180 L181 I182 C280 L284	I166-L178 HydrophobicContact CG1-CD1 3.68Å; A169-L178 HydrophobicContact CB-CB 4.25Å; A169-L178 HydrophobicContact CB-CD1 4.24Å; A170-L178 HydrophobicContact CB-CD1 4.47Å; Q174-L178 VanDerWaalsContact O-CB 3.29Å; Q174-L178 WeakPolarHBondContact O-CB 3.33Å; Q174-L178 PolarHBondContact O-N 2.97Å; P175-L178 PolarHBondContact O-N 3.13Å; V176-L178 VanDerWaalsContact C-N 3.33Å; V176-L178 PolarHBondContact O-N 3.34Å; L178-Y180 VanDerWaalsContact C-N 3.34Å; L178-Y180 PolarHBondContact O-N 3.43Å; L178-L181 PolarHBondContact O-N 3.36Å; L178-I182 HydrophobicContact CG-CD1 4.19Å; L178-I182 VanDerWaalsContact O-CG1 3.28Å; L178-I182 WeakPolarHBondContact O-CG1 3.28Å; L178-I182 PolarHBondContact O-N 3.42Å; L178-C280 HydrophobicContact CD2-CB 3.65Å; L178-L284 HydrophobicContact CD1-CD2 4.33Å; L178-L284 HydrophobicContact CD2-CD1 4.14Å; L178-L284 HydrophobicContact CD2-CD2 4.27Å; L178-L284 HydrophobicContact CD2-CG 3.89Å
179	S	91.1	Very high	88.6	Confident	54 Å²	54	37.5 Å²	37.5	38%	0.378	19%	0.188	S	C	.	.	H	α-helix	trans	-62.9	-39.5	176.3	74	0	0	0	0	112.8	P175 V176 I177 R183	P175-S179 PolarHBondContact O-N 3.19Å; V176-S179 PolarHBondContact O-N 3.49Å; V176-S179 PolarHBondContact O-OG 3.43Å; I177-S179 VanDerWaalsContact C-N 3.34Å; I177-S179 PolarHBondContact O-N 2.97Å; S179-R183 PolarHBondContact O-N 2.81Å
180	Y	91.2	Very high	87.8	Confident	11 Å²	11	41.2 Å²	41.2	4%	0.043	21%	0.205	C	C	.	.	H	α-helix	trans	-64.8	-47	175.3	175.3	-97.6	0	0	0	111.4	I141 V144 E145 V148 V176 I177 L178 I182 R183 V184	I141-Y180 HydrophobicContact CD1-CG 4.25Å; V144-Y180 HydrophobicContact CG1-CD1 4.05Å; V144-Y180 HydrophobicContact CG1-CE1 4.02Å; E145-Y180 HydrophobicContact CG-CD2 4.08Å; E145-Y180 HydrophobicContact CG-CE1 4.22Å; E145-Y180 HydrophobicContact CG-CE2 3.7Å; V148-Y180 HydrophobicContact CB-CE1 4.31Å; V148-Y180 HydrophobicContact CG1-CE1 4.3Å; V148-Y180 HydrophobicContact CG2-CE1 4.38Å; V176-Y180 PolarHBondContact O-N 3.35Å; V176-Y180 VanDerWaalsContact O-N 3.07Å; I177-Y180 WeakPolarHBondContact O-CB 3.24Å; I177-Y180 PolarHBondContact O-N 2.86Å; L178-Y180 VanDerWaalsContact C-N 3.34Å; L178-Y180 PolarHBondContact O-N 3.43Å; Y180-I182 PolarHBondContact O-N 3.41Å; Y180-R183 WeakPolarHBondContact O-CB 3.48Å; Y180-R183 PolarHBondContact O-N 3.49Å; Y180-V184 HydrophobicContact CD1-CG2 4.15Å; Y180-V184 HydrophobicContact CD2-CG2 4.44Å; Y180-V184 HydrophobicContact CE1-CG2 3.67Å; Y180-V184 HydrophobicContact CE2-CG2 3.96Å; Y180-V184 WeakPolarHBondContact O-CG2 3.42Å; Y180-V184 PolarHBondContact O-N 3.38Å
181	L	91.3	Very high	87	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.4	-40.4	-179.5	-71.8	175.9	0	0	0	112.4	V144 L155 P165 A169 I177 L178 R183 V184 L185	V144-L181 HydrophobicContact CG1-CD2 4.42Å; L155-L181 HydrophobicContact CD2-CD2 4.03Å; P165-L181 HydrophobicContact CB-CD1 4.05Å; P165-L181 HydrophobicContact CB-CD2 4.47Å; A169-L181 HydrophobicContact CB-CD1 4.11Å; I177-L181 HydrophobicContact CG2-CD1 3.78Å; I177-L181 HydrophobicContact CG2-CG 4.08Å; I177-L181 WeakPolarHBondContact O-CB 3.41Å; I177-L181 WeakPolarHBondContact O-CG 3.49Å; I177-L181 PolarHBondContact O-N 2.93Å; L178-L181 PolarHBondContact O-N 3.36Å; L181-R183 VanDerWaalsContact C-N 3.29Å; L181-R183 PolarHBondContact O-N 3.2Å; L181-V184 PolarHBondContact O-N 3.27Å; L181-L185 VanDerWaalsContact O-CB 3.28Å; L181-L185 WeakPolarHBondContact O-CB 3.35Å; L181-L185 VanDerWaalsContact O-CG 3.29Å; L181-L185 WeakPolarHBondContact O-CG 3.44Å; L181-L185 PolarHBondContact O-N 2.93Å
182	I	90.6	Very high	86.5	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.015	26%	0.264	C	S	.	.	H	α-helix	trans	-58.6	-44.9	174.4	-68.9	164.9	0	0	0	110.2	I166 L178 Y180 S186 A253 I283 L284 N287	I166-I182 HydrophobicContact CD1-CG1 3.92Å; L178-I182 HydrophobicContact CG-CD1 4.19Å; L178-I182 VanDerWaalsContact O-CG1 3.28Å; L178-I182 WeakPolarHBondContact O-CG1 3.28Å; L178-I182 PolarHBondContact O-N 3.42Å; Y180-I182 PolarHBondContact O-N 3.41Å; I182-S186 WeakPolarHBondContact O-CB 3.18Å; I182-S186 PolarHBondContact O-N 3.49Å; I182-A253 HydrophobicContact CG2-CB 4.48Å; I182-I283 HydrophobicContact CD1-CG2 4.07Å; I182-L284 HydrophobicContact CD1-CD2 4.08Å; I182-N287 HydrophobicContact CD1-CB 4.34Å; I182-N287 HydrophobicContact CG2-CB 4.29Å
183	R	87.8	Confident	86.2	Confident	149 Å²	149	50 Å²	50	56%	0.562	26%	0.259	S	S	*	.	H	α-helix	trans	-62.3	-46.5	177.7	-174	176.6	67.3	97.1	-1	111.7	S179 Y180 L181 S186	S179-R183 PolarHBondContact O-N 2.81Å; Y180-R183 WeakPolarHBondContact O-CB 3.48Å; Y180-R183 PolarHBondContact O-N 3.49Å; L181-R183 VanDerWaalsContact C-N 3.29Å; L181-R183 PolarHBondContact O-N 3.2Å; R183-S186 PolarHBondContact O-N 3.13Å; R183-S186 PolarHBondContact O-OG 3.32Å
184	V	87.5	Confident	86	Confident	14 Å²	14	50.3 Å²	50.3	9%	0.085	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-47.6	179.3	175	0	0	0	0	111.2	V148 L155 Y180 L181 S186 T187 R188	V148-V184 HydrophobicContact CG1-CG1 3.82Å; V148-V184 HydrophobicContact CG1-CG2 4.28Å; L155-V184 HydrophobicContact CD1-CG1 3.62Å; Y180-V184 HydrophobicContact CD1-CG2 4.15Å; Y180-V184 HydrophobicContact CD2-CG2 4.44Å; Y180-V184 HydrophobicContact CE1-CG2 3.67Å; Y180-V184 HydrophobicContact CE2-CG2 3.96Å; Y180-V184 WeakPolarHBondContact O-CG2 3.42Å; Y180-V184 PolarHBondContact O-N 3.38Å; L181-V184 PolarHBondContact O-N 3.27Å; V184-S186 VanDerWaalsContact C-N 3.27Å; V184-S186 PolarHBondContact O-N 2.71Å; V184-T187 PolarHBondContact O-N 3.23Å; V184-T187 PolarHBondContact O-OG1 3.17Å; V184-R188 PolarHBondContact O-N 2.89Å
185	L	86	Confident	85.5	Confident	6 Å²	6	48.5 Å²	48.5	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-63.2	-33.1	-179.8	-73	168.8	0	0	0	112.2	L155 I166 L181 T187 R188 L189 A253 Y256	L155-L185 HydrophobicContact CB-CD2 4.22Å; L155-L185 HydrophobicContact CD1-CD2 4.47Å; I166-L185 HydrophobicContact CB-CD1 3.86Å; I166-L185 HydrophobicContact CD1-CD1 3.81Å; I166-L185 HydrophobicContact CG1-CD1 4.32Å; I166-L185 HydrophobicContact CG2-CD1 4.06Å; L181-L185 VanDerWaalsContact O-CB 3.28Å; L181-L185 WeakPolarHBondContact O-CB 3.35Å; L181-L185 VanDerWaalsContact O-CG 3.29Å; L181-L185 WeakPolarHBondContact O-CG 3.44Å; L181-L185 PolarHBondContact O-N 2.93Å; L185-T187 PolarHBondContact O-N 3.06Å; L185-R188 CarbonylContact O-C 3.6Å; L185-R188 VanDerWaalsContact O-C 3.25Å; L185-R188 PolarHBondContact O-N 3.45Å; L185-R188 VanDerWaalsContact O-N 3.08Å; L185-L189 VanDerWaalsContact O-CD2 3.3Å; L185-L189 WeakPolarHBondContact O-CD2 3.4Å; L185-L189 WeakPolarHBondContact O-CG 3.45Å; L185-L189 PolarHBondContact O-N 3.28Å; L185-A253 HydrophobicContact CB-CB 3.95Å; L185-Y256 HydrophobicContact CD1-CD1 4.37Å; L185-Y256 HydrophobicContact CD2-CD1 4.47Å; L185-Y256 HydrophobicContact CD2-CE1 3.96Å
186	S	83.4	Confident	84.9	Confident	16 Å²	16	51 Å²	51	11%	0.112	27%	0.274	C	S	.	.	H	α-helix	trans	-59.9	-26	174.5	76.6	0	0	0	0	113.6	I182 R183 V184	I182-S186 WeakPolarHBondContact O-CB 3.18Å; I182-S186 PolarHBondContact O-N 3.49Å; R183-S186 PolarHBondContact O-N 3.13Å; R183-S186 PolarHBondContact O-OG 3.32Å; V184-S186 VanDerWaalsContact C-N 3.27Å; V184-S186 PolarHBondContact O-N 2.71Å
187	T	82.2	Confident	84.3	Confident	106 Å²	106	51.5 Å²	51.5	65%	0.65	27%	0.271	S	S	*	.	H	α-helix	trans	-89.9	-22.5	176.2	65.4	0	0	0	0	113.4	V184 L185	V184-T187 PolarHBondContact O-N 3.23Å; V184-T187 PolarHBondContact O-OG1 3.17Å; L185-T187 PolarHBondContact O-N 3.06Å
188	R	80.4	Confident	83.7	Confident	149 Å²	149	52.7 Å²	52.7	56%	0.562	28%	0.276	S	S	*	.	S	Bend	trans	-126.1	60	-175	-64.3	-176.3	-177.5	171.9	1.6	110.1	V184 L185	V184-R188 PolarHBondContact O-N 2.89Å; L185-R188 CarbonylContact O-C 3.6Å; L185-R188 VanDerWaalsContact O-C 3.25Å; L185-R188 PolarHBondContact O-N 3.45Å; L185-R188 VanDerWaalsContact O-N 3.08Å
189	L	79.2	Confident	82.9	Confident	45 Å²	45	55.1 Å²	55.1	24%	0.236	29%	0.289	C	S	.	.			trans	-76.6	131.2	-175.9	-73	172.6	0	0	0	111.4	L185 I194 L202 K249 A252 A253 Y256	L185-L189 VanDerWaalsContact O-CD2 3.3Å; L185-L189 WeakPolarHBondContact O-CD2 3.4Å; L185-L189 WeakPolarHBondContact O-CG 3.45Å; L185-L189 PolarHBondContact O-N 3.28Å; L189-I194 HydrophobicContact CB-CD1 4.1Å; L189-I194 HydrophobicContact CD2-CD1 4.12Å; L189-I194 HydrophobicContact CG-CD1 4.49Å; L189-L202 HydrophobicContact CD1-CD1 4.32Å; L189-L202 HydrophobicContact CD1-CD2 3.94Å; L189-K249 HydrophobicContact CD1-CB 3.73Å; L189-K249 HydrophobicContact CD1-CD 4.4Å; L189-K249 HydrophobicContact CD1-CG 3.65Å; L189-A252 HydrophobicContact CD1-CB 4.36Å; L189-A252 HydrophobicContact CD2-CB 4.29Å; L189-A253 HydrophobicContact CD2-CB 4.13Å; L189-Y256 WeakPolarHBondContact CA-OH 3.4Å; L189-Y256 HydrophobicContact CD2-CE2 3.53Å; L189-Y256 VanDerWaalsContact CD2-OH 3.27Å; L189-Y256 WeakPolarHBondContact CD2-OH 3.22Å
190	H	76.7	Confident	81.9	Confident	78 Å²	78	56.6 Å²	56.6	36%	0.361	30%	0.297	S	S	.	.			trans	-106.8	121	173.2	-166.1	-100.9	0	0	0	110.6	L192 N193 I194 Y256	H190-L192 VanDerWaalsContact C-N 3.28Å; H190-L192 WeakPolarHBondContact CE1-CD1 3.47Å; H190-L192 PolarHBondContact O-N 3.27Å; H190-N193 PolarHBondContact O-N 2.8Å; H190-I194 WeakPolarHBondContact O-CG1 3.5Å; H190-Y256 PolarHBondContact N-OH 2.95Å
191	P	74.7	Confident	80.6	Confident	79 Å²	79	57.6 Å²	57.6	51%	0.513	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-57.3	-34.7	-171.8	-25.6	32.9	0	0	0	114.6	N193 I194 L199	P191-N193 VanDerWaalsContact C-N 3.29Å; P191-N193 PolarHBondContact O-N 2.76Å; P191-I194 PolarHBondContact O-N 2.83Å; P191-L199 HydrophobicContact CB-CD2 4.02Å
192	L	78.6	Confident	79.4	Confident	144 Å²	144	59 Å²	59	75%	0.754	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-66	-27.1	-176.1	-81.4	109.3	0	0	0	114.4	H190	H190-L192 VanDerWaalsContact C-N 3.28Å; H190-L192 WeakPolarHBondContact CE1-CD1 3.47Å; H190-L192 PolarHBondContact O-N 3.27Å
193	N	83.4	Confident	78	Confident	29 Å²	29	63.8 Å²	63.8	16%	0.155	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-95	1	-176.2	-67	-2.5	0	0	0	112	Q156 H190 P191 Y256 L257	Q156-N193 PolarHBondContact OE1-ND2 3.12Å; H190-N193 PolarHBondContact O-N 2.8Å; P191-N193 VanDerWaalsContact C-N 3.29Å; P191-N193 PolarHBondContact O-N 2.76Å; N193-Y256 HydrophobicContact CB-CD1 3.99Å; N193-Y256 HydrophobicContact CB-CE1 4.07Å; N193-Y256 HydrophobicContact CB-CG 4.46Å; N193-Y256 CarbonylContact O-C 3.53Å; N193-Y256 WeakPolarHBondContact O-CA 3.43Å; N193-L257 PolarHBondContact O-N 3.01Å
194	I	84.1	Confident	76.6	Confident	8 Å²	8	65.1 Å²	65.1	4%	0.041	35%	0.353	C	S	.	.	S	Bend	trans	-96.5	128.3	-178.5	-60.1	169.1	0	0	0	108.2	L189 H190 P191 A196 F198 L199 L202 A252 Y256	L189-I194 HydrophobicContact CB-CD1 4.1Å; L189-I194 HydrophobicContact CD2-CD1 4.12Å; L189-I194 HydrophobicContact CG-CD1 4.49Å; H190-I194 WeakPolarHBondContact O-CG1 3.5Å; P191-I194 PolarHBondContact O-N 2.83Å; I194-A196 PolarHBondContact O-N 3Å; I194-F198 HydrophobicContact CG2-CB 3.73Å; I194-L199 HydrophobicContact CB-CD2 4.47Å; I194-L199 HydrophobicContact CG2-CG 4.42Å; I194-L202 HydrophobicContact CD1-CD1 3.58Å; I194-L202 HydrophobicContact CG2-CD1 4.2Å; I194-A252 HydrophobicContact CD1-CB 4.4Å; I194-A252 HydrophobicContact CG2-CB 4.13Å; I194-Y256 HydrophobicContact CD1-CE2 4.36Å; I194-Y256 HydrophobicContact CG1-CD2 4.39Å; I194-Y256 HydrophobicContact CG1-CE2 3.72Å
195	P	82.4	Confident	74.7	Confident	9 Å²	9	69.5 Å²	69.5	6%	0.058	38%	0.377	C	S	.	.			trans	-55.9	140.9	175.4	-22	28.8	0	0	0	111.2	Q197 F198 N255 L257 L293	P195-Q197 HydrophobicContact CB-CG 4.3Å; P195-Q197 PolarHBondContact O-N 2.94Å; P195-F198 HydrophobicContact CB-CD2 3.84Å; P195-F198 HydrophobicContact CB-CE2 4.19Å; P195-F198 HydrophobicContact CG-CD2 3.89Å; P195-F198 HydrophobicContact CG-CE2 4.07Å; P195-F198 PolarHBondContact O-N 2.94Å; P195-N255 WeakPolarHBondContact CD-O 3.4Å; P195-N255 HydrophobicContact CG-CB 4.16Å; P195-N255 WeakPolarHBondContact CG-O 3.45Å; P195-L257 HydrophobicContact CB-CD1 4.31Å; P195-L257 HydrophobicContact CG-CD1 4.02Å; P195-L257 HydrophobicContact CG-CD2 4.16Å; P195-L257 HydrophobicContact CG-CG 3.91Å; P195-L293 HydrophobicContact CG-CD1 4.16Å
196	A	77	Confident	72.5	Confident	79 Å²	79	74.1 Å²	74.1	65%	0.653	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-29.5	-174.4	0	0	0	0	0	114.2	I194 F198 L199 P200	I194-A196 PolarHBondContact O-N 3Å; A196-F198 PolarHBondContact O-N 3.24Å; A196-L199 PolarHBondContact O-N 3.05Å; A196-P200 WeakPolarHBondContact O-CD 3.49Å
197	Q	77.9	Confident	69.9	Low	101 Å²	101	83.3 Å²	83.3	47%	0.472	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-20.7	177.5	70.8	-177.8	21.9	0	0	114.4	P195 D290	P195-Q197 HydrophobicContact CB-CG 4.3Å; P195-Q197 PolarHBondContact O-N 2.94Å; Q197-D290 PolarHBondContact NE2-OD2 3.1Å
198	F	79.6	Confident	67.3	Low	26 Å²	26	82.6 Å²	82.6	11%	0.114	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-14.2	-179	-57.9	-69.1	0	0	0	113.5	I194 P195 A196 V251 N255 D290 L293	I194-F198 HydrophobicContact CG2-CB 3.73Å; P195-F198 HydrophobicContact CB-CD2 3.84Å; P195-F198 HydrophobicContact CB-CE2 4.19Å; P195-F198 HydrophobicContact CG-CD2 3.89Å; P195-F198 HydrophobicContact CG-CE2 4.07Å; P195-F198 PolarHBondContact O-N 2.94Å; A196-F198 PolarHBondContact O-N 3.24Å; F198-V251 HydrophobicContact CD1-CG1 4.14Å; F198-V251 HydrophobicContact CE1-CG1 3.76Å; F198-V251 HydrophobicContact CZ-CG1 4.4Å; F198-N255 HydrophobicContact CD2-CB 4.13Å; F198-N255 HydrophobicContact CE2-CB 3.58Å; F198-N255 HydrophobicContact CZ-CB 4.24Å; F198-N255 VanDerWaalsContact CZ-ND2 3.31Å; F198-N255 WeakPolarHBondContact CZ-ND2 3.48Å; F198-D290 HydrophobicContact CZ-CB 4.19Å; F198-L293 HydrophobicContact CE2-CD1 4.22Å
199	L	76	Confident	64.8	Low	51 Å²	51	80 Å²	80	27%	0.267	45%	0.445	S	S	.	.	S	Bend	trans	-62.5	-47.9	179.3	-81.5	167	0	0	0	114.1	P191 I194 A196 A201 L202 N203	P191-L199 HydrophobicContact CB-CD2 4.02Å; I194-L199 HydrophobicContact CB-CD2 4.47Å; I194-L199 HydrophobicContact CG2-CG 4.42Å; A196-L199 PolarHBondContact O-N 3.05Å; L199-A201 PolarHBondContact O-N 3.39Å; L199-A201 VanDerWaalsContact O-N 3.12Å; L199-L202 PolarHBondContact O-N 3.27Å; L199-N203 PolarHBondContact O-N 3.06Å
200	P	69.5	Low	62.3	Low	85 Å²	85	85.2 Å²	85.2	55%	0.552	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-33.6	-177.8	-25.2	33.2	0	0	0	112.8	A196 L202 N203	A196-P200 WeakPolarHBondContact O-CD 3.49Å; P200-L202 VanDerWaalsContact C-N 3.31Å; P200-L202 PolarHBondContact O-N 3.31Å; P200-N203 PolarHBondContact O-N 2.96Å
201	A	63.8	Low	59.9	Low	33 Å²	33	89.8 Å²	89.8	27%	0.273	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-9.4	-175	0	0	0	0	0	113.5	L199 M248	L199-A201 PolarHBondContact O-N 3.39Å; L199-A201 VanDerWaalsContact O-N 3.12Å; A201-M248 HydrophobicContact CB-CE 3.05Å; A201-M248 HydrophobicContact CB-CG 4.18Å; A201-M248 HydrophobicContact CB-SD 3.33Å; A201-M248 WeakPolarHBondContact CB-SD 3.45Å
202	L	66.6	Low	57.6	Low	29 Å²	29	93.6 Å²	93.6	15%	0.152	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-24.7	167.9	-65.7	168	0	0	0	111.7	L189 I194 L199 P200 M248 K249 A252	L189-L202 HydrophobicContact CD1-CD1 4.32Å; L189-L202 HydrophobicContact CD1-CD2 3.94Å; I194-L202 HydrophobicContact CD1-CD1 3.58Å; I194-L202 HydrophobicContact CG2-CD1 4.2Å; L199-L202 PolarHBondContact O-N 3.27Å; P200-L202 VanDerWaalsContact C-N 3.31Å; P200-L202 PolarHBondContact O-N 3.31Å; L202-M248 HydrophobicContact CD2-CG 4.47Å; L202-K249 HydrophobicContact CD2-CG 3.85Å; L202-A252 HydrophobicContact CD1-CB 3.96Å; L202-A252 HydrophobicContact CD2-CB 4.36Å
203	N	61.4	Low	55.2	Low	104 Å²	104	96.2 Å²	96.2	56%	0.556	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-81.6	-9.5	-175.1	-72.8	-4.1	0	0	0	114	L199 P200 D205 N206	L199-N203 PolarHBondContact O-N 3.06Å; P200-N203 PolarHBondContact O-N 2.96Å; N203-D205 PolarHBondContact O-N 3.39Å; N203-D205 VanDerWaalsContact O-N 3.08Å; N203-N206 PolarHBondContact O-N 3.11Å
204	E	57.7	Low	52.5	Low	176 Å²	176	103.3 Å²	103.3	82%	0.822	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-60.5	-16.8	172.9	-69.7	-167.6	164.9	0	0	112.3
205	D	47.5	Very low	49.9	Very low	107 Å²	107	107.6 Å²	107.6	57%	0.572	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-110.6	-4.6	-179.6	-66.3	-24.1	0	0	0	115.6	N203	N203-D205 PolarHBondContact O-N 3.39Å; N203-D205 VanDerWaalsContact O-N 3.08Å
206	N	39.9	Very low	47.2	Very low	103 Å²	103	116.3 Å²	116.3	55%	0.551	62%	0.622	S	S	*	*			trans	-127.3	89.2	-168.8	-97.5	10.8	0	0	0	113.9	N203 C208	N203-N206 PolarHBondContact O-N 3.11Å; N206-C208 HydrophobicContact CB-CB 4.22Å; N206-C208 PolarHBondContact O-N 3.15Å
207	E	29.4	Very low	44.8	Very low	208 Å²	208	120 Å²	120	97%	0.972	63%	0.631	S	S	*	*			trans	-62.5	84.3	138.5	-83.3	-176.7	151.9	0	0	107.3
208	C	27.1	Very low	42.4	Very low	92 Å²	92	122.9 Å²	122.9	62%	0.622	65%	0.65	S	S	*	*			trans	-88.9	112.1	-178.7	-144.4	0	0	0	0	109.5	N206 L210	N206-C208 HydrophobicContact CB-CB 4.22Å; N206-C208 PolarHBondContact O-N 3.15Å; C208-L210 PolarHBondContact O-N 3.43Å
209	S	27.4	Very low	39.9	Very low	93 Å²	93	127.9 Å²	127.9	65%	0.65	68%	0.682	S	S	*	*			trans	-52.6	123.2	168.3	43.2	0	0	0	0	110.8	E211	S209-E211 PolarHBondContact O-N 3Å; S209-E211 VanDerWaalsContact O-N 3.11Å
210	L	26.8	Very low	37.4	Very low	155 Å²	155	131.9 Å²	131.9	81%	0.812	70%	0.704	S	S	*	*			trans	-66.8	99.8	168.3	-64.9	167.8	0	0	0	107.9	C208	C208-L210 PolarHBondContact O-N 3.43Å
211	E	26.9	Very low	35.4	Very low	174 Å²	174	133 Å²	133	81%	0.813	71%	0.705	S	S	*	*			trans	-95	94.5	160.2	-70.1	-174.2	178.7	0	0	106.7	S209 E213	S209-E211 PolarHBondContact O-N 3Å; S209-E211 VanDerWaalsContact O-N 3.11Å; E211-E213 PolarHBondContact O-N 3.17Å
212	E	27.6	Very low	33.5	Very low	160 Å²	160	139.3 Å²	139.3	75%	0.748	73%	0.726	S	S	*	*			trans	-69.6	105.4	166.6	-67.7	175.8	167.2	0	0	107.1	E214	E212-E214 VanDerWaalsContact C-N 3.3Å; E212-E214 PolarHBondContact O-N 3.29Å
213	E	27.1	Very low	31.5	Very low	198 Å²	198	146.4 Å²	146.4	93%	0.925	76%	0.759	S	S	*	*			trans	-70.1	88.2	166.8	-81.7	-175.6	152.6	0	0	108.7	E211	E211-E213 PolarHBondContact O-N 3.17Å
214	E	26.2	Very low	29.8	Very low	179 Å²	179	148.5 Å²	148.5	84%	0.836	77%	0.77	S	S	*	*			trans	-75.6	117.4	157.3	-75.3	-171.3	155.4	0	0	108.7	E212 E216	E212-E214 VanDerWaalsContact C-N 3.3Å; E212-E214 PolarHBondContact O-N 3.29Å; E214-E216 PolarHBondContact O-N 3.33Å
215	A	30.9	Very low	28.2	Very low	98 Å²	98	149 Å²	149	81%	0.81	77%	0.772	S	S	*	*			trans	-71.7	117	173	0	0	0	0	0	110.2
216	E	24.5	Very low	27.2	Very low	191 Å²	191	150.3 Å²	150.3	89%	0.893	78%	0.779	S	S	*	*			trans	-142.6	136.8	148.6	-77.8	-161.3	160.6	0	0	110.7	E214	E214-E216 PolarHBondContact O-N 3.33Å
217	D	28	Very low	26.5	Very low	156 Å²	156	151.1 Å²	151.1	83%	0.834	79%	0.79	S	S	*	*			trans	-58.8	137.1	-178.3	-56.7	-70.6	0	0	0	112.6
218	D	26.7	Very low	26.2	Very low	163 Å²	163	150.6 Å²	150.6	87%	0.872	79%	0.785	S	S	*	*				-166.7	139.4	123.8	-109.8	-29.5	0	0	0	114.1
219	V	27.3	Very low	26	Very low	131 Å²	131	154.2 Å²	154.2	79%	0.794	79%	0.792	S	S	*	*			trans	-69	136.8	-178	175.7	0	0	0	0	110
220	N	24.1	Very low	25.8	Very low	134 Å²	134	155.8 Å²	155.8	72%	0.717	80%	0.802	S	S	*	*				147.5	130.5	121.8	-151.3	5	0	0	0	114.7
221	N	25.9	Very low	25.5	Very low	109 Å²	109	156.8 Å²	156.8	58%	0.583	80%	0.8	S	S	*	*			trans	79.1	101.5	151.7	-91.6	-27.2	0	0	0	122.4
222	K	24.9	Very low	25.2	Very low	166 Å²	166	156 Å²	156	72%	0.722	80%	0.8	S	S	*	*				74.9	107.2	119.6	-74.2	176.1	-173.6	172	0	120.5
223	Q	25	Very low	25.1	Very low	177 Å²	177	153.1 Å²	153.1	83%	0.827	80%	0.798	S	S	*	*				46.6	94.4	120.5	-72.7	175.2	-30.8	0	0	117.3
224	N	25.3	Very low	25.1	Very low	148 Å²	148	149.7 Å²	149.7	79%	0.791	79%	0.79	S	S	*	*			trans	-177.5	79.7	133.3	-117.6	-6.3	0	0	0	111.4
225	Q	24.5	Very low	25.2	Very low	186 Å²	186	147 Å²	147	87%	0.869	79%	0.787	S	S	*	*			trans	-137.5	107.7	161	-68.1	-167.3	7.5	0	0	109.8
226	N	25	Very low	25.2	Very low	135 Å²	135	146.5 Å²	146.5	72%	0.722	78%	0.782	S	S	*	*			trans	-64	154	-176.9	-74.8	-31.9	0	0	0	112	F228	N226-F228 PolarHBondContact O-N 2.85Å
227	P	25.9	Very low	25.4	Very low	121 Å²	121	146.5 Å²	146.5	79%	0.786	78%	0.779	S	S	*	*			trans	-71.8	128.8	-166.4	14.8	-7	0	0	0	112.2	H229	P227-H229 PolarHBondContact O-N 3.35Å
228	F	23.6	Very low	25.8	Very low	196 Å²	196	146.2 Å²	146.2	86%	0.86	78%	0.778	S	S	*	*			trans	-59.9	100.1	179.5	-83	-94.8	0	0	0	112.1	N226 C230	N226-F228 PolarHBondContact O-N 2.85Å; F228-C230 PolarHBondContact O-N 2.95Å
229	H	22.1	Very low	26.8	Very low	168 Å²	168	143.4 Å²	143.4	78%	0.778	77%	0.771	S	S	*	*			trans	-85	86.8	173.8	-156.8	-61.3	0	0	0	109.6	P227 K231	P227-H229 PolarHBondContact O-N 3.35Å; H229-K231 PolarHBondContact O-N 3.25Å
230	C	22.9	Very low	27.7	Very low	126 Å²	126	140.9 Å²	140.9	85%	0.851	76%	0.759	S	S	*	*			trans	-76.3	90.3	176.7	-156.7	0	0	0	0	110.3	F228	F228-C230 PolarHBondContact O-N 2.95Å
231	K	20.6	Very low	28.8	Very low	177 Å²	177	142.1 Å²	142.1	77%	0.77	76%	0.76	S	S	*	*			trans	-85	112.2	173.6	-153.4	173.8	-171	174.3	0	108.1	H229 S233	H229-K231 PolarHBondContact O-N 3.25Å; K231-S233 PolarHBondContact O-N 3.39Å; K231-S233 VanDerWaalsContact O-N 3.07Å
232	L	22.4	Very low	30.2	Very low	156 Å²	156	138.8 Å²	138.8	82%	0.817	75%	0.751	S	S	*	*			trans	-46	111.1	174	-115.3	87.1	0	0	0	110.8	V234	L232-V234 HydrophobicContact CD2-CG2 4.24Å
233	S	24.2	Very low	32.2	Very low	101 Å²	101	137.7 Å²	137.7	71%	0.706	75%	0.747	S	S	*	*			trans	-94.9	104	163.3	75.4	0	0	0	0	108.1	K231 T235	K231-S233 PolarHBondContact O-N 3.39Å; K231-S233 VanDerWaalsContact O-N 3.07Å; S233-T235 PolarHBondContact O-N 3.1Å
234	V	26.7	Very low	34.3	Very low	126 Å²	126	136.3 Å²	136.3	76%	0.764	74%	0.738	S	S	*	*			trans	-81.1	88.6	171	178.8	0	0	0	0	106.5	L232	L232-V234 HydrophobicContact CD2-CG2 4.24Å
235	T	28.7	Very low	36.5	Very low	123 Å²	123	130.2 Å²	130.2	76%	0.755	71%	0.708	S	S	*	*			trans	-97.2	104.3	167.2	49.7	0	0	0	0	108.3	S233 K237	S233-T235 PolarHBondContact O-N 3.1Å; T235-K237 PolarHBondContact O-N 3.3Å
236	A	30.2	Very low	38.9	Very low	87 Å²	87	126.1 Å²	126.1	72%	0.719	69%	0.693	S	S	*	*			trans	-72.6	105.6	178	0	0	0	0	0	109.9
237	K	30	Very low	41.5	Very low	190 Å²	190	122.8 Å²	122.8	83%	0.826	68%	0.677	S	S	*	*	S	Bend	trans	163.8	80.3	144.9	-90.5	165.3	-178	-175.1	0	108.2	T235	T235-K237 PolarHBondContact O-N 3.3Å
238	D	36.6	Very low	44.2	Very low	151 Å²	151	120.4 Å²	120.4	81%	0.807	66%	0.656	S	S	*	*			trans	-178.7	26.6	156.6	-83.9	-21	0	0	0	110.3	S240	D238-S240 VanDerWaalsContact C-N 3.29Å; D238-S240 PolarHBondContact O-N 2.88Å; D238-S240 VanDerWaalsContact O-N 3.08Å
239	S	47.1	Very low	47	Very low	103 Å²	103	114.8 Å²	114.8	72%	0.72	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-7.5	-159.4	57.1	0	0	0	0	116.1	F243	S239-F243 WeakPolarHBondContact O-CB 3.38Å
240	S	45.6	Very low	50.1	Low	78 Å²	78	108.4 Å²	108.4	55%	0.545	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.4	-45.2	-177.2	168.8	0	0	0	0	112.4	D238 K244	D238-S240 VanDerWaalsContact C-N 3.29Å; D238-S240 PolarHBondContact O-N 2.88Å; D238-S240 VanDerWaalsContact O-N 3.08Å; S240-K244 PolarHBondContact O-N 3.31Å
241	E	48.1	Very low	53.1	Low	161 Å²	161	103.9 Å²	103.9	75%	0.752	57%	0.573	S	S	*	*	H	α-helix	trans	-76.6	-46.7	-177.4	-70.2	-178.6	171.8	0	0	110.9	F243 K244 A245	E241-F243 PolarHBondContact O-N 3.15Å; E241-K244 PolarHBondContact O-N 3.35Å; E241-K244 VanDerWaalsContact O-N 3.09Å; E241-A245 PolarHBondContact O-N 3.16Å
242	G	54.8	Low	56.2	Low	38 Å²	38	95.5 Å²	95.5	39%	0.392	54%	0.536	S	S	.	.	H	α-helix	trans	-60.4	-31.8	175.1	0	0	0	0	0	113.7	N246	G242-N246 WeakPolarHBondContact O-CB 3.34Å; G242-N246 PolarHBondContact O-N 2.92Å; G242-N246 PolarHBondContact O-ND2 2.97Å
243	F	66.2	Low	59.3	Low	144 Å²	144	88 Å²	88	63%	0.632	50%	0.497	S	S	*	.	H	α-helix	trans	-69.1	-44.1	174.1	-177.9	-98.7	0	0	0	111.8	S239 E241 N246 V247	S239-F243 WeakPolarHBondContact O-CB 3.38Å; E241-F243 PolarHBondContact O-N 3.15Å; F243-N246 PolarHBondContact O-N 3.01Å; F243-V247 HydrophobicContact CD1-CG2 4.24Å; F243-V247 HydrophobicContact CE1-CG2 3.88Å; F243-V247 HydrophobicContact CE2-CG2 4.4Å; F243-V247 HydrophobicContact CZ-CG2 3.97Å; F243-V247 VanDerWaalsContact O-CG2 3.29Å; F243-V247 WeakPolarHBondContact O-CG2 3.22Å; F243-V247 PolarHBondContact O-N 3.41Å
244	K	69	Low	62.5	Low	147 Å²	147	83.2 Å²	83.2	64%	0.639	46%	0.464	S	S	*	.	H	α-helix	trans	-62.2	-44.7	175.8	-75.4	-179.3	-179.7	179.5	0	111.8	S240 E241 N246 V247 M248	S240-K244 PolarHBondContact O-N 3.31Å; E241-K244 PolarHBondContact O-N 3.35Å; E241-K244 VanDerWaalsContact O-N 3.09Å; K244-N246 PolarHBondContact O-N 3.46Å; K244-V247 PolarHBondContact O-N 3.04Å; K244-M248 WeakPolarHBondContact O-CB 3.47Å; K244-M248 PolarHBondContact O-N 3.42Å
245	A	71.3	Confident	65.5	Low	20 Å²	20	77.2 Å²	77.2	17%	0.165	43%	0.427	C	S	.	.	H	α-helix	trans	-60.6	-44.5	177.6	0	0	0	0	0	111.7	E241 V247 M248 K249	E241-A245 PolarHBondContact O-N 3.16Å; A245-V247 PolarHBondContact O-N 2.95Å; A245-M248 WeakPolarHBondContact O-CB 3.43Å; A245-M248 PolarHBondContact O-N 2.99Å; A245-K249 WeakPolarHBondContact O-CG 3.41Å; A245-K249 PolarHBondContact O-N 2.91Å
246	N	75.4	Confident	68.5	Low	101 Å²	101	71.4 Å²	71.4	54%	0.54	39%	0.391	S	S	.	.	H	α-helix	trans	-63	-43.2	176.5	-75.2	-18.2	0	0	0	112.3	G242 F243 K244 M248 K249 T250	G242-N246 WeakPolarHBondContact O-CB 3.34Å; G242-N246 PolarHBondContact O-N 2.92Å; G242-N246 PolarHBondContact O-ND2 2.97Å; F243-N246 PolarHBondContact O-N 3.01Å; K244-N246 PolarHBondContact O-N 3.46Å; N246-M248 VanDerWaalsContact C-N 3.32Å; N246-M248 PolarHBondContact O-N 3.12Å; N246-K249 PolarHBondContact O-N 3.22Å; N246-T250 WeakPolarHBondContact O-CG2 3.41Å; N246-T250 PolarHBondContact O-N 2.91Å; N246-T250 PolarHBondContact O-OG1 2.95Å
247	V	79.9	Confident	71.4	Confident	64 Å²	64	68.7 Å²	68.7	39%	0.388	37%	0.365	S	S	.	.	H	α-helix	trans	-60.8	-44	174.9	172.9	0	0	0	0	110.2	F243 K244 A245 K249 T250 V251	F243-V247 HydrophobicContact CD1-CG2 4.24Å; F243-V247 HydrophobicContact CE1-CG2 3.88Å; F243-V247 HydrophobicContact CE2-CG2 4.4Å; F243-V247 HydrophobicContact CZ-CG2 3.97Å; F243-V247 VanDerWaalsContact O-CG2 3.29Å; F243-V247 WeakPolarHBondContact O-CG2 3.22Å; F243-V247 PolarHBondContact O-N 3.41Å; K244-V247 PolarHBondContact O-N 3.04Å; A245-V247 PolarHBondContact O-N 2.95Å; V247-K249 VanDerWaalsContact C-N 3.34Å; V247-K249 PolarHBondContact O-N 3.19Å; V247-T250 WeakPolarHBondContact CA-OG1 3.43Å; V247-T250 PolarHBondContact O-N 3.35Å; V247-T250 VanDerWaalsContact O-N 3.16Å; V247-T250 PolarHBondContact O-OG1 3.13Å; V247-V251 HydrophobicContact CG1-CG2 4.36Å; V247-V251 VanDerWaalsContact O-CG2 3.3Å; V247-V251 WeakPolarHBondContact O-CG2 3.18Å; V247-V251 PolarHBondContact O-N 2.93Å
248	M	82.7	Confident	74.2	Confident	72 Å²	72	59.8 Å²	59.8	36%	0.355	33%	0.326	S	S	.	.	H	α-helix	trans	-62.3	-40.7	179.1	-160.8	127.9	-136.2	0	0	112.7	A201 L202 K244 A245 N246 V251 A252	A201-M248 HydrophobicContact CB-CE 3.05Å; A201-M248 HydrophobicContact CB-CG 4.18Å; A201-M248 HydrophobicContact CB-SD 3.33Å; A201-M248 WeakPolarHBondContact CB-SD 3.45Å; L202-M248 HydrophobicContact CD2-CG 4.47Å; K244-M248 WeakPolarHBondContact O-CB 3.47Å; K244-M248 PolarHBondContact O-N 3.42Å; A245-M248 WeakPolarHBondContact O-CB 3.43Å; A245-M248 PolarHBondContact O-N 2.99Å; N246-M248 VanDerWaalsContact C-N 3.32Å; N246-M248 PolarHBondContact O-N 3.12Å; M248-V251 PolarHBondContact O-N 3.31Å; M248-A252 WeakPolarHBondContact O-CB 3.2Å; M248-A252 PolarHBondContact O-N 3.01Å
249	K	82.8	Confident	76.5	Confident	77 Å²	77	59 Å²	59	34%	0.335	32%	0.32	S	S	.	.	H	α-helix	trans	-63.6	-39.4	174.3	-70.8	178.7	-178	177.2	0	112.3	L189 L202 A245 N246 V247 A252 A253	L189-K249 HydrophobicContact CD1-CB 3.73Å; L189-K249 HydrophobicContact CD1-CD 4.4Å; L189-K249 HydrophobicContact CD1-CG 3.65Å; L202-K249 HydrophobicContact CD2-CG 3.85Å; A245-K249 WeakPolarHBondContact O-CG 3.41Å; A245-K249 PolarHBondContact O-N 2.91Å; N246-K249 PolarHBondContact O-N 3.22Å; V247-K249 VanDerWaalsContact C-N 3.34Å; V247-K249 PolarHBondContact O-N 3.19Å; K249-A252 PolarHBondContact O-N 3.29Å; K249-A253 WeakPolarHBondContact O-CB 3.36Å; K249-A253 PolarHBondContact O-N 2.98Å
250	T	86.5	Confident	78.2	Confident	35 Å²	35	57.9 Å²	57.9	22%	0.215	31%	0.305	C	S	.	.	H	α-helix	trans	-66.7	-39.1	174.5	55.5	0	0	0	0	112.6	N246 V247 A253 A254	N246-T250 WeakPolarHBondContact O-CG2 3.41Å; N246-T250 PolarHBondContact O-N 2.91Å; N246-T250 PolarHBondContact O-OG1 2.95Å; V247-T250 WeakPolarHBondContact CA-OG1 3.43Å; V247-T250 PolarHBondContact O-N 3.35Å; V247-T250 VanDerWaalsContact O-N 3.16Å; V247-T250 PolarHBondContact O-OG1 3.13Å; T250-A253 PolarHBondContact O-N 3.32Å; T250-A254 PolarHBondContact O-N 2.91Å
251	V	86.4	Confident	80.2	Confident	30 Å²	30	59.7 Å²	59.7	18%	0.182	31%	0.305	C	S	.	.	H	α-helix	trans	-65.1	-41.9	175.5	172	0	0	0	0	111.2	F198 V247 M248 A254 N255 N287	F198-V251 HydrophobicContact CD1-CG1 4.14Å; F198-V251 HydrophobicContact CE1-CG1 3.76Å; F198-V251 HydrophobicContact CZ-CG1 4.4Å; V247-V251 HydrophobicContact CG1-CG2 4.36Å; V247-V251 VanDerWaalsContact O-CG2 3.3Å; V247-V251 WeakPolarHBondContact O-CG2 3.18Å; V247-V251 PolarHBondContact O-N 2.93Å; M248-V251 PolarHBondContact O-N 3.31Å; V251-A254 PolarHBondContact O-N 2.74Å; V251-N255 PolarHBondContact O-N 3.1Å; V251-N255 PolarHBondContact O-ND2 3.13Å; V251-N287 WeakPolarHBondContact CA-O 3.48Å
252	A	86.5	Confident	82.2	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-61.2	-45.4	174.2	0	0	0	0	0	111	L189 I194 L202 M248 K249 A254 N255 Y256	L189-A252 HydrophobicContact CD1-CB 4.36Å; L189-A252 HydrophobicContact CD2-CB 4.29Å; I194-A252 HydrophobicContact CD1-CB 4.4Å; I194-A252 HydrophobicContact CG2-CB 4.13Å; L202-A252 HydrophobicContact CD1-CB 3.96Å; L202-A252 HydrophobicContact CD2-CB 4.36Å; M248-A252 WeakPolarHBondContact O-CB 3.2Å; M248-A252 PolarHBondContact O-N 3.01Å; K249-A252 PolarHBondContact O-N 3.29Å; A252-A254 PolarHBondContact O-N 3.46Å; A252-N255 PolarHBondContact O-N 3.31Å; A252-Y256 VanDerWaalsContact O-CD2 3.29Å; A252-Y256 WeakPolarHBondContact O-CD2 3.49Å
253	A	87.1	Confident	83.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.8	-41.4	177.5	0	0	0	0	0	113.3	I166 I182 L185 L189 K249 T250 N255 Y256	I166-A253 WeakPolarHBondContact CD1-O 3.4Å; I182-A253 HydrophobicContact CG2-CB 4.48Å; L185-A253 HydrophobicContact CB-CB 3.95Å; L189-A253 HydrophobicContact CD2-CB 4.13Å; K249-A253 WeakPolarHBondContact O-CB 3.36Å; K249-A253 PolarHBondContact O-N 2.98Å; T250-A253 PolarHBondContact O-N 3.32Å; A253-N255 PolarHBondContact O-N 3.42Å; A253-Y256 WeakPolarHBondContact O-CD2 3.44Å; A253-Y256 PolarHBondContact O-N 2.93Å
254	A	90.3	Very high	85.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.3	-20.3	178.4	0	0	0	0	0	113.4	T250 V251 A252 N287 A289	T250-A254 PolarHBondContact O-N 2.91Å; V251-A254 PolarHBondContact O-N 2.74Å; A252-A254 PolarHBondContact O-N 3.46Å; A254-N287 HydrophobicContact CB-CB 4.14Å; A254-A289 HydrophobicContact CB-CB 4.3Å
255	N	91	Very high	86.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	21.3	-178.5	-71.2	-61.9	0	0	0	113.9	P195 F198 V251 A252 A253 G288 A289 D290 L293	P195-N255 WeakPolarHBondContact CD-O 3.4Å; P195-N255 HydrophobicContact CG-CB 4.16Å; P195-N255 WeakPolarHBondContact CG-O 3.45Å; F198-N255 HydrophobicContact CD2-CB 4.13Å; F198-N255 HydrophobicContact CE2-CB 3.58Å; F198-N255 HydrophobicContact CZ-CB 4.24Å; F198-N255 VanDerWaalsContact CZ-ND2 3.31Å; F198-N255 WeakPolarHBondContact CZ-ND2 3.48Å; V251-N255 PolarHBondContact O-N 3.1Å; V251-N255 PolarHBondContact O-ND2 3.13Å; A252-N255 PolarHBondContact O-N 3.31Å; A253-N255 PolarHBondContact O-N 3.42Å; N255-G288 PolarHBondContact ND2-O 3.03Å; N255-A289 WeakPolarHBondContact OD1-CA 3.28Å; N255-D290 PolarHBondContact OD1-N 3.18Å; N255-L293 HydrophobicContact CB-CD1 4.34Å
256	Y	91	Very high	87.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.			trans	-53.7	141.5	177.5	-97.2	-136.2	0	0	0	112.2	H167 L185 L189 H190 N193 I194 A252 A253 T263 P264	H167-Y256 PolarHBondContact NE2-O 2.76Å; H167-Y256 VanDerWaalsContact NE2-O 3.11Å; L185-Y256 HydrophobicContact CD1-CD1 4.37Å; L185-Y256 HydrophobicContact CD2-CD1 4.47Å; L185-Y256 HydrophobicContact CD2-CE1 3.96Å; L189-Y256 WeakPolarHBondContact CA-OH 3.4Å; L189-Y256 HydrophobicContact CD2-CE2 3.53Å; L189-Y256 VanDerWaalsContact CD2-OH 3.27Å; L189-Y256 WeakPolarHBondContact CD2-OH 3.22Å; H190-Y256 PolarHBondContact N-OH 2.95Å; N193-Y256 HydrophobicContact CB-CD1 3.99Å; N193-Y256 HydrophobicContact CB-CE1 4.07Å; N193-Y256 HydrophobicContact CB-CG 4.46Å; N193-Y256 CarbonylContact O-C 3.53Å; N193-Y256 WeakPolarHBondContact O-CA 3.43Å; I194-Y256 HydrophobicContact CD1-CE2 4.36Å; I194-Y256 HydrophobicContact CG1-CD2 4.39Å; I194-Y256 HydrophobicContact CG1-CE2 3.72Å; A252-Y256 VanDerWaalsContact O-CD2 3.29Å; A252-Y256 WeakPolarHBondContact O-CD2 3.49Å; A253-Y256 WeakPolarHBondContact O-CD2 3.44Å; A253-Y256 PolarHBondContact O-N 2.93Å; Y256-T263 WeakPolarHBondContact O-CA 3.38Å; Y256-P264 VanDerWaalsContact O-CD 3.25Å; Y256-P264 WeakPolarHBondContact O-CD 3.44Å
257	L	90.3	Very high	87.7	Confident	30 Å²	30	33.4 Å²	33.4	16%	0.157	17%	0.167	C	C	.	.			trans	-97.7	133.8	175.8	-63.1	176.1	0	0	0	109.3	L164 N193 P195 W262 T263	L164-L257 VanDerWaalsContact CD1-O 3.28Å; L164-L257 WeakPolarHBondContact CD1-O 3.29Å; N193-L257 PolarHBondContact O-N 3.01Å; P195-L257 HydrophobicContact CB-CD1 4.31Å; P195-L257 HydrophobicContact CG-CD1 4.02Å; P195-L257 HydrophobicContact CG-CD2 4.16Å; P195-L257 HydrophobicContact CG-CG 3.91Å; L257-W262 WeakPolarHBondContact CA-O 3.45Å; L257-T263 HydrophobicContact CD2-CG2 3.83Å
258	D	89.4	Confident	88.1	Confident	4 Å²	4	30.3 Å²	30.3	2%	0.021	15%	0.149	C	C	.	.			trans	-76.8	177.8	164.5	82.2	-5.9	0	0	0	111.4	G162 H167 N260 H261 W262 H267	G162-D258 WeakPolarHBondContact O-CB 3.44Å; H167-D258 PolarHBondContact CE1-N 3.49Å; D258-N260 PolarHBondContact O-N 3.32Å; D258-N260 VanDerWaalsContact O-N 3.1Å; D258-N260 VanDerWaalsContact OD1-C 3.23Å; D258-N260 VanDerWaalsContact OD1-CA 3.24Å; D258-N260 WeakPolarHBondContact OD1-CA 3.47Å; D258-N260 WeakPolarHBondContact OD1-CB 3.26Å; D258-N260 PolarHBondContact OD1-N 3.17Å; D258-H261 PolarHBondContact O-N 2.85Å; D258-H261 PolarHBondContact OD1-N 3.24Å; D258-W262 PolarHBondContact N-O 2.79Å; D258-W262 WeakPolarHBondContact OD1-CB 3.3Å; D258-W262 PolarHBondContact OD1-N 3.45Å; D258-H267 IonicContact OD2-CD2 3.89Å; D258-H267 IonicContact OD2-CE1 3.72Å; D258-H267 IonicContact OD2-NE2 3.84Å; D258-H267 PolarHBondContact OD2-NE2 3.08Å
259	M	84.5	Confident	88.2	Confident	135 Å²	135	27 Å²	27	67%	0.665	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-14.4	179.5	-58.5	-64.3	-80.6	0	0	113.2	A158 G162	A158-M259 HydrophobicContact CB-CG 3.92Å; G162-M259 WeakPolarHBondContact O-CG 3.46Å; G162-M259 PolarHBondContact O-N 3.09Å
260	N	84.1	Confident	88.2	Confident	78 Å²	78	23.7 Å²	23.7	42%	0.417	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	6.5	175	-56.1	-50	0	0	0	112.6	N161 D258 W262	N161-N260 PolarHBondContact O-ND2 3.4Å; D258-N260 PolarHBondContact O-N 3.32Å; D258-N260 VanDerWaalsContact O-N 3.1Å; D258-N260 VanDerWaalsContact OD1-C 3.23Å; D258-N260 VanDerWaalsContact OD1-CA 3.24Å; D258-N260 WeakPolarHBondContact OD1-CA 3.47Å; D258-N260 WeakPolarHBondContact OD1-CB 3.26Å; D258-N260 PolarHBondContact OD1-N 3.17Å; N260-W262 VanDerWaalsContact C-N 3.34Å; N260-W262 VanDerWaalsContact O-CD1 3.31Å
261	H	86	Confident	87.6	Confident	116 Å²	116	28.8 Å²	28.8	54%	0.537	14%	0.141	S	C	.	.	S	Bend	trans	58.8	38.6	-172.1	-60.7	-77.8	0	0	0	113.9	D258	D258-H261 PolarHBondContact O-N 2.85Å; D258-H261 PolarHBondContact OD1-N 3.24Å
262	W	90.2	Very high	87.2	Confident	47 Å²	47	33 Å²	33	18%	0.178	16%	0.162	C	C	.	.			trans	-101.9	143.9	171.9	-72.6	25.8	0	0	0	110.4	H167 L257 D258 N260 H266 H267 T295	H167-W262 PolarHBondContact NE2-O 3.01Å; L257-W262 WeakPolarHBondContact CA-O 3.45Å; D258-W262 PolarHBondContact N-O 2.79Å; D258-W262 WeakPolarHBondContact OD1-CB 3.3Å; D258-W262 PolarHBondContact OD1-N 3.45Å; N260-W262 VanDerWaalsContact C-N 3.34Å; N260-W262 VanDerWaalsContact O-CD1 3.31Å; W262-H266 HydrophobicContact CB-CB 4.19Å; W262-H266 HydrophobicContact CD2-CB 4.4Å; W262-H266 HydrophobicContact CE3-CB 4.26Å; W262-H266 HydrophobicContact CG-CB 4.4Å; W262-H267 AromaticContact CE3-CE1 3.7Å; W262-H267 AromaticContact CE3-NE2 3.8Å; W262-T295 HydrophobicContact CD2-CG2 4.27Å; W262-T295 HydrophobicContact CG-CG2 4.11Å
263	T	91.4	Very high	86.8	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.163	C	C	.	.			trans	-88.2	162.9	174.1	61.9	0	0	0	0	110.4	Y256 L257 L265 H266 H267 L293	Y256-T263 WeakPolarHBondContact O-CA 3.38Å; L257-T263 HydrophobicContact CD2-CG2 3.83Å; T263-L265 PolarHBondContact O-N 3.48Å; T263-L265 VanDerWaalsContact O-N 3.17Å; T263-H266 PolarHBondContact N-ND1 2.98Å; T263-H266 WeakPolarHBondContact O-CB 3.17Å; T263-H266 PolarHBondContact O-N 3.02Å; T263-H266 PolarHBondContact OG1-N 3.42Å; T263-H266 PolarHBondContact OG1-ND1 3.49Å; T263-H267 PolarHBondContact O-CD2 3.18Å; T263-H267 PolarHBondContact O-N 3.18Å; T263-L293 HydrophobicContact CG2-CB 4.46Å; T263-L293 HydrophobicContact CG2-CD1 3.81Å
264	P	91.5	Very high	86.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-56.7	-31.4	171.7	-24.2	33.4	0	0	0	112	I166 H167 A170 Y256 H267 A268 L284	I166-P264 HydrophobicContact CD1-CG 3.87Å; I166-P264 HydrophobicContact CG1-CB 4.34Å; I166-P264 HydrophobicContact CG1-CG 3.9Å; I166-P264 HydrophobicContact CG2-CG 4.17Å; H167-P264 WeakPolarHBondContact NE2-CD 3.47Å; A170-P264 HydrophobicContact CB-CB 4.08Å; A170-P264 WeakPolarHBondContact CB-O 3.48Å; Y256-P264 VanDerWaalsContact O-CD 3.25Å; Y256-P264 WeakPolarHBondContact O-CD 3.44Å; P264-H267 PolarHBondContact O-N 2.88Å; P264-A268 PolarHBondContact O-N 3.46Å; P264-L284 HydrophobicContact CB-CD1 3.87Å; P264-L284 HydrophobicContact CB-CD2 3.73Å; P264-L284 HydrophobicContact CB-CG 4.49Å; P264-L284 HydrophobicContact CG-CD2 4.41Å
265	L	90.9	Very high	85.4	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-69.3	-35.1	177.9	-172.5	61.6	0	0	0	112.4	T263 A268 S269 I281 L284 L285 A289 P291 A301	T263-L265 PolarHBondContact O-N 3.48Å; T263-L265 VanDerWaalsContact O-N 3.17Å; L265-A268 PolarHBondContact O-N 3.21Å; L265-S269 VanDerWaalsContact O-CB 3.29Å; L265-S269 WeakPolarHBondContact O-CB 3.37Å; L265-S269 PolarHBondContact O-N 2.85Å; L265-S269 VanDerWaalsContact O-N 3.13Å; L265-S269 PolarHBondContact O-OG 3.34Å; L265-I281 HydrophobicContact CD1-CG1 4.34Å; L265-I281 HydrophobicContact CD1-CG2 4.19Å; L265-L284 HydrophobicContact CB-CD1 4.35Å; L265-L284 HydrophobicContact CD1-CB 4.34Å; L265-L284 HydrophobicContact CD1-CD1 4.39Å; L265-L285 HydrophobicContact CD1-CG 4.41Å; L265-L285 HydrophobicContact CD2-CD2 3.92Å; L265-A289 HydrophobicContact CB-CB 4.23Å; L265-A289 HydrophobicContact CD2-CB 4.06Å; L265-P291 HydrophobicContact CD2-CB 3.96Å; L265-A301 HydrophobicContact CD2-CB 4.21Å; L265-A301 HydrophobicContact CG-CB 4.01Å
266	H	90.5	Very high	84.8	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-45.8	170.9	-68.1	147.1	0	0	0	111.6	W262 T263 S269 C270 L293 T295 A301 L304	W262-H266 HydrophobicContact CB-CB 4.19Å; W262-H266 HydrophobicContact CD2-CB 4.4Å; W262-H266 HydrophobicContact CE3-CB 4.26Å; W262-H266 HydrophobicContact CG-CB 4.4Å; T263-H266 PolarHBondContact N-ND1 2.98Å; T263-H266 WeakPolarHBondContact O-CB 3.17Å; T263-H266 PolarHBondContact O-N 3.02Å; T263-H266 PolarHBondContact OG1-N 3.42Å; T263-H266 PolarHBondContact OG1-ND1 3.49Å; H266-S269 PolarHBondContact O-N 3.26Å; H266-S269 VanDerWaalsContact O-N 3.15Å; H266-C270 PolarHBondContact O-N 3.44Å; H266-C270 VanDerWaalsContact O-N 3.11Å; H266-L293 PolarHBondContact CE1-O 3.28Å; H266-L293 PolarHBondContact NE2-O 3.14Å; H266-T295 HydrophobicContact CB-CG2 4.44Å; H266-T295 WeakPolarHBondContact ND1-CG2 3.44Å; H266-A301 PolarHBondContact CD2-N 2.77Å; H266-A301 PolarHBondContact NE2-N 3.11Å; H266-L304 HydrophobicContact CB-CD1 3.71Å
267	H	88.3	Confident	84.4	Confident	10 Å²	10	50.4 Å²	50.4	5%	0.046	25%	0.249	C	C	.	.	H	α-helix	trans	-63.5	-40.1	177.6	-83.7	-69.7	0	0	0	112.7	H167 A170 V171 D258 W262 T263 P264 S269 C270 A273	H167-H267 AromaticContact CD2-CD2 3.58Å; H167-H267 AromaticContact CG-CD2 3.95Å; A170-H267 HydrophobicContact CB-CB 4.32Å; V171-H267 HydrophobicContact CG2-CB 3.55Å; V171-H267 VanDerWaalsContact CG2-ND1 3.31Å; V171-H267 WeakPolarHBondContact CG2-ND1 3.45Å; D258-H267 IonicContact OD2-CD2 3.89Å; D258-H267 IonicContact OD2-CE1 3.72Å; D258-H267 IonicContact OD2-NE2 3.84Å; D258-H267 PolarHBondContact OD2-NE2 3.08Å; W262-H267 AromaticContact CE3-CE1 3.7Å; W262-H267 AromaticContact CE3-NE2 3.8Å; T263-H267 PolarHBondContact O-CD2 3.18Å; T263-H267 PolarHBondContact O-N 3.18Å; P264-H267 PolarHBondContact O-N 2.88Å; H267-S269 PolarHBondContact O-N 3.19Å; H267-C270 PolarHBondContact O-SG 2.86Å; H267-A273 WeakPolarHBondContact O-CB 3.44Å
268	A	88.9	Confident	84.1	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.9	-21.2	174.9	0	0	0	0	0	113.3	A170 P264 L265 C280 I281 L284	A170-A268 HydrophobicContact CB-CB 4.28Å; P264-A268 PolarHBondContact O-N 3.46Å; L265-A268 PolarHBondContact O-N 3.21Å; A268-C280 HydrophobicContact CB-CB 4.5Å; A268-I281 HydrophobicContact CB-CG1 3.76Å; A268-L284 HydrophobicContact CB-CD1 4.23Å
269	S	84.9	Confident	83.9	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.014	27%	0.273	C	S	.	.	H	α-helix	trans	-94.9	-14.3	-176.4	-58.3	0	0	0	0	113.9	L265 H266 H267 A301 L304 A305 L314	L265-S269 VanDerWaalsContact O-CB 3.29Å; L265-S269 WeakPolarHBondContact O-CB 3.37Å; L265-S269 PolarHBondContact O-N 2.85Å; L265-S269 VanDerWaalsContact O-N 3.13Å; L265-S269 PolarHBondContact O-OG 3.34Å; H266-S269 PolarHBondContact O-N 3.26Å; H266-S269 VanDerWaalsContact O-N 3.15Å; H267-S269 PolarHBondContact O-N 3.19Å; S269-A301 WeakPolarHBondContact CB-O 3.19Å; S269-L304 CarbonylContact O-C 3.45Å; S269-L304 VanDerWaalsContact O-C 3.29Å; S269-A305 VanDerWaalsContact O-CA 3.29Å; S269-A305 WeakPolarHBondContact O-CA 3.44Å; S269-A305 PolarHBondContact O-N 3.07Å; S269-L314 VanDerWaalsContact OG-CD1 3.28Å; S269-L314 WeakPolarHBondContact OG-CD1 3.39Å
270	C	83.7	Confident	84.1	Confident	7 Å²	7	49.5 Å²	49.5	5%	0.047	24%	0.242	C	C	.	.	S	Bend	trans	-79.1	173	-177.6	74.7	0	0	0	0	112.8	H266 H267 D272 A273 R310	H266-C270 PolarHBondContact O-N 3.44Å; H266-C270 VanDerWaalsContact O-N 3.11Å; H267-C270 PolarHBondContact O-SG 2.86Å; C270-D272 VanDerWaalsContact C-N 3.32Å; C270-A273 PolarHBondContact O-N 2.87Å; C270-R310 PolarHBondContact O-NH1 3.24Å
271	E	73.5	Confident	84.3	Confident	143 Å²	143	46 Å²	46	67%	0.668	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-33.8	179.5	-170.8	175.1	176.4	0	0	112.2	A273 A308 R310	E271-A273 PolarHBondContact O-N 3.31Å; E271-A273 VanDerWaalsContact O-N 3.16Å; E271-A308 HydrophobicContact CB-CB 4.13Å; E271-R310 PolarHBondContact O-NH2 2.75Å
272	D	77.9	Confident	84.4	Confident	117 Å²	117	45 Å²	45	63%	0.626	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.5	-180	-54.9	-38.7	0	0	0	112.9	V171 C270 V274	V171-D272 HydrophobicContact CG1-CB 4.27Å; V171-D272 WeakPolarHBondContact CG1-O 3.23Å; C270-D272 VanDerWaalsContact C-N 3.32Å; D272-V274 VanDerWaalsContact O-CG2 3.32Å; D272-V274 WeakPolarHBondContact O-CG2 3.11Å; D272-V274 PolarHBondContact O-N 2.87Å
273	A	78.4	Confident	84.3	Confident	4 Å²	4	44.5 Å²	44.5	3%	0.033	22%	0.218	C	C	.	.			trans	-66.4	126.1	177.9	0	0	0	0	0	111.2	V171 H267 C270 E271 R310	V171-A273 CarbonylContact O-C 3.54Å; V171-A273 WeakPolarHBondContact O-CA 3.34Å; H267-A273 WeakPolarHBondContact O-CB 3.44Å; C270-A273 PolarHBondContact O-N 2.87Å; E271-A273 PolarHBondContact O-N 3.31Å; E271-A273 VanDerWaalsContact O-N 3.16Å; A273-R310 PolarHBondContact O-NH1 2.96Å; A273-R310 PolarHBondContact O-NH2 3.47Å
274	V	76.2	Confident	84.2	Confident	66 Å²	66	44.5 Å²	44.5	40%	0.4	22%	0.218	S	C	.	.			trans	-99.4	171.2	-176.9	-151.9	0	0	0	0	109.2	V171 F172 D272	V171-V274 PolarHBondContact O-N 3.31Å; F172-V274 HydrophobicContact CD1-CG2 4.25Å; D272-V274 VanDerWaalsContact O-CG2 3.32Å; D272-V274 WeakPolarHBondContact O-CG2 3.11Å; D272-V274 PolarHBondContact O-N 2.87Å
275	N	71.9	Confident	84	Confident	118 Å²	118	45.7 Å²	45.7	63%	0.631	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-20.4	138.9	-176.9	-60.5	-23.6	0	0	0	117.7	G173 Y277	G173-N275 VanDerWaalsContact CA-O 3.25Å; G173-N275 WeakPolarHBondContact CA-O 3.47Å; N275-Y277 VanDerWaalsContact C-N 3.3Å; N275-Y277 PolarHBondContact O-N 3.32Å
276	H	78.2	Confident	83.7	Confident	119 Å²	119	51 Å²	51	55%	0.551	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	14.8	-179.6	-47.2	92.5	0	0	0	116.2	Y278 D279 C280	H276-Y278 PolarHBondContact O-N 3.43Å; H276-D279 IonicContact CD2-OD2 2.7Å; H276-D279 PolarHBondContact O-N 3.28Å; H276-C280 PolarHBondContact O-N 3.22Å
277	Y	81.7	Confident	83.6	Confident	60 Å²	60	53.4 Å²	53.4	24%	0.235	27%	0.265	C	S	.	.	H	α-helix	trans	-51.4	-30.1	170.7	60.3	-95.9	0	0	0	113.6	N275 C280 I281 R310 M313	N275-Y277 VanDerWaalsContact C-N 3.3Å; N275-Y277 PolarHBondContact O-N 3.32Å; Y277-C280 PolarHBondContact O-N 2.77Å; Y277-I281 HydrophobicContact CD2-CD1 4.16Å; Y277-I281 WeakPolarHBondContact O-CB 3.44Å; Y277-I281 VanDerWaalsContact O-CG1 3.25Å; Y277-I281 WeakPolarHBondContact O-CG1 3.44Å; Y277-I281 PolarHBondContact O-N 2.99Å; Y277-R310 HydrophobicContact CE2-CG 4.46Å; Y277-M313 HydrophobicContact CE2-CG 4.48Å
278	Y	83.6	Confident	83.5	Confident	86 Å²	86	54.3 Å²	54.3	34%	0.337	28%	0.277	S	S	.	.	H	α-helix	trans	-59.7	-46.7	175.6	176.6	-101.8	0	0	0	112.3	H276 C280 I281 K282 M313 V317	H276-Y278 PolarHBondContact O-N 3.43Å; Y278-C280 VanDerWaalsContact C-N 3.31Å; Y278-C280 PolarHBondContact O-N 3.26Å; Y278-I281 PolarHBondContact O-N 3.27Å; Y278-K282 WeakPolarHBondContact O-CB 3.35Å; Y278-K282 PolarHBondContact O-N 3.2Å; Y278-M313 HydrophobicContact CD2-CB 4.32Å; Y278-M313 HydrophobicContact CD2-CE 3.25Å; Y278-M313 HydrophobicContact CD2-SD 4.47Å; Y278-M313 HydrophobicContact CE2-CE 3.87Å; Y278-M313 HydrophobicContact CG-CE 3.7Å; Y278-V317 HydrophobicContact CD2-CG2 4.27Å; Y278-V317 HydrophobicContact CE2-CG2 3.48Å; Y278-V317 VanDerWaalsContact CE2-CG2 3.48Å
279	D	86.5	Confident	83.4	Confident	64 Å²	64	54.4 Å²	54.4	34%	0.342	28%	0.278	S	S	.	.	H	α-helix	trans	-67.7	-36	178.7	-63.2	-42.5	0	0	0	110.4	P175 H276 K282 I283	P175-D279 HydrophobicContact CB-CB 4Å; P175-D279 HydrophobicContact CG-CB 4.27Å; H276-D279 IonicContact CD2-OD2 2.7Å; H276-D279 PolarHBondContact O-N 3.28Å; D279-K282 PolarHBondContact O-N 3.37Å; D279-I283 WeakPolarHBondContact O-CB 3.49Å; D279-I283 WeakPolarHBondContact O-CD1 3.29Å; D279-I283 WeakPolarHBondContact O-CG1 3.31Å; D279-I283 PolarHBondContact O-N 3.32Å
280	C	88.6	Confident	83.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-45.4	173.1	-67.8	0	0	0	0	112.8	G173 L178 A268 H276 Y277 Y278 K282 I283 L284	G173-C280 VanDerWaalsContact CA-SG 3.6Å; L178-C280 HydrophobicContact CD2-CB 3.65Å; A268-C280 HydrophobicContact CB-CB 4.5Å; H276-C280 PolarHBondContact O-N 3.22Å; Y277-C280 PolarHBondContact O-N 2.77Å; Y278-C280 VanDerWaalsContact C-N 3.31Å; Y278-C280 PolarHBondContact O-N 3.26Å; C280-K282 VanDerWaalsContact C-N 3.28Å; C280-K282 PolarHBondContact O-N 3.47Å; C280-I283 PolarHBondContact O-N 3.42Å; C280-L284 WeakPolarHBondContact O-CB 3.46Å; C280-L284 VanDerWaalsContact O-CG 3.25Å; C280-L284 WeakPolarHBondContact O-CG 3.06Å; C280-L284 PolarHBondContact O-N 3.41Å
281	I	88.3	Confident	83.2	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-58.8	-45.1	175.3	-71.6	167.1	0	0	0	109.6	L265 A268 Y277 Y278 L284 L285	L265-I281 HydrophobicContact CD1-CG1 4.34Å; L265-I281 HydrophobicContact CD1-CG2 4.19Å; A268-I281 HydrophobicContact CB-CG1 3.76Å; Y277-I281 HydrophobicContact CD2-CD1 4.16Å; Y277-I281 WeakPolarHBondContact O-CB 3.44Å; Y277-I281 VanDerWaalsContact O-CG1 3.25Å; Y277-I281 WeakPolarHBondContact O-CG1 3.44Å; Y277-I281 PolarHBondContact O-N 2.99Å; Y278-I281 PolarHBondContact O-N 3.27Å; I281-L284 PolarHBondContact O-N 2.91Å; I281-L285 HydrophobicContact CG2-CD1 3.7Å; I281-L285 HydrophobicContact CG2-CG 4.35Å; I281-L285 WeakPolarHBondContact O-CB 3.35Å; I281-L285 VanDerWaalsContact O-CG 3.29Å; I281-L285 WeakPolarHBondContact O-CG 3.34Å; I281-L285 PolarHBondContact O-N 3.31Å
282	K	86.3	Confident	83.4	Confident	95 Å²	95	50.6 Å²	50.6	41%	0.413	26%	0.261	S	S	.	.	H	α-helix	trans	-62.1	-49.5	178.1	-174.4	179.9	176	-173.6	0	111.9	Y278 D279 C280 L284 L285 D286 V317	Y278-K282 WeakPolarHBondContact O-CB 3.35Å; Y278-K282 PolarHBondContact O-N 3.2Å; D279-K282 PolarHBondContact O-N 3.37Å; C280-K282 VanDerWaalsContact C-N 3.28Å; C280-K282 PolarHBondContact O-N 3.47Å; K282-L284 VanDerWaalsContact C-N 3.3Å; K282-L284 PolarHBondContact O-N 3.35Å; K282-L285 PolarHBondContact O-N 3.42Å; K282-D286 VanDerWaalsContact O-CB 3.25Å; K282-D286 WeakPolarHBondContact O-CB 3.32Å; K282-D286 PolarHBondContact O-N 2.95Å; K282-V317 HydrophobicContact CB-CG1 4.36Å; K282-V317 HydrophobicContact CG-CG1 4.38Å
283	I	88.5	Confident	83.5	Confident	37 Å²	37	46 Å²	46	19%	0.19	24%	0.236	C	C	.	.	H	α-helix	trans	-59.8	-42.1	177.6	-71.1	166.2	0	0	0	110.9	P175 I182 D279 C280 N287	P175-I283 HydrophobicContact CB-CD1 3.39Å; P175-I283 WeakPolarHBondContact O-CD1 3.44Å; I182-I283 HydrophobicContact CD1-CG2 4.07Å; D279-I283 WeakPolarHBondContact O-CB 3.49Å; D279-I283 WeakPolarHBondContact O-CD1 3.29Å; D279-I283 WeakPolarHBondContact O-CG1 3.31Å; D279-I283 PolarHBondContact O-N 3.32Å; C280-I283 PolarHBondContact O-N 3.42Å; I283-N287 WeakPolarHBondContact O-CB 3.41Å; I283-N287 PolarHBondContact O-N 3.01Å; I283-N287 PolarHBondContact O-ND2 3.26Å
284	L	90.7	Very high	83.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-47.2	178.4	-74.6	168.2	0	0	0	111.8	A170 L178 I182 P264 L265 A268 C280 I281 K282 N287 G288 A289	A170-L284 HydrophobicContact CB-CD1 4.46Å; L178-L284 HydrophobicContact CD1-CD2 4.33Å; L178-L284 HydrophobicContact CD2-CD1 4.14Å; L178-L284 HydrophobicContact CD2-CD2 4.27Å; L178-L284 HydrophobicContact CD2-CG 3.89Å; I182-L284 HydrophobicContact CD1-CD2 4.08Å; P264-L284 HydrophobicContact CB-CD1 3.87Å; P264-L284 HydrophobicContact CB-CD2 3.73Å; P264-L284 HydrophobicContact CB-CG 4.49Å; P264-L284 HydrophobicContact CG-CD2 4.41Å; L265-L284 HydrophobicContact CB-CD1 4.35Å; L265-L284 HydrophobicContact CD1-CB 4.34Å; L265-L284 HydrophobicContact CD1-CD1 4.39Å; A268-L284 HydrophobicContact CB-CD1 4.23Å; C280-L284 WeakPolarHBondContact O-CB 3.46Å; C280-L284 VanDerWaalsContact O-CG 3.25Å; C280-L284 WeakPolarHBondContact O-CG 3.06Å; C280-L284 PolarHBondContact O-N 3.41Å; I281-L284 PolarHBondContact O-N 2.91Å; K282-L284 VanDerWaalsContact C-N 3.3Å; K282-L284 PolarHBondContact O-N 3.35Å; L284-N287 CarbonylContact O-C 3.56Å; L284-N287 PolarHBondContact O-N 2.59Å; L284-G288 PolarHBondContact O-N 3.29Å; L284-A289 HydrophobicContact CB-CB 3.78Å; L284-A289 WeakPolarHBondContact O-CB 3.38Å; L284-A289 PolarHBondContact O-N 3.06Å
285	L	86.7	Confident	83.7	Confident	24 Å²	24	46.8 Å²	46.8	13%	0.126	24%	0.242	C	C	.	.	H	α-helix	trans	-65.6	-39.6	177.9	-70.1	173.2	0	0	0	111.9	L265 I281 K282 N287 G288 P291 V317 L318	L265-L285 HydrophobicContact CD1-CG 4.41Å; L265-L285 HydrophobicContact CD2-CD2 3.92Å; I281-L285 HydrophobicContact CG2-CD1 3.7Å; I281-L285 HydrophobicContact CG2-CG 4.35Å; I281-L285 WeakPolarHBondContact O-CB 3.35Å; I281-L285 VanDerWaalsContact O-CG 3.29Å; I281-L285 WeakPolarHBondContact O-CG 3.34Å; I281-L285 PolarHBondContact O-N 3.31Å; K282-L285 PolarHBondContact O-N 3.42Å; L285-N287 PolarHBondContact O-N 2.97Å; L285-G288 PolarHBondContact O-N 3.19Å; L285-P291 HydrophobicContact CD2-CG 4.44Å; L285-V317 HydrophobicContact CB-CG1 4.38Å; L285-V317 HydrophobicContact CD1-CB 3.95Å; L285-V317 HydrophobicContact CD1-CG1 3.49Å; L285-V317 VanDerWaalsContact CD1-CG1 3.49Å; L285-L318 HydrophobicContact CD1-CD2 4.31Å; L285-L318 HydrophobicContact CD2-CD2 4.08Å
286	D	84.9	Confident	83.9	Confident	114 Å²	114	45.5 Å²	45.5	61%	0.61	24%	0.242	S	C	*	.	H	α-helix	trans	-63.3	-29.8	175.2	-72.3	-15.1	0	0	0	111.7	K282	K282-D286 VanDerWaalsContact O-CB 3.25Å; K282-D286 WeakPolarHBondContact O-CB 3.32Å; K282-D286 PolarHBondContact O-N 2.95Å
287	N	88	Confident	83.6	Confident	51 Å²	51	45.7 Å²	45.7	27%	0.273	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	10.8	173.7	-72.3	-79	0	0	0	113.7	I182 V251 A254 I283 L284 L285	I182-N287 HydrophobicContact CD1-CB 4.34Å; I182-N287 HydrophobicContact CG2-CB 4.29Å; V251-N287 WeakPolarHBondContact CA-O 3.48Å; A254-N287 HydrophobicContact CB-CB 4.14Å; I283-N287 WeakPolarHBondContact O-CB 3.41Å; I283-N287 PolarHBondContact O-N 3.01Å; I283-N287 PolarHBondContact O-ND2 3.26Å; L284-N287 CarbonylContact O-C 3.56Å; L284-N287 PolarHBondContact O-N 2.59Å; L285-N287 PolarHBondContact O-N 2.97Å
288	G	85	Confident	83.2	Confident	29 Å²	29	45.4 Å²	45.4	30%	0.299	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	25.7	173.4	0	0	0	0	0	115.9	N255 L284 L285 D290	N255-G288 PolarHBondContact ND2-O 3.03Å; L284-G288 PolarHBondContact O-N 3.29Å; L285-G288 PolarHBondContact O-N 3.19Å; G288-D290 PolarHBondContact O-N 3.48Å
289	A	87.7	Confident	82.7	Confident	2 Å²	2	45.4 Å²	45.4	2%	0.017	26%	0.26	C	S	.	.			trans	-58.1	131.3	166.9	0	0	0	0	0	110.5	A254 N255 L265 L284 P291	A254-A289 HydrophobicContact CB-CB 4.3Å; N255-A289 WeakPolarHBondContact OD1-CA 3.28Å; L265-A289 HydrophobicContact CB-CB 4.23Å; L265-A289 HydrophobicContact CD2-CB 4.06Å; L284-A289 HydrophobicContact CB-CB 3.78Å; L284-A289 WeakPolarHBondContact O-CB 3.38Å; L284-A289 PolarHBondContact O-N 3.06Å; A289-P291 WeakPolarHBondContact O-CD 3.29Å
290	D	82.1	Confident	82.4	Confident	30 Å²	30	43 Å²	43	16%	0.16	25%	0.247	C	C	.	.			trans	-90	110.3	-177.2	-175	3	0	0	0	110.7	Q197 F198 N255 G288 M292 L293	Q197-D290 PolarHBondContact NE2-OD2 3.1Å; F198-D290 HydrophobicContact CZ-CB 4.19Å; N255-D290 PolarHBondContact OD1-N 3.18Å; G288-D290 PolarHBondContact O-N 3.48Å; D290-M292 PolarHBondContact O-N 3.25Å; D290-M292 WeakPolarHBondContact OD1-CB 3.43Å; D290-M292 PolarHBondContact OD1-N 2.95Å; D290-L293 HydrophobicContact CB-CD1 3.97Å; D290-L293 HydrophobicContact CB-CG 4.01Å
291	P	82.6	Confident	82	Confident	1 Å²	1	43 Å²	43	1%	0.006	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-13.8	178.2	30.9	-38.5	0	0	0	113.8	L265 L285 A289 L318 L326	L265-P291 HydrophobicContact CD2-CB 3.96Å; L285-P291 HydrophobicContact CD2-CG 4.44Å; A289-P291 WeakPolarHBondContact O-CD 3.29Å; P291-L318 HydrophobicContact CB-CD2 3.73Å; P291-L318 HydrophobicContact CG-CD2 3.45Å; P291-L318 VanDerWaalsContact CG-CD2 3.45Å; P291-L326 HydrophobicContact CB-CD1 4.27Å
292	M	77.3	Confident	81.4	Confident	40 Å²	40	42.8 Å²	42.8	20%	0.197	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-15.5	-178.7	-59.3	-59.1	114.3	0	0	113.4	D290 P294 Q322 A325 L326	D290-M292 PolarHBondContact O-N 3.25Å; D290-M292 WeakPolarHBondContact OD1-CB 3.43Å; D290-M292 PolarHBondContact OD1-N 2.95Å; M292-P294 WeakPolarHBondContact O-CD 3.34Å; M292-Q322 HydrophobicContact CE-CB 4.22Å; M292-Q322 WeakPolarHBondContact CE-O 3.41Å; M292-A325 HydrophobicContact SD-CB 4.38Å; M292-L326 HydrophobicContact CE-CB 3.54Å; M292-L326 HydrophobicContact CE-CD1 3.25Å; M292-L326 HydrophobicContact CE-CG 3.21Å; M292-L326 HydrophobicContact SD-CB 3.99Å; M292-L326 HydrophobicContact SD-CD1 4.33Å; M292-L326 HydrophobicContact SD-CG 3.68Å
293	L	80.7	Confident	80.7	Confident	22 Å²	22	41.1 Å²	41.1	12%	0.115	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-60.4	122.5	-176.4	-78.1	171.2	0	0	0	109.9	P195 F198 N255 T263 H266 D290	P195-L293 HydrophobicContact CG-CD1 4.16Å; F198-L293 HydrophobicContact CE2-CD1 4.22Å; N255-L293 HydrophobicContact CB-CD1 4.34Å; T263-L293 HydrophobicContact CG2-CB 4.46Å; T263-L293 HydrophobicContact CG2-CD1 3.81Å; H266-L293 PolarHBondContact CE1-O 3.28Å; H266-L293 PolarHBondContact NE2-O 3.14Å; D290-L293 HydrophobicContact CB-CD1 3.97Å; D290-L293 HydrophobicContact CB-CG 4.01Å
294	P	78.5	Confident	80.1	Confident	80 Å²	80	40.1 Å²	40.1	52%	0.519	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-79.7	139.1	176	30.4	-31.8	0	0	0	110.1	M292	M292-P294 WeakPolarHBondContact O-CD 3.34Å
295	T	80.1	Confident	79.4	Confident	6 Å²	6	40.2 Å²	40.2	4%	0.037	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-61.3	167.6	161.5	56	0	0	0	0	110.8	W262 H266 Q297 G298 K299 L304	W262-T295 HydrophobicContact CD2-CG2 4.27Å; W262-T295 HydrophobicContact CG-CG2 4.11Å; H266-T295 HydrophobicContact CB-CG2 4.44Å; H266-T295 WeakPolarHBondContact ND1-CG2 3.44Å; T295-Q297 PolarHBondContact O-N 2.91Å; T295-G298 WeakPolarHBondContact O-CA 3.25Å; T295-G298 PolarHBondContact O-N 3.49Å; T295-K299 WeakPolarHBondContact CG2-O 3.23Å; T295-K299 PolarHBondContact N-O 2.94Å; T295-K299 WeakPolarHBondContact OG1-CB 2.93Å; T295-K299 PolarHBondContact OG1-N 3.14Å; T295-K299 VanDerWaalsContact OG1-N 3.09Å; T295-K299 PolarHBondContact OG1-O 2.94Å; T295-L304 HydrophobicContact CG2-CD1 4.34Å
296	S	75.4	Confident	78.5	Confident	90 Å²	90	43 Å²	43	63%	0.629	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-22	170.6	53.4	0	0	0	0	114.2	G298	S296-G298 VanDerWaalsContact C-N 3.33Å
297	Q	72.3	Confident	77.6	Confident	124 Å²	124	41.5 Å²	41.5	58%	0.579	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-0.8	173.9	-62	-175.8	-3.2	0	0	113.8	T295 K299	T295-Q297 PolarHBondContact O-N 2.91Å; Q297-K299 VanDerWaalsContact C-N 3.31Å; Q297-K299 HydrophobicContact CB-CD 4.44Å; Q297-K299 HydrophobicContact CB-CG 4.36Å
298	G	72.7	Confident	76.7	Confident	53 Å²	53	40 Å²	40	55%	0.546	25%	0.246	S	C	.	.	S	Bend	trans	77.2	10.4	-174.6	0	0	0	0	0	114.7	T295 S296	T295-G298 WeakPolarHBondContact O-CA 3.25Å; T295-G298 PolarHBondContact O-N 3.49Å; S296-G298 VanDerWaalsContact C-N 3.33Å
299	K	73.1	Confident	75.7	Confident	87 Å²	87	41.5 Å²	41.5	38%	0.378	26%	0.261	S	S	.	.			trans	-89.3	135.4	178.6	-62.8	173.8	179.9	162.5	0	110.5	T295 Q297 D303 L304	T295-K299 WeakPolarHBondContact CG2-O 3.23Å; T295-K299 PolarHBondContact N-O 2.94Å; T295-K299 WeakPolarHBondContact OG1-CB 2.93Å; T295-K299 PolarHBondContact OG1-N 3.14Å; T295-K299 VanDerWaalsContact OG1-N 3.09Å; T295-K299 PolarHBondContact OG1-O 2.94Å; Q297-K299 VanDerWaalsContact C-N 3.31Å; Q297-K299 HydrophobicContact CB-CD 4.44Å; Q297-K299 HydrophobicContact CB-CG 4.36Å; K299-D303 HydrophobicContact CB-CB 4.12Å; K299-L304 HydrophobicContact CD-CD2 4.12Å
300	T	80.1	Confident	74.6	Confident	12 Å²	12	43.8 Å²	43.8	7%	0.074	27%	0.269	C	S	.	.			trans	-84.5	169.8	171.9	62.9	0	0	0	0	111.5	L302 D303 L304	T300-L302 PolarHBondContact O-N 2.93Å; T300-D303 PolarHBondContact N-OD2 3.27Å; T300-D303 WeakPolarHBondContact O-CB 3.35Å; T300-D303 PolarHBondContact O-N 3.02Å; T300-D303 VanDerWaalsContact O-N 3.1Å; T300-D303 PolarHBondContact OG1-N 3.14Å; T300-D303 PolarHBondContact OG1-OD2 3.36Å; T300-L304 PolarHBondContact O-N 3.25Å
301	A	81.3	Confident	73.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-57.1	-35.2	172.6	0	0	0	0	0	112.9	L265 H266 S269 L304 A305 L314	L265-A301 HydrophobicContact CD2-CB 4.21Å; L265-A301 HydrophobicContact CG-CB 4.01Å; H266-A301 PolarHBondContact CD2-N 2.77Å; H266-A301 PolarHBondContact NE2-N 3.11Å; S269-A301 WeakPolarHBondContact CB-O 3.19Å; A301-L304 PolarHBondContact O-N 2.86Å; A301-A305 WeakPolarHBondContact O-CB 3.36Å; A301-A305 PolarHBondContact O-N 2.87Å; A301-L314 HydrophobicContact CB-CD1 4.33Å
302	L	75.7	Confident	72.9	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-67.2	-36.7	177.1	-169.2	71.2	0	0	0	111.9	T300 L304 A305 Y306 L314 V315 L326 I330	T300-L302 PolarHBondContact O-N 2.93Å; L302-L304 VanDerWaalsContact C-N 3.34Å; L302-A305 PolarHBondContact O-N 3.07Å; L302-Y306 HydrophobicContact CD1-CD2 4.38Å; L302-Y306 HydrophobicContact CD1-CE2 4.09Å; L302-Y306 HydrophobicContact CD2-CD2 4.31Å; L302-Y306 HydrophobicContact CD2-CE2 3.76Å; L302-Y306 HydrophobicContact CG-CD2 3.79Å; L302-Y306 HydrophobicContact CG-CE2 3.66Å; L302-Y306 WeakPolarHBondContact O-CB 3.31Å; L302-Y306 VanDerWaalsContact O-CD2 3.22Å; L302-Y306 WeakPolarHBondContact O-CD2 3.46Å; L302-Y306 PolarHBondContact O-N 3.16Å; L302-L314 HydrophobicContact CB-CD2 4.25Å; L302-L314 HydrophobicContact CD1-CB 4.37Å; L302-L314 HydrophobicContact CD1-CD2 3.64Å; L302-V315 HydrophobicContact CD1-CG2 4.13Å; L302-L326 HydrophobicContact CB-CD1 3.74Å; L302-L326 HydrophobicContact CB-CD2 3.66Å; L302-L326 HydrophobicContact CB-CG 4.37Å; L302-L326 HydrophobicContact CD2-CD1 4.13Å; L302-L326 HydrophobicContact CD2-CD2 3.6Å; L302-L326 HydrophobicContact CD2-CG 4.3Å; L302-L326 HydrophobicContact CG-CD1 4.44Å; L302-L326 HydrophobicContact CG-CD2 4.26Å; L302-I330 HydrophobicContact CD2-CD1 3.71Å
303	D	71.6	Confident	72.3	Confident	61 Å²	61	49.7 Å²	49.7	33%	0.326	30%	0.298	S	S	.	.	H	α-helix	trans	-65.6	-39.1	177.6	-62.6	-48.2	0	0	0	111.7	K299 T300 Y306 A307	K299-D303 HydrophobicContact CB-CB 4.12Å; T300-D303 PolarHBondContact N-OD2 3.27Å; T300-D303 WeakPolarHBondContact O-CB 3.35Å; T300-D303 PolarHBondContact O-N 3.02Å; T300-D303 VanDerWaalsContact O-N 3.1Å; T300-D303 PolarHBondContact OG1-N 3.14Å; T300-D303 PolarHBondContact OG1-OD2 3.36Å; D303-Y306 PolarHBondContact O-N 3.25Å; D303-A307 PolarHBondContact O-N 2.96Å
304	L	76.4	Confident	71.6	Confident	15 Å²	15	48.7 Å²	48.7	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-66.2	-45.1	174.3	-63.6	175.8	0	0	0	111.1	H266 S269 T295 K299 T300 A301 L302 Y306 A307 A308	H266-L304 HydrophobicContact CB-CD1 3.71Å; S269-L304 CarbonylContact O-C 3.45Å; S269-L304 VanDerWaalsContact O-C 3.29Å; T295-L304 HydrophobicContact CG2-CD1 4.34Å; K299-L304 HydrophobicContact CD-CD2 4.12Å; T300-L304 PolarHBondContact O-N 3.25Å; A301-L304 PolarHBondContact O-N 2.86Å; L302-L304 VanDerWaalsContact C-N 3.34Å; L304-Y306 VanDerWaalsContact C-N 3.27Å; L304-Y306 PolarHBondContact O-N 2.96Å; L304-A307 PolarHBondContact O-N 2.93Å; L304-A307 VanDerWaalsContact O-N 3.14Å; L304-A308 WeakPolarHBondContact O-CB 3.48Å; L304-A308 PolarHBondContact O-N 2.56Å
305	A	76	Confident	70.9	Confident	2 Å²	2	47.1 Å²	47.1	2%	0.017	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-35.3	175.1	0	0	0	0	0	112.1	S269 A301 L302 G309 R310 S311 L314	S269-A305 VanDerWaalsContact O-CA 3.29Å; S269-A305 WeakPolarHBondContact O-CA 3.44Å; S269-A305 PolarHBondContact O-N 3.07Å; A301-A305 WeakPolarHBondContact O-CB 3.36Å; A301-A305 PolarHBondContact O-N 2.87Å; L302-A305 PolarHBondContact O-N 3.07Å; A305-G309 PolarHBondContact O-N 3.28Å; A305-R310 CarbonylContact O-C 3.57Å; A305-R310 WeakPolarHBondContact O-CA 3.38Å; A305-R310 PolarHBondContact O-N 3.46Å; A305-S311 PolarHBondContact O-N 3.07Å; A305-L314 HydrophobicContact CB-CB 4.32Å; A305-L314 HydrophobicContact CB-CD1 4.24Å
306	Y	67.2	Low	70.2	Confident	82 Å²	82	52.8 Å²	52.8	32%	0.322	31%	0.312	S	S	.	.	H	α-helix	trans	-67.4	-43.6	172.7	-92	-64.3	0	0	0	112.5	L302 D303 L304 A308 G309 S311 R392	L302-Y306 HydrophobicContact CD1-CD2 4.38Å; L302-Y306 HydrophobicContact CD1-CE2 4.09Å; L302-Y306 HydrophobicContact CD2-CD2 4.31Å; L302-Y306 HydrophobicContact CD2-CE2 3.76Å; L302-Y306 HydrophobicContact CG-CD2 3.79Å; L302-Y306 HydrophobicContact CG-CE2 3.66Å; L302-Y306 WeakPolarHBondContact O-CB 3.31Å; L302-Y306 VanDerWaalsContact O-CD2 3.22Å; L302-Y306 WeakPolarHBondContact O-CD2 3.46Å; L302-Y306 PolarHBondContact O-N 3.16Å; D303-Y306 PolarHBondContact O-N 3.25Å; L304-Y306 VanDerWaalsContact C-N 3.27Å; L304-Y306 PolarHBondContact O-N 2.96Å; Y306-A308 VanDerWaalsContact C-N 3.27Å; Y306-A308 PolarHBondContact O-N 2.91Å; Y306-G309 PolarHBondContact O-N 3.11Å; Y306-G309 VanDerWaalsContact O-N 3.17Å; Y306-S311 WeakPolarHBondContact CD1-OG 3.4Å; Y306-S311 WeakPolarHBondContact CE1-OG 3.43Å; Y306-R392 PolarHBondContact OH-NH1 3.43Å
307	A	65.3	Low	69.9	Low	83 Å²	83	50 Å²	50	69%	0.686	29%	0.291	S	S	*	.	H	α-helix	trans	-62.1	-37.7	177.3	0	0	0	0	0	111.7	D303 L304 G309	D303-A307 PolarHBondContact O-N 2.96Å; L304-A307 PolarHBondContact O-N 2.93Å; L304-A307 VanDerWaalsContact O-N 3.14Å; A307-G309 VanDerWaalsContact C-N 3.29Å; A307-G309 PolarHBondContact O-N 2.91Å
308	A	69	Low	69.7	Low	20 Å²	20	44.6 Å²	44.6	17%	0.165	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-4	177.1	0	0	0	0	0	114.5	E271 L304 Y306 R310	E271-A308 HydrophobicContact CB-CB 4.13Å; L304-A308 WeakPolarHBondContact O-CB 3.48Å; L304-A308 PolarHBondContact O-N 2.56Å; Y306-A308 VanDerWaalsContact C-N 3.27Å; Y306-A308 PolarHBondContact O-N 2.91Å; A308-R310 VanDerWaalsContact C-N 3.33Å; A308-R310 HydrophobicContact CB-CG 4.2Å; A308-R310 PolarHBondContact O-N 3.1Å
309	G	64.4	Low	69.3	Low	60 Å²	60	45.4 Å²	45.4	62%	0.619	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	14.2	-176.6	0	0	0	0	0	115.2	A305 Y306 A307	A305-G309 PolarHBondContact O-N 3.28Å; Y306-G309 PolarHBondContact O-N 3.11Å; Y306-G309 VanDerWaalsContact O-N 3.17Å; A307-G309 VanDerWaalsContact C-N 3.29Å; A307-G309 PolarHBondContact O-N 2.91Å
310	R	64.4	Low	68.5	Low	51 Å²	51	49.5 Å²	49.5	19%	0.192	28%	0.279	C	S	.	.			trans	-109.2	10.7	-171	-59.4	169.9	-163.9	-177	2.1	114	C270 E271 A273 Y277 A305 A308 Q312 M313	C270-R310 PolarHBondContact O-NH1 3.24Å; E271-R310 PolarHBondContact O-NH2 2.75Å; A273-R310 PolarHBondContact O-NH1 2.96Å; A273-R310 PolarHBondContact O-NH2 3.47Å; Y277-R310 HydrophobicContact CE2-CG 4.46Å; A305-R310 CarbonylContact O-C 3.57Å; A305-R310 WeakPolarHBondContact O-CA 3.38Å; A305-R310 PolarHBondContact O-N 3.46Å; A308-R310 VanDerWaalsContact C-N 3.33Å; A308-R310 HydrophobicContact CB-CG 4.2Å; A308-R310 PolarHBondContact O-N 3.1Å; R310-Q312 VanDerWaalsContact C-N 3.3Å; R310-Q312 PolarHBondContact O-N 2.73Å; R310-Q312 VanDerWaalsContact O-N 3.16Å; R310-M313 WeakPolarHBondContact O-CB 3.33Å; R310-M313 PolarHBondContact O-N 2.93Å
311	S	64.5	Low	67.4	Low	21 Å²	21	57.6 Å²	57.6	15%	0.147	31%	0.314	C	S	.	.	H	α-helix	trans	-53.5	-36.6	-172.9	59.5	0	0	0	0	115.6	A305 Y306 M313 L314 V315	A305-S311 PolarHBondContact O-N 3.07Å; Y306-S311 WeakPolarHBondContact CD1-OG 3.4Å; Y306-S311 WeakPolarHBondContact CE1-OG 3.43Å; S311-M313 PolarHBondContact O-N 3.35Å; S311-L314 PolarHBondContact O-N 3.18Å; S311-V315 VanDerWaalsContact O-CG2 3.29Å; S311-V315 WeakPolarHBondContact O-CG2 3.06Å; S311-V315 PolarHBondContact O-N 3.23Å
312	Q	64.2	Low	66.4	Low	113 Å²	113	60.8 Å²	60.8	53%	0.528	33%	0.328	S	S	.	.	H	α-helix	trans	-58.3	-38.7	178.7	-76.9	178.8	-6.7	0	0	111.8	R310 L314 V315 D316	R310-Q312 VanDerWaalsContact C-N 3.3Å; R310-Q312 PolarHBondContact O-N 2.73Å; R310-Q312 VanDerWaalsContact O-N 3.16Å; Q312-L314 VanDerWaalsContact C-N 3.34Å; Q312-L314 PolarHBondContact O-N 2.76Å; Q312-V315 PolarHBondContact O-N 3.17Å; Q312-D316 VanDerWaalsContact O-CG 3.27Å; Q312-D316 PolarHBondContact O-N 3.43Å
313	M	65	Low	65.5	Low	61 Å²	61	62.1 Å²	62.1	30%	0.3	34%	0.336	S	S	.	.	H	α-helix	trans	-64.7	-38.8	-177.8	-57.7	-59	-80.3	0	0	112.2	Y277 Y278 R310 S311 V317	Y277-M313 HydrophobicContact CE2-CG 4.48Å; Y278-M313 HydrophobicContact CD2-CB 4.32Å; Y278-M313 HydrophobicContact CD2-CE 3.25Å; Y278-M313 HydrophobicContact CD2-SD 4.47Å; Y278-M313 HydrophobicContact CE2-CE 3.87Å; Y278-M313 HydrophobicContact CG-CE 3.7Å; R310-M313 WeakPolarHBondContact O-CB 3.33Å; R310-M313 PolarHBondContact O-N 2.93Å; S311-M313 PolarHBondContact O-N 3.35Å; M313-V317 WeakPolarHBondContact O-CG2 3.46Å
314	L	65.4	Low	64.5	Low	1 Å²	1	64 Å²	64	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-76.5	-35	178.1	-158.2	136.4	0	0	0	111	S269 A301 L302 A305 S311 Q312 D316 V317 L318	S269-L314 VanDerWaalsContact OG-CD1 3.28Å; S269-L314 WeakPolarHBondContact OG-CD1 3.39Å; A301-L314 HydrophobicContact CB-CD1 4.33Å; L302-L314 HydrophobicContact CB-CD2 4.25Å; L302-L314 HydrophobicContact CD1-CB 4.37Å; L302-L314 HydrophobicContact CD1-CD2 3.64Å; A305-L314 HydrophobicContact CB-CB 4.32Å; A305-L314 HydrophobicContact CB-CD1 4.24Å; S311-L314 PolarHBondContact O-N 3.18Å; Q312-L314 VanDerWaalsContact C-N 3.34Å; Q312-L314 PolarHBondContact O-N 2.76Å; L314-D316 VanDerWaalsContact C-N 3.33Å; L314-D316 PolarHBondContact O-N 3.49Å; L314-V317 PolarHBondContact O-N 3.34Å; L314-L318 HydrophobicContact CD2-CD1 3.35Å; L314-L318 HydrophobicContact CD2-CD2 4.38Å; L314-L318 HydrophobicContact CD2-CG 3.77Å; L314-L318 HydrophobicContact CG-CD1 4.47Å; L314-L318 HydrophobicContact CG-CG 4.46Å; L314-L318 WeakPolarHBondContact O-CB 3.25Å; L314-L318 WeakPolarHBondContact O-CG 3.37Å; L314-L318 PolarHBondContact O-N 2.94Å
315	V	64.7	Low	63.3	Low	47 Å²	47	65 Å²	65	29%	0.285	36%	0.355	S	S	.	.	H	α-helix	trans	-64	-36.9	174.6	172.7	0	0	0	0	112.1	L302 S311 Q312 V317 L323	L302-V315 HydrophobicContact CD1-CG2 4.13Å; S311-V315 VanDerWaalsContact O-CG2 3.29Å; S311-V315 WeakPolarHBondContact O-CG2 3.06Å; S311-V315 PolarHBondContact O-N 3.23Å; Q312-V315 PolarHBondContact O-N 3.17Å; V315-V317 VanDerWaalsContact C-N 3.34Å; V315-L323 HydrophobicContact CG1-CD1 4.22Å; V315-L323 HydrophobicContact CG1-CD2 4.11Å; V315-L323 HydrophobicContact CG2-CD1 4.16Å
316	D	64.6	Low	62.2	Low	125 Å²	125	65 Å²	65	67%	0.668	36%	0.355	S	S	*	.	H	α-helix	trans	-71.5	-28.3	-179.3	-73.4	-14.2	0	0	0	113.2	Q312 L314	Q312-D316 VanDerWaalsContact O-CG 3.27Å; Q312-D316 PolarHBondContact O-N 3.43Å; L314-D316 VanDerWaalsContact C-N 3.33Å; L314-D316 PolarHBondContact O-N 3.49Å
317	V	69.4	Low	61.4	Low	30 Å²	30	63.8 Å²	63.8	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-93.9	-27	-178.2	-173.3	0	0	0	0	112.1	Y278 K282 L285 M313 L314 V315	Y278-V317 HydrophobicContact CD2-CG2 4.27Å; Y278-V317 HydrophobicContact CE2-CG2 3.48Å; Y278-V317 VanDerWaalsContact CE2-CG2 3.48Å; K282-V317 HydrophobicContact CB-CG1 4.36Å; K282-V317 HydrophobicContact CG-CG1 4.38Å; L285-V317 HydrophobicContact CB-CG1 4.38Å; L285-V317 HydrophobicContact CD1-CB 3.95Å; L285-V317 HydrophobicContact CD1-CG1 3.49Å; L285-V317 VanDerWaalsContact CD1-CG1 3.49Å; M313-V317 WeakPolarHBondContact O-CG2 3.46Å; L314-V317 PolarHBondContact O-N 3.34Å; V315-V317 VanDerWaalsContact C-N 3.34Å
318	L	68.5	Low	60.4	Low	12 Å²	12	65.2 Å²	65.2	6%	0.063	35%	0.347	C	S	.	.	S	Bend	trans	-65.4	134.5	-176.5	-83.7	177.7	0	0	0	113.6	L285 P291 L314 K320 L323 L326	L285-L318 HydrophobicContact CD1-CD2 4.31Å; L285-L318 HydrophobicContact CD2-CD2 4.08Å; P291-L318 HydrophobicContact CB-CD2 3.73Å; P291-L318 HydrophobicContact CG-CD2 3.45Å; P291-L318 VanDerWaalsContact CG-CD2 3.45Å; L314-L318 HydrophobicContact CD2-CD1 3.35Å; L314-L318 HydrophobicContact CD2-CD2 4.38Å; L314-L318 HydrophobicContact CD2-CG 3.77Å; L314-L318 HydrophobicContact CG-CD1 4.47Å; L314-L318 HydrophobicContact CG-CG 4.46Å; L314-L318 WeakPolarHBondContact O-CB 3.25Å; L314-L318 WeakPolarHBondContact O-CG 3.37Å; L314-L318 PolarHBondContact O-N 2.94Å; L318-K320 PolarHBondContact O-N 3.44Å; L318-L323 HydrophobicContact CB-CB 4.29Å; L318-L323 HydrophobicContact CD1-CD1 4.08Å; L318-L326 HydrophobicContact CD1-CD1 3.87Å
319	P	63.8	Low	59.1	Low	70 Å²	70	69.8 Å²	69.8	46%	0.455	37%	0.369	S	S	.	.			trans	-58.4	133.7	169.2	-20.6	30.1	0	0	0	111.6	K321 Q322 L323	P319-K321 PolarHBondContact O-N 3.05Å; P319-Q322 PolarHBondContact O-N 3.31Å; P319-L323 PolarHBondContact O-N 3.23Å
320	K	57.6	Low	58.2	Low	173 Å²	173	67.9 Å²	67.9	75%	0.752	34%	0.344	S	S	*	.	H	α-helix	trans	-47.8	-38.5	-176.6	-80.2	-176	178.7	177.6	0	114.4	L318 L323 I324	L318-K320 PolarHBondContact O-N 3.44Å; K320-L323 PolarHBondContact O-N 2.92Å; K320-I324 WeakPolarHBondContact O-CB 3.34Å; K320-I324 WeakPolarHBondContact O-CD1 3.48Å; K320-I324 WeakPolarHBondContact O-CG1 3.19Å; K320-I324 PolarHBondContact O-N 3.14Å
321	K	55.9	Low	56.8	Low	182 Å²	182	70 Å²	70	79%	0.791	36%	0.359	S	S	*	.	H	α-helix	trans	-65.3	-47	179	-73.8	-174.9	178.1	-179.7	0	112.3	P319 I324 A325	P319-K321 PolarHBondContact O-N 3.05Å; K321-I324 PolarHBondContact O-N 3.5Å; K321-A325 PolarHBondContact O-N 2.87Å
322	Q	60.7	Low	55.5	Low	66 Å²	66	72.1 Å²	72.1	31%	0.308	37%	0.369	S	S	.	.	H	α-helix	trans	-67.1	-39.7	175.9	-74.9	178.1	-17	0	0	110.8	M292 P319 I324 A325 L326	M292-Q322 HydrophobicContact CE-CB 4.22Å; M292-Q322 WeakPolarHBondContact CE-O 3.41Å; P319-Q322 PolarHBondContact O-N 3.31Å; Q322-I324 VanDerWaalsContact C-N 3.33Å; Q322-I324 PolarHBondContact O-N 2.92Å; Q322-A325 PolarHBondContact O-N 3.41Å; Q322-L326 WeakPolarHBondContact O-CB 3.23Å; Q322-L326 PolarHBondContact O-N 3.01Å
323	L	56.5	Low	54.2	Low	30 Å²	30	68.3 Å²	68.3	16%	0.157	35%	0.352	C	S	.	.	H	α-helix	trans	-59.3	-43.5	173.9	-177.2	66.5	0	0	0	111.5	V315 L318 P319 K320 L326 L327	V315-L323 HydrophobicContact CG1-CD1 4.22Å; V315-L323 HydrophobicContact CG1-CD2 4.11Å; V315-L323 HydrophobicContact CG2-CD1 4.16Å; L318-L323 HydrophobicContact CB-CB 4.29Å; L318-L323 HydrophobicContact CD1-CD1 4.08Å; P319-L323 PolarHBondContact O-N 3.23Å; K320-L323 PolarHBondContact O-N 2.92Å; L323-L326 PolarHBondContact O-N 3.3Å; L323-L327 HydrophobicContact CD1-CD1 4.33Å; L323-L327 HydrophobicContact CD1-CG 4.45Å; L323-L327 HydrophobicContact CG-CD1 3.89Å; L323-L327 HydrophobicContact CG-CG 4.44Å; L323-L327 VanDerWaalsContact O-CB 3.26Å; L323-L327 WeakPolarHBondContact O-CB 3.35Å; L323-L327 WeakPolarHBondContact O-CD1 3.17Å; L323-L327 WeakPolarHBondContact O-CG 3.38Å; L323-L327 PolarHBondContact O-N 2.8Å
324	I	51.6	Low	52.6	Low	99 Å²	99	67.3 Å²	67.3	51%	0.508	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-45.9	174.9	-69.4	161.7	0	0	0	110.3	K320 K321 Q322 L326 L327 M328	K320-I324 WeakPolarHBondContact O-CB 3.34Å; K320-I324 WeakPolarHBondContact O-CD1 3.48Å; K320-I324 WeakPolarHBondContact O-CG1 3.19Å; K320-I324 PolarHBondContact O-N 3.14Å; K321-I324 PolarHBondContact O-N 3.5Å; Q322-I324 VanDerWaalsContact C-N 3.33Å; Q322-I324 PolarHBondContact O-N 2.92Å; I324-L326 PolarHBondContact O-N 3.33Å; I324-L327 CarbonylContact O-C 3.59Å; I324-L327 PolarHBondContact O-N 3.39Å; I324-M328 HydrophobicContact CG2-CG 4.41Å; I324-M328 VanDerWaalsContact O-CG 3.29Å; I324-M328 WeakPolarHBondContact O-CG 3.28Å; I324-M328 PolarHBondContact O-N 3.18Å
325	A	50.9	Low	51.2	Low	37 Å²	37	71.2 Å²	71.2	31%	0.306	37%	0.374	S	S	.	.	H	α-helix	trans	-60.4	-45.1	177.1	0	0	0	0	0	112.1	M292 K321 Q322 L327 M328 L329	M292-A325 HydrophobicContact SD-CB 4.38Å; K321-A325 PolarHBondContact O-N 2.87Å; Q322-A325 PolarHBondContact O-N 3.41Å; A325-L327 PolarHBondContact O-N 3.22Å; A325-M328 WeakPolarHBondContact O-CB 3.27Å; A325-M328 PolarHBondContact O-N 3.14Å; A325-L329 PolarHBondContact O-N 3.48Å
326	L	53.2	Low	49.7	Very low	2 Å²	2	75.2 Å²	75.2	1%	0.01	39%	0.393	C	S	.	.	H	α-helix	trans	-59.7	-46.8	173.7	-126.3	164.9	0	0	0	110.7	P291 M292 L302 L318 Q322 L323 I324 M328 L329 I330	P291-L326 HydrophobicContact CB-CD1 4.27Å; M292-L326 HydrophobicContact CE-CB 3.54Å; M292-L326 HydrophobicContact CE-CD1 3.25Å; M292-L326 HydrophobicContact CE-CG 3.21Å; M292-L326 HydrophobicContact SD-CB 3.99Å; M292-L326 HydrophobicContact SD-CD1 4.33Å; M292-L326 HydrophobicContact SD-CG 3.68Å; L302-L326 HydrophobicContact CB-CD1 3.74Å; L302-L326 HydrophobicContact CB-CD2 3.66Å; L302-L326 HydrophobicContact CB-CG 4.37Å; L302-L326 HydrophobicContact CD2-CD1 4.13Å; L302-L326 HydrophobicContact CD2-CD2 3.6Å; L302-L326 HydrophobicContact CD2-CG 4.3Å; L302-L326 HydrophobicContact CG-CD1 4.44Å; L302-L326 HydrophobicContact CG-CD2 4.26Å; L318-L326 HydrophobicContact CD1-CD1 3.87Å; Q322-L326 WeakPolarHBondContact O-CB 3.23Å; Q322-L326 PolarHBondContact O-N 3.01Å; L323-L326 PolarHBondContact O-N 3.3Å; I324-L326 PolarHBondContact O-N 3.33Å; L326-M328 PolarHBondContact O-N 3.43Å; L326-L329 CarbonylContact O-C 3.53Å; L326-L329 PolarHBondContact O-N 2.85Å; L326-L329 VanDerWaalsContact O-N 3.11Å; L326-I330 HydrophobicContact CD2-CG1 4.36Å; L326-I330 VanDerWaalsContact O-CG1 3.25Å; L326-I330 WeakPolarHBondContact O-CG1 3.17Å; L326-I330 PolarHBondContact O-N 3.34Å
327	L	49.9	Very low	48.6	Very low	56 Å²	56	77.6 Å²	77.6	29%	0.293	40%	0.398	S	S	.	.	H	α-helix	trans	-62.1	-28.4	175.4	-72.3	165.3	0	0	0	112	L323 I324 A325 I330 I333	L323-L327 HydrophobicContact CD1-CD1 4.33Å; L323-L327 HydrophobicContact CD1-CG 4.45Å; L323-L327 HydrophobicContact CG-CD1 3.89Å; L323-L327 HydrophobicContact CG-CG 4.44Å; L323-L327 VanDerWaalsContact O-CB 3.26Å; L323-L327 WeakPolarHBondContact O-CB 3.35Å; L323-L327 WeakPolarHBondContact O-CD1 3.17Å; L323-L327 WeakPolarHBondContact O-CG 3.38Å; L323-L327 PolarHBondContact O-N 2.8Å; I324-L327 CarbonylContact O-C 3.59Å; I324-L327 PolarHBondContact O-N 3.39Å; A325-L327 PolarHBondContact O-N 3.22Å; L327-I330 HydrophobicContact CD2-CD1 4.13Å; L327-I333 HydrophobicContact CB-CD1 3.95Å; L327-I333 HydrophobicContact CD2-CD1 3.54Å; L327-I333 HydrophobicContact CG-CD1 4.36Å; L327-I333 VanDerWaalsContact O-CB 3.3Å; L327-I333 WeakPolarHBondContact O-CB 3.15Å; L327-I333 WeakPolarHBondContact O-CD1 3.4Å
328	M	43.8	Very low	47.2	Very low	114 Å²	114	79.5 Å²	79.5	56%	0.562	41%	0.409	S	S	*	.	H	α-helix	trans	-77.4	-31.9	173.7	-68.5	-157.6	-46.4	0	0	112.9	I324 A325 L326	I324-M328 HydrophobicContact CG2-CG 4.41Å; I324-M328 VanDerWaalsContact O-CG 3.29Å; I324-M328 WeakPolarHBondContact O-CG 3.28Å; I324-M328 PolarHBondContact O-N 3.18Å; A325-M328 WeakPolarHBondContact O-CB 3.27Å; A325-M328 PolarHBondContact O-N 3.14Å; L326-M328 PolarHBondContact O-N 3.43Å
329	L	43.1	Very low	45.5	Very low	116 Å²	116	82.8 Å²	82.8	61%	0.607	42%	0.421	S	S	*	.	H	α-helix	trans	-83.5	-23.8	-179.2	-132.5	142.5	0	0	0	112.6	A325 L326 D331	A325-L329 PolarHBondContact O-N 3.48Å; L326-L329 CarbonylContact O-C 3.53Å; L326-L329 PolarHBondContact O-N 2.85Å; L326-L329 VanDerWaalsContact O-N 3.11Å; L329-D331 PolarHBondContact O-N 2.94Å
330	I	43.9	Very low	44.5	Very low	19 Å²	19	85.9 Å²	85.9	10%	0.097	43%	0.427	C	S	.	.	S	Bend	trans	-58.5	108.3	161.7	-67.2	164.3	0	0	0	106.2	L302 L326 L327 D332 I333	L302-I330 HydrophobicContact CD2-CD1 3.71Å; L326-I330 HydrophobicContact CD2-CG1 4.36Å; L326-I330 VanDerWaalsContact O-CG1 3.25Å; L326-I330 WeakPolarHBondContact O-CG1 3.17Å; L326-I330 PolarHBondContact O-N 3.34Å; L327-I330 HydrophobicContact CD2-CD1 4.13Å; I330-D332 PolarHBondContact O-N 2.93Å; I330-I333 HydrophobicContact CB-CD1 4.11Å; I330-I333 HydrophobicContact CD1-CD1 4.29Å; I330-I333 HydrophobicContact CG2-CD1 4.07Å; I330-I333 HydrophobicContact CG2-CG1 4.24Å; I330-I333 PolarHBondContact O-N 3.18Å
331	D	35.8	Very low	43.7	Very low	95 Å²	95	86.6 Å²	86.6	51%	0.508	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	1.9	-158.8	-117.4	-26.1	0	0	0	115.4	L329 R339	L329-D331 PolarHBondContact O-N 2.94Å; D331-R339 PolarHBondContact O-NH1 3.33Å; D331-R339 PolarHBondContact O-NH2 3.45Å; D331-R339 IonicContact OD1-CZ 3.64Å; D331-R339 IonicContact OD1-NH1 2.76Å; D331-R339 PolarHBondContact OD1-NH1 3.46Å; D331-R339 IonicContact OD1-NH2 3.73Å
332	D	37.7	Very low	43	Very low	67 Å²	67	82.2 Å²	82.2	36%	0.358	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	0.3	-170.9	-67	-33.4	0	0	0	115.4	I330 D396	I330-D332 PolarHBondContact O-N 2.93Å; D332-D396 WeakPolarHBondContact CB-OD2 3.39Å
333	I	36.4	Very low	42.2	Very low	33 Å²	33	81.4 Å²	81.4	17%	0.169	41%	0.412	C	S	.	.	S	Bend	trans	-87.3	-28.2	-172.3	-68.9	177.1	0	0	0	114.7	L327 I330	L327-I333 HydrophobicContact CB-CD1 3.95Å; L327-I333 HydrophobicContact CD2-CD1 3.54Å; L327-I333 HydrophobicContact CG-CD1 4.36Å; L327-I333 VanDerWaalsContact O-CB 3.3Å; L327-I333 WeakPolarHBondContact O-CB 3.15Å; L327-I333 WeakPolarHBondContact O-CD1 3.4Å; I330-I333 HydrophobicContact CB-CD1 4.11Å; I330-I333 HydrophobicContact CD1-CD1 4.29Å; I330-I333 HydrophobicContact CG2-CD1 4.07Å; I330-I333 HydrophobicContact CG2-CG1 4.24Å; I330-I333 PolarHBondContact O-N 3.18Å
334	V	31.7	Very low	41.7	Very low	39 Å²	39	86.4 Å²	86.4	24%	0.236	43%	0.434	C	S	.	.	S	Bend	trans	-110.4	114.7	-174.9	-179.4	0	0	0	0	109.9	L336 V338 R339	V334-L336 PolarHBondContact O-N 3.11Å; V334-V338 HydrophobicContact CG1-CB 3.62Å; V334-V338 HydrophobicContact CG1-CG1 3.73Å; V334-R339 HydrophobicContact CB-CG 4.37Å; V334-R339 HydrophobicContact CG1-CG 4.07Å
335	P	35.5	Very low	41.3	Very low	83 Å²	83	87 Å²	87	54%	0.539	44%	0.435	S	S	.	.			trans	-52.9	135.1	178.7	-26.1	33.4	0	0	0	111.7	K337 V338	P335-K337 PolarHBondContact O-N 2.92Å; P335-V338 PolarHBondContact O-N 3.46Å
336	L	33.4	Very low	41	Very low	131 Å²	131	90.8 Å²	90.8	69%	0.686	45%	0.446	S	S	*	.	H	α-helix	trans	-43.1	-31.8	-177.3	-104.5	154.7	0	0	0	115	V334 V338 K340	V334-L336 PolarHBondContact O-N 3.11Å; L336-V338 VanDerWaalsContact C-N 3.34Å; L336-V338 PolarHBondContact O-N 2.7Å; L336-K340 WeakPolarHBondContact O-CB 3.28Å; L336-K340 WeakPolarHBondContact O-CG 3.14Å; L336-K340 PolarHBondContact O-N 3.06Å
337	K	41.3	Very low	40.5	Very low	176 Å²	176	96.6 Å²	96.6	77%	0.765	47%	0.471	S	S	*	.	H	α-helix	trans	-62.6	-36.4	176.5	-75.9	-177.8	177.2	176.5	0	113.3	P335 R341	P335-K337 PolarHBondContact O-N 2.92Å; K337-R341 PolarHBondContact O-N 3.38Å; K337-R341 VanDerWaalsContact O-N 3.09Å
338	V	39.8	Very low	39.9	Very low	69 Å²	69	99.7 Å²	99.7	42%	0.418	49%	0.487	S	S	.	.	H	α-helix	trans	-77.4	-40.3	-179.9	179.2	0	0	0	0	110.5	V334 P335 L336 K340 R341 L342	V334-V338 HydrophobicContact CG1-CB 3.62Å; V334-V338 HydrophobicContact CG1-CG1 3.73Å; P335-V338 PolarHBondContact O-N 3.46Å; L336-V338 VanDerWaalsContact C-N 3.34Å; L336-V338 PolarHBondContact O-N 2.7Å; V338-K340 PolarHBondContact O-N 3.14Å; V338-R341 PolarHBondContact O-N 3.05Å; V338-L342 HydrophobicContact CG1-CD1 4.19Å; V338-L342 PolarHBondContact O-N 2.86Å
339	R	33.4	Very low	39.7	Very low	81 Å²	81	101.6 Å²	101.6	31%	0.306	49%	0.493	S	S	.	.	H	α-helix	trans	-62.3	-40.6	172.3	-71.9	-171.4	-166.2	170	8.4	112.4	D331 V334 S343	D331-R339 PolarHBondContact O-NH1 3.33Å; D331-R339 PolarHBondContact O-NH2 3.45Å; D331-R339 IonicContact OD1-CZ 3.64Å; D331-R339 IonicContact OD1-NH1 2.76Å; D331-R339 PolarHBondContact OD1-NH1 3.46Å; D331-R339 IonicContact OD1-NH2 3.73Å; V334-R339 HydrophobicContact CB-CG 4.37Å; V334-R339 HydrophobicContact CG1-CG 4.07Å; R339-S343 WeakPolarHBondContact O-CB 3.38Å; R339-S343 PolarHBondContact O-N 2.96Å
340	K	42.6	Very low	39.5	Very low	135 Å²	135	102.9 Å²	102.9	59%	0.587	50%	0.496	S	S	*	.	H	α-helix	trans	-65.1	-40.7	175	-77.1	-171.8	177.5	-170.7	0	112.1	L336 V338 E344	L336-K340 WeakPolarHBondContact O-CB 3.28Å; L336-K340 WeakPolarHBondContact O-CG 3.14Å; L336-K340 PolarHBondContact O-N 3.06Å; V338-K340 PolarHBondContact O-N 3.14Å; K340-E344 WeakPolarHBondContact O-CB 3.44Å; K340-E344 VanDerWaalsContact O-CG 3.29Å; K340-E344 WeakPolarHBondContact O-CG 3.24Å; K340-E344 PolarHBondContact O-N 3.45Å
341	R	40.1	Very low	39.1	Very low	188 Å²	188	112.6 Å²	112.6	71%	0.709	53%	0.531	S	S	*	.	H	α-helix	trans	-66.5	-43.3	176.8	-83.6	-175.7	178.1	172.7	-2.1	113.1	K337 V338 E344 E345	K337-R341 PolarHBondContact O-N 3.38Å; K337-R341 VanDerWaalsContact O-N 3.09Å; V338-R341 PolarHBondContact O-N 3.05Å; R341-E344 PolarHBondContact O-N 2.97Å; R341-E345 WeakPolarHBondContact O-CB 3.43Å; R341-E345 WeakPolarHBondContact O-CG 3.31Å; R341-E345 PolarHBondContact O-N 3.33Å
342	L	42	Very low	39.1	Very low	90 Å²	90	113.8 Å²	113.8	47%	0.471	54%	0.542	S	S	.	.	H	α-helix	trans	-69.4	-40.7	177.1	-94.2	153	0	0	0	111.9	V338 E344 E345 E346	V338-L342 HydrophobicContact CG1-CD1 4.19Å; V338-L342 PolarHBondContact O-N 2.86Å; L342-E344 VanDerWaalsContact C-N 3.31Å; L342-E344 PolarHBondContact O-N 3.44Å; L342-E345 PolarHBondContact O-N 3.02Å; L342-E346 WeakPolarHBondContact O-CB 3.3Å; L342-E346 WeakPolarHBondContact O-CG 3.48Å; L342-E346 PolarHBondContact O-N 3.06Å
343	S	43.2	Very low	38.8	Very low	50 Å²	50	113.1 Å²	113.1	35%	0.35	55%	0.55	S	S	.	*	H	α-helix	trans	-67.4	-32.2	174	-172.7	0	0	0	0	112.1	R339 K347	R339-S343 WeakPolarHBondContact O-CB 3.38Å; R339-S343 PolarHBondContact O-N 2.96Å; S343-K347 WeakPolarHBondContact O-CB 3.23Å; S343-K347 WeakPolarHBondContact O-CG 3.39Å; S343-K347 PolarHBondContact O-N 2.79Å
344	E	46.3	Very low	38.3	Very low	135 Å²	135	120.4 Å²	120.4	63%	0.631	59%	0.589	S	S	*	*	H	α-helix	trans	-73.2	-36.1	171	-77.9	-173.4	-178.5	0	0	112.2	K340 R341 L342 K347 L348	K340-E344 WeakPolarHBondContact O-CB 3.44Å; K340-E344 VanDerWaalsContact O-CG 3.29Å; K340-E344 WeakPolarHBondContact O-CG 3.24Å; K340-E344 PolarHBondContact O-N 3.45Å; R341-E344 PolarHBondContact O-N 2.97Å; L342-E344 VanDerWaalsContact C-N 3.31Å; L342-E344 PolarHBondContact O-N 3.44Å; E344-K347 CarbonylContact O-C 3.44Å; E344-K347 PolarHBondContact O-N 2.93Å; E344-L348 WeakPolarHBondContact O-CB 3.35Å; E344-L348 PolarHBondContact O-N 3.08Å
345	E	43.7	Very low	38	Very low	111 Å²	111	122.1 Å²	122.1	52%	0.519	62%	0.615	S	S	.	*	H	α-helix	trans	-69.3	-38	173.7	-82.7	179.7	179.9	0	0	112.3	R341 L342 L348 K349	R341-E345 WeakPolarHBondContact O-CB 3.43Å; R341-E345 WeakPolarHBondContact O-CG 3.31Å; R341-E345 PolarHBondContact O-N 3.33Å; L342-E345 PolarHBondContact O-N 3.02Å; E345-L348 PolarHBondContact O-N 3.43Å; E345-K349 WeakPolarHBondContact O-CB 3.12Å; E345-K349 WeakPolarHBondContact O-CG 3.03Å; E345-K349 PolarHBondContact O-N 3.45Å
346	E	44	Very low	37.5	Very low	116 Å²	116	122 Å²	122	54%	0.542	63%	0.629	S	S	.	*	H	α-helix	trans	-66.7	-45.2	171.9	-77.5	174.5	167.1	0	0	110.2	L342 L348 K349 E350	L342-E346 WeakPolarHBondContact O-CB 3.3Å; L342-E346 WeakPolarHBondContact O-CG 3.48Å; L342-E346 PolarHBondContact O-N 3.06Å; E346-L348 VanDerWaalsContact C-N 3.27Å; E346-L348 PolarHBondContact O-N 2.98Å; E346-K349 PolarHBondContact O-N 2.83Å; E346-E350 WeakPolarHBondContact O-CB 3.36Å; E346-E350 WeakPolarHBondContact O-CG 2.8Å; E346-E350 PolarHBondContact O-N 2.85Å
347	K	43.1	Very low	37	Very low	125 Å²	125	125 Å²	125	54%	0.543	64%	0.641	S	S	.	*	H	α-helix	trans	-64.9	-28.3	172.5	-75.5	175.7	-178.9	-177.9	0	113.3	S343 E344 R351	S343-K347 WeakPolarHBondContact O-CB 3.23Å; S343-K347 WeakPolarHBondContact O-CG 3.39Å; S343-K347 PolarHBondContact O-N 2.79Å; E344-K347 CarbonylContact O-C 3.44Å; E344-K347 PolarHBondContact O-N 2.93Å; K347-R351 VanDerWaalsContact O-CB 3.25Å; K347-R351 WeakPolarHBondContact O-CB 3.4Å; K347-R351 VanDerWaalsContact O-CG 3.32Å; K347-R351 WeakPolarHBondContact O-CG 3.3Å; K347-R351 PolarHBondContact O-N 3.42Å
348	L	36.8	Very low	36.3	Very low	120 Å²	120	122.8 Å²	122.8	63%	0.628	64%	0.643	S	S	*	*	H	α-helix	trans	-77	-35.5	175.2	-156	87.6	0	0	0	111.3	E344 E345 E346 T352	E344-L348 WeakPolarHBondContact O-CB 3.35Å; E344-L348 PolarHBondContact O-N 3.08Å; E345-L348 PolarHBondContact O-N 3.43Å; E346-L348 VanDerWaalsContact C-N 3.27Å; E346-L348 PolarHBondContact O-N 2.98Å; L348-T352 PolarHBondContact O-N 3.38Å; L348-T352 PolarHBondContact O-OG1 2.84Å; L348-T352 VanDerWaalsContact O-OG1 3.11Å
349	K	40.8	Very low	35.6	Very low	155 Å²	155	124.3 Å²	124.3	67%	0.674	66%	0.662	S	S	*	*	H	α-helix	trans	-69.4	-38.7	171.4	-78.7	177.8	178.1	176.3	0	111.6	E345 E346 T352 G353	E345-K349 WeakPolarHBondContact O-CB 3.12Å; E345-K349 WeakPolarHBondContact O-CG 3.03Å; E345-K349 PolarHBondContact O-N 3.45Å; E346-K349 PolarHBondContact O-N 2.83Å; K349-T352 PolarHBondContact O-N 3.05Å; K349-T352 PolarHBondContact O-OG1 3.2Å; K349-G353 PolarHBondContact O-N 2.8Å
350	E	38.8	Very low	34.9	Very low	143 Å²	143	126.6 Å²	126.6	67%	0.668	69%	0.69	S	S	*	*	H	α-helix	trans	-69.7	-35.3	173.7	-74.6	176.8	171.3	0	0	111.7	E346 T352 G353	E346-E350 WeakPolarHBondContact O-CB 3.36Å; E346-E350 WeakPolarHBondContact O-CG 2.8Å; E346-E350 PolarHBondContact O-N 2.85Å; E350-T352 VanDerWaalsContact C-N 3.29Å; E350-T352 PolarHBondContact O-N 3.41Å; E350-G353 PolarHBondContact O-N 2.85Å
351	R	35.5	Very low	34	Very low	223 Å²	223	128.4 Å²	128.4	84%	0.842	70%	0.7	S	S	*	*	H	α-helix	trans	-70.7	-20.5	175.2	-86.5	-179.7	172.1	-177.4	-2.4	114.5	K347	K347-R351 VanDerWaalsContact O-CB 3.25Å; K347-R351 WeakPolarHBondContact O-CB 3.4Å; K347-R351 VanDerWaalsContact O-CG 3.32Å; K347-R351 WeakPolarHBondContact O-CG 3.3Å; K347-R351 PolarHBondContact O-N 3.42Å
352	T	35	Very low	33.3	Very low	119 Å²	119	125.5 Å²	125.5	73%	0.73	71%	0.706	S	S	*	*	H	α-helix	trans	-94.6	-7.5	173.1	50.1	0	0	0	0	113.1	L348 K349 E350 L354	L348-T352 PolarHBondContact O-N 3.38Å; L348-T352 PolarHBondContact O-OG1 2.84Å; L348-T352 VanDerWaalsContact O-OG1 3.11Å; K349-T352 PolarHBondContact O-N 3.05Å; K349-T352 PolarHBondContact O-OG1 3.2Å; E350-T352 VanDerWaalsContact C-N 3.29Å; E350-T352 PolarHBondContact O-N 3.41Å; T352-L354 PolarHBondContact O-N 3.49Å
353	G	32	Very low	32.3	Very low	53 Å²	53	132 Å²	132	55%	0.546	73%	0.725	S	S	.	*			trans	-86.8	93.2	172.1	0	0	0	0	0	112.1	K349 E350 G355	K349-G353 PolarHBondContact O-N 2.8Å; E350-G353 PolarHBondContact O-N 2.85Å; G353-G355 PolarHBondContact O-N 3.15Å
354	L	25.1	Very low	31.3	Very low	187 Å²	187	134.3 Å²	134.3	98%	0.979	75%	0.747	S	S	*	*			trans	-65.9	116.1	171.3	-153.4	89.6	0	0	0	110.1	T352	T352-L354 PolarHBondContact O-N 3.49Å
355	G	26	Very low	30.3	Very low	75 Å²	75	134.2 Å²	134.2	77%	0.773	76%	0.756	S	S	*	*			trans	152.4	95.5	168.3	0	0	0	0	0	113.4	G353	G353-G355 PolarHBondContact O-N 3.15Å
356	G	24	Very low	29.2	Very low	81 Å²	81	138.1 Å²	138.1	84%	0.835	78%	0.776	S	S	*	*			trans	-73	151.8	-177.1	0	0	0	0	0	114.7
357	M	24.1	Very low	28.3	Very low	192 Å²	192	137.7 Å²	137.7	95%	0.946	79%	0.786	S	S	*	*			trans	-148.4	135.7	149.3	-148.9	118.4	174.6	0	0	108.7
358	T	26.3	Very low	27.5	Very low	131 Å²	131	136.3 Å²	136.3	80%	0.804	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-74	146.9	-160.5	41.2	0	0	0	0	114.9
359	A	23.9	Very low	26.8	Very low	100 Å²	100	140.6 Å²	140.6	83%	0.826	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-58.9	130.7	175.7	0	0	0	0	0	113.1
360	C	20.5	Very low	26	Very low	130 Å²	130	144.9 Å²	144.9	88%	0.878	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-94.3	128.3	164.8	-75	0	0	0	0	109.8
361	E	22.6	Very low	25.3	Very low	173 Å²	173	147.2 Å²	147.2	81%	0.808	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-75.1	152.9	175.7	-70.5	-177	151.5	0	0	112.3
362	P	25.1	Very low	24.8	Very low	127 Å²	127	142.4 Å²	142.4	83%	0.825	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-89.8	126.6	-170.9	29.2	-20.4	0	0	0	112.5
363	Y	20.8	Very low	24.3	Very low	226 Å²	226	142.2 Å²	142.2	89%	0.886	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-72.8	130.8	178.9	-76.3	-89.3	0	0	0	112.7
364	A	23.6	Very low	24.1	Very low	98 Å²	98	146 Å²	146	81%	0.81	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-75.4	124.8	-178	0	0	0	0	0	112.2
365	V	25.3	Very low	24.2	Very low	134 Å²	134	140.6 Å²	140.6	81%	0.812	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-73	121.8	175.3	174.6	0	0	0	0	110.1	S367	V365-S367 PolarHBondContact O-N 2.94Å
366	M	19.7	Very low	24.1	Very low	192 Å²	192	142.9 Å²	142.9	95%	0.946	83%	0.834	S	S	*	*			trans	-70.1	102.6	169.9	-72.5	178.5	66.4	0	0	109.9
367	S	25.5	Very low	24.3	Very low	108 Å²	108	144.7 Å²	144.7	76%	0.755	83%	0.834	S	S	*	*			trans	-106.4	119.4	170.3	151.5	0	0	0	0	109.3	V365	V365-S367 PolarHBondContact O-N 2.94Å
368	A	26.6	Very low	24.7	Very low	96 Å²	96	139.3 Å²	139.3	79%	0.793	82%	0.82	S	S	*	*			trans	-58.5	133.4	179.7	0	0	0	0	0	112.9	R370	A368-R370 PolarHBondContact O-N 2.98Å
369	K	22.3	Very low	24.8	Very low	210 Å²	210	137 Å²	137	91%	0.913	80%	0.803	S	S	*	*			trans	-20.5	107.6	171.1	-70.8	170.9	173.7	176	0	115.5
370	R	22.9	Very low	24.9	Very low	245 Å²	245	139.2 Å²	139.2	93%	0.925	80%	0.798	S	S	*	*			trans	-120.5	127.8	140.3	-86	-176.7	174.4	166.2	-0	107.7	A368	A368-R370 PolarHBondContact O-N 2.98Å
371	E	23.6	Very low	25.3	Very low	191 Å²	191	140 Å²	140	89%	0.893	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-59.7	143.8	-173.2	-68.3	-178.6	156.3	0	0	112.1
372	P	26.3	Very low	25.5	Very low	122 Å²	122	138.9 Å²	138.9	79%	0.792	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-94	118.5	-163.2	32.5	-23.5	0	0	0	111.2
373	S	23.9	Very low	25.6	Very low	116 Å²	116	142.5 Å²	142.5	81%	0.811	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-86.9	129.7	159	51.7	0	0	0	0	109.4
374	P	28.6	Very low	26	Very low	132 Å²	132	135.5 Å²	135.5	86%	0.857	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-87.5	138.8	-162.7	32.7	-33.1	0	0	0	112.9
375	G	26.5	Very low	26.2	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	76%	0.756	S	S	*	*			trans	97.3	66.9	153.9	0	0	0	0	0	117
376	L	24.7	Very low	26.3	Very low	123 Å²	123	141 Å²	141	64%	0.644	75%	0.752	S	S	*	*			trans	-148.8	56.9	165.1	-140	96.5	0	0	0	113.6	D379	L376-D379 HydrophobicContact CD2-CB 3.98Å; L376-D379 HydrophobicContact CG-CB 4.32Å
377	S	28.6	Very low	26.7	Very low	120 Å²	120	135.4 Å²	135.4	84%	0.839	74%	0.743	S	S	*	*	S	Bend	trans	-94.6	6.4	-179.8	59.1	0	0	0	0	116.1
378	A	30.9	Very low	26.8	Very low	78 Å²	78	135.8 Å²	135.8	65%	0.645	73%	0.729	S	S	*	*	S	Bend	trans	-110.5	-18	175.3	0	0	0	0	0	114.8
379	D	28.9	Very low	27.6	Very low	83 Å²	83	134.3 Å²	134.3	44%	0.444	71%	0.713	S	S	.	*	S	Bend	trans	-89.5	-19.6	-175.6	-89.9	-18.8	0	0	0	114.4	L376 H381 K382 R383	L376-D379 HydrophobicContact CD2-CB 3.98Å; L376-D379 HydrophobicContact CG-CB 4.32Å; D379-H381 VanDerWaalsContact C-N 3.35Å; D379-H381 PolarHBondContact O-N 3.27Å; D379-K382 PolarHBondContact O-N 3.42Å; D379-K382 VanDerWaalsContact O-N 3.13Å; D379-R383 PolarHBondContact O-N 2.83Å
380	M	26.3	Very low	28.4	Very low	146 Å²	146	129.5 Å²	129.5	72%	0.719	69%	0.692	S	S	*	*	H	α-helix	trans	-63.3	-37.7	176.3	-89.5	177.3	66	0	0	112.6	K382 R383 S384	M380-K382 VanDerWaalsContact C-N 3.31Å; M380-K382 PolarHBondContact O-N 2.66Å; M380-R383 PolarHBondContact O-N 3.4Å; M380-S384 PolarHBondContact O-N 3.26Å; M380-S384 PolarHBondContact O-OG 3.07Å
381	H	27.9	Very low	29.1	Very low	147 Å²	147	120 Å²	120	68%	0.681	66%	0.659	S	S	*	*	H	α-helix	trans	-72.1	-21	175	-79.6	-69.4	0	0	0	113.8	D379 S384	D379-H381 VanDerWaalsContact C-N 3.35Å; D379-H381 PolarHBondContact O-N 3.27Å; H381-S384 PolarHBondContact O-OG 2.9Å
382	K	27.2	Very low	29.7	Very low	149 Å²	149	114.4 Å²	114.4	65%	0.648	63%	0.63	S	S	*	*	H	α-helix	trans	-84	-30.3	171.3	-82.5	179	179.4	171	0	112.5	D379 M380	D379-K382 PolarHBondContact O-N 3.42Å; D379-K382 VanDerWaalsContact O-N 3.13Å; M380-K382 VanDerWaalsContact C-N 3.31Å; M380-K382 PolarHBondContact O-N 2.66Å
383	R	28.5	Very low	30.3	Very low	203 Å²	203	112.8 Å²	112.8	77%	0.766	61%	0.608	S	S	*	*	H	α-helix	trans	-72.9	-38.4	172.9	-98.6	-179.5	173.7	171.4	-1.1	112.5	D379 M380 R385 K386	D379-R383 PolarHBondContact O-N 2.83Å; M380-R383 PolarHBondContact O-N 3.4Å; R383-R385 VanDerWaalsContact C-N 3.26Å; R383-R385 PolarHBondContact O-N 3.29Å; R383-K386 PolarHBondContact O-N 2.82Å; R383-K386 VanDerWaalsContact O-N 3.1Å
384	S	29.4	Very low	30.9	Very low	79 Å²	79	107.6 Å²	107.6	55%	0.552	57%	0.571	S	S	*	*	H	α-helix	trans	-64.6	-28.2	177.7	65.1	0	0	0	0	113.4	M380 H381 K386	M380-S384 PolarHBondContact O-N 3.26Å; M380-S384 PolarHBondContact O-OG 3.07Å; H381-S384 PolarHBondContact O-OG 2.9Å; S384-K386 PolarHBondContact O-N 3.09Å
385	R	26.4	Very low	31.3	Very low	183 Å²	183	103.2 Å²	103.2	69%	0.691	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-6.7	173	-82.5	-175.6	176.7	177.9	1	115.2	R383 R393	R383-R385 VanDerWaalsContact C-N 3.26Å; R383-R385 PolarHBondContact O-N 3.29Å; R385-R393 PolarHBondContact O-NH1 3.2Å; R385-R393 PolarHBondContact O-NH2 3.34Å
386	K	27.6	Very low	31.7	Very low	165 Å²	165	102.8 Å²	102.8	72%	0.717	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-12	-178.7	-75.3	-174.6	177	-178.4	0	114.5	R383 S384 R393	R383-K386 PolarHBondContact O-N 2.82Å; R383-K386 VanDerWaalsContact O-N 3.1Å; S384-K386 PolarHBondContact O-N 3.09Å; K386-R393 PolarHBondContact O-NH2 2.76Å
387	G	28	Very low	32.2	Very low	74 Å²	74	103.7 Å²	103.7	76%	0.763	53%	0.525	S	S	*	.			trans	-81.4	-12.2	-174.2	0	0	0	0	0	118.2
388	Y	28.7	Very low	32.5	Very low	116 Å²	116	101 Å²	101	46%	0.455	50%	0.5	S	S	.	.	S	Bend	trans	-67.6	138.4	-179.6	-68	-86.9	0	0	0	112.1	F390 R393	Y388-F390 PolarHBondContact O-N 3.1Å; Y388-R393 PolarHBondContact O-NH2 3.18Å
389	S	43	Very low	32.6	Very low	66 Å²	66	102.6 Å²	102.6	46%	0.462	50%	0.498	S	S	.	.			trans	-51.7	120.5	176.4	77.2	0	0	0	0	109.3	I391 R392	S389-I391 PolarHBondContact O-N 3.29Å; S389-R392 PolarHBondContact O-N 2.8Å
390	F	39.1	Very low	32.6	Very low	109 Å²	109	103.4 Å²	103.4	48%	0.478	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-29.3	-172.9	173.5	-100.1	0	0	0	113	Y388 L394 S424 I425	Y388-F390 PolarHBondContact O-N 3.1Å; F390-L394 HydrophobicContact CD1-CD1 4.23Å; F390-L394 HydrophobicContact CE1-CD1 3.67Å; F390-L394 HydrophobicContact CE2-CD1 4.45Å; F390-L394 HydrophobicContact CZ-CD1 3.79Å; F390-S424 VanDerWaalsContact CE1-OG 3.3Å; F390-S424 WeakPolarHBondContact CE1-OG 3.4Å; F390-S424 WeakPolarHBondContact CZ-OG 3.38Å; F390-I425 HydrophobicContact CE1-CG1 4.06Å
391	I	36.9	Very low	32.7	Very low	46 Å²	46	101.4 Å²	101.4	24%	0.236	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-35.6	-177	-53.8	164.2	0	0	0	112.1	S389 L394 A395 L437	S389-I391 PolarHBondContact O-N 3.29Å; I391-L394 WeakPolarHBondContact O-CB 3.48Å; I391-L394 PolarHBondContact O-N 3.29Å; I391-A395 PolarHBondContact O-N 2.76Å; I391-L437 HydrophobicContact CD1-CD1 3.16Å; I391-L437 HydrophobicContact CG1-CD1 4.11Å
392	R	37.6	Very low	32.7	Very low	72 Å²	72	101.6 Å²	101.6	27%	0.272	51%	0.508	S	S	.	.	H	α-helix	trans	-77.3	-42.6	-174.8	-144.2	171.4	-166.3	141	2.1	112.2	Y306 S389 L394 A395 D396	Y306-R392 PolarHBondContact OH-NH1 3.43Å; S389-R392 PolarHBondContact O-N 2.8Å; R392-L394 PolarHBondContact O-N 2.93Å; R392-A395 PolarHBondContact O-N 3.1Å; R392-D396 PolarHBondContact O-N 3.31Å
393	R	37.4	Very low	32.7	Very low	88 Å²	88	100.6 Å²	100.6	33%	0.332	51%	0.514	S	S	.	.	H	α-helix	trans	-52.4	-21.8	167.8	-86	-170.4	-82.7	-164.7	-14.8	113.9	R385 K386 Y388 K397	R385-R393 PolarHBondContact O-NH1 3.2Å; R385-R393 PolarHBondContact O-NH2 3.34Å; K386-R393 PolarHBondContact O-NH2 2.76Å; Y388-R393 PolarHBondContact O-NH2 3.18Å; R393-K397 WeakPolarHBondContact O-CG 3.23Å
394	L	36.5	Very low	32.6	Very low	7 Å²	7	96.6 Å²	96.6	4%	0.037	52%	0.517	C	S	.	.	H	α-helix	trans	-89.2	-33.5	-176.2	-144	136	0	0	0	111.9	F390 I391 R392 M398 N421 I422 I425	F390-L394 HydrophobicContact CD1-CD1 4.23Å; F390-L394 HydrophobicContact CE1-CD1 3.67Å; F390-L394 HydrophobicContact CE2-CD1 4.45Å; F390-L394 HydrophobicContact CZ-CD1 3.79Å; I391-L394 WeakPolarHBondContact O-CB 3.48Å; I391-L394 PolarHBondContact O-N 3.29Å; R392-L394 PolarHBondContact O-N 2.93Å; L394-M398 HydrophobicContact CD2-CE 3.64Å; L394-M398 WeakPolarHBondContact O-CG 3.32Å; L394-N421 HydrophobicContact CD1-CB 3.61Å; L394-N421 HydrophobicContact CD2-CB 3.62Å; L394-N421 HydrophobicContact CG-CB 3.55Å; L394-I422 HydrophobicContact CD2-CG1 4.38Å; L394-I425 HydrophobicContact CD1-CD1 3.9Å; L394-I425 HydrophobicContact CD1-CG1 4.17Å; L394-I425 HydrophobicContact CD2-CD1 3.64Å; L394-I425 HydrophobicContact CG-CD1 4.23Å
395	A	36.7	Very low	32.4	Very low	41 Å²	41	103.1 Å²	103.1	34%	0.339	54%	0.536	S	S	.	.	H	α-helix	trans	-67.6	-43.7	174	0	0	0	0	0	111.3	I391 R392 K397 M398	I391-A395 PolarHBondContact O-N 2.76Å; R392-A395 PolarHBondContact O-N 3.1Å; A395-K397 VanDerWaalsContact C-N 3.32Å; A395-K397 PolarHBondContact O-N 2.81Å; A395-M398 PolarHBondContact O-N 3.37Å; A395-M398 VanDerWaalsContact O-N 3.16Å
396	D	35.2	Very low	32.4	Very low	63 Å²	63	97.4 Å²	97.4	34%	0.337	53%	0.534	S	S	.	.	H	α-helix	trans	-70	-28.5	-177.8	-56.4	-41.3	0	0	0	112.9	D332 R392 M398 D399	D332-D396 WeakPolarHBondContact CB-OD2 3.39Å; R392-D396 PolarHBondContact O-N 3.31Å; D396-M398 VanDerWaalsContact C-N 3.26Å; D396-M398 PolarHBondContact O-N 2.99Å; D396-D399 PolarHBondContact O-N 2.85Å
397	K	35.8	Very low	32.3	Very low	143 Å²	143	99 Å²	99	62%	0.622	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-74.4	-12.4	175.3	-78.7	-174.9	178.1	-174	0	113.9	R393 A395 D399	R393-K397 WeakPolarHBondContact O-CG 3.23Å; A395-K397 VanDerWaalsContact C-N 3.32Å; A395-K397 PolarHBondContact O-N 2.81Å; K397-D399 VanDerWaalsContact C-N 3.29Å
398	M	34	Very low	32	Very low	64 Å²	64	104.5 Å²	104.5	32%	0.315	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-81.7	-4.4	176.4	-67.1	-171.1	-159.6	0	0	113.5	L394 A395 D396 I422 R448	L394-M398 HydrophobicContact CD2-CE 3.64Å; L394-M398 WeakPolarHBondContact O-CG 3.32Å; A395-M398 PolarHBondContact O-N 3.37Å; A395-M398 VanDerWaalsContact O-N 3.16Å; D396-M398 VanDerWaalsContact C-N 3.26Å; D396-M398 PolarHBondContact O-N 2.99Å; M398-I422 HydrophobicContact CE-CD1 3.5Å; M398-I422 VanDerWaalsContact CE-CD1 3.5Å; M398-I422 HydrophobicContact CE-CG1 3.33Å; M398-I422 HydrophobicContact SD-CD1 4.18Å; M398-R448 PolarHBondContact O-NH2 2.85Å; M398-R448 VanDerWaalsContact O-NH2 3.12Å; M398-R448 PolarHBondContact SD-NH1 3.08Å
399	D	34.1	Very low	31.8	Very low	111 Å²	111	102.1 Å²	102.1	59%	0.594	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-84.5	-1	-177	-85.4	4.4	0	0	0	114.5	D396 K397 T401 R448	D396-D399 PolarHBondContact O-N 2.85Å; K397-D399 VanDerWaalsContact C-N 3.29Å; D399-T401 PolarHBondContact O-N 3.42Å; D399-R448 IonicContact OD1-CZ 3.97Å; D399-R448 IonicContact OD1-NH2 3.02Å; D399-R448 PolarHBondContact OD1-NH2 3.25Å
400	T	28.4	Very low	30.8	Very low	99 Å²	99	106.4 Å²	106.4	61%	0.607	58%	0.583	S	S	*	*			trans	-85.1	50.7	176.6	68.9	0	0	0	0	112.5
401	T	28.2	Very low	30	Very low	104 Å²	104	111 Å²	111	64%	0.638	60%	0.603	S	S	*	*			trans	-134	93.4	159.4	55.1	0	0	0	0	105.6	D399	D399-T401 PolarHBondContact O-N 3.42Å
402	D	27.3	Very low	29.4	Very low	152 Å²	152	115.4 Å²	115.4	81%	0.813	63%	0.632	S	S	*	*			trans	-174.6	129.8	139.3	-91.4	-21.8	0	0	0	114.4
403	V	28.3	Very low	28.7	Very low	128 Å²	128	121 Å²	121	78%	0.776	66%	0.659	S	S	*	*			trans	55.3	78.6	136.2	-165.7	0	0	0	0	116.6
404	S	26.3	Very low	28	Very low	118 Å²	118	123.6 Å²	123.6	83%	0.825	68%	0.684	S	S	*	*			trans	-128.3	62.8	146.9	52.6	0	0	0	0	110.2	G406	S404-G406 VanDerWaalsContact C-N 3.31Å; S404-G406 PolarHBondContact O-N 2.78Å; S404-G406 VanDerWaalsContact O-N 3.08Å
405	K	25	Very low	27.5	Very low	217 Å²	217	129.1 Å²	129.1	94%	0.943	72%	0.718	S	S	*	*			trans	-71.9	93.6	157.4	-82.8	-174.9	177	178	0	107.3
406	G	26.4	Very low	27	Very low	63 Å²	63	136.2 Å²	136.2	65%	0.649	74%	0.741	S	S	*	*			trans	162.9	53.8	174.4	0	0	0	0	0	114.4	S404	S404-G406 VanDerWaalsContact C-N 3.31Å; S404-G406 PolarHBondContact O-N 2.78Å; S404-G406 VanDerWaalsContact O-N 3.08Å
407	Q	24.7	Very low	26.8	Very low	198 Å²	198	138 Å²	138	93%	0.925	75%	0.754	S	S	*	*			trans	-175.9	109.6	143.9	-103.2	161	-8	0	0	109	G409	Q407-G409 PolarHBondContact O-N 3.18Å
408	L	23.1	Very low	26.6	Very low	190 Å²	190	136.5 Å²	136.5	100%	0.995	75%	0.753	S	S	*	*			trans	-60.4	115.7	171.5	-111.2	78.4	0	0	0	109
409	G	23.3	Very low	26.7	Very low	65 Å²	65	136.9 Å²	136.9	67%	0.67	76%	0.762	S	S	*	*			trans	-172	99.1	173.2	0	0	0	0	0	110.6	Q407 F411	Q407-G409 PolarHBondContact O-N 3.18Å; G409-F411 PolarHBondContact O-N 3.39Å
410	N	22.6	Very low	27.1	Very low	156 Å²	156	135.4 Å²	135.4	83%	0.834	76%	0.757	S	S	*	*			trans	-37.5	108.7	-177.7	-68.5	-26.6	0	0	0	115.4
411	F	23.1	Very low	28.6	Very low	207 Å²	207	132.8 Å²	132.8	91%	0.908	74%	0.739	S	S	*	*			trans	-144.4	93	150.2	-98.1	-78.5	0	0	0	110	G409 K413	G409-F411 PolarHBondContact O-N 3.39Å; F411-K413 PolarHBondContact O-N 3.42Å
412	T	22.5	Very low	30.3	Very low	137 Å²	137	130 Å²	130	84%	0.84	72%	0.72	S	S	*	*			trans	-77.1	87.8	170.1	47.1	0	0	0	0	110.1
413	K	23.4	Very low	32.2	Very low	191 Å²	191	123.4 Å²	123.4	83%	0.83	68%	0.684	S	S	*	*			trans	-140.4	93.9	151.3	-89.4	-173.4	179.6	174.7	0	107.9	F411 V415	F411-K413 PolarHBondContact O-N 3.42Å; K413-V415 PolarHBondContact O-N 3.08Å
414	T	23.9	Very low	34	Very low	141 Å²	141	119 Å²	119	87%	0.865	66%	0.659	S	S	*	*			trans	-60.7	93.8	172.5	36.1	0	0	0	0	109.5	K416	T414-K416 PolarHBondContact O-N 2.94Å; T414-K416 VanDerWaalsContact O-N 3.09Å
415	V	26.1	Very low	35.9	Very low	123 Å²	123	113.7 Å²	113.7	75%	0.745	62%	0.621	S	S	*	*			trans	-66.1	105.8	167.7	177.4	0	0	0	0	107	K413 V417	K413-V415 PolarHBondContact O-N 3.08Å; V415-V417 PolarHBondContact O-N 2.89Å; V415-V417 VanDerWaalsContact O-N 3.08Å
416	K	24.8	Very low	38.2	Very low	191 Å²	191	103.5 Å²	103.5	83%	0.83	58%	0.577	S	S	*	*			trans	-61.2	107.3	166.1	-80.1	179.7	175.3	176.4	0	107.2	T414 D418	T414-K416 PolarHBondContact O-N 2.94Å; T414-K416 VanDerWaalsContact O-N 3.09Å; K416-D418 PolarHBondContact O-N 2.62Å
417	V	31.5	Very low	40.4	Very low	99 Å²	99	104.9 Å²	104.9	60%	0.6	56%	0.563	S	S	*	*			trans	-72.3	121.6	176	176.1	0	0	0	0	108.5	V415 S419	V415-V417 PolarHBondContact O-N 2.89Å; V415-V417 VanDerWaalsContact O-N 3.08Å; V417-S419 PolarHBondContact O-N 3.06Å; V417-S419 VanDerWaalsContact O-N 3.07Å
418	D	32.7	Very low	42.6	Very low	112 Å²	112	100.9 Å²	100.9	60%	0.599	54%	0.542	S	S	*	.			trans	-68.5	94.9	-167.5	-76.9	-37	0	0	0	113.7	K416 T420	K416-D418 PolarHBondContact O-N 2.62Å; D418-T420 PolarHBondContact O-N 3.04Å; D418-T420 VanDerWaalsContact O-N 3.09Å
419	S	35.3	Very low	44.9	Very low	72 Å²	72	91.9 Å²	91.9	50%	0.503	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-3	164.7	59.8	0	0	0	0	114.3	V417 N421 Q490	V417-S419 PolarHBondContact O-N 3.06Å; V417-S419 VanDerWaalsContact O-N 3.07Å; S419-N421 PolarHBondContact O-N 3.14Å; S419-Q490 VanDerWaalsContact CB-NE2 3.34Å; S419-Q490 PolarHBondContact OG-NE2 3.41Å
420	T	42.4	Very low	47.2	Very low	80 Å²	80	88.9 Å²	88.9	49%	0.491	46%	0.464	S	S	.	.	H	α-helix	trans	-66.3	-19.9	-176.9	56.9	0	0	0	0	113.2	D418 M423 S424	D418-T420 PolarHBondContact O-N 3.04Å; D418-T420 VanDerWaalsContact O-N 3.09Å; T420-M423 WeakPolarHBondContact O-CB 3.19Å; T420-S424 PolarHBondContact O-N 3.07Å
421	N	60.9	Low	49.6	Very low	44 Å²	44	83 Å²	83	24%	0.235	43%	0.432	C	S	.	.	H	α-helix	trans	-75.6	-46.5	-172.1	-90.3	-9.4	0	0	0	113.9	L394 S419 M423 S424 I425	L394-N421 HydrophobicContact CD1-CB 3.61Å; L394-N421 HydrophobicContact CD2-CB 3.62Å; L394-N421 HydrophobicContact CG-CB 3.55Å; S419-N421 PolarHBondContact O-N 3.14Å; N421-M423 VanDerWaalsContact C-N 3.28Å; N421-M423 PolarHBondContact O-N 3.38Å; N421-S424 PolarHBondContact O-N 3.24Å; N421-S424 PolarHBondContact O-OG 3.4Å; N421-I425 PolarHBondContact O-N 3.41Å
422	I	62.9	Low	51.7	Low	47 Å²	47	78 Å²	78	24%	0.241	42%	0.415	C	S	.	.	H	α-helix	trans	-62.7	-40	174.7	-67.6	172.8	0	0	0	110.5	L394 M398 S424 I425 W426 I486	L394-I422 HydrophobicContact CD2-CG1 4.38Å; M398-I422 HydrophobicContact CE-CD1 3.5Å; M398-I422 VanDerWaalsContact CE-CD1 3.5Å; M398-I422 HydrophobicContact CE-CG1 3.33Å; M398-I422 HydrophobicContact SD-CD1 4.18Å; I422-S424 VanDerWaalsContact C-N 3.31Å; I422-S424 PolarHBondContact O-N 3.16Å; I422-I425 PolarHBondContact O-N 2.68Å; I422-I425 VanDerWaalsContact O-N 3.15Å; I422-W426 PolarHBondContact O-N 3.29Å; I422-I486 HydrophobicContact CG2-CD1 4.38Å; I422-I486 HydrophobicContact CG2-CG1 4.3Å
423	M	67.3	Low	53.9	Low	12 Å²	12	73.2 Å²	73.2	6%	0.059	38%	0.384	C	S	.	.	H	α-helix	trans	-56.7	-43.3	176.9	-82.9	-70.6	-79.2	0	0	112.1	T420 N421 I425 W426 R427 Q490 E493 L494	T420-M423 WeakPolarHBondContact O-CB 3.19Å; N421-M423 VanDerWaalsContact C-N 3.28Å; N421-M423 PolarHBondContact O-N 3.38Å; M423-I425 VanDerWaalsContact C-N 3.34Å; M423-I425 PolarHBondContact O-N 2.99Å; M423-W426 PolarHBondContact O-N 3.38Å; M423-R427 VanDerWaalsContact O-CB 3.25Å; M423-R427 WeakPolarHBondContact O-CB 3.45Å; M423-R427 PolarHBondContact O-N 3.25Å; M423-Q490 HydrophobicContact CE-CB 4.08Å; M423-Q490 HydrophobicContact CE-CG 4.42Å; M423-Q490 WeakPolarHBondContact CE-O 3.28Å; M423-Q490 HydrophobicContact CG-CB 4.21Å; M423-Q490 HydrophobicContact CG-CG 4.03Å; M423-Q490 HydrophobicContact SD-CB 3.59Å; M423-Q490 VanDerWaalsContact SD-CB 3.59Å; M423-Q490 HydrophobicContact SD-CG 4.07Å; M423-E493 HydrophobicContact CE-CB 3.68Å; M423-L494 HydrophobicContact CE-CB 3.91Å; M423-L494 HydrophobicContact SD-CB 4.09Å
424	S	66.4	Low	56.1	Low	35 Å²	35	66.4 Å²	66.4	25%	0.245	36%	0.357	C	S	.	.	H	α-helix	trans	-64.4	-34.8	177.5	73.4	0	0	0	0	113.6	F390 T420 N421 I422 R427 K428	F390-S424 VanDerWaalsContact CE1-OG 3.3Å; F390-S424 WeakPolarHBondContact CE1-OG 3.4Å; F390-S424 WeakPolarHBondContact CZ-OG 3.38Å; T420-S424 PolarHBondContact O-N 3.07Å; N421-S424 PolarHBondContact O-N 3.24Å; N421-S424 PolarHBondContact O-OG 3.4Å; I422-S424 VanDerWaalsContact C-N 3.31Å; I422-S424 PolarHBondContact O-N 3.16Å; S424-R427 WeakPolarHBondContact O-CB 3.48Å; S424-R427 PolarHBondContact O-N 3.38Å; S424-K428 PolarHBondContact O-N 3.15Å
425	I	66.2	Low	58.3	Low	8 Å²	8	61.6 Å²	61.6	4%	0.041	33%	0.327	C	S	.	.	H	α-helix	trans	-69.5	-48.3	177.3	-59.4	167.9	0	0	0	109.9	F390 L394 N421 I422 M423 R427 K428 I429 L437 L441	F390-I425 HydrophobicContact CE1-CG1 4.06Å; L394-I425 HydrophobicContact CD1-CD1 3.9Å; L394-I425 HydrophobicContact CD1-CG1 4.17Å; L394-I425 HydrophobicContact CD2-CD1 3.64Å; L394-I425 HydrophobicContact CG-CD1 4.23Å; N421-I425 PolarHBondContact O-N 3.41Å; I422-I425 PolarHBondContact O-N 2.68Å; I422-I425 VanDerWaalsContact O-N 3.15Å; M423-I425 VanDerWaalsContact C-N 3.34Å; M423-I425 PolarHBondContact O-N 2.99Å; I425-R427 PolarHBondContact O-N 3.37Å; I425-K428 CarbonylContact O-C 3.55Å; I425-K428 WeakPolarHBondContact O-CA 3.25Å; I425-K428 WeakPolarHBondContact O-CB 3.44Å; I425-K428 PolarHBondContact O-N 3.25Å; I425-I429 HydrophobicContact CG2-CD1 3.84Å; I425-I429 HydrophobicContact CG2-CG1 4.27Å; I425-I429 WeakPolarHBondContact O-CG1 3.48Å; I425-I429 PolarHBondContact O-N 3Å; I425-L437 HydrophobicContact CG2-CD2 4.41Å; I425-L437 HydrophobicContact CG2-CG 4.44Å; I425-L441 HydrophobicContact CB-CD1 4.4Å; I425-L441 HydrophobicContact CD1-CD1 4.09Å; I425-L441 HydrophobicContact CG2-CD1 3.64Å
426	W	72.9	Confident	60.3	Low	2 Å²	2	62.7 Å²	62.7	1%	0.008	32%	0.324	C	S	.	.	H	α-helix	trans	-60.9	-37.1	175.5	-82.1	101.7	0	0	0	112.3	I422 M423 K428 I429 L430 L438 L441 Q484 I486 L494 L553 L569	I422-W426 PolarHBondContact O-N 3.29Å; M423-W426 PolarHBondContact O-N 3.38Å; W426-K428 VanDerWaalsContact C-N 3.31Å; W426-K428 PolarHBondContact O-N 3.15Å; W426-I429 HydrophobicContact CE3-CD1 4.42Å; W426-I429 HydrophobicContact CE3-CG2 4.5Å; W426-I429 HydrophobicContact CZ3-CG2 4.43Å; W426-I429 PolarHBondContact O-N 3.44Å; W426-L430 HydrophobicContact CE3-CG 4.44Å; W426-L430 WeakPolarHBondContact O-CB 3.15Å; W426-L430 WeakPolarHBondContact O-CG 3.27Å; W426-L430 PolarHBondContact O-N 3.49Å; W426-L438 HydrophobicContact CH2-CD1 3.59Å; W426-L438 HydrophobicContact CZ2-CD1 4.34Å; W426-L438 HydrophobicContact CZ3-CD1 4.08Å; W426-L441 HydrophobicContact CZ2-CD2 3.86Å; W426-Q484 VanDerWaalsContact CZ2-NE2 3.34Å; W426-I486 HydrophobicContact CG-CD1 4.2Å; W426-L494 HydrophobicContact CB-CD1 4.06Å; W426-L494 HydrophobicContact CB-CD2 3.66Å; W426-L494 HydrophobicContact CG-CD2 4.4Å; W426-L553 HydrophobicContact CD2-CD1 3.9Å; W426-L553 VanDerWaalsContact CE2-CD1 3.49Å; W426-L553 HydrophobicContact CE3-CD1 4.04Å; W426-L553 HydrophobicContact CH2-CD1 3.47Å; W426-L553 VanDerWaalsContact CH2-CD1 3.47Å; W426-L553 HydrophobicContact CZ2-CD1 3.31Å; W426-L553 HydrophobicContact CZ3-CD1 3.83Å; W426-L569 HydrophobicContact CH2-CD2 4.03Å
427	R	72.7	Confident	62.3	Low	92 Å²	92	54.4 Å²	54.4	35%	0.347	29%	0.289	S	S	.	.	H	α-helix	trans	-57.8	-47	172.9	-169.3	-170.6	-66.7	-133	5.3	109.8	M423 S424 I425 L431 L494 D497	M423-R427 VanDerWaalsContact O-CB 3.25Å; M423-R427 WeakPolarHBondContact O-CB 3.45Å; M423-R427 PolarHBondContact O-N 3.25Å; S424-R427 WeakPolarHBondContact O-CB 3.48Å; S424-R427 PolarHBondContact O-N 3.38Å; I425-R427 PolarHBondContact O-N 3.37Å; R427-L431 HydrophobicContact CG-CD1 3.57Å; R427-L431 HydrophobicContact CG-CG 4.3Å; R427-L431 WeakPolarHBondContact O-CB 3.38Å; R427-L431 WeakPolarHBondContact O-CD1 3.3Å; R427-L431 WeakPolarHBondContact O-CG 3.32Å; R427-L431 PolarHBondContact O-N 2.91Å; R427-L494 HydrophobicContact CB-CD1 3.83Å; R427-L494 HydrophobicContact CG-CD1 4.49Å; R427-D497 HydrophobicContact CG-CB 4.38Å; R427-D497 IonicContact CZ-OD1 2.85Å; R427-D497 IonicContact CZ-OD2 3.06Å; R427-D497 IonicContact NE-OD2 2.74Å; R427-D497 PolarHBondContact NE-OD2 3Å; R427-D497 IonicContact NH1-OD1 3.73Å; R427-D497 PolarHBondContact NH1-OD1 2.87Å; R427-D497 IonicContact NH1-OD2 3.42Å; R427-D497 IonicContact NH2-OD1 3.8Å; R427-D497 PolarHBondContact NH2-OD1 3.34Å; R427-D497 IonicContact NH2-OD2 2.73Å; R427-D497 PolarHBondContact NH2-OD2 2.81Å
428	K	70.3	Confident	64	Low	115 Å²	115	49.7 Å²	49.7	50%	0.5	26%	0.26	S	S	.	.	H	α-helix	trans	-66.1	-40.4	177.1	-164.9	172.3	-176.8	-179.9	0	113.2	S424 I425 W426 N432 L437	S424-K428 PolarHBondContact O-N 3.15Å; I425-K428 CarbonylContact O-C 3.55Å; I425-K428 WeakPolarHBondContact O-CA 3.25Å; I425-K428 WeakPolarHBondContact O-CB 3.44Å; I425-K428 PolarHBondContact O-N 3.25Å; W426-K428 VanDerWaalsContact C-N 3.31Å; W426-K428 PolarHBondContact O-N 3.15Å; K428-N432 WeakPolarHBondContact O-CB 3.48Å; K428-N432 PolarHBondContact O-N 3Å; K428-L437 HydrophobicContact CB-CD2 4.04Å; K428-L437 HydrophobicContact CD-CD2 4.06Å; K428-L437 HydrophobicContact CG-CD2 3.94Å
429	I	71.3	Confident	65.5	Low	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.9	-50.5	177.7	-67.4	169.3	0	0	0	110.5	I425 W426 D433 N434 L437 L438 L441 V565	I425-I429 HydrophobicContact CG2-CD1 3.84Å; I425-I429 HydrophobicContact CG2-CG1 4.27Å; I425-I429 WeakPolarHBondContact O-CG1 3.48Å; I425-I429 PolarHBondContact O-N 3Å; W426-I429 HydrophobicContact CE3-CD1 4.42Å; W426-I429 HydrophobicContact CE3-CG2 4.5Å; W426-I429 HydrophobicContact CZ3-CG2 4.43Å; W426-I429 PolarHBondContact O-N 3.44Å; I429-D433 WeakPolarHBondContact O-CA 3.29Å; I429-D433 PolarHBondContact O-N 3.28Å; I429-N434 PolarHBondContact O-N 2.79Å; I429-L437 HydrophobicContact CD1-CD2 4.5Å; I429-L437 HydrophobicContact CD1-CG 4.19Å; I429-L437 HydrophobicContact CG1-CB 4.11Å; I429-L437 HydrophobicContact CG1-CD2 3.55Å; I429-L437 HydrophobicContact CG1-CG 3.62Å; I429-L438 HydrophobicContact CD1-CB 4.37Å; I429-L438 HydrophobicContact CD1-CD1 4.23Å; I429-L438 HydrophobicContact CG2-CB 4.21Å; I429-L441 HydrophobicContact CD1-CD2 4.3Å; I429-V565 HydrophobicContact CG2-CG1 4.42Å; I429-V565 HydrophobicContact CG2-CG2 4.09Å
430	L	73.2	Confident	66.7	Low	3 Å²	3	47.3 Å²	47.3	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-74.3	-32.7	-176.5	-67	176	0	0	0	112.9	W426 L494 L556 A557 R562 V565	W426-L430 HydrophobicContact CE3-CG 4.44Å; W426-L430 WeakPolarHBondContact O-CB 3.15Å; W426-L430 WeakPolarHBondContact O-CG 3.27Å; W426-L430 PolarHBondContact O-N 3.49Å; L430-L494 HydrophobicContact CD1-CD1 4.34Å; L430-L494 HydrophobicContact CD1-CD2 3.64Å; L430-L494 HydrophobicContact CD1-CG 3.86Å; L430-L556 HydrophobicContact CD1-CD2 3.76Å; L430-L556 HydrophobicContact CD1-CG 4.28Å; L430-A557 HydrophobicContact CD2-CB 4Å; L430-R562 WeakPolarHBondContact O-CG 3.09Å; L430-R562 PolarHBondContact O-NE 2.94Å; L430-V565 HydrophobicContact CD2-CG1 4.29Å
431	L	71	Confident	67.8	Low	33 Å²	33	44.1 Å²	44.1	17%	0.173	22%	0.222	C	C	.	.	H	α-helix	trans	-73	-37.7	176.4	-73.8	172.8	0	0	0	112.8	R427 N501 T503 R562	R427-L431 HydrophobicContact CG-CD1 3.57Å; R427-L431 HydrophobicContact CG-CG 4.3Å; R427-L431 WeakPolarHBondContact O-CB 3.38Å; R427-L431 WeakPolarHBondContact O-CD1 3.3Å; R427-L431 WeakPolarHBondContact O-CG 3.32Å; R427-L431 PolarHBondContact O-N 2.91Å; L431-N501 HydrophobicContact CD2-CB 3.41Å; L431-N501 VanDerWaalsContact CD2-CB 3.41Å; L431-T503 HydrophobicContact CD2-CG2 4.4Å; L431-R562 PolarHBondContact O-NH2 3.14Å
432	N	67.9	Low	68	Low	102 Å²	102	44.2 Å²	44.2	55%	0.545	22%	0.219	S	C	.	.	H	α-helix	trans	-100.5	0.5	-174.5	-64.1	-0.1	0	0	0	113.4	K428 N434	K428-N432 WeakPolarHBondContact O-CB 3.48Å; K428-N432 PolarHBondContact O-N 3Å; N432-N434 HydrophobicContact CB-CB 4.12Å; N432-N434 PolarHBondContact O-N 3.12Å; N432-N434 VanDerWaalsContact O-N 3.15Å
433	D	68.9	Low	67.8	Low	35 Å²	35	44.8 Å²	44.8	19%	0.187	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	37.2	-170.7	-158.5	26.4	0	0	0	111.7	I429 V435 R564 V565	I429-D433 WeakPolarHBondContact O-CA 3.29Å; I429-D433 PolarHBondContact O-N 3.28Å; D433-V435 PolarHBondContact O-N 3.22Å; D433-V435 VanDerWaalsContact O-N 3.08Å; D433-R564 WeakPolarHBondContact OD2-CD 3.25Å; D433-V565 VanDerWaalsContact OD1-CG2 3.23Å; D433-V565 WeakPolarHBondContact OD1-CG2 3.33Å; D433-V565 PolarHBondContact OD1-N 3.4Å
434	N	69.3	Low	67.2	Low	48 Å²	48	46.6 Å²	46.6	26%	0.257	24%	0.236	S	C	.	.			trans	-83.6	92.2	-168.6	-169.5	-27.7	0	0	0	110.3	I429 N432 E436 L437 L438	I429-N434 PolarHBondContact O-N 2.79Å; N432-N434 HydrophobicContact CB-CB 4.12Å; N432-N434 PolarHBondContact O-N 3.12Å; N432-N434 VanDerWaalsContact O-N 3.15Å; N434-E436 VanDerWaalsContact C-N 3.35Å; N434-E436 PolarHBondContact OD1-N 3.29Å; N434-L437 HydrophobicContact CB-CB 3.96Å; N434-L437 VanDerWaalsContact CG-CB 3.49Å; N434-L437 PolarHBondContact O-N 3.34Å; N434-L437 WeakPolarHBondContact OD1-CB 3.41Å; N434-L437 PolarHBondContact OD1-N 3.3Å; N434-L438 PolarHBondContact O-N 2.81Å
435	V	71.3	Confident	66.9	Low	41 Å²	41	46.5 Å²	46.5	25%	0.248	23%	0.233	C	C	.	.	H	α-helix	trans	-65.2	-37.6	-179.1	-177.4	0	0	0	0	111.6	D433 L437 L438 E439 R564 Q568	D433-V435 PolarHBondContact O-N 3.22Å; D433-V435 VanDerWaalsContact O-N 3.08Å; V435-L437 PolarHBondContact O-N 2.74Å; V435-L438 WeakPolarHBondContact O-CB 3.28Å; V435-L438 PolarHBondContact O-N 2.85Å; V435-L438 VanDerWaalsContact O-N 3.14Å; V435-E439 WeakPolarHBondContact O-CG 3.22Å; V435-E439 PolarHBondContact O-N 3.16Å; V435-R564 HydrophobicContact CG2-CB 4.01Å; V435-Q568 HydrophobicContact CG1-CB 4.21Å; V435-Q568 HydrophobicContact CG1-CG 4.07Å
436	E	67.2	Low	66.4	Low	145 Å²	145	48.7 Å²	48.7	68%	0.678	25%	0.251	S	S	*	.	H	α-helix	trans	-64.3	-41.6	179.1	-61.9	172.5	-174.3	0	0	111.5	N434 L438 E439 T440	N434-E436 VanDerWaalsContact C-N 3.35Å; N434-E436 PolarHBondContact OD1-N 3.29Å; E436-L438 VanDerWaalsContact C-N 3.26Å; E436-L438 PolarHBondContact O-N 2.77Å; E436-E439 PolarHBondContact O-N 3.42Å; E436-T440 WeakPolarHBondContact O-CG2 3.26Å; E436-T440 PolarHBondContact O-N 2.64Å; E436-T440 PolarHBondContact O-OG1 3.02Å; E436-T440 VanDerWaalsContact O-OG1 3.11Å
437	L	66.6	Low	65.1	Low	17 Å²	17	55 Å²	55	9%	0.089	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-35.2	174.8	-177.6	61	0	0	0	111.9	I391 I425 K428 I429 N434 V435 T440 L441	I391-L437 HydrophobicContact CD1-CD1 3.16Å; I391-L437 HydrophobicContact CG1-CD1 4.11Å; I425-L437 HydrophobicContact CG2-CD2 4.41Å; I425-L437 HydrophobicContact CG2-CG 4.44Å; K428-L437 HydrophobicContact CB-CD2 4.04Å; K428-L437 HydrophobicContact CD-CD2 4.06Å; K428-L437 HydrophobicContact CG-CD2 3.94Å; I429-L437 HydrophobicContact CD1-CD2 4.5Å; I429-L437 HydrophobicContact CD1-CG 4.19Å; I429-L437 HydrophobicContact CG1-CB 4.11Å; I429-L437 HydrophobicContact CG1-CD2 3.55Å; I429-L437 HydrophobicContact CG1-CG 3.62Å; N434-L437 HydrophobicContact CB-CB 3.96Å; N434-L437 VanDerWaalsContact CG-CB 3.49Å; N434-L437 PolarHBondContact O-N 3.34Å; N434-L437 WeakPolarHBondContact OD1-CB 3.41Å; N434-L437 PolarHBondContact OD1-N 3.3Å; V435-L437 PolarHBondContact O-N 2.74Å; L437-T440 WeakPolarHBondContact CA-OG1 3.42Å; L437-T440 PolarHBondContact O-OG1 2.9Å; L437-L441 VanDerWaalsContact O-CB 3.28Å; L437-L441 WeakPolarHBondContact O-CB 3.38Å; L437-L441 PolarHBondContact O-N 3.1Å
438	L	67.4	Low	63.9	Low	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-70	-39.5	174.9	180	67.8	0	0	0	111.8	W426 I429 N434 V435 E436 L441 R442 F480 V565 Q568 L569 M572	W426-L438 HydrophobicContact CH2-CD1 3.59Å; W426-L438 HydrophobicContact CZ2-CD1 4.34Å; W426-L438 HydrophobicContact CZ3-CD1 4.08Å; I429-L438 HydrophobicContact CD1-CB 4.37Å; I429-L438 HydrophobicContact CD1-CD1 4.23Å; I429-L438 HydrophobicContact CG2-CB 4.21Å; N434-L438 PolarHBondContact O-N 2.81Å; V435-L438 WeakPolarHBondContact O-CB 3.28Å; V435-L438 PolarHBondContact O-N 2.85Å; V435-L438 VanDerWaalsContact O-N 3.14Å; E436-L438 VanDerWaalsContact C-N 3.26Å; E436-L438 PolarHBondContact O-N 2.77Å; L438-L441 HydrophobicContact CD1-CD2 4.46Å; L438-L441 PolarHBondContact O-N 3.48Å; L438-R442 PolarHBondContact O-N 3.43Å; L438-F480 HydrophobicContact CD1-CE1 4.46Å; L438-F480 HydrophobicContact CD1-CZ 4.29Å; L438-V565 HydrophobicContact CD2-CG1 4.23Å; L438-Q568 HydrophobicContact CD2-CB 4.04Å; L438-Q568 HydrophobicContact CD2-CG 3.95Å; L438-L569 HydrophobicContact CD1-CD2 4.05Å; L438-L569 HydrophobicContact CD2-CD2 3.97Å; L438-L569 HydrophobicContact CD2-CG 4.09Å; L438-M572 HydrophobicContact CD1-SD 4.43Å; L438-M572 HydrophobicContact CD2-CE 4.06Å; L438-M572 HydrophobicContact CD2-SD 4.27Å; L438-M572 HydrophobicContact CG-CE 3.72Å; L438-M572 HydrophobicContact CG-SD 4.08Å
439	E	64.9	Low	62.9	Low	68 Å²	68	53.3 Å²	53.3	32%	0.318	27%	0.269	S	S	.	.	H	α-helix	trans	-65.2	-43.1	176.2	-70.7	-173.9	168.3	0	0	112.2	V435 E436 R442 D443 Q568 M572	V435-E439 WeakPolarHBondContact O-CG 3.22Å; V435-E439 PolarHBondContact O-N 3.16Å; E436-E439 PolarHBondContact O-N 3.42Å; E439-R442 WeakPolarHBondContact O-CB 3.42Å; E439-R442 PolarHBondContact O-N 3.02Å; E439-D443 VanDerWaalsContact O-CG 3.26Å; E439-D443 PolarHBondContact O-N 2.9Å; E439-Q568 PolarHBondContact OE1-NE2 2.85Å; E439-M572 HydrophobicContact CG-CE 4.19Å
440	T	60.5	Low	61.5	Low	66 Å²	66	56.5 Å²	56.5	41%	0.405	29%	0.292	S	S	.	.	H	α-helix	trans	-66.3	-38.5	175.3	54.3	0	0	0	0	112.4	E436 L437 R442 D443 S444	E436-T440 WeakPolarHBondContact O-CG2 3.26Å; E436-T440 PolarHBondContact O-N 2.64Å; E436-T440 PolarHBondContact O-OG1 3.02Å; E436-T440 VanDerWaalsContact O-OG1 3.11Å; L437-T440 WeakPolarHBondContact CA-OG1 3.42Å; L437-T440 PolarHBondContact O-OG1 2.9Å; T440-R442 VanDerWaalsContact C-N 3.29Å; T440-R442 PolarHBondContact O-N 3.42Å; T440-D443 PolarHBondContact O-N 3.28Å; T440-S444 WeakPolarHBondContact O-CB 3.44Å; T440-S444 PolarHBondContact O-N 2.87Å; T440-S444 PolarHBondContact O-OG 3.01Å
441	L	65.4	Low	59.8	Low	13 Å²	13	60.9 Å²	60.9	7%	0.068	31%	0.31	C	S	.	.	H	α-helix	trans	-60.9	-39.3	172	-172.8	103.1	0	0	0	111.3	I425 W426 I429 L437 L438 S444 M445 F480	I425-L441 HydrophobicContact CB-CD1 4.4Å; I425-L441 HydrophobicContact CD1-CD1 4.09Å; I425-L441 HydrophobicContact CG2-CD1 3.64Å; W426-L441 HydrophobicContact CZ2-CD2 3.86Å; I429-L441 HydrophobicContact CD1-CD2 4.3Å; L437-L441 VanDerWaalsContact O-CB 3.28Å; L437-L441 WeakPolarHBondContact O-CB 3.38Å; L437-L441 PolarHBondContact O-N 3.1Å; L438-L441 HydrophobicContact CD1-CD2 4.46Å; L438-L441 PolarHBondContact O-N 3.48Å; L441-S444 WeakPolarHBondContact CA-OG 3.37Å; L441-S444 PolarHBondContact O-OG 2.91Å; L441-M445 HydrophobicContact CD1-CE 4.46Å; L441-M445 HydrophobicContact CD2-CE 3.27Å; L441-M445 HydrophobicContact CG-CE 3.56Å; L441-M445 PolarHBondContact O-N 3.41Å; L441-M445 VanDerWaalsContact O-N 3.12Å; L441-F480 HydrophobicContact CD2-CZ 4.08Å
442	R	64.2	Low	58.2	Low	47 Å²	47	63 Å²	63	18%	0.177	33%	0.328	C	S	.	.	H	α-helix	trans	-61.8	-51.6	173.3	176.4	-159	68	-151.6	-6.4	111.9	L438 E439 T440 S444 M445 A446 F480 M572	L438-R442 PolarHBondContact O-N 3.43Å; E439-R442 WeakPolarHBondContact O-CB 3.42Å; E439-R442 PolarHBondContact O-N 3.02Å; T440-R442 VanDerWaalsContact C-N 3.29Å; T440-R442 PolarHBondContact O-N 3.42Å; R442-S444 VanDerWaalsContact C-N 3.31Å; R442-S444 PolarHBondContact O-N 3.49Å; R442-M445 PolarHBondContact O-N 3.47Å; R442-A446 WeakPolarHBondContact O-CB 3.48Å; R442-A446 PolarHBondContact O-N 3.26Å; R442-F480 HydrophobicContact CB-CE2 3.87Å; R442-F480 HydrophobicContact CB-CZ 4.25Å; R442-F480 HydrophobicContact CG-CD2 4.42Å; R442-F480 HydrophobicContact CG-CE2 4.26Å; R442-M572 HydrophobicContact CB-CE 3.85Å; R442-M572 HydrophobicContact CB-SD 4.1Å; R442-M572 HydrophobicContact CG-CE 4.28Å; R442-M572 HydrophobicContact CG-SD 4.27Å
443	D	58.5	Low	56.6	Low	58 Å²	58	64.8 Å²	64.8	31%	0.31	34%	0.338	S	S	.	.	H	α-helix	trans	-66.1	-37.3	-174.2	-63	-12.4	0	0	0	111.1	E439 T440 A446 W447	E439-D443 VanDerWaalsContact O-CG 3.26Å; E439-D443 PolarHBondContact O-N 2.9Å; T440-D443 PolarHBondContact O-N 3.28Å; D443-A446 PolarHBondContact O-N 3.3Å; D443-W447 WeakPolarHBondContact O-CB 3.39Å; D443-W447 PolarHBondContact O-N 2.69Å
444	S	55.3	Low	54.7	Low	50 Å²	50	67.8 Å²	67.8	35%	0.35	36%	0.357	S	S	.	.	H	α-helix	trans	-65.3	-39.9	173.6	57.4	0	0	0	0	113.4	T440 L441 R442 R448	T440-S444 WeakPolarHBondContact O-CB 3.44Å; T440-S444 PolarHBondContact O-N 2.87Å; T440-S444 PolarHBondContact O-OG 3.01Å; L441-S444 WeakPolarHBondContact CA-OG 3.37Å; L441-S444 PolarHBondContact O-OG 2.91Å; R442-S444 VanDerWaalsContact C-N 3.31Å; R442-S444 PolarHBondContact O-N 3.49Å; S444-R448 PolarHBondContact O-N 3.01Å; S444-R448 VanDerWaalsContact O-N 3.1Å
445	M	59.3	Low	52.9	Low	34 Å²	34	70.3 Å²	70.3	17%	0.167	38%	0.379	C	S	.	.	H	α-helix	trans	-68	-42.5	174.3	-81.8	-165.1	-102.7	0	0	112.6	L441 R442 W447 R448 Q449 F480 A483 Q484	L441-M445 HydrophobicContact CD1-CE 4.46Å; L441-M445 HydrophobicContact CD2-CE 3.27Å; L441-M445 HydrophobicContact CG-CE 3.56Å; L441-M445 PolarHBondContact O-N 3.41Å; L441-M445 VanDerWaalsContact O-N 3.12Å; R442-M445 PolarHBondContact O-N 3.47Å; M445-W447 VanDerWaalsContact C-N 3.28Å; M445-W447 PolarHBondContact O-N 3.27Å; M445-R448 WeakPolarHBondContact O-CB 3.49Å; M445-R448 PolarHBondContact O-N 3.46Å; M445-R448 VanDerWaalsContact O-N 3.11Å; M445-Q449 PolarHBondContact O-N 2.89Å; M445-Q449 VanDerWaalsContact O-N 3.13Å; M445-F480 HydrophobicContact CE-CD2 3.95Å; M445-F480 HydrophobicContact CE-CE2 3.18Å; M445-F480 HydrophobicContact CE-CZ 3.7Å; M445-F480 HydrophobicContact SD-CD2 4.24Å; M445-F480 HydrophobicContact SD-CE2 4.03Å; M445-A483 HydrophobicContact SD-CB 3.89Å; M445-Q484 HydrophobicContact CE-CG 3.92Å; M445-Q484 HydrophobicContact SD-CG 4.12Å
446	A	55.4	Low	50.8	Low	53 Å²	53	74.7 Å²	74.7	44%	0.438	41%	0.406	S	S	.	.	H	α-helix	trans	-61.1	-39.6	176.9	0	0	0	0	0	111.4	R442 D443 Q449 S450	R442-A446 WeakPolarHBondContact O-CB 3.48Å; R442-A446 PolarHBondContact O-N 3.26Å; D443-A446 PolarHBondContact O-N 3.3Å; A446-Q449 PolarHBondContact O-N 2.93Å; A446-S450 PolarHBondContact O-N 3.19Å
447	W	46.9	Very low	49.1	Very low	136 Å²	136	74.8 Å²	74.8	52%	0.515	41%	0.41	S	S	.	.	H	α-helix	trans	-64.8	-36.3	173.5	-173.2	87.1	0	0	0	112.9	D443 M445 Q449 S450 K451	D443-W447 WeakPolarHBondContact O-CB 3.39Å; D443-W447 PolarHBondContact O-N 2.69Å; M445-W447 VanDerWaalsContact C-N 3.28Å; M445-W447 PolarHBondContact O-N 3.27Å; W447-Q449 PolarHBondContact O-N 3.22Å; W447-S450 PolarHBondContact O-N 3.5Å; W447-S450 PolarHBondContact O-OG 2.99Å; W447-K451 HydrophobicContact CH2-CD 3.89Å; W447-K451 HydrophobicContact CZ2-CD 4.44Å; W447-K451 HydrophobicContact CZ3-CD 4.08Å; W447-K451 PolarHBondContact O-N 3.36Å
448	R	47.3	Very low	47.4	Very low	99 Å²	99	79.6 Å²	79.6	37%	0.374	44%	0.443	S	S	.	.	H	α-helix	trans	-63.5	-41.6	175.8	-161.8	177.3	-169	-161.9	-0	112.1	M398 D399 S444 M445 S450 K451	M398-R448 PolarHBondContact O-NH2 2.85Å; M398-R448 VanDerWaalsContact O-NH2 3.12Å; M398-R448 PolarHBondContact SD-NH1 3.08Å; D399-R448 IonicContact OD1-CZ 3.97Å; D399-R448 IonicContact OD1-NH2 3.02Å; D399-R448 PolarHBondContact OD1-NH2 3.25Å; S444-R448 PolarHBondContact O-N 3.01Å; S444-R448 VanDerWaalsContact O-N 3.1Å; M445-R448 WeakPolarHBondContact O-CB 3.49Å; M445-R448 PolarHBondContact O-N 3.46Å; M445-R448 VanDerWaalsContact O-N 3.11Å; R448-S450 VanDerWaalsContact C-N 3.33Å; R448-S450 PolarHBondContact O-N 3.31Å; R448-K451 PolarHBondContact O-N 3.35Å
449	Q	48.9	Very low	45.4	Very low	71 Å²	71	85.9 Å²	85.9	33%	0.332	47%	0.473	S	S	.	.	H	α-helix	trans	-66.6	-31.4	178.6	-70.4	-177.8	-15.6	0	0	113.1	M445 A446 W447 S452 D478	M445-Q449 PolarHBondContact O-N 2.89Å; M445-Q449 VanDerWaalsContact O-N 3.13Å; A446-Q449 PolarHBondContact O-N 2.93Å; W447-Q449 PolarHBondContact O-N 3.22Å; Q449-S452 PolarHBondContact O-OG 3.32Å; Q449-S452 VanDerWaalsContact O-OG 3.14Å; Q449-D478 PolarHBondContact NE2-O 3.4Å
450	S	42.1	Very low	43.7	Very low	68 Å²	68	88.2 Å²	88.2	48%	0.476	49%	0.488	S	S	.	.	H	α-helix	trans	-71.7	-31.5	177	68.7	0	0	0	0	112.3	A446 W447 R448	A446-S450 PolarHBondContact O-N 3.19Å; W447-S450 PolarHBondContact O-N 3.5Å; W447-S450 PolarHBondContact O-OG 2.99Å; R448-S450 VanDerWaalsContact C-N 3.33Å; R448-S450 PolarHBondContact O-N 3.31Å
451	K	37.1	Very low	42.2	Very low	94 Å²	94	92.9 Å²	92.9	41%	0.409	50%	0.503	S	S	.	.	H	α-helix	trans	-71.2	-35.3	-177.1	-155.7	176.3	-173.7	-178.3	0	113.4	W447 R448 N453 T454	W447-K451 HydrophobicContact CH2-CD 3.89Å; W447-K451 HydrophobicContact CZ2-CD 4.44Å; W447-K451 HydrophobicContact CZ3-CD 4.08Å; W447-K451 PolarHBondContact O-N 3.36Å; R448-K451 PolarHBondContact O-N 3.35Å; K451-N453 PolarHBondContact O-N 2.98Å; K451-T454 PolarHBondContact O-N 3.2Å; K451-T454 VanDerWaalsContact O-N 3.16Å; K451-T454 PolarHBondContact O-OG1 2.93Å
452	S	37	Very low	40.7	Very low	79 Å²	79	96 Å²	96	55%	0.552	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.6	-179.5	59.6	0	0	0	0	113.7	Q449 T454	Q449-S452 PolarHBondContact O-OG 3.32Å; Q449-S452 VanDerWaalsContact O-OG 3.14Å; S452-T454 VanDerWaalsContact C-N 3.28Å; S452-T454 PolarHBondContact O-N 3.14Å
453	N	35.7	Very low	39.3	Very low	139 Å²	139	101.3 Å²	101.3	74%	0.743	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-4.7	179	-68.3	-15	0	0	0	113.7	K451	K451-N453 PolarHBondContact O-N 2.98Å
454	T	28.8	Very low	37.9	Very low	98 Å²	98	102.8 Å²	102.8	60%	0.601	56%	0.557	S	S	*	*			trans	-117	52.1	179	34	0	0	0	0	110.8	K451 S452 T456	K451-T454 PolarHBondContact O-N 3.2Å; K451-T454 VanDerWaalsContact O-N 3.16Å; K451-T454 PolarHBondContact O-OG1 2.93Å; S452-T454 VanDerWaalsContact C-N 3.28Å; S452-T454 PolarHBondContact O-N 3.14Å; T454-T456 PolarHBondContact O-N 3.47Å
455	S	31.7	Very low	36.8	Very low	100 Å²	100	104.2 Å²	104.2	70%	0.699	57%	0.567	S	S	*	*			trans	-82.3	88.2	164.2	55.9	0	0	0	0	109.2	L457	S455-L457 VanDerWaalsContact C-N 3.34Å; S455-L457 PolarHBondContact O-N 3.46Å
456	T	27.4	Very low	35.5	Very low	133 Å²	133	109.7 Å²	109.7	82%	0.816	60%	0.597	S	S	*	*			trans	-65.5	87.4	168.8	52.4	0	0	0	0	109.9	T454	T454-T456 PolarHBondContact O-N 3.47Å
457	L	29.5	Very low	34.1	Very low	147 Å²	147	111 Å²	111	77%	0.77	60%	0.603	S	S	*	*			trans	-111	127.5	157.5	-92	146.8	0	0	0	107.1	S455 M459	S455-L457 VanDerWaalsContact C-N 3.34Å; S455-L457 PolarHBondContact O-N 3.46Å; L457-M459 PolarHBondContact O-N 3.34Å
458	P	31.2	Very low	33.1	Very low	119 Å²	119	111.2 Å²	111.2	77%	0.773	61%	0.613	S	S	*	*			trans	-66.9	106.1	-176	27.9	-30.8	0	0	0	107.8	D460	P458-D460 PolarHBondContact O-N 3.37Å; P458-D460 VanDerWaalsContact O-N 3.1Å
459	M	26.9	Very low	32.1	Very low	132 Å²	132	112.1 Å²	112.1	65%	0.65	63%	0.63	S	S	*	*			trans	-65.2	111	170.4	-94.7	-156.5	-74.7	0	0	108.1	L457 F461 I464	L457-M459 PolarHBondContact O-N 3.34Å; M459-F461 VanDerWaalsContact O-CD2 3.23Å; M459-F461 WeakPolarHBondContact O-CD2 3.19Å; M459-F461 PolarHBondContact O-N 3.11Å; M459-I464 HydrophobicContact SD-CD1 3.86Å
460	D	28.4	Very low	30.9	Very low	117 Å²	117	116.8 Å²	116.8	63%	0.626	65%	0.653	S	S	*	*			trans	-68.5	95.4	169.1	-151	-16.4	0	0	0	107.5	P458 S462 K463	P458-D460 PolarHBondContact O-N 3.37Å; P458-D460 VanDerWaalsContact O-N 3.1Å; D460-S462 PolarHBondContact O-N 3.08Å; D460-S462 PolarHBondContact OD1-OG 2.96Å; D460-K463 PolarHBondContact O-N 3.34Å
461	F	29.5	Very low	30.1	Very low	163 Å²	163	118.5 Å²	118.5	72%	0.715	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-59.7	-10.3	-173.4	-83.2	-86.4	0	0	0	113.7	M459 K463 I464	M459-F461 VanDerWaalsContact O-CD2 3.23Å; M459-F461 WeakPolarHBondContact O-CD2 3.19Å; M459-F461 PolarHBondContact O-N 3.11Å; F461-K463 VanDerWaalsContact C-N 3.31Å; F461-K463 PolarHBondContact O-N 3.44Å; F461-I464 HydrophobicContact CD1-CD1 3.94Å; F461-I464 HydrophobicContact CE1-CD1 4.31Å
462	S	33.4	Very low	29.5	Very low	78 Å²	78	120 Å²	120	55%	0.545	68%	0.68	S	S	.	*	G	3₁₀ helix	trans	-70.7	-19.9	176.5	60.8	0	0	0	0	114.3	D460	D460-S462 PolarHBondContact O-N 3.08Å; D460-S462 PolarHBondContact OD1-OG 2.96Å
463	K	34.5	Very low	29	Very low	160 Å²	160	123.1 Å²	123.1	70%	0.696	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-96.4	-0.7	179.7	-71.6	-175.4	178.8	175.7	0	114.8	D460 F461	D460-K463 PolarHBondContact O-N 3.34Å; F461-K463 VanDerWaalsContact C-N 3.31Å; F461-K463 PolarHBondContact O-N 3.44Å
464	I	29.2	Very low	28.7	Very low	88 Å²	88	124.9 Å²	124.9	45%	0.451	69%	0.694	S	S	.	*	S	Bend	trans	-83.9	-16.9	-177.8	-61.1	177	0	0	0	111.9	M459 F461 D466	M459-I464 HydrophobicContact SD-CD1 3.86Å; F461-I464 HydrophobicContact CD1-CD1 3.94Å; F461-I464 HydrophobicContact CE1-CD1 4.31Å; I464-D466 VanDerWaalsContact C-N 3.34Å; I464-D466 PolarHBondContact O-N 2.87Å
465	S	33.1	Very low	28.6	Very low	81 Å²	81	128 Å²	128	57%	0.566	71%	0.706	S	S	*	*	S	Bend	trans	-70.6	-28.5	175.4	61.4	0	0	0	0	113.6
466	D	30.6	Very low	28.7	Very low	148 Å²	148	127.3 Å²	127.3	79%	0.791	70%	0.7	S	S	*	*	S	Bend	trans	-105.7	2.3	-165.1	-70.2	10.5	0	0	0	114.2	I464	I464-D466 VanDerWaalsContact C-N 3.34Å; I464-D466 PolarHBondContact O-N 2.87Å
467	S	26.9	Very low	29	Very low	81 Å²	81	127.1 Å²	127.1	57%	0.566	69%	0.694	S	S	*	*			trans	-131.9	57	178.5	57.7	0	0	0	0	112.7	T469	S467-T469 PolarHBondContact O-N 3.03Å
468	I	26	Very low	29.7	Very low	141 Å²	141	123.5 Å²	123.5	72%	0.723	68%	0.675	S	S	*	*			trans	-70.8	74.3	162.6	-55.2	174.9	0	0	0	108.6
469	T	26.6	Very low	30.7	Very low	118 Å²	118	118.7 Å²	118.7	72%	0.724	64%	0.643	S	S	*	*			trans	-143.4	95.9	157.9	43.4	0	0	0	0	107.8	S467 P471	S467-T469 PolarHBondContact O-N 3.03Å; T469-P471 VanDerWaalsContact O-CD 3.3Å; T469-P471 WeakPolarHBondContact O-CD 3.26Å
470	M	23.6	Very low	32.1	Very low	168 Å²	168	113.4 Å²	113.4	83%	0.828	62%	0.616	S	S	*	*			trans	-47.9	114.6	-176.4	-66.1	-80.8	143.5	0	0	113.5
471	P	25.1	Very low	33.4	Very low	104 Å²	104	109 Å²	109	68%	0.675	59%	0.592	S	S	*	*			trans	-88.4	119.6	157.5	15.8	2.7	0	0	0	108.6	T469 D473	T469-P471 VanDerWaalsContact O-CD 3.3Å; T469-P471 WeakPolarHBondContact O-CD 3.26Å; P471-D473 PolarHBondContact O-N 3.2Å
472	T	24.3	Very low	34.6	Very low	125 Å²	125	103 Å²	103	77%	0.767	57%	0.569	S	S	*	*			trans	-71.1	90.1	173.1	49.4	0	0	0	0	109.8
473	D	27.5	Very low	35.5	Very low	146 Å²	146	101 Å²	101	78%	0.781	56%	0.558	S	S	*	*			trans	-76.9	131.9	174	-80.8	-28	0	0	0	111.8	P471 I475	P471-D473 PolarHBondContact O-N 3.2Å; D473-I475 PolarHBondContact O-N 3.31Å
474	H	27.9	Very low	36.7	Very low	175 Å²	175	94 Å²	94	81%	0.81	53%	0.527	S	S	*	.			trans	-71.4	113.7	-171.6	-76.1	-91.3	0	0	0	112.1	S476	H474-S476 PolarHBondContact O-N 3.32Å
475	I	26.9	Very low	38.1	Very low	165 Å²	165	98.1 Å²	98.1	85%	0.846	54%	0.544	S	S	*	.			trans	-75	99.7	163.4	-59.5	168	0	0	0	107.7	D473 L477	D473-I475 PolarHBondContact O-N 3.31Å; I475-L477 PolarHBondContact O-N 2.75Å
476	S	34.9	Very low	39.7	Very low	84 Å²	84	95.9 Å²	95.9	59%	0.587	53%	0.526	S	S	*	.			trans	-81.1	94	176.7	57.7	0	0	0	0	110.9	H474 D478	H474-S476 PolarHBondContact O-N 3.32Å; S476-D478 VanDerWaalsContact C-N 3.25Å; S476-D478 PolarHBondContact O-N 3.3Å
477	L	33.8	Very low	41.5	Very low	129 Å²	129	91.5 Å²	91.5	68%	0.675	51%	0.507	S	S	*	.			trans	-76.7	76.4	169.1	-163.1	88.1	0	0	0	109	I475 D479 F575	I475-L477 PolarHBondContact O-N 2.75Å; L477-D479 PolarHBondContact O-N 3.28Å; L477-F575 HydrophobicContact CD2-CE1 3.87Å; L477-F575 HydrophobicContact CD2-CE2 4.4Å; L477-F575 HydrophobicContact CD2-CZ 3.4Å; L477-F575 VanDerWaalsContact CD2-CZ 3.4Å; L477-F575 HydrophobicContact CG-CZ 4.19Å
478	D	43.7	Very low	43.4	Very low	71 Å²	71	91.5 Å²	91.5	38%	0.38	50%	0.5	S	S	.	.			trans	-81.3	108.3	-174.2	-88.4	-37.6	0	0	0	112.5	Q449 S476 T482	Q449-D478 PolarHBondContact NE2-O 3.4Å; S476-D478 VanDerWaalsContact C-N 3.25Å; S476-D478 PolarHBondContact O-N 3.3Å; D478-T482 VanDerWaalsContact C-OG1 3.31Å; D478-T482 VanDerWaalsContact CA-OG1 3.22Å; D478-T482 WeakPolarHBondContact CA-OG1 3.37Å; D478-T482 WeakPolarHBondContact CB-OG1 2.98Å; D478-T482 VanDerWaalsContact CG-OG1 3.27Å; D478-T482 WeakPolarHBondContact OD1-CB 3.37Å; D478-T482 PolarHBondContact OD1-OG1 2.78Å
479	D	52.9	Low	45.4	Very low	19 Å²	19	91.6 Å²	91.6	10%	0.102	50%	0.495	C	S	.	.			trans	-57.5	152.3	170.6	-144.4	-5.7	0	0	0	111.1	L477 E481 T482 A483 Q574 F575	L477-D479 PolarHBondContact O-N 3.28Å; D479-E481 PolarHBondContact O-N 2.97Å; D479-T482 HydrophobicContact CB-CG2 4Å; D479-T482 PolarHBondContact N-OG1 2.98Å; D479-T482 VanDerWaalsContact N-OG1 3.13Å; D479-T482 PolarHBondContact O-N 3.42Å; D479-T482 PolarHBondContact O-OG1 2.99Å; D479-A483 PolarHBondContact O-N 3.02Å; D479-Q574 WeakPolarHBondContact OD1-CB 3.48Å; D479-Q574 VanDerWaalsContact OD1-CG 3.23Å; D479-Q574 WeakPolarHBondContact OD1-CG 3.42Å; D479-F575 HydrophobicContact CB-CD2 4.34Å; D479-F575 HydrophobicContact CB-CE2 3.9Å; D479-F575 VanDerWaalsContact CG-CE2 3.5Å; D479-F575 WeakPolarHBondContact OD2-CD2 3.12Å
480	F	54.4	Low	47.6	Very low	20 Å²	20	87.3 Å²	87.3	9%	0.088	47%	0.467	C	S	.	.	H	α-helix	trans	-55.4	-32.5	-177.4	176.1	-110	0	0	0	113.2	L438 L441 R442 M445 Q484 L569 M572	L438-F480 HydrophobicContact CD1-CE1 4.46Å; L438-F480 HydrophobicContact CD1-CZ 4.29Å; L441-F480 HydrophobicContact CD2-CZ 4.08Å; R442-F480 HydrophobicContact CB-CE2 3.87Å; R442-F480 HydrophobicContact CB-CZ 4.25Å; R442-F480 HydrophobicContact CG-CD2 4.42Å; R442-F480 HydrophobicContact CG-CE2 4.26Å; M445-F480 HydrophobicContact CE-CD2 3.95Å; M445-F480 HydrophobicContact CE-CE2 3.18Å; M445-F480 HydrophobicContact CE-CZ 3.7Å; M445-F480 HydrophobicContact SD-CD2 4.24Å; M445-F480 HydrophobicContact SD-CE2 4.03Å; F480-Q484 VanDerWaalsContact CD1-NE2 3.35Å; F480-Q484 WeakPolarHBondContact O-CG 3.3Å; F480-Q484 PolarHBondContact O-NE2 3.12Å; F480-L569 HydrophobicContact CE1-CD2 4.26Å; F480-M572 HydrophobicContact CD1-CB 4.4Å; F480-M572 HydrophobicContact CD1-SD 4.33Å; F480-M572 HydrophobicContact CE1-SD 3.8Å; F480-M572 HydrophobicContact CZ-SD 4.02Å
481	E	55.9	Low	49.8	Very low	25 Å²	25	79.6 Å²	79.6	12%	0.117	43%	0.429	C	S	.	.	H	α-helix	trans	-77.9	-20.3	174	-69.2	-170.6	175.5	0	0	114.2	D479 R547 S552 R573	D479-E481 PolarHBondContact O-N 2.97Å; E481-R547 VanDerWaalsContact C-NH1 3.28Å; E481-R547 PolarHBondContact O-NH1 3.01Å; E481-R547 IonicContact OE2-NH1 3.79Å; E481-S552 PolarHBondContact OE1-OG 3.49Å; E481-R573 IonicContact OE1-CZ 3.04Å; E481-R573 IonicContact OE1-NE 3.8Å; E481-R573 PolarHBondContact OE1-NE 2.68Å; E481-R573 VanDerWaalsContact OE1-NE 3.15Å; E481-R573 IonicContact OE1-NH2 3.98Å; E481-R573 PolarHBondContact OE1-NH2 2.76Å; E481-R573 IonicContact OE2-NH2 3.23Å; E481-R573 PolarHBondContact OE2-NH2 2.89Å
482	T	55.5	Low	51.8	Low	36 Å²	36	75 Å²	75	22%	0.221	40%	0.399	C	S	.	.	H	α-helix	trans	-75.9	-38.3	173.1	67.3	0	0	0	0	110.2	D478 D479 Q484 Q485	D478-T482 VanDerWaalsContact C-OG1 3.31Å; D478-T482 VanDerWaalsContact CA-OG1 3.22Å; D478-T482 WeakPolarHBondContact CA-OG1 3.37Å; D478-T482 WeakPolarHBondContact CB-OG1 2.98Å; D478-T482 VanDerWaalsContact CG-OG1 3.27Å; D478-T482 WeakPolarHBondContact OD1-CB 3.37Å; D478-T482 PolarHBondContact OD1-OG1 2.78Å; D479-T482 HydrophobicContact CB-CG2 4Å; D479-T482 PolarHBondContact N-OG1 2.98Å; D479-T482 VanDerWaalsContact N-OG1 3.13Å; D479-T482 PolarHBondContact O-N 3.42Å; D479-T482 PolarHBondContact O-OG1 2.99Å; T482-Q484 PolarHBondContact O-N 3.15Å; T482-Q484 VanDerWaalsContact O-N 3.15Å; T482-Q485 PolarHBondContact O-N 2.59Å
483	A	51.8	Low	54.2	Low	38 Å²	38	73 Å²	73	31%	0.314	38%	0.381	S	S	.	.	H	α-helix	trans	-60.9	-23.5	-179.3	0	0	0	0	0	114	M445 D479	M445-A483 HydrophobicContact SD-CB 3.89Å; D479-A483 PolarHBondContact O-N 3.02Å
484	Q	59.1	Low	56.3	Low	11 Å²	11	66.1 Å²	66.1	5%	0.051	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-22.4	-172.9	-69.8	163.4	-0.7	0	0	115	W426 M445 F480 T482 I486	W426-Q484 VanDerWaalsContact CZ2-NE2 3.34Å; M445-Q484 HydrophobicContact CE-CG 3.92Å; M445-Q484 HydrophobicContact SD-CG 4.12Å; F480-Q484 VanDerWaalsContact CD1-NE2 3.35Å; F480-Q484 WeakPolarHBondContact O-CG 3.3Å; F480-Q484 PolarHBondContact O-NE2 3.12Å; T482-Q484 PolarHBondContact O-N 3.15Å; T482-Q484 VanDerWaalsContact O-N 3.15Å; Q484-I486 HydrophobicContact CB-CD1 4.37Å; Q484-I486 HydrophobicContact CB-CG1 4.22Å; Q484-I486 PolarHBondContact O-N 3.42Å
485	Q	59.9	Low	58.3	Low	175 Å²	175	58.1 Å²	58.1	82%	0.818	31%	0.307	S	S	*	.			trans	44.2	31.5	-179.4	-61.3	-171.5	-1.1	0	0	116.6	T482 S487	T482-Q485 PolarHBondContact O-N 2.59Å; Q485-S487 PolarHBondContact O-N 3.06Å
486	I	66.5	Low	60.3	Low	34 Å²	34	52.8 Å²	52.8	17%	0.174	29%	0.285	C	S	.	.			trans	-74.6	123.3	179.5	-59.7	175.2	0	0	0	110	I422 W426 Q484 Q490 L553	I422-I486 HydrophobicContact CG2-CD1 4.38Å; I422-I486 HydrophobicContact CG2-CG1 4.3Å; W426-I486 HydrophobicContact CG-CD1 4.2Å; Q484-I486 HydrophobicContact CB-CD1 4.37Å; Q484-I486 HydrophobicContact CB-CG1 4.22Å; Q484-I486 PolarHBondContact O-N 3.42Å; I486-Q490 HydrophobicContact CG2-CB 3.74Å; I486-L553 HydrophobicContact CD1-CD1 3.81Å; I486-L553 HydrophobicContact CD1-CD2 4Å; I486-L553 HydrophobicContact CD1-CG 4.32Å
487	S	67.9	Low	62	Low	56 Å²	56	49.9 Å²	49.9	39%	0.392	26%	0.262	S	S	.	.			trans	-72.5	154.9	175.3	70.4	0	0	0	0	111.7	Q485 K489 Q490 M491	Q485-S487 PolarHBondContact O-N 3.06Å; S487-K489 PolarHBondContact O-N 2.85Å; S487-Q490 WeakPolarHBondContact O-CB 3.3Å; S487-Q490 PolarHBondContact O-N 3.05Å; S487-Q490 VanDerWaalsContact O-N 3.1Å; S487-Q490 WeakPolarHBondContact OG-CB 3.27Å; S487-Q490 VanDerWaalsContact OG-CG 3.29Å; S487-Q490 WeakPolarHBondContact OG-CG 3.21Å; S487-Q490 PolarHBondContact OG-N 3.43Å; S487-Q490 PolarHBondContact OG-OE1 2.99Å; S487-M491 PolarHBondContact O-N 3.36Å
488	L	66.5	Low	63.6	Low	81 Å²	81	43.9 Å²	43.9	42%	0.424	23%	0.231	S	C	.	.	H	α-helix	trans	-59	-32.6	177.7	-168.1	70.6	0	0	0	112.2	M491 S492 F522	L488-M491 HydrophobicContact CD1-SD 4.48Å; L488-M491 WeakPolarHBondContact O-CB 3.39Å; L488-M491 PolarHBondContact O-N 3.46Å; L488-S492 PolarHBondContact O-N 3.47Å; L488-S492 PolarHBondContact O-OG 3.15Å; L488-F522 HydrophobicContact CD1-CD2 4.11Å; L488-F522 HydrophobicContact CD1-CE2 4.49Å
489	K	68.9	Low	64.4	Low	143 Å²	143	44.9 Å²	44.9	62%	0.622	23%	0.23	S	C	*	.	H	α-helix	trans	-66.5	-44.1	175.6	-171.3	-179.1	177.3	-176.3	0	111.8	S487 M491 S492 E493	S487-K489 PolarHBondContact O-N 2.85Å; K489-M491 VanDerWaalsContact C-N 3.31Å; K489-M491 PolarHBondContact O-N 3.36Å; K489-S492 WeakPolarHBondContact CA-OG 3.48Å; K489-S492 PolarHBondContact O-N 3.28Å; K489-S492 PolarHBondContact O-OG 2.94Å; K489-E493 WeakPolarHBondContact CE-OE1 3.47Å; K489-E493 WeakPolarHBondContact O-CG 3.41Å; K489-E493 PolarHBondContact O-N 3.41Å
490	Q	71.7	Confident	65	Low	28 Å²	28	51 Å²	51	13%	0.131	26%	0.258	C	S	.	.	H	α-helix	trans	-62.4	-39.3	173.5	-78.7	166.9	-22.4	0	0	111.7	S419 M423 I486 S487 S492 E493 L494	S419-Q490 VanDerWaalsContact CB-NE2 3.34Å; S419-Q490 PolarHBondContact OG-NE2 3.41Å; M423-Q490 HydrophobicContact CE-CB 4.08Å; M423-Q490 HydrophobicContact CE-CG 4.42Å; M423-Q490 WeakPolarHBondContact CE-O 3.28Å; M423-Q490 HydrophobicContact CG-CB 4.21Å; M423-Q490 HydrophobicContact CG-CG 4.03Å; M423-Q490 HydrophobicContact SD-CB 3.59Å; M423-Q490 VanDerWaalsContact SD-CB 3.59Å; M423-Q490 HydrophobicContact SD-CG 4.07Å; I486-Q490 HydrophobicContact CG2-CB 3.74Å; S487-Q490 WeakPolarHBondContact O-CB 3.3Å; S487-Q490 PolarHBondContact O-N 3.05Å; S487-Q490 VanDerWaalsContact O-N 3.1Å; S487-Q490 WeakPolarHBondContact OG-CB 3.27Å; S487-Q490 VanDerWaalsContact OG-CG 3.29Å; S487-Q490 WeakPolarHBondContact OG-CG 3.21Å; S487-Q490 PolarHBondContact OG-N 3.43Å; S487-Q490 PolarHBondContact OG-OE1 2.99Å; Q490-S492 VanDerWaalsContact C-N 3.31Å; Q490-S492 PolarHBondContact O-N 3.01Å; Q490-E493 PolarHBondContact O-N 3.15Å; Q490-L494 VanDerWaalsContact O-CB 3.29Å; Q490-L494 WeakPolarHBondContact O-CB 3.3Å; Q490-L494 PolarHBondContact O-N 3.19Å
491	M	70.2	Confident	65.5	Low	7 Å²	7	54.3 Å²	54.3	3%	0.034	28%	0.277	C	S	.	.	H	α-helix	trans	-60	-40.6	173.8	-173.8	175.9	-68	0	0	112	S487 L488 K489 F495 F522 R551 L553 L556	S487-M491 PolarHBondContact O-N 3.36Å; L488-M491 HydrophobicContact CD1-SD 4.48Å; L488-M491 WeakPolarHBondContact O-CB 3.39Å; L488-M491 PolarHBondContact O-N 3.46Å; K489-M491 VanDerWaalsContact C-N 3.31Å; K489-M491 PolarHBondContact O-N 3.36Å; M491-F495 WeakPolarHBondContact O-CB 3.49Å; M491-F495 PolarHBondContact O-N 2.97Å; M491-F522 HydrophobicContact CG-CZ 4.49Å; M491-R551 VanDerWaalsContact CE-O 3.28Å; M491-R551 WeakPolarHBondContact CE-O 3.38Å; M491-L553 HydrophobicContact CE-CD2 4.26Å; M491-L556 HydrophobicContact CG-CB 4.44Å; M491-L556 HydrophobicContact CG-CD1 4.28Å; M491-L556 HydrophobicContact CG-CD2 4.05Å; M491-L556 HydrophobicContact CG-CG 4.49Å
492	S	67.7	Low	65.3	Low	7 Å²	7	55.5 Å²	55.5	5%	0.049	30%	0.296	C	S	.	.	H	α-helix	trans	-71.5	-34.5	175.1	57.8	0	0	0	0	114.1	L488 K489 Q490 F495 S496 H520	L488-S492 PolarHBondContact O-N 3.47Å; L488-S492 PolarHBondContact O-OG 3.15Å; K489-S492 WeakPolarHBondContact CA-OG 3.48Å; K489-S492 PolarHBondContact O-N 3.28Å; K489-S492 PolarHBondContact O-OG 2.94Å; Q490-S492 VanDerWaalsContact C-N 3.31Å; Q490-S492 PolarHBondContact O-N 3.01Å; S492-F495 WeakPolarHBondContact O-CB 3.34Å; S492-F495 PolarHBondContact O-N 2.84Å; S492-S496 PolarHBondContact O-N 3.37Å; S492-S496 PolarHBondContact O-OG 3.37Å; S492-H520 VanDerWaalsContact CB-CE1 3.46Å; S492-H520 WeakPolarHBondContact CB-CE1 3.48Å; S492-H520 WeakPolarHBondContact CB-ND1 3.38Å; S492-H520 PolarHBondContact OG-CE1 3.05Å; S492-H520 VanDerWaalsContact OG-CE1 3.29Å; S492-H520 PolarHBondContact OG-ND1 3.44Å
493	E	74.4	Confident	65.1	Low	84 Å²	84	55.2 Å²	55.2	39%	0.393	29%	0.294	S	S	.	.	H	α-helix	trans	-64.2	-47.7	173.5	-74.8	168.4	-169.5	0	0	110	M423 K489 Q490 F495 S496 D497	M423-E493 HydrophobicContact CE-CB 3.68Å; K489-E493 WeakPolarHBondContact CE-OE1 3.47Å; K489-E493 WeakPolarHBondContact O-CG 3.41Å; K489-E493 PolarHBondContact O-N 3.41Å; Q490-E493 PolarHBondContact O-N 3.15Å; E493-F495 VanDerWaalsContact C-N 3.25Å; E493-F495 PolarHBondContact O-N 3.33Å; E493-S496 WeakPolarHBondContact O-CB 3.5Å; E493-S496 PolarHBondContact O-N 3.14Å; E493-S496 VanDerWaalsContact O-N 3.08Å; E493-D497 PolarHBondContact O-N 3.21Å
494	L	71.1	Confident	65.1	Low	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-37.3	178	-175.2	64.6	0	0	0	111.9	M423 W426 R427 L430 Q490 C498 L556	M423-L494 HydrophobicContact CE-CB 3.91Å; M423-L494 HydrophobicContact SD-CB 4.09Å; W426-L494 HydrophobicContact CB-CD1 4.06Å; W426-L494 HydrophobicContact CB-CD2 3.66Å; W426-L494 HydrophobicContact CG-CD2 4.4Å; R427-L494 HydrophobicContact CB-CD1 3.83Å; R427-L494 HydrophobicContact CG-CD1 4.49Å; L430-L494 HydrophobicContact CD1-CD1 4.34Å; L430-L494 HydrophobicContact CD1-CD2 3.64Å; L430-L494 HydrophobicContact CD1-CG 3.86Å; Q490-L494 VanDerWaalsContact O-CB 3.29Å; Q490-L494 WeakPolarHBondContact O-CB 3.3Å; Q490-L494 PolarHBondContact O-N 3.19Å; L494-C498 PolarHBondContact O-N 3.39Å; L494-C498 PolarHBondContact O-SG 3.18Å; L494-L556 HydrophobicContact CB-CD2 4.36Å; L494-L556 HydrophobicContact CD2-CD2 3.5Å; L494-L556 HydrophobicContact CG-CD2 3.99Å
495	F	70.2	Confident	64.7	Low	8 Å²	8	57.2 Å²	57.2	4%	0.035	32%	0.315	C	S	.	.	H	α-helix	trans	-61.7	-51.2	172	177.9	-101.5	0	0	0	112	M491 S492 E493 D497 C498 Y499 F506 L517 F522 L556 I559	M491-F495 WeakPolarHBondContact O-CB 3.49Å; M491-F495 PolarHBondContact O-N 2.97Å; S492-F495 WeakPolarHBondContact O-CB 3.34Å; S492-F495 PolarHBondContact O-N 2.84Å; E493-F495 VanDerWaalsContact C-N 3.25Å; E493-F495 PolarHBondContact O-N 3.33Å; F495-D497 VanDerWaalsContact C-N 3.27Å; F495-D497 PolarHBondContact O-N 3.39Å; F495-C498 PolarHBondContact O-N 3.32Å; F495-Y499 PolarHBondContact O-N 3.25Å; F495-F506 HydrophobicContact CD2-CZ 4.33Å; F495-F506 HydrophobicContact CE2-CE1 4.43Å; F495-F506 AromaticContact CE2-CE2 3.87Å; F495-F506 HydrophobicContact CE2-CE2 3.87Å; F495-F506 AromaticContact CE2-CZ 3.35Å; F495-F506 HydrophobicContact CE2-CZ 3.35Å; F495-F506 HydrophobicContact CZ-CE1 4.44Å; F495-F506 HydrophobicContact CZ-CE2 4.22Å; F495-F506 AromaticContact CZ-CZ 3.47Å; F495-F506 HydrophobicContact CZ-CZ 3.47Å; F495-F506 VanDerWaalsContact CZ-CZ 3.47Å; F495-L517 HydrophobicContact CD1-CD2 4.41Å; F495-L517 HydrophobicContact CE1-CB 3.84Å; F495-L517 HydrophobicContact CE1-CD1 3.91Å; F495-L517 HydrophobicContact CE1-CD2 3.79Å; F495-L517 HydrophobicContact CE1-CG 4.05Å; F495-L517 HydrophobicContact CE2-CD1 4.42Å; F495-L517 HydrophobicContact CE2-CD2 4.11Å; F495-L517 HydrophobicContact CZ-CB 4.25Å; F495-L517 HydrophobicContact CZ-CD1 3.45Å; F495-L517 VanDerWaalsContact CZ-CD1 3.45Å; F495-L517 HydrophobicContact CZ-CD2 3.6Å; F495-L517 HydrophobicContact CZ-CG 3.95Å; F495-F522 HydrophobicContact CB-CZ 4.41Å; F495-F522 HydrophobicContact CG-CE1 4.45Å; F495-L556 HydrophobicContact CB-CD1 3.69Å; F495-L556 HydrophobicContact CD2-CD1 3.76Å; F495-L556 HydrophobicContact CG-CD1 4.19Å; F495-I559 HydrophobicContact CD2-CG2 4.32Å; F495-I559 HydrophobicContact CE2-CB 4.3Å; F495-I559 HydrophobicContact CE2-CG2 3.44Å; F495-I559 VanDerWaalsContact CE2-CG2 3.44Å; F495-I559 HydrophobicContact CZ-CG2 4.14Å
496	S	69.5	Low	64.5	Low	53 Å²	53	49.2 Å²	49.2	37%	0.371	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-35.5	177	-64	0	0	0	0	112.4	S492 E493 Y499 E500	S492-S496 PolarHBondContact O-N 3.37Å; S492-S496 PolarHBondContact O-OG 3.37Å; E493-S496 WeakPolarHBondContact O-CB 3.5Å; E493-S496 PolarHBondContact O-N 3.14Å; E493-S496 VanDerWaalsContact O-N 3.08Å; S496-Y499 VanDerWaalsContact O-CB 3.29Å; S496-Y499 WeakPolarHBondContact O-CB 3.48Å; S496-Y499 PolarHBondContact O-N 3.49Å; S496-E500 WeakPolarHBondContact O-CG 3.25Å; S496-E500 PolarHBondContact O-N 3.19Å
497	D	70	Confident	64.2	Low	22 Å²	22	51.5 Å²	51.5	12%	0.118	29%	0.293	C	S	.	.	H	α-helix	trans	-67.7	-42.3	175.8	-62.5	-53.5	0	0	0	112.1	R427 E493 F495 Y499 E500 N501	R427-D497 HydrophobicContact CG-CB 4.38Å; R427-D497 IonicContact CZ-OD1 2.85Å; R427-D497 IonicContact CZ-OD2 3.06Å; R427-D497 IonicContact NE-OD2 2.74Å; R427-D497 PolarHBondContact NE-OD2 3Å; R427-D497 IonicContact NH1-OD1 3.73Å; R427-D497 PolarHBondContact NH1-OD1 2.87Å; R427-D497 IonicContact NH1-OD2 3.42Å; R427-D497 IonicContact NH2-OD1 3.8Å; R427-D497 PolarHBondContact NH2-OD1 3.34Å; R427-D497 IonicContact NH2-OD2 2.73Å; R427-D497 PolarHBondContact NH2-OD2 2.81Å; E493-D497 PolarHBondContact O-N 3.21Å; F495-D497 VanDerWaalsContact C-N 3.27Å; F495-D497 PolarHBondContact O-N 3.39Å; D497-Y499 PolarHBondContact O-N 2.96Å; D497-E500 PolarHBondContact O-N 3.1Å; D497-N501 PolarHBondContact O-N 3.14Å; D497-N501 PolarHBondContact O-ND2 3.28Å
498	C	67	Low	63.5	Low	3 Å²	3	53.8 Å²	53.8	2%	0.02	30%	0.298	C	S	.	.	H	α-helix	trans	-64.6	-31.5	175	-66.1	0	0	0	0	111.2	L494 F495	L494-C498 PolarHBondContact O-N 3.39Å; L494-C498 PolarHBondContact O-SG 3.18Å; F495-C498 PolarHBondContact O-N 3.32Å
499	Y	62.2	Low	63	Low	92 Å²	92	50.6 Å²	50.6	36%	0.361	28%	0.282	S	S	.	.	H	α-helix	trans	-65.2	-53.6	173.8	174.5	-117.1	0	0	0	113.1	F495 S496 D497 N501 G502 F506 Q510	F495-Y499 PolarHBondContact O-N 3.25Å; S496-Y499 VanDerWaalsContact O-CB 3.29Å; S496-Y499 WeakPolarHBondContact O-CB 3.48Å; S496-Y499 PolarHBondContact O-N 3.49Å; D497-Y499 PolarHBondContact O-N 2.96Å; Y499-N501 PolarHBondContact O-N 2.73Å; Y499-G502 PolarHBondContact O-N 3.11Å; Y499-F506 HydrophobicContact CD2-CD1 4.22Å; Y499-F506 AromaticContact CD2-CE1 3.72Å; Y499-F506 HydrophobicContact CD2-CE1 3.72Å; Y499-F506 HydrophobicContact CG-CE1 4.2Å; Y499-Q510 VanDerWaalsContact CD2-NE2 3.25Å
500	E	65.2	Low	62.4	Low	149 Å²	149	44.3 Å²	44.3	70%	0.696	26%	0.255	S	S	*	.	H	α-helix	trans	-62.3	-31.9	-176.1	-74.3	178.4	-177.1	0	0	112.6	S496 D497 G502	S496-E500 WeakPolarHBondContact O-CG 3.25Å; S496-E500 PolarHBondContact O-N 3.19Å; D497-E500 PolarHBondContact O-N 3.1Å; E500-G502 VanDerWaalsContact C-N 3.3Å; E500-G502 PolarHBondContact O-N 3.29Å
501	N	63.5	Low	61.9	Low	89 Å²	89	45.7 Å²	45.7	48%	0.476	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	5.4	-177.1	-68.4	-56	0	0	0	114.7	L431 D497 Y499 T503	L431-N501 HydrophobicContact CD2-CB 3.41Å; L431-N501 VanDerWaalsContact CD2-CB 3.41Å; D497-N501 PolarHBondContact O-N 3.14Å; D497-N501 PolarHBondContact O-ND2 3.28Å; Y499-N501 PolarHBondContact O-N 2.73Å; N501-T503 PolarHBondContact O-N 2.83Å
502	G	52.6	Low	61.4	Low	50 Å²	50	48.9 Å²	48.9	52%	0.515	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	39.8	155.9	0	0	0	0	0	117.1	Y499 E500 G504	Y499-G502 PolarHBondContact O-N 3.11Å; E500-G502 VanDerWaalsContact C-N 3.3Å; E500-G502 PolarHBondContact O-N 3.29Å; G502-G504 PolarHBondContact O-N 3.12Å
503	T	51.6	Low	61.2	Low	30 Å²	30	49.6 Å²	49.6	18%	0.184	31%	0.306	C	S	.	.			trans	-82.7	84	-178	64.4	0	0	0	0	111.7	L431 N501 V505 F506 R562	L431-T503 HydrophobicContact CD2-CG2 4.4Å; N501-T503 PolarHBondContact O-N 2.83Å; T503-V505 PolarHBondContact O-N 2.78Å; T503-F506 PolarHBondContact O-N 3.28Å; T503-R562 PolarHBondContact OG1-NH2 3.11Å
504	G	50.7	Low	60.6	Low	62 Å²	62	48.5 Å²	48.5	64%	0.639	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.6	-66.7	157.2	0	0	0	0	0	120.2	G502 F506	G502-G504 PolarHBondContact O-N 3.12Å; G504-F506 VanDerWaalsContact C-N 3.28Å; G504-F506 PolarHBondContact O-N 3.08Å
505	V	52.5	Low	60.3	Low	28 Å²	28	56.4 Å²	56.4	17%	0.17	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-19.9	-171.7	-172.9	0	0	0	0	111.9	T503 F597 M601	T503-V505 PolarHBondContact O-N 2.78Å; V505-F597 HydrophobicContact CG1-CE2 4.37Å; V505-F597 HydrophobicContact CG1-CZ 3.81Å; V505-M601 HydrophobicContact CG1-CE 4.28Å; V505-M601 HydrophobicContact CG1-CG 4.22Å; V505-M601 HydrophobicContact CG2-CE 3.73Å; V505-M601 HydrophobicContact CG2-CG 4.01Å; V505-M601 HydrophobicContact CG2-SD 3.89Å
506	F	55.4	Low	60	Low	7 Å²	7	58.7 Å²	58.7	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-87.8	-31.1	-158.4	-176.2	-124.1	0	0	0	115.6	F495 Y499 T503 G504 H508 Q510 I559	F495-F506 HydrophobicContact CD2-CZ 4.33Å; F495-F506 HydrophobicContact CE2-CE1 4.43Å; F495-F506 AromaticContact CE2-CE2 3.87Å; F495-F506 HydrophobicContact CE2-CE2 3.87Å; F495-F506 AromaticContact CE2-CZ 3.35Å; F495-F506 HydrophobicContact CE2-CZ 3.35Å; F495-F506 HydrophobicContact CZ-CE1 4.44Å; F495-F506 HydrophobicContact CZ-CE2 4.22Å; F495-F506 AromaticContact CZ-CZ 3.47Å; F495-F506 HydrophobicContact CZ-CZ 3.47Å; F495-F506 VanDerWaalsContact CZ-CZ 3.47Å; Y499-F506 HydrophobicContact CD2-CD1 4.22Å; Y499-F506 AromaticContact CD2-CE1 3.72Å; Y499-F506 HydrophobicContact CD2-CE1 3.72Å; Y499-F506 HydrophobicContact CG-CE1 4.2Å; T503-F506 PolarHBondContact O-N 3.28Å; G504-F506 VanDerWaalsContact C-N 3.28Å; G504-F506 PolarHBondContact O-N 3.08Å; F506-H508 VanDerWaalsContact C-N 3.26Å; F506-H508 PolarHBondContact O-N 3.05Å; F506-Q510 HydrophobicContact CZ-CB 4.48Å; F506-Q510 VanDerWaalsContact CZ-CD 3.45Å; F506-Q510 HydrophobicContact CZ-CG 4.29Å; F506-I559 WeakPolarHBondContact CD2-O 3.23Å; F506-I559 HydrophobicContact CE2-CG2 3.96Å; F506-I559 WeakPolarHBondContact CE2-O 3.4Å
507	T	58.8	Low	59.7	Low	82 Å²	82	56.6 Å²	56.6	50%	0.503	34%	0.335	S	S	.	.	H	α-helix	trans	-62.1	-30.3	-171.5	51.2	0	0	0	0	113.5
508	H	54.7	Low	59.4	Low	104 Å²	104	62.6 Å²	62.6	48%	0.481	36%	0.36	S	S	.	.	H	α-helix	trans	-81	-44.8	-174.8	-84.1	-84.8	0	0	0	114.9	F506 Q510 T596	F506-H508 VanDerWaalsContact C-N 3.26Å; F506-H508 PolarHBondContact O-N 3.05Å; H508-Q510 PolarHBondContact O-N 3.48Å; H508-T596 PolarHBondContact ND1-O 3.46Å
509	V	56.1	Low	59.3	Low	15 Å²	15	65.2 Å²	65.2	9%	0.091	38%	0.382	C	S	.	.	H	α-helix	trans	-62.7	-31.2	177.1	177.9	0	0	0	0	110.1	F513 L591 F597	V509-F513 HydrophobicContact CG1-CD2 4.17Å; V509-F513 HydrophobicContact CG1-CE2 4.3Å; V509-F513 VanDerWaalsContact O-CD2 3.25Å; V509-F513 WeakPolarHBondContact O-CD2 3.3Å; V509-L591 HydrophobicContact CG1-CD2 4.06Å; V509-L591 HydrophobicContact CG2-CD2 4.29Å; V509-F597 HydrophobicContact CG2-CD2 3.6Å; V509-F597 HydrophobicContact CG2-CE2 3.54Å
510	Q	56.3	Low	59.2	Low	10 Å²	10	65.7 Å²	65.7	5%	0.047	39%	0.387	C	S	.	.	H	α-helix	trans	-80.5	-28.1	-172.5	-161.9	177	0.4	0	0	114.3	Y499 F506 H508 A512 F513 Q514 L517	Y499-Q510 VanDerWaalsContact CD2-NE2 3.25Å; F506-Q510 HydrophobicContact CZ-CB 4.48Å; F506-Q510 VanDerWaalsContact CZ-CD 3.45Å; F506-Q510 HydrophobicContact CZ-CG 4.29Å; H508-Q510 PolarHBondContact O-N 3.48Å; Q510-A512 PolarHBondContact O-N 2.82Å; Q510-A512 VanDerWaalsContact O-N 3.11Å; Q510-F513 CarbonylContact O-C 3.56Å; Q510-F513 PolarHBondContact O-N 3.4Å; Q510-Q514 WeakPolarHBondContact O-CA 3.41Å; Q510-Q514 WeakPolarHBondContact O-CB 3.29Å; Q510-Q514 PolarHBondContact O-N 3.06Å; Q510-L517 HydrophobicContact CG-CD1 3.82Å
511	G	60.4	Low	59.4	Low	58 Å²	58	62.5 Å²	62.5	60%	0.598	38%	0.375	S	S	*	.	H	α-helix	trans	-53.2	-35	176	0	0	0	0	0	112.8
512	A	60.4	Low	59.7	Low	73 Å²	73	58.4 Å²	58.4	60%	0.603	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-24.2	177.4	0	0	0	0	0	114.5	Q510	Q510-A512 PolarHBondContact O-N 2.82Å; Q510-A512 VanDerWaalsContact O-N 3.11Å
513	F	62.5	Low	60.5	Low	22 Å²	22	61.6 Å²	61.6	10%	0.096	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	3.9	-173.3	-59.1	-60	0	0	0	114.1	V509 Q510 E515 N516 L517 V525 S528 M529	V509-F513 HydrophobicContact CG1-CD2 4.17Å; V509-F513 HydrophobicContact CG1-CE2 4.3Å; V509-F513 VanDerWaalsContact O-CD2 3.25Å; V509-F513 WeakPolarHBondContact O-CD2 3.3Å; Q510-F513 CarbonylContact O-C 3.56Å; Q510-F513 PolarHBondContact O-N 3.4Å; F513-E515 VanDerWaalsContact C-N 3.34Å; F513-E515 PolarHBondContact O-N 3.49Å; F513-N516 PolarHBondContact O-N 2.92Å; F513-L517 HydrophobicContact CB-CD1 3.94Å; F513-L517 HydrophobicContact CB-CG 4.46Å; F513-L517 WeakPolarHBondContact O-CB 3.45Å; F513-L517 WeakPolarHBondContact O-CD1 3.38Å; F513-L517 WeakPolarHBondContact O-CG 3.5Å; F513-L517 PolarHBondContact O-N 2.76Å; F513-V525 HydrophobicContact CB-CG1 4.45Å; F513-V525 HydrophobicContact CG-CG1 4.38Å; F513-S528 WeakPolarHBondContact CE1-OG 3.25Å; F513-M529 HydrophobicContact CE2-CG 4.41Å
514	Q	63.1	Low	61.4	Low	62 Å²	62	62.5 Å²	62.5	29%	0.29	36%	0.355	S	S	.	.	H	α-helix	trans	-57.2	-43.8	-172.1	-169.9	-178.4	8	0	0	112.5	Q510 L517 K518	Q510-Q514 WeakPolarHBondContact O-CA 3.41Å; Q510-Q514 WeakPolarHBondContact O-CB 3.29Å; Q510-Q514 PolarHBondContact O-N 3.06Å; Q514-L517 PolarHBondContact O-N 3.34Å; Q514-K518 HydrophobicContact CG-CD 4.38Å; Q514-K518 WeakPolarHBondContact O-CB 3.27Å; Q514-K518 WeakPolarHBondContact O-CG 3.5Å; Q514-K518 PolarHBondContact O-N 3.47Å
515	E	64.6	Low	62.4	Low	166 Å²	166	59.6 Å²	59.6	78%	0.776	33%	0.325	S	S	*	.	H	α-helix	trans	-63	-46.9	178.6	-66.4	-175.3	169.1	0	0	111.8	F513 L517 K518 A519	F513-E515 VanDerWaalsContact C-N 3.34Å; F513-E515 PolarHBondContact O-N 3.49Å; E515-L517 VanDerWaalsContact C-N 3.3Å; E515-L517 PolarHBondContact O-N 3.39Å; E515-K518 PolarHBondContact O-N 3.25Å; E515-A519 PolarHBondContact O-N 2.89Å
516	N	62.8	Low	63.4	Low	56 Å²	56	58.3 Å²	58.3	30%	0.299	32%	0.317	S	S	.	.	H	α-helix	trans	-64	-35.9	178.2	-70	-44.3	0	0	0	112.4	F513 D521 V525	F513-N516 PolarHBondContact O-N 2.92Å; N516-D521 PolarHBondContact O-N 3.43Å; N516-D521 VanDerWaalsContact O-N 3.07Å; N516-V525 HydrophobicContact CB-CG2 3.87Å
517	L	64	Low	64.2	Low	9 Å²	9	60.4 Å²	60.4	5%	0.047	33%	0.327	C	S	.	.	H	α-helix	trans	-71.5	-40.8	177.3	-74.9	158.8	0	0	0	111.9	F495 Q510 F513 Q514 E515 A519 H520 F522 V525	F495-L517 HydrophobicContact CD1-CD2 4.41Å; F495-L517 HydrophobicContact CE1-CB 3.84Å; F495-L517 HydrophobicContact CE1-CD1 3.91Å; F495-L517 HydrophobicContact CE1-CD2 3.79Å; F495-L517 HydrophobicContact CE1-CG 4.05Å; F495-L517 HydrophobicContact CE2-CD1 4.42Å; F495-L517 HydrophobicContact CE2-CD2 4.11Å; F495-L517 HydrophobicContact CZ-CB 4.25Å; F495-L517 HydrophobicContact CZ-CD1 3.45Å; F495-L517 VanDerWaalsContact CZ-CD1 3.45Å; F495-L517 HydrophobicContact CZ-CD2 3.6Å; F495-L517 HydrophobicContact CZ-CG 3.95Å; Q510-L517 HydrophobicContact CG-CD1 3.82Å; F513-L517 HydrophobicContact CB-CD1 3.94Å; F513-L517 HydrophobicContact CB-CG 4.46Å; F513-L517 WeakPolarHBondContact O-CB 3.45Å; F513-L517 WeakPolarHBondContact O-CD1 3.38Å; F513-L517 WeakPolarHBondContact O-CG 3.5Å; F513-L517 PolarHBondContact O-N 2.76Å; Q514-L517 PolarHBondContact O-N 3.34Å; E515-L517 VanDerWaalsContact C-N 3.3Å; E515-L517 PolarHBondContact O-N 3.39Å; L517-A519 VanDerWaalsContact C-N 3.28Å; L517-A519 PolarHBondContact O-N 2.94Å; L517-H520 PolarHBondContact O-N 2.97Å; L517-F522 HydrophobicContact CD2-CD1 4.02Å; L517-F522 HydrophobicContact CD2-CE1 3.79Å; L517-V525 HydrophobicContact CD2-CG2 3.95Å; L517-V525 HydrophobicContact CG-CG2 3.91Å
518	K	64.1	Low	64.7	Low	147 Å²	147	59 Å²	59	64%	0.639	32%	0.321	S	S	*	.	H	α-helix	trans	-63	-34.8	172.9	-77.2	179.4	178.6	177.3	0	112	Q514 E515 H520	Q514-K518 HydrophobicContact CG-CD 4.38Å; Q514-K518 WeakPolarHBondContact O-CB 3.27Å; Q514-K518 WeakPolarHBondContact O-CG 3.5Å; Q514-K518 PolarHBondContact O-N 3.47Å; E515-K518 PolarHBondContact O-N 3.25Å; K518-H520 PolarHBondContact O-N 3.26Å; K518-H520 VanDerWaalsContact O-N 3.17Å
519	A	63.9	Low	65.5	Low	58 Å²	58	54.4 Å²	54.4	48%	0.479	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	2.1	173.1	0	0	0	0	0	114	E515 L517 D521	E515-A519 PolarHBondContact O-N 2.89Å; L517-A519 VanDerWaalsContact C-N 3.28Å; L517-A519 PolarHBondContact O-N 2.94Å; A519-D521 HydrophobicContact CB-CB 4.49Å; A519-D521 PolarHBondContact O-N 2.86Å
520	H	60.3	Low	66.2	Low	102 Å²	102	53.7 Å²	53.7	47%	0.472	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	19.8	-174.7	-57.9	-56.6	0	0	0	114.6	S492 L517 K518 F522	S492-H520 VanDerWaalsContact CB-CE1 3.46Å; S492-H520 WeakPolarHBondContact CB-CE1 3.48Å; S492-H520 WeakPolarHBondContact CB-ND1 3.38Å; S492-H520 PolarHBondContact OG-CE1 3.05Å; S492-H520 VanDerWaalsContact OG-CE1 3.29Å; S492-H520 PolarHBondContact OG-ND1 3.44Å; L517-H520 PolarHBondContact O-N 2.97Å; K518-H520 PolarHBondContact O-N 3.26Å; K518-H520 VanDerWaalsContact O-N 3.17Å; H520-F522 VanDerWaalsContact C-N 3.33Å; H520-F522 PolarHBondContact O-N 3.48Å; H520-F522 VanDerWaalsContact O-N 3.12Å
521	D	69.9	Low	66.7	Low	83 Å²	83	54.9 Å²	54.9	44%	0.444	31%	0.311	S	S	.	.			trans	-92.8	59.6	-174.9	-87.4	-19	0	0	0	111.7	N516 A519 R523 T524 V525	N516-D521 PolarHBondContact O-N 3.43Å; N516-D521 VanDerWaalsContact O-N 3.07Å; A519-D521 HydrophobicContact CB-CB 4.49Å; A519-D521 PolarHBondContact O-N 2.86Å; D521-R523 PolarHBondContact O-N 3.46Å; D521-T524 WeakPolarHBondContact O-CB 3.3Å; D521-T524 PolarHBondContact O-N 3.41Å; D521-V525 PolarHBondContact O-N 2.92Å
522	F	68.9	Low	67.1	Low	3 Å²	3	52.4 Å²	52.4	1%	0.013	28%	0.284	C	S	.	.	H	α-helix	trans	-53.3	-26.5	174.4	-69.8	-69.3	0	0	0	113.2	L488 M491 F495 L517 H520 L526 H550 F555 I559	L488-F522 HydrophobicContact CD1-CD2 4.11Å; L488-F522 HydrophobicContact CD1-CE2 4.49Å; M491-F522 HydrophobicContact CG-CZ 4.49Å; F495-F522 HydrophobicContact CB-CZ 4.41Å; F495-F522 HydrophobicContact CG-CE1 4.45Å; L517-F522 HydrophobicContact CD2-CD1 4.02Å; L517-F522 HydrophobicContact CD2-CE1 3.79Å; H520-F522 VanDerWaalsContact C-N 3.33Å; H520-F522 PolarHBondContact O-N 3.48Å; H520-F522 VanDerWaalsContact O-N 3.12Å; F522-L526 WeakPolarHBondContact O-CB 3.32Å; F522-L526 PolarHBondContact O-N 2.87Å; F522-H550 HydrophobicContact CB-CB 4.27Å; F522-F555 HydrophobicContact CB-CE1 4.12Å; F522-F555 HydrophobicContact CD1-CE1 4.18Å; F522-I559 HydrophobicContact CD1-CD1 4.02Å; F522-I559 HydrophobicContact CE1-CD1 4.28Å
523	R	70.8	Confident	67.1	Low	116 Å²	116	56 Å²	56	44%	0.438	29%	0.292	S	S	.	.	H	α-helix	trans	-64.5	-44.3	174.3	-178.1	178.5	175.1	-169.2	-3.3	111.5	D521 V525 L526 Q527	D521-R523 PolarHBondContact O-N 3.46Å; R523-V525 VanDerWaalsContact C-N 3.34Å; R523-L526 PolarHBondContact O-N 3.27Å; R523-Q527 WeakPolarHBondContact O-CB 3.25Å; R523-Q527 WeakPolarHBondContact O-CG 3.24Å; R523-Q527 PolarHBondContact O-N 3.45Å
524	T	70	Confident	66.8	Low	50 Å²	50	57.7 Å²	57.7	31%	0.307	30%	0.304	S	S	.	.	H	α-helix	trans	-67.2	-39.3	179.3	-51.8	0	0	0	0	110.2	D521 Q527 S528	D521-T524 WeakPolarHBondContact O-CB 3.3Å; D521-T524 PolarHBondContact O-N 3.41Å; T524-Q527 WeakPolarHBondContact O-CB 3.46Å; T524-Q527 PolarHBondContact O-N 3.23Å; T524-S528 PolarHBondContact O-N 2.89Å; T524-S528 PolarHBondContact O-OG 3.22Å
525	V	70.9	Confident	66.7	Low	1 Å²	1	55.1 Å²	55.1	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-63	-45.8	173.5	-175.4	0	0	0	0	111.5	F513 N516 L517 D521 R523 Q527 S528 M529 F555	F513-V525 HydrophobicContact CB-CG1 4.45Å; F513-V525 HydrophobicContact CG-CG1 4.38Å; N516-V525 HydrophobicContact CB-CG2 3.87Å; L517-V525 HydrophobicContact CD2-CG2 3.95Å; L517-V525 HydrophobicContact CG-CG2 3.91Å; D521-V525 PolarHBondContact O-N 2.92Å; R523-V525 VanDerWaalsContact C-N 3.34Å; V525-Q527 VanDerWaalsContact C-N 3.29Å; V525-Q527 PolarHBondContact O-N 3.25Å; V525-S528 PolarHBondContact O-N 3.1Å; V525-S528 PolarHBondContact O-OG 3.41Å; V525-M529 HydrophobicContact CG1-CG 4.39Å; V525-M529 HydrophobicContact CG1-SD 3.9Å; V525-M529 WeakPolarHBondContact O-CB 3.47Å; V525-M529 VanDerWaalsContact O-CG 3.22Å; V525-M529 WeakPolarHBondContact O-CG 3.45Å; V525-M529 PolarHBondContact O-N 2.98Å; V525-F555 HydrophobicContact CB-CZ 4.33Å; V525-F555 HydrophobicContact CG1-CZ 4.1Å
526	L	73.4	Confident	66.6	Low	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-37.5	175.6	-178.7	64.6	0	0	0	111.5	F522 R523 S530 F535 M549 H550 F555 I587	F522-L526 WeakPolarHBondContact O-CB 3.32Å; F522-L526 PolarHBondContact O-N 2.87Å; R523-L526 PolarHBondContact O-N 3.27Å; L526-S530 VanDerWaalsContact O-CB 3.28Å; L526-S530 WeakPolarHBondContact O-CB 3.33Å; L526-S530 PolarHBondContact O-N 3.44Å; L526-S530 PolarHBondContact O-OG 3.28Å; L526-F535 HydrophobicContact CD2-CD1 3.97Å; L526-F535 HydrophobicContact CD2-CD2 4.36Å; L526-F535 HydrophobicContact CD2-CE1 3.84Å; L526-F535 HydrophobicContact CD2-CE2 4.2Å; L526-F535 HydrophobicContact CD2-CG 4.23Å; L526-F535 HydrophobicContact CD2-CZ 3.93Å; L526-F535 HydrophobicContact CG-CE1 4.26Å; L526-F535 HydrophobicContact CG-CE2 4.18Å; L526-F535 HydrophobicContact CG-CZ 3.9Å; L526-M549 HydrophobicContact CD2-CB 3.87Å; L526-H550 HydrophobicContact CB-CB 4.29Å; L526-H550 HydrophobicContact CD2-CB 3.9Å; L526-F555 HydrophobicContact CB-CE1 4.12Å; L526-F555 HydrophobicContact CB-CE2 4Å; L526-F555 HydrophobicContact CB-CZ 3.65Å; L526-F555 HydrophobicContact CD1-CD2 3.8Å; L526-F555 HydrophobicContact CD1-CE2 3.52Å; L526-F555 HydrophobicContact CD1-CZ 4.1Å; L526-F555 HydrophobicContact CG-CE2 4.33Å; L526-F555 HydrophobicContact CG-CZ 4.45Å; L526-I587 HydrophobicContact CD1-CD1 3.77Å
527	Q	71.9	Confident	66.7	Low	52 Å²	52	55.3 Å²	55.3	24%	0.243	30%	0.295	C	S	.	.	H	α-helix	trans	-63.5	-43.1	176.6	-78	174.8	-23.1	0	0	111.7	R523 T524 V525 G531 L532 L533 F535	R523-Q527 WeakPolarHBondContact O-CB 3.25Å; R523-Q527 WeakPolarHBondContact O-CG 3.24Å; R523-Q527 PolarHBondContact O-N 3.45Å; T524-Q527 WeakPolarHBondContact O-CB 3.46Å; T524-Q527 PolarHBondContact O-N 3.23Å; V525-Q527 VanDerWaalsContact C-N 3.29Å; V525-Q527 PolarHBondContact O-N 3.25Å; Q527-G531 WeakPolarHBondContact O-CA 3.33Å; Q527-G531 PolarHBondContact O-N 3.2Å; Q527-L532 WeakPolarHBondContact CG-O 3.37Å; Q527-L533 PolarHBondContact NE2-O 2.86Å; Q527-L533 VanDerWaalsContact NE2-O 3.1Å; Q527-F535 HydrophobicContact CB-CE2 4.48Å; Q527-F535 HydrophobicContact CG-CD2 3.92Å; Q527-F535 HydrophobicContact CG-CE2 3.56Å
528	S	69	Low	66.3	Low	53 Å²	53	55.1 Å²	55.1	37%	0.371	30%	0.295	S	S	.	.	H	α-helix	trans	-65.9	-48.4	175.8	62	0	0	0	0	111.2	F513 T524 V525 S530	F513-S528 WeakPolarHBondContact CE1-OG 3.25Å; T524-S528 PolarHBondContact O-N 2.89Å; T524-S528 PolarHBondContact O-OG 3.22Å; V525-S528 PolarHBondContact O-N 3.1Å; V525-S528 PolarHBondContact O-OG 3.41Å; S528-S530 PolarHBondContact O-N 3.37Å
529	M	71.6	Confident	66	Low	6 Å²	6	50.3 Å²	50.3	3%	0.03	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-44.2	-178.2	-67.4	177	95.2	0	0	112.7	F513 V525 F555 I558 I587 R590 L591	F513-M529 HydrophobicContact CE2-CG 4.41Å; V525-M529 HydrophobicContact CG1-CG 4.39Å; V525-M529 HydrophobicContact CG1-SD 3.9Å; V525-M529 WeakPolarHBondContact O-CB 3.47Å; V525-M529 VanDerWaalsContact O-CG 3.22Å; V525-M529 WeakPolarHBondContact O-CG 3.45Å; V525-M529 PolarHBondContact O-N 2.98Å; M529-F555 HydrophobicContact SD-CE2 3.86Å; M529-F555 HydrophobicContact SD-CZ 4.14Å; M529-I558 HydrophobicContact CE-CG2 4.48Å; M529-I587 HydrophobicContact CB-CG2 4.3Å; M529-I587 HydrophobicContact CE-CG2 3.74Å; M529-R590 WeakPolarHBondContact O-CD 3.36Å; M529-L591 HydrophobicContact CE-CD1 3.74Å; M529-L591 HydrophobicContact CE-CD2 3.83Å; M529-L591 HydrophobicContact CE-CG 4.09Å
530	S	72.1	Confident	65.3	Low	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-90.8	-21.8	-176.7	68.7	0	0	0	0	114.3	L526 S528 L532 F535 R590	L526-S530 VanDerWaalsContact O-CB 3.28Å; L526-S530 WeakPolarHBondContact O-CB 3.33Å; L526-S530 PolarHBondContact O-N 3.44Å; L526-S530 PolarHBondContact O-OG 3.28Å; S528-S530 PolarHBondContact O-N 3.37Å; S530-L532 VanDerWaalsContact C-N 3.34Å; S530-L532 PolarHBondContact OG-N 3.2Å; S530-F535 WeakPolarHBondContact OG-CZ 3.19Å; S530-R590 PolarHBondContact O-NH1 2.88Å
531	G	66.7	Low	64.9	Low	36 Å²	36	52.2 Å²	52.2	37%	0.371	29%	0.287	S	S	.	.			trans	59.8	39	-173	0	0	0	0	0	113.3	Q527 R590 K657	Q527-G531 WeakPolarHBondContact O-CA 3.33Å; Q527-G531 PolarHBondContact O-N 3.2Å; G531-R590 VanDerWaalsContact CA-NH1 3.31Å; G531-K657 PolarHBondContact O-NZ 3.33Å
532	L	69.3	Low	63.9	Low	6 Å²	6	58.2 Å²	58.2	3%	0.031	31%	0.309	C	S	.	.			trans	-119.2	136.3	177.6	-62.3	170.6	0	0	0	109.9	Q527 S530 F535 L583 L586 F646 I649 L654 K657	Q527-L532 WeakPolarHBondContact CG-O 3.37Å; S530-L532 VanDerWaalsContact C-N 3.34Å; S530-L532 PolarHBondContact OG-N 3.2Å; L532-F535 HydrophobicContact CB-CE1 4.22Å; L532-F535 HydrophobicContact CB-CE2 4.22Å; L532-F535 HydrophobicContact CB-CZ 3.61Å; L532-F535 HydrophobicContact CD1-CE1 4.33Å; L532-F535 HydrophobicContact CD1-CZ 4.34Å; L532-F535 WeakPolarHBondContact O-CE2 3.38Å; L532-L583 HydrophobicContact CD1-CD1 3.94Å; L532-L586 HydrophobicContact CD1-CD2 4.43Å; L532-F646 HydrophobicContact CD1-CB 4.42Å; L532-I649 HydrophobicContact CD2-CD1 3.33Å; L532-I649 HydrophobicContact CD2-CG1 4.46Å; L532-L654 HydrophobicContact CD1-CD1 4.1Å; L532-K657 HydrophobicContact CD2-CD 4.41Å; L532-K657 VanDerWaalsContact CD2-NZ 3.29Å
533	L	59.8	Low	63	Low	148 Å²	148	63.8 Å²	63.8	78%	0.775	34%	0.337	S	S	*	.	S	Bend	trans	-85	-27.7	-169.8	-73.2	156.6	0	0	0	114.5	Q527	Q527-L533 PolarHBondContact NE2-O 2.86Å; Q527-L533 VanDerWaalsContact NE2-O 3.1Å
534	T	56.4	Low	62.3	Low	58 Å²	58	61.4 Å²	61.4	36%	0.356	34%	0.335	S	S	.	.			trans	-124.5	128.4	-172.9	72.4	0	0	0	0	114.3	R644 T645 G647	T534-R644 PolarHBondContact OG1-O 2.92Å; T534-R644 VanDerWaalsContact OG1-O 3.12Å; T534-T645 CarbonylContact O-C 3.57Å; T534-T645 VanDerWaalsContact O-O 3.14Å; T534-G647 PolarHBondContact O-N 3.42Å; T534-G647 WeakPolarHBondContact OG1-CA 3.42Å; T534-G647 PolarHBondContact OG1-N 3.2Å
535	F	60.7	Low	61.7	Low	8 Å²	8	59.9 Å²	59.9	4%	0.035	33%	0.325	C	S	.	.			trans	-136.3	53.4	179.1	-60.9	-75.3	0	0	0	111.5	L526 Q527 S530 L532 T645	L526-F535 HydrophobicContact CD2-CD1 3.97Å; L526-F535 HydrophobicContact CD2-CD2 4.36Å; L526-F535 HydrophobicContact CD2-CE1 3.84Å; L526-F535 HydrophobicContact CD2-CE2 4.2Å; L526-F535 HydrophobicContact CD2-CG 4.23Å; L526-F535 HydrophobicContact CD2-CZ 3.93Å; L526-F535 HydrophobicContact CG-CE1 4.26Å; L526-F535 HydrophobicContact CG-CE2 4.18Å; L526-F535 HydrophobicContact CG-CZ 3.9Å; Q527-F535 HydrophobicContact CB-CE2 4.48Å; Q527-F535 HydrophobicContact CG-CD2 3.92Å; Q527-F535 HydrophobicContact CG-CE2 3.56Å; S530-F535 WeakPolarHBondContact OG-CZ 3.19Å; L532-F535 HydrophobicContact CB-CE1 4.22Å; L532-F535 HydrophobicContact CB-CE2 4.22Å; L532-F535 HydrophobicContact CB-CZ 3.61Å; L532-F535 HydrophobicContact CD1-CE1 4.33Å; L532-F535 HydrophobicContact CD1-CZ 4.34Å; L532-F535 WeakPolarHBondContact O-CE2 3.38Å; F535-T645 WeakPolarHBondContact CD1-O 3.47Å
536	K	61.9	Low	61.2	Low	161 Å²	161	60 Å²	60	70%	0.7	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-78.8	146	172.5	-69.5	-172	178.1	-175.7	0	109.5	T645	K536-T645 WeakPolarHBondContact O-CG2 3.42Å
537	S	64.2	Low	60.8	Low	64 Å²	64	64 Å²	64	45%	0.448	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-68.9	146.3	173.4	54.6	0	0	0	0	111.4
538	L	57.3	Low	60.5	Low	6 Å²	6	62.2 Å²	62.2	3%	0.031	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.2	166.2	-170	72.4	0	0	0	107.8	V544 I545 L546 T645 Y1221 I1225	L538-V544 CarbonylContact O-C 3.59Å; L538-I545 HydrophobicContact CD2-CB 4.45Å; L538-I545 PolarHBondContact O-N 3.09Å; L538-L546 HydrophobicContact CB-CB 4.01Å; L538-L546 HydrophobicContact CB-CD1 4.28Å; L538-L546 HydrophobicContact CD2-CD1 3.83Å; L538-L546 PolarHBondContact N-O 3.2Å; L538-L546 VanDerWaalsContact N-O 3.15Å; L538-L546 PolarHBondContact O-N 2.98Å; L538-T645 HydrophobicContact CB-CG2 4.32Å; L538-Y1221 HydrophobicContact CD1-CD2 4.31Å; L538-Y1221 HydrophobicContact CD1-CE2 3.79Å; L538-I1225 HydrophobicContact CD1-CG1 4.14Å; L538-I1225 HydrophobicContact CD2-CG1 4.33Å; L538-I1225 HydrophobicContact CG-CG1 4.44Å
539	S	57.8	Low	60.7	Low	46 Å²	46	60 Å²	60	32%	0.322	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	150.9	176.4	62.1	0	0	0	0	111.3	I543 Y1221	S539-I543 CarbonylContact C-O 3.6Å; S539-I543 WeakPolarHBondContact CA-O 3.18Å; S539-I543 VanDerWaalsContact CB-O 3.28Å; S539-I543 WeakPolarHBondContact CB-O 3.26Å; S539-Y1221 PolarHBondContact O-OH 2.98Å
540	T	49.3	Very low	60.7	Low	38 Å²	38	60.8 Å²	60.8	23%	0.233	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128.5	174.1	49.8	0	0	0	0	109	K542 I543 I545 I1225	T540-K542 VanDerWaalsContact C-N 3.29Å; T540-K542 PolarHBondContact O-N 3.03Å; T540-I543 PolarHBondContact N-O 2.69Å; T540-I543 WeakPolarHBondContact O-CA 3.38Å; T540-I543 WeakPolarHBondContact O-CB 3.42Å; T540-I543 PolarHBondContact O-N 3.14Å; T540-I545 HydrophobicContact CG2-CD1 3.58Å; T540-I545 WeakPolarHBondContact OG1-CD1 3.24Å; T540-I1225 HydrophobicContact CG2-CB 4.42Å; T540-I1225 HydrophobicContact CG2-CD1 3.51Å; T540-I1225 HydrophobicContact CG2-CG1 3.91Å; T540-I1225 HydrophobicContact CG2-CG2 3.62Å
541	N	50.3	Low	60.5	Low	162 Å²	162	68.6 Å²	68.6	87%	0.866	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	44	50.2	177.3	-65.1	-7.6	0	0	0	114	I543	N541-I543 PolarHBondContact O-N 3.04Å
542	K	49.9	Very low	60.9	Low	209 Å²	209	67 Å²	67	91%	0.909	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	-3.6	-176.6	-52.8	178.3	178.8	177.1	0	116.4	T540	T540-K542 VanDerWaalsContact C-N 3.29Å; T540-K542 PolarHBondContact O-N 3.03Å
543	I	50.7	Low	61.3	Low	119 Å²	119	67 Å²	67	61%	0.61	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	122.3	174.3	-57.1	169.1	0	0	0	108.9	S539 T540 N541 I545	S539-I543 CarbonylContact C-O 3.6Å; S539-I543 WeakPolarHBondContact CA-O 3.18Å; S539-I543 VanDerWaalsContact CB-O 3.28Å; S539-I543 WeakPolarHBondContact CB-O 3.26Å; T540-I543 PolarHBondContact N-O 2.69Å; T540-I543 WeakPolarHBondContact O-CA 3.38Å; T540-I543 WeakPolarHBondContact O-CB 3.42Å; T540-I543 PolarHBondContact O-N 3.14Å; N541-I543 PolarHBondContact O-N 3.04Å; I543-I545 PolarHBondContact O-N 3.32Å
544	V	54.9	Low	62.2	Low	66 Å²	66	60.1 Å²	60.1	40%	0.4	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	107.6	177	-177.4	0	0	0	0	108.9	L538 R547	L538-V544 CarbonylContact O-C 3.59Å; V544-R547 HydrophobicContact CG1-CG 3.7Å
545	I	57.8	Low	63.3	Low	18 Å²	18	57.5 Å²	57.5	9%	0.092	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-46.6	-179.1	-58.6	176.1	0	0	0	111	L538 T540 I543 I1225 V1228 I1232	L538-I545 HydrophobicContact CD2-CB 4.45Å; L538-I545 PolarHBondContact O-N 3.09Å; T540-I545 HydrophobicContact CG2-CD1 3.58Å; T540-I545 WeakPolarHBondContact OG1-CD1 3.24Å; I543-I545 PolarHBondContact O-N 3.32Å; I545-I1225 HydrophobicContact CD1-CG2 4.31Å; I545-V1228 HydrophobicContact CG2-CG1 3.73Å; I545-I1232 HydrophobicContact CG2-CD1 3.41Å; I545-I1232 VanDerWaalsContact CG2-CD1 3.41Å
546	L	60.6	Low	64.1	Low	4 Å²	4	57.1 Å²	57.1	2%	0.021	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	112.8	177.8	-75.1	151.5	0	0	0	108.8	L538 D576 T645 V1228	L538-L546 HydrophobicContact CB-CB 4.01Å; L538-L546 HydrophobicContact CB-CD1 4.28Å; L538-L546 HydrophobicContact CD2-CD1 3.83Å; L538-L546 PolarHBondContact N-O 3.2Å; L538-L546 VanDerWaalsContact N-O 3.15Å; L538-L546 PolarHBondContact O-N 2.98Å; L546-D576 HydrophobicContact CD2-CB 3.63Å; L546-T645 HydrophobicContact CB-CG2 3.77Å; L546-V1228 HydrophobicContact CD1-CG1 3.9Å; L546-V1228 HydrophobicContact CD1-CG2 4.34Å; L546-V1228 HydrophobicContact CG-CG1 4.48Å
547	R	64	Low	64.9	Low	83 Å²	83	49.5 Å²	49.5	31%	0.313	25%	0.247	S	C	.	.			trans	-77.2	146.6	177	-76.7	-179.4	170.7	-156.5	-7.8	110.8	E481 V544 M549	E481-R547 VanDerWaalsContact C-NH1 3.28Å; E481-R547 PolarHBondContact O-NH1 3.01Å; E481-R547 IonicContact OE2-NH1 3.79Å; V544-R547 HydrophobicContact CG1-CG 3.7Å; R547-M549 PolarHBondContact O-N 3.01Å
548	P	66.9	Low	65.5	Low	15 Å²	15	46.7 Å²	46.7	10%	0.097	23%	0.227	C	C	.	.			trans	-73.1	127.4	174.6	31.3	-32.4	0	0	0	109.7	H550 R551	P548-H550 VanDerWaalsContact CB-CE1 3.41Å; P548-H550 WeakPolarHBondContact CB-CE1 3.41Å; P548-H550 PolarHBondContact O-N 3.23Å; P548-H550 VanDerWaalsContact O-N 3.17Å; P548-R551 HydrophobicContact CG-CB 4.46Å; P548-R551 HydrophobicContact CG-CG 4.14Å; P548-R551 PolarHBondContact O-N 2.98Å
549	M	73.2	Confident	66.3	Low	8 Å²	8	46.9 Å²	46.9	4%	0.039	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-58.1	-31.8	-173.5	-74.5	-78.4	169.2	0	0	114.2	L526 R547 R551 S552 L554 F555 A580 L583	L526-M549 HydrophobicContact CD2-CB 3.87Å; R547-M549 PolarHBondContact O-N 3.01Å; M549-R551 PolarHBondContact O-N 3.38Å; M549-S552 WeakPolarHBondContact O-CB 3.37Å; M549-S552 PolarHBondContact O-N 3.27Å; M549-L554 HydrophobicContact SD-CD2 3.79Å; M549-F555 WeakPolarHBondContact O-CB 3.44Å; M549-A580 HydrophobicContact CE-CB 3.48Å; M549-A580 VanDerWaalsContact CE-CB 3.48Å; M549-L583 HydrophobicContact CB-CD2 3.92Å; M549-L583 HydrophobicContact CG-CD2 3.58Å; M549-L583 HydrophobicContact SD-CD2 4.46Å
550	H	70.2	Confident	67	Low	21 Å²	21	44.8 Å²	44.8	10%	0.097	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-63.8	-11.2	177.5	68.1	-93.7	0	0	0	114.1	F522 L526 P548	F522-H550 HydrophobicContact CB-CB 4.27Å; L526-H550 HydrophobicContact CB-CB 4.29Å; L526-H550 HydrophobicContact CD2-CB 3.9Å; P548-H550 VanDerWaalsContact CB-CE1 3.41Å; P548-H550 WeakPolarHBondContact CB-CE1 3.41Å; P548-H550 PolarHBondContact O-N 3.23Å; P548-H550 VanDerWaalsContact O-N 3.17Å
551	R	69.3	Low	68.2	Low	164 Å²	164	43.6 Å²	43.6	62%	0.619	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-107	4.1	173.7	-58.4	-170.9	179.6	-169.3	-6.5	113.2	M491 P548 M549	M491-R551 VanDerWaalsContact CE-O 3.28Å; M491-R551 WeakPolarHBondContact CE-O 3.38Å; P548-R551 HydrophobicContact CG-CB 4.46Å; P548-R551 HydrophobicContact CG-CG 4.14Å; P548-R551 PolarHBondContact O-N 2.98Å; M549-R551 PolarHBondContact O-N 3.38Å
552	S	75	Confident	69.6	Low	2 Å²	2	37.9 Å²	37.9	1%	0.014	17%	0.174	C	C	.	.	S	Bend	trans	-92.7	143.1	180	171.1	0	0	0	0	110.5	E481 M549 L554 F555 L556 R573	E481-S552 PolarHBondContact OE1-OG 3.49Å; M549-S552 WeakPolarHBondContact O-CB 3.37Å; M549-S552 PolarHBondContact O-N 3.27Å; S552-L554 PolarHBondContact O-N 3.34Å; S552-L554 VanDerWaalsContact OG-CB 3.27Å; S552-L554 WeakPolarHBondContact OG-CB 3.43Å; S552-L554 PolarHBondContact OG-N 3.05Å; S552-F555 PolarHBondContact O-N 2.9Å; S552-L556 PolarHBondContact O-N 3.45Å; S552-R573 PolarHBondContact OG-NH2 3Å
553	L	76.8	Confident	71	Confident	8 Å²	8	28.5 Å²	28.5	4%	0.042	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-24.5	169	-72.1	175.6	0	0	0	112.9	W426 I486 M491 F555 L556 A557	W426-L553 HydrophobicContact CD2-CD1 3.9Å; W426-L553 VanDerWaalsContact CE2-CD1 3.49Å; W426-L553 HydrophobicContact CE3-CD1 4.04Å; W426-L553 HydrophobicContact CH2-CD1 3.47Å; W426-L553 VanDerWaalsContact CH2-CD1 3.47Å; W426-L553 HydrophobicContact CZ2-CD1 3.31Å; W426-L553 HydrophobicContact CZ3-CD1 3.83Å; I486-L553 HydrophobicContact CD1-CD1 3.81Å; I486-L553 HydrophobicContact CD1-CD2 4Å; I486-L553 HydrophobicContact CD1-CG 4.32Å; M491-L553 HydrophobicContact CE-CD2 4.26Å; L553-F555 VanDerWaalsContact C-N 3.3Å; L553-F555 PolarHBondContact O-N 3.32Å; L553-L556 HydrophobicContact CD2-CD2 3.94Å; L553-L556 WeakPolarHBondContact O-CB 3.38Å; L553-L556 PolarHBondContact O-N 2.89Å; L553-A557 WeakPolarHBondContact O-CB 3.33Å; L553-A557 PolarHBondContact O-N 3.43Å
554	L	79.8	Confident	72.3	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-60.9	-41.4	172.5	172.4	141.7	0	0	0	111.2	M549 S552 A557 I558 I570 V584	M549-L554 HydrophobicContact SD-CD2 3.79Å; S552-L554 PolarHBondContact O-N 3.34Å; S552-L554 VanDerWaalsContact OG-CB 3.27Å; S552-L554 WeakPolarHBondContact OG-CB 3.43Å; S552-L554 PolarHBondContact OG-N 3.05Å; L554-A557 PolarHBondContact O-N 2.98Å; L554-I558 HydrophobicContact CD2-CD1 3.82Å; L554-I558 HydrophobicContact CG-CD1 4.32Å; L554-I558 WeakPolarHBondContact O-CD1 3.5Å; L554-I558 WeakPolarHBondContact O-CG1 3.49Å; L554-I558 PolarHBondContact O-N 3.35Å; L554-I570 HydrophobicContact CD1-CB 4.5Å; L554-I570 HydrophobicContact CD1-CD1 4.03Å; L554-I570 HydrophobicContact CD1-CG1 3.28Å; L554-V584 HydrophobicContact CD1-CG2 4.39Å; L554-V584 HydrophobicContact CD2-CG2 3.62Å; L554-V584 HydrophobicContact CG-CG2 4.33Å
555	F	78.9	Confident	73.5	Confident	3 Å²	3	27 Å²	27	1%	0.013	11%	0.113	C	C	.	.	H	α-helix	trans	-68.6	-40.5	174.7	-178.5	-119.6	0	0	0	111.5	F522 V525 L526 M529 M549 S552 L553 A557 I558 I559	F522-F555 HydrophobicContact CB-CE1 4.12Å; F522-F555 HydrophobicContact CD1-CE1 4.18Å; V525-F555 HydrophobicContact CB-CZ 4.33Å; V525-F555 HydrophobicContact CG1-CZ 4.1Å; L526-F555 HydrophobicContact CB-CE1 4.12Å; L526-F555 HydrophobicContact CB-CE2 4Å; L526-F555 HydrophobicContact CB-CZ 3.65Å; L526-F555 HydrophobicContact CD1-CD2 3.8Å; L526-F555 HydrophobicContact CD1-CE2 3.52Å; L526-F555 HydrophobicContact CD1-CZ 4.1Å; L526-F555 HydrophobicContact CG-CE2 4.33Å; L526-F555 HydrophobicContact CG-CZ 4.45Å; M529-F555 HydrophobicContact SD-CE2 3.86Å; M529-F555 HydrophobicContact SD-CZ 4.14Å; M549-F555 WeakPolarHBondContact O-CB 3.44Å; S552-F555 PolarHBondContact O-N 2.9Å; L553-F555 VanDerWaalsContact C-N 3.3Å; L553-F555 PolarHBondContact O-N 3.32Å; F555-A557 VanDerWaalsContact C-N 3.35Å; F555-A557 PolarHBondContact O-N 2.77Å; F555-I558 WeakPolarHBondContact O-CB 3.43Å; F555-I558 PolarHBondContact O-N 2.67Å; F555-I559 HydrophobicContact CD1-CD1 3.59Å; F555-I559 HydrophobicContact CD1-CG1 4.4Å; F555-I559 HydrophobicContact CD2-CD1 4.32Å; F555-I559 HydrophobicContact CD2-CG1 4.28Å; F555-I559 HydrophobicContact CE1-CD1 3.19Å; F555-I559 HydrophobicContact CE1-CG1 4.08Å; F555-I559 HydrophobicContact CE2-CD1 3.96Å; F555-I559 HydrophobicContact CE2-CG1 3.92Å; F555-I559 HydrophobicContact CG-CD1 4.16Å; F555-I559 HydrophobicContact CZ-CD1 3.39Å; F555-I559 HydrophobicContact CZ-CG1 3.82Å; F555-I559 VanDerWaalsContact O-CG1 3.3Å; F555-I559 WeakPolarHBondContact O-CG1 3.29Å; F555-I559 PolarHBondContact O-N 2.87Å
556	L	77.3	Confident	74.8	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-57.8	-47.6	173.6	-177.9	68.2	0	0	0	111.5	L430 M491 L494 F495 S552 L553 I558 I559 C560	L430-L556 HydrophobicContact CD1-CD2 3.76Å; L430-L556 HydrophobicContact CD1-CG 4.28Å; M491-L556 HydrophobicContact CG-CB 4.44Å; M491-L556 HydrophobicContact CG-CD1 4.28Å; M491-L556 HydrophobicContact CG-CD2 4.05Å; M491-L556 HydrophobicContact CG-CG 4.49Å; L494-L556 HydrophobicContact CB-CD2 4.36Å; L494-L556 HydrophobicContact CD2-CD2 3.5Å; L494-L556 HydrophobicContact CG-CD2 3.99Å; F495-L556 HydrophobicContact CB-CD1 3.69Å; F495-L556 HydrophobicContact CD2-CD1 3.76Å; F495-L556 HydrophobicContact CG-CD1 4.19Å; S552-L556 PolarHBondContact O-N 3.45Å; L553-L556 HydrophobicContact CD2-CD2 3.94Å; L553-L556 WeakPolarHBondContact O-CB 3.38Å; L553-L556 PolarHBondContact O-N 2.89Å; L556-I558 VanDerWaalsContact C-N 3.3Å; L556-I558 PolarHBondContact O-N 3.33Å; L556-I559 PolarHBondContact O-N 3.35Å; L556-I559 VanDerWaalsContact O-N 3.16Å; L556-C560 WeakPolarHBondContact O-CB 3.38Å; L556-C560 PolarHBondContact O-N 2.93Å; L556-C560 PolarHBondContact O-SG 3.46Å
557	A	78.1	Confident	75.8	Confident	0 Å²	0	27 Å²	27	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.4	-34.1	178.9	0	0	0	0	0	112.8	L430 L553 L554 F555 G561 R562 V565 V566 L569	L430-A557 HydrophobicContact CD2-CB 4Å; L553-A557 WeakPolarHBondContact O-CB 3.33Å; L553-A557 PolarHBondContact O-N 3.43Å; L554-A557 PolarHBondContact O-N 2.98Å; F555-A557 VanDerWaalsContact C-N 3.35Å; F555-A557 PolarHBondContact O-N 2.77Å; A557-G561 PolarHBondContact O-N 3.39Å; A557-R562 PolarHBondContact O-N 3.18Å; A557-V565 HydrophobicContact CB-CG1 4.18Å; A557-V566 HydrophobicContact CB-CG2 3.6Å; A557-L569 HydrophobicContact CB-CD1 4.06Å
558	I	77.3	Confident	76.6	Confident	6 Å²	6	24 Å²	24	3%	0.031	10%	0.102	C	C	.	.	H	α-helix	trans	-64.3	-48.7	171.9	-68.7	161.7	0	0	0	110.3	M529 L554 F555 L556 C560 G561 V566 V584 I587	M529-I558 HydrophobicContact CE-CG2 4.48Å; L554-I558 HydrophobicContact CD2-CD1 3.82Å; L554-I558 HydrophobicContact CG-CD1 4.32Å; L554-I558 WeakPolarHBondContact O-CD1 3.5Å; L554-I558 WeakPolarHBondContact O-CG1 3.49Å; L554-I558 PolarHBondContact O-N 3.35Å; F555-I558 WeakPolarHBondContact O-CB 3.43Å; F555-I558 PolarHBondContact O-N 2.67Å; L556-I558 VanDerWaalsContact C-N 3.3Å; L556-I558 PolarHBondContact O-N 3.33Å; I558-C560 VanDerWaalsContact C-N 3.29Å; I558-C560 PolarHBondContact O-N 3.15Å; I558-G561 PolarHBondContact O-N 3Å; I558-G561 VanDerWaalsContact O-N 3.08Å; I558-V566 HydrophobicContact CD1-CG1 4.49Å; I558-V566 HydrophobicContact CG1-CG1 4Å; I558-V566 HydrophobicContact CG1-CG2 3.71Å; I558-V584 HydrophobicContact CD1-CB 4.21Å; I558-V584 HydrophobicContact CD1-CG1 3.73Å; I558-V584 HydrophobicContact CD1-CG2 3.57Å; I558-V584 HydrophobicContact CG1-CG1 4.19Å; I558-I587 HydrophobicContact CG2-CG2 4Å
559	I	73.5	Confident	77.2	Confident	9 Å²	9	23.7 Å²	23.7	5%	0.046	10%	0.1	C	C	.	.	H	α-helix	trans	-63	-41.2	179.5	-58.2	164.8	0	0	0	109.4	F495 F506 F522 F555 L556 G561	F495-I559 HydrophobicContact CD2-CG2 4.32Å; F495-I559 HydrophobicContact CE2-CB 4.3Å; F495-I559 HydrophobicContact CE2-CG2 3.44Å; F495-I559 VanDerWaalsContact CE2-CG2 3.44Å; F495-I559 HydrophobicContact CZ-CG2 4.14Å; F506-I559 WeakPolarHBondContact CD2-O 3.23Å; F506-I559 HydrophobicContact CE2-CG2 3.96Å; F506-I559 WeakPolarHBondContact CE2-O 3.4Å; F522-I559 HydrophobicContact CD1-CD1 4.02Å; F522-I559 HydrophobicContact CE1-CD1 4.28Å; F555-I559 HydrophobicContact CD1-CD1 3.59Å; F555-I559 HydrophobicContact CD1-CG1 4.4Å; F555-I559 HydrophobicContact CD2-CD1 4.32Å; F555-I559 HydrophobicContact CD2-CG1 4.28Å; F555-I559 HydrophobicContact CE1-CD1 3.19Å; F555-I559 HydrophobicContact CE1-CG1 4.08Å; F555-I559 HydrophobicContact CE2-CD1 3.96Å; F555-I559 HydrophobicContact CE2-CG1 3.92Å; F555-I559 HydrophobicContact CG-CD1 4.16Å; F555-I559 HydrophobicContact CZ-CD1 3.39Å; F555-I559 HydrophobicContact CZ-CG1 3.82Å; F555-I559 VanDerWaalsContact O-CG1 3.3Å; F555-I559 WeakPolarHBondContact O-CG1 3.29Å; F555-I559 PolarHBondContact O-N 2.87Å; L556-I559 PolarHBondContact O-N 3.35Å; L556-I559 VanDerWaalsContact O-N 3.16Å; I559-G561 PolarHBondContact O-N 3.15Å; I559-G561 VanDerWaalsContact O-N 3.16Å
560	C	74.3	Confident	77.6	Confident	3 Å²	3	23.3 Å²	23.3	2%	0.02	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-3.5	175.8	-63.5	0	0	0	0	114.7	L556 I558 R562	L556-C560 WeakPolarHBondContact O-CB 3.38Å; L556-C560 PolarHBondContact O-N 2.93Å; L556-C560 PolarHBondContact O-SG 3.46Å; I558-C560 VanDerWaalsContact C-N 3.29Å; I558-C560 PolarHBondContact O-N 3.15Å; C560-R562 VanDerWaalsContact C-N 3.35Å; C560-R562 HydrophobicContact CB-CG 4.28Å; C560-R562 PolarHBondContact O-N 3.1Å
561	G	74.1	Confident	77.9	Confident	12 Å²	12	24.5 Å²	24.5	12%	0.124	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	21.2	178.1	0	0	0	0	0	115.3	A557 I558 I559 F563	A557-G561 PolarHBondContact O-N 3.39Å; I558-G561 PolarHBondContact O-N 3Å; I558-G561 VanDerWaalsContact O-N 3.08Å; I559-G561 PolarHBondContact O-N 3.15Å; I559-G561 VanDerWaalsContact O-N 3.16Å; G561-F563 PolarHBondContact O-N 2.73Å
562	R	78.2	Confident	77.9	Confident	42 Å²	42	17.4 Å²	17.4	16%	0.158	8%	0.075	C	C	.	.			trans	-98.2	73	-176.8	-59.3	-50.5	-169.6	168.2	8.1	112.2	L430 L431 T503 A557 C560 R564 V565 V566	L430-R562 WeakPolarHBondContact O-CG 3.09Å; L430-R562 PolarHBondContact O-NE 2.94Å; L431-R562 PolarHBondContact O-NH2 3.14Å; T503-R562 PolarHBondContact OG1-NH2 3.11Å; A557-R562 PolarHBondContact O-N 3.18Å; C560-R562 VanDerWaalsContact C-N 3.35Å; C560-R562 HydrophobicContact CB-CG 4.28Å; C560-R562 PolarHBondContact O-N 3.1Å; R562-R564 VanDerWaalsContact C-N 3.32Å; R562-R564 PolarHBondContact O-N 2.64Å; R562-V565 HydrophobicContact CB-CB 4.23Å; R562-V565 PolarHBondContact O-N 3.49Å; R562-V566 WeakPolarHBondContact O-CG2 3.41Å; R562-V566 PolarHBondContact O-N 3.16Å
563	F	79.8	Confident	77.9	Confident	12 Å²	12	17.6 Å²	17.6	5%	0.053	8%	0.076	C	C	.	.	H	α-helix	trans	-67.7	-26.4	-169.6	-52.2	-60.3	0	0	0	114.3	G561 V566 E567 L588 M601 L605 F608	G561-F563 PolarHBondContact O-N 2.73Å; F563-V566 WeakPolarHBondContact O-CB 3.26Å; F563-V566 PolarHBondContact O-N 3.37Å; F563-E567 PolarHBondContact O-N 3.11Å; F563-L588 HydrophobicContact CD1-CD2 3.77Å; F563-L588 HydrophobicContact CE1-CD2 3.46Å; F563-L588 VanDerWaalsContact CE1-CD2 3.46Å; F563-L588 HydrophobicContact CZ-CD2 4.42Å; F563-M601 HydrophobicContact CE2-CE 4.35Å; F563-L605 HydrophobicContact CE1-CD1 3.96Å; F563-L605 HydrophobicContact CE2-CD1 4.17Å; F563-L605 HydrophobicContact CZ-CD1 3.73Å; F563-F608 HydrophobicContact CB-CB 4.42Å; F563-F608 HydrophobicContact CB-CD1 3.74Å; F563-F608 HydrophobicContact CB-CD2 3.82Å; F563-F608 HydrophobicContact CB-CE1 3.81Å; F563-F608 HydrophobicContact CB-CE2 3.93Å; F563-F608 HydrophobicContact CB-CG 3.75Å; F563-F608 HydrophobicContact CB-CZ 3.93Å; F563-F608 HydrophobicContact CD2-CD2 4.12Å; F563-F608 HydrophobicContact CD2-CE2 4.24Å; F563-F608 HydrophobicContact CG-CD2 4.22Å; F563-F608 HydrophobicContact CG-CG 4.41Å
564	R	78.8	Confident	77.3	Confident	154 Å²	154	19.5 Å²	19.5	58%	0.581	9%	0.085	S	C	*	.	H	α-helix	trans	-69.3	-45.6	175	-62.7	-177.7	175.2	-175.5	-1.3	111.3	D433 V435 R562 V566 E567 Q568 F608	D433-R564 WeakPolarHBondContact OD2-CD 3.25Å; V435-R564 HydrophobicContact CG2-CB 4.01Å; R562-R564 VanDerWaalsContact C-N 3.32Å; R562-R564 PolarHBondContact O-N 2.64Å; R564-V566 VanDerWaalsContact C-N 3.3Å; R564-V566 PolarHBondContact O-N 3.36Å; R564-E567 WeakPolarHBondContact O-CB 3.23Å; R564-E567 PolarHBondContact O-N 3.05Å; R564-Q568 PolarHBondContact O-N 3.42Å; R564-Q568 VanDerWaalsContact O-N 3.11Å; R564-F608 HydrophobicContact CG-CE1 4.05Å; R564-F608 HydrophobicContact CG-CZ 3.97Å
565	V	80.3	Confident	76.7	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-59.6	-41	170.4	167.4	0	0	0	0	111.2	I429 L430 D433 L438 A557 R562 E567 Q568 L569	I429-V565 HydrophobicContact CG2-CG1 4.42Å; I429-V565 HydrophobicContact CG2-CG2 4.09Å; L430-V565 HydrophobicContact CD2-CG1 4.29Å; D433-V565 VanDerWaalsContact OD1-CG2 3.23Å; D433-V565 WeakPolarHBondContact OD1-CG2 3.33Å; D433-V565 PolarHBondContact OD1-N 3.4Å; L438-V565 HydrophobicContact CD2-CG1 4.23Å; A557-V565 HydrophobicContact CB-CG1 4.18Å; R562-V565 HydrophobicContact CB-CB 4.23Å; R562-V565 PolarHBondContact O-N 3.49Å; V565-E567 PolarHBondContact O-N 3.13Å; V565-Q568 PolarHBondContact O-N 3.29Å; V565-L569 HydrophobicContact CG1-CD1 3.73Å; V565-L569 HydrophobicContact CG1-CG 4.07Å; V565-L569 WeakPolarHBondContact O-CB 3.33Å; V565-L569 VanDerWaalsContact O-CG 3.26Å; V565-L569 WeakPolarHBondContact O-CG 3.46Å; V565-L569 PolarHBondContact O-N 3.14Å
566	V	83.6	Confident	76.4	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-59.3	-46.1	175.7	173.1	0	0	0	0	111.8	A557 I558 R562 F563 R564 Q568 L569 I570 V584	A557-V566 HydrophobicContact CB-CG2 3.6Å; I558-V566 HydrophobicContact CD1-CG1 4.49Å; I558-V566 HydrophobicContact CG1-CG1 4Å; I558-V566 HydrophobicContact CG1-CG2 3.71Å; R562-V566 WeakPolarHBondContact O-CG2 3.41Å; R562-V566 PolarHBondContact O-N 3.16Å; F563-V566 WeakPolarHBondContact O-CB 3.26Å; F563-V566 PolarHBondContact O-N 3.37Å; R564-V566 VanDerWaalsContact C-N 3.3Å; R564-V566 PolarHBondContact O-N 3.36Å; V566-Q568 VanDerWaalsContact C-N 3.31Å; V566-Q568 PolarHBondContact O-N 3.08Å; V566-L569 PolarHBondContact O-N 3.35Å; V566-I570 HydrophobicContact CG1-CD1 3.95Å; V566-I570 WeakPolarHBondContact O-CG1 3.4Å; V566-I570 PolarHBondContact O-N 3.45Å; V566-V584 HydrophobicContact CG1-CG1 3.99Å
567	E	82.8	Confident	76.6	Confident	22 Å²	22	21.5 Å²	21.5	10%	0.103	9%	0.094	C	C	.	.	H	α-helix	trans	-56.5	-46.9	176.8	-174.6	177.7	170.3	0	0	110.9	F563 R564 V565 I570 R571 R611 L612 I615	F563-E567 PolarHBondContact O-N 3.11Å; R564-E567 WeakPolarHBondContact O-CB 3.23Å; R564-E567 PolarHBondContact O-N 3.05Å; V565-E567 PolarHBondContact O-N 3.13Å; E567-I570 PolarHBondContact O-N 3.26Å; E567-R571 WeakPolarHBondContact O-CG 3.39Å; E567-R571 PolarHBondContact O-N 3.37Å; E567-R571 VanDerWaalsContact O-N 3.16Å; E567-R571 IonicContact OE1-CZ 3.92Å; E567-R571 IonicContact OE1-NE 3.94Å; E567-R571 IonicContact OE1-NH2 3.67Å; E567-R571 PolarHBondContact OE1-NH2 2.97Å; E567-R611 IonicContact OE2-CZ 3.95Å; E567-R611 IonicContact OE2-NH1 3.15Å; E567-R611 PolarHBondContact OE2-NH1 2.95Å; E567-L612 HydrophobicContact CB-CD2 4.38Å; E567-L612 HydrophobicContact CG-CD2 4.37Å; E567-I615 HydrophobicContact CG-CD1 4.03Å
568	Q	79.5	Confident	76.8	Confident	18 Å²	18	21.6 Å²	21.6	8%	0.084	9%	0.094	C	C	.	.	H	α-helix	trans	-70.2	-39	-179.7	-168.6	67.6	-8.7	0	0	112.9	V435 L438 E439 R564 V565 V566 I570 R571 M572	V435-Q568 HydrophobicContact CG1-CB 4.21Å; V435-Q568 HydrophobicContact CG1-CG 4.07Å; L438-Q568 HydrophobicContact CD2-CB 4.04Å; L438-Q568 HydrophobicContact CD2-CG 3.95Å; E439-Q568 PolarHBondContact OE1-NE2 2.85Å; R564-Q568 PolarHBondContact O-N 3.42Å; R564-Q568 VanDerWaalsContact O-N 3.11Å; V565-Q568 PolarHBondContact O-N 3.29Å; V566-Q568 VanDerWaalsContact C-N 3.31Å; V566-Q568 PolarHBondContact O-N 3.08Å; Q568-I570 VanDerWaalsContact C-N 3.27Å; Q568-I570 PolarHBondContact O-N 2.73Å; Q568-R571 WeakPolarHBondContact O-CB 3.27Å; Q568-R571 PolarHBondContact O-N 3.47Å; Q568-R571 VanDerWaalsContact O-N 3.13Å; Q568-M572 HydrophobicContact CG-CE 3.62Å; Q568-M572 VanDerWaalsContact O-CG 3.29Å; Q568-M572 WeakPolarHBondContact O-CG 3.36Å; Q568-M572 PolarHBondContact O-N 3.36Å
569	L	79.7	Confident	77.1	Confident	9 Å²	9	21.4 Å²	21.4	5%	0.047	9%	0.093	C	C	.	.	H	α-helix	trans	-61.4	-35.7	174.5	-73.3	174.5	0	0	0	112.1	W426 L438 F480 A557 V565 V566 M572 R573	W426-L569 HydrophobicContact CH2-CD2 4.03Å; L438-L569 HydrophobicContact CD1-CD2 4.05Å; L438-L569 HydrophobicContact CD2-CD2 3.97Å; L438-L569 HydrophobicContact CD2-CG 4.09Å; F480-L569 HydrophobicContact CE1-CD2 4.26Å; A557-L569 HydrophobicContact CB-CD1 4.06Å; V565-L569 HydrophobicContact CG1-CD1 3.73Å; V565-L569 HydrophobicContact CG1-CG 4.07Å; V565-L569 WeakPolarHBondContact O-CB 3.33Å; V565-L569 VanDerWaalsContact O-CG 3.26Å; V565-L569 WeakPolarHBondContact O-CG 3.46Å; V565-L569 PolarHBondContact O-N 3.14Å; V566-L569 PolarHBondContact O-N 3.35Å; L569-M572 PolarHBondContact O-N 2.97Å; L569-R573 PolarHBondContact O-N 3.39Å
570	I	81.6	Confident	77.5	Confident	0 Å²	0	21 Å²	21	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.2	-43.4	173.6	-70.6	168.7	0	0	0	110.7	L554 V566 E567 Q568 M572 R573 V577 A581 V584 L612 I615	L554-I570 HydrophobicContact CD1-CB 4.5Å; L554-I570 HydrophobicContact CD1-CD1 4.03Å; L554-I570 HydrophobicContact CD1-CG1 3.28Å; V566-I570 HydrophobicContact CG1-CD1 3.95Å; V566-I570 WeakPolarHBondContact O-CG1 3.4Å; V566-I570 PolarHBondContact O-N 3.45Å; E567-I570 PolarHBondContact O-N 3.26Å; Q568-I570 VanDerWaalsContact C-N 3.27Å; Q568-I570 PolarHBondContact O-N 2.73Å; I570-M572 PolarHBondContact O-N 3.19Å; I570-R573 PolarHBondContact O-N 3.26Å; I570-V577 HydrophobicContact CG2-CG1 3.98Å; I570-A581 HydrophobicContact CG2-CB 4.32Å; I570-V584 HydrophobicContact CD1-CB 4.31Å; I570-V584 HydrophobicContact CD1-CG1 4.47Å; I570-V584 HydrophobicContact CD1-CG2 4.09Å; I570-L612 HydrophobicContact CD1-CD1 3.95Å; I570-L612 HydrophobicContact CD1-CD2 3.46Å; I570-L612 VanDerWaalsContact CD1-CD2 3.46Å; I570-L612 HydrophobicContact CD1-CG 4.29Å; I570-I615 HydrophobicContact CG2-CG2 4.25Å
571	R	76.6	Confident	78.1	Confident	47 Å²	47	20.8 Å²	20.8	18%	0.177	9%	0.09	C	C	.	.	H	α-helix	trans	-64.8	-27.3	177.1	-67	173.7	-177.5	-162.7	1.8	112.8	E567 Q568 I615 L1246	E567-R571 WeakPolarHBondContact O-CG 3.39Å; E567-R571 PolarHBondContact O-N 3.37Å; E567-R571 VanDerWaalsContact O-N 3.16Å; E567-R571 IonicContact OE1-CZ 3.92Å; E567-R571 IonicContact OE1-NE 3.94Å; E567-R571 IonicContact OE1-NH2 3.67Å; E567-R571 PolarHBondContact OE1-NH2 2.97Å; Q568-R571 WeakPolarHBondContact O-CB 3.27Å; Q568-R571 PolarHBondContact O-N 3.47Å; Q568-R571 VanDerWaalsContact O-N 3.13Å; R571-I615 HydrophobicContact CG-CD1 4.19Å; R571-L1246 PolarHBondContact NH2-O 3.41Å
572	M	70.1	Confident	78.7	Confident	14 Å²	14	20.3 Å²	20.3	7%	0.069	9%	0.085	C	C	.	.	H	α-helix	trans	-80.9	-20.5	178.9	-70.3	-177.8	-178.8	0	0	114.1	L438 E439 R442 F480 Q568 L569 I570	L438-M572 HydrophobicContact CD1-SD 4.43Å; L438-M572 HydrophobicContact CD2-CE 4.06Å; L438-M572 HydrophobicContact CD2-SD 4.27Å; L438-M572 HydrophobicContact CG-CE 3.72Å; L438-M572 HydrophobicContact CG-SD 4.08Å; E439-M572 HydrophobicContact CG-CE 4.19Å; R442-M572 HydrophobicContact CB-CE 3.85Å; R442-M572 HydrophobicContact CB-SD 4.1Å; R442-M572 HydrophobicContact CG-CE 4.28Å; R442-M572 HydrophobicContact CG-SD 4.27Å; F480-M572 HydrophobicContact CD1-CB 4.4Å; F480-M572 HydrophobicContact CD1-SD 4.33Å; F480-M572 HydrophobicContact CE1-SD 3.8Å; F480-M572 HydrophobicContact CZ-SD 4.02Å; Q568-M572 HydrophobicContact CG-CE 3.62Å; Q568-M572 VanDerWaalsContact O-CG 3.29Å; Q568-M572 WeakPolarHBondContact O-CG 3.36Å; Q568-M572 PolarHBondContact O-N 3.36Å; L569-M572 PolarHBondContact O-N 2.97Å; I570-M572 PolarHBondContact O-N 3.19Å
573	R	73.9	Confident	79	Confident	7 Å²	7	18.4 Å²	18.4	3%	0.026	8%	0.078	C	C	.	.			trans	-66.7	139.4	-179.9	-82.6	167.6	159.3	-118.1	-2.9	111.5	E481 S552 L569 I570 D576 V577	E481-R573 IonicContact OE1-CZ 3.04Å; E481-R573 IonicContact OE1-NE 3.8Å; E481-R573 PolarHBondContact OE1-NE 2.68Å; E481-R573 VanDerWaalsContact OE1-NE 3.15Å; E481-R573 IonicContact OE1-NH2 3.98Å; E481-R573 PolarHBondContact OE1-NH2 2.76Å; E481-R573 IonicContact OE2-NH2 3.23Å; E481-R573 PolarHBondContact OE2-NH2 2.89Å; S552-R573 PolarHBondContact OG-NH2 3Å; L569-R573 PolarHBondContact O-N 3.39Å; I570-R573 PolarHBondContact O-N 3.26Å; R573-D576 IonicContact CZ-OD1 3.15Å; R573-D576 IonicContact CZ-OD2 2.7Å; R573-D576 IonicContact NE-OD1 3.51Å; R573-D576 IonicContact NH1-OD1 3.48Å; R573-D576 PolarHBondContact NH1-OD1 3.34Å; R573-D576 IonicContact NH1-OD2 3.66Å; R573-D576 PolarHBondContact NH1-OD2 2.83Å; R573-V577 HydrophobicContact CB-CG2 3.96Å; R573-V577 WeakPolarHBondContact O-CG2 3.41Å
574	Q	65.4	Low	79.3	Confident	48 Å²	48	17.9 Å²	17.9	22%	0.224	8%	0.075	C	C	.	.	S	Bend	trans	-96.1	-41	-174.6	-57.7	-169.9	0.9	0	0	113.1	D479	D479-Q574 WeakPolarHBondContact OD1-CB 3.48Å; D479-Q574 VanDerWaalsContact OD1-CG 3.23Å; D479-Q574 WeakPolarHBondContact OD1-CG 3.42Å
575	F	67.3	Low	79.7	Confident	35 Å²	35	10.6 Å²	10.6	15%	0.154	5%	0.048	C	C	.	.	S	Bend	trans	-108.5	-32.9	-166.6	-51.8	-55.8	0	0	0	114.2	L477 D479 I1232	L477-F575 HydrophobicContact CD2-CE1 3.87Å; L477-F575 HydrophobicContact CD2-CE2 4.4Å; L477-F575 HydrophobicContact CD2-CZ 3.4Å; L477-F575 VanDerWaalsContact CD2-CZ 3.4Å; L477-F575 HydrophobicContact CG-CZ 4.19Å; D479-F575 HydrophobicContact CB-CD2 4.34Å; D479-F575 HydrophobicContact CB-CE2 3.9Å; D479-F575 VanDerWaalsContact CG-CE2 3.5Å; D479-F575 WeakPolarHBondContact OD2-CD2 3.12Å; F575-I1232 HydrophobicContact CB-CD1 4.18Å; F575-I1232 HydrophobicContact CB-CG1 4.29Å; F575-I1232 HydrophobicContact CB-CG2 4.05Å; F575-I1232 HydrophobicContact CD1-CG2 3.44Å; F575-I1232 VanDerWaalsContact CD1-CG2 3.44Å; F575-I1232 HydrophobicContact CE1-CG2 4.32Å; F575-I1232 HydrophobicContact CG-CG2 4.11Å; F575-I1232 WeakPolarHBondContact O-CG1 3.11Å
576	D	73	Confident	80	Confident	10 Å²	10	10.7 Å²	10.7	5%	0.053	5%	0.049	C	C	.	.			trans	-120.5	24.3	-168.7	68.7	-9.5	0	0	0	114.7	L546 R573 L578 P579 A580	L546-D576 HydrophobicContact CD2-CB 3.63Å; R573-D576 IonicContact CZ-OD1 3.15Å; R573-D576 IonicContact CZ-OD2 2.7Å; R573-D576 IonicContact NE-OD1 3.51Å; R573-D576 IonicContact NH1-OD1 3.48Å; R573-D576 PolarHBondContact NH1-OD1 3.34Å; R573-D576 IonicContact NH1-OD2 3.66Å; R573-D576 PolarHBondContact NH1-OD2 2.83Å; D576-L578 VanDerWaalsContact C-N 3.33Å; D576-L578 PolarHBondContact O-N 3.21Å; D576-P579 WeakPolarHBondContact O-CD 3.35Å; D576-A580 WeakPolarHBondContact O-CB 3.15Å; D576-A580 PolarHBondContact O-N 3.07Å
577	V	80.8	Confident	79.9	Confident	2 Å²	2	10.8 Å²	10.8	1%	0.012	5%	0.049	C	C	.	.	H	α-helix	trans	-50.5	-47.6	-179	-174.3	0	0	0	0	112.6	I570 R573 A581 I615 V619 Q1235	I570-V577 HydrophobicContact CG2-CG1 3.98Å; R573-V577 HydrophobicContact CB-CG2 3.96Å; R573-V577 WeakPolarHBondContact O-CG2 3.41Å; V577-A581 VanDerWaalsContact O-CB 3.25Å; V577-A581 WeakPolarHBondContact O-CB 3.46Å; V577-A581 PolarHBondContact O-N 3.47Å; V577-I615 HydrophobicContact CG1-CG2 4.3Å; V577-V619 HydrophobicContact CG1-CG2 4.03Å; V577-Q1235 VanDerWaalsContact CG2-NE2 3.35Å
578	L	82.9	Confident	79.9	Confident	2 Å²	2	9.8 Å²	9.8	1%	0.01	5%	0.045	C	C	.	.	H	α-helix	trans	-69.4	-54.2	-174.5	177.8	68.8	0	0	0	112.8	D576 A580 A581 V582 A616 V619 L620 L651 F1231	D576-L578 VanDerWaalsContact C-N 3.33Å; D576-L578 PolarHBondContact O-N 3.21Å; L578-A580 VanDerWaalsContact C-N 3.28Å; L578-A580 PolarHBondContact O-N 2.9Å; L578-A581 PolarHBondContact O-N 3.15Å; L578-V582 HydrophobicContact CD1-CG2 4.46Å; L578-V582 WeakPolarHBondContact O-CG2 3.18Å; L578-V582 PolarHBondContact O-N 3.02Å; L578-A616 HydrophobicContact CD1-CB 3.83Å; L578-V619 HydrophobicContact CB-CG1 4.42Å; L578-L620 HydrophobicContact CD2-CD1 4.2Å; L578-L651 HydrophobicContact CD2-CD2 3.68Å; L578-L651 HydrophobicContact CG-CD2 4.01Å; L578-F1231 HydrophobicContact CB-CE1 4.49Å; L578-F1231 HydrophobicContact CB-CZ 4.42Å; L578-F1231 HydrophobicContact CD2-CE1 4.32Å; L578-F1231 HydrophobicContact CD2-CE2 4.39Å; L578-F1231 HydrophobicContact CD2-CZ 3.64Å
579	P	82.1	Confident	80.2	Confident	2 Å²	2	11.5 Å²	11.5	1%	0.013	5%	0.05	C	C	.	.	H	α-helix	trans	-60.6	-35.3	174.2	-23.6	33.4	0	0	0	113.6	D576 L583 M638 L643 F646 L651	D576-P579 WeakPolarHBondContact O-CD 3.35Å; P579-L583 WeakPolarHBondContact O-CB 3.28Å; P579-L583 PolarHBondContact O-N 2.88Å; P579-L583 VanDerWaalsContact O-N 3.07Å; P579-M638 HydrophobicContact CG-CE 3.73Å; P579-L643 HydrophobicContact CB-CD1 4.38Å; P579-L643 HydrophobicContact CG-CD1 4.37Å; P579-F646 HydrophobicContact CB-CE2 3.55Å; P579-F646 HydrophobicContact CB-CZ 3.55Å; P579-L651 HydrophobicContact CB-CD1 4.35Å; P579-L651 HydrophobicContact CG-CD1 4.43Å
580	A	82.9	Confident	80.2	Confident	0 Å²	0	15 Å²	15	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-61.8	-54.9	175.8	0	0	0	0	0	111.2	M549 D576 L578 V582 L583 V584	M549-A580 HydrophobicContact CE-CB 3.48Å; M549-A580 VanDerWaalsContact CE-CB 3.48Å; D576-A580 WeakPolarHBondContact O-CB 3.15Å; D576-A580 PolarHBondContact O-N 3.07Å; L578-A580 VanDerWaalsContact C-N 3.28Å; L578-A580 PolarHBondContact O-N 2.9Å; A580-V582 VanDerWaalsContact C-N 3.3Å; A580-V582 PolarHBondContact O-N 3.25Å; A580-L583 PolarHBondContact O-N 3.27Å; A580-L583 VanDerWaalsContact O-N 3.08Å; A580-V584 WeakPolarHBondContact O-CG2 3.44Å; A580-V584 PolarHBondContact O-N 3.44Å
581	A	86.4	Confident	79.9	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-56	-44.5	-178.7	0	0	0	0	0	111.7	I570 V577 L578 L583 V584 T585 A616	I570-A581 HydrophobicContact CG2-CB 4.32Å; V577-A581 VanDerWaalsContact O-CB 3.25Å; V577-A581 WeakPolarHBondContact O-CB 3.46Å; V577-A581 PolarHBondContact O-N 3.47Å; L578-A581 PolarHBondContact O-N 3.15Å; A581-L583 PolarHBondContact O-N 2.91Å; A581-V584 PolarHBondContact O-N 3.01Å; A581-T585 WeakPolarHBondContact O-CG2 3.04Å; A581-T585 PolarHBondContact O-N 3.24Å; A581-T585 PolarHBondContact O-OG1 2.81Å; A581-A616 HydrophobicContact CB-CB 4.18Å
582	V	86.8	Confident	79.9	Confident	1 Å²	1	15.8 Å²	15.8	1%	0.006	7%	0.069	C	C	.	.	H	α-helix	trans	-67	-36.4	178.5	179.8	0	0	0	0	112.3	L578 A580 T585 L586 L651 L654 C655 A658	L578-V582 HydrophobicContact CD1-CG2 4.46Å; L578-V582 WeakPolarHBondContact O-CG2 3.18Å; L578-V582 PolarHBondContact O-N 3.02Å; A580-V582 VanDerWaalsContact C-N 3.3Å; A580-V582 PolarHBondContact O-N 3.25Å; V582-T585 WeakPolarHBondContact CA-OG1 3.44Å; V582-T585 PolarHBondContact O-OG1 3.03Å; V582-L586 PolarHBondContact O-N 3.48Å; V582-L586 VanDerWaalsContact O-N 3.08Å; V582-L651 HydrophobicContact CG2-CD1 4.49Å; V582-L654 HydrophobicContact CB-CD2 4.46Å; V582-L654 HydrophobicContact CG1-CB 4.33Å; V582-L654 HydrophobicContact CG1-CD2 4.05Å; V582-L654 HydrophobicContact CG1-CG 3.86Å; V582-C655 HydrophobicContact CG1-CB 4.38Å; V582-A658 HydrophobicContact CG1-CB 4.05Å
583	L	84.5	Confident	80	Confident	2 Å²	2	20.2 Å²	20.2	1%	0.01	9%	0.087	C	C	.	.	H	α-helix	trans	-68	-41.4	174.6	-177.7	70.1	0	0	0	111.3	L532 M549 P579 A580 A581 L586 I587 F646	L532-L583 HydrophobicContact CD1-CD1 3.94Å; M549-L583 HydrophobicContact CB-CD2 3.92Å; M549-L583 HydrophobicContact CG-CD2 3.58Å; M549-L583 HydrophobicContact SD-CD2 4.46Å; P579-L583 WeakPolarHBondContact O-CB 3.28Å; P579-L583 PolarHBondContact O-N 2.88Å; P579-L583 VanDerWaalsContact O-N 3.07Å; A580-L583 PolarHBondContact O-N 3.27Å; A580-L583 VanDerWaalsContact O-N 3.08Å; A581-L583 PolarHBondContact O-N 2.91Å; L583-L586 HydrophobicContact CD1-CD2 4.24Å; L583-L586 WeakPolarHBondContact O-CB 3.44Å; L583-L586 PolarHBondContact O-N 2.77Å; L583-I587 HydrophobicContact CD2-CD1 4.43Å; L583-I587 HydrophobicContact CG-CD1 4.08Å; L583-I587 WeakPolarHBondContact O-CG1 3.09Å; L583-I587 PolarHBondContact O-N 3.49Å; L583-F646 HydrophobicContact CB-CD1 4.28Å; L583-F646 HydrophobicContact CB-CE1 3.81Å; L583-F646 HydrophobicContact CD1-CD1 4.1Å; L583-F646 HydrophobicContact CD1-CE1 4.39Å; L583-F646 HydrophobicContact CD2-CD1 4.06Å; L583-F646 HydrophobicContact CD2-CE1 3.68Å; L583-F646 HydrophobicContact CG-CD1 4.35Å; L583-F646 HydrophobicContact CG-CE1 4.13Å
584	V	86.4	Confident	79.9	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.006	10%	0.099	C	C	.	.	H	α-helix	trans	-64.1	-45.2	178	-178.9	0	0	0	0	110.5	L554 I558 V566 I570 A580 A581 L586 I587 L588 L612	L554-V584 HydrophobicContact CD1-CG2 4.39Å; L554-V584 HydrophobicContact CD2-CG2 3.62Å; L554-V584 HydrophobicContact CG-CG2 4.33Å; I558-V584 HydrophobicContact CD1-CB 4.21Å; I558-V584 HydrophobicContact CD1-CG1 3.73Å; I558-V584 HydrophobicContact CD1-CG2 3.57Å; I558-V584 HydrophobicContact CG1-CG1 4.19Å; V566-V584 HydrophobicContact CG1-CG1 3.99Å; I570-V584 HydrophobicContact CD1-CB 4.31Å; I570-V584 HydrophobicContact CD1-CG1 4.47Å; I570-V584 HydrophobicContact CD1-CG2 4.09Å; A580-V584 WeakPolarHBondContact O-CG2 3.44Å; A580-V584 PolarHBondContact O-N 3.44Å; A581-V584 PolarHBondContact O-N 3.01Å; V584-L586 VanDerWaalsContact C-N 3.26Å; V584-L586 PolarHBondContact O-N 2.89Å; V584-I587 PolarHBondContact O-N 3.29Å; V584-L588 HydrophobicContact CG1-CD1 3.95Å; V584-L588 HydrophobicContact CG1-CG 4.02Å; V584-L588 WeakPolarHBondContact O-CG 3.1Å; V584-L588 PolarHBondContact O-N 3.45Å; V584-L612 HydrophobicContact CB-CD1 3.98Å; V584-L612 HydrophobicContact CG1-CD1 3.36Å
585	T	87.4	Confident	79.8	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.006	13%	0.129	C	C	.	.	H	α-helix	trans	-60.2	-36.6	175.8	56.5	0	0	0	0	112.2	A581 V582 R589 A609 L612 C660	A581-T585 WeakPolarHBondContact O-CG2 3.04Å; A581-T585 PolarHBondContact O-N 3.24Å; A581-T585 PolarHBondContact O-OG1 2.81Å; V582-T585 WeakPolarHBondContact CA-OG1 3.44Å; V582-T585 PolarHBondContact O-OG1 3.03Å; T585-R589 VanDerWaalsContact O-CB 3.31Å; T585-R589 WeakPolarHBondContact O-CB 3.29Å; T585-R589 VanDerWaalsContact O-CG 3.32Å; T585-R589 WeakPolarHBondContact O-CG 3.41Å; T585-R589 PolarHBondContact O-N 2.91Å; T585-A609 WeakPolarHBondContact CG2-O 3.19Å; T585-L612 HydrophobicContact CG2-CB 3.6Å; T585-C660 PolarHBondContact OG1-SG 3.32Å
586	L	85.2	Confident	79.7	Confident	3 Å²	3	28.8 Å²	28.8	2%	0.016	15%	0.145	C	C	.	.	H	α-helix	trans	-59.6	-47.1	171.8	177.2	67.1	0	0	0	111.8	L532 V582 L583 V584 R590 L654 K657 A658	L532-L586 HydrophobicContact CD1-CD2 4.43Å; V582-L586 PolarHBondContact O-N 3.48Å; V582-L586 VanDerWaalsContact O-N 3.08Å; L583-L586 HydrophobicContact CD1-CD2 4.24Å; L583-L586 WeakPolarHBondContact O-CB 3.44Å; L583-L586 PolarHBondContact O-N 2.77Å; V584-L586 VanDerWaalsContact C-N 3.26Å; V584-L586 PolarHBondContact O-N 2.89Å; L586-R590 WeakPolarHBondContact O-CB 3.46Å; L586-R590 WeakPolarHBondContact O-CG 3.44Å; L586-R590 PolarHBondContact O-N 3.03Å; L586-R590 VanDerWaalsContact O-N 3.1Å; L586-L654 HydrophobicContact CD2-CD1 4.18Å; L586-K657 HydrophobicContact CD1-CB 4.39Å; L586-K657 HydrophobicContact CD1-CG 3.96Å; L586-K657 VanDerWaalsContact CD1-O 3.32Å; L586-K657 WeakPolarHBondContact CD1-O 3.49Å; L586-K657 HydrophobicContact CD2-CD 4.45Å; L586-A658 HydrophobicContact CB-CB 3.81Å; L586-A658 HydrophobicContact CD1-CB 4.31Å
587	I	82.8	Confident	79.3	Confident	2 Å²	2	29 Å²	29	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-65.1	-50	-179.1	-66.8	165.4	0	0	0	110.2	L526 M529 I558 L583 V584 R589 R590 L591	L526-I587 HydrophobicContact CD1-CD1 3.77Å; M529-I587 HydrophobicContact CB-CG2 4.3Å; M529-I587 HydrophobicContact CE-CG2 3.74Å; I558-I587 HydrophobicContact CG2-CG2 4Å; L583-I587 HydrophobicContact CD2-CD1 4.43Å; L583-I587 HydrophobicContact CG-CD1 4.08Å; L583-I587 WeakPolarHBondContact O-CG1 3.09Å; L583-I587 PolarHBondContact O-N 3.49Å; V584-I587 PolarHBondContact O-N 3.29Å; I587-R589 VanDerWaalsContact C-N 3.33Å; I587-R589 PolarHBondContact O-N 3.28Å; I587-R590 PolarHBondContact O-N 3.36Å; I587-R590 VanDerWaalsContact O-N 3.1Å; I587-L591 HydrophobicContact CG2-CD1 3.94Å; I587-L591 HydrophobicContact CG2-CG 4.37Å; I587-L591 WeakPolarHBondContact O-CG 3.33Å; I587-L591 PolarHBondContact O-N 3.26Å
588	L	83.4	Confident	78.7	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-60.5	-41.6	-179.5	-61.3	179.6	0	0	0	111.8	F563 V584 R590 L591 H592 L605 A609 L612	F563-L588 HydrophobicContact CD1-CD2 3.77Å; F563-L588 HydrophobicContact CE1-CD2 3.46Å; F563-L588 VanDerWaalsContact CE1-CD2 3.46Å; F563-L588 HydrophobicContact CZ-CD2 4.42Å; V584-L588 HydrophobicContact CG1-CD1 3.95Å; V584-L588 HydrophobicContact CG1-CG 4.02Å; V584-L588 WeakPolarHBondContact O-CG 3.1Å; V584-L588 PolarHBondContact O-N 3.45Å; L588-R590 VanDerWaalsContact C-N 3.3Å; L588-R590 PolarHBondContact O-N 3.43Å; L588-L591 PolarHBondContact O-N 3.17Å; L588-H592 PolarHBondContact O-N 3.01Å; L588-L605 HydrophobicContact CB-CD1 3.88Å; L588-L605 HydrophobicContact CB-CG 4.3Å; L588-L605 HydrophobicContact CD2-CD1 3.55Å; L588-L605 HydrophobicContact CG-CD1 4.14Å; L588-L605 WeakPolarHBondContact O-CD2 3.43Å; L588-A609 HydrophobicContact CB-CB 4.31Å; L588-A609 HydrophobicContact CD1-CB 4.39Å; L588-L612 HydrophobicContact CD1-CD1 3.72Å
589	R	85.1	Confident	77.9	Confident	53 Å²	53	39 Å²	39	20%	0.2	20%	0.195	C	C	.	.	H	α-helix	trans	-72.6	-21.6	178.3	-72.5	175.9	172.3	-178.4	0.3	113.7	T585 I587 A609 D610 E613 A658 K659	T585-R589 VanDerWaalsContact O-CB 3.31Å; T585-R589 WeakPolarHBondContact O-CB 3.29Å; T585-R589 VanDerWaalsContact O-CG 3.32Å; T585-R589 WeakPolarHBondContact O-CG 3.41Å; T585-R589 PolarHBondContact O-N 2.91Å; I587-R589 VanDerWaalsContact C-N 3.33Å; I587-R589 PolarHBondContact O-N 3.28Å; R589-A609 HydrophobicContact CG-CB 4.14Å; R589-D610 IonicContact NH2-OD1 3.35Å; R589-D610 PolarHBondContact NH2-OD1 2.9Å; R589-D610 VanDerWaalsContact NH2-OD1 3.15Å; R589-E613 IonicContact CZ-OE2 3.05Å; R589-E613 IonicContact NH1-OE2 3.04Å; R589-E613 IonicContact NH2-OE2 3.57Å; R589-E613 PolarHBondContact NH2-OE2 3.21Å; R589-A658 WeakPolarHBondContact CD-O 3.44Å; R589-A658 PolarHBondContact NH1-O 2.93Å; R589-K659 PolarHBondContact NH1-O 2.85Å
590	R	80	Confident	77.2	Confident	83 Å²	83	47.7 Å²	47.7	31%	0.313	24%	0.236	S	C	.	.	H	α-helix	trans	-78.4	-44.5	170.9	-78.7	179.3	167.3	-136.4	-6	111.2	M529 S530 G531 L586 I587 L588 H592 K593 E594	M529-R590 WeakPolarHBondContact O-CD 3.36Å; S530-R590 PolarHBondContact O-NH1 2.88Å; G531-R590 VanDerWaalsContact CA-NH1 3.31Å; L586-R590 WeakPolarHBondContact O-CB 3.46Å; L586-R590 WeakPolarHBondContact O-CG 3.44Å; L586-R590 PolarHBondContact O-N 3.03Å; L586-R590 VanDerWaalsContact O-N 3.1Å; I587-R590 PolarHBondContact O-N 3.36Å; I587-R590 VanDerWaalsContact O-N 3.1Å; L588-R590 VanDerWaalsContact C-N 3.3Å; L588-R590 PolarHBondContact O-N 3.43Å; R590-H592 PolarHBondContact O-N 3.26Å; R590-K593 WeakPolarHBondContact O-CB 3.43Å; R590-K593 PolarHBondContact O-N 2.9Å; R590-E594 PolarHBondContact O-N 3.12Å
591	L	76	Confident	76.5	Confident	7 Å²	7	49.3 Å²	49.3	4%	0.037	24%	0.244	C	C	.	.	H	α-helix	trans	-56.2	-40.3	172.3	-72.5	171	0	0	0	111.6	V509 M529 I587 L588 K593 E594 L605	V509-L591 HydrophobicContact CG1-CD2 4.06Å; V509-L591 HydrophobicContact CG2-CD2 4.29Å; M529-L591 HydrophobicContact CE-CD1 3.74Å; M529-L591 HydrophobicContact CE-CD2 3.83Å; M529-L591 HydrophobicContact CE-CG 4.09Å; I587-L591 HydrophobicContact CG2-CD1 3.94Å; I587-L591 HydrophobicContact CG2-CG 4.37Å; I587-L591 WeakPolarHBondContact O-CG 3.33Å; I587-L591 PolarHBondContact O-N 3.26Å; L588-L591 PolarHBondContact O-N 3.17Å; L591-K593 PolarHBondContact O-N 3.41Å; L591-K593 VanDerWaalsContact O-N 3.13Å; L591-E594 PolarHBondContact O-N 3.18Å; L591-L605 HydrophobicContact CB-CD2 4.14Å
592	H	76	Confident	75.8	Confident	57 Å²	57	51.4 Å²	51.4	26%	0.264	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-28	174.4	-178.8	-76.1	0	0	0	113.6	L588 R590 L602 L605 I606	L588-H592 PolarHBondContact O-N 3.01Å; R590-H592 PolarHBondContact O-N 3.26Å; H592-L602 PolarHBondContact CD2-O 3.36Å; H592-L605 HydrophobicContact CB-CD2 3.85Å; H592-I606 VanDerWaalsContact CD2-CG1 3.42Å; H592-I606 WeakPolarHBondContact CD2-CG1 3.42Å; H592-I606 WeakPolarHBondContact NE2-CD1 3.41Å
593	K	72.3	Confident	75.1	Confident	107 Å²	107	53.5 Å²	53.5	47%	0.465	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-11.4	179.9	-68.1	-178	-178.4	-177.2	0	112.9	R590 L591	R590-K593 WeakPolarHBondContact O-CB 3.43Å; R590-K593 PolarHBondContact O-N 2.9Å; L591-K593 PolarHBondContact O-N 3.41Å; L591-K593 VanDerWaalsContact O-N 3.13Å
594	E	72.3	Confident	74.8	Confident	59 Å²	59	57.9 Å²	57.9	28%	0.276	30%	0.297	S	S	.	.			trans	-74.6	124.5	179.3	-72.2	-176.8	174.4	0	0	109.8	R590 L591 T596 F597	R590-E594 PolarHBondContact O-N 3.12Å; L591-E594 PolarHBondContact O-N 3.18Å; E594-T596 PolarHBondContact O-N 3.06Å; E594-F597 PolarHBondContact O-N 3Å
595	P	61.5	Low	74.5	Confident	131 Å²	131	57.9 Å²	57.9	85%	0.851	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-15.8	-174.7	28.1	-35.3	0	0	0	113.3	F597	P595-F597 VanDerWaalsContact C-N 3.29Å; P595-F597 PolarHBondContact O-N 3.36Å
596	T	65.5	Low	74.3	Confident	80 Å²	80	61.3 Å²	61.3	49%	0.491	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-7.2	-178.6	49.9	0	0	0	0	113.7	H508 E594	H508-T596 PolarHBondContact ND1-O 3.46Å; E594-T596 PolarHBondContact O-N 3.06Å
597	F	65.6	Low	74.2	Confident	13 Å²	13	64.4 Å²	64.4	6%	0.057	33%	0.334	C	S	.	.	S	Bend	trans	-84.7	139.5	-172.9	-158.6	-90.7	0	0	0	112.6	V505 V509 E594 P595 Q599 M601 L602 L605	V505-F597 HydrophobicContact CG1-CE2 4.37Å; V505-F597 HydrophobicContact CG1-CZ 3.81Å; V509-F597 HydrophobicContact CG2-CD2 3.6Å; V509-F597 HydrophobicContact CG2-CE2 3.54Å; E594-F597 PolarHBondContact O-N 3Å; P595-F597 VanDerWaalsContact C-N 3.29Å; P595-F597 PolarHBondContact O-N 3.36Å; F597-Q599 PolarHBondContact O-N 2.6Å; F597-M601 HydrophobicContact CD1-CB 4.33Å; F597-M601 HydrophobicContact CE1-CB 3.54Å; F597-M601 HydrophobicContact CZ-CB 4.32Å; F597-L602 HydrophobicContact CB-CD1 3.94Å; F597-L602 HydrophobicContact CD1-CD1 3.5Å; F597-L602 VanDerWaalsContact CD1-CD1 3.5Å; F597-L602 HydrophobicContact CE1-CD1 4.43Å; F597-L602 HydrophobicContact CG-CD1 4.13Å; F597-L605 HydrophobicContact CE1-CD2 4.25Å; F597-L605 HydrophobicContact CZ-CD2 4.43Å
598	P	67.5	Low	74.2	Confident	39 Å²	39	64.9 Å²	64.9	25%	0.253	34%	0.335	S	S	.	.			trans	-61	129.8	-176.7	19.7	-31.2	0	0	0	113.3	Q600 M601 L602	P598-Q600 VanDerWaalsContact C-N 3.34Å; P598-Q600 PolarHBondContact O-N 2.8Å; P598-M601 HydrophobicContact CG-CB 4.3Å; P598-M601 HydrophobicContact CG-CG 4.19Å; P598-M601 PolarHBondContact O-N 3.16Å; P598-M601 VanDerWaalsContact O-N 3.14Å; P598-L602 PolarHBondContact O-N 2.68Å
599	Q	67.3	Low	74.4	Confident	175 Å²	175	64.8 Å²	64.8	82%	0.818	34%	0.335	S	S	*	.	H	α-helix	trans	-61	-35.9	-173.5	-70.5	-173.2	-8.8	0	0	114	F597 M601 L602	F597-Q599 PolarHBondContact O-N 2.6Å; Q599-M601 PolarHBondContact O-N 2.92Å; Q599-L602 WeakPolarHBondContact O-CB 3.2Å; Q599-L602 PolarHBondContact O-N 3.29Å
600	Q	67.5	Low	74.4	Confident	186 Å²	186	65.6 Å²	65.6	87%	0.869	34%	0.343	S	S	*	.	H	α-helix	trans	-61.3	-35	178.9	-69.9	176.6	-11.9	0	0	111.9	P598	P598-Q600 VanDerWaalsContact C-N 3.34Å; P598-Q600 PolarHBondContact O-N 2.8Å
601	M	66.7	Low	74.6	Confident	33 Å²	33	65.7 Å²	65.7	16%	0.163	34%	0.344	C	S	.	.	H	α-helix	trans	-85.9	-16.5	-178	-64.6	-59.6	-56.1	0	0	113.4	V505 F563 F597 P598 Q599 G603 E604 L605	V505-M601 HydrophobicContact CG1-CE 4.28Å; V505-M601 HydrophobicContact CG1-CG 4.22Å; V505-M601 HydrophobicContact CG2-CE 3.73Å; V505-M601 HydrophobicContact CG2-CG 4.01Å; V505-M601 HydrophobicContact CG2-SD 3.89Å; F563-M601 HydrophobicContact CE2-CE 4.35Å; F597-M601 HydrophobicContact CD1-CB 4.33Å; F597-M601 HydrophobicContact CE1-CB 3.54Å; F597-M601 HydrophobicContact CZ-CB 4.32Å; P598-M601 HydrophobicContact CG-CB 4.3Å; P598-M601 HydrophobicContact CG-CG 4.19Å; P598-M601 PolarHBondContact O-N 3.16Å; P598-M601 VanDerWaalsContact O-N 3.14Å; Q599-M601 PolarHBondContact O-N 2.92Å; M601-G603 VanDerWaalsContact C-N 3.26Å; M601-G603 PolarHBondContact O-N 3.48Å; M601-E604 HydrophobicContact CE-CB 4.33Å; M601-E604 WeakPolarHBondContact CE-OE2 3.36Å; M601-E604 PolarHBondContact O-N 3.46Å; M601-L605 WeakPolarHBondContact O-CB 3.34Å; M601-L605 PolarHBondContact O-N 3.31Å
602	L	72.9	Confident	75.1	Confident	45 Å²	45	65.6 Å²	65.6	24%	0.236	34%	0.343	C	S	.	.	H	α-helix	trans	-58.4	-41	179.2	-122.2	69.9	0	0	0	111.3	H592 F597 P598 Q599 L605 I606	H592-L602 PolarHBondContact CD2-O 3.36Å; F597-L602 HydrophobicContact CB-CD1 3.94Å; F597-L602 HydrophobicContact CD1-CD1 3.5Å; F597-L602 VanDerWaalsContact CD1-CD1 3.5Å; F597-L602 HydrophobicContact CE1-CD1 4.43Å; F597-L602 HydrophobicContact CG-CD1 4.13Å; P598-L602 PolarHBondContact O-N 2.68Å; Q599-L602 WeakPolarHBondContact O-CB 3.2Å; Q599-L602 PolarHBondContact O-N 3.29Å; L602-L605 PolarHBondContact O-N 3.48Å; L602-I606 PolarHBondContact O-N 2.82Å
603	G	72.4	Confident	75.7	Confident	44 Å²	44	62.9 Å²	62.9	45%	0.454	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-49.2	176.2	0	0	0	0	0	112.1	M601 L605 I606 T607	M601-G603 VanDerWaalsContact C-N 3.26Å; M601-G603 PolarHBondContact O-N 3.48Å; G603-L605 VanDerWaalsContact C-N 3.32Å; G603-L605 PolarHBondContact O-N 2.93Å; G603-I606 PolarHBondContact O-N 3.44Å; G603-T607 WeakPolarHBondContact O-CG2 3.16Å; G603-T607 PolarHBondContact O-N 3.33Å
604	E	78.3	Confident	76.4	Confident	95 Å²	95	59.2 Å²	59.2	44%	0.444	32%	0.321	S	S	.	.	H	α-helix	trans	-60	-43.1	177.5	-66.3	-164.6	173.8	0	0	111.7	M601 I606 T607 F608	M601-E604 HydrophobicContact CE-CB 4.33Å; M601-E604 WeakPolarHBondContact CE-OE2 3.36Å; M601-E604 PolarHBondContact O-N 3.46Å; E604-I606 VanDerWaalsContact C-N 3.31Å; E604-I606 PolarHBondContact O-N 2.86Å; E604-T607 PolarHBondContact O-N 3.34Å; E604-T607 PolarHBondContact O-OG1 3.33Å; E604-F608 HydrophobicContact CB-CD2 4.17Å; E604-F608 HydrophobicContact CB-CE2 4.11Å; E604-F608 WeakPolarHBondContact O-CD2 3.31Å; E604-F608 PolarHBondContact O-N 2.77Å
605	L	79.5	Confident	77	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-58.6	-39.8	-178.5	-169.6	65.4	0	0	0	112.7	F563 L588 L591 H592 F597 M601 L602 G603 A609	F563-L605 HydrophobicContact CE1-CD1 3.96Å; F563-L605 HydrophobicContact CE2-CD1 4.17Å; F563-L605 HydrophobicContact CZ-CD1 3.73Å; L588-L605 HydrophobicContact CB-CD1 3.88Å; L588-L605 HydrophobicContact CB-CG 4.3Å; L588-L605 HydrophobicContact CD2-CD1 3.55Å; L588-L605 HydrophobicContact CG-CD1 4.14Å; L588-L605 WeakPolarHBondContact O-CD2 3.43Å; L591-L605 HydrophobicContact CB-CD2 4.14Å; H592-L605 HydrophobicContact CB-CD2 3.85Å; F597-L605 HydrophobicContact CE1-CD2 4.25Å; F597-L605 HydrophobicContact CZ-CD2 4.43Å; M601-L605 WeakPolarHBondContact O-CB 3.34Å; M601-L605 PolarHBondContact O-N 3.31Å; L602-L605 PolarHBondContact O-N 3.48Å; G603-L605 VanDerWaalsContact C-N 3.32Å; G603-L605 PolarHBondContact O-N 2.93Å; L605-A609 WeakPolarHBondContact O-CB 3.38Å; L605-A609 PolarHBondContact O-N 3.34Å
606	I	82.4	Confident	78.2	Confident	74 Å²	74	50.3 Å²	50.3	38%	0.379	27%	0.268	S	S	.	.	H	α-helix	trans	-64.8	-47.2	173.2	-67.4	165.7	0	0	0	110.2	H592 L602 G603 E604 F608 A609 D610	H592-I606 VanDerWaalsContact CD2-CG1 3.42Å; H592-I606 WeakPolarHBondContact CD2-CG1 3.42Å; H592-I606 WeakPolarHBondContact NE2-CD1 3.41Å; L602-I606 PolarHBondContact O-N 2.82Å; G603-I606 PolarHBondContact O-N 3.44Å; E604-I606 VanDerWaalsContact C-N 3.31Å; E604-I606 PolarHBondContact O-N 2.86Å; I606-F608 VanDerWaalsContact C-N 3.26Å; I606-F608 PolarHBondContact O-N 3.3Å; I606-A609 PolarHBondContact O-N 2.76Å; I606-A609 VanDerWaalsContact O-N 3.15Å; I606-D610 PolarHBondContact O-N 2.82Å
607	T	83.8	Confident	79.3	Confident	68 Å²	68	47.5 Å²	47.5	42%	0.417	25%	0.251	S	S	.	.	H	α-helix	trans	-62	-35.7	-179.8	70.2	0	0	0	0	112.4	G603 E604 R611	G603-T607 WeakPolarHBondContact O-CG2 3.16Å; G603-T607 PolarHBondContact O-N 3.33Å; E604-T607 PolarHBondContact O-N 3.34Å; E604-T607 PolarHBondContact O-OG1 3.33Å; T607-R611 WeakPolarHBondContact O-CG 3.22Å; T607-R611 PolarHBondContact O-N 3.49Å; T607-R611 PolarHBondContact O-NE 3.4Å
608	F	82.2	Confident	80.1	Confident	11 Å²	11	49.1 Å²	49.1	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-68.8	-44.9	174	-80.3	-69.9	0	0	0	111.2	F563 R564 E604 I606 D610 R611 L612	F563-F608 HydrophobicContact CB-CB 4.42Å; F563-F608 HydrophobicContact CB-CD1 3.74Å; F563-F608 HydrophobicContact CB-CD2 3.82Å; F563-F608 HydrophobicContact CB-CE1 3.81Å; F563-F608 HydrophobicContact CB-CE2 3.93Å; F563-F608 HydrophobicContact CB-CG 3.75Å; F563-F608 HydrophobicContact CB-CZ 3.93Å; F563-F608 HydrophobicContact CD2-CD2 4.12Å; F563-F608 HydrophobicContact CD2-CE2 4.24Å; F563-F608 HydrophobicContact CG-CD2 4.22Å; F563-F608 HydrophobicContact CG-CG 4.41Å; R564-F608 HydrophobicContact CG-CE1 4.05Å; R564-F608 HydrophobicContact CG-CZ 3.97Å; E604-F608 HydrophobicContact CB-CD2 4.17Å; E604-F608 HydrophobicContact CB-CE2 4.11Å; E604-F608 WeakPolarHBondContact O-CD2 3.31Å; E604-F608 PolarHBondContact O-N 2.77Å; I606-F608 VanDerWaalsContact C-N 3.26Å; I606-F608 PolarHBondContact O-N 3.3Å; F608-D610 VanDerWaalsContact C-N 3.25Å; F608-D610 PolarHBondContact O-N 2.75Å; F608-R611 VanDerWaalsContact CD1-CZ 3.43Å; F608-R611 VanDerWaalsContact CD1-NH2 3.28Å; F608-R611 VanDerWaalsContact CE1-NH1 3.27Å; F608-R611 VanDerWaalsContact CZ-NH2 3.32Å; F608-R611 PolarHBondContact O-N 2.75Å; F608-L612 WeakPolarHBondContact O-CG 3.33Å; F608-L612 PolarHBondContact O-N 2.93Å
609	A	86.9	Confident	80.9	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-59	-38.3	175.5	0	0	0	0	0	112	T585 L588 R589 L605 I606 L612 E613	T585-A609 WeakPolarHBondContact CG2-O 3.19Å; L588-A609 HydrophobicContact CB-CB 4.31Å; L588-A609 HydrophobicContact CD1-CB 4.39Å; R589-A609 HydrophobicContact CG-CB 4.14Å; L605-A609 WeakPolarHBondContact O-CB 3.38Å; L605-A609 PolarHBondContact O-N 3.34Å; I606-A609 PolarHBondContact O-N 2.76Å; I606-A609 VanDerWaalsContact O-N 3.15Å; A609-L612 PolarHBondContact O-N 3.46Å; A609-E613 WeakPolarHBondContact O-CB 3.22Å; A609-E613 PolarHBondContact O-N 3.49Å
610	D	86.2	Confident	81.7	Confident	69 Å²	69	39 Å²	39	37%	0.369	21%	0.209	S	C	.	.	H	α-helix	trans	-71.6	-35.7	177.9	-69.2	-14.2	0	0	0	112.3	R589 I606 F608 E613 A614	R589-D610 IonicContact NH2-OD1 3.35Å; R589-D610 PolarHBondContact NH2-OD1 2.9Å; R589-D610 VanDerWaalsContact NH2-OD1 3.15Å; I606-D610 PolarHBondContact O-N 2.82Å; F608-D610 VanDerWaalsContact C-N 3.25Å; F608-D610 PolarHBondContact O-N 2.75Å; D610-E613 WeakPolarHBondContact O-CB 3.46Å; D610-E613 PolarHBondContact O-N 3.34Å; D610-A614 PolarHBondContact O-N 3.39Å
611	R	84.8	Confident	82.6	Confident	85 Å²	85	32.7 Å²	32.7	32%	0.321	18%	0.181	S	C	.	.	H	α-helix	trans	-64.1	-43.7	171.1	-81.2	-176.2	-84.8	166.8	-14.7	112.5	E567 T607 F608 E613 A614 I615	E567-R611 IonicContact OE2-CZ 3.95Å; E567-R611 IonicContact OE2-NH1 3.15Å; E567-R611 PolarHBondContact OE2-NH1 2.95Å; T607-R611 WeakPolarHBondContact O-CG 3.22Å; T607-R611 PolarHBondContact O-N 3.49Å; T607-R611 PolarHBondContact O-NE 3.4Å; F608-R611 VanDerWaalsContact CD1-CZ 3.43Å; F608-R611 VanDerWaalsContact CD1-NH2 3.28Å; F608-R611 VanDerWaalsContact CE1-NH1 3.27Å; F608-R611 VanDerWaalsContact CZ-NH2 3.32Å; F608-R611 PolarHBondContact O-N 2.75Å; R611-E613 VanDerWaalsContact C-N 3.29Å; R611-E613 PolarHBondContact O-N 3.15Å; R611-A614 WeakPolarHBondContact O-CB 3.45Å; R611-A614 PolarHBondContact O-N 3.31Å; R611-A614 VanDerWaalsContact O-N 3.14Å; R611-I615 WeakPolarHBondContact O-CG1 3.36Å; R611-I615 PolarHBondContact O-N 3.19Å
612	L	86.1	Confident	83.3	Confident	5 Å²	5	33.1 Å²	33.1	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-65.5	-35.2	175.2	-65.8	-174.6	0	0	0	112	E567 I570 V584 T585 L588 F608 A609 A614 I615 A616	E567-L612 HydrophobicContact CB-CD2 4.38Å; E567-L612 HydrophobicContact CG-CD2 4.37Å; I570-L612 HydrophobicContact CD1-CD1 3.95Å; I570-L612 HydrophobicContact CD1-CD2 3.46Å; I570-L612 VanDerWaalsContact CD1-CD2 3.46Å; I570-L612 HydrophobicContact CD1-CG 4.29Å; V584-L612 HydrophobicContact CB-CD1 3.98Å; V584-L612 HydrophobicContact CG1-CD1 3.36Å; T585-L612 HydrophobicContact CG2-CB 3.6Å; L588-L612 HydrophobicContact CD1-CD1 3.72Å; F608-L612 WeakPolarHBondContact O-CG 3.33Å; F608-L612 PolarHBondContact O-N 2.93Å; A609-L612 PolarHBondContact O-N 3.46Å; L612-A614 VanDerWaalsContact C-N 3.35Å; L612-I615 HydrophobicContact CD2-CD1 4.08Å; L612-I615 PolarHBondContact O-N 3.37Å; L612-A616 PolarHBondContact O-N 3Å; L612-A616 VanDerWaalsContact O-N 3.12Å
613	E	88.6	Confident	83.7	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.7	-40.1	171.1	-170.9	173.7	172.9	0	0	111.6	R589 A609 D610 R611 A616 V617 C660 T661 N662 V663	R589-E613 IonicContact CZ-OE2 3.05Å; R589-E613 IonicContact NH1-OE2 3.04Å; R589-E613 IonicContact NH2-OE2 3.57Å; R589-E613 PolarHBondContact NH2-OE2 3.21Å; A609-E613 WeakPolarHBondContact O-CB 3.22Å; A609-E613 PolarHBondContact O-N 3.49Å; D610-E613 WeakPolarHBondContact O-CB 3.46Å; D610-E613 PolarHBondContact O-N 3.34Å; R611-E613 VanDerWaalsContact C-N 3.29Å; R611-E613 PolarHBondContact O-N 3.15Å; E613-A616 WeakPolarHBondContact O-CB 3.22Å; E613-A616 PolarHBondContact O-N 3.48Å; E613-V617 WeakPolarHBondContact O-CG2 3.34Å; E613-V617 PolarHBondContact O-N 3.28Å; E613-C660 HydrophobicContact CG-CB 4.17Å; E613-C660 WeakPolarHBondContact OE1-CA 3.45Å; E613-C660 WeakPolarHBondContact OE1-CB 3.39Å; E613-T661 PolarHBondContact OE1-N 2.98Å; E613-N662 HydrophobicContact CG-CB 4.36Å; E613-N662 WeakPolarHBondContact OE1-CA 3.44Å; E613-N662 VanDerWaalsContact OE1-CB 3.29Å; E613-N662 WeakPolarHBondContact OE1-CB 3.39Å; E613-N662 PolarHBondContact OE1-N 2.91Å; E613-V663 HydrophobicContact CG-CG2 3.77Å; E613-V663 PolarHBondContact OE1-N 3.06Å
614	A	86.9	Confident	84.1	Confident	31 Å²	31	31 Å²	31	26%	0.256	16%	0.161	S	C	.	.	H	α-helix	trans	-62.2	-41.7	175.3	0	0	0	0	0	112.3	D610 R611 L612 A616 V617 D618	D610-A614 PolarHBondContact O-N 3.39Å; R611-A614 WeakPolarHBondContact O-CB 3.45Å; R611-A614 PolarHBondContact O-N 3.31Å; R611-A614 VanDerWaalsContact O-N 3.14Å; L612-A614 VanDerWaalsContact C-N 3.35Å; A614-A616 VanDerWaalsContact C-N 3.31Å; A614-A616 PolarHBondContact O-N 3.45Å; A614-V617 WeakPolarHBondContact O-CB 3.43Å; A614-V617 PolarHBondContact O-N 2.95Å; A614-V617 VanDerWaalsContact O-N 3.17Å; A614-D618 PolarHBondContact O-N 3.02Å
615	I	84.3	Confident	84.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.4	-45	173	-64.8	169.8	0	0	0	110.5	E567 I570 R571 V577 R611 L612 V617 D618 V619 L1246	E567-I615 HydrophobicContact CG-CD1 4.03Å; I570-I615 HydrophobicContact CG2-CG2 4.25Å; R571-I615 HydrophobicContact CG-CD1 4.19Å; V577-I615 HydrophobicContact CG1-CG2 4.3Å; R611-I615 WeakPolarHBondContact O-CG1 3.36Å; R611-I615 PolarHBondContact O-N 3.19Å; L612-I615 HydrophobicContact CD2-CD1 4.08Å; L612-I615 PolarHBondContact O-N 3.37Å; I615-V617 VanDerWaalsContact C-N 3.33Å; I615-V617 PolarHBondContact O-N 3.48Å; I615-D618 PolarHBondContact O-N 3.45Å; I615-V619 HydrophobicContact CG2-CG2 4.36Å; I615-V619 VanDerWaalsContact O-CG2 3.26Å; I615-V619 WeakPolarHBondContact O-CG2 3.39Å; I615-V619 PolarHBondContact O-N 3.34Å; I615-L1246 HydrophobicContact CG1-CB 4.49Å; I615-L1246 HydrophobicContact CG2-CB 4.34Å
616	A	87.8	Confident	84.1	Confident	2 Å²	2	36.5 Å²	36.5	2%	0.017	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-38.9	177.3	0	0	0	0	0	112.5	L578 A581 L612 E613 A614 L620 V663	L578-A616 HydrophobicContact CD1-CB 3.83Å; A581-A616 HydrophobicContact CB-CB 4.18Å; L612-A616 PolarHBondContact O-N 3Å; L612-A616 VanDerWaalsContact O-N 3.12Å; E613-A616 WeakPolarHBondContact O-CB 3.22Å; E613-A616 PolarHBondContact O-N 3.48Å; A614-A616 VanDerWaalsContact C-N 3.31Å; A614-A616 PolarHBondContact O-N 3.45Å; A616-L620 WeakPolarHBondContact O-CB 3.43Å; A616-L620 PolarHBondContact O-N 2.92Å; A616-V663 HydrophobicContact CB-CG2 3.96Å
617	V	86.8	Confident	84	Confident	22 Å²	22	33 Å²	33	13%	0.133	17%	0.171	C	C	.	.	H	α-helix	trans	-62	-48.4	174.8	166.3	0	0	0	0	111.1	E613 A614 I615 L620 N621 N662 V663 L666	E613-V617 WeakPolarHBondContact O-CG2 3.34Å; E613-V617 PolarHBondContact O-N 3.28Å; A614-V617 WeakPolarHBondContact O-CB 3.43Å; A614-V617 PolarHBondContact O-N 2.95Å; A614-V617 VanDerWaalsContact O-N 3.17Å; I615-V617 VanDerWaalsContact C-N 3.33Å; I615-V617 PolarHBondContact O-N 3.48Å; V617-L620 PolarHBondContact O-N 2.95Å; V617-N621 WeakPolarHBondContact O-CB 3.49Å; V617-N621 PolarHBondContact O-N 3.38Å; V617-N621 PolarHBondContact O-ND2 2.84Å; V617-N662 HydrophobicContact CG2-CB 3.96Å; V617-V663 HydrophobicContact CG2-CB 4.44Å; V617-V663 HydrophobicContact CG2-CG2 3.66Å; V617-L666 HydrophobicContact CB-CD1 4.42Å; V617-L666 HydrophobicContact CG1-CD1 4.24Å; V617-L666 HydrophobicContact CG1-CD2 4.19Å; V617-L666 HydrophobicContact CG2-CD1 4.27Å
618	D	83.8	Confident	83.7	Confident	47 Å²	47	36.9 Å²	36.9	25%	0.251	19%	0.189	S	C	.	.	H	α-helix	trans	-65.2	-45.8	-177.9	-70.5	-17.7	0	0	0	111.8	A614 I615 L620 N621 L622 L1246 G1247	A614-D618 PolarHBondContact O-N 3.02Å; I615-D618 PolarHBondContact O-N 3.45Å; D618-L620 VanDerWaalsContact C-N 3.33Å; D618-L620 PolarHBondContact O-N 3Å; D618-N621 PolarHBondContact O-N 3.39Å; D618-L622 WeakPolarHBondContact O-CB 3.37Å; D618-L622 VanDerWaalsContact O-CG 3.28Å; D618-L622 WeakPolarHBondContact O-CG 3.14Å; D618-L622 PolarHBondContact O-N 3.42Å; D618-L1246 HydrophobicContact CB-CD2 3.74Å; D618-G1247 WeakPolarHBondContact OD2-CA 3.36Å; D618-G1247 PolarHBondContact OD2-N 2.88Å
619	V	83.1	Confident	83.3	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-57.9	-48.1	175.4	172.8	0	0	0	0	110.1	V577 L578 I615 N621 L622 V623 Q1235 L1239 L1246	V577-V619 HydrophobicContact CG1-CG2 4.03Å; L578-V619 HydrophobicContact CB-CG1 4.42Å; I615-V619 HydrophobicContact CG2-CG2 4.36Å; I615-V619 VanDerWaalsContact O-CG2 3.26Å; I615-V619 WeakPolarHBondContact O-CG2 3.39Å; I615-V619 PolarHBondContact O-N 3.34Å; V619-N621 PolarHBondContact O-N 3.47Å; V619-L622 PolarHBondContact O-N 3.08Å; V619-V623 HydrophobicContact CG1-CG2 4.43Å; V619-V623 VanDerWaalsContact O-CG2 3.22Å; V619-V623 WeakPolarHBondContact O-CG2 3.29Å; V619-V623 PolarHBondContact O-N 3.33Å; V619-Q1235 HydrophobicContact CG1-CG 4.2Å; V619-L1239 HydrophobicContact CG2-CD2 4.41Å; V619-L1246 HydrophobicContact CG2-CD1 4Å; V619-L1246 HydrophobicContact CG2-CD2 3.96Å
620	L	85.7	Confident	82.2	Confident	1 Å²	1	41 Å²	41	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-66.9	-37.7	-178.1	-172.1	58.3	0	0	0	112.3	L578 A616 V617 D618 F624 L639 V663 L666	L578-L620 HydrophobicContact CD2-CD1 4.2Å; A616-L620 WeakPolarHBondContact O-CB 3.43Å; A616-L620 PolarHBondContact O-N 2.92Å; V617-L620 PolarHBondContact O-N 2.95Å; D618-L620 VanDerWaalsContact C-N 3.33Å; D618-L620 PolarHBondContact O-N 3Å; L620-F624 WeakPolarHBondContact O-CB 3.3Å; L620-F624 PolarHBondContact O-N 3.47Å; L620-L639 HydrophobicContact CD2-CD2 4.49Å; L620-V663 HydrophobicContact CD2-CG1 4.28Å; L620-L666 HydrophobicContact CB-CD1 4.2Å; L620-L666 HydrophobicContact CD2-CD1 3.82Å; L620-L666 HydrophobicContact CG-CD1 4.25Å
621	N	86.1	Confident	81.3	Confident	53 Å²	53	42.9 Å²	42.9	28%	0.283	22%	0.222	S	C	.	.	H	α-helix	trans	-64.9	-45.6	175.2	-82.4	-29.1	0	0	0	112.4	V617 D618 V619 V623 F624 L625 L666	V617-N621 WeakPolarHBondContact O-CB 3.49Å; V617-N621 PolarHBondContact O-N 3.38Å; V617-N621 PolarHBondContact O-ND2 2.84Å; D618-N621 PolarHBondContact O-N 3.39Å; V619-N621 PolarHBondContact O-N 3.47Å; N621-V623 PolarHBondContact O-N 3.08Å; N621-F624 PolarHBondContact O-N 3.39Å; N621-L625 WeakPolarHBondContact O-CB 3.41Å; N621-L625 VanDerWaalsContact O-CG 3.3Å; N621-L625 WeakPolarHBondContact O-CG 3.25Å; N621-L625 PolarHBondContact O-N 3.34Å; N621-L666 VanDerWaalsContact OD1-CD2 3.24Å; N621-L666 WeakPolarHBondContact OD1-CD2 3.36Å
622	L	81.3	Confident	80.8	Confident	42 Å²	42	41.1 Å²	41.1	22%	0.22	22%	0.217	C	C	.	.	H	α-helix	trans	-61.3	-45.2	177.4	-73.2	170.2	0	0	0	111.5	D618 V619 L625 K626 A1238 L1239 L1246	D618-L622 WeakPolarHBondContact O-CB 3.37Å; D618-L622 VanDerWaalsContact O-CG 3.28Å; D618-L622 WeakPolarHBondContact O-CG 3.14Å; D618-L622 PolarHBondContact O-N 3.42Å; V619-L622 PolarHBondContact O-N 3.08Å; L622-L625 PolarHBondContact O-N 3.34Å; L622-K626 PolarHBondContact O-N 2.84Å; L622-K626 VanDerWaalsContact O-N 3.11Å; L622-A1238 HydrophobicContact CB-CB 4.43Å; L622-L1239 HydrophobicContact CD1-CD2 3.91Å; L622-L1246 HydrophobicContact CD1-CD2 3.94Å
623	V	81	Confident	80.2	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-42.5	176.6	178.7	0	0	0	0	110.6	V619 N621 L625 K626 D627 C635 F1231 I1234 Q1235 A1238	V619-V623 HydrophobicContact CG1-CG2 4.43Å; V619-V623 VanDerWaalsContact O-CG2 3.22Å; V619-V623 WeakPolarHBondContact O-CG2 3.29Å; V619-V623 PolarHBondContact O-N 3.33Å; N621-V623 PolarHBondContact O-N 3.08Å; V623-L625 VanDerWaalsContact C-N 3.34Å; V623-L625 PolarHBondContact O-N 2.8Å; V623-K626 PolarHBondContact O-N 2.95Å; V623-D627 WeakPolarHBondContact O-CB 3.33Å; V623-D627 PolarHBondContact O-N 3.28Å; V623-C635 VanDerWaalsContact CG1-SG 3.6Å; V623-F1231 HydrophobicContact CB-CE2 4.45Å; V623-F1231 HydrophobicContact CG1-CD2 4.11Å; V623-F1231 HydrophobicContact CG1-CE2 3.74Å; V623-F1231 HydrophobicContact CG1-CZ 4.49Å; V623-I1234 HydrophobicContact CG1-CB 4.39Å; V623-I1234 HydrophobicContact CG1-CG2 3.73Å; V623-Q1235 HydrophobicContact CG2-CB 3.99Å; V623-Q1235 HydrophobicContact CG2-CG 4.19Å; V623-A1238 HydrophobicContact CG2-CB 4.15Å
624	F	81.6	Confident	79.5	Confident	45 Å²	45	46.6 Å²	46.6	20%	0.197	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-39.3	177.7	179.2	-98.6	0	0	0	113	L620 N621 K632 C668	L620-F624 WeakPolarHBondContact O-CB 3.3Å; L620-F624 PolarHBondContact O-N 3.47Å; N621-F624 PolarHBondContact O-N 3.39Å; F624-K632 HydrophobicContact CD2-CB 4.36Å; F624-K632 HydrophobicContact CD2-CD 4.47Å; F624-K632 HydrophobicContact CD2-CG 4.12Å; F624-K632 HydrophobicContact CE2-CB 4.13Å; F624-K632 HydrophobicContact CE2-CD 4.32Å; F624-K632 HydrophobicContact CE2-CG 3.65Å; F624-K632 HydrophobicContact CZ-CG 4.22Å; F624-K632 WeakPolarHBondContact O-CE 3.44Å; F624-K632 PolarHBondContact O-NZ 3.03Å; F624-C668 HydrophobicContact CD2-CB 3.62Å; F624-C668 HydrophobicContact CE2-CB 3.9Å; F624-C668 HydrophobicContact CG-CB 4.32Å
625	L	79.4	Confident	79.1	Confident	126 Å²	126	45.1 Å²	45.1	66%	0.66	23%	0.232	S	C	*	.	H	α-helix	trans	-65.1	-43.5	175.8	-73.8	168.8	0	0	0	111.4	N621 L622 V623	N621-L625 WeakPolarHBondContact O-CB 3.41Å; N621-L625 VanDerWaalsContact O-CG 3.3Å; N621-L625 WeakPolarHBondContact O-CG 3.25Å; N621-L625 PolarHBondContact O-N 3.34Å; L622-L625 PolarHBondContact O-N 3.34Å; V623-L625 VanDerWaalsContact C-N 3.34Å; V623-L625 PolarHBondContact O-N 2.8Å
626	K	78.4	Confident	78.8	Confident	84 Å²	84	47.8 Å²	47.8	37%	0.365	24%	0.242	S	C	.	.	H	α-helix	trans	-78.2	-21.9	-179	-68.2	-150.8	-172.2	-176.5	0	115.2	L622 V623 N628 I1234 F1237 A1238	L622-K626 PolarHBondContact O-N 2.84Å; L622-K626 VanDerWaalsContact O-N 3.11Å; V623-K626 PolarHBondContact O-N 2.95Å; K626-N628 PolarHBondContact O-N 3.49Å; K626-I1234 HydrophobicContact CB-CG2 4.4Å; K626-F1237 HydrophobicContact CD-CD1 3.7Å; K626-F1237 HydrophobicContact CD-CE1 3.91Å; K626-F1237 PolarHBondContact NZ-O 3.37Å; K626-A1238 HydrophobicContact CD-CB 3.97Å; K626-A1238 HydrophobicContact CG-CB 4.39Å; K626-A1238 PolarHBondContact NZ-O 2.88Å
627	D	79.8	Confident	78	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.26	C	S	.	.			trans	-66.2	98.2	179.7	-177.5	1	0	0	0	110.5	V623 T629 K632 I634 C635 I1234	V623-D627 WeakPolarHBondContact O-CB 3.33Å; V623-D627 PolarHBondContact O-N 3.28Å; D627-T629 VanDerWaalsContact C-N 3.25Å; D627-T629 VanDerWaalsContact CG-OG1 3.29Å; D627-T629 PolarHBondContact O-N 3.02Å; D627-T629 VanDerWaalsContact OD1-CB 3.25Å; D627-T629 WeakPolarHBondContact OD1-CB 3.47Å; D627-T629 WeakPolarHBondContact OD1-CG2 3.37Å; D627-T629 PolarHBondContact OD1-N 3.12Å; D627-T629 PolarHBondContact OD1-OG1 3.02Å; D627-T629 PolarHBondContact OD2-OG1 3.42Å; D627-K632 HydrophobicContact CB-CD 4.01Å; D627-K632 WeakPolarHBondContact O-CD 3.45Å; D627-K632 VanDerWaalsContact O-CE 3.23Å; D627-K632 WeakPolarHBondContact O-CE 3.47Å; D627-K632 PolarHBondContact O-NZ 2.93Å; D627-K632 VanDerWaalsContact OD2-CA 3.27Å; D627-K632 WeakPolarHBondContact OD2-CA 3.4Å; D627-I634 PolarHBondContact OD2-N 2.91Å; D627-C635 PolarHBondContact OD2-N 3.27Å; D627-I1234 HydrophobicContact CB-CD1 4.45Å
628	N	77.4	Confident	77.7	Confident	150 Å²	150	49.4 Å²	49.4	80%	0.802	25%	0.254	S	S	*	.			trans	-85.9	8.8	178.2	-72.4	-26.4	0	0	0	113.4	K626	K626-N628 PolarHBondContact O-N 3.49Å
629	T	73.7	Confident	77.6	Confident	41 Å²	41	47.2 Å²	47.2	25%	0.252	24%	0.243	S	C	.	.	S	Bend	trans	-68.2	146.4	177.7	62.3	0	0	0	0	111.3	D627 E631 K632 M633 I634	D627-T629 VanDerWaalsContact C-N 3.25Å; D627-T629 VanDerWaalsContact CG-OG1 3.29Å; D627-T629 PolarHBondContact O-N 3.02Å; D627-T629 VanDerWaalsContact OD1-CB 3.25Å; D627-T629 WeakPolarHBondContact OD1-CB 3.47Å; D627-T629 WeakPolarHBondContact OD1-CG2 3.37Å; D627-T629 PolarHBondContact OD1-N 3.12Å; D627-T629 PolarHBondContact OD1-OG1 3.02Å; D627-T629 PolarHBondContact OD2-OG1 3.42Å; T629-E631 PolarHBondContact O-N 3.38Å; T629-K632 PolarHBondContact O-N 3.07Å; T629-M633 PolarHBondContact OG1-N 3.45Å; T629-I634 HydrophobicContact CG2-CD1 3.45Å; T629-I634 VanDerWaalsContact CG2-CD1 3.45Å; T629-I634 HydrophobicContact CG2-CG1 3.9Å
630	P	64.2	Low	77.5	Confident	58 Å²	58	49.7 Å²	49.7	38%	0.377	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-54.8	131	174.7	25.9	-37.2	0	0	0	109.4	K632 M633 F755	P630-K632 PolarHBondContact O-N 3.46Å; P630-K632 VanDerWaalsContact O-N 3.1Å; P630-M633 HydrophobicContact CG-CE 4.1Å; P630-M633 HydrophobicContact CG-SD 4.3Å; P630-M633 VanDerWaalsContact O-CG 3.29Å; P630-M633 WeakPolarHBondContact O-CG 3.43Å; P630-F755 HydrophobicContact CB-CZ 4.09Å; P630-F755 HydrophobicContact CG-CE1 3.82Å; P630-F755 HydrophobicContact CG-CZ 3.78Å
631	E	67.1	Low	76.9	Confident	107 Å²	107	50.1 Å²	50.1	50%	0.5	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	58.5	15.7	-176.4	-51.2	-170.8	160.4	0	0	116.2	T629 M633 R636	T629-E631 PolarHBondContact O-N 3.38Å; E631-M633 PolarHBondContact O-N 3.18Å; E631-R636 IonicContact OE2-NH1 3.8Å
632	K	74.8	Confident	76.2	Confident	49 Å²	49	50 Å²	50	21%	0.213	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	57.8	46	178.9	-49	-69.3	-172.6	164.5	0	112.1	F624 D627 T629 P630 I634 C635 R636	F624-K632 HydrophobicContact CD2-CB 4.36Å; F624-K632 HydrophobicContact CD2-CD 4.47Å; F624-K632 HydrophobicContact CD2-CG 4.12Å; F624-K632 HydrophobicContact CE2-CB 4.13Å; F624-K632 HydrophobicContact CE2-CD 4.32Å; F624-K632 HydrophobicContact CE2-CG 3.65Å; F624-K632 HydrophobicContact CZ-CG 4.22Å; F624-K632 WeakPolarHBondContact O-CE 3.44Å; F624-K632 PolarHBondContact O-NZ 3.03Å; D627-K632 HydrophobicContact CB-CD 4.01Å; D627-K632 WeakPolarHBondContact O-CD 3.45Å; D627-K632 VanDerWaalsContact O-CE 3.23Å; D627-K632 WeakPolarHBondContact O-CE 3.47Å; D627-K632 PolarHBondContact O-NZ 2.93Å; D627-K632 VanDerWaalsContact OD2-CA 3.27Å; D627-K632 WeakPolarHBondContact OD2-CA 3.4Å; T629-K632 PolarHBondContact O-N 3.07Å; P630-K632 PolarHBondContact O-N 3.46Å; P630-K632 VanDerWaalsContact O-N 3.1Å; K632-I634 PolarHBondContact O-N 3.41Å; K632-C635 PolarHBondContact O-N 3.38Å; K632-R636 WeakPolarHBondContact O-CB 3.37Å; K632-R636 PolarHBondContact O-N 3.32Å
633	M	72.5	Confident	75.7	Confident	94 Å²	94	48 Å²	48	46%	0.463	25%	0.251	S	S	.	.	H	α-helix	trans	-58.1	-29.9	-173.4	-81	175	-168.7	0	0	113.6	T629 P630 E631 S637	T629-M633 PolarHBondContact OG1-N 3.45Å; P630-M633 HydrophobicContact CG-CE 4.1Å; P630-M633 HydrophobicContact CG-SD 4.3Å; P630-M633 VanDerWaalsContact O-CG 3.29Å; P630-M633 WeakPolarHBondContact O-CG 3.43Å; E631-M633 PolarHBondContact O-N 3.18Å; M633-S637 VanDerWaalsContact O-CB 3.26Å; M633-S637 WeakPolarHBondContact O-CB 3.44Å; M633-S637 PolarHBondContact O-N 3.46Å
634	I	74.4	Confident	75	Confident	26 Å²	26	52.5 Å²	52.5	13%	0.133	27%	0.268	C	S	.	.	H	α-helix	trans	-75.8	-48.5	-174.8	-64.5	168.8	0	0	0	110.4	D627 T629 K632 R636 S637 M638 K1230 F1231 I1234	D627-I634 PolarHBondContact OD2-N 2.91Å; T629-I634 HydrophobicContact CG2-CD1 3.45Å; T629-I634 VanDerWaalsContact CG2-CD1 3.45Å; T629-I634 HydrophobicContact CG2-CG1 3.9Å; K632-I634 PolarHBondContact O-N 3.41Å; I634-R636 VanDerWaalsContact C-N 3.26Å; I634-R636 PolarHBondContact O-N 3.49Å; I634-S637 PolarHBondContact O-N 3.38Å; I634-M638 PolarHBondContact O-N 3.42Å; I634-K1230 HydrophobicContact CD1-CB 4.42Å; I634-K1230 HydrophobicContact CG1-CB 4.38Å; I634-K1230 HydrophobicContact CG2-CB 3.89Å; I634-F1231 HydrophobicContact CG2-CB 4.31Å; I634-I1234 HydrophobicContact CB-CD1 4.03Å; I634-I1234 HydrophobicContact CD1-CD1 3.32Å; I634-I1234 HydrophobicContact CD1-CG1 4.41Å; I634-I1234 HydrophobicContact CG1-CD1 4.26Å; I634-I1234 HydrophobicContact CG2-CD1 3.88Å
635	C	77.5	Confident	74.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-56.2	-44.4	172.3	-68.7	0	0	0	0	111.4	V623 D627 K632 S637 M638 L639	V623-C635 VanDerWaalsContact CG1-SG 3.6Å; D627-C635 PolarHBondContact OD2-N 3.27Å; K632-C635 PolarHBondContact O-N 3.38Å; C635-S637 PolarHBondContact O-N 2.92Å; C635-M638 PolarHBondContact O-N 3.28Å; C635-L639 WeakPolarHBondContact O-CG 3.29Å; C635-L639 PolarHBondContact O-N 3.33Å
636	R	77.8	Confident	73.7	Confident	55 Å²	55	45 Å²	45	21%	0.208	23%	0.23	C	C	.	.	H	α-helix	trans	-58.5	-47.3	176.7	178.3	-178.2	-178.5	175.5	4.8	112.4	E631 K632 I634 L639 N640 L672 E675	E631-R636 IonicContact OE2-NH1 3.8Å; K632-R636 WeakPolarHBondContact O-CB 3.37Å; K632-R636 PolarHBondContact O-N 3.32Å; I634-R636 VanDerWaalsContact C-N 3.26Å; I634-R636 PolarHBondContact O-N 3.49Å; R636-L639 PolarHBondContact O-N 3.37Å; R636-N640 WeakPolarHBondContact O-CB 3.12Å; R636-N640 PolarHBondContact O-N 3.03Å; R636-N640 VanDerWaalsContact O-N 3.14Å; R636-L672 HydrophobicContact CG-CD1 3.69Å; R636-E675 IonicContact CZ-OE1 3.33Å; R636-E675 IonicContact CZ-OE2 3.01Å; R636-E675 IonicContact NE-OE1 2.63Å; R636-E675 PolarHBondContact NE-OE1 3.32Å; R636-E675 VanDerWaalsContact NE-OE1 3.11Å; R636-E675 IonicContact NE-OE2 2.62Å; R636-E675 PolarHBondContact NE-OE2 2.95Å; R636-E675 IonicContact NH1-OE1 3.13Å; R636-E675 PolarHBondContact NH1-OE1 3.37Å; R636-E675 VanDerWaalsContact NH1-OE1 3.1Å; R636-E675 IonicContact NH1-OE2 3.14Å; R636-E675 IonicContact NH2-OE1 2.7Å; R636-E675 PolarHBondContact NH2-OE1 2.73Å; R636-E675 IonicContact NH2-OE2 2.7Å; R636-E675 PolarHBondContact NH2-OE2 3.37Å
637	S	72.6	Confident	72.9	Confident	55 Å²	55	42.3 Å²	42.3	39%	0.385	23%	0.227	S	C	.	.	H	α-helix	trans	-64.6	-40.8	-178.7	-168.2	0	0	0	0	111.6	M633 I634 C635 A641 A1227	M633-S637 VanDerWaalsContact O-CB 3.26Å; M633-S637 WeakPolarHBondContact O-CB 3.44Å; M633-S637 PolarHBondContact O-N 3.46Å; I634-S637 PolarHBondContact O-N 3.38Å; C635-S637 PolarHBondContact O-N 2.92Å; S637-A641 VanDerWaalsContact O-CB 3.23Å; S637-A641 WeakPolarHBondContact O-CB 3.38Å; S637-A641 PolarHBondContact O-N 3.09Å; S637-A1227 WeakPolarHBondContact OG-CB 3.5Å
638	M	80	Confident	72.4	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-45.8	177	-178.2	62.4	177.7	0	0	112.1	P579 I634 C635 N640 A641 L651 V1228 F1231	P579-M638 HydrophobicContact CG-CE 3.73Å; I634-M638 PolarHBondContact O-N 3.42Å; C635-M638 PolarHBondContact O-N 3.28Å; M638-N640 VanDerWaalsContact C-N 3.29Å; M638-N640 PolarHBondContact O-N 3.09Å; M638-A641 PolarHBondContact O-N 2.92Å; M638-L651 HydrophobicContact CE-CD2 4.34Å; M638-L651 HydrophobicContact CG-CD2 4.33Å; M638-V1228 HydrophobicContact CE-CG2 4.43Å; M638-V1228 HydrophobicContact SD-CB 4.46Å; M638-V1228 HydrophobicContact SD-CG2 3.88Å; M638-F1231 HydrophobicContact CB-CB 3.9Å; M638-F1231 HydrophobicContact CB-CD2 3.61Å; M638-F1231 HydrophobicContact CB-CE2 4.27Å; M638-F1231 HydrophobicContact CB-CG 3.77Å; M638-F1231 HydrophobicContact CE-CD1 3.95Å; M638-F1231 HydrophobicContact CE-CE1 4.24Å; M638-F1231 HydrophobicContact CG-CB 3.95Å; M638-F1231 HydrophobicContact CG-CD1 3.78Å; M638-F1231 HydrophobicContact CG-CD2 3.63Å; M638-F1231 HydrophobicContact CG-CE1 4.16Å; M638-F1231 HydrophobicContact CG-CE2 4.03Å; M638-F1231 HydrophobicContact CG-CG 3.5Å; M638-F1231 VanDerWaalsContact CG-CG 3.5Å; M638-F1231 HydrophobicContact CG-CZ 4.29Å; M638-F1231 HydrophobicContact SD-CB 4.09Å; M638-F1231 HydrophobicContact SD-CD1 4.06Å; M638-F1231 HydrophobicContact SD-CG 4.06Å
639	L	82.3	Confident	72.1	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-65.6	-32.3	-178	-73.2	170.2	0	0	0	113	L620 C635 R636 L651 I652 L672	L620-L639 HydrophobicContact CD2-CD2 4.49Å; C635-L639 WeakPolarHBondContact O-CG 3.29Å; C635-L639 PolarHBondContact O-N 3.33Å; R636-L639 PolarHBondContact O-N 3.37Å; L639-L651 HydrophobicContact CD2-CD2 4.05Å; L639-L651 HydrophobicContact CD2-CG 4.27Å; L639-L651 PolarHBondContact O-N 3.41Å; L639-I652 PolarHBondContact O-N 3.46Å; L639-L672 HydrophobicContact CB-CD2 3.37Å; L639-L672 HydrophobicContact CD1-CD2 4.15Å; L639-L672 HydrophobicContact CG-CD2 4.39Å
640	N	79.5	Confident	72.5	Confident	52 Å²	52	37.5 Å²	37.5	28%	0.278	21%	0.209	S	C	.	.	H	α-helix	trans	-89.3	-24	179.1	-90.8	-19.7	0	0	0	114.6	R636 M638 S650 L672 R676	R636-N640 WeakPolarHBondContact O-CB 3.12Å; R636-N640 PolarHBondContact O-N 3.03Å; R636-N640 VanDerWaalsContact O-N 3.14Å; M638-N640 VanDerWaalsContact C-N 3.29Å; M638-N640 PolarHBondContact O-N 3.09Å; N640-S650 WeakPolarHBondContact O-CB 3.18Å; N640-L672 WeakPolarHBondContact ND2-CD1 3.37Å; N640-L672 WeakPolarHBondContact OD1-CD2 3.45Å; N640-R676 PolarHBondContact OD1-NE 3.31Å; N640-R676 VanDerWaalsContact OD1-NE 3.12Å; N640-R676 PolarHBondContact OD1-NH2 3.32Å
641	A	73.5	Confident	73.4	Confident	10 Å²	10	34.7 Å²	34.7	8%	0.083	19%	0.191	C	C	.	.	S	Bend	trans	-62.2	126.8	-176.7	0	0	0	0	0	110.7	S637 M638 L643 A1227	S637-A641 VanDerWaalsContact O-CB 3.23Å; S637-A641 WeakPolarHBondContact O-CB 3.38Å; S637-A641 PolarHBondContact O-N 3.09Å; M638-A641 PolarHBondContact O-N 2.92Å; A641-L643 PolarHBondContact O-N 2.94Å; A641-A1227 HydrophobicContact CB-CB 4.25Å
642	P	72.3	Confident	74.2	Confident	51 Å²	51	29.7 Å²	29.7	33%	0.331	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	117	174.8	28	-32.2	0	0	0	109.5	R644 G648	P642-R644 PolarHBondContact O-N 3.43Å; P642-G648 WeakPolarHBondContact CB-O 3.4Å
643	L	70.3	Confident	74.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113.1	-176.6	-60.1	171.8	0	0	0	110.1	P579 A641 T645 F646 G648 I649 L651 V1228	P579-L643 HydrophobicContact CB-CD1 4.38Å; P579-L643 HydrophobicContact CG-CD1 4.37Å; A641-L643 PolarHBondContact O-N 2.94Å; L643-T645 PolarHBondContact O-N 3.1Å; L643-F646 HydrophobicContact CB-CD2 3.75Å; L643-F646 HydrophobicContact CD1-CD2 3.75Å; L643-F646 HydrophobicContact CD1-CE2 4.02Å; L643-F646 HydrophobicContact CG-CD2 4.4Å; L643-F646 PolarHBondContact O-N 3.2Å; L643-F646 VanDerWaalsContact O-N 3.08Å; L643-G648 VanDerWaalsContact O-CA 3.3Å; L643-G648 WeakPolarHBondContact O-CA 3.37Å; L643-G648 PolarHBondContact O-N 2.91Å; L643-I649 PolarHBondContact N-O 3.17Å; L643-L651 HydrophobicContact CD1-CB 4.24Å; L643-L651 HydrophobicContact CD1-CD1 4.39Å; L643-V1228 HydrophobicContact CD2-CG2 3.98Å
644	R	65.4	Low	75	Confident	95 Å²	95	24.9 Å²	24.9	36%	0.358	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-63.5	-27.1	179.6	-72.9	179.6	178.4	-175.3	3.5	113.5	T534 P642 F646 E1224	T534-R644 PolarHBondContact OG1-O 2.92Å; T534-R644 VanDerWaalsContact OG1-O 3.12Å; P642-R644 PolarHBondContact O-N 3.43Å; R644-F646 PolarHBondContact O-N 3.5Å; R644-E1224 WeakPolarHBondContact CD-OE2 3.49Å; R644-E1224 WeakPolarHBondContact CG-OE2 3.44Å; R644-E1224 PolarHBondContact N-OE1 3.29Å; R644-E1224 IonicContact NE-OE2 3.83Å
645	T	65.3	Low	75.5	Confident	6 Å²	6	23.7 Å²	23.7	4%	0.037	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-65.5	-21	175.4	45.4	0	0	0	0	112.9	T534 F535 K536 L538 L546 L643	T534-T645 CarbonylContact O-C 3.57Å; T534-T645 VanDerWaalsContact O-O 3.14Å; F535-T645 WeakPolarHBondContact CD1-O 3.47Å; K536-T645 WeakPolarHBondContact O-CG2 3.42Å; L538-T645 HydrophobicContact CB-CG2 4.32Å; L546-T645 HydrophobicContact CB-CG2 3.77Å; L643-T645 PolarHBondContact O-N 3.1Å
646	F	68.3	Low	75.8	Confident	6 Å²	6	24.6 Å²	24.6	3%	0.026	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-123.1	38.6	-176.4	-57.6	-86.7	0	0	0	112.6	L532 P579 L583 L643 R644 L654	L532-F646 HydrophobicContact CD1-CB 4.42Å; P579-F646 HydrophobicContact CB-CE2 3.55Å; P579-F646 HydrophobicContact CB-CZ 3.55Å; L583-F646 HydrophobicContact CB-CD1 4.28Å; L583-F646 HydrophobicContact CB-CE1 3.81Å; L583-F646 HydrophobicContact CD1-CD1 4.1Å; L583-F646 HydrophobicContact CD1-CE1 4.39Å; L583-F646 HydrophobicContact CD2-CD1 4.06Å; L583-F646 HydrophobicContact CD2-CE1 3.68Å; L583-F646 HydrophobicContact CG-CD1 4.35Å; L583-F646 HydrophobicContact CG-CE1 4.13Å; L643-F646 HydrophobicContact CB-CD2 3.75Å; L643-F646 HydrophobicContact CD1-CD2 3.75Å; L643-F646 HydrophobicContact CD1-CE2 4.02Å; L643-F646 HydrophobicContact CG-CD2 4.4Å; L643-F646 PolarHBondContact O-N 3.2Å; L643-F646 VanDerWaalsContact O-N 3.08Å; R644-F646 PolarHBondContact O-N 3.5Å; F646-L654 HydrophobicContact CB-CD2 4.4Å; F646-L654 HydrophobicContact CD1-CD2 4.16Å; F646-L654 HydrophobicContact CG-CD2 4.23Å
647	G	63.4	Low	75.9	Confident	29 Å²	29	25.7 Å²	25.7	30%	0.299	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	5.2	178.9	0	0	0	0	0	116	T534 I649	T534-G647 PolarHBondContact O-N 3.42Å; T534-G647 WeakPolarHBondContact OG1-CA 3.42Å; T534-G647 PolarHBondContact OG1-N 3.2Å; G647-I649 VanDerWaalsContact C-N 3.3Å
648	G	67.8	Low	76.4	Confident	39 Å²	39	23.2 Å²	23.2	40%	0.402	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	20.8	-172.2	0	0	0	0	0	113.4	P642 L643	P642-G648 WeakPolarHBondContact CB-O 3.4Å; L643-G648 VanDerWaalsContact O-CA 3.3Å; L643-G648 WeakPolarHBondContact O-CA 3.37Å; L643-G648 PolarHBondContact O-N 2.91Å
649	I	72.4	Confident	76.5	Confident	43 Å²	43	28.3 Å²	28.3	22%	0.221	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	140.6	179.8	-57.6	-176.6	0	0	0	108.6	L532 L643 G647 D653 L654	L532-I649 HydrophobicContact CD2-CD1 3.33Å; L532-I649 HydrophobicContact CD2-CG1 4.46Å; L643-I649 PolarHBondContact N-O 3.17Å; G647-I649 VanDerWaalsContact C-N 3.3Å; I649-D653 HydrophobicContact CG2-CB 3.47Å; I649-D653 VanDerWaalsContact CG2-CB 3.47Å; I649-L654 HydrophobicContact CG2-CB 4.45Å
650	S	81	Confident	76.6	Confident	7 Å²	7	28.2 Å²	28.2	5%	0.049	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	151.6	174.4	73.1	0	0	0	0	110.8	N640 I652 D653 L654 R676	N640-S650 WeakPolarHBondContact O-CB 3.18Å; S650-I652 VanDerWaalsContact C-N 3.26Å; S650-I652 PolarHBondContact O-N 3.33Å; S650-I652 WeakPolarHBondContact OG-CG2 3.08Å; S650-D653 PolarHBondContact O-N 3.38Å; S650-D653 PolarHBondContact OG-OD1 3.02Å; S650-D653 PolarHBondContact OG-OD2 3.43Å; S650-L654 PolarHBondContact O-N 3.19Å; S650-R676 PolarHBondContact OG-NH2 3.19Å
651	L	83	Confident	76.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.9	-36	-175.6	-177.2	60.6	0	0	0	112.3	L578 P579 V582 M638 L639 L643 D653 L654 C655	L578-L651 HydrophobicContact CD2-CD2 3.68Å; L578-L651 HydrophobicContact CG-CD2 4.01Å; P579-L651 HydrophobicContact CB-CD1 4.35Å; P579-L651 HydrophobicContact CG-CD1 4.43Å; V582-L651 HydrophobicContact CG2-CD1 4.49Å; M638-L651 HydrophobicContact CE-CD2 4.34Å; M638-L651 HydrophobicContact CG-CD2 4.33Å; L639-L651 HydrophobicContact CD2-CD2 4.05Å; L639-L651 HydrophobicContact CD2-CG 4.27Å; L639-L651 PolarHBondContact O-N 3.41Å; L643-L651 HydrophobicContact CD1-CB 4.24Å; L643-L651 HydrophobicContact CD1-CD1 4.39Å; L651-D653 VanDerWaalsContact C-N 3.34Å; L651-D653 PolarHBondContact O-N 3.4Å; L651-L654 HydrophobicContact CD1-CD2 4.28Å; L651-L654 WeakPolarHBondContact O-CB 3.41Å; L651-L654 PolarHBondContact O-N 3.14Å; L651-C655 PolarHBondContact O-N 2.91Å; L651-C655 PolarHBondContact O-SG 3.17Å
652	I	84.5	Confident	77.4	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-64.3	-37.2	174.3	-171.4	163.3	0	0	0	112.8	L639 S650 L654 C655 A656 L664 L672 L673 R676 Y1111	L639-I652 PolarHBondContact O-N 3.46Å; S650-I652 VanDerWaalsContact C-N 3.26Å; S650-I652 PolarHBondContact O-N 3.33Å; S650-I652 WeakPolarHBondContact OG-CG2 3.08Å; I652-L654 VanDerWaalsContact C-N 3.32Å; I652-C655 WeakPolarHBondContact O-CB 3.42Å; I652-C655 PolarHBondContact O-N 2.97Å; I652-A656 PolarHBondContact O-N 3.39Å; I652-L664 HydrophobicContact CG1-CD2 3.97Å; I652-L672 HydrophobicContact CB-CD2 4.37Å; I652-L672 HydrophobicContact CD1-CB 4.38Å; I652-L672 HydrophobicContact CD1-CD2 3.91Å; I652-L672 HydrophobicContact CD1-CG 4.38Å; I652-L672 HydrophobicContact CG2-CD2 4.31Å; I652-L673 HydrophobicContact CD1-CD2 3.96Å; I652-L673 HydrophobicContact CD1-CG 3.92Å; I652-R676 VanDerWaalsContact CG2-CZ 3.41Å; I652-Y1111 HydrophobicContact CG1-CD2 4.19Å; I652-Y1111 HydrophobicContact CG1-CE2 4.35Å
653	D	81.5	Confident	78.1	Confident	42 Å²	42	27.8 Å²	27.8	23%	0.225	15%	0.153	C	C	.	.	H	α-helix	trans	-71.4	-32.7	176.7	-56.7	-25.8	0	0	0	111	I649 S650 L651 A656 K657 R676 Y1111	I649-D653 HydrophobicContact CG2-CB 3.47Å; I649-D653 VanDerWaalsContact CG2-CB 3.47Å; S650-D653 PolarHBondContact O-N 3.38Å; S650-D653 PolarHBondContact OG-OD1 3.02Å; S650-D653 PolarHBondContact OG-OD2 3.43Å; L651-D653 VanDerWaalsContact C-N 3.34Å; L651-D653 PolarHBondContact O-N 3.4Å; D653-A656 PolarHBondContact O-N 3.26Å; D653-K657 WeakPolarHBondContact O-CB 3.39Å; D653-K657 PolarHBondContact O-N 3.19Å; D653-R676 IonicContact OD1-CZ 3.61Å; D653-R676 IonicContact OD1-NH1 2.78Å; D653-R676 PolarHBondContact OD1-NH1 2.95Å; D653-R676 IonicContact OD1-NH2 2.76Å; D653-R676 IonicContact OD2-NH1 3.35Å; D653-Y1111 VanDerWaalsContact CA-OH 3.31Å; D653-Y1111 WeakPolarHBondContact CA-OH 3.06Å; D653-Y1111 WeakPolarHBondContact CB-OH 3.48Å; D653-Y1111 WeakPolarHBondContact OD1-CE2 3.49Å; D653-Y1111 PolarHBondContact OD1-OH 3.37Å
654	L	81.8	Confident	78.8	Confident	1 Å²	1	28 Å²	28	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-66	-44.5	172.8	-169.6	69.4	0	0	0	110.9	L532 V582 L586 F646 I649 S650 L651 I652 A656 K657 A658	L532-L654 HydrophobicContact CD1-CD1 4.1Å; V582-L654 HydrophobicContact CB-CD2 4.46Å; V582-L654 HydrophobicContact CG1-CB 4.33Å; V582-L654 HydrophobicContact CG1-CD2 4.05Å; V582-L654 HydrophobicContact CG1-CG 3.86Å; L586-L654 HydrophobicContact CD2-CD1 4.18Å; F646-L654 HydrophobicContact CB-CD2 4.4Å; F646-L654 HydrophobicContact CD1-CD2 4.16Å; F646-L654 HydrophobicContact CG-CD2 4.23Å; I649-L654 HydrophobicContact CG2-CB 4.45Å; S650-L654 PolarHBondContact O-N 3.19Å; L651-L654 HydrophobicContact CD1-CD2 4.28Å; L651-L654 WeakPolarHBondContact O-CB 3.41Å; L651-L654 PolarHBondContact O-N 3.14Å; I652-L654 VanDerWaalsContact C-N 3.32Å; L654-A656 VanDerWaalsContact C-N 3.26Å; L654-A656 PolarHBondContact O-N 3.45Å; L654-K657 PolarHBondContact O-N 2.99Å; L654-K657 VanDerWaalsContact O-N 3.17Å; L654-A658 WeakPolarHBondContact O-CB 3.36Å; L654-A658 PolarHBondContact O-N 3.06Å
655	C	86.1	Confident	79.8	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.007	15%	0.147	C	C	.	.	H	α-helix	trans	-56.5	-41.5	173.3	-68.4	0	0	0	0	111.6	V582 L651 I652 A658 K659 C660 L664	V582-C655 HydrophobicContact CG1-CB 4.38Å; L651-C655 PolarHBondContact O-N 2.91Å; L651-C655 PolarHBondContact O-SG 3.17Å; I652-C655 WeakPolarHBondContact O-CB 3.42Å; I652-C655 PolarHBondContact O-N 2.97Å; C655-A658 CarbonylContact O-C 3.56Å; C655-A658 PolarHBondContact O-N 3.37Å; C655-K659 PolarHBondContact O-N 3.09Å; C655-C660 HydrophobicContact CB-CB 4.4Å; C655-C660 PolarHBondContact O-N 3.13Å; C655-L664 HydrophobicContact CB-CD2 4.3Å; C655-L664 HydrophobicContact CB-CG 4.42Å
656	A	82.9	Confident	80.7	Confident	19 Å²	19	25.6 Å²	25.6	16%	0.157	15%	0.15	C	C	.	.	H	α-helix	trans	-70	-39.6	176.6	0	0	0	0	0	113.2	I652 D653 L654 A658 K659 L664 Y1111	I652-A656 PolarHBondContact O-N 3.39Å; D653-A656 PolarHBondContact O-N 3.26Å; L654-A656 VanDerWaalsContact C-N 3.26Å; L654-A656 PolarHBondContact O-N 3.45Å; A656-A658 VanDerWaalsContact C-N 3.25Å; A656-A658 PolarHBondContact O-N 2.98Å; A656-K659 WeakPolarHBondContact O-CA 3.37Å; A656-K659 PolarHBondContact O-N 3.25Å; A656-L664 HydrophobicContact CB-CD1 4.19Å; A656-Y1111 HydrophobicContact CB-CD1 3.26Å; A656-Y1111 HydrophobicContact CB-CD2 3.93Å; A656-Y1111 HydrophobicContact CB-CE1 3.05Å; A656-Y1111 HydrophobicContact CB-CE2 3.75Å; A656-Y1111 HydrophobicContact CB-CG 3.74Å
657	K	80.1	Confident	81.4	Confident	78 Å²	78	28.8 Å²	28.8	34%	0.339	17%	0.173	S	C	.	.	H	α-helix	trans	-62.1	-36.5	173.4	-165	177.9	179.9	-176.6	0	111.2	G531 L532 L586 D653 L654 K659	G531-K657 PolarHBondContact O-NZ 3.33Å; L532-K657 HydrophobicContact CD2-CD 4.41Å; L532-K657 VanDerWaalsContact CD2-NZ 3.29Å; L586-K657 HydrophobicContact CD1-CB 4.39Å; L586-K657 HydrophobicContact CD1-CG 3.96Å; L586-K657 VanDerWaalsContact CD1-O 3.32Å; L586-K657 WeakPolarHBondContact CD1-O 3.49Å; L586-K657 HydrophobicContact CD2-CD 4.45Å; D653-K657 WeakPolarHBondContact O-CB 3.39Å; D653-K657 PolarHBondContact O-N 3.19Å; L654-K657 PolarHBondContact O-N 2.99Å; L654-K657 VanDerWaalsContact O-N 3.17Å; K657-K659 PolarHBondContact O-N 3.43Å
658	A	82.7	Confident	82.4	Confident	2 Å²	2	27.9 Å²	27.9	2%	0.017	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-7.3	173.6	0	0	0	0	0	113.6	V582 L586 R589 L654 C655 A656 C660	V582-A658 HydrophobicContact CG1-CB 4.05Å; L586-A658 HydrophobicContact CB-CB 3.81Å; L586-A658 HydrophobicContact CD1-CB 4.31Å; R589-A658 WeakPolarHBondContact CD-O 3.44Å; R589-A658 PolarHBondContact NH1-O 2.93Å; L654-A658 WeakPolarHBondContact O-CB 3.36Å; L654-A658 PolarHBondContact O-N 3.06Å; C655-A658 CarbonylContact O-C 3.56Å; C655-A658 PolarHBondContact O-N 3.37Å; A656-A658 VanDerWaalsContact C-N 3.25Å; A656-A658 PolarHBondContact O-N 2.98Å; A658-C660 VanDerWaalsContact C-N 3.28Å; A658-C660 PolarHBondContact O-N 3.36Å
659	K	82.8	Confident	83.2	Confident	110 Å²	110	26.1 Å²	26.1	48%	0.478	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	28.3	-174.4	-56.9	-173.1	174.1	-167.2	0	114.4	R589 C655 A656 K657 T661	R589-K659 PolarHBondContact NH1-O 2.85Å; C655-K659 PolarHBondContact O-N 3.09Å; A656-K659 WeakPolarHBondContact O-CA 3.37Å; A656-K659 PolarHBondContact O-N 3.25Å; K657-K659 PolarHBondContact O-N 3.43Å; K659-T661 PolarHBondContact O-N 3.37Å
660	C	84.9	Confident	83.8	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.007	14%	0.136	C	C	.	.			trans	-68.6	90.5	-178.9	-63.7	0	0	0	0	111.3	T585 E613 C655 A658 V663 L664	T585-C660 PolarHBondContact OG1-SG 3.32Å; E613-C660 HydrophobicContact CG-CB 4.17Å; E613-C660 WeakPolarHBondContact OE1-CA 3.45Å; E613-C660 WeakPolarHBondContact OE1-CB 3.39Å; C655-C660 HydrophobicContact CB-CB 4.4Å; C655-C660 PolarHBondContact O-N 3.13Å; A658-C660 VanDerWaalsContact C-N 3.28Å; A658-C660 PolarHBondContact O-N 3.36Å; C660-V663 HydrophobicContact CB-CB 3.93Å; C660-V663 HydrophobicContact CB-CG2 4.08Å; C660-L664 WeakPolarHBondContact O-CB 3.35Å; C660-L664 WeakPolarHBondContact O-CD1 3.34Å; C660-L664 WeakPolarHBondContact O-CG 3.35Å; C660-L664 PolarHBondContact O-N 2.94Å; C660-L664 VanDerWaalsContact O-N 3.08Å
661	T	83.8	Confident	83.8	Confident	30 Å²	30	29.8 Å²	29.8	18%	0.184	15%	0.154	C	C	.	.	H	α-helix	trans	-71	-37.9	-173.3	49.6	0	0	0	0	113	E613 K659 S665 A1108	E613-T661 PolarHBondContact OE1-N 2.98Å; K659-T661 PolarHBondContact O-N 3.37Å; T661-S665 WeakPolarHBondContact O-CB 3.5Å; T661-S665 PolarHBondContact O-N 3.49Å; T661-S665 PolarHBondContact O-OG 3.28Å; T661-A1108 HydrophobicContact CG2-CB 3.92Å
662	N	85.3	Confident	83.8	Confident	72 Å²	72	29.9 Å²	29.9	39%	0.385	16%	0.155	S	C	.	.	H	α-helix	trans	-74.6	-37.9	-179	-57.7	-21.5	0	0	0	110.5	E613 V617 S665	E613-N662 HydrophobicContact CG-CB 4.36Å; E613-N662 WeakPolarHBondContact OE1-CA 3.44Å; E613-N662 VanDerWaalsContact OE1-CB 3.29Å; E613-N662 WeakPolarHBondContact OE1-CB 3.39Å; E613-N662 PolarHBondContact OE1-N 2.91Å; V617-N662 HydrophobicContact CG2-CB 3.96Å; N662-S665 WeakPolarHBondContact CA-OG 3.47Å; N662-S665 PolarHBondContact O-N 2.94Å; N662-S665 PolarHBondContact O-OG 3.45Å
663	V	86	Confident	83.8	Confident	1 Å²	1	30 Å²	30	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-66.6	-41.1	173.6	178.8	0	0	0	0	110.6	E613 A616 V617 L620 C660 S665 L666 C669	E613-V663 HydrophobicContact CG-CG2 3.77Å; E613-V663 PolarHBondContact OE1-N 3.06Å; A616-V663 HydrophobicContact CB-CG2 3.96Å; V617-V663 HydrophobicContact CG2-CB 4.44Å; V617-V663 HydrophobicContact CG2-CG2 3.66Å; L620-V663 HydrophobicContact CD2-CG1 4.28Å; C660-V663 HydrophobicContact CB-CB 3.93Å; C660-V663 HydrophobicContact CB-CG2 4.08Å; V663-S665 VanDerWaalsContact C-N 3.34Å; V663-S665 PolarHBondContact O-N 3.24Å; V663-L666 WeakPolarHBondContact O-CB 3.36Å; V663-L666 PolarHBondContact O-N 3.13Å; V663-C669 PolarHBondContact O-SG 3.12Å
664	L	85.4	Confident	83.8	Confident	4 Å²	4	31.1 Å²	31.1	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-70.1	-28.7	178.4	-73.9	170.1	0	0	0	112.9	I652 C655 A656 C660 L666 Q670 A1108 Y1111	I652-L664 HydrophobicContact CG1-CD2 3.97Å; C655-L664 HydrophobicContact CB-CD2 4.3Å; C655-L664 HydrophobicContact CB-CG 4.42Å; A656-L664 HydrophobicContact CB-CD1 4.19Å; C660-L664 WeakPolarHBondContact O-CB 3.35Å; C660-L664 WeakPolarHBondContact O-CD1 3.34Å; C660-L664 WeakPolarHBondContact O-CG 3.35Å; C660-L664 PolarHBondContact O-N 2.94Å; C660-L664 VanDerWaalsContact O-N 3.08Å; L664-L666 VanDerWaalsContact C-N 3.26Å; L664-L666 PolarHBondContact O-N 3.32Å; L664-Q670 PolarHBondContact O-NE2 3.24Å; L664-A1108 HydrophobicContact CB-CB 4.08Å; L664-A1108 HydrophobicContact CD1-CB 4.14Å; L664-Y1111 HydrophobicContact CD2-CD2 4.5Å
665	S	85.9	Confident	83.7	Confident	31 Å²	31	31.8 Å²	31.8	22%	0.217	17%	0.165	C	C	.	.	H	α-helix	trans	-75.1	-13.4	178.4	67.8	0	0	0	0	113.7	T661 N662 V663	T661-S665 WeakPolarHBondContact O-CB 3.5Å; T661-S665 PolarHBondContact O-N 3.49Å; T661-S665 PolarHBondContact O-OG 3.28Å; N662-S665 WeakPolarHBondContact CA-OG 3.47Å; N662-S665 PolarHBondContact O-N 2.94Å; N662-S665 PolarHBondContact O-OG 3.45Å; V663-S665 VanDerWaalsContact C-N 3.34Å; V663-S665 PolarHBondContact O-N 3.24Å
666	L	85.9	Confident	83.5	Confident	21 Å²	21	35 Å²	35	11%	0.11	18%	0.177	C	C	.	.	S	Bend	trans	-58.6	143.7	176.4	-72	172.9	0	0	0	112.6	V617 L620 N621 V663 L664 C668 C669 Q670	V617-L666 HydrophobicContact CB-CD1 4.42Å; V617-L666 HydrophobicContact CG1-CD1 4.24Å; V617-L666 HydrophobicContact CG1-CD2 4.19Å; V617-L666 HydrophobicContact CG2-CD1 4.27Å; L620-L666 HydrophobicContact CB-CD1 4.2Å; L620-L666 HydrophobicContact CD2-CD1 3.82Å; L620-L666 HydrophobicContact CG-CD1 4.25Å; N621-L666 VanDerWaalsContact OD1-CD2 3.24Å; N621-L666 WeakPolarHBondContact OD1-CD2 3.36Å; V663-L666 WeakPolarHBondContact O-CB 3.36Å; V663-L666 PolarHBondContact O-N 3.13Å; L664-L666 VanDerWaalsContact C-N 3.26Å; L664-L666 PolarHBondContact O-N 3.32Å; L666-C668 PolarHBondContact O-N 2.9Å; L666-C669 PolarHBondContact O-N 2.93Å; L666-C669 VanDerWaalsContact O-N 3.1Å; L666-Q670 WeakPolarHBondContact O-CG 3.39Å; L666-Q670 PolarHBondContact O-N 3.12Å
667	S	81.6	Confident	83.5	Confident	72 Å²	72	35.8 Å²	35.8	50%	0.503	18%	0.175	S	C	.	.	H	α-helix	trans	-57.2	-35.2	-178.5	57.6	0	0	0	0	113.1	R671	S667-R671 WeakPolarHBondContact O-CB 3.41Å; S667-R671 PolarHBondContact O-N 3.24Å
668	C	84.1	Confident	83.6	Confident	11 Å²	11	33.7 Å²	33.7	7%	0.074	17%	0.167	C	C	.	.	H	α-helix	trans	-63.6	-48.8	175.7	-174.8	0	0	0	0	112.1	F624 L666 R671 L672	F624-C668 HydrophobicContact CD2-CB 3.62Å; F624-C668 HydrophobicContact CE2-CB 3.9Å; F624-C668 HydrophobicContact CG-CB 4.32Å; L666-C668 PolarHBondContact O-N 2.9Å; C668-R671 PolarHBondContact O-N 3.47Å; C668-L672 PolarHBondContact O-N 2.93Å; C668-L672 VanDerWaalsContact O-N 3.13Å
669	C	85.1	Confident	83.4	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.007	18%	0.175	C	C	.	.	H	α-helix	trans	-65.4	-40.3	177.2	-67.3	0	0	0	0	111.6	V663 L666 L672 L673	V663-C669 PolarHBondContact O-SG 3.12Å; L666-C669 PolarHBondContact O-N 2.93Å; L666-C669 VanDerWaalsContact O-N 3.1Å; C669-L672 WeakPolarHBondContact O-CB 3.21Å; C669-L672 PolarHBondContact O-N 3.31Å; C669-L673 WeakPolarHBondContact O-CG 3.39Å; C669-L673 PolarHBondContact O-N 3.5Å
670	Q	85.3	Confident	83.1	Confident	15 Å²	15	29.7 Å²	29.7	7%	0.07	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-40.6	177.4	-69.7	-61.7	-49.8	0	0	112.3	L664 L666 L672 L673 D674 L1107	L664-Q670 PolarHBondContact O-NE2 3.24Å; L666-Q670 WeakPolarHBondContact O-CG 3.39Å; L666-Q670 PolarHBondContact O-N 3.12Å; Q670-L672 VanDerWaalsContact C-N 3.3Å; Q670-L672 PolarHBondContact O-N 3.19Å; Q670-L673 WeakPolarHBondContact O-CB 3.49Å; Q670-L673 PolarHBondContact O-N 3.26Å; Q670-D674 PolarHBondContact O-N 3.28Å; Q670-L1107 HydrophobicContact CG-CD2 4.08Å; Q670-L1107 PolarHBondContact NE2-O 2.89Å
671	R	81.5	Confident	82.7	Confident	112 Å²	112	29.6 Å²	29.6	42%	0.423	16%	0.155	S	C	.	.	H	α-helix	trans	-61.8	-39.2	173.6	-175	173.7	-179.7	149.6	1.7	112	S667 C668 D674 E675	S667-R671 WeakPolarHBondContact O-CB 3.41Å; S667-R671 PolarHBondContact O-N 3.24Å; C668-R671 PolarHBondContact O-N 3.47Å; R671-D674 PolarHBondContact O-N 3.3Å; R671-E675 WeakPolarHBondContact O-CG 3.3Å; R671-E675 PolarHBondContact O-N 2.91Å; R671-E675 VanDerWaalsContact O-N 3.13Å
672	L	82.5	Confident	82.2	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-66.2	-38.5	175.2	-165.7	62.4	0	0	0	112.7	R636 L639 N640 I652 C668 C669 Q670 E675 R676	R636-L672 HydrophobicContact CG-CD1 3.69Å; L639-L672 HydrophobicContact CB-CD2 3.37Å; L639-L672 HydrophobicContact CD1-CD2 4.15Å; L639-L672 HydrophobicContact CG-CD2 4.39Å; N640-L672 WeakPolarHBondContact ND2-CD1 3.37Å; N640-L672 WeakPolarHBondContact OD1-CD2 3.45Å; I652-L672 HydrophobicContact CB-CD2 4.37Å; I652-L672 HydrophobicContact CD1-CB 4.38Å; I652-L672 HydrophobicContact CD1-CD2 3.91Å; I652-L672 HydrophobicContact CD1-CG 4.38Å; I652-L672 HydrophobicContact CG2-CD2 4.31Å; C668-L672 PolarHBondContact O-N 2.93Å; C668-L672 VanDerWaalsContact O-N 3.13Å; C669-L672 WeakPolarHBondContact O-CB 3.21Å; C669-L672 PolarHBondContact O-N 3.31Å; Q670-L672 VanDerWaalsContact C-N 3.3Å; Q670-L672 PolarHBondContact O-N 3.19Å; L672-E675 WeakPolarHBondContact CD1-OE2 3.07Å; L672-E675 WeakPolarHBondContact O-CB 3.5Å; L672-E675 PolarHBondContact O-N 3.08Å; L672-R676 PolarHBondContact O-N 3.27Å
673	L	84.4	Confident	81.5	Confident	3 Å²	3	28.9 Å²	28.9	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-65.3	-40.6	174	-74.9	172.4	0	0	0	111.6	I652 C669 Q670 E675 R676 W677 Y1111 V1114	I652-L673 HydrophobicContact CD1-CD2 3.96Å; I652-L673 HydrophobicContact CD1-CG 3.92Å; C669-L673 WeakPolarHBondContact O-CG 3.39Å; C669-L673 PolarHBondContact O-N 3.5Å; Q670-L673 WeakPolarHBondContact O-CB 3.49Å; Q670-L673 PolarHBondContact O-N 3.26Å; L673-E675 PolarHBondContact O-N 2.95Å; L673-R676 PolarHBondContact O-N 3.29Å; L673-W677 VanDerWaalsContact O-CB 3.28Å; L673-W677 WeakPolarHBondContact O-CB 3.3Å; L673-W677 PolarHBondContact O-N 3.11Å; L673-Y1111 HydrophobicContact CD2-CD2 3.83Å; L673-Y1111 HydrophobicContact CD2-CG 4.37Å; L673-V1114 HydrophobicContact CD2-CB 4.48Å; L673-V1114 HydrophobicContact CD2-CG2 4.37Å
674	D	82.6	Confident	81.1	Confident	66 Å²	66	29 Å²	29	35%	0.353	15%	0.152	S	C	.	.	H	α-helix	trans	-60.7	-36.8	175.1	-73.3	-27.9	0	0	0	111.3	Q670 R671 W677 H678	Q670-D674 PolarHBondContact O-N 3.28Å; R671-D674 PolarHBondContact O-N 3.3Å; D674-W677 PolarHBondContact O-N 2.79Å; D674-H678 WeakPolarHBondContact O-CB 3.41Å; D674-H678 PolarHBondContact O-N 3.39Å; D674-H678 PolarHBondContact O-ND1 2.99Å
675	E	79.4	Confident	80.7	Confident	16 Å²	16	30.4 Å²	30.4	8%	0.075	16%	0.162	C	C	.	.	H	α-helix	trans	-66.4	-45.6	173.8	-70	167.1	178.3	0	0	112.8	R636 R671 L672 L673 W677 G679 I682	R636-E675 IonicContact CZ-OE1 3.33Å; R636-E675 IonicContact CZ-OE2 3.01Å; R636-E675 IonicContact NE-OE1 2.63Å; R636-E675 PolarHBondContact NE-OE1 3.32Å; R636-E675 VanDerWaalsContact NE-OE1 3.11Å; R636-E675 IonicContact NE-OE2 2.62Å; R636-E675 PolarHBondContact NE-OE2 2.95Å; R636-E675 IonicContact NH1-OE1 3.13Å; R636-E675 PolarHBondContact NH1-OE1 3.37Å; R636-E675 VanDerWaalsContact NH1-OE1 3.1Å; R636-E675 IonicContact NH1-OE2 3.14Å; R636-E675 IonicContact NH2-OE1 2.7Å; R636-E675 PolarHBondContact NH2-OE1 2.73Å; R636-E675 IonicContact NH2-OE2 2.7Å; R636-E675 PolarHBondContact NH2-OE2 3.37Å; R671-E675 WeakPolarHBondContact O-CG 3.3Å; R671-E675 PolarHBondContact O-N 2.91Å; R671-E675 VanDerWaalsContact O-N 3.13Å; L672-E675 WeakPolarHBondContact CD1-OE2 3.07Å; L672-E675 WeakPolarHBondContact O-CB 3.5Å; L672-E675 PolarHBondContact O-N 3.08Å; L673-E675 PolarHBondContact O-N 2.95Å; E675-W677 VanDerWaalsContact C-N 3.26Å; E675-W677 PolarHBondContact O-N 3.37Å; E675-G679 WeakPolarHBondContact O-CA 3.36Å; E675-G679 PolarHBondContact O-N 3Å; E675-I682 HydrophobicContact CB-CD1 4.21Å; E675-I682 HydrophobicContact CG-CD1 3.4Å
676	R	81.7	Confident	80.3	Confident	69 Å²	69	35 Å²	35	26%	0.26	18%	0.182	S	C	.	.	H	α-helix	trans	-63.6	-35.3	175.3	-71.7	-173.6	178.2	-164.2	1.1	111.6	N640 S650 I652 D653 L672 L673 P820 V1114	N640-R676 PolarHBondContact OD1-NE 3.31Å; N640-R676 VanDerWaalsContact OD1-NE 3.12Å; N640-R676 PolarHBondContact OD1-NH2 3.32Å; S650-R676 PolarHBondContact OG-NH2 3.19Å; I652-R676 VanDerWaalsContact CG2-CZ 3.41Å; D653-R676 IonicContact OD1-CZ 3.61Å; D653-R676 IonicContact OD1-NH1 2.78Å; D653-R676 PolarHBondContact OD1-NH1 2.95Å; D653-R676 IonicContact OD1-NH2 2.76Å; D653-R676 IonicContact OD2-NH1 3.35Å; L672-R676 PolarHBondContact O-N 3.27Å; L673-R676 PolarHBondContact O-N 3.29Å; R676-P820 WeakPolarHBondContact O-CD 3.37Å; R676-P820 WeakPolarHBondContact O-CG 3.08Å; R676-V1114 HydrophobicContact CB-CG1 3.85Å
677	W	83.6	Confident	79.9	Confident	34 Å²	34	41.9 Å²	41.9	13%	0.129	21%	0.207	C	C	.	.	H	α-helix	trans	-68.2	-48.6	178.9	-179.2	-113.5	0	0	0	113	L673 D674 E675 P820 S821 F824 I950 V1114 Y1117	L673-W677 VanDerWaalsContact O-CB 3.28Å; L673-W677 WeakPolarHBondContact O-CB 3.3Å; L673-W677 PolarHBondContact O-N 3.11Å; D674-W677 PolarHBondContact O-N 2.79Å; E675-W677 VanDerWaalsContact C-N 3.26Å; E675-W677 PolarHBondContact O-N 3.37Å; W677-P820 HydrophobicContact CD2-CB 4.44Å; W677-P820 HydrophobicContact CE3-CB 3.66Å; W677-P820 HydrophobicContact CZ3-CB 3.97Å; W677-P820 WeakPolarHBondContact O-CD 3.15Å; W677-S821 PolarHBondContact NE1-OG 2.74Å; W677-S821 WeakPolarHBondContact O-CB 3.41Å; W677-S821 PolarHBondContact O-N 2.62Å; W677-F824 HydrophobicContact CH2-CB 3.42Å; W677-F824 VanDerWaalsContact CH2-CB 3.42Å; W677-F824 HydrophobicContact CH2-CD1 4.28Å; W677-F824 HydrophobicContact CH2-CD2 4.03Å; W677-F824 AromaticContact CH2-CG 3.63Å; W677-F824 HydrophobicContact CH2-CG 3.63Å; W677-F824 HydrophobicContact CZ2-CB 3.78Å; W677-F824 HydrophobicContact CZ2-CD1 4.02Å; W677-F824 AromaticContact CZ2-CG 3.84Å; W677-F824 HydrophobicContact CZ2-CG 3.84Å; W677-F824 HydrophobicContact CZ3-CB 4.41Å; W677-I950 HydrophobicContact CH2-CD1 3.35Å; W677-I950 HydrophobicContact CZ2-CD1 3.47Å; W677-I950 VanDerWaalsContact CZ2-CD1 3.47Å; W677-I950 HydrophobicContact CZ3-CD1 4.24Å; W677-V1114 HydrophobicContact CB-CG2 4.2Å; W677-V1114 HydrophobicContact CD2-CG2 4.48Å; W677-V1114 HydrophobicContact CE3-CB 4.47Å; W677-V1114 HydrophobicContact CE3-CG2 3.8Å; W677-Y1117 HydrophobicContact CH2-CD2 4.42Å; W677-Y1117 HydrophobicContact CZ3-CD2 4.29Å; W677-Y1117 HydrophobicContact CZ3-CG 4.44Å
678	H	81.2	Confident	79.9	Confident	34 Å²	34	39.5 Å²	39.5	16%	0.157	19%	0.188	C	C	.	.	H	α-helix	trans	-80.3	-24.3	-179.3	-66	94.4	0	0	0	112.5	D674 V680 L681 I682	D674-H678 WeakPolarHBondContact O-CB 3.41Å; D674-H678 PolarHBondContact O-N 3.39Å; D674-H678 PolarHBondContact O-ND1 2.99Å; H678-V680 PolarHBondContact O-N 2.94Å; H678-L681 HydrophobicContact CB-CB 4.31Å; H678-L681 WeakPolarHBondContact O-CB 3.49Å; H678-L681 VanDerWaalsContact O-CD1 3.31Å; H678-L681 WeakPolarHBondContact O-CD1 3.19Å; H678-L681 PolarHBondContact O-N 3.05Å; H678-I682 HydrophobicContact CB-CB 4.22Å
679	G	78.9	Confident	79.8	Confident	19 Å²	19	41.4 Å²	41.4	20%	0.196	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	52	-123.7	-175.6	0	0	0	0	0	111.3	E675 L681 I682	E675-G679 WeakPolarHBondContact O-CA 3.36Å; E675-G679 PolarHBondContact O-N 3Å; G679-L681 PolarHBondContact O-N 3.05Å; G679-I682 WeakPolarHBondContact O-CG2 3.06Å; G679-I682 PolarHBondContact O-N 3.46Å
680	V	75.2	Confident	79.5	Confident	9 Å²	9	49 Å²	49	6%	0.055	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-65	-23.3	-179.1	-173.7	0	0	0	0	112.7	H678 I682 C683 F802 W804 F812	H678-V680 PolarHBondContact O-N 2.94Å; V680-I682 PolarHBondContact O-N 3.07Å; V680-C683 PolarHBondContact O-N 3.38Å; V680-F802 HydrophobicContact CG2-CE1 4.3Å; V680-F802 HydrophobicContact CG2-CE2 4.39Å; V680-F802 HydrophobicContact CG2-CZ 4.16Å; V680-W804 HydrophobicContact CG1-CH2 3.99Å; V680-W804 HydrophobicContact CG1-CZ2 4.4Å; V680-W804 HydrophobicContact CG2-CH2 4.44Å; V680-W804 HydrophobicContact CG2-CZ2 4.04Å; V680-F812 HydrophobicContact CG1-CD2 3.35Å; V680-F812 HydrophobicContact CG1-CE2 3.38Å; V680-F812 HydrophobicContact CG1-CG 4.39Å; V680-F812 HydrophobicContact CG1-CZ 4.44Å
681	L	76.8	Confident	79.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-67.8	-16.7	-179.7	-73	79.3	0	0	0	113	H678 G679 C683 L684 R689 K693 V816 S819	H678-L681 HydrophobicContact CB-CB 4.31Å; H678-L681 WeakPolarHBondContact O-CB 3.49Å; H678-L681 VanDerWaalsContact O-CD1 3.31Å; H678-L681 WeakPolarHBondContact O-CD1 3.19Å; H678-L681 PolarHBondContact O-N 3.05Å; G679-L681 PolarHBondContact O-N 3.05Å; L681-C683 PolarHBondContact O-N 3.24Å; L681-L684 WeakPolarHBondContact O-CB 3.02Å; L681-L684 PolarHBondContact O-N 3.19Å; L681-L684 VanDerWaalsContact O-N 3.09Å; L681-R689 PolarHBondContact O-NE 3.23Å; L681-K693 HydrophobicContact CD2-CG 4.06Å; L681-V816 HydrophobicContact CD1-CB 4.25Å; L681-V816 HydrophobicContact CD1-CG1 4.06Å; L681-V816 HydrophobicContact CD1-CG2 4.1Å; L681-S819 VanDerWaalsContact CD1-OG 3.25Å; L681-S819 WeakPolarHBondContact CD1-OG 3.46Å
682	I	73.8	Confident	79.3	Confident	53 Å²	53	45.4 Å²	45.4	27%	0.272	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-65.3	-27.8	-178.1	-156.3	173.4	0	0	0	112.6	E675 H678 G679 V680 L684 R689	E675-I682 HydrophobicContact CB-CD1 4.21Å; E675-I682 HydrophobicContact CG-CD1 3.4Å; H678-I682 HydrophobicContact CB-CB 4.22Å; G679-I682 WeakPolarHBondContact O-CG2 3.06Å; G679-I682 PolarHBondContact O-N 3.46Å; V680-I682 PolarHBondContact O-N 3.07Å; I682-L684 PolarHBondContact O-N 3.45Å; I682-R689 PolarHBondContact O-NH2 3.49Å; I682-R689 VanDerWaalsContact O-NH2 3.09Å
683	C	70	Confident	79.2	Confident	33 Å²	33	46.5 Å²	46.5	22%	0.223	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-67	-12.6	177.2	-62.2	0	0	0	0	113.2	V680 L681 F703 M798	V680-C683 PolarHBondContact O-N 3.38Å; L681-C683 PolarHBondContact O-N 3.24Å; C683-F703 HydrophobicContact CB-CE1 4.01Å; C683-F703 HydrophobicContact CB-CZ 3.53Å; C683-M798 HydrophobicContact CB-SD 4.42Å
684	L	77.7	Confident	78.9	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.016	25%	0.245	C	C	.	.	S	Bend	trans	-95.6	146.4	176.5	-65.7	164.6	0	0	0	111.6	L681 I682 M688 R689 C692 Y702 F703 F812	L681-L684 WeakPolarHBondContact O-CB 3.02Å; L681-L684 PolarHBondContact O-N 3.19Å; L681-L684 VanDerWaalsContact O-N 3.09Å; I682-L684 PolarHBondContact O-N 3.45Å; L684-M688 HydrophobicContact CD2-CG 4.23Å; L684-R689 HydrophobicContact CB-CG 4.16Å; L684-R689 PolarHBondContact O-NE 3.4Å; L684-R689 PolarHBondContact O-NH2 2.89Å; L684-C692 HydrophobicContact CD1-CB 3.89Å; L684-C692 WeakPolarHBondContact CD1-SG 3.31Å; L684-Y702 HydrophobicContact CD2-CD1 3.55Å; L684-Y702 HydrophobicContact CD2-CE1 4.23Å; L684-Y702 HydrophobicContact CD2-CG 4.23Å; L684-F703 HydrophobicContact CD1-CE2 4.48Å; L684-F703 HydrophobicContact CD2-CD2 4.13Å; L684-F703 HydrophobicContact CD2-CE2 3.45Å; L684-F703 VanDerWaalsContact CD2-CE2 3.45Å; L684-F703 HydrophobicContact CD2-CZ 3.75Å; L684-F703 HydrophobicContact CG-CE2 3.78Å; L684-F703 HydrophobicContact CG-CZ 3.94Å; L684-F812 HydrophobicContact CD1-CZ 4.21Å
685	P	77.9	Confident	78.8	Confident	35 Å²	35	56.4 Å²	56.4	23%	0.227	26%	0.259	C	S	.	.			trans	-64.7	153.1	172	28.1	-33.7	0	0	0	111.5	W687 M688 R689 Y702	P685-W687 VanDerWaalsContact C-N 3.34Å; P685-W687 PolarHBondContact O-N 2.97Å; P685-M688 HydrophobicContact CG-CB 3.83Å; P685-M688 WeakPolarHBondContact O-CA 3.23Å; P685-M688 WeakPolarHBondContact O-CB 3.11Å; P685-M688 PolarHBondContact O-N 3.19Å; P685-R689 PolarHBondContact O-N 3.03Å; P685-R689 VanDerWaalsContact O-N 3.09Å; P685-Y702 HydrophobicContact CG-CE1 4.14Å; P685-Y702 HydrophobicContact CG-CE2 4.06Å
686	I	77.7	Confident	78.7	Confident	126 Å²	126	56.2 Å²	56.2	65%	0.646	26%	0.259	S	S	*	.	H	α-helix	trans	-54	-45.1	-168.6	-61.5	163.9	0	0	0	112.8	M688 R689	I686-M688 VanDerWaalsContact C-N 3.26Å; I686-M688 PolarHBondContact O-N 2.94Å; I686-R689 WeakPolarHBondContact O-CB 3.46Å; I686-R689 PolarHBondContact O-N 3.31Å
687	W	77.1	Confident	78.5	Confident	167 Å²	167	56.8 Å²	56.8	63%	0.633	27%	0.27	S	S	*	.	H	α-helix	trans	-61.7	-35.4	178.6	69.3	-89.5	0	0	0	112.5	P685	P685-W687 VanDerWaalsContact C-N 3.34Å; P685-W687 PolarHBondContact O-N 2.97Å
688	M	81.7	Confident	78.3	Confident	22 Å²	22	56.4 Å²	56.4	11%	0.108	27%	0.274	C	S	.	.	H	α-helix	trans	-81.2	-19.2	-179.2	-160.7	60.1	141.7	0	0	112.7	L684 P685 I686 W690 T691 C692 A698 Y702	L684-M688 HydrophobicContact CD2-CG 4.23Å; P685-M688 HydrophobicContact CG-CB 3.83Å; P685-M688 WeakPolarHBondContact O-CA 3.23Å; P685-M688 WeakPolarHBondContact O-CB 3.11Å; P685-M688 PolarHBondContact O-N 3.19Å; I686-M688 VanDerWaalsContact C-N 3.26Å; I686-M688 PolarHBondContact O-N 2.94Å; M688-W690 VanDerWaalsContact C-N 3.27Å; M688-W690 PolarHBondContact O-N 3.08Å; M688-T691 WeakPolarHBondContact CA-OG1 3.07Å; M688-T691 PolarHBondContact O-N 3Å; M688-T691 PolarHBondContact O-OG1 2.9Å; M688-T691 PolarHBondContact SD-OG1 3.15Å; M688-C692 WeakPolarHBondContact O-CB 3.24Å; M688-C692 PolarHBondContact O-N 3.36Å; M688-C692 PolarHBondContact O-SG 3.22Å; M688-A698 HydrophobicContact CE-CB 4.33Å; M688-A698 WeakPolarHBondContact CE-O 3.43Å; M688-Y702 HydrophobicContact CE-CD2 4.24Å; M688-Y702 HydrophobicContact CE-CG 4.26Å; M688-Y702 HydrophobicContact CG-CG 4.47Å
689	R	82.3	Confident	78.1	Confident	51 Å²	51	54.8 Å²	54.8	19%	0.192	27%	0.267	C	S	.	.	H	α-helix	trans	-62.7	-36.8	175.5	-66.4	-180	-172.3	174	1.7	111.5	L681 I682 L684 P685 I686 K693	L681-R689 PolarHBondContact O-NE 3.23Å; I682-R689 PolarHBondContact O-NH2 3.49Å; I682-R689 VanDerWaalsContact O-NH2 3.09Å; L684-R689 HydrophobicContact CB-CG 4.16Å; L684-R689 PolarHBondContact O-NE 3.4Å; L684-R689 PolarHBondContact O-NH2 2.89Å; P685-R689 PolarHBondContact O-N 3.03Å; P685-R689 VanDerWaalsContact O-N 3.09Å; I686-R689 WeakPolarHBondContact O-CB 3.46Å; I686-R689 PolarHBondContact O-N 3.31Å; R689-K693 WeakPolarHBondContact O-CG 3.33Å; R689-K693 PolarHBondContact O-N 3.04Å
690	W	79.4	Confident	78	Confident	159 Å²	159	55.1 Å²	55.1	60%	0.602	26%	0.264	S	S	*	.	H	α-helix	trans	-70.2	-46.9	178	-79.6	100.5	0	0	0	112.2	M688 C692 K693 F694	M688-W690 VanDerWaalsContact C-N 3.27Å; M688-W690 PolarHBondContact O-N 3.08Å; W690-C692 VanDerWaalsContact C-N 3.29Å; W690-C692 PolarHBondContact O-N 3.3Å; W690-K693 WeakPolarHBondContact O-CB 3.47Å; W690-K693 PolarHBondContact O-N 2.76Å; W690-F694 WeakPolarHBondContact O-CD2 3.28Å
691	T	81.1	Confident	78.2	Confident	52 Å²	52	60.9 Å²	60.9	32%	0.319	29%	0.288	S	S	.	.	H	α-helix	trans	-63.3	-37.4	178.6	57.1	0	0	0	0	111.7	M688 K693 F694 F695	M688-T691 WeakPolarHBondContact CA-OG1 3.07Å; M688-T691 PolarHBondContact O-N 3Å; M688-T691 PolarHBondContact O-OG1 2.9Å; M688-T691 PolarHBondContact SD-OG1 3.15Å; T691-K693 VanDerWaalsContact C-N 3.29Å; T691-K693 PolarHBondContact O-N 3.15Å; T691-F694 PolarHBondContact O-N 3.08Å; T691-F695 PolarHBondContact O-N 3.38Å
692	C	81.3	Confident	78.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-69.9	-21.1	178.9	-66.9	0	0	0	0	114.5	L684 M688 W690 F695 P696 G699	L684-C692 HydrophobicContact CD1-CB 3.89Å; L684-C692 WeakPolarHBondContact CD1-SG 3.31Å; M688-C692 WeakPolarHBondContact O-CB 3.24Å; M688-C692 PolarHBondContact O-N 3.36Å; M688-C692 PolarHBondContact O-SG 3.22Å; W690-C692 VanDerWaalsContact C-N 3.29Å; W690-C692 PolarHBondContact O-N 3.3Å; C692-F695 WeakPolarHBondContact CA-O 3.41Å; C692-F695 CarbonylContact O-C 3.53Å; C692-P696 VanDerWaalsContact O-CA 3.29Å; C692-P696 WeakPolarHBondContact O-CA 3.48Å; C692-G699 WeakPolarHBondContact SG-CA 3.31Å; C692-G699 PolarHBondContact SG-N 3.12Å
693	K	79.3	Confident	78.3	Confident	25 Å²	25	61 Å²	61	11%	0.109	29%	0.286	C	S	.	.	H	α-helix	trans	-66	-42.2	172.1	-73.8	175.3	178.7	-172.1	0	110.8	L681 R689 W690 T691 S821 M822	L681-K693 HydrophobicContact CD2-CG 4.06Å; R689-K693 WeakPolarHBondContact O-CG 3.33Å; R689-K693 PolarHBondContact O-N 3.04Å; W690-K693 WeakPolarHBondContact O-CB 3.47Å; W690-K693 PolarHBondContact O-N 2.76Å; T691-K693 VanDerWaalsContact C-N 3.29Å; T691-K693 PolarHBondContact O-N 3.15Å; K693-S821 WeakPolarHBondContact CE-OG 3.13Å; K693-S821 PolarHBondContact NZ-OG 2.98Å; K693-M822 HydrophobicContact CB-SD 3.84Å; K693-M822 HydrophobicContact CG-SD 4.02Å; K693-M822 WeakPolarHBondContact O-CE 3.09Å
694	F	79.1	Confident	78.7	Confident	129 Å²	129	61.3 Å²	61.3	57%	0.566	28%	0.284	S	S	*	.	H	α-helix	trans	-81.7	-42.6	177.5	-64.1	-76.9	0	0	0	112	W690 T691	W690-F694 WeakPolarHBondContact O-CD2 3.28Å; T691-F694 PolarHBondContact O-N 3.08Å
695	F	80.4	Confident	78.7	Confident	149 Å²	149	68 Å²	68	65%	0.654	31%	0.31	S	S	*	.			trans	-126.3	83.1	-176.4	-59.7	-75.3	0	0	0	110.6	T691 C692 V697 A698	T691-F695 PolarHBondContact O-N 3.38Å; C692-F695 WeakPolarHBondContact CA-O 3.41Å; C692-F695 CarbonylContact O-C 3.53Å; F695-V697 PolarHBondContact O-N 3.44Å; F695-V697 VanDerWaalsContact O-N 3.08Å; F695-A698 HydrophobicContact CB-CB 4.26Å; F695-A698 VanDerWaalsContact O-CB 3.26Å; F695-A698 WeakPolarHBondContact O-CB 3.25Å; F695-A698 PolarHBondContact O-N 3.3Å
696	P	76.1	Confident	78.7	Confident	11 Å²	11	71 Å²	71	7%	0.071	32%	0.317	C	S	.	.	H	α-helix	trans	-59.3	-25.9	-178.6	22.3	-33.6	0	0	0	113.2	C692 A698 G699 L700 V813 V816 Y817	C692-P696 VanDerWaalsContact O-CA 3.29Å; C692-P696 WeakPolarHBondContact O-CA 3.48Å; P696-A698 VanDerWaalsContact C-N 3.27Å; P696-A698 PolarHBondContact O-N 2.85Å; P696-G699 PolarHBondContact O-N 3.07Å; P696-G699 VanDerWaalsContact O-N 3.13Å; P696-L700 PolarHBondContact O-N 3.04Å; P696-V813 HydrophobicContact CB-CG1 4.3Å; P696-V813 HydrophobicContact CG-CG1 4.32Å; P696-V816 HydrophobicContact CB-CG1 4.19Å; P696-Y817 HydrophobicContact CG-CE2 3.91Å
697	V	77.2	Confident	78.5	Confident	81 Å²	81	66.8 Å²	66.8	49%	0.491	30%	0.297	S	S	.	.	H	α-helix	trans	-62.7	-32.4	175.3	-170.7	0	0	0	0	111.8	F695 G699 L700 F701	F695-V697 PolarHBondContact O-N 3.44Å; F695-V697 VanDerWaalsContact O-N 3.08Å; V697-G699 PolarHBondContact O-N 3.19Å; V697-L700 WeakPolarHBondContact O-CA 3.34Å; V697-L700 VanDerWaalsContact O-CB 3.3Å; V697-L700 WeakPolarHBondContact O-CB 3.21Å; V697-L700 PolarHBondContact O-N 3.17Å; V697-F701 HydrophobicContact CG1-CD2 3.86Å; V697-F701 HydrophobicContact CG1-CE2 3.57Å; V697-F701 VanDerWaalsContact O-CD2 3.29Å; V697-F701 WeakPolarHBondContact O-CD2 3.29Å; V697-F701 PolarHBondContact O-N 2.9Å
698	A	80.3	Confident	78.5	Confident	27 Å²	27	65 Å²	65	22%	0.223	29%	0.294	C	S	.	.	H	α-helix	trans	-60.5	-36.9	175.1	0	0	0	0	0	111.6	M688 F695 P696 L700 F701 Y702	M688-A698 HydrophobicContact CE-CB 4.33Å; M688-A698 WeakPolarHBondContact CE-O 3.43Å; F695-A698 HydrophobicContact CB-CB 4.26Å; F695-A698 VanDerWaalsContact O-CB 3.26Å; F695-A698 WeakPolarHBondContact O-CB 3.25Å; F695-A698 PolarHBondContact O-N 3.3Å; P696-A698 VanDerWaalsContact C-N 3.27Å; P696-A698 PolarHBondContact O-N 2.85Å; A698-L700 VanDerWaalsContact C-N 3.34Å; A698-F701 PolarHBondContact O-N 2.77Å; A698-Y702 PolarHBondContact O-N 3.4Å
699	G	76.7	Confident	78.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-39.1	174.6	0	0	0	0	0	112.2	C692 P696 V697 Y702 F703	C692-G699 WeakPolarHBondContact SG-CA 3.31Å; C692-G699 PolarHBondContact SG-N 3.12Å; P696-G699 PolarHBondContact O-N 3.07Å; P696-G699 VanDerWaalsContact O-N 3.13Å; V697-G699 PolarHBondContact O-N 3.19Å; G699-Y702 PolarHBondContact O-N 2.73Å; G699-F703 WeakPolarHBondContact O-CD2 3.2Å; G699-F703 PolarHBondContact O-N 2.74Å
700	L	77	Confident	77.9	Confident	25 Å²	25	68.9 Å²	68.9	13%	0.131	31%	0.312	C	S	.	.	H	α-helix	trans	-62.1	-47.8	175	-154.8	102.9	0	0	0	111.1	P696 V697 A698 Y702 F703 E704 R809 F812 V813	P696-L700 PolarHBondContact O-N 3.04Å; V697-L700 WeakPolarHBondContact O-CA 3.34Å; V697-L700 VanDerWaalsContact O-CB 3.3Å; V697-L700 WeakPolarHBondContact O-CB 3.21Å; V697-L700 PolarHBondContact O-N 3.17Å; A698-L700 VanDerWaalsContact C-N 3.34Å; L700-Y702 VanDerWaalsContact C-N 3.3Å; L700-Y702 PolarHBondContact O-N 3.38Å; L700-F703 PolarHBondContact O-N 3.23Å; L700-F703 VanDerWaalsContact O-N 3.15Å; L700-E704 WeakPolarHBondContact O-CG 3.48Å; L700-E704 PolarHBondContact O-N 2.79Å; L700-R809 HydrophobicContact CD1-CB 3.89Å; L700-R809 HydrophobicContact CD1-CG 4.15Å; L700-R809 HydrophobicContact CD2-CG 4.47Å; L700-F812 HydrophobicContact CD1-CD1 4.11Å; L700-V813 HydrophobicContact CD1-CG2 4.47Å
701	F	78.9	Confident	77.7	Confident	131 Å²	131	66.8 Å²	66.8	58%	0.575	31%	0.312	S	S	*	.	H	α-helix	trans	-59.7	-39.9	176.1	-80.5	-64.1	0	0	0	112.4	V697 A698 E704 Y705	V697-F701 HydrophobicContact CG1-CD2 3.86Å; V697-F701 HydrophobicContact CG1-CE2 3.57Å; V697-F701 VanDerWaalsContact O-CD2 3.29Å; V697-F701 WeakPolarHBondContact O-CD2 3.29Å; V697-F701 PolarHBondContact O-N 2.9Å; A698-F701 PolarHBondContact O-N 2.77Å; F701-E704 PolarHBondContact O-N 3.18Å; F701-Y705 WeakPolarHBondContact O-CB 3.31Å; F701-Y705 PolarHBondContact O-N 2.75Å
702	Y	78.6	Confident	77.5	Confident	52 Å²	52	71.5 Å²	71.5	20%	0.204	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-42.8	174.9	179.2	-95.1	0	0	0	112.3	L684 P685 M688 A698 G699 L700 Y705 R706	L684-Y702 HydrophobicContact CD2-CD1 3.55Å; L684-Y702 HydrophobicContact CD2-CE1 4.23Å; L684-Y702 HydrophobicContact CD2-CG 4.23Å; P685-Y702 HydrophobicContact CG-CE1 4.14Å; P685-Y702 HydrophobicContact CG-CE2 4.06Å; M688-Y702 HydrophobicContact CE-CD2 4.24Å; M688-Y702 HydrophobicContact CE-CG 4.26Å; M688-Y702 HydrophobicContact CG-CG 4.47Å; A698-Y702 PolarHBondContact O-N 3.4Å; G699-Y702 PolarHBondContact O-N 2.73Å; L700-Y702 VanDerWaalsContact C-N 3.3Å; L700-Y702 PolarHBondContact O-N 3.38Å; Y702-Y705 PolarHBondContact O-N 2.75Å; Y702-R706 WeakPolarHBondContact O-CB 3.32Å; Y702-R706 PolarHBondContact O-N 3.3Å
703	F	74.9	Confident	77.1	Confident	2 Å²	2	78 Å²	78	1%	0.009	35%	0.353	C	S	.	.	H	α-helix	trans	-64.3	-40.7	175.6	-79.9	-61.6	0	0	0	112	C683 L684 G699 L700 Y705 R706 T707 I794 Y795 M798 F812	C683-F703 HydrophobicContact CB-CE1 4.01Å; C683-F703 HydrophobicContact CB-CZ 3.53Å; L684-F703 HydrophobicContact CD1-CE2 4.48Å; L684-F703 HydrophobicContact CD2-CD2 4.13Å; L684-F703 HydrophobicContact CD2-CE2 3.45Å; L684-F703 VanDerWaalsContact CD2-CE2 3.45Å; L684-F703 HydrophobicContact CD2-CZ 3.75Å; L684-F703 HydrophobicContact CG-CE2 3.78Å; L684-F703 HydrophobicContact CG-CZ 3.94Å; G699-F703 WeakPolarHBondContact O-CD2 3.2Å; G699-F703 PolarHBondContact O-N 2.74Å; L700-F703 PolarHBondContact O-N 3.23Å; L700-F703 VanDerWaalsContact O-N 3.15Å; F703-Y705 VanDerWaalsContact C-N 3.35Å; F703-R706 PolarHBondContact O-N 2.81Å; F703-T707 WeakPolarHBondContact O-CG2 3.43Å; F703-T707 PolarHBondContact O-N 2.77Å; F703-T707 PolarHBondContact O-OG1 2.75Å; F703-I794 HydrophobicContact CD1-CG2 4.3Å; F703-Y795 HydrophobicContact CB-CE1 4.4Å; F703-Y795 WeakPolarHBondContact CB-OH 3.48Å; F703-M798 HydrophobicContact CD1-CE 3.49Å; F703-M798 VanDerWaalsContact CD1-CE 3.49Å; F703-M798 HydrophobicContact CD2-CE 4.31Å; F703-M798 HydrophobicContact CE1-CE 3.33Å; F703-M798 HydrophobicContact CE2-CE 4.2Å; F703-M798 HydrophobicContact CG-CE 4.01Å; F703-M798 HydrophobicContact CZ-CE 3.73Å; F703-M798 HydrophobicContact CZ-SD 4.44Å; F703-F812 HydrophobicContact CD2-CD2 4.34Å; F703-F812 HydrophobicContact CD2-CE1 4.45Å; F703-F812 AromaticContact CD2-CE2 3.74Å; F703-F812 HydrophobicContact CD2-CE2 3.74Å; F703-F812 AromaticContact CD2-CZ 3.82Å; F703-F812 HydrophobicContact CD2-CZ 3.82Å; F703-F812 HydrophobicContact CE2-CD2 4.14Å; F703-F812 HydrophobicContact CE2-CE1 4.45Å; F703-F812 AromaticContact CE2-CE2 3.22Å; F703-F812 HydrophobicContact CE2-CE2 3.22Å; F703-F812 AromaticContact CE2-CZ 3.44Å; F703-F812 HydrophobicContact CE2-CZ 3.44Å; F703-F812 VanDerWaalsContact CE2-CZ 3.44Å; F703-F812 HydrophobicContact CZ-CE2 4.16Å
704	E	77.6	Confident	76.8	Confident	40 Å²	40	77.5 Å²	77.5	19%	0.187	35%	0.354	C	S	.	.	H	α-helix	trans	-63.7	-39.6	174.4	-70.2	-165.3	160.9	0	0	112.6	L700 F701 T707 K708 R809	L700-E704 WeakPolarHBondContact O-CG 3.48Å; L700-E704 PolarHBondContact O-N 2.79Å; F701-E704 PolarHBondContact O-N 3.18Å; E704-T707 WeakPolarHBondContact CA-OG1 3.43Å; E704-T707 PolarHBondContact O-OG1 3.45Å; E704-K708 WeakPolarHBondContact O-CB 3.34Å; E704-K708 VanDerWaalsContact O-CG 3.26Å; E704-K708 WeakPolarHBondContact O-CG 2.97Å; E704-K708 PolarHBondContact O-N 3.27Å; E704-K708 VanDerWaalsContact O-N 3.08Å; E704-R809 IonicContact OE1-CZ 2.83Å; E704-R809 IonicContact OE1-NE 2.79Å; E704-R809 IonicContact OE1-NH1 3.39Å; E704-R809 IonicContact OE1-NH2 3.52Å; E704-R809 PolarHBondContact OE1-NH2 3.48Å
705	Y	79.3	Confident	76.7	Confident	144 Å²	144	77.4 Å²	77.4	57%	0.565	36%	0.355	S	S	*	.	H	α-helix	trans	-63.1	-43.5	173.6	174.9	-106.4	0	0	0	111.4	F701 Y702 F703 K708 K709	F701-Y705 WeakPolarHBondContact O-CB 3.31Å; F701-Y705 PolarHBondContact O-N 2.75Å; Y702-Y705 PolarHBondContact O-N 2.75Å; F703-Y705 VanDerWaalsContact C-N 3.35Å; Y705-K708 PolarHBondContact O-N 3.14Å; Y705-K709 PolarHBondContact O-N 3.45Å
706	R	76.3	Confident	76.5	Confident	99 Å²	99	75.3 Å²	75.3	37%	0.374	35%	0.35	S	S	.	.	H	α-helix	trans	-67.5	-42.2	179.9	-168.5	179.6	177.6	167.4	4.5	112.3	Y702 F703 K709 E710 I794	Y702-R706 WeakPolarHBondContact O-CB 3.32Å; Y702-R706 PolarHBondContact O-N 3.3Å; F703-R706 PolarHBondContact O-N 2.81Å; R706-K709 PolarHBondContact O-N 2.62Å; R706-E710 IonicContact NE-OE1 2.59Å; R706-E710 PolarHBondContact O-N 3.4Å; R706-I794 HydrophobicContact CB-CD1 4.16Å; R706-I794 HydrophobicContact CG-CD1 3.72Å
707	T	73.9	Confident	76.4	Confident	36 Å²	36	79.7 Å²	79.7	22%	0.221	37%	0.372	C	S	.	.	H	α-helix	trans	-63.4	-43.1	175.8	52	0	0	0	0	111.2	F703 E704 K709 E710 L711 I794 Y795	F703-T707 WeakPolarHBondContact O-CG2 3.43Å; F703-T707 PolarHBondContact O-N 2.77Å; F703-T707 PolarHBondContact O-OG1 2.75Å; E704-T707 WeakPolarHBondContact CA-OG1 3.43Å; E704-T707 PolarHBondContact O-OG1 3.45Å; T707-K709 VanDerWaalsContact C-N 3.31Å; T707-K709 PolarHBondContact O-N 2.8Å; T707-E710 PolarHBondContact O-N 2.91Å; T707-L711 WeakPolarHBondContact O-CB 3.44Å; T707-L711 PolarHBondContact O-N 3.36Å; T707-I794 HydrophobicContact CG2-CB 3.75Å; T707-I794 HydrophobicContact CG2-CD1 3.75Å; T707-I794 HydrophobicContact CG2-CG1 3.85Å; T707-Y795 HydrophobicContact CG2-CD2 4.09Å; T707-Y795 HydrophobicContact CG2-CE2 4.04Å
708	K	77.1	Confident	76.1	Confident	131 Å²	131	83.3 Å²	83.3	57%	0.57	38%	0.376	S	S	*	.	H	α-helix	trans	-59.4	-41.1	174.3	-75.1	175.4	-179.3	178.2	0	111.8	E704 Y705 L711 K712	E704-K708 WeakPolarHBondContact O-CB 3.34Å; E704-K708 VanDerWaalsContact O-CG 3.26Å; E704-K708 WeakPolarHBondContact O-CG 2.97Å; E704-K708 PolarHBondContact O-N 3.27Å; E704-K708 VanDerWaalsContact O-N 3.08Å; Y705-K708 PolarHBondContact O-N 3.14Å; K708-L711 PolarHBondContact O-N 2.91Å; K708-K712 WeakPolarHBondContact O-CG 3.23Å; K708-K712 PolarHBondContact O-N 2.76Å
709	K	76.4	Confident	75.8	Confident	99 Å²	99	85 Å²	85	43%	0.43	39%	0.387	S	S	.	.	H	α-helix	trans	-67.9	-41.3	177.5	-170.8	174.4	-178.8	173.6	0	112.6	Y705 R706 T707 R713	Y705-K709 PolarHBondContact O-N 3.45Å; R706-K709 PolarHBondContact O-N 2.62Å; T707-K709 VanDerWaalsContact C-N 3.31Å; T707-K709 PolarHBondContact O-N 2.8Å; K709-R713 WeakPolarHBondContact O-CG 3.09Å; K709-R713 PolarHBondContact O-N 3.28Å
710	E	74.8	Confident	75.6	Confident	54 Å²	54	89.7 Å²	89.7	25%	0.252	41%	0.411	S	S	.	.	H	α-helix	trans	-66	-40.2	174.8	-75.5	-167.8	-168.2	0	0	111.7	R706 T707 R713 A714 I794 R797	R706-E710 IonicContact NE-OE1 2.59Å; R706-E710 PolarHBondContact O-N 3.4Å; T707-E710 PolarHBondContact O-N 2.91Å; E710-R713 PolarHBondContact O-N 3.03Å; E710-A714 WeakPolarHBondContact O-CB 3.43Å; E710-A714 PolarHBondContact O-N 3.25Å; E710-I794 HydrophobicContact CG-CD1 4.37Å; E710-R797 IonicContact OE2-CZ 3.88Å; E710-R797 IonicContact OE2-NH2 2.98Å; E710-R797 PolarHBondContact OE2-NH2 3.44Å
711	L	75.9	Confident	75.2	Confident	116 Å²	116	92.4 Å²	92.4	61%	0.607	43%	0.429	S	S	*	.	H	α-helix	trans	-60.9	-48.7	176.3	-168.3	81.8	0	0	0	111.4	T707 K708 R713 A714 E715	T707-L711 WeakPolarHBondContact O-CB 3.44Å; T707-L711 PolarHBondContact O-N 3.36Å; K708-L711 PolarHBondContact O-N 2.91Å; L711-R713 VanDerWaalsContact C-N 3.28Å; L711-R713 PolarHBondContact O-N 3.25Å; L711-A714 PolarHBondContact O-N 2.75Å; L711-A714 VanDerWaalsContact O-N 3.16Å; L711-E715 WeakPolarHBondContact O-CB 3.29Å; L711-E715 PolarHBondContact O-N 3.41Å
712	K	76.2	Confident	74.4	Confident	150 Å²	150	88.9 Å²	88.9	65%	0.652	42%	0.424	S	S	*	.	H	α-helix	trans	-58.9	-38.2	176.7	-74.1	-179	179	-169	0	112.6	K708 L716	K708-K712 WeakPolarHBondContact O-CG 3.23Å; K708-K712 PolarHBondContact O-N 2.76Å; K712-L716 WeakPolarHBondContact O-CB 3.49Å; K712-L716 PolarHBondContact O-N 3.42Å
713	R	73.6	Confident	73.5	Confident	136 Å²	136	90.1 Å²	90.1	51%	0.513	44%	0.44	S	S	.	.	H	α-helix	trans	-68.5	-42.4	175.5	-75.5	177.6	174.5	-176.6	-5	112.1	K709 E710 L711 E715 L716 I717	K709-R713 WeakPolarHBondContact O-CG 3.09Å; K709-R713 PolarHBondContact O-N 3.28Å; E710-R713 PolarHBondContact O-N 3.03Å; L711-R713 VanDerWaalsContact C-N 3.28Å; L711-R713 PolarHBondContact O-N 3.25Å; R713-E715 VanDerWaalsContact C-N 3.32Å; R713-L716 PolarHBondContact O-N 3.45Å; R713-I717 VanDerWaalsContact O-CG1 3.3Å; R713-I717 WeakPolarHBondContact O-CG1 3.36Å; R713-I717 PolarHBondContact O-N 2.91Å
714	A	72.2	Confident	72.4	Confident	16 Å²	16	94.1 Å²	94.1	13%	0.132	47%	0.473	C	S	.	.	H	α-helix	trans	-64.2	-39.9	177.1	0	0	0	0	0	111.5	E710 L711 I717 R718 H791	E710-A714 WeakPolarHBondContact O-CB 3.43Å; E710-A714 PolarHBondContact O-N 3.25Å; L711-A714 PolarHBondContact O-N 2.75Å; L711-A714 VanDerWaalsContact O-N 3.16Å; A714-I717 PolarHBondContact O-N 2.85Å; A714-R718 WeakPolarHBondContact O-CB 3.31Å; A714-R718 PolarHBondContact O-N 2.88Å; A714-H791 HydrophobicContact CB-CB 4.5Å
715	E	78.1	Confident	70.9	Confident	126 Å²	126	96.2 Å²	96.2	59%	0.589	50%	0.498	S	S	*	.	H	α-helix	trans	-66.4	-42.2	176.3	-169.3	169.2	-159.8	0	0	112.2	L711 R713 I717 R718 S719	L711-E715 WeakPolarHBondContact O-CB 3.29Å; L711-E715 PolarHBondContact O-N 3.41Å; R713-E715 VanDerWaalsContact C-N 3.32Å; E715-I717 VanDerWaalsContact C-N 3.35Å; E715-I717 PolarHBondContact O-N 3.43Å; E715-R718 CarbonylContact O-C 3.25Å; E715-R718 WeakPolarHBondContact O-CB 3.39Å; E715-R718 PolarHBondContact O-N 3.01Å; E715-R718 VanDerWaalsContact O-N 3.12Å; E715-S719 PolarHBondContact O-N 3.46Å; E715-S719 PolarHBondContact O-OG 3.43Å
716	L	76	Confident	69.2	Low	105 Å²	105	93.5 Å²	93.5	55%	0.55	50%	0.5	S	S	.	.	H	α-helix	trans	-58.5	-44.3	171.7	-173.6	86.4	0	0	0	111.9	K712 R713 R718 S719 I720	K712-L716 WeakPolarHBondContact O-CB 3.49Å; K712-L716 PolarHBondContact O-N 3.42Å; R713-L716 PolarHBondContact O-N 3.45Å; L716-R718 VanDerWaalsContact C-N 3.27Å; L716-R718 PolarHBondContact O-N 2.7Å; L716-S719 PolarHBondContact O-N 3.49Å; L716-S719 PolarHBondContact O-OG 3.27Å; L716-I720 HydrophobicContact CD2-CD1 4.4Å; L716-I720 HydrophobicContact CG-CD1 4.06Å; L716-I720 WeakPolarHBondContact O-CD1 3.43Å; L716-I720 VanDerWaalsContact O-CG1 3.23Å; L716-I720 WeakPolarHBondContact O-CG1 3.48Å; L716-I720 PolarHBondContact O-N 3.32Å
717	I	72.4	Confident	67.2	Low	103 Å²	103	92.6 Å²	92.6	53%	0.528	52%	0.521	S	S	.	.	H	α-helix	trans	-63.9	-38.5	176.7	-67.6	164.4	0	0	0	110.1	R713 A714 E715 I720 T721	R713-I717 VanDerWaalsContact O-CG1 3.3Å; R713-I717 WeakPolarHBondContact O-CG1 3.36Å; R713-I717 PolarHBondContact O-N 2.91Å; A714-I717 PolarHBondContact O-N 2.85Å; E715-I717 VanDerWaalsContact C-N 3.35Å; E715-I717 PolarHBondContact O-N 3.43Å; I717-I720 PolarHBondContact O-N 3.49Å; I717-T721 WeakPolarHBondContact O-CG2 3.48Å; I717-T721 PolarHBondContact O-N 3.02Å; I717-T721 PolarHBondContact O-OG1 2.93Å; I717-T721 VanDerWaalsContact O-OG1 3.06Å
718	R	72.3	Confident	65.2	Low	157 Å²	157	94 Å²	94	59%	0.592	54%	0.542	S	S	*	.	H	α-helix	trans	-68.5	-36.5	179	-146.4	-179.6	-150.2	155.6	2.6	112.8	A714 E715 L716 T721 A722	A714-R718 WeakPolarHBondContact O-CB 3.31Å; A714-R718 PolarHBondContact O-N 2.88Å; E715-R718 CarbonylContact O-C 3.25Å; E715-R718 WeakPolarHBondContact O-CB 3.39Å; E715-R718 PolarHBondContact O-N 3.01Å; E715-R718 VanDerWaalsContact O-N 3.12Å; L716-R718 VanDerWaalsContact C-N 3.27Å; L716-R718 PolarHBondContact O-N 2.7Å; R718-T721 WeakPolarHBondContact CA-OG1 3.43Å; R718-T721 PolarHBondContact O-OG1 2.97Å; R718-T721 VanDerWaalsContact O-OG1 3.09Å; R718-A722 WeakPolarHBondContact O-CB 3.34Å; R718-A722 PolarHBondContact O-N 2.83Å
719	S	74.4	Confident	63.1	Low	63 Å²	63	98.1 Å²	98.1	44%	0.441	56%	0.56	S	S	.	*	H	α-helix	trans	-72.1	-37.3	176	65.3	0	0	0	0	111.8	E715 L716 A722 S723	E715-S719 PolarHBondContact O-N 3.46Å; E715-S719 PolarHBondContact O-OG 3.43Å; L716-S719 PolarHBondContact O-N 3.49Å; L716-S719 PolarHBondContact O-OG 3.27Å; S719-A722 PolarHBondContact O-N 3.3Å; S719-S723 WeakPolarHBondContact O-CB 3.21Å; S719-S723 PolarHBondContact O-N 3.22Å; S719-S723 PolarHBondContact O-OG 3.37Å
720	I	70.9	Confident	60.9	Low	99 Å²	99	99.7 Å²	99.7	51%	0.508	58%	0.578	S	S	.	*	H	α-helix	trans	-64.3	-43.4	173	-67.1	166.3	0	0	0	110.6	L716 I717 S723 A724	L716-I720 HydrophobicContact CD2-CD1 4.4Å; L716-I720 HydrophobicContact CG-CD1 4.06Å; L716-I720 WeakPolarHBondContact O-CD1 3.43Å; L716-I720 VanDerWaalsContact O-CG1 3.23Å; L716-I720 WeakPolarHBondContact O-CG1 3.48Å; L716-I720 PolarHBondContact O-N 3.32Å; I717-I720 PolarHBondContact O-N 3.49Å; I720-S723 PolarHBondContact O-OG 3.2Å; I720-A724 WeakPolarHBondContact O-CB 3.39Å; I720-A724 PolarHBondContact O-N 2.81Å; I720-A724 VanDerWaalsContact O-N 3.14Å
721	T	70.2	Confident	58.7	Low	82 Å²	82	103.1 Å²	103.1	50%	0.503	60%	0.602	S	S	.	*	H	α-helix	trans	-71.9	-33.8	177.6	53.3	0	0	0	0	113	I717 R718 A725	I717-T721 WeakPolarHBondContact O-CG2 3.48Å; I717-T721 PolarHBondContact O-N 3.02Å; I717-T721 PolarHBondContact O-OG1 2.93Å; I717-T721 VanDerWaalsContact O-OG1 3.06Å; R718-T721 WeakPolarHBondContact CA-OG1 3.43Å; R718-T721 PolarHBondContact O-OG1 2.97Å; R718-T721 VanDerWaalsContact O-OG1 3.09Å; T721-A725 WeakPolarHBondContact O-CB 3.27Å; T721-A725 PolarHBondContact O-N 3.07Å
722	A	62.3	Low	56.9	Low	57 Å²	57	102.9 Å²	102.9	47%	0.471	61%	0.608	S	S	.	*	H	α-helix	trans	-68.6	-43.1	175.7	0	0	0	0	0	112.2	R718 S719 A724 A725 S726	R718-A722 WeakPolarHBondContact O-CB 3.34Å; R718-A722 PolarHBondContact O-N 2.83Å; S719-A722 PolarHBondContact O-N 3.3Å; A722-A724 VanDerWaalsContact C-N 3.34Å; A722-A724 PolarHBondContact O-N 3.5Å; A722-A725 PolarHBondContact O-N 3.36Å; A722-A725 VanDerWaalsContact O-N 3.13Å; A722-S726 PolarHBondContact O-N 3.38Å; A722-S726 VanDerWaalsContact O-N 3.13Å; A722-S726 PolarHBondContact O-OG 3.28Å
723	S	57.9	Low	54.5	Low	77 Å²	77	103 Å²	103	54%	0.538	62%	0.616	S	S	.	*	H	α-helix	trans	-67	-33.3	177.3	53.1	0	0	0	0	112.9	S719 I720 A725	S719-S723 WeakPolarHBondContact O-CB 3.21Å; S719-S723 PolarHBondContact O-N 3.22Å; S719-S723 PolarHBondContact O-OG 3.37Å; I720-S723 PolarHBondContact O-OG 3.2Å; S723-A725 VanDerWaalsContact C-N 3.28Å; S723-A725 PolarHBondContact O-N 3.09Å
724	A	52.4	Low	52.3	Low	86 Å²	86	104.5 Å²	104.5	71%	0.711	63%	0.633	S	S	*	*	H	α-helix	trans	-68.9	-25	172.1	0	0	0	0	0	113.2	I720 A722	I720-A724 WeakPolarHBondContact O-CB 3.39Å; I720-A724 PolarHBondContact O-N 2.81Å; I720-A724 VanDerWaalsContact O-N 3.14Å; A722-A724 VanDerWaalsContact C-N 3.34Å; A722-A724 PolarHBondContact O-N 3.5Å
725	A	45.6	Very low	50	Low	85 Å²	85	111.3 Å²	111.3	70%	0.702	67%	0.667	S	S	*	*	H	α-helix	trans	-88.1	-29.2	-177.8	0	0	0	0	0	113.6	T721 A722 S723 G727	T721-A725 WeakPolarHBondContact O-CB 3.27Å; T721-A725 PolarHBondContact O-N 3.07Å; A722-A725 PolarHBondContact O-N 3.36Å; A722-A725 VanDerWaalsContact O-N 3.13Å; S723-A725 VanDerWaalsContact C-N 3.28Å; S723-A725 PolarHBondContact O-N 3.09Å; A725-G727 PolarHBondContact O-N 3.16Å
726	S	43.5	Very low	47.5	Very low	87 Å²	87	109.9 Å²	109.9	61%	0.608	67%	0.671	S	S	*	*	S	Bend	trans	-89.9	87.7	176.7	61.1	0	0	0	0	110.7	A722	A722-S726 PolarHBondContact O-N 3.38Å; A722-S726 VanDerWaalsContact O-N 3.13Å; A722-S726 PolarHBondContact O-OG 3.28Å
727	G	35	Very low	45.1	Very low	80 Å²	80	112 Å²	112	83%	0.825	68%	0.682	S	S	*	*			trans	-56.6	146	176	0	0	0	0	0	113.7	A725	A725-G727 PolarHBondContact O-N 3.16Å
728	G	32.9	Very low	42.8	Very low	64 Å²	64	111.4 Å²	111.4	66%	0.66	69%	0.687	S	S	*	*			trans	-164.3	112	168.1	0	0	0	0	0	109.5	V730	G728-V730 PolarHBondContact O-N 3.17Å
729	K	31.2	Very low	40.5	Very low	218 Å²	218	109.8 Å²	109.8	95%	0.948	70%	0.695	S	S	*	*			trans	-51.5	117.1	175.1	-75.4	171.4	172.1	176.3	0	110
730	V	31	Very low	38.1	Very low	133 Å²	133	112.2 Å²	112.2	81%	0.806	71%	0.712	S	S	*	*			trans	-119.4	107.4	167.1	-177.5	0	0	0	0	107.8	G728	G728-V730 PolarHBondContact O-N 3.17Å
731	T	28	Very low	35.8	Very low	125 Å²	125	118.1 Å²	118.1	77%	0.767	73%	0.728	S	S	*	*			trans	-59.1	135	170.3	38.2	0	0	0	0	110.5
732	P	38.7	Very low	33.7	Very low	112 Å²	112	119.8 Å²	119.8	73%	0.727	74%	0.738	S	S	*	*			trans	-85.7	117.1	-179.5	33.2	-27.2	0	0	0	108.2
733	N	25.4	Very low	31.9	Very low	152 Å²	152	124.1 Å²	124.1	81%	0.813	75%	0.753	S	S	*	*			trans	179.8	102.7	156.4	-89.8	-18	0	0	0	109.4
734	L	27.9	Very low	30.3	Very low	167 Å²	167	125.9 Å²	125.9	87%	0.874	76%	0.76	S	S	*	*				-161	100.3	129.4	-133.8	88.6	0	0	0	109
735	L	24.7	Very low	28.9	Very low	160 Å²	160	132.3 Å²	132.3	84%	0.838	77%	0.773	S	S	*	*			trans	-71.1	162.4	152.1	-80.4	151.9	0	0	0	109
736	S	24.9	Very low	27.9	Very low	96 Å²	96	133.2 Å²	133.2	67%	0.671	77%	0.773	S	S	*	*			trans	82.3	132.3	-178.8	77.5	0	0	0	0	114.2
737	D	24.8	Very low	27	Very low	149 Å²	149	134.1 Å²	134.1	80%	0.797	78%	0.78	S	S	*	*			cis	-162.4	148.9	12.6	-127.6	-19.2	0	0	0	112.2
738	S	24.3	Very low	26.4	Very low	91 Å²	91	134.2 Å²	134.2	64%	0.636	78%	0.781	S	S	*	*			trans	61.1	113.3	145.1	70.4	0	0	0	0	123.7
739	T	24	Very low	26	Very low	123 Å²	123	138.9 Å²	138.9	76%	0.755	79%	0.785	S	S	*	*				84.1	113.7	122.8	54.3	0	0	0	0	123.8
740	S	23.8	Very low	25.6	Very low	113 Å²	113	135.6 Å²	135.6	79%	0.79	78%	0.776	S	S	*	*			trans	71.3	132.3	144.6	76	0	0	0	0	117.1
741	R	23.4	Very low	25.2	Very low	224 Å²	224	136.3 Å²	136.3	85%	0.845	77%	0.774	S	S	*	*			cis	-167.3	137.8	31.9	-134	168.5	179.7	170.5	-0.8	109.3
742	T	25.3	Very low	25	Very low	117 Å²	117	136.4 Å²	136.4	72%	0.718	77%	0.774	S	S	*	*			trans	63.3	90.6	148.4	54.8	0	0	0	0	121
743	D	24.6	Very low	24.2	Very low	147 Å²	147	140.7 Å²	140.7	79%	0.786	78%	0.782	S	S	*	*				44.8	104.2	112.9	-59.6	-31.7	0	0	0	119.7
744	V	25	Very low	24.3	Very low	114 Å²	114	140 Å²	140	69%	0.691	78%	0.783	S	S	*	*				84.5	100.4	76	174.5	0	0	0	0	113.1
745	K	23.5	Very low	24.2	Very low	222 Å²	222	139.5 Å²	139.5	97%	0.965	77%	0.774	S	S	*	*			trans	-136.8	82.5	145	-83.1	-172.6	178.5	175.1	0	108.2
746	S	24.8	Very low	24.4	Very low	103 Å²	103	138 Å²	138	72%	0.72	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-90.8	123.3	177.9	51.6	0	0	0	0	111.5
747	S	23	Very low	24.5	Very low	107 Å²	107	138.1 Å²	138.1	75%	0.748	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-65.2	123.7	164.5	49.7	0	0	0	0	112.4
748	G	23.1	Very low	24.5	Very low	81 Å²	81	137.5 Å²	137.5	84%	0.835	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-88.6	120.6	166	0	0	0	0	0	111.2
749	H	23.8	Very low	24.6	Very low	163 Å²	163	137.8 Å²	137.8	76%	0.755	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-100.2	119.3	-172.4	-129	-67.2	0	0	0	110.7
750	I	23.5	Very low	24.6	Very low	148 Å²	148	139.9 Å²	139.9	76%	0.759	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-81	133.2	177.6	-66.4	169.2	0	0	0	110.8
751	I	23.5	Very low	24.7	Very low	148 Å²	148	142 Å²	142	76%	0.759	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-76.8	121.5	-179.5	-64.4	168	0	0	0	110.3	K753	I751-K753 HydrophobicContact CG2-CG 4.48Å
752	T	22.4	Very low	24.8	Very low	127 Å²	127	137.5 Å²	137.5	78%	0.779	78%	0.782	S	S	*	*			trans	-115.5	118.6	167.7	30.1	0	0	0	0	109.2
753	K	23.3	Very low	24.7	Very low	203 Å²	203	139.5 Å²	139.5	88%	0.883	79%	0.789	S	S	*	*			trans	-79.4	146.5	-175.7	-75.4	179.6	175.6	176.4	0	112.3	I751	I751-K753 HydrophobicContact CG2-CG 4.48Å
754	V	27.1	Very low	24.7	Very low	137 Å²	137	139.6 Å²	139.6	83%	0.83	79%	0.789	S	S	*	*			trans	-108.1	148.9	-165.2	169.5	0	0	0	0	111.7
755	F	25.4	Very low	24.8	Very low	157 Å²	157	140 Å²	140	69%	0.689	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-67.2	151.4	-178.8	-72.6	-95.3	0	0	0	115.9	P630	P630-F755 HydrophobicContact CB-CZ 4.09Å; P630-F755 HydrophobicContact CG-CE1 3.82Å; P630-F755 HydrophobicContact CG-CZ 3.78Å
756	P	28.4	Very low	24.8	Very low	128 Å²	128	137.4 Å²	137.4	83%	0.831	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-93.7	139.2	165.8	34.6	-27.3	0	0	0	112.4
757	A	27	Very low	24.9	Very low	98 Å²	98	139 Å²	139	81%	0.81	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-93.5	143.6	-178.1	0	0	0	0	0	112.7
758	T	25.3	Very low	24.9	Very low	136 Å²	136	139.9 Å²	139.9	83%	0.834	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-82.2	140	169.5	32.6	0	0	0	0	111.4
759	P	27.3	Very low	24.9	Very low	98 Å²	98	145.5 Å²	145.5	64%	0.636	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-89	123.7	-161	32.4	-32.2	0	0	0	114
760	Q	24.1	Very low	24.8	Very low	167 Å²	167	148.6 Å²	148.6	78%	0.78	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-80.6	142.3	162.3	-66.1	-177.9	-10.7	0	0	111.2	K789	Q760-K789 PolarHBondContact O-NZ 3.32Å
761	L	25.4	Very low	24.7	Very low	156 Å²	156	148.2 Å²	148.2	82%	0.817	81%	0.807	S	S	*	*			trans	-116.2	144.1	173.5	-160.6	79.1	0	0	0	109.5
762	T	25	Very low	24.7	Very low	131 Å²	131	150.7 Å²	150.7	80%	0.804	81%	0.812	S	S	*	*			trans	-84.4	139	-156.8	44.2	0	0	0	0	115.2
763	N	23.5	Very low	24.7	Very low	159 Å²	159	151.1 Å²	151.1	85%	0.85	82%	0.815	S	S	*	*			trans	-78.7	128	167.4	-69.4	-29.2	0	0	0	110.4
764	N	25.2	Very low	24.8	Very low	148 Å²	148	148.4 Å²	148.4	79%	0.791	82%	0.816	S	S	*	*			trans	-129.2	128.8	150.7	-97.1	-12.8	0	0	0	108.2	L766	N764-L766 PolarHBondContact O-N 2.91Å
765	P	26.5	Very low	24.6	Very low	123 Å²	123	151.3 Å²	151.3	80%	0.799	82%	0.817	S	S	*	*			trans	-77	114.9	-171	30.4	-31.9	0	0	0	110.5	V767	P765-V767 PolarHBondContact O-N 3.29Å
766	L	24.1	Very low	24.5	Very low	168 Å²	168	149.6 Å²	149.6	88%	0.88	82%	0.819	S	S	*	*			trans	-66.4	115	176.7	-85.4	144.9	0	0	0	111.1	N764 T768	N764-L766 PolarHBondContact O-N 2.91Å; L766-T768 PolarHBondContact O-N 3.48Å
767	V	25.6	Very low	24.3	Very low	136 Å²	136	152.6 Å²	152.6	82%	0.824	82%	0.822	S	S	*	*			trans	-59.8	120.3	155	170.9	0	0	0	0	108	P765 K769	P765-V767 PolarHBondContact O-N 3.29Å; V767-K769 PolarHBondContact O-N 3.23Å
768	T	23.9	Very low	24.1	Very low	125 Å²	125	155.1 Å²	155.1	77%	0.767	82%	0.822	S	S	*	*			trans	-59.4	121.9	171.9	24.9	0	0	0	0	111.2	L766	L766-T768 PolarHBondContact O-N 3.48Å
769	K	22.9	Very low	24.1	Very low	199 Å²	199	155 Å²	155	87%	0.865	82%	0.822	S	S	*	*			trans	-176.4	127.7	133.1	-102.2	162.9	-175.1	-179.8	0	113.8	V767	V767-K769 PolarHBondContact O-N 3.23Å
770	R	21.5	Very low	23.8	Very low	229 Å²	229	158.3 Å²	158.3	86%	0.864	83%	0.832	S	S	*	*			trans	63.1	96.8	150.8	-81.3	-179.9	169.1	170.9	-3.4	119.4	K772	R770-K772 PolarHBondContact O-N 2.83Å
771	T	21.5	Very low	23.9	Very low	139 Å²	139	155.9 Å²	155.9	85%	0.853	83%	0.833	S	S	*	*			trans	-23.3	114.1	133.5	29.6	0	0	0	0	114.6
772	K	23.1	Very low	23.8	Very low	200 Å²	200	154.3 Å²	154.3	87%	0.87	83%	0.83	S	S	*	*			trans	-142.8	132.9	138.6	-87.5	-168.8	179	179.4	0	109.5	R770	R770-K772 PolarHBondContact O-N 2.83Å
773	T	22.9	Very low	23.8	Very low	136 Å²	136	157 Å²	157	83%	0.834	83%	0.833	S	S	*	*			trans	-60.4	131.5	-178.1	44.2	0	0	0	0	113.7
774	T	25.7	Very low	23.9	Very low	147 Å²	147	154.8 Å²	154.8	90%	0.902	83%	0.83	S	S	*	*			trans	-151.5	133.1	151.4	-2.5	0	0	0	0	111
775	K	22.4	Very low	24	Very low	198 Å²	198	153.3 Å²	153.3	86%	0.861	83%	0.832	S	S	*	*			trans	-67.1	135.8	-173.7	-73.4	170.3	170.5	177	0	112.1
776	V	23.6	Very low	24.1	Very low	121 Å²	121	154.7 Å²	154.7	73%	0.733	83%	0.827	S	S	*	*			trans	26.6	111.4	133.8	-171.6	0	0	0	0	117.1
777	Q	23.9	Very low	24.3	Very low	191 Å²	191	149.4 Å²	149.4	89%	0.893	81%	0.813	S	S	*	*			trans	-151.8	120.1	138.8	-114.7	160	-7.4	0	0	110.6
778	N	22.3	Very low	24.8	Very low	151 Å²	151	148.7 Å²	148.7	81%	0.807	81%	0.811	S	S	*	*			trans	-65.6	126.1	179.6	-71.4	-28.7	0	0	0	111
779	T	25.2	Very low	25.4	Very low	134 Å²	134	147.7 Å²	147.7	82%	0.822	80%	0.796	S	S	*	*			trans	-136.7	120	152.6	37.7	0	0	0	0	109.4	S781	T779-S781 PolarHBondContact O-N 3.22Å
780	I	22.4	Very low	26.3	Very low	166 Å²	166	143.1 Å²	143.1	85%	0.851	79%	0.787	S	S	*	*			trans	-67.4	111.5	177.5	-65.1	161	0	0	0	107.1
781	S	25.3	Very low	27.4	Very low	116 Å²	116	138.9 Å²	138.9	81%	0.811	78%	0.777	S	S	*	*			trans	-102.8	115.9	171.6	47.8	0	0	0	0	109.8	T779	T779-S781 PolarHBondContact O-N 3.22Å
782	V	24.3	Very low	28.9	Very low	124 Å²	124	135.3 Å²	135.3	75%	0.752	75%	0.754	S	S	*	*			trans	-66.5	125.7	179.2	171.6	0	0	0	0	110	S784	V782-S784 PolarHBondContact O-N 3.39Å
783	H	24.3	Very low	30.4	Very low	187 Å²	187	127.6 Å²	127.6	87%	0.866	73%	0.731	S	S	*	*			trans	10.1	98.6	159.7	-71.4	-76.7	0	0	0	117.9
784	S	25.1	Very low	32.2	Very low	113 Å²	113	121.9 Å²	121.9	79%	0.79	70%	0.696	S	S	*	*			trans	-82.1	126.5	155.3	65.3	0	0	0	0	110.1	V782 Q786	V782-S784 PolarHBondContact O-N 3.39Å; S784-Q786 PolarHBondContact O-N 2.77Å
785	S	27	Very low	33.8	Very low	117 Å²	117	116.7 Å²	116.7	82%	0.818	66%	0.66	S	S	*	*			trans	-55.3	115.1	177.8	50.4	0	0	0	0	112.1	G787	S785-G787 PolarHBondContact O-N 2.94Å
786	Q	29.5	Very low	35.5	Very low	152 Å²	152	112.3 Å²	112.3	71%	0.71	64%	0.642	S	S	*	*			trans	-69.1	112.7	170.1	-73	-176.3	-2.2	0	0	109.7	S784	S784-Q786 PolarHBondContact O-N 2.77Å
787	G	28.8	Very low	37.3	Very low	56 Å²	56	112.2 Å²	112.2	58%	0.577	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-61.2	159.8	171.4	0	0	0	0	0	113	S785 K789	S785-G787 PolarHBondContact O-N 2.94Å; G787-K789 PolarHBondContact O-N 3.1Å
788	P	36.3	Very low	38.9	Very low	121 Å²	121	103.5 Å²	103.5	79%	0.786	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-66.1	127.4	-170.9	25.6	-32.6	0	0	0	112.2
789	K	34.9	Very low	40.7	Very low	105 Å²	105	97.3 Å²	97.3	46%	0.457	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-66.5	139.7	-179.7	-62.7	-172.5	-178.5	-162.3	0	111.4	Q760 G787	Q760-K789 PolarHBondContact O-NZ 3.32Å; G787-K789 PolarHBondContact O-N 3.1Å
790	P	43.5	Very low	42.2	Very low	102 Å²	102	96.4 Å²	96.4	66%	0.662	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-66.5	146.3	-179	26.5	-33.1	0	0	0	112.4	V792	P790-V792 PolarHBondContact O-N 3.27Å
791	H	43.4	Very low	43.9	Very low	141 Å²	141	93.9 Å²	93.9	65%	0.653	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-64.5	119.6	179.9	-117.2	-88.1	0	0	0	111.3	A714	A714-H791 HydrophobicContact CB-CB 4.5Å
792	V	52.3	Low	45.6	Very low	63 Å²	63	92.1 Å²	92.1	38%	0.382	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-76.3	124	177.5	-179.7	0	0	0	0	110.5	P790 E796 R797	P790-V792 PolarHBondContact O-N 3.27Å; V792-E796 HydrophobicContact CG1-CB 3.84Å; V792-E796 HydrophobicContact CG1-CG 3.95Å; V792-R797 HydrophobicContact CG1-CG 4.11Å; V792-R797 PolarHBondContact O-NE 3.05Å; V792-R797 PolarHBondContact O-NH2 3.14Å
793	G	54.5	Low	47.1	Very low	38 Å²	38	89 Å²	89	39%	0.392	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-66	155.3	-179.6	0	0	0	0	0	113.5	Y795 E796 R797	G793-Y795 VanDerWaalsContact C-N 3.3Å; G793-Y795 PolarHBondContact O-N 3.48Å; G793-E796 PolarHBondContact O-N 2.89Å; G793-E796 VanDerWaalsContact O-N 3.11Å; G793-R797 PolarHBondContact O-N 3.24Å; G793-R797 VanDerWaalsContact O-N 3.08Å
794	I	62	Low	48.9	Very low	17 Å²	17	81.7 Å²	81.7	9%	0.087	47%	0.467	C	S	.	.	H	α-helix	trans	-60.3	-38.9	-178.1	-56.3	177.1	0	0	0	111.7	F703 R706 T707 E710 E796 R797 M798	F703-I794 HydrophobicContact CD1-CG2 4.3Å; R706-I794 HydrophobicContact CB-CD1 4.16Å; R706-I794 HydrophobicContact CG-CD1 3.72Å; T707-I794 HydrophobicContact CG2-CB 3.75Å; T707-I794 HydrophobicContact CG2-CD1 3.75Å; T707-I794 HydrophobicContact CG2-CG1 3.85Å; E710-I794 HydrophobicContact CG-CD1 4.37Å; I794-E796 VanDerWaalsContact C-N 3.3Å; I794-E796 PolarHBondContact O-N 3.38Å; I794-R797 PolarHBondContact O-N 3.22Å; I794-M798 HydrophobicContact CG2-CE 3.67Å; I794-M798 PolarHBondContact O-N 3.06Å
795	Y	58.9	Low	50.3	Low	38 Å²	38	82.8 Å²	82.8	15%	0.149	47%	0.469	C	S	.	.	H	α-helix	trans	-65.2	-33.3	177.1	-72.4	-72.1	0	0	0	112.7	F703 T707 G793 M798 S799 P808	F703-Y795 HydrophobicContact CB-CE1 4.4Å; F703-Y795 WeakPolarHBondContact CB-OH 3.48Å; T707-Y795 HydrophobicContact CG2-CD2 4.09Å; T707-Y795 HydrophobicContact CG2-CE2 4.04Å; G793-Y795 VanDerWaalsContact C-N 3.3Å; G793-Y795 PolarHBondContact O-N 3.48Å; Y795-M798 PolarHBondContact O-N 3.33Å; Y795-S799 VanDerWaalsContact O-CB 3.3Å; Y795-S799 WeakPolarHBondContact O-CB 3.28Å; Y795-S799 PolarHBondContact O-N 2.97Å; Y795-S799 PolarHBondContact O-OG 2.83Å; Y795-P808 HydrophobicContact CD1-CB 4.17Å
796	E	58.7	Low	51.8	Low	105 Å²	105	82.2 Å²	82.2	49%	0.491	47%	0.465	S	S	.	.	H	α-helix	trans	-74.7	-35.3	177.9	-166.2	174.4	-173.2	0	0	111.2	V792 G793 I794 S799 N800	V792-E796 HydrophobicContact CG1-CB 3.84Å; V792-E796 HydrophobicContact CG1-CG 3.95Å; G793-E796 PolarHBondContact O-N 2.89Å; G793-E796 VanDerWaalsContact O-N 3.11Å; I794-E796 VanDerWaalsContact C-N 3.3Å; I794-E796 PolarHBondContact O-N 3.38Å; E796-S799 VanDerWaalsContact CA-OG 3.3Å; E796-S799 WeakPolarHBondContact CA-OG 3.43Å; E796-S799 PolarHBondContact O-OG 3.2Å; E796-N800 VanDerWaalsContact O-CB 3.27Å; E796-N800 WeakPolarHBondContact O-CB 3.41Å; E796-N800 PolarHBondContact O-N 2.97Å; E796-N800 PolarHBondContact O-ND2 3.05Å; E796-N800 VanDerWaalsContact O-ND2 3.08Å
797	R	60.6	Low	53.8	Low	120 Å²	120	77 Å²	77	45%	0.453	45%	0.445	S	S	.	.	H	α-helix	trans	-61.1	-45.1	167.6	-77.9	-176	-109.5	153.6	2.7	111.7	E710 V792 G793 I794 Q801	E710-R797 IonicContact OE2-CZ 3.88Å; E710-R797 IonicContact OE2-NH2 2.98Å; E710-R797 PolarHBondContact OE2-NH2 3.44Å; V792-R797 HydrophobicContact CG1-CG 4.11Å; V792-R797 PolarHBondContact O-NE 3.05Å; V792-R797 PolarHBondContact O-NH2 3.14Å; G793-R797 PolarHBondContact O-N 3.24Å; G793-R797 VanDerWaalsContact O-N 3.08Å; I794-R797 PolarHBondContact O-N 3.22Å; R797-Q801 WeakPolarHBondContact O-CB 3.46Å; R797-Q801 PolarHBondContact O-N 2.76Å
798	M	58	Low	55.7	Low	7 Å²	7	76.7 Å²	76.7	3%	0.034	43%	0.433	C	S	.	.	H	α-helix	trans	-68.5	-41.2	177	-82.9	-165	-101.4	0	0	112.8	C683 F703 I794 Y795 N800 Q801 F802 W804	C683-M798 HydrophobicContact CB-SD 4.42Å; F703-M798 HydrophobicContact CD1-CE 3.49Å; F703-M798 VanDerWaalsContact CD1-CE 3.49Å; F703-M798 HydrophobicContact CD2-CE 4.31Å; F703-M798 HydrophobicContact CE1-CE 3.33Å; F703-M798 HydrophobicContact CE2-CE 4.2Å; F703-M798 HydrophobicContact CG-CE 4.01Å; F703-M798 HydrophobicContact CZ-CE 3.73Å; F703-M798 HydrophobicContact CZ-SD 4.44Å; I794-M798 HydrophobicContact CG2-CE 3.67Å; I794-M798 PolarHBondContact O-N 3.06Å; Y795-M798 PolarHBondContact O-N 3.33Å; M798-N800 VanDerWaalsContact C-N 3.28Å; M798-N800 PolarHBondContact O-N 2.92Å; M798-Q801 PolarHBondContact O-N 3.22Å; M798-Q801 VanDerWaalsContact O-N 3.12Å; M798-F802 WeakPolarHBondContact O-CD2 3.41Å; M798-F802 PolarHBondContact O-N 2.8Å; M798-W804 HydrophobicContact CB-CZ3 4.03Å
799	S	59.3	Low	57.4	Low	22 Å²	22	77.7 Å²	77.7	15%	0.154	42%	0.421	C	S	.	.	H	α-helix	trans	-64.3	-36.7	177.8	68.1	0	0	0	0	111.1	Y795 E796 G803 W804	Y795-S799 VanDerWaalsContact O-CB 3.3Å; Y795-S799 WeakPolarHBondContact O-CB 3.28Å; Y795-S799 PolarHBondContact O-N 2.97Å; Y795-S799 PolarHBondContact O-OG 2.83Å; E796-S799 VanDerWaalsContact CA-OG 3.3Å; E796-S799 WeakPolarHBondContact CA-OG 3.43Å; E796-S799 PolarHBondContact O-OG 3.2Å; S799-G803 CarbonylContact O-C 3.51Å; S799-G803 WeakPolarHBondContact O-CA 3.39Å; S799-G803 PolarHBondContact O-N 3.44Å; S799-W804 WeakPolarHBondContact CB-O 3.45Å; S799-W804 PolarHBondContact O-N 3.21Å
800	N	56.4	Low	59.1	Low	115 Å²	115	78.1 Å²	78.1	62%	0.615	43%	0.428	S	S	*	.	H	α-helix	trans	-69.7	-33.7	173.1	-70.9	-23.9	0	0	0	112.4	E796 M798	E796-N800 VanDerWaalsContact O-CB 3.27Å; E796-N800 WeakPolarHBondContact O-CB 3.41Å; E796-N800 PolarHBondContact O-N 2.97Å; E796-N800 PolarHBondContact O-ND2 3.05Å; E796-N800 VanDerWaalsContact O-ND2 3.08Å; M798-N800 VanDerWaalsContact C-N 3.28Å; M798-N800 PolarHBondContact O-N 2.92Å
801	Q	59.6	Low	60.4	Low	112 Å²	112	76.6 Å²	76.6	52%	0.523	41%	0.412	S	S	.	.	H	α-helix	trans	-73	-38.2	178.1	-173.1	176.3	3.7	0	0	113	R797 M798	R797-Q801 WeakPolarHBondContact O-CB 3.46Å; R797-Q801 PolarHBondContact O-N 2.76Å; M798-Q801 PolarHBondContact O-N 3.22Å; M798-Q801 VanDerWaalsContact O-N 3.12Å
802	F	59.3	Low	62	Low	80 Å²	80	69.9 Å²	69.9	35%	0.351	38%	0.381	S	S	.	.	H	α-helix	trans	-108.7	-3	-175.6	-65.3	-74.6	0	0	0	114.6	V680 M798 W804	V680-F802 HydrophobicContact CG2-CE1 4.3Å; V680-F802 HydrophobicContact CG2-CE2 4.39Å; V680-F802 HydrophobicContact CG2-CZ 4.16Å; M798-F802 WeakPolarHBondContact O-CD2 3.41Å; M798-F802 PolarHBondContact O-N 2.8Å; F802-W804 HydrophobicContact CB-CD2 4.19Å; F802-W804 HydrophobicContact CB-CG 4.38Å; F802-W804 HydrophobicContact CB-CZ2 3.95Å; F802-W804 HydrophobicContact CD2-CH2 4.18Å; F802-W804 AromaticContact CD2-CZ2 3.91Å; F802-W804 HydrophobicContact CD2-CZ2 3.91Å; F802-W804 HydrophobicContact CG-CZ2 4.03Å
803	G	57.1	Low	63.1	Low	57 Å²	57	68.8 Å²	68.8	59%	0.588	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	32.2	178.2	0	0	0	0	0	115.3	S799	S799-G803 CarbonylContact O-C 3.51Å; S799-G803 WeakPolarHBondContact O-CA 3.39Å; S799-G803 PolarHBondContact O-N 3.44Å
804	W	61.4	Low	64.1	Low	34 Å²	34	70.5 Å²	70.5	13%	0.129	38%	0.377	C	S	.	.			trans	-81.2	122.6	-178.2	-57.1	-21.3	0	0	0	111.6	V680 M798 S799 F802 P808 H811 F812	V680-W804 HydrophobicContact CG1-CH2 3.99Å; V680-W804 HydrophobicContact CG1-CZ2 4.4Å; V680-W804 HydrophobicContact CG2-CH2 4.44Å; V680-W804 HydrophobicContact CG2-CZ2 4.04Å; M798-W804 HydrophobicContact CB-CZ3 4.03Å; S799-W804 WeakPolarHBondContact CB-O 3.45Å; S799-W804 PolarHBondContact O-N 3.21Å; F802-W804 HydrophobicContact CB-CD2 4.19Å; F802-W804 HydrophobicContact CB-CG 4.38Å; F802-W804 HydrophobicContact CB-CZ2 3.95Å; F802-W804 HydrophobicContact CD2-CH2 4.18Å; F802-W804 AromaticContact CD2-CZ2 3.91Å; F802-W804 HydrophobicContact CD2-CZ2 3.91Å; F802-W804 HydrophobicContact CG-CZ2 4.03Å; W804-P808 HydrophobicContact CE3-CB 4.23Å; W804-H811 HydrophobicContact CB-CB 4.26Å; W804-H811 AromaticContact CD1-CG 3.96Å; W804-H811 AromaticContact CD1-ND1 4Å; W804-H811 HydrophobicContact CD2-CB 3.63Å; W804-H811 HydrophobicContact CE3-CB 4.14Å; W804-H811 HydrophobicContact CG-CB 3.67Å; W804-H811 AromaticContact CG-CG 3.95Å; W804-H811 HydrophobicContact CZ2-CB 4.49Å; W804-F812 HydrophobicContact CH2-CB 4.18Å; W804-F812 HydrophobicContact CH2-CD2 4.32Å; W804-F812 HydrophobicContact CZ3-CB 4.31Å
805	T	54.1	Low	64.7	Low	137 Å²	137	70.3 Å²	70.3	84%	0.84	38%	0.379	S	S	*	.			trans	-111.1	-25.2	-172.8	55.1	0	0	0	0	115.6
806	S	59.5	Low	65.8	Low	104 Å²	104	68.5 Å²	68.5	73%	0.727	37%	0.372	S	S	*	.	S	Bend	trans	-111	-47.9	-170.2	-176.4	0	0	0	0	114.5
807	S	71.4	Confident	66.9	Low	42 Å²	42	67.4 Å²	67.4	29%	0.294	36%	0.364	S	S	.	.			trans	-147.7	95.1	-177.6	55.4	0	0	0	0	113.5	R809 L810 H811	S807-R809 PolarHBondContact O-N 3.34Å; S807-R809 VanDerWaalsContact O-N 3.11Å; S807-L810 PolarHBondContact O-N 3.47Å; S807-H811 WeakPolarHBondContact O-CB 3.34Å; S807-H811 PolarHBondContact O-CD2 3.41Å; S807-H811 PolarHBondContact O-N 3Å
808	P	68.2	Low	67.8	Low	51 Å²	51	66.5 Å²	66.5	33%	0.331	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-27.8	-171.2	23.2	-33.3	0	0	0	113.8	Y795 W804 F812	Y795-P808 HydrophobicContact CD1-CB 4.17Å; W804-P808 HydrophobicContact CE3-CB 4.23Å; P808-F812 WeakPolarHBondContact O-CB 3.45Å; P808-F812 PolarHBondContact O-N 3.2Å
809	R	72.5	Confident	69	Low	141 Å²	141	66.4 Å²	66.4	53%	0.532	37%	0.368	S	S	.	.	H	α-helix	trans	-70.6	-47.9	179.2	-64.5	177.9	178.7	-164.2	-11.5	112.5	L700 E704 S807 F812 V813	L700-R809 HydrophobicContact CD1-CB 3.89Å; L700-R809 HydrophobicContact CD1-CG 4.15Å; L700-R809 HydrophobicContact CD2-CG 4.47Å; E704-R809 IonicContact OE1-CZ 2.83Å; E704-R809 IonicContact OE1-NE 2.79Å; E704-R809 IonicContact OE1-NH1 3.39Å; E704-R809 IonicContact OE1-NH2 3.52Å; E704-R809 PolarHBondContact OE1-NH2 3.48Å; S807-R809 PolarHBondContact O-N 3.34Å; S807-R809 VanDerWaalsContact O-N 3.11Å; R809-F812 WeakPolarHBondContact O-CB 3.47Å; R809-F812 PolarHBondContact O-N 3.41Å; R809-V813 PolarHBondContact O-N 2.91Å
810	L	71.3	Confident	70.3	Confident	115 Å²	115	65.9 Å²	65.9	60%	0.602	36%	0.364	S	S	*	.	H	α-helix	trans	-68	-42.3	177.8	-168.5	70.9	0	0	0	110	S807 F812 V813 T814	S807-L810 PolarHBondContact O-N 3.47Å; L810-F812 VanDerWaalsContact C-N 3.27Å; L810-F812 PolarHBondContact O-N 2.88Å; L810-V813 PolarHBondContact O-N 3.01Å; L810-T814 WeakPolarHBondContact O-CB 3.29Å; L810-T814 PolarHBondContact O-N 2.91Å; L810-T814 PolarHBondContact O-OG1 3.06Å
811	H	70.6	Confident	71.6	Confident	70 Å²	70	60.5 Å²	60.5	32%	0.324	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-32.4	174.1	-81	-74	0	0	0	113.5	W804 S807 G815	W804-H811 HydrophobicContact CB-CB 4.26Å; W804-H811 AromaticContact CD1-CG 3.96Å; W804-H811 AromaticContact CD1-ND1 4Å; W804-H811 HydrophobicContact CD2-CB 3.63Å; W804-H811 HydrophobicContact CE3-CB 4.14Å; W804-H811 HydrophobicContact CG-CB 3.67Å; W804-H811 AromaticContact CG-CG 3.95Å; W804-H811 HydrophobicContact CZ2-CB 4.49Å; S807-H811 WeakPolarHBondContact O-CB 3.34Å; S807-H811 PolarHBondContact O-CD2 3.41Å; S807-H811 PolarHBondContact O-N 3Å; H811-G815 WeakPolarHBondContact O-CA 3.44Å; H811-G815 PolarHBondContact O-N 3.4Å
812	F	76.3	Confident	72.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-50.6	172.2	177.4	-92.8	0	0	0	111.4	V680 L684 L700 F703 W804 P808 R809 L810 G815 V816	V680-F812 HydrophobicContact CG1-CD2 3.35Å; V680-F812 HydrophobicContact CG1-CE2 3.38Å; V680-F812 HydrophobicContact CG1-CG 4.39Å; V680-F812 HydrophobicContact CG1-CZ 4.44Å; L684-F812 HydrophobicContact CD1-CZ 4.21Å; L700-F812 HydrophobicContact CD1-CD1 4.11Å; F703-F812 HydrophobicContact CD2-CD2 4.34Å; F703-F812 HydrophobicContact CD2-CE1 4.45Å; F703-F812 AromaticContact CD2-CE2 3.74Å; F703-F812 HydrophobicContact CD2-CE2 3.74Å; F703-F812 AromaticContact CD2-CZ 3.82Å; F703-F812 HydrophobicContact CD2-CZ 3.82Å; F703-F812 HydrophobicContact CE2-CD2 4.14Å; F703-F812 HydrophobicContact CE2-CE1 4.45Å; F703-F812 AromaticContact CE2-CE2 3.22Å; F703-F812 HydrophobicContact CE2-CE2 3.22Å; F703-F812 AromaticContact CE2-CZ 3.44Å; F703-F812 HydrophobicContact CE2-CZ 3.44Å; F703-F812 VanDerWaalsContact CE2-CZ 3.44Å; F703-F812 HydrophobicContact CZ-CE2 4.16Å; W804-F812 HydrophobicContact CH2-CB 4.18Å; W804-F812 HydrophobicContact CH2-CD2 4.32Å; W804-F812 HydrophobicContact CZ3-CB 4.31Å; P808-F812 WeakPolarHBondContact O-CB 3.45Å; P808-F812 PolarHBondContact O-N 3.2Å; R809-F812 WeakPolarHBondContact O-CB 3.47Å; R809-F812 PolarHBondContact O-N 3.41Å; L810-F812 VanDerWaalsContact C-N 3.27Å; L810-F812 PolarHBondContact O-N 2.88Å; F812-G815 CarbonylContact O-C 3.29Å; F812-G815 WeakPolarHBondContact O-CA 3.39Å; F812-G815 PolarHBondContact O-N 2.75Å; F812-G815 VanDerWaalsContact O-N 3.15Å; F812-V816 HydrophobicContact CD1-CG2 4.29Å; F812-V816 HydrophobicContact CE1-CG2 3.8Å; F812-V816 HydrophobicContact CE2-CG2 4.46Å; F812-V816 HydrophobicContact CZ-CG2 3.87Å; F812-V816 WeakPolarHBondContact O-CG2 3.45Å; F812-V816 PolarHBondContact O-N 2.97Å
813	V	76.5	Confident	74.1	Confident	39 Å²	39	52.2 Å²	52.2	24%	0.236	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-47.6	179.5	176.7	0	0	0	0	110.8	P696 L700 R809 L810 G815 V816 Y817	P696-V813 HydrophobicContact CB-CG1 4.3Å; P696-V813 HydrophobicContact CG-CG1 4.32Å; L700-V813 HydrophobicContact CD1-CG2 4.47Å; R809-V813 PolarHBondContact O-N 2.91Å; L810-V813 PolarHBondContact O-N 3.01Å; V813-G815 VanDerWaalsContact C-N 3.26Å; V813-G815 PolarHBondContact O-N 3.44Å; V813-V816 WeakPolarHBondContact O-CB 3.49Å; V813-V816 PolarHBondContact O-N 3.23Å; V813-V816 VanDerWaalsContact O-N 3.14Å; V813-Y817 HydrophobicContact CG1-CD2 4.15Å; V813-Y817 HydrophobicContact CG1-CE2 3.9Å; V813-Y817 VanDerWaalsContact O-CD2 3.3Å; V813-Y817 WeakPolarHBondContact O-CD2 3.38Å; V813-Y817 PolarHBondContact O-N 3.35Å
814	T	75.5	Confident	75.6	Confident	74 Å²	74	51.1 Å²	51.1	45%	0.454	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-38.1	174.3	-54.3	0	0	0	0	111.3	L810 V816 Y817 L818	L810-T814 WeakPolarHBondContact O-CB 3.29Å; L810-T814 PolarHBondContact O-N 2.91Å; L810-T814 PolarHBondContact O-OG1 3.06Å; T814-V816 PolarHBondContact O-N 2.7Å; T814-Y817 PolarHBondContact O-N 3.47Å; T814-L818 WeakPolarHBondContact O-CB 3.26Å; T814-L818 PolarHBondContact O-N 3.39Å
815	G	74.4	Confident	76.7	Confident	13 Å²	13	51 Å²	51	13%	0.134	28%	0.28	C	S	.	.	H	α-helix	trans	-66.3	-31.8	175.9	0	0	0	0	0	113.9	H811 F812 V813 S819	H811-G815 WeakPolarHBondContact O-CA 3.44Å; H811-G815 PolarHBondContact O-N 3.4Å; F812-G815 CarbonylContact O-C 3.29Å; F812-G815 WeakPolarHBondContact O-CA 3.39Å; F812-G815 PolarHBondContact O-N 2.75Å; F812-G815 VanDerWaalsContact O-N 3.15Å; V813-G815 VanDerWaalsContact C-N 3.26Å; V813-G815 PolarHBondContact O-N 3.44Å; G815-S819 PolarHBondContact O-N 3.42Å; G815-S819 VanDerWaalsContact O-N 3.11Å
816	V	81.7	Confident	78.2	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-65.7	-46.7	172.2	168.5	0	0	0	0	110.4	L681 P696 F812 V813 T814 L818 S819 M822	L681-V816 HydrophobicContact CD1-CB 4.25Å; L681-V816 HydrophobicContact CD1-CG1 4.06Å; L681-V816 HydrophobicContact CD1-CG2 4.1Å; P696-V816 HydrophobicContact CB-CG1 4.19Å; F812-V816 HydrophobicContact CD1-CG2 4.29Å; F812-V816 HydrophobicContact CE1-CG2 3.8Å; F812-V816 HydrophobicContact CE2-CG2 4.46Å; F812-V816 HydrophobicContact CZ-CG2 3.87Å; F812-V816 WeakPolarHBondContact O-CG2 3.45Å; F812-V816 PolarHBondContact O-N 2.97Å; V813-V816 WeakPolarHBondContact O-CB 3.49Å; V813-V816 PolarHBondContact O-N 3.23Å; V813-V816 VanDerWaalsContact O-N 3.14Å; T814-V816 PolarHBondContact O-N 2.7Å; V816-L818 VanDerWaalsContact C-N 3.34Å; V816-L818 PolarHBondContact O-N 3.21Å; V816-S819 VanDerWaalsContact O-CB 3.3Å; V816-S819 WeakPolarHBondContact O-CB 3.3Å; V816-S819 PolarHBondContact O-N 3.02Å; V816-S819 PolarHBondContact O-OG 3.13Å; V816-M822 VanDerWaalsContact O-CB 3.23Å; V816-M822 WeakPolarHBondContact O-CB 3.48Å
817	Y	81.6	Confident	79.6	Confident	82 Å²	82	41.9 Å²	41.9	32%	0.322	22%	0.218	S	C	.	.	H	α-helix	trans	-70.6	-28.9	177.2	-72.4	-71.7	0	0	0	113.6	P696 V813 T814 S819 M822 L826	P696-Y817 HydrophobicContact CG-CE2 3.91Å; V813-Y817 HydrophobicContact CG1-CD2 4.15Å; V813-Y817 HydrophobicContact CG1-CE2 3.9Å; V813-Y817 VanDerWaalsContact O-CD2 3.3Å; V813-Y817 WeakPolarHBondContact O-CD2 3.38Å; V813-Y817 PolarHBondContact O-N 3.35Å; T814-Y817 PolarHBondContact O-N 3.47Å; Y817-S819 PolarHBondContact O-N 2.98Å; Y817-M822 HydrophobicContact CD1-CE 4.15Å; Y817-M822 HydrophobicContact CD1-CG 4.14Å; Y817-M822 HydrophobicContact CE1-CE 3.79Å; Y817-L826 HydrophobicContact CD1-CD1 4.3Å
818	L	80.2	Confident	80.5	Confident	101 Å²	101	40.5 Å²	40.5	53%	0.529	21%	0.209	S	C	.	.	H	α-helix	trans	-74.8	-17.2	174.3	-167.1	62.8	0	0	0	112.5	T814 V816 K823 L1122	T814-L818 WeakPolarHBondContact O-CB 3.26Å; T814-L818 PolarHBondContact O-N 3.39Å; V816-L818 VanDerWaalsContact C-N 3.34Å; V816-L818 PolarHBondContact O-N 3.21Å; L818-K823 WeakPolarHBondContact O-CE 3.48Å; L818-L1122 HydrophobicContact CB-CD1 4.27Å; L818-L1122 HydrophobicContact CD1-CD1 3.69Å
819	S	83.1	Confident	81.5	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.028	22%	0.215	C	C	.	.	S	Bend	trans	-63	134.7	-179.9	75.7	0	0	0	0	111.5	L681 G815 V816 Y817 S821 M822 K823	L681-S819 VanDerWaalsContact CD1-OG 3.25Å; L681-S819 WeakPolarHBondContact CD1-OG 3.46Å; G815-S819 PolarHBondContact O-N 3.42Å; G815-S819 VanDerWaalsContact O-N 3.11Å; V816-S819 VanDerWaalsContact O-CB 3.3Å; V816-S819 WeakPolarHBondContact O-CB 3.3Å; V816-S819 PolarHBondContact O-N 3.02Å; V816-S819 PolarHBondContact O-OG 3.13Å; Y817-S819 PolarHBondContact O-N 2.98Å; S819-S821 VanDerWaalsContact C-N 3.25Å; S819-S821 PolarHBondContact O-N 3.38Å; S819-M822 PolarHBondContact O-N 3.2Å; S819-M822 VanDerWaalsContact O-N 3.08Å; S819-M822 WeakPolarHBondContact OG-CB 3.25Å; S819-M822 PolarHBondContact OG-N 2.98Å; S819-K823 PolarHBondContact O-N 3.32Å; S819-K823 VanDerWaalsContact O-N 3.09Å
820	P	85.5	Confident	82.4	Confident	12 Å²	12	37.8 Å²	37.8	8%	0.078	20%	0.199	C	C	.	.	H	α-helix	trans	-56.5	-37.7	179.2	-28.7	36.4	0	0	0	113.5	R676 W677 M822 K823 F824	R676-P820 WeakPolarHBondContact O-CD 3.37Å; R676-P820 WeakPolarHBondContact O-CG 3.08Å; W677-P820 HydrophobicContact CD2-CB 4.44Å; W677-P820 HydrophobicContact CE3-CB 3.66Å; W677-P820 HydrophobicContact CZ3-CB 3.97Å; W677-P820 WeakPolarHBondContact O-CD 3.15Å; P820-M822 VanDerWaalsContact C-N 3.3Å; P820-M822 PolarHBondContact O-N 2.95Å; P820-K823 PolarHBondContact O-N 3.2Å; P820-F824 WeakPolarHBondContact O-CB 3.37Å; P820-F824 PolarHBondContact O-N 2.94Å
821	S	84.1	Confident	83.4	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.014	17%	0.172	C	C	.	.	H	α-helix	trans	-61.5	-36.4	177.9	-168.5	0	0	0	0	113.1	W677 K693 S819 C825	W677-S821 PolarHBondContact NE1-OG 2.74Å; W677-S821 WeakPolarHBondContact O-CB 3.41Å; W677-S821 PolarHBondContact O-N 2.62Å; K693-S821 WeakPolarHBondContact CE-OG 3.13Å; K693-S821 PolarHBondContact NZ-OG 2.98Å; S819-S821 VanDerWaalsContact C-N 3.25Å; S819-S821 PolarHBondContact O-N 3.38Å; S821-C825 WeakPolarHBondContact O-CB 3.5Å; S821-C825 PolarHBondContact O-N 3.08Å; S821-C825 VanDerWaalsContact O-N 3.14Å
822	M	84.5	Confident	84.5	Confident	8 Å²	8	33.7 Å²	33.7	4%	0.039	18%	0.18	C	C	.	.	H	α-helix	trans	-75.3	-43.2	177.5	-173.4	56.4	-175.6	0	0	111.3	K693 V816 Y817 S819 P820 F824 C825 L826	K693-M822 HydrophobicContact CB-SD 3.84Å; K693-M822 HydrophobicContact CG-SD 4.02Å; K693-M822 WeakPolarHBondContact O-CE 3.09Å; V816-M822 VanDerWaalsContact O-CB 3.23Å; V816-M822 WeakPolarHBondContact O-CB 3.48Å; Y817-M822 HydrophobicContact CD1-CE 4.15Å; Y817-M822 HydrophobicContact CD1-CG 4.14Å; Y817-M822 HydrophobicContact CE1-CE 3.79Å; S819-M822 PolarHBondContact O-N 3.2Å; S819-M822 VanDerWaalsContact O-N 3.08Å; S819-M822 WeakPolarHBondContact OG-CB 3.25Å; S819-M822 PolarHBondContact OG-N 2.98Å; P820-M822 VanDerWaalsContact C-N 3.3Å; P820-M822 PolarHBondContact O-N 2.95Å; M822-F824 VanDerWaalsContact C-N 3.29Å; M822-F824 PolarHBondContact O-N 3.44Å; M822-C825 WeakPolarHBondContact O-CB 3.45Å; M822-C825 PolarHBondContact O-N 3.33Å; M822-C825 VanDerWaalsContact O-N 3.14Å; M822-L826 HydrophobicContact CE-CD1 3.86Å; M822-L826 HydrophobicContact CE-CD2 3.9Å; M822-L826 HydrophobicContact CE-CG 3.73Å; M822-L826 HydrophobicContact CG-CD1 4.3Å; M822-L826 PolarHBondContact O-N 2.94Å; M822-L826 HydrophobicContact SD-CG 4.44Å
823	K	86.8	Confident	85.2	Confident	10 Å²	10	37.7 Å²	37.7	4%	0.043	20%	0.201	C	C	.	.	H	α-helix	trans	-54.7	-47.2	172.9	-68.2	179.2	177.8	-170.7	0	111.1	L818 S819 P820 C825 L826 H827 Y1117 S1118 R1120	L818-K823 WeakPolarHBondContact O-CE 3.48Å; S819-K823 PolarHBondContact O-N 3.32Å; S819-K823 VanDerWaalsContact O-N 3.09Å; P820-K823 PolarHBondContact O-N 3.2Å; K823-C825 PolarHBondContact O-N 3.15Å; K823-L826 PolarHBondContact O-N 3.32Å; K823-H827 WeakPolarHBondContact O-CB 3.31Å; K823-H827 PolarHBondContact O-CD2 3.2Å; K823-H827 PolarHBondContact O-N 2.8Å; K823-Y1117 HydrophobicContact CB-CD1 4.41Å; K823-Y1117 WeakPolarHBondContact CD-O 3.37Å; K823-Y1117 PolarHBondContact NZ-O 3.08Å; K823-S1118 PolarHBondContact NZ-O 3.47Å; K823-S1118 VanDerWaalsContact NZ-O 3.16Å; K823-R1120 PolarHBondContact NZ-O 2.72Å
824	F	87.9	Confident	86.1	Confident	33 Å²	33	35.9 Å²	35.9	15%	0.145	19%	0.189	C	C	.	.	H	α-helix	trans	-57.9	-47.3	175.4	172.9	-95.6	0	0	0	112.4	W677 P820 M822 L826 S828 I947 I950 Y1117	W677-F824 HydrophobicContact CH2-CB 3.42Å; W677-F824 VanDerWaalsContact CH2-CB 3.42Å; W677-F824 HydrophobicContact CH2-CD1 4.28Å; W677-F824 HydrophobicContact CH2-CD2 4.03Å; W677-F824 AromaticContact CH2-CG 3.63Å; W677-F824 HydrophobicContact CH2-CG 3.63Å; W677-F824 HydrophobicContact CZ2-CB 3.78Å; W677-F824 HydrophobicContact CZ2-CD1 4.02Å; W677-F824 AromaticContact CZ2-CG 3.84Å; W677-F824 HydrophobicContact CZ2-CG 3.84Å; W677-F824 HydrophobicContact CZ3-CB 4.41Å; P820-F824 WeakPolarHBondContact O-CB 3.37Å; P820-F824 PolarHBondContact O-N 2.94Å; M822-F824 VanDerWaalsContact C-N 3.29Å; M822-F824 PolarHBondContact O-N 3.44Å; F824-L826 PolarHBondContact O-N 2.85Å; F824-S828 WeakPolarHBondContact CZ-OG 3.28Å; F824-S828 VanDerWaalsContact O-CB 3.27Å; F824-S828 WeakPolarHBondContact O-CB 3.45Å; F824-S828 PolarHBondContact O-N 2.92Å; F824-S828 PolarHBondContact O-OG 2.89Å; F824-I947 HydrophobicContact CE2-CG2 3.98Å; F824-I947 HydrophobicContact CZ-CG2 3.74Å; F824-I950 HydrophobicContact CD1-CD1 4.48Å; F824-I950 HydrophobicContact CD2-CD1 3.98Å; F824-I950 HydrophobicContact CE1-CD1 4.4Å; F824-I950 HydrophobicContact CE1-CG2 3.98Å; F824-I950 HydrophobicContact CE2-CB 4.4Å; F824-I950 HydrophobicContact CE2-CD1 3.89Å; F824-I950 HydrophobicContact CE2-CG2 4.1Å; F824-I950 HydrophobicContact CG-CD1 4.3Å; F824-I950 HydrophobicContact CZ-CB 4.26Å; F824-I950 HydrophobicContact CZ-CD1 4.12Å; F824-I950 HydrophobicContact CZ-CG2 3.47Å; F824-I950 VanDerWaalsContact CZ-CG2 3.47Å; F824-Y1117 HydrophobicContact CB-CD1 4.08Å; F824-Y1117 HydrophobicContact CB-CE1 4.14Å; F824-Y1117 HydrophobicContact CB-CG 4.34Å; F824-Y1117 HydrophobicContact CD2-CD2 4.34Å; F824-Y1117 HydrophobicContact CD2-CE1 4.06Å; F824-Y1117 AromaticContact CD2-CE2 3.73Å; F824-Y1117 HydrophobicContact CD2-CE2 3.73Å; F824-Y1117 AromaticContact CD2-CZ 3.58Å; F824-Y1117 HydrophobicContact CE2-CE2 4.47Å
825	C	85.5	Confident	87	Confident	31 Å²	31	32.5 Å²	32.5	21%	0.209	17%	0.169	C	C	.	.	H	α-helix	trans	-61.5	-45.2	-179.5	-167.4	0	0	0	0	111.9	S821 M822 K823 L829	S821-C825 WeakPolarHBondContact O-CB 3.5Å; S821-C825 PolarHBondContact O-N 3.08Å; S821-C825 VanDerWaalsContact O-N 3.14Å; M822-C825 WeakPolarHBondContact O-CB 3.45Å; M822-C825 PolarHBondContact O-N 3.33Å; M822-C825 VanDerWaalsContact O-N 3.14Å; K823-C825 PolarHBondContact O-N 3.15Å; C825-L829 WeakPolarHBondContact O-CB 3.36Å; C825-L829 PolarHBondContact O-N 2.7Å
826	L	85.9	Confident	87.8	Confident	41 Å²	41	37.9 Å²	37.9	22%	0.215	19%	0.192	C	C	.	.	H	α-helix	trans	-66.2	-50.8	178	-73.7	174	0	0	0	111.6	Y817 M822 K823 F824 S828 L829 F830 P1124	Y817-L826 HydrophobicContact CD1-CD1 4.3Å; M822-L826 HydrophobicContact CE-CD1 3.86Å; M822-L826 HydrophobicContact CE-CD2 3.9Å; M822-L826 HydrophobicContact CE-CG 3.73Å; M822-L826 HydrophobicContact CG-CD1 4.3Å; M822-L826 PolarHBondContact O-N 2.94Å; M822-L826 HydrophobicContact SD-CG 4.44Å; K823-L826 PolarHBondContact O-N 3.32Å; F824-L826 PolarHBondContact O-N 2.85Å; L826-S828 VanDerWaalsContact C-N 3.28Å; L826-S828 PolarHBondContact O-N 3.14Å; L826-L829 PolarHBondContact O-N 3.02Å; L826-F830 HydrophobicContact CD2-CE2 4.47Å; L826-F830 VanDerWaalsContact O-CD2 3.26Å; L826-F830 WeakPolarHBondContact O-CD2 3.19Å; L826-F830 PolarHBondContact O-N 3.03Å; L826-P1124 HydrophobicContact CB-CG 4.45Å
827	H	88.7	Confident	88.3	Confident	10 Å²	10	39 Å²	39	5%	0.046	20%	0.198	C	C	.	.	H	α-helix	trans	-58.5	-40.9	178.5	-82.9	-112.4	0	0	0	111.8	K823 H831 Y1117 T1121	K823-H827 WeakPolarHBondContact O-CB 3.31Å; K823-H827 PolarHBondContact O-CD2 3.2Å; K823-H827 PolarHBondContact O-N 2.8Å; H827-H831 VanDerWaalsContact O-CB 3.26Å; H827-H831 WeakPolarHBondContact O-CB 3.21Å; H827-H831 PolarHBondContact O-N 3.49Å; H827-Y1117 HydrophobicContact CB-CE1 4.28Å; H827-T1121 PolarHBondContact NE2-O 3.25Å
828	S	89.1	Confident	88.9	Confident	13 Å²	13	35.1 Å²	35.1	9%	0.091	18%	0.182	C	C	.	.	H	α-helix	trans	-66.3	-43.4	177.8	-56.7	0	0	0	0	112.3	F824 L826 H831 L832 I947	F824-S828 WeakPolarHBondContact CZ-OG 3.28Å; F824-S828 VanDerWaalsContact O-CB 3.27Å; F824-S828 WeakPolarHBondContact O-CB 3.45Å; F824-S828 PolarHBondContact O-N 2.92Å; F824-S828 PolarHBondContact O-OG 2.89Å; L826-S828 VanDerWaalsContact C-N 3.28Å; L826-S828 PolarHBondContact O-N 3.14Å; S828-H831 PolarHBondContact O-N 2.87Å; S828-L832 WeakPolarHBondContact O-CG 3.41Å; S828-L832 PolarHBondContact O-N 3.11Å; S828-I947 WeakPolarHBondContact OG-CG2 3.37Å
829	L	89.4	Confident	89.6	Confident	90 Å²	90	32 Å²	32	47%	0.471	17%	0.169	S	C	.	.	H	α-helix	trans	-64.9	-44.5	179.1	-178.5	136.7	0	0	0	111.6	C825 L826 H831 L832 L833	C825-L829 WeakPolarHBondContact O-CB 3.36Å; C825-L829 PolarHBondContact O-N 2.7Å; L826-L829 PolarHBondContact O-N 3.02Å; L829-H831 VanDerWaalsContact C-N 3.32Å; L829-H831 PolarHBondContact O-N 3.39Å; L829-L832 PolarHBondContact O-N 3.17Å; L829-L833 WeakPolarHBondContact O-CB 3.45Å; L829-L833 PolarHBondContact O-N 2.85Å
830	F	91.7	Very high	90	Very high	45 Å²	45	34.7 Å²	34.7	20%	0.197	19%	0.185	C	C	.	.	H	α-helix	trans	-67.2	-33.3	176.4	-85.2	-104	0	0	0	112.2	L826 L833 F834 Y860 P1124 F1127	L826-F830 HydrophobicContact CD2-CE2 4.47Å; L826-F830 VanDerWaalsContact O-CD2 3.26Å; L826-F830 WeakPolarHBondContact O-CD2 3.19Å; L826-F830 PolarHBondContact O-N 3.03Å; F830-L833 PolarHBondContact O-N 2.89Å; F830-F834 WeakPolarHBondContact O-CB 3.49Å; F830-F834 PolarHBondContact O-N 3.07Å; F830-Y860 HydrophobicContact CB-CE1 4.49Å; F830-Y860 HydrophobicContact CD1-CE1 4.23Å; F830-P1124 HydrophobicContact CB-CB 3.78Å; F830-P1124 HydrophobicContact CB-CG 4.04Å; F830-P1124 HydrophobicContact CD1-CB 4.29Å; F830-P1124 HydrophobicContact CD1-CG 3.81Å; F830-P1124 HydrophobicContact CD2-CB 4.1Å; F830-P1124 HydrophobicContact CD2-CG 3.41Å; F830-P1124 VanDerWaalsContact CD2-CG 3.41Å; F830-P1124 HydrophobicContact CE1-CG 4.08Å; F830-P1124 HydrophobicContact CE2-CG 3.69Å; F830-P1124 HydrophobicContact CG-CB 3.8Å; F830-P1124 HydrophobicContact CG-CG 3.46Å; F830-P1124 VanDerWaalsContact CG-CG 3.46Å; F830-P1124 HydrophobicContact CZ-CG 4.01Å; F830-F1127 HydrophobicContact CE1-CD2 4.11Å; F830-F1127 AromaticContact CE1-CE2 3.97Å; F830-F1127 HydrophobicContact CE1-CE2 3.97Å
831	H	92.8	Very high	90.2	Very high	6 Å²	6	34.1 Å²	34.1	3%	0.028	18%	0.182	C	C	.	.	H	α-helix	trans	-65.1	-44.9	173.2	-176.7	74.9	0	0	0	112.3	H827 S828 L829 L833 F834 L835 Y864 F940 T944 I947	H827-H831 VanDerWaalsContact O-CB 3.26Å; H827-H831 WeakPolarHBondContact O-CB 3.21Å; H827-H831 PolarHBondContact O-N 3.49Å; S828-H831 PolarHBondContact O-N 2.87Å; L829-H831 VanDerWaalsContact C-N 3.32Å; L829-H831 PolarHBondContact O-N 3.39Å; H831-L833 VanDerWaalsContact C-N 3.35Å; H831-L833 PolarHBondContact O-N 3.08Å; H831-F834 WeakPolarHBondContact O-CB 3.39Å; H831-F834 PolarHBondContact O-N 3.34Å; H831-L835 WeakPolarHBondContact O-CG 3.13Å; H831-L835 PolarHBondContact O-N 3.41Å; H831-Y864 WeakPolarHBondContact CA-OH 3.42Å; H831-Y864 AromaticContact ND1-CZ 3.66Å; H831-Y864 PolarHBondContact ND1-OH 3.05Å; H831-F940 PolarHBondContact NE2-O 3.4Å; H831-T944 PolarHBondContact NE2-OG1 2.89Å; H831-I947 HydrophobicContact CB-CD1 4.1Å; H831-I947 WeakPolarHBondContact CD2-CD1 3.21Å
832	L	92.8	Very high	90.4	Very high	93 Å²	93	34.1 Å²	34.1	49%	0.487	18%	0.182	S	C	.	.	H	α-helix	trans	-64.3	-40	175.8	-68.8	175.5	0	0	0	111.9	S828 L829 F834 L835 M836 T944	S828-L832 WeakPolarHBondContact O-CG 3.41Å; S828-L832 PolarHBondContact O-N 3.11Å; L829-L832 PolarHBondContact O-N 3.17Å; L832-F834 VanDerWaalsContact C-N 3.34Å; L832-L835 HydrophobicContact CD2-CD1 4.49Å; L832-L835 PolarHBondContact O-N 3.27Å; L832-M836 WeakPolarHBondContact O-CG 3.46Å; L832-M836 PolarHBondContact O-N 3Å; L832-T944 HydrophobicContact CD2-CG2 4.23Å
833	L	92.2	Very high	90.6	Very high	84 Å²	84	37.7 Å²	37.7	44%	0.44	20%	0.204	S	C	.	.	H	α-helix	trans	-63.4	-41.5	174.8	-171	151.4	0	0	0	111.3	L829 F830 H831 M836 L837 Y860	L829-L833 WeakPolarHBondContact O-CB 3.45Å; L829-L833 PolarHBondContact O-N 2.85Å; F830-L833 PolarHBondContact O-N 2.89Å; H831-L833 VanDerWaalsContact C-N 3.35Å; H831-L833 PolarHBondContact O-N 3.08Å; L833-M836 PolarHBondContact O-N 2.87Å; L833-L837 VanDerWaalsContact O-CB 3.29Å; L833-L837 WeakPolarHBondContact O-CB 3.39Å; L833-L837 PolarHBondContact O-N 3.4Å; L833-Y860 WeakPolarHBondContact CD2-OH 3.3Å
834	F	94.1	Very high	90.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.4	-47	172.7	162.8	-107.8	0	0	0	112.1	F830 H831 L832 M836 L837 F838 Y860 V861 Y864 F940	F830-F834 WeakPolarHBondContact O-CB 3.49Å; F830-F834 PolarHBondContact O-N 3.07Å; H831-F834 WeakPolarHBondContact O-CB 3.39Å; H831-F834 PolarHBondContact O-N 3.34Å; L832-F834 VanDerWaalsContact C-N 3.34Å; F834-M836 VanDerWaalsContact C-N 3.34Å; F834-M836 PolarHBondContact O-N 3.05Å; F834-L837 PolarHBondContact O-N 3.42Å; F834-F838 HydrophobicContact CD2-CB 4.26Å; F834-F838 HydrophobicContact CE2-CB 3.88Å; F834-F838 HydrophobicContact CE2-CD1 4.32Å; F834-F838 HydrophobicContact CE2-CG 4.05Å; F834-F838 HydrophobicContact CZ-CB 4.18Å; F834-F838 AromaticContact CZ-CD1 3.92Å; F834-F838 HydrophobicContact CZ-CD1 3.92Å; F834-F838 HydrophobicContact CZ-CG 4.13Å; F834-F838 VanDerWaalsContact O-CB 3.24Å; F834-F838 WeakPolarHBondContact O-CB 3.44Å; F834-F838 PolarHBondContact O-N 3.3Å; F834-Y860 HydrophobicContact CB-CD1 3.59Å; F834-Y860 HydrophobicContact CB-CE1 3.86Å; F834-Y860 HydrophobicContact CB-CG 4.07Å; F834-Y860 AromaticContact CD2-CD1 4Å; F834-Y860 HydrophobicContact CD2-CD1 4Å; F834-Y860 HydrophobicContact CD2-CD2 4.3Å; F834-Y860 AromaticContact CD2-CG 3.64Å; F834-Y860 HydrophobicContact CD2-CG 3.64Å; F834-Y860 HydrophobicContact CG-CD1 4.04Å; F834-Y860 HydrophobicContact CG-CG 4.17Å; F834-V861 HydrophobicContact CE2-CG2 3.98Å; F834-V861 HydrophobicContact CZ-CG2 3.96Å; F834-Y864 AromaticContact CD1-CE2 3.75Å; F834-Y864 HydrophobicContact CD1-CE2 3.75Å; F834-Y864 AromaticContact CE1-CE2 3.89Å; F834-Y864 HydrophobicContact CE1-CE2 3.89Å; F834-Y864 HydrophobicContact CG-CE2 4.06Å; F834-Y864 HydrophobicContact CZ-CE2 4.33Å; F834-F940 HydrophobicContact CE1-CB 4.03Å; F834-F940 HydrophobicContact CE1-CD1 4.1Å; F834-F940 AromaticContact CE1-CD2 3.79Å; F834-F940 HydrophobicContact CE1-CD2 3.79Å; F834-F940 HydrophobicContact CE1-CE2 4.23Å; F834-F940 AromaticContact CE1-CG 3.73Å; F834-F940 HydrophobicContact CE1-CG 3.73Å; F834-F940 AromaticContact CZ-CD2 3.83Å; F834-F940 HydrophobicContact CZ-CD2 3.83Å; F834-F940 AromaticContact CZ-CE2 3.93Å; F834-F940 HydrophobicContact CZ-CE2 3.93Å; F834-F940 HydrophobicContact CZ-CG 4.24Å; F834-F940 HydrophobicContact CZ-CZ 4.41Å
835	L	94.2	Very high	90.2	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-44.3	179.2	-71.9	173.2	0	0	0	111.9	H831 L832 S839 L937 F940 Y941 T944	H831-L835 WeakPolarHBondContact O-CG 3.13Å; H831-L835 PolarHBondContact O-N 3.41Å; L832-L835 HydrophobicContact CD2-CD1 4.49Å; L832-L835 PolarHBondContact O-N 3.27Å; L835-S839 WeakPolarHBondContact O-CB 3.49Å; L835-S839 PolarHBondContact O-N 3.15Å; L835-L937 HydrophobicContact CD2-CD1 4.1Å; L835-F940 HydrophobicContact CD2-CB 3.67Å; L835-Y941 HydrophobicContact CB-CE1 4.09Å; L835-Y941 HydrophobicContact CD1-CD1 3.91Å; L835-Y941 HydrophobicContact CD1-CE1 4.06Å; L835-Y941 HydrophobicContact CD2-CD1 4.19Å; L835-Y941 HydrophobicContact CD2-CD2 4.4Å; L835-Y941 HydrophobicContact CD2-CE1 4.32Å; L835-Y941 HydrophobicContact CD2-CG 4.21Å; L835-Y941 HydrophobicContact CG-CD1 4.5Å; L835-Y941 HydrophobicContact CG-CE1 4.4Å; L835-T944 WeakPolarHBondContact CD1-OG1 3.31Å
836	M	92.4	Very high	90	Very high	126 Å²	126	45.1 Å²	45.1	62%	0.621	23%	0.231	S	C	*	.	H	α-helix	trans	-61.4	-48.4	175.5	-71.2	-60.8	-60.7	0	0	111.5	L832 L833 F834 V840	L832-M836 WeakPolarHBondContact O-CG 3.46Å; L832-M836 PolarHBondContact O-N 3Å; L833-M836 PolarHBondContact O-N 2.87Å; F834-M836 VanDerWaalsContact C-N 3.34Å; F834-M836 PolarHBondContact O-N 3.05Å; M836-V840 WeakPolarHBondContact O-CG2 3.36Å; M836-V840 PolarHBondContact O-N 3Å
837	L	92.2	Very high	89.7	Confident	24 Å²	24	46.5 Å²	46.5	13%	0.126	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-50	179	-173.7	92.9	0	0	0	111.4	L833 F834 V840 V841 M853 V856 Y860	L833-L837 VanDerWaalsContact O-CB 3.29Å; L833-L837 WeakPolarHBondContact O-CB 3.39Å; L833-L837 PolarHBondContact O-N 3.4Å; F834-L837 PolarHBondContact O-N 3.42Å; L837-V840 PolarHBondContact O-N 2.88Å; L837-V841 WeakPolarHBondContact O-CG2 3.31Å; L837-V841 PolarHBondContact O-N 3.01Å; L837-M853 HydrophobicContact CD1-CE 3.26Å; L837-M853 HydrophobicContact CD1-SD 4.3Å; L837-M853 HydrophobicContact CG-CE 4.41Å; L837-V856 HydrophobicContact CD2-CB 4.22Å; L837-V856 HydrophobicContact CD2-CG1 3.72Å; L837-Y860 HydrophobicContact CD2-CD2 4.48Å; L837-Y860 HydrophobicContact CD2-CE2 4.46Å
838	F	94	Very high	89.1	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68.7	-36.5	-176.6	-167.7	-133.8	0	0	0	111.3	F834 V840 V841 C842 T900 Y933 L937 F940	F834-F838 HydrophobicContact CD2-CB 4.26Å; F834-F838 HydrophobicContact CE2-CB 3.88Å; F834-F838 HydrophobicContact CE2-CD1 4.32Å; F834-F838 HydrophobicContact CE2-CG 4.05Å; F834-F838 HydrophobicContact CZ-CB 4.18Å; F834-F838 AromaticContact CZ-CD1 3.92Å; F834-F838 HydrophobicContact CZ-CD1 3.92Å; F834-F838 HydrophobicContact CZ-CG 4.13Å; F834-F838 VanDerWaalsContact O-CB 3.24Å; F834-F838 WeakPolarHBondContact O-CB 3.44Å; F834-F838 PolarHBondContact O-N 3.3Å; F838-V840 PolarHBondContact O-N 3.02Å; F838-V841 WeakPolarHBondContact O-CB 3.37Å; F838-V841 PolarHBondContact O-N 2.85Å; F838-C842 PolarHBondContact O-N 3.36Å; F838-C842 PolarHBondContact O-SG 3.19Å; F838-T900 HydrophobicContact CE1-CG2 4.08Å; F838-T900 HydrophobicContact CZ-CG2 3.9Å; F838-Y933 HydrophobicContact CZ-CG 4.25Å; F838-L937 HydrophobicContact CB-CD1 4.28Å; F838-L937 HydrophobicContact CD1-CB 3.92Å; F838-L937 HydrophobicContact CD1-CD1 3.55Å; F838-L937 HydrophobicContact CD1-CG 4.25Å; F838-L937 HydrophobicContact CE1-CB 3.8Å; F838-L937 HydrophobicContact CE1-CD1 4.33Å; F838-L937 HydrophobicContact CG-CD1 4.3Å; F838-F940 HydrophobicContact CE1-CD2 4.46Å
839	S	93.7	Very high	88.6	Confident	35 Å²	35	50.5 Å²	50.5	25%	0.245	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-44.1	171.1	-170.6	0	0	0	0	112.1	L835 V841 C842 V843	L835-S839 WeakPolarHBondContact O-CB 3.49Å; L835-S839 PolarHBondContact O-N 3.15Å; S839-V841 VanDerWaalsContact C-N 3.31Å; S839-V841 PolarHBondContact O-N 3.16Å; S839-C842 PolarHBondContact O-N 3.16Å; S839-V843 WeakPolarHBondContact O-CB 3.32Å; S839-V843 VanDerWaalsContact O-CG2 3.27Å; S839-V843 WeakPolarHBondContact O-CG2 3.31Å; S839-V843 PolarHBondContact O-N 2.95Å; S839-V843 VanDerWaalsContact O-N 3.1Å
840	V	91.5	Very high	88.2	Confident	62 Å²	62	49 Å²	49	38%	0.376	26%	0.259	S	S	.	.	H	α-helix	trans	-64.6	-37.9	175.6	171.1	0	0	0	0	111.2	M836 L837 F838 Y844	M836-V840 WeakPolarHBondContact O-CG2 3.36Å; M836-V840 PolarHBondContact O-N 3Å; L837-V840 PolarHBondContact O-N 2.88Å; F838-V840 PolarHBondContact O-N 3.02Å; V840-Y844 PolarHBondContact O-N 3.08Å
841	V	90.4	Very high	87.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.3	-49.4	175.7	169.6	0	0	0	0	111.4	L837 F838 S839 V843 N845 L846 M853 E854	L837-V841 WeakPolarHBondContact O-CG2 3.31Å; L837-V841 PolarHBondContact O-N 3.01Å; F838-V841 WeakPolarHBondContact O-CB 3.37Å; F838-V841 PolarHBondContact O-N 2.85Å; S839-V841 VanDerWaalsContact C-N 3.31Å; S839-V841 PolarHBondContact O-N 3.16Å; V841-V843 VanDerWaalsContact C-N 3.31Å; V841-V843 PolarHBondContact O-N 3.27Å; V841-N845 PolarHBondContact O-N 3.44Å; V841-N845 VanDerWaalsContact O-N 3.11Å; V841-L846 PolarHBondContact O-N 2.84Å; V841-M853 HydrophobicContact CG2-CB 3.81Å; V841-E854 HydrophobicContact CG1-CB 3.9Å; V841-E854 HydrophobicContact CG1-CG 3.89Å
842	C	88.5	Confident	87.6	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.014	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-32.3	-178	-63.4	0	0	0	0	113.4	F838 S839 M934 L937	F838-C842 PolarHBondContact O-N 3.36Å; F838-C842 PolarHBondContact O-SG 3.19Å; S839-C842 PolarHBondContact O-N 3.16Å; C842-M934 HydrophobicContact CB-CG 4.49Å; C842-M934 HydrophobicContact CB-SD 3.5Å; C842-M934 VanDerWaalsContact CB-SD 3.5Å; C842-L937 HydrophobicContact CB-CD2 4.43Å
843	V	87.9	Confident	87.5	Confident	83 Å²	83	57.4 Å²	57.4	50%	0.503	29%	0.291	S	S	.	.	H	α-helix	trans	-85.4	-43.5	-178.4	177	0	0	0	0	112.3	S839 V841	S839-V843 WeakPolarHBondContact O-CB 3.32Å; S839-V843 VanDerWaalsContact O-CG2 3.27Å; S839-V843 WeakPolarHBondContact O-CG2 3.31Å; S839-V843 PolarHBondContact O-N 2.95Å; S839-V843 VanDerWaalsContact O-N 3.1Å; V841-V843 VanDerWaalsContact C-N 3.31Å; V841-V843 PolarHBondContact O-N 3.27Å
844	Y	83.2	Confident	87.4	Confident	176 Å²	176	53.4 Å²	53.4	69%	0.69	27%	0.271	S	S	*	.	H	α-helix	trans	-117.2	-31.9	-167.9	-68.3	-74.2	0	0	0	115.9	V840	V840-Y844 PolarHBondContact O-N 3.08Å
845	N	83.3	Confident	87.1	Confident	47 Å²	47	57.9 Å²	57.9	25%	0.251	29%	0.294	S	S	.	.			trans	-110	22.6	-166.5	-67.2	-67.8	0	0	0	114.2	V841 H847	V841-N845 PolarHBondContact O-N 3.44Å; V841-N845 VanDerWaalsContact O-N 3.11Å; N845-H847 PolarHBondContact O-N 3.45Å
846	L	81.6	Confident	87	Confident	7 Å²	7	60.7 Å²	60.7	4%	0.037	31%	0.311	C	S	.	.			trans	-89.5	90.4	179.7	-167.3	73.8	0	0	0	110.3	V841 L926 R930 Y933	V841-L846 PolarHBondContact O-N 2.84Å; L846-L926 HydrophobicContact CD2-CD1 4.09Å; L846-L926 HydrophobicContact CD2-CG 4.11Å; L846-L926 HydrophobicContact CG-CD1 3.96Å; L846-L926 HydrophobicContact CG-CG 4.33Å; L846-R930 HydrophobicContact CD2-CB 3.63Å; L846-R930 HydrophobicContact CD2-CG 4.09Å; L846-Y933 HydrophobicContact CD1-CD2 3.89Å; L846-Y933 HydrophobicContact CD1-CE2 3.71Å
847	H	80.7	Confident	87	Confident	69 Å²	69	54.7 Å²	54.7	32%	0.319	28%	0.281	S	S	.	.			trans	-114	165.9	176.9	-66.6	-78.8	0	0	0	112	N845 S849 E920	N845-H847 PolarHBondContact O-N 3.45Å; H847-S849 VanDerWaalsContact C-N 3.25Å; H847-S849 PolarHBondContact O-N 3.43Å; H847-E920 VanDerWaalsContact C-OE1 3.24Å; H847-E920 WeakPolarHBondContact CA-OE1 3.34Å; H847-E920 WeakPolarHBondContact CB-OE1 3.43Å; H847-E920 IonicContact CE1-OE2 3.45Å; H847-E920 IonicContact CG-OE1 3.5Å; H847-E920 IonicContact CG-OE2 3.44Å; H847-E920 IonicContact ND1-OE1 3.16Å; H847-E920 PolarHBondContact ND1-OE1 2.82Å; H847-E920 IonicContact ND1-OE2 2.86Å; H847-E920 PolarHBondContact ND1-OE2 3.29Å
848	F	75.8	Confident	86.9	Confident	20 Å²	20	55 Å²	55	9%	0.088	28%	0.283	C	S	.	.	S	Bend	trans	-55.4	-44.5	171.3	-67.6	-49.9	0	0	0	110	V910 E920 D923	F848-V910 HydrophobicContact CD1-CB 4.43Å; F848-V910 HydrophobicContact CD1-CG1 3.4Å; F848-V910 VanDerWaalsContact CD1-CG1 3.4Å; F848-V910 HydrophobicContact CE1-CG1 3.36Å; F848-E920 HydrophobicContact CD1-CG 4.49Å; F848-E920 HydrophobicContact CD2-CB 3.96Å; F848-E920 HydrophobicContact CD2-CG 3.7Å; F848-E920 WeakPolarHBondContact CD2-OE1 3.3Å; F848-E920 HydrophobicContact CE1-CG 4.4Å; F848-E920 HydrophobicContact CE2-CB 3.44Å; F848-E920 VanDerWaalsContact CE2-CB 3.44Å; F848-E920 HydrophobicContact CE2-CG 3.62Å; F848-E920 HydrophobicContact CG-CG 4.18Å; F848-E920 HydrophobicContact CZ-CB 3.92Å; F848-E920 HydrophobicContact CZ-CG 3.99Å; F848-E920 PolarHBondContact N-OE1 2.96Å; F848-D923 HydrophobicContact CE1-CB 4.28Å; F848-D923 HydrophobicContact CZ-CB 4.25Å
849	S	77.8	Confident	86.8	Confident	88 Å²	88	57 Å²	57	62%	0.615	30%	0.297	S	S	*	.	S	Bend	trans	-77.8	139.2	172.9	71.7	0	0	0	0	111.4	H847 S851	H847-S849 VanDerWaalsContact C-N 3.25Å; H847-S849 PolarHBondContact O-N 3.43Å; S849-S851 PolarHBondContact O-N 3.49Å
850	C	80.8	Confident	86.7	Confident	57 Å²	57	56 Å²	56	39%	0.385	29%	0.288	S	S	.	.			trans	-68.7	105.1	-178.6	-152.8	0	0	0	0	111.2	I855 R907	C850-I855 HydrophobicContact CB-CD1 4.26Å; C850-I855 HydrophobicContact CB-CG1 4.36Å; C850-I855 WeakPolarHBondContact SG-CG1 3.32Å; C850-R907 VanDerWaalsContact SG-CZ 3.59Å; C850-R907 PolarHBondContact SG-NH1 2.63Å; C850-R907 PolarHBondContact SG-NH2 2.9Å
851	S	85	Confident	86.9	Confident	28 Å²	28	53.5 Å²	53.5	20%	0.196	27%	0.273	C	S	.	.			trans	-64.3	141.5	173.9	178.8	0	0	0	0	110.2	S849 M853 E854 I855	S849-S851 PolarHBondContact O-N 3.49Å; S851-M853 PolarHBondContact O-N 3.25Å; S851-M853 VanDerWaalsContact O-N 3.16Å; S851-M853 PolarHBondContact OG-N 3.26Å; S851-E854 WeakPolarHBondContact O-CB 3.3Å; S851-E854 PolarHBondContact O-N 3.37Å; S851-I855 PolarHBondContact O-N 3.39Å; S851-I855 VanDerWaalsContact O-N 3.13Å
852	R	88	Confident	86.9	Confident	215 Å²	215	57.9 Å²	57.9	81%	0.811	30%	0.296	S	S	*	.	H	α-helix	trans	-54.4	-36.9	176.3	-65.3	-177.9	-175.9	172.9	2	111.4	I855 V856	R852-I855 PolarHBondContact O-N 2.8Å; R852-V856 WeakPolarHBondContact O-CG2 3.46Å; R852-V856 PolarHBondContact O-N 3.35Å; R852-V856 VanDerWaalsContact O-N 3.09Å
853	M	89.4	Confident	87	Confident	78 Å²	78	57.8 Å²	57.8	38%	0.384	30%	0.295	S	S	.	.	H	α-helix	trans	-67.6	-36.5	179	-61.9	-61	-83	0	0	112	L837 V841 S851 V856 S857	L837-M853 HydrophobicContact CD1-CE 3.26Å; L837-M853 HydrophobicContact CD1-SD 4.3Å; L837-M853 HydrophobicContact CG-CE 4.41Å; V841-M853 HydrophobicContact CG2-CB 3.81Å; S851-M853 PolarHBondContact O-N 3.25Å; S851-M853 VanDerWaalsContact O-N 3.16Å; S851-M853 PolarHBondContact OG-N 3.26Å; M853-V856 PolarHBondContact O-N 3.27Å; M853-S857 PolarHBondContact O-N 2.97Å
854	E	90.3	Very high	87.2	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-47.7	175.1	-168.7	-166.8	166.2	0	0	110.4	V841 S851 V856 S857 L858 R907 Y933	V841-E854 HydrophobicContact CG1-CB 3.9Å; V841-E854 HydrophobicContact CG1-CG 3.89Å; S851-E854 WeakPolarHBondContact O-CB 3.3Å; S851-E854 PolarHBondContact O-N 3.37Å; E854-V856 VanDerWaalsContact C-N 3.27Å; E854-V856 PolarHBondContact O-N 3.22Å; E854-S857 WeakPolarHBondContact CA-OG 3.35Å; E854-S857 CarbonylContact O-C 3.6Å; E854-S857 PolarHBondContact O-N 2.87Å; E854-S857 PolarHBondContact O-OG 3.31Å; E854-L858 HydrophobicContact CG-CD1 3.97Å; E854-L858 HydrophobicContact CG-CG 4.32Å; E854-L858 WeakPolarHBondContact O-CG 3.48Å; E854-L858 PolarHBondContact O-N 2.92Å; E854-R907 WeakPolarHBondContact OE1-CD 3.47Å; E854-R907 IonicContact OE1-CZ 3.48Å; E854-R907 VanDerWaalsContact OE1-CZ 3.3Å; E854-R907 IonicContact OE1-NE 2.8Å; E854-R907 PolarHBondContact OE1-NE 3.24Å; E854-R907 IonicContact OE1-NH1 3.8Å; E854-R907 PolarHBondContact OE1-NH1 2.89Å; E854-R907 IonicContact OE2-CZ 2.8Å; E854-R907 IonicContact OE2-NE 3.18Å; E854-R907 PolarHBondContact OE2-NE 3.39Å; E854-R907 IonicContact OE2-NH1 3.53Å; E854-R907 PolarHBondContact OE2-NH1 2.87Å; E854-R907 IonicContact OE2-NH2 3.37Å; E854-Y933 PolarHBondContact OE1-OH 3.4Å; E854-Y933 VanDerWaalsContact OE1-OH 3.05Å
855	I	89.3	Confident	87.6	Confident	94 Å²	94	48 Å²	48	48%	0.482	25%	0.254	S	S	.	.	H	α-helix	trans	-56.3	-44.3	177.2	-60.7	172.5	0	0	0	110.7	C850 S851 R852 L858 S859	C850-I855 HydrophobicContact CB-CD1 4.26Å; C850-I855 HydrophobicContact CB-CG1 4.36Å; C850-I855 WeakPolarHBondContact SG-CG1 3.32Å; S851-I855 PolarHBondContact O-N 3.39Å; S851-I855 VanDerWaalsContact O-N 3.13Å; R852-I855 PolarHBondContact O-N 2.8Å; I855-L858 PolarHBondContact O-N 3.46Å; I855-S859 PolarHBondContact O-N 3.39Å
856	V	91.5	Very high	87.9	Confident	64 Å²	64	49.8 Å²	49.8	39%	0.388	26%	0.259	S	S	.	.	H	α-helix	trans	-61.3	-47.4	175.9	175.7	0	0	0	0	110.3	L837 R852 M853 E854 L858 S859 Y860	L837-V856 HydrophobicContact CD2-CB 4.22Å; L837-V856 HydrophobicContact CD2-CG1 3.72Å; R852-V856 WeakPolarHBondContact O-CG2 3.46Å; R852-V856 PolarHBondContact O-N 3.35Å; R852-V856 VanDerWaalsContact O-N 3.09Å; M853-V856 PolarHBondContact O-N 3.27Å; E854-V856 VanDerWaalsContact C-N 3.27Å; E854-V856 PolarHBondContact O-N 3.22Å; V856-L858 PolarHBondContact O-N 2.97Å; V856-S859 WeakPolarHBondContact O-CB 3.28Å; V856-S859 PolarHBondContact O-N 3.1Å; V856-S859 VanDerWaalsContact O-N 3.14Å; V856-S859 PolarHBondContact O-OG 3.05Å; V856-Y860 HydrophobicContact CG1-CD2 4.34Å; V856-Y860 HydrophobicContact CG1-CE2 4.11Å; V856-Y860 WeakPolarHBondContact O-CD2 3.42Å; V856-Y860 PolarHBondContact O-N 3.44Å
857	S	91.7	Very high	88.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-38.6	178.7	71.8	0	0	0	0	113.4	M853 E854 S859 Y860 V861	M853-S857 PolarHBondContact O-N 2.97Å; E854-S857 WeakPolarHBondContact CA-OG 3.35Å; E854-S857 CarbonylContact O-C 3.6Å; E854-S857 PolarHBondContact O-N 2.87Å; E854-S857 PolarHBondContact O-OG 3.31Å; S857-S859 VanDerWaalsContact C-N 3.3Å; S857-S859 PolarHBondContact O-N 3.39Å; S857-Y860 VanDerWaalsContact O-CB 3.31Å; S857-Y860 WeakPolarHBondContact O-CB 3Å; S857-Y860 PolarHBondContact O-N 2.73Å; S857-Y860 VanDerWaalsContact O-N 3.13Å; S857-V861 PolarHBondContact O-N 3.31Å; S857-V861 VanDerWaalsContact O-N 3.13Å
858	L	91.6	Very high	88.4	Confident	29 Å²	29	46.9 Å²	46.9	15%	0.152	25%	0.246	C	C	.	.	H	α-helix	trans	-67.5	-32.8	174.8	-69.4	170.6	0	0	0	111.4	E854 I855 V856 Y860 V861 L862 F904	E854-L858 HydrophobicContact CG-CD1 3.97Å; E854-L858 HydrophobicContact CG-CG 4.32Å; E854-L858 WeakPolarHBondContact O-CG 3.48Å; E854-L858 PolarHBondContact O-N 2.92Å; I855-L858 PolarHBondContact O-N 3.46Å; V856-L858 PolarHBondContact O-N 2.97Å; L858-Y860 VanDerWaalsContact C-N 3.28Å; L858-Y860 PolarHBondContact O-N 3.45Å; L858-V861 PolarHBondContact O-N 3.12Å; L858-L862 WeakPolarHBondContact O-CB 3.37Å; L858-L862 PolarHBondContact O-N 3.02Å; L858-F904 HydrophobicContact CD1-CD2 3.47Å; L858-F904 VanDerWaalsContact CD1-CD2 3.47Å; L858-F904 HydrophobicContact CD1-CE2 3.61Å; L858-F904 HydrophobicContact CD2-CB 4.48Å; L858-F904 HydrophobicContact CD2-CD2 4.17Å; L858-F904 HydrophobicContact CG-CD2 4.47Å
859	S	91	Very high	88.8	Confident	42 Å²	42	50 Å²	50	29%	0.294	26%	0.263	S	S	.	.	H	α-helix	trans	-64	-33.3	172.2	83.3	0	0	0	0	112.3	I855 V856 S857 G863 P1126	I855-S859 PolarHBondContact O-N 3.39Å; V856-S859 WeakPolarHBondContact O-CB 3.28Å; V856-S859 PolarHBondContact O-N 3.1Å; V856-S859 VanDerWaalsContact O-N 3.14Å; V856-S859 PolarHBondContact O-OG 3.05Å; S857-S859 VanDerWaalsContact C-N 3.3Å; S857-S859 PolarHBondContact O-N 3.39Å; S859-G863 PolarHBondContact O-N 2.98Å; S859-P1126 WeakPolarHBondContact O-CB 3.38Å
860	Y	92.7	Very high	89.1	Confident	15 Å²	15	48 Å²	48	6%	0.059	24%	0.242	C	C	.	.	H	α-helix	trans	-65.5	-47.7	171.3	-86.7	-95.9	0	0	0	111.1	F830 L833 F834 L837 V856 S857 L858 L862 G863 Y864 P1125 P1126	F830-Y860 HydrophobicContact CB-CE1 4.49Å; F830-Y860 HydrophobicContact CD1-CE1 4.23Å; L833-Y860 WeakPolarHBondContact CD2-OH 3.3Å; F834-Y860 HydrophobicContact CB-CD1 3.59Å; F834-Y860 HydrophobicContact CB-CE1 3.86Å; F834-Y860 HydrophobicContact CB-CG 4.07Å; F834-Y860 AromaticContact CD2-CD1 4Å; F834-Y860 HydrophobicContact CD2-CD1 4Å; F834-Y860 HydrophobicContact CD2-CD2 4.3Å; F834-Y860 AromaticContact CD2-CG 3.64Å; F834-Y860 HydrophobicContact CD2-CG 3.64Å; F834-Y860 HydrophobicContact CG-CD1 4.04Å; F834-Y860 HydrophobicContact CG-CG 4.17Å; L837-Y860 HydrophobicContact CD2-CD2 4.48Å; L837-Y860 HydrophobicContact CD2-CE2 4.46Å; V856-Y860 HydrophobicContact CG1-CD2 4.34Å; V856-Y860 HydrophobicContact CG1-CE2 4.11Å; V856-Y860 WeakPolarHBondContact O-CD2 3.42Å; V856-Y860 PolarHBondContact O-N 3.44Å; S857-Y860 VanDerWaalsContact O-CB 3.31Å; S857-Y860 WeakPolarHBondContact O-CB 3Å; S857-Y860 PolarHBondContact O-N 2.73Å; S857-Y860 VanDerWaalsContact O-N 3.13Å; L858-Y860 VanDerWaalsContact C-N 3.28Å; L858-Y860 PolarHBondContact O-N 3.45Å; Y860-L862 VanDerWaalsContact C-N 3.3Å; Y860-L862 PolarHBondContact O-N 3.42Å; Y860-G863 CarbonylContact O-C 3.54Å; Y860-G863 WeakPolarHBondContact O-CA 3.35Å; Y860-G863 PolarHBondContact O-N 3.15Å; Y860-Y864 WeakPolarHBondContact O-CD2 3.37Å; Y860-Y864 PolarHBondContact O-N 2.99Å; Y860-P1125 WeakPolarHBondContact CD1-O 3.02Å; Y860-P1125 WeakPolarHBondContact CE1-O 3.17Å; Y860-P1126 HydrophobicContact CD2-CG 4.22Å; Y860-P1126 VanDerWaalsContact CE1-CD 3.48Å; Y860-P1126 HydrophobicContact CE2-CG 4.13Å; Y860-P1126 HydrophobicContact CG-CG 4.5Å; Y860-P1126 VanDerWaalsContact CZ-CD 3.45Å
861	V	93.7	Very high	89.2	Confident	10 Å²	10	46.4 Å²	46.4	6%	0.061	23%	0.229	C	C	.	.	H	α-helix	trans	-57.9	-44.4	177.1	177.4	0	0	0	0	110.7	F834 S857 L858 G863 Y864 A865 T900 F940	F834-V861 HydrophobicContact CE2-CG2 3.98Å; F834-V861 HydrophobicContact CZ-CG2 3.96Å; S857-V861 PolarHBondContact O-N 3.31Å; S857-V861 VanDerWaalsContact O-N 3.13Å; L858-V861 PolarHBondContact O-N 3.12Å; V861-G863 VanDerWaalsContact C-N 3.32Å; V861-G863 PolarHBondContact O-N 2.88Å; V861-Y864 WeakPolarHBondContact O-CB 3.43Å; V861-Y864 PolarHBondContact O-N 3.46Å; V861-A865 PolarHBondContact O-N 3.35Å; V861-T900 WeakPolarHBondContact CG1-OG1 3.43Å; V861-F940 HydrophobicContact CG2-CE2 4.24Å; V861-F940 HydrophobicContact CG2-CZ 4.39Å
862	L	91.2	Very high	89	Confident	92 Å²	92	47.6 Å²	47.6	48%	0.482	23%	0.233	S	C	.	.	H	α-helix	trans	-62.6	-39.7	175	-174.6	65.4	0	0	0	111.8	L858 Y860 A865 F866	L858-L862 WeakPolarHBondContact O-CB 3.37Å; L858-L862 PolarHBondContact O-N 3.02Å; Y860-L862 VanDerWaalsContact C-N 3.3Å; Y860-L862 PolarHBondContact O-N 3.42Å; L862-A865 PolarHBondContact O-N 3.02Å; L862-F866 HydrophobicContact CD1-CD2 4.21Å; L862-F866 HydrophobicContact CD1-CE2 3.7Å; L862-F866 HydrophobicContact CD1-CZ 3.95Å; L862-F866 HydrophobicContact CD2-CE2 3.86Å; L862-F866 HydrophobicContact CG-CD2 3.87Å; L862-F866 HydrophobicContact CG-CE2 3.49Å; L862-F866 VanDerWaalsContact CG-CE2 3.49Å; L862-F866 HydrophobicContact CG-CZ 4.23Å; L862-F866 VanDerWaalsContact O-CD2 3.23Å; L862-F866 WeakPolarHBondContact O-CD2 3.48Å; L862-F866 PolarHBondContact O-N 3.01Å
863	G	91.4	Very high	88.6	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-37.9	173.6	0	0	0	0	0	113.5	S859 Y860 V861 E867	S859-G863 PolarHBondContact O-N 2.98Å; Y860-G863 CarbonylContact O-C 3.54Å; Y860-G863 WeakPolarHBondContact O-CA 3.35Å; Y860-G863 PolarHBondContact O-N 3.15Å; V861-G863 VanDerWaalsContact C-N 3.32Å; V861-G863 PolarHBondContact O-N 2.88Å; G863-E867 PolarHBondContact O-N 2.86Å; G863-E867 VanDerWaalsContact O-N 3.16Å
864	Y	91.4	Very high	87.9	Confident	26 Å²	26	41.5 Å²	41.5	10%	0.102	22%	0.217	C	C	.	.	H	α-helix	trans	-66.2	-46.4	170.6	-72	-62.3	0	0	0	111.2	H831 F834 Y860 V861 F866 E867 E868 F940 P1125	H831-Y864 WeakPolarHBondContact CA-OH 3.42Å; H831-Y864 AromaticContact ND1-CZ 3.66Å; H831-Y864 PolarHBondContact ND1-OH 3.05Å; F834-Y864 AromaticContact CD1-CE2 3.75Å; F834-Y864 HydrophobicContact CD1-CE2 3.75Å; F834-Y864 AromaticContact CE1-CE2 3.89Å; F834-Y864 HydrophobicContact CE1-CE2 3.89Å; F834-Y864 HydrophobicContact CG-CE2 4.06Å; F834-Y864 HydrophobicContact CZ-CE2 4.33Å; Y860-Y864 WeakPolarHBondContact O-CD2 3.37Å; Y860-Y864 PolarHBondContact O-N 2.99Å; V861-Y864 WeakPolarHBondContact O-CB 3.43Å; V861-Y864 PolarHBondContact O-N 3.46Å; Y864-F866 VanDerWaalsContact C-N 3.29Å; Y864-F866 PolarHBondContact O-N 3.43Å; Y864-E867 PolarHBondContact O-N 2.9Å; Y864-E868 WeakPolarHBondContact O-CG 3.48Å; Y864-E868 PolarHBondContact O-N 3.45Å; Y864-F940 HydrophobicContact CD2-CE1 4.33Å; Y864-P1125 HydrophobicContact CD1-CB 4.37Å; Y864-P1125 HydrophobicContact CD1-CG 3.89Å; Y864-P1125 HydrophobicContact CE1-CB 4.31Å; Y864-P1125 HydrophobicContact CE1-CG 3.87Å; Y864-P1125 HydrophobicContact CG-CG 4.48Å
865	A	90.8	Very high	87.1	Confident	27 Å²	27	44.2 Å²	44.2	22%	0.223	23%	0.229	C	C	.	.	H	α-helix	trans	-56.7	-42.2	178	0	0	0	0	0	112.3	V861 L862 L869 I897	V861-A865 PolarHBondContact O-N 3.35Å; L862-A865 PolarHBondContact O-N 3.02Å; A865-L869 WeakPolarHBondContact O-CB 3.44Å; A865-L869 PolarHBondContact O-N 2.58Å; A865-I897 HydrophobicContact CB-CD1 4.37Å; A865-I897 HydrophobicContact CB-CG2 3.85Å
866	F	89.6	Confident	86.3	Confident	84 Å²	84	41.9 Å²	41.9	37%	0.368	22%	0.224	S	C	.	.	H	α-helix	trans	-69.4	-33.4	175.3	-72.9	-48.1	0	0	0	113.6	L862 Y864 L869 R870 T1129 I1132	L862-F866 HydrophobicContact CD1-CD2 4.21Å; L862-F866 HydrophobicContact CD1-CE2 3.7Å; L862-F866 HydrophobicContact CD1-CZ 3.95Å; L862-F866 HydrophobicContact CD2-CE2 3.86Å; L862-F866 HydrophobicContact CG-CD2 3.87Å; L862-F866 HydrophobicContact CG-CE2 3.49Å; L862-F866 VanDerWaalsContact CG-CE2 3.49Å; L862-F866 HydrophobicContact CG-CZ 4.23Å; L862-F866 VanDerWaalsContact O-CD2 3.23Å; L862-F866 WeakPolarHBondContact O-CD2 3.48Å; L862-F866 PolarHBondContact O-N 3.01Å; Y864-F866 VanDerWaalsContact C-N 3.29Å; Y864-F866 PolarHBondContact O-N 3.43Å; F866-L869 HydrophobicContact CD1-CD2 4.42Å; F866-R870 VanDerWaalsContact O-CB 3.27Å; F866-R870 WeakPolarHBondContact O-CB 3.4Å; F866-R870 PolarHBondContact O-N 2.94Å; F866-T1129 HydrophobicContact CD2-CG2 3.45Å; F866-T1129 VanDerWaalsContact CD2-CG2 3.45Å; F866-T1129 HydrophobicContact CE2-CG2 3.97Å; F866-T1129 HydrophobicContact CG-CG2 4.45Å; F866-I1132 HydrophobicContact CB-CD1 4.05Å
867	E	86.3	Confident	85.1	Confident	3 Å²	3	42.8 Å²	42.8	1%	0.014	23%	0.233	C	C	.	.	H	α-helix	trans	-68.5	-44.1	174.8	-172.3	54.9	-162.5	0	0	111.5	G863 Y864 R870 Q871 N1128	G863-E867 PolarHBondContact O-N 2.86Å; G863-E867 VanDerWaalsContact O-N 3.16Å; Y864-E867 PolarHBondContact O-N 2.9Å; E867-R870 WeakPolarHBondContact O-CB 3.36Å; E867-R870 PolarHBondContact O-N 3.24Å; E867-R870 IonicContact OE1-CZ 3.84Å; E867-R870 IonicContact OE1-NE 3.65Å; E867-R870 PolarHBondContact OE1-NE 3.16Å; E867-R870 IonicContact OE1-NH2 3.68Å; E867-R870 PolarHBondContact OE1-NH2 3.2Å; E867-R870 IonicContact OE2-CZ 2.87Å; E867-R870 IonicContact OE2-NE 2.73Å; E867-R870 PolarHBondContact OE2-NE 3.48Å; E867-R870 IonicContact OE2-NH2 3.46Å; E867-Q871 WeakPolarHBondContact O-CG 3.36Å; E867-Q871 PolarHBondContact O-N 2.9Å; E867-Q871 PolarHBondContact OE1-NE2 3.21Å; E867-N1128 WeakPolarHBondContact CB-ND2 3.29Å; E867-N1128 PolarHBondContact OE2-ND2 3.24Å
868	E	87.6	Confident	83.8	Confident	12 Å²	12	48.7 Å²	48.7	6%	0.056	26%	0.255	C	S	.	.	H	α-helix	trans	-64.7	-41.7	175.9	-65.2	-51	132.6	0	0	111	Y864 R870 Q871 L872 Y884 D893 I897	Y864-E868 WeakPolarHBondContact O-CG 3.48Å; Y864-E868 PolarHBondContact O-N 3.45Å; E868-R870 VanDerWaalsContact C-N 3.33Å; E868-R870 PolarHBondContact O-N 3.12Å; E868-Q871 PolarHBondContact O-N 3.17Å; E868-L872 VanDerWaalsContact O-CB 3.28Å; E868-L872 WeakPolarHBondContact O-CB 3.39Å; E868-L872 PolarHBondContact O-N 3.33Å; E868-Y884 PolarHBondContact OE2-OH 3.25Å; E868-D893 HydrophobicContact CG-CB 4.37Å; E868-I897 HydrophobicContact CB-CD1 4.47Å; E868-I897 HydrophobicContact CG-CD1 3.98Å
869	L	85	Confident	82.1	Confident	86 Å²	86	55.1 Å²	55.1	45%	0.45	29%	0.29	S	S	.	.	H	α-helix	trans	-61.3	-41.5	173.8	-178.1	62.8	0	0	0	111.7	A865 F866 L872 I873	A865-L869 WeakPolarHBondContact O-CB 3.44Å; A865-L869 PolarHBondContact O-N 2.58Å; F866-L869 HydrophobicContact CD1-CD2 4.42Å; L869-L872 HydrophobicContact CD1-CD2 4.41Å; L869-L872 PolarHBondContact O-N 3.22Å; L869-I873 HydrophobicContact CD1-CD1 4.15Å; L869-I873 HydrophobicContact CD1-CG1 4.39Å; L869-I873 HydrophobicContact CG-CD1 3.92Å; L869-I873 WeakPolarHBondContact O-CB 3.36Å; L869-I873 WeakPolarHBondContact O-CD1 3.41Å; L869-I873 WeakPolarHBondContact O-CG1 3.45Å; L869-I873 PolarHBondContact O-N 2.7Å
870	R	84	Confident	80.7	Confident	46 Å²	46	53.8 Å²	53.8	17%	0.174	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-44.9	176.2	-173.3	-173	79.4	96.4	7	111.3	F866 E867 E868 I873 L874 E1119 I1132	F866-R870 VanDerWaalsContact O-CB 3.27Å; F866-R870 WeakPolarHBondContact O-CB 3.4Å; F866-R870 PolarHBondContact O-N 2.94Å; E867-R870 WeakPolarHBondContact O-CB 3.36Å; E867-R870 PolarHBondContact O-N 3.24Å; E867-R870 IonicContact OE1-CZ 3.84Å; E867-R870 IonicContact OE1-NE 3.65Å; E867-R870 PolarHBondContact OE1-NE 3.16Å; E867-R870 IonicContact OE1-NH2 3.68Å; E867-R870 PolarHBondContact OE1-NH2 3.2Å; E867-R870 IonicContact OE2-CZ 2.87Å; E867-R870 IonicContact OE2-NE 2.73Å; E867-R870 PolarHBondContact OE2-NE 3.48Å; E867-R870 IonicContact OE2-NH2 3.46Å; E868-R870 VanDerWaalsContact C-N 3.33Å; E868-R870 PolarHBondContact O-N 3.12Å; R870-I873 PolarHBondContact O-N 3.21Å; R870-L874 WeakPolarHBondContact O-CB 3.45Å; R870-L874 PolarHBondContact O-N 2.85Å; R870-E1119 PolarHBondContact NH1-O 3.45Å; R870-E1119 PolarHBondContact NH2-O 3.04Å; R870-I1132 HydrophobicContact CB-CD1 4.38Å
871	Q	81.3	Confident	79.4	Confident	23 Å²	23	58 Å²	58	11%	0.107	30%	0.302	C	S	.	.	H	α-helix	trans	-63.3	-45.2	176.9	-71.7	179.7	24.2	0	0	111.1	E867 E868 I873 L874 E875 Y884	E867-Q871 WeakPolarHBondContact O-CG 3.36Å; E867-Q871 PolarHBondContact O-N 2.9Å; E867-Q871 PolarHBondContact OE1-NE2 3.21Å; E868-Q871 PolarHBondContact O-N 3.17Å; Q871-I873 PolarHBondContact O-N 3.28Å; Q871-L874 PolarHBondContact O-N 3.04Å; Q871-E875 WeakPolarHBondContact O-CB 3.5Å; Q871-E875 WeakPolarHBondContact O-CG 3.48Å; Q871-E875 PolarHBondContact O-N 3.12Å; Q871-Y884 HydrophobicContact CB-CE2 4.47Å
872	L	82	Confident	77.9	Confident	53 Å²	53	61.9 Å²	61.9	28%	0.277	33%	0.329	S	S	.	.	H	α-helix	trans	-58.7	-44.5	175.8	-173.9	119.2	0	0	0	111.9	E868 L869 E875 A876 F881 Y884	E868-L872 VanDerWaalsContact O-CB 3.28Å; E868-L872 WeakPolarHBondContact O-CB 3.39Å; E868-L872 PolarHBondContact O-N 3.33Å; L869-L872 HydrophobicContact CD1-CD2 4.41Å; L869-L872 PolarHBondContact O-N 3.22Å; L872-E875 PolarHBondContact O-N 3.45Å; L872-A876 WeakPolarHBondContact O-CB 3.31Å; L872-A876 PolarHBondContact O-N 2.83Å; L872-F881 HydrophobicContact CD1-CE2 4Å; L872-F881 HydrophobicContact CG-CE2 4.45Å; L872-Y884 HydrophobicContact CD1-CD1 3.89Å; L872-Y884 HydrophobicContact CD1-CE1 3.63Å
873	I	79.6	Confident	76.8	Confident	102 Å²	102	61.9 Å²	61.9	52%	0.523	33%	0.329	S	S	.	.	H	α-helix	trans	-64.7	-42.4	176.4	-69	164.8	0	0	0	111.1	L869 R870 Q871 S877	L869-I873 HydrophobicContact CD1-CD1 4.15Å; L869-I873 HydrophobicContact CD1-CG1 4.39Å; L869-I873 HydrophobicContact CG-CD1 3.92Å; L869-I873 WeakPolarHBondContact O-CB 3.36Å; L869-I873 WeakPolarHBondContact O-CD1 3.41Å; L869-I873 WeakPolarHBondContact O-CG1 3.45Å; L869-I873 PolarHBondContact O-N 2.7Å; R870-I873 PolarHBondContact O-N 3.21Å; Q871-I873 PolarHBondContact O-N 3.28Å; I873-S877 WeakPolarHBondContact O-CB 3.48Å; I873-S877 PolarHBondContact O-N 3.23Å
874	L	73.9	Confident	75.9	Confident	64 Å²	64	62.3 Å²	62.3	34%	0.335	33%	0.331	S	S	.	.	H	α-helix	trans	-65.3	-40.7	179.8	-170	70.6	0	0	0	111.4	R870 Q871 S877 R878	R870-L874 WeakPolarHBondContact O-CB 3.45Å; R870-L874 PolarHBondContact O-N 2.85Å; Q871-L874 PolarHBondContact O-N 3.04Å; L874-S877 PolarHBondContact O-OG 3.38Å; L874-R878 WeakPolarHBondContact O-CG 3.31Å; L874-R878 PolarHBondContact O-N 3.05Å
875	E	73.7	Confident	74.9	Confident	57 Å²	57	64.1 Å²	64.1	27%	0.266	34%	0.342	S	S	.	.	H	α-helix	trans	-76.4	-38	178.5	-68.6	-168.1	171.8	0	0	112.7	Q871 L872 S877 R878 D879 G880 Y884	Q871-E875 WeakPolarHBondContact O-CB 3.5Å; Q871-E875 WeakPolarHBondContact O-CG 3.48Å; Q871-E875 PolarHBondContact O-N 3.12Å; L872-E875 PolarHBondContact O-N 3.45Å; E875-S877 VanDerWaalsContact C-N 3.26Å; E875-S877 PolarHBondContact O-N 3.37Å; E875-R878 CarbonylContact O-C 3.56Å; E875-R878 WeakPolarHBondContact O-CA 3.23Å; E875-R878 PolarHBondContact O-N 3.39Å; E875-D879 PolarHBondContact O-N 3.12Å; E875-G880 PolarHBondContact O-N 2.95Å; E875-Y884 WeakPolarHBondContact OE2-CA 3.11Å; E875-Y884 WeakPolarHBondContact OE2-CB 3.48Å; E875-Y884 WeakPolarHBondContact OE2-CD2 3.5Å
876	A	72.6	Confident	73.8	Confident	44 Å²	44	71 Å²	71	36%	0.364	36%	0.362	S	S	.	.	H	α-helix	trans	-59.8	-39	170.7	0	0	0	0	0	111.2	L872 R878 D879	L872-A876 WeakPolarHBondContact O-CB 3.31Å; L872-A876 PolarHBondContact O-N 2.83Å; A876-R878 PolarHBondContact O-N 3.39Å; A876-D879 PolarHBondContact O-N 2.88Å
877	S	65.7	Low	73.1	Confident	84 Å²	84	69.1 Å²	69.1	59%	0.587	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-16.8	175.1	80.9	0	0	0	0	114.2	I873 L874 E875	I873-S877 WeakPolarHBondContact O-CB 3.48Å; I873-S877 PolarHBondContact O-N 3.23Å; L874-S877 PolarHBondContact O-OG 3.38Å; E875-S877 VanDerWaalsContact C-N 3.26Å; E875-S877 PolarHBondContact O-N 3.37Å
878	R	65.6	Low	72.7	Confident	124 Å²	124	71.1 Å²	71.1	47%	0.468	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	13.4	178.5	-74.2	172.1	157	166.9	-5.5	112.2	L874 E875 A876 G880 E1119	L874-R878 WeakPolarHBondContact O-CG 3.31Å; L874-R878 PolarHBondContact O-N 3.05Å; E875-R878 CarbonylContact O-C 3.56Å; E875-R878 WeakPolarHBondContact O-CA 3.23Å; E875-R878 PolarHBondContact O-N 3.39Å; A876-R878 PolarHBondContact O-N 3.39Å; R878-G880 PolarHBondContact O-N 3.33Å; R878-G880 VanDerWaalsContact O-N 3.13Å; R878-E1119 IonicContact NH1-OE1 2.79Å; R878-E1119 IonicContact NH1-OE2 3.3Å; R878-E1119 PolarHBondContact NH1-OE2 3.39Å; R878-E1119 IonicContact NH2-OE1 3.3Å; R878-E1119 PolarHBondContact NH2-OE1 3.37Å
879	D	54.8	Low	72.5	Confident	163 Å²	163	74.1 Å²	74.1	87%	0.872	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	24	-171.2	-61.3	-39.6	0	0	0	113.3	E875 A876	E875-D879 PolarHBondContact O-N 3.12Å; A876-D879 PolarHBondContact O-N 2.88Å
880	G	63	Low	72.5	Confident	14 Å²	14	70.7 Å²	70.7	14%	0.144	37%	0.371	C	S	.	.			trans	-100.9	17.2	-171.5	0	0	0	0	0	114.7	E875 R878 S882 D883 Y884	E875-G880 PolarHBondContact O-N 2.95Å; R878-G880 PolarHBondContact O-N 3.33Å; R878-G880 VanDerWaalsContact O-N 3.13Å; G880-S882 PolarHBondContact O-N 3.4Å; G880-S882 VanDerWaalsContact O-N 3.12Å; G880-D883 PolarHBondContact O-N 2.99Å; G880-Y884 PolarHBondContact O-N 3.15Å
881	F	65.1	Low	72.6	Confident	105 Å²	105	73.7 Å²	73.7	46%	0.461	38%	0.382	S	S	.	.	H	α-helix	trans	-54.9	-34.6	-175.1	-172.4	-106.3	0	0	0	113.3	L872 D883 Y884 L885	L872-F881 HydrophobicContact CD1-CE2 4Å; L872-F881 HydrophobicContact CG-CE2 4.45Å; F881-D883 VanDerWaalsContact C-N 3.35Å; F881-D883 PolarHBondContact O-N 2.94Å; F881-Y884 PolarHBondContact O-N 2.68Å; F881-L885 HydrophobicContact CD1-CD1 3.78Å; F881-L885 HydrophobicContact CD1-CG 4.35Å; F881-L885 HydrophobicContact CE1-CD1 3.32Å; F881-L885 HydrophobicContact CE1-CG 4.03Å; F881-L885 HydrophobicContact CZ-CD1 3.92Å; F881-L885 HydrophobicContact CZ-CD2 4.42Å; F881-L885 HydrophobicContact CZ-CG 4.25Å; F881-L885 PolarHBondContact O-N 3.36Å
882	S	61.5	Low	73	Confident	90 Å²	90	74.7 Å²	74.7	63%	0.629	39%	0.388	S	S	*	.	H	α-helix	trans	-66.2	-34	175.7	-178.8	0	0	0	0	113.2	G880 R886	G880-S882 PolarHBondContact O-N 3.4Å; G880-S882 VanDerWaalsContact O-N 3.12Å; S882-R886 WeakPolarHBondContact O-CB 3.31Å; S882-R886 PolarHBondContact O-N 3.08Å; S882-R886 VanDerWaalsContact O-N 3.13Å
883	D	67.2	Low	73.3	Confident	92 Å²	92	72.6 Å²	72.6	49%	0.492	38%	0.377	S	S	.	.	H	α-helix	trans	-71.4	-38.8	178.6	-77.8	-27.8	0	0	0	110.6	G880 F881 R886	G880-D883 PolarHBondContact O-N 2.99Å; F881-D883 VanDerWaalsContact C-N 3.35Å; F881-D883 PolarHBondContact O-N 2.94Å; D883-R886 PolarHBondContact O-N 3.42Å
884	Y	73.6	Confident	73.9	Confident	9 Å²	9	70 Å²	70	4%	0.035	37%	0.365	C	S	.	.	H	α-helix	trans	-56.2	-51.9	172.1	-174	-97.7	0	0	0	111.6	E868 Q871 L872 E875 G880 F881 R886 D887 N890	E868-Y884 PolarHBondContact OE2-OH 3.25Å; Q871-Y884 HydrophobicContact CB-CE2 4.47Å; L872-Y884 HydrophobicContact CD1-CD1 3.89Å; L872-Y884 HydrophobicContact CD1-CE1 3.63Å; E875-Y884 WeakPolarHBondContact OE2-CA 3.11Å; E875-Y884 WeakPolarHBondContact OE2-CB 3.48Å; E875-Y884 WeakPolarHBondContact OE2-CD2 3.5Å; G880-Y884 PolarHBondContact O-N 3.15Å; F881-Y884 PolarHBondContact O-N 2.68Å; Y884-R886 PolarHBondContact O-N 2.8Å; Y884-D887 PolarHBondContact O-N 3.43Å; Y884-N890 WeakPolarHBondContact CD2-ND2 3.21Å; Y884-N890 HydrophobicContact CE1-CB 4.11Å; Y884-N890 HydrophobicContact CE2-CB 4.01Å; Y884-N890 VanDerWaalsContact CE2-ND2 3.28Å; Y884-N890 WeakPolarHBondContact CE2-ND2 3.35Å; Y884-N890 PolarHBondContact O-ND2 3.41Å
885	L	70.2	Confident	74.8	Confident	65 Å²	65	71.9 Å²	71.9	34%	0.34	37%	0.371	S	S	.	.	H	α-helix	trans	-68.3	-20.5	-177	-71	-178.4	0	0	0	113.3	F881 D887 W891	F881-L885 HydrophobicContact CD1-CD1 3.78Å; F881-L885 HydrophobicContact CD1-CG 4.35Å; F881-L885 HydrophobicContact CE1-CD1 3.32Å; F881-L885 HydrophobicContact CE1-CG 4.03Å; F881-L885 HydrophobicContact CZ-CD1 3.92Å; F881-L885 HydrophobicContact CZ-CD2 4.42Å; F881-L885 HydrophobicContact CZ-CG 4.25Å; F881-L885 PolarHBondContact O-N 3.36Å; L885-D887 VanDerWaalsContact C-N 3.33Å; L885-W891 HydrophobicContact CD2-CZ2 3.9Å; L885-W891 PolarHBondContact O-NE1 3.36Å
886	R	68.7	Low	75.7	Confident	170 Å²	170	69.1 Å²	69.1	64%	0.642	36%	0.358	S	S	*	.	H	α-helix	trans	-79.1	-21	179.1	-168.5	172.6	-178.6	169.3	5.5	112.5	S882 D883 Y884 G888	S882-R886 WeakPolarHBondContact O-CB 3.31Å; S882-R886 PolarHBondContact O-N 3.08Å; S882-R886 VanDerWaalsContact O-N 3.13Å; D883-R886 PolarHBondContact O-N 3.42Å; Y884-R886 PolarHBondContact O-N 2.8Å; R886-G888 PolarHBondContact O-N 3.14Å
887	D	74.4	Confident	76.8	Confident	45 Å²	45	68.2 Å²	68.2	24%	0.241	35%	0.347	C	S	.	.			trans	-80.1	103.4	177.9	-78.6	-32.5	0	0	0	110.6	Y884 L885 W889 N890 W891 K1112	Y884-D887 PolarHBondContact O-N 3.43Å; L885-D887 VanDerWaalsContact C-N 3.33Å; D887-W889 PolarHBondContact O-N 3.25Å; D887-N890 PolarHBondContact O-N 3.25Å; D887-W891 PolarHBondContact O-N 3.3Å; D887-K1112 IonicContact OD1-NZ 3.11Å; D887-K1112 PolarHBondContact OD1-NZ 3.13Å; D887-K1112 IonicContact OD2-NZ 3.1Å; D887-K1112 PolarHBondContact OD2-NZ 2.83Å
888	G	77.3	Confident	78.1	Confident	45 Å²	45	67 Å²	67	46%	0.464	34%	0.336	S	S	.	.	H	α-helix	trans	-57.5	-23.2	-178.8	0	0	0	0	0	114.5	R886 I892	R886-G888 PolarHBondContact O-N 3.14Å; G888-I892 WeakPolarHBondContact O-CG1 3.37Å; G888-I892 PolarHBondContact O-N 2.9Å; G888-I892 VanDerWaalsContact O-N 3.13Å
889	W	82.5	Confident	79.5	Confident	76 Å²	76	63.2 Å²	63.2	29%	0.288	33%	0.325	S	S	.	.	H	α-helix	trans	-69.5	-36.5	174.8	-65.7	109.9	0	0	0	113.1	D887 W891 I892 D893 M942 L945 H946	D887-W889 PolarHBondContact O-N 3.25Å; W889-W891 VanDerWaalsContact C-N 3.3Å; W889-I892 HydrophobicContact CE3-CD1 3.83Å; W889-I892 HydrophobicContact CZ3-CD1 4.11Å; W889-I892 WeakPolarHBondContact O-CB 3.36Å; W889-I892 PolarHBondContact O-N 3.29Å; W889-D893 PolarHBondContact O-N 3.23Å; W889-M942 WeakPolarHBondContact CZ3-O 3.41Å; W889-L945 HydrophobicContact CH2-CB 3.98Å; W889-L945 HydrophobicContact CH2-CD2 4.03Å; W889-L945 HydrophobicContact CH2-CG 4.19Å; W889-L945 HydrophobicContact CZ3-CB 4.43Å; W889-H946 AromaticContact CD1-CD2 3.77Å; W889-H946 HydrophobicContact CD2-CB 4.11Å; W889-H946 AromaticContact CD2-CD2 3.95Å; W889-H946 AromaticContact CE2-CD2 3.9Å; W889-H946 HydrophobicContact CE3-CB 3.99Å; W889-H946 AromaticContact CG-CD2 3.89Å; W889-H946 HydrophobicContact CH2-CB 4.35Å; W889-H946 HydrophobicContact CZ2-CB 4.44Å; W889-H946 HydrophobicContact CZ3-CB 4.12Å; W889-H946 AromaticContact NE1-CD2 3.77Å
890	N	85.2	Confident	81.4	Confident	14 Å²	14	55.5 Å²	55.5	8%	0.075	28%	0.284	C	S	.	.	H	α-helix	trans	-69.3	-35.8	178.5	-61.7	0	0	0	0	109.8	Y884 D887 D893 V894	Y884-N890 WeakPolarHBondContact CD2-ND2 3.21Å; Y884-N890 HydrophobicContact CE1-CB 4.11Å; Y884-N890 HydrophobicContact CE2-CB 4.01Å; Y884-N890 VanDerWaalsContact CE2-ND2 3.28Å; Y884-N890 WeakPolarHBondContact CE2-ND2 3.35Å; Y884-N890 PolarHBondContact O-ND2 3.41Å; D887-N890 PolarHBondContact O-N 3.25Å; N890-D893 PolarHBondContact O-N 2.7Å; N890-V894 WeakPolarHBondContact O-CB 3.48Å; N890-V894 VanDerWaalsContact O-CG2 3.26Å; N890-V894 WeakPolarHBondContact O-CG2 3.47Å; N890-V894 PolarHBondContact O-N 2.89Å
891	W	87.3	Confident	82.8	Confident	108 Å²	108	57.8 Å²	57.8	41%	0.409	30%	0.298	S	S	.	.	H	α-helix	trans	-61.9	-42.8	170.4	-87.3	101.6	0	0	0	112.7	L885 D887 W889 D893 V894 F895	L885-W891 HydrophobicContact CD2-CZ2 3.9Å; L885-W891 PolarHBondContact O-NE1 3.36Å; D887-W891 PolarHBondContact O-N 3.3Å; W889-W891 VanDerWaalsContact C-N 3.3Å; W891-D893 VanDerWaalsContact C-N 3.31Å; W891-D893 PolarHBondContact O-N 2.84Å; W891-V894 PolarHBondContact O-N 3.03Å; W891-F895 HydrophobicContact CB-CD2 4.38Å; W891-F895 HydrophobicContact CB-CE2 4.34Å; W891-F895 HydrophobicContact CD2-CE2 4.19Å; W891-F895 AromaticContact CE3-CD2 4Å; W891-F895 HydrophobicContact CE3-CD2 4Å; W891-F895 HydrophobicContact CE3-CE1 4.42Å; W891-F895 AromaticContact CE3-CE2 3.3Å; W891-F895 HydrophobicContact CE3-CE2 3.3Å; W891-F895 AromaticContact CE3-CZ 3.55Å; W891-F895 HydrophobicContact CE3-CZ 3.55Å; W891-F895 HydrophobicContact CZ3-CE1 4.34Å; W891-F895 AromaticContact CZ3-CE2 3.91Å; W891-F895 HydrophobicContact CZ3-CE2 3.91Å; W891-F895 AromaticContact CZ3-CZ 3.63Å; W891-F895 HydrophobicContact CZ3-CZ 3.63Å; W891-F895 WeakPolarHBondContact O-CB 3.33Å; W891-F895 WeakPolarHBondContact O-CD2 3.49Å; W891-F895 WeakPolarHBondContact O-CG 3.44Å; W891-F895 PolarHBondContact O-N 3.37Å
892	I	89.1	Confident	84.2	Confident	45 Å²	45	57 Å²	57	23%	0.231	30%	0.297	C	S	.	.	H	α-helix	trans	-59	-44.8	175.7	-69.5	164.9	0	0	0	110.6	G888 W889 F895 A896 L939	G888-I892 WeakPolarHBondContact O-CG1 3.37Å; G888-I892 PolarHBondContact O-N 2.9Å; G888-I892 VanDerWaalsContact O-N 3.13Å; W889-I892 HydrophobicContact CE3-CD1 3.83Å; W889-I892 HydrophobicContact CZ3-CD1 4.11Å; W889-I892 WeakPolarHBondContact O-CB 3.36Å; W889-I892 PolarHBondContact O-N 3.29Å; I892-F895 PolarHBondContact O-N 3.4Å; I892-A896 WeakPolarHBondContact O-CB 3.28Å; I892-A896 PolarHBondContact O-N 2.91Å; I892-L939 HydrophobicContact CG2-CB 4.26Å; I892-L939 HydrophobicContact CG2-CD2 4.4Å
893	D	89.1	Confident	85.6	Confident	8 Å²	8	52.8 Å²	52.8	4%	0.043	27%	0.267	C	S	.	.	H	α-helix	trans	-64.9	-44.6	178.7	-70.1	-14.8	0	0	0	111.4	E868 W889 N890 W891 F895 A896 I897 R943	E868-D893 HydrophobicContact CG-CB 4.37Å; W889-D893 PolarHBondContact O-N 3.23Å; N890-D893 PolarHBondContact O-N 2.7Å; W891-D893 VanDerWaalsContact C-N 3.31Å; W891-D893 PolarHBondContact O-N 2.84Å; D893-F895 PolarHBondContact O-N 3.25Å; D893-A896 PolarHBondContact O-N 3.01Å; D893-I897 WeakPolarHBondContact O-CB 3.46Å; D893-I897 WeakPolarHBondContact O-CD1 3.29Å; D893-I897 VanDerWaalsContact O-CG1 3.23Å; D893-I897 WeakPolarHBondContact O-CG1 2.93Å; D893-I897 PolarHBondContact O-N 3.36Å; D893-R943 WeakPolarHBondContact OD1-CD 3.46Å; D893-R943 WeakPolarHBondContact OD1-CG 3.38Å; D893-R943 IonicContact OD1-CZ 3.64Å; D893-R943 IonicContact OD1-NE 2.64Å; D893-R943 PolarHBondContact OD1-NE 3.16Å; D893-R943 IonicContact OD2-CZ 2.73Å; D893-R943 IonicContact OD2-NE 3.19Å; D893-R943 PolarHBondContact OD2-NE 2.92Å; D893-R943 VanDerWaalsContact OD2-NE 3.09Å; D893-R943 IonicContact OD2-NH1 3.81Å; D893-R943 PolarHBondContact OD2-NH1 3.33Å; D893-R943 IonicContact OD2-NH2 3.88Å; D893-R943 PolarHBondContact OD2-NH2 3.3Å
894	V	91	Very high	86.8	Confident	47 Å²	47	51.8 Å²	51.8	29%	0.285	26%	0.259	S	S	.	.	H	α-helix	trans	-61.7	-42.1	175.3	171.4	0	0	0	0	111.4	N890 W891 I897 T898	N890-V894 WeakPolarHBondContact O-CB 3.48Å; N890-V894 VanDerWaalsContact O-CG2 3.26Å; N890-V894 WeakPolarHBondContact O-CG2 3.47Å; N890-V894 PolarHBondContact O-N 2.89Å; W891-V894 PolarHBondContact O-N 3.03Å; V894-I897 PolarHBondContact O-N 3.25Å; V894-T898 HydrophobicContact CG1-CG2 4.3Å; V894-T898 WeakPolarHBondContact O-CB 3.4Å; V894-T898 VanDerWaalsContact O-CG2 3.26Å; V894-T898 WeakPolarHBondContact O-CG2 3.21Å; V894-T898 PolarHBondContact O-N 2.63Å; V894-T898 PolarHBondContact O-OG1 3.33Å
895	F	92.5	Very high	87.6	Confident	104 Å²	104	54.8 Å²	54.8	46%	0.456	28%	0.28	S	S	.	.	H	α-helix	trans	-65.6	-39.7	175.6	-77.9	-57	0	0	0	112.1	W891 I892 D893 T898 L899 L939	W891-F895 HydrophobicContact CB-CD2 4.38Å; W891-F895 HydrophobicContact CB-CE2 4.34Å; W891-F895 HydrophobicContact CD2-CE2 4.19Å; W891-F895 AromaticContact CE3-CD2 4Å; W891-F895 HydrophobicContact CE3-CD2 4Å; W891-F895 HydrophobicContact CE3-CE1 4.42Å; W891-F895 AromaticContact CE3-CE2 3.3Å; W891-F895 HydrophobicContact CE3-CE2 3.3Å; W891-F895 AromaticContact CE3-CZ 3.55Å; W891-F895 HydrophobicContact CE3-CZ 3.55Å; W891-F895 HydrophobicContact CZ3-CE1 4.34Å; W891-F895 AromaticContact CZ3-CE2 3.91Å; W891-F895 HydrophobicContact CZ3-CE2 3.91Å; W891-F895 AromaticContact CZ3-CZ 3.63Å; W891-F895 HydrophobicContact CZ3-CZ 3.63Å; W891-F895 WeakPolarHBondContact O-CB 3.33Å; W891-F895 WeakPolarHBondContact O-CD2 3.49Å; W891-F895 WeakPolarHBondContact O-CG 3.44Å; W891-F895 PolarHBondContact O-N 3.37Å; I892-F895 PolarHBondContact O-N 3.4Å; D893-F895 PolarHBondContact O-N 3.25Å; F895-T898 VanDerWaalsContact CA-OG1 3.28Å; F895-T898 WeakPolarHBondContact CA-OG1 3.42Å; F895-T898 PolarHBondContact O-N 3.32Å; F895-T898 PolarHBondContact O-OG1 3.31Å; F895-L899 WeakPolarHBondContact O-CB 3.48Å; F895-L899 WeakPolarHBondContact O-CG 3.28Å; F895-L899 PolarHBondContact O-N 3.4Å; F895-L939 HydrophobicContact CB-CD1 3.84Å
896	A	94.4	Very high	88.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.5	-45.7	175.6	0	0	0	0	0	111.5	I892 D893 T900 L939 F940	I892-A896 WeakPolarHBondContact O-CB 3.28Å; I892-A896 PolarHBondContact O-N 2.91Å; D893-A896 PolarHBondContact O-N 3.01Å; A896-T900 WeakPolarHBondContact O-CB 3.33Å; A896-T900 WeakPolarHBondContact O-CG2 3.23Å; A896-T900 PolarHBondContact O-N 2.91Å; A896-T900 PolarHBondContact O-OG1 3.48Å; A896-L939 HydrophobicContact CB-CB 3.68Å; A896-L939 HydrophobicContact CB-CD1 4.24Å; A896-F940 HydrophobicContact CB-CD1 3.96Å; A896-F940 HydrophobicContact CB-CD2 4.17Å; A896-F940 HydrophobicContact CB-CE1 3.69Å; A896-F940 HydrophobicContact CB-CE2 3.92Å; A896-F940 HydrophobicContact CB-CG 4.19Å; A896-F940 HydrophobicContact CB-CZ 3.67Å
897	I	94.3	Very high	89.3	Confident	25 Å²	25	45.3 Å²	45.3	13%	0.128	24%	0.244	C	C	.	.	H	α-helix	trans	-65.7	-42.7	178.5	-66.4	159.1	0	0	0	111	A865 E868 D893 V894 T900 S901 F940	A865-I897 HydrophobicContact CB-CD1 4.37Å; A865-I897 HydrophobicContact CB-CG2 3.85Å; E868-I897 HydrophobicContact CB-CD1 4.47Å; E868-I897 HydrophobicContact CG-CD1 3.98Å; D893-I897 WeakPolarHBondContact O-CB 3.46Å; D893-I897 WeakPolarHBondContact O-CD1 3.29Å; D893-I897 VanDerWaalsContact O-CG1 3.23Å; D893-I897 WeakPolarHBondContact O-CG1 2.93Å; D893-I897 PolarHBondContact O-N 3.36Å; V894-I897 PolarHBondContact O-N 3.25Å; I897-T900 WeakPolarHBondContact CA-OG1 3.24Å; I897-T900 PolarHBondContact O-OG1 3.22Å; I897-S901 WeakPolarHBondContact O-CB 3.48Å; I897-S901 PolarHBondContact O-N 3.35Å; I897-F940 HydrophobicContact CG1-CZ 4.33Å
898	T	94	Very high	89.9	Confident	59 Å²	59	46.6 Å²	46.6	36%	0.362	25%	0.249	S	C	.	.	H	α-helix	trans	-68.2	-44	179.8	49.2	0	0	0	0	112	V894 F895 T900 S901 I902	V894-T898 HydrophobicContact CG1-CG2 4.3Å; V894-T898 WeakPolarHBondContact O-CB 3.4Å; V894-T898 VanDerWaalsContact O-CG2 3.26Å; V894-T898 WeakPolarHBondContact O-CG2 3.21Å; V894-T898 PolarHBondContact O-N 2.63Å; V894-T898 PolarHBondContact O-OG1 3.33Å; F895-T898 VanDerWaalsContact CA-OG1 3.28Å; F895-T898 WeakPolarHBondContact CA-OG1 3.42Å; F895-T898 PolarHBondContact O-N 3.32Å; F895-T898 PolarHBondContact O-OG1 3.31Å; T898-T900 PolarHBondContact O-N 3.22Å; T898-S901 PolarHBondContact O-N 2.88Å; T898-I902 VanDerWaalsContact O-CG1 3.22Å; T898-I902 WeakPolarHBondContact O-CG1 3.36Å; T898-I902 PolarHBondContact O-N 3.09Å
899	L	95.5	Very high	90.2	Very high	44 Å²	44	50.5 Å²	50.5	23%	0.23	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-42.9	176.5	-74	170.3	0	0	0	112.3	F895 I902 G903 L932 L935 L939	F895-L899 WeakPolarHBondContact O-CB 3.48Å; F895-L899 WeakPolarHBondContact O-CG 3.28Å; F895-L899 PolarHBondContact O-N 3.4Å; L899-I902 PolarHBondContact O-N 3.47Å; L899-G903 PolarHBondContact O-N 3.35Å; L899-L932 HydrophobicContact CD2-CD2 3.98Å; L899-L935 HydrophobicContact CD1-CB 4.18Å; L899-L939 HydrophobicContact CD1-CD1 3.75Å
900	T	93.5	Very high	90.2	Very high	1 Å²	1	47 Å²	47	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-67.5	-36.8	174.8	50.7	0	0	0	0	112.2	F838 V861 A896 I897 T898 G903 F904 Y933 F940	F838-T900 HydrophobicContact CE1-CG2 4.08Å; F838-T900 HydrophobicContact CZ-CG2 3.9Å; V861-T900 WeakPolarHBondContact CG1-OG1 3.43Å; A896-T900 WeakPolarHBondContact O-CB 3.33Å; A896-T900 WeakPolarHBondContact O-CG2 3.23Å; A896-T900 PolarHBondContact O-N 2.91Å; A896-T900 PolarHBondContact O-OG1 3.48Å; I897-T900 WeakPolarHBondContact CA-OG1 3.24Å; I897-T900 PolarHBondContact O-OG1 3.22Å; T898-T900 PolarHBondContact O-N 3.22Å; T900-G903 PolarHBondContact O-N 3.5Å; T900-F904 WeakPolarHBondContact O-CB 3.47Å; T900-F904 PolarHBondContact O-N 2.9Å; T900-Y933 WeakPolarHBondContact O-CE1 3.42Å; T900-F940 HydrophobicContact CG2-CE2 3.95Å
901	S	92.6	Very high	89.9	Confident	62 Å²	62	48.7 Å²	48.7	43%	0.434	26%	0.257	S	S	.	.	H	α-helix	trans	-66.2	-41.5	174.2	-172.7	0	0	0	0	112.3	I897 T898 G903 F904 C905	I897-S901 WeakPolarHBondContact O-CB 3.48Å; I897-S901 PolarHBondContact O-N 3.35Å; T898-S901 PolarHBondContact O-N 2.88Å; S901-G903 VanDerWaalsContact C-N 3.34Å; S901-F904 PolarHBondContact O-N 3.34Å; S901-C905 PolarHBondContact O-N 3.34Å; S901-C905 PolarHBondContact O-SG 3.24Å
902	I	93.9	Very high	89.4	Confident	89 Å²	89	50.6 Å²	50.6	46%	0.456	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-43.3	175.5	-66.2	163.8	0	0	0	109.4	T898 L899 F904 C905 T906 L932	T898-I902 VanDerWaalsContact O-CG1 3.22Å; T898-I902 WeakPolarHBondContact O-CG1 3.36Å; T898-I902 PolarHBondContact O-N 3.09Å; L899-I902 PolarHBondContact O-N 3.47Å; I902-F904 VanDerWaalsContact C-N 3.29Å; I902-F904 PolarHBondContact O-N 3.36Å; I902-C905 PolarHBondContact O-N 2.93Å; I902-T906 HydrophobicContact CG2-CG2 4.47Å; I902-T906 WeakPolarHBondContact O-CG2 3.47Å; I902-T906 PolarHBondContact O-N 2.9Å; I902-T906 PolarHBondContact O-OG1 3.41Å; I902-L932 HydrophobicContact CG2-CD1 3.87Å
903	G	92.1	Very high	88.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-58.2	-40.7	173.6	0	0	0	0	0	112.6	L899 T900 S901 T906 R907 T929	L899-G903 PolarHBondContact O-N 3.35Å; T900-G903 PolarHBondContact O-N 3.5Å; S901-G903 VanDerWaalsContact C-N 3.34Å; G903-T906 WeakPolarHBondContact CA-OG1 3.15Å; G903-T906 PolarHBondContact O-N 3.12Å; G903-T906 PolarHBondContact O-OG1 3.46Å; G903-R907 WeakPolarHBondContact O-CB 3.32Å; G903-R907 PolarHBondContact O-N 3.43Å; G903-T929 WeakPolarHBondContact O-CG2 3.43Å
904	F	91.3	Very high	87.7	Confident	72 Å²	72	61.8 Å²	61.8	32%	0.316	32%	0.324	S	S	.	.	H	α-helix	trans	-65.7	-43.1	175.3	178.3	-102.9	0	0	0	111.6	L858 T900 S901 I902 R907 M908 Y933	L858-F904 HydrophobicContact CD1-CD2 3.47Å; L858-F904 VanDerWaalsContact CD1-CD2 3.47Å; L858-F904 HydrophobicContact CD1-CE2 3.61Å; L858-F904 HydrophobicContact CD2-CB 4.48Å; L858-F904 HydrophobicContact CD2-CD2 4.17Å; L858-F904 HydrophobicContact CG-CD2 4.47Å; T900-F904 WeakPolarHBondContact O-CB 3.47Å; T900-F904 PolarHBondContact O-N 2.9Å; S901-F904 PolarHBondContact O-N 3.34Å; I902-F904 VanDerWaalsContact C-N 3.29Å; I902-F904 PolarHBondContact O-N 3.36Å; F904-R907 WeakPolarHBondContact O-CB 3.37Å; F904-R907 PolarHBondContact O-N 3.36Å; F904-M908 HydrophobicContact CD1-CG 4.28Å; F904-M908 HydrophobicContact CD2-CE 3.96Å; F904-M908 HydrophobicContact CE1-CG 3.85Å; F904-M908 HydrophobicContact CE1-SD 4.17Å; F904-M908 HydrophobicContact CE2-CE 3.41Å; F904-M908 VanDerWaalsContact CE2-CE 3.41Å; F904-M908 HydrophobicContact CE2-CG 4.38Å; F904-M908 HydrophobicContact CE2-SD 3.95Å; F904-M908 HydrophobicContact CZ-CE 3.76Å; F904-M908 HydrophobicContact CZ-CG 3.91Å; F904-M908 HydrophobicContact CZ-SD 3.6Å; F904-M908 WeakPolarHBondContact O-CG 3.41Å; F904-M908 PolarHBondContact O-N 3.41Å; F904-Y933 HydrophobicContact CB-CE1 4.49Å
905	C	91.5	Very high	86.6	Confident	71 Å²	71	61.4 Å²	61.4	48%	0.48	33%	0.33	S	S	.	.	H	α-helix	trans	-62	-43.2	175.6	-68.6	0	0	0	0	112.3	S901 I902 R907 M908	S901-C905 PolarHBondContact O-N 3.34Å; S901-C905 PolarHBondContact O-SG 3.24Å; I902-C905 PolarHBondContact O-N 2.93Å; C905-R907 VanDerWaalsContact C-N 3.27Å; C905-R907 PolarHBondContact O-N 2.94Å; C905-M908 PolarHBondContact O-N 2.81Å
906	T	88.7	Confident	85.8	Confident	32 Å²	32	59.5 Å²	59.5	20%	0.196	33%	0.329	C	S	.	.	H	α-helix	trans	-64	-36.2	176.1	54.8	0	0	0	0	111.5	I902 G903 N909 T929 L932	I902-T906 HydrophobicContact CG2-CG2 4.47Å; I902-T906 WeakPolarHBondContact O-CG2 3.47Å; I902-T906 PolarHBondContact O-N 2.9Å; I902-T906 PolarHBondContact O-OG1 3.41Å; G903-T906 WeakPolarHBondContact CA-OG1 3.15Å; G903-T906 PolarHBondContact O-N 3.12Å; G903-T906 PolarHBondContact O-OG1 3.46Å; T906-N909 WeakPolarHBondContact O-CB 3.46Å; T906-N909 PolarHBondContact O-N 2.98Å; T906-T929 PolarHBondContact OG1-OG1 3.49Å; T906-L932 HydrophobicContact CG2-CD1 4.32Å
907	R	85.7	Confident	84.9	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.015	37%	0.365	C	S	.	.	H	α-helix	trans	-64	-43	175	-169.7	-163.7	155.9	-135.2	-17.6	112.6	C850 E854 G903 F904 C905 N909 V910 V911 T929	C850-R907 VanDerWaalsContact SG-CZ 3.59Å; C850-R907 PolarHBondContact SG-NH1 2.63Å; C850-R907 PolarHBondContact SG-NH2 2.9Å; E854-R907 WeakPolarHBondContact OE1-CD 3.47Å; E854-R907 IonicContact OE1-CZ 3.48Å; E854-R907 VanDerWaalsContact OE1-CZ 3.3Å; E854-R907 IonicContact OE1-NE 2.8Å; E854-R907 PolarHBondContact OE1-NE 3.24Å; E854-R907 IonicContact OE1-NH1 3.8Å; E854-R907 PolarHBondContact OE1-NH1 2.89Å; E854-R907 IonicContact OE2-CZ 2.8Å; E854-R907 IonicContact OE2-NE 3.18Å; E854-R907 PolarHBondContact OE2-NE 3.39Å; E854-R907 IonicContact OE2-NH1 3.53Å; E854-R907 PolarHBondContact OE2-NH1 2.87Å; E854-R907 IonicContact OE2-NH2 3.37Å; G903-R907 WeakPolarHBondContact O-CB 3.32Å; G903-R907 PolarHBondContact O-N 3.43Å; F904-R907 WeakPolarHBondContact O-CB 3.37Å; F904-R907 PolarHBondContact O-N 3.36Å; C905-R907 VanDerWaalsContact C-N 3.27Å; C905-R907 PolarHBondContact O-N 2.94Å; R907-N909 PolarHBondContact O-N 3.4Å; R907-N909 VanDerWaalsContact O-N 3.11Å; R907-V910 PolarHBondContact O-N 3.16Å; R907-V911 PolarHBondContact O-N 3.04Å; R907-T929 HydrophobicContact CB-CG2 3.9Å; R907-T929 HydrophobicContact CG-CG2 4.37Å
908	M	87.1	Confident	83.9	Confident	72 Å²	72	73.1 Å²	73.1	36%	0.355	39%	0.391	S	S	.	.	H	α-helix	trans	-58	-27.2	-178.6	-71.2	-54.3	93.9	0	0	113.1	F904 C905 V910 V911	F904-M908 HydrophobicContact CD1-CG 4.28Å; F904-M908 HydrophobicContact CD2-CE 3.96Å; F904-M908 HydrophobicContact CE1-CG 3.85Å; F904-M908 HydrophobicContact CE1-SD 4.17Å; F904-M908 HydrophobicContact CE2-CE 3.41Å; F904-M908 VanDerWaalsContact CE2-CE 3.41Å; F904-M908 HydrophobicContact CE2-CG 4.38Å; F904-M908 HydrophobicContact CE2-SD 3.95Å; F904-M908 HydrophobicContact CZ-CE 3.76Å; F904-M908 HydrophobicContact CZ-CG 3.91Å; F904-M908 HydrophobicContact CZ-SD 3.6Å; F904-M908 WeakPolarHBondContact O-CG 3.41Å; F904-M908 PolarHBondContact O-N 3.41Å; C905-M908 PolarHBondContact O-N 2.81Å; M908-V910 PolarHBondContact O-N 3.34Å; M908-V911 HydrophobicContact CE-CG2 3.51Å; M908-V911 HydrophobicContact SD-CG2 4.02Å
909	N	82.2	Confident	83.1	Confident	128 Å²	128	75.9 Å²	75.9	68%	0.684	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-18.6	175.1	-63.9	-24.3	0	0	0	113.6	T906 R907	T906-N909 WeakPolarHBondContact O-CB 3.46Å; T906-N909 PolarHBondContact O-N 2.98Å; R907-N909 PolarHBondContact O-N 3.4Å; R907-N909 VanDerWaalsContact O-N 3.11Å
910	V	82.8	Confident	82.2	Confident	2 Å²	2	74.7 Å²	74.7	1%	0.012	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-10.6	-173.3	-161.7	0	0	0	0	112.4	F848 R907 M908 N912 K913 I925	F848-V910 HydrophobicContact CD1-CB 4.43Å; F848-V910 HydrophobicContact CD1-CG1 3.4Å; F848-V910 VanDerWaalsContact CD1-CG1 3.4Å; F848-V910 HydrophobicContact CE1-CG1 3.36Å; R907-V910 PolarHBondContact O-N 3.16Å; M908-V910 PolarHBondContact O-N 3.34Å; V910-N912 PolarHBondContact O-N 2.64Å; V910-K913 HydrophobicContact CG1-CB 4.15Å; V910-K913 HydrophobicContact CG1-CD 4Å; V910-K913 HydrophobicContact CG1-CG 4.29Å; V910-K913 WeakPolarHBondContact O-CB 3.06Å; V910-K913 PolarHBondContact O-N 3.11Å; V910-I925 HydrophobicContact CG2-CB 3.72Å; V910-I925 HydrophobicContact CG2-CD1 3.97Å; V910-I925 HydrophobicContact CG2-CG1 4.46Å; V910-I925 HydrophobicContact CG2-CG2 3.31Å
911	V	79.7	Confident	81.3	Confident	50 Å²	50	77 Å²	77	30%	0.303	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-29	-175.1	166.7	0	0	0	0	113.7	R907 M908	R907-V911 PolarHBondContact O-N 3.04Å; M908-V911 HydrophobicContact CE-CG2 3.51Å; M908-V911 HydrophobicContact SD-CG2 4.02Å
912	N	76.4	Confident	80.6	Confident	147 Å²	147	80.3 Å²	80.3	79%	0.786	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-9.6	179.8	-64.9	-19.1	0	0	0	113.8	V910 H914	V910-N912 PolarHBondContact O-N 2.64Å; N912-H914 PolarHBondContact O-ND1 3.48Å; N912-H914 VanDerWaalsContact O-ND1 3.13Å
913	K	73.8	Confident	80.1	Confident	106 Å²	106	77.5 Å²	77.5	46%	0.461	41%	0.406	S	S	.	.			trans	-77.8	136.5	176	-70.3	-166.9	-173.5	172.6	0	110	V910	V910-K913 HydrophobicContact CG1-CB 4.15Å; V910-K913 HydrophobicContact CG1-CD 4Å; V910-K913 HydrophobicContact CG1-CG 4.29Å; V910-K913 WeakPolarHBondContact O-CB 3.06Å; V910-K913 PolarHBondContact O-N 3.11Å
914	H	68.7	Low	79.8	Confident	182 Å²	182	82.6 Å²	82.6	84%	0.843	44%	0.437	S	S	*	.			trans	-120.8	121.9	172.7	-63.4	74.6	0	0	0	107	N912	N912-H914 PolarHBondContact O-ND1 3.48Å; N912-H914 VanDerWaalsContact O-ND1 3.13Å
915	G	69	Low	79.6	Confident	39 Å²	39	82.1 Å²	82.1	40%	0.402	44%	0.437	S	S	.	.			trans	-144.3	169.7	-178.6	0	0	0	0	0	110.8
916	S	74.4	Confident	79.3	Confident	64 Å²	64	78.8 Å²	78.8	45%	0.448	42%	0.415	S	S	.	.			trans	-69.2	155.4	174.2	61.4	0	0	0	0	111.5	F918 E919 E920	S916-F918 PolarHBondContact O-N 2.9Å; S916-F918 VanDerWaalsContact O-N 3.08Å; S916-E919 PolarHBondContact N-OE2 3.1Å; S916-E919 VanDerWaalsContact N-OE2 3.08Å; S916-E919 PolarHBondContact O-N 2.96Å; S916-E919 WeakPolarHBondContact OG-CG 3.48Å; S916-E919 PolarHBondContact OG-OE2 2.93Å; S916-E919 VanDerWaalsContact OG-OE2 3.1Å; S916-E920 PolarHBondContact O-N 3.03Å
917	E	75.1	Confident	79.2	Confident	162 Å²	162	83.6 Å²	83.6	76%	0.757	43%	0.43	S	S	*	.	H	α-helix	trans	-54.7	-30.9	179.7	-66.3	179.8	176.4	0	0	112.8	A921	E917-A921 PolarHBondContact O-N 3.1Å
918	F	75.1	Confident	79.3	Confident	150 Å²	150	86.4 Å²	86.4	66%	0.658	45%	0.448	S	S	*	.	H	α-helix	trans	-70.4	-44	177.4	-177.5	-98.6	0	0	0	112.8	S916 E920 A921 H922	S916-F918 PolarHBondContact O-N 2.9Å; S916-F918 VanDerWaalsContact O-N 3.08Å; F918-E920 VanDerWaalsContact C-N 3.3Å; F918-A921 PolarHBondContact O-N 3.45Å; F918-H922 AromaticContact CE2-CE1 3.76Å; F918-H922 AromaticContact CZ-CE1 3.96Å; F918-H922 PolarHBondContact O-N 3.34Å; F918-H922 PolarHBondContact O-ND1 2.78Å; F918-H922 VanDerWaalsContact O-ND1 3.14Å
919	E	76.7	Confident	79.5	Confident	116 Å²	116	83 Å²	83	54%	0.542	43%	0.431	S	S	.	.	H	α-helix	trans	-66.4	-36	175.7	-71.6	170.7	146.5	0	0	111.3	S916 A921 H922 D923	S916-E919 PolarHBondContact N-OE2 3.1Å; S916-E919 VanDerWaalsContact N-OE2 3.08Å; S916-E919 PolarHBondContact O-N 2.96Å; S916-E919 WeakPolarHBondContact OG-CG 3.48Å; S916-E919 PolarHBondContact OG-OE2 2.93Å; S916-E919 VanDerWaalsContact OG-OE2 3.1Å; E919-A921 PolarHBondContact O-N 3.18Å; E919-H922 PolarHBondContact O-N 2.78Å; E919-D923 PolarHBondContact O-N 2.95Å
920	E	75.4	Confident	79.9	Confident	20 Å²	20	80.5 Å²	80.5	9%	0.093	41%	0.412	C	S	.	.	H	α-helix	trans	-60.1	-44.7	175.5	-173.8	172.7	-135.2	0	0	112.1	H847 F848 S916 F918 H922 D923 L926	H847-E920 VanDerWaalsContact C-OE1 3.24Å; H847-E920 WeakPolarHBondContact CA-OE1 3.34Å; H847-E920 WeakPolarHBondContact CB-OE1 3.43Å; H847-E920 IonicContact CE1-OE2 3.45Å; H847-E920 IonicContact CG-OE1 3.5Å; H847-E920 IonicContact CG-OE2 3.44Å; H847-E920 IonicContact ND1-OE1 3.16Å; H847-E920 PolarHBondContact ND1-OE1 2.82Å; H847-E920 IonicContact ND1-OE2 2.86Å; H847-E920 PolarHBondContact ND1-OE2 3.29Å; F848-E920 HydrophobicContact CD1-CG 4.49Å; F848-E920 HydrophobicContact CD2-CB 3.96Å; F848-E920 HydrophobicContact CD2-CG 3.7Å; F848-E920 WeakPolarHBondContact CD2-OE1 3.3Å; F848-E920 HydrophobicContact CE1-CG 4.4Å; F848-E920 HydrophobicContact CE2-CB 3.44Å; F848-E920 VanDerWaalsContact CE2-CB 3.44Å; F848-E920 HydrophobicContact CE2-CG 3.62Å; F848-E920 HydrophobicContact CG-CG 4.18Å; F848-E920 HydrophobicContact CZ-CB 3.92Å; F848-E920 HydrophobicContact CZ-CG 3.99Å; F848-E920 PolarHBondContact N-OE1 2.96Å; S916-E920 PolarHBondContact O-N 3.03Å; F918-E920 VanDerWaalsContact C-N 3.3Å; E920-H922 PolarHBondContact O-N 3.19Å; E920-D923 PolarHBondContact O-N 2.95Å; E920-L926 HydrophobicContact CG-CD2 3.66Å; E920-L926 VanDerWaalsContact O-CD2 3.32Å; E920-L926 WeakPolarHBondContact O-CD2 3.03Å
921	A	75.4	Confident	80.3	Confident	49 Å²	49	83.6 Å²	83.6	41%	0.405	43%	0.428	S	S	.	.	H	α-helix	trans	-63.9	-28.2	179.6	0	0	0	0	0	113.7	E917 F918 E919	E917-A921 PolarHBondContact O-N 3.1Å; F918-A921 PolarHBondContact O-N 3.45Å; E919-A921 PolarHBondContact O-N 3.18Å
922	H	77.9	Confident	80.9	Confident	131 Å²	131	82.6 Å²	82.6	61%	0.606	42%	0.421	S	S	*	.	H	α-helix	trans	-104.6	0.8	-175.7	-68.2	70.8	0	0	0	113.7	F918 E919 E920 V924	F918-H922 AromaticContact CE2-CE1 3.76Å; F918-H922 AromaticContact CZ-CE1 3.96Å; F918-H922 PolarHBondContact O-N 3.34Å; F918-H922 PolarHBondContact O-ND1 2.78Å; F918-H922 VanDerWaalsContact O-ND1 3.14Å; E919-H922 PolarHBondContact O-N 2.78Å; E920-H922 PolarHBondContact O-N 3.19Å; H922-V924 PolarHBondContact O-N 3.31Å
923	D	83.4	Confident	81.8	Confident	30 Å²	30	75.6 Å²	75.6	16%	0.16	38%	0.384	C	S	.	.			trans	-66.2	125.1	178	-174.3	35.5	0	0	0	110.7	F848 E919 E920 I925 L926 Y927	F848-D923 HydrophobicContact CE1-CB 4.28Å; F848-D923 HydrophobicContact CZ-CB 4.25Å; E919-D923 PolarHBondContact O-N 2.95Å; E920-D923 PolarHBondContact O-N 2.95Å; D923-I925 PolarHBondContact O-N 3.11Å; D923-L926 HydrophobicContact CB-CB 4.17Å; D923-L926 PolarHBondContact O-N 3.08Å; D923-Y927 WeakPolarHBondContact O-CB 3.32Å; D923-Y927 PolarHBondContact O-N 3.42Å
924	V	85.7	Confident	82.7	Confident	108 Å²	108	73.7 Å²	73.7	66%	0.655	38%	0.377	S	S	*	.	H	α-helix	trans	-61.3	-35.9	-175	180	0	0	0	0	111.1	H922 T928	H922-V924 PolarHBondContact O-N 3.31Å; V924-T928 WeakPolarHBondContact O-CB 3.47Å; V924-T928 PolarHBondContact O-N 3.36Å; V924-T928 PolarHBondContact O-OG1 2.81Å
925	I	86.3	Confident	83.8	Confident	61 Å²	61	69.6 Å²	69.6	31%	0.313	36%	0.361	S	S	.	.	H	α-helix	trans	-72.9	-42	-178.7	-53.9	171.3	0	0	0	110.5	V910 D923 T928 T929	V910-I925 HydrophobicContact CG2-CB 3.72Å; V910-I925 HydrophobicContact CG2-CD1 3.97Å; V910-I925 HydrophobicContact CG2-CG1 4.46Å; V910-I925 HydrophobicContact CG2-CG2 3.31Å; D923-I925 PolarHBondContact O-N 3.11Å; I925-T928 PolarHBondContact O-N 3.46Å; I925-T929 WeakPolarHBondContact O-CB 3.43Å; I925-T929 PolarHBondContact O-N 3.26Å; I925-T929 PolarHBondContact O-OG1 2.86Å
926	L	85.7	Confident	85	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-66.8	-38.4	175.6	-163.1	69.9	0	0	0	111.5	L846 E920 D923 T929 R930	L846-L926 HydrophobicContact CD2-CD1 4.09Å; L846-L926 HydrophobicContact CD2-CG 4.11Å; L846-L926 HydrophobicContact CG-CD1 3.96Å; L846-L926 HydrophobicContact CG-CG 4.33Å; E920-L926 HydrophobicContact CG-CD2 3.66Å; E920-L926 VanDerWaalsContact O-CD2 3.32Å; E920-L926 WeakPolarHBondContact O-CD2 3.03Å; D923-L926 HydrophobicContact CB-CB 4.17Å; D923-L926 PolarHBondContact O-N 3.08Å; L926-T929 WeakPolarHBondContact O-CB 3.16Å; L926-T929 PolarHBondContact O-N 3.48Å; L926-R930 WeakPolarHBondContact O-CB 3.22Å; L926-R930 PolarHBondContact O-N 2.74Å
927	Y	86.4	Confident	86	Confident	132 Å²	132	65 Å²	65	52%	0.518	32%	0.322	S	S	.	.	H	α-helix	trans	-60.4	-45	172.6	-177	-100	0	0	0	111.9	D923 T929 R930 N931	D923-Y927 WeakPolarHBondContact O-CB 3.32Å; D923-Y927 PolarHBondContact O-N 3.42Å; Y927-T929 VanDerWaalsContact C-N 3.34Å; Y927-T929 PolarHBondContact O-N 3.49Å; Y927-R930 WeakPolarHBondContact O-CB 3.25Å; Y927-R930 PolarHBondContact O-N 3.3Å; Y927-N931 WeakPolarHBondContact CD1-ND2 3.02Å; Y927-N931 WeakPolarHBondContact CE1-ND2 3.43Å; Y927-N931 PolarHBondContact O-N 3.19Å; Y927-N931 PolarHBondContact O-ND2 3.06Å
928	T	89	Confident	86.8	Confident	63 Å²	63	61.6 Å²	61.6	39%	0.387	31%	0.309	S	S	.	.	H	α-helix	trans	-61.9	-43.2	175.3	-56.4	0	0	0	0	111.2	V924 I925 R930 N931 L932	V924-T928 WeakPolarHBondContact O-CB 3.47Å; V924-T928 PolarHBondContact O-N 3.36Å; V924-T928 PolarHBondContact O-OG1 2.81Å; I925-T928 PolarHBondContact O-N 3.46Å; T928-R930 PolarHBondContact O-N 3.12Å; T928-N931 PolarHBondContact O-N 2.9Å; T928-L932 HydrophobicContact CG2-CD1 4.38Å; T928-L932 WeakPolarHBondContact O-CG 3.35Å; T928-L932 PolarHBondContact O-N 3.4Å
929	T	90.1	Very high	87.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-45.8	175	-61.7	0	0	0	0	111.4	G903 T906 R907 I925 L926 Y927 N931 L932 Y933	G903-T929 WeakPolarHBondContact O-CG2 3.43Å; T906-T929 PolarHBondContact OG1-OG1 3.49Å; R907-T929 HydrophobicContact CB-CG2 3.9Å; R907-T929 HydrophobicContact CG-CG2 4.37Å; I925-T929 WeakPolarHBondContact O-CB 3.43Å; I925-T929 PolarHBondContact O-N 3.26Å; I925-T929 PolarHBondContact O-OG1 2.86Å; L926-T929 WeakPolarHBondContact O-CB 3.16Å; L926-T929 PolarHBondContact O-N 3.48Å; Y927-T929 VanDerWaalsContact C-N 3.34Å; Y927-T929 PolarHBondContact O-N 3.49Å; T929-N931 VanDerWaalsContact C-N 3.34Å; T929-N931 PolarHBondContact O-N 2.93Å; T929-L932 PolarHBondContact O-N 3.39Å; T929-Y933 HydrophobicContact CG2-CD2 4.28Å; T929-Y933 HydrophobicContact CG2-CE1 4.39Å; T929-Y933 HydrophobicContact CG2-CE2 4.07Å; T929-Y933 PolarHBondContact O-N 3.31Å
930	R	91	Very high	88.5	Confident	76 Å²	76	51.2 Å²	51.2	29%	0.287	26%	0.264	S	S	.	.	H	α-helix	trans	-58.3	-46.4	176.4	-170.9	179.5	-68.9	146.3	2.3	110.8	L846 L926 Y927 T928 L932 Y933 M934	L846-R930 HydrophobicContact CD2-CB 3.63Å; L846-R930 HydrophobicContact CD2-CG 4.09Å; L926-R930 WeakPolarHBondContact O-CB 3.22Å; L926-R930 PolarHBondContact O-N 2.74Å; Y927-R930 WeakPolarHBondContact O-CB 3.25Å; Y927-R930 PolarHBondContact O-N 3.3Å; T928-R930 PolarHBondContact O-N 3.12Å; R930-L932 PolarHBondContact O-N 3.07Å; R930-Y933 PolarHBondContact O-N 3.35Å; R930-M934 HydrophobicContact CG-CG 4.31Å; R930-M934 WeakPolarHBondContact O-CB 3.15Å; R930-M934 WeakPolarHBondContact O-CG 3.29Å; R930-M934 PolarHBondContact O-N 3.29Å
931	N	90.8	Very high	89.3	Confident	67 Å²	67	54.9 Å²	54.9	36%	0.358	28%	0.277	S	S	.	.	H	α-helix	trans	-60.4	-44.9	176.9	-76.8	-37.6	0	0	0	112.3	Y927 T928 T929 M934 L935	Y927-N931 WeakPolarHBondContact CD1-ND2 3.02Å; Y927-N931 WeakPolarHBondContact CE1-ND2 3.43Å; Y927-N931 PolarHBondContact O-N 3.19Å; Y927-N931 PolarHBondContact O-ND2 3.06Å; T928-N931 PolarHBondContact O-N 2.9Å; T929-N931 VanDerWaalsContact C-N 3.34Å; T929-N931 PolarHBondContact O-N 2.93Å; N931-M934 PolarHBondContact O-N 3.46Å; N931-L935 WeakPolarHBondContact O-CB 3.18Å; N931-L935 VanDerWaalsContact O-CG 3.29Å; N931-L935 WeakPolarHBondContact O-CG 3.24Å; N931-L935 PolarHBondContact O-N 3.22Å
932	L	93.4	Very high	90	Very high	29 Å²	29	57.9 Å²	57.9	15%	0.152	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-43.7	177.4	-70.5	171.9	0	0	0	112.2	L899 I902 T906 T928 T929 R930 L935 G936	L899-L932 HydrophobicContact CD2-CD2 3.98Å; I902-L932 HydrophobicContact CG2-CD1 3.87Å; T906-L932 HydrophobicContact CG2-CD1 4.32Å; T928-L932 HydrophobicContact CG2-CD1 4.38Å; T928-L932 WeakPolarHBondContact O-CG 3.35Å; T928-L932 PolarHBondContact O-N 3.4Å; T929-L932 PolarHBondContact O-N 3.39Å; R930-L932 PolarHBondContact O-N 3.07Å; L932-L935 PolarHBondContact O-N 3.09Å; L932-G936 PolarHBondContact O-N 2.75Å
933	Y	93.7	Very high	90.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-42.2	174.4	-77.5	-0	0	0	0	112.1	F838 L846 E854 T900 F904 T929 R930 G936 L937	F838-Y933 HydrophobicContact CZ-CG 4.25Å; L846-Y933 HydrophobicContact CD1-CD2 3.89Å; L846-Y933 HydrophobicContact CD1-CE2 3.71Å; E854-Y933 PolarHBondContact OE1-OH 3.4Å; E854-Y933 VanDerWaalsContact OE1-OH 3.05Å; T900-Y933 WeakPolarHBondContact O-CE1 3.42Å; F904-Y933 HydrophobicContact CB-CE1 4.49Å; T929-Y933 HydrophobicContact CG2-CD2 4.28Å; T929-Y933 HydrophobicContact CG2-CE1 4.39Å; T929-Y933 HydrophobicContact CG2-CE2 4.07Å; T929-Y933 PolarHBondContact O-N 3.31Å; R930-Y933 PolarHBondContact O-N 3.35Å; Y933-G936 PolarHBondContact O-N 2.88Å; Y933-L937 WeakPolarHBondContact O-CB 3.37Å; Y933-L937 PolarHBondContact O-N 3.28Å
934	M	93.1	Very high	90.7	Very high	67 Å²	67	52.5 Å²	52.5	33%	0.33	26%	0.26	S	S	.	.	H	α-helix	trans	-66.7	-38.5	177.7	-70	-64	-79.7	0	0	112.1	C842 R930 N931 L937 N938	C842-M934 HydrophobicContact CB-CG 4.49Å; C842-M934 HydrophobicContact CB-SD 3.5Å; C842-M934 VanDerWaalsContact CB-SD 3.5Å; R930-M934 HydrophobicContact CG-CG 4.31Å; R930-M934 WeakPolarHBondContact O-CB 3.15Å; R930-M934 WeakPolarHBondContact O-CG 3.29Å; R930-M934 PolarHBondContact O-N 3.29Å; N931-M934 PolarHBondContact O-N 3.46Å; M934-L937 PolarHBondContact O-N 3.2Å; M934-L937 HydrophobicContact SD-CD2 4.11Å; M934-N938 PolarHBondContact O-N 3.34Å; M934-N938 PolarHBondContact O-ND2 3.38Å
935	L	93	Very high	90.7	Very high	96 Å²	96	50.6 Å²	50.6	50%	0.503	25%	0.246	S	C	.	.	H	α-helix	trans	-63.5	-45.3	172.3	-72.8	170.3	0	0	0	111.2	L899 N931 L932 N938 L939	L899-L935 HydrophobicContact CD1-CB 4.18Å; N931-L935 WeakPolarHBondContact O-CB 3.18Å; N931-L935 VanDerWaalsContact O-CG 3.29Å; N931-L935 WeakPolarHBondContact O-CG 3.24Å; N931-L935 PolarHBondContact O-N 3.22Å; L932-L935 PolarHBondContact O-N 3.09Å; L935-N938 PolarHBondContact O-N 3.5Å; L935-L939 PolarHBondContact O-N 3.03Å; L935-L939 VanDerWaalsContact O-N 3.16Å
936	G	93.9	Very high	90.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-44.3	173.7	0	0	0	0	0	113	L932 Y933 N938 L939 F940	L932-G936 PolarHBondContact O-N 2.75Å; Y933-G936 PolarHBondContact O-N 2.88Å; G936-N938 PolarHBondContact O-N 3.17Å; G936-L939 PolarHBondContact O-N 3.17Å; G936-F940 WeakPolarHBondContact O-CD2 3.34Å; G936-F940 PolarHBondContact O-N 3.2Å
937	L	94.4	Very high	90.4	Very high	5 Å²	5	49.6 Å²	49.6	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-59.9	-43.7	176.2	176.1	64.7	0	0	0	111.6	L835 F838 C842 Y933 M934 L939 F940 Y941	L835-L937 HydrophobicContact CD2-CD1 4.1Å; F838-L937 HydrophobicContact CB-CD1 4.28Å; F838-L937 HydrophobicContact CD1-CB 3.92Å; F838-L937 HydrophobicContact CD1-CD1 3.55Å; F838-L937 HydrophobicContact CD1-CG 4.25Å; F838-L937 HydrophobicContact CE1-CB 3.8Å; F838-L937 HydrophobicContact CE1-CD1 4.33Å; F838-L937 HydrophobicContact CG-CD1 4.3Å; C842-L937 HydrophobicContact CB-CD2 4.43Å; Y933-L937 WeakPolarHBondContact O-CB 3.37Å; Y933-L937 PolarHBondContact O-N 3.28Å; M934-L937 PolarHBondContact O-N 3.2Å; M934-L937 HydrophobicContact SD-CD2 4.11Å; L937-L939 VanDerWaalsContact C-N 3.31Å; L937-L939 PolarHBondContact O-N 3.48Å; L937-F940 CarbonylContact O-C 3.58Å; L937-F940 PolarHBondContact O-N 3.35Å; L937-F940 VanDerWaalsContact O-N 3.15Å; L937-Y941 HydrophobicContact CD1-CD2 3.93Å; L937-Y941 HydrophobicContact CD1-CE2 3.57Å; L937-Y941 HydrophobicContact CD2-CE2 4.02Å; L937-Y941 HydrophobicContact CG-CD2 3.82Å; L937-Y941 HydrophobicContact CG-CE2 3.62Å; L937-Y941 WeakPolarHBondContact O-CD2 3.3Å; L937-Y941 PolarHBondContact O-N 2.86Å
938	N	92.9	Very high	90.2	Very high	92 Å²	92	45.7 Å²	45.7	49%	0.492	23%	0.23	S	C	.	.	H	α-helix	trans	-60.1	-40.7	175.8	-81.6	-54.5	0	0	0	112.1	M934 L935 G936 Y941 M942	M934-N938 PolarHBondContact O-N 3.34Å; M934-N938 PolarHBondContact O-ND2 3.38Å; L935-N938 PolarHBondContact O-N 3.5Å; G936-N938 PolarHBondContact O-N 3.17Å; N938-Y941 WeakPolarHBondContact O-CB 3.38Å; N938-Y941 PolarHBondContact O-N 3.13Å; N938-M942 WeakPolarHBondContact O-CG 3.27Å; N938-M942 PolarHBondContact O-N 3.02Å
939	L	94	Very high	89.8	Confident	45 Å²	45	43.8 Å²	43.8	24%	0.236	22%	0.219	C	C	.	.	H	α-helix	trans	-66.1	-37.3	175	-65.8	177.9	0	0	0	112	I892 F895 A896 L899 L935 G936 L937 M942 R943	I892-L939 HydrophobicContact CG2-CB 4.26Å; I892-L939 HydrophobicContact CG2-CD2 4.4Å; F895-L939 HydrophobicContact CB-CD1 3.84Å; A896-L939 HydrophobicContact CB-CB 3.68Å; A896-L939 HydrophobicContact CB-CD1 4.24Å; L899-L939 HydrophobicContact CD1-CD1 3.75Å; L935-L939 PolarHBondContact O-N 3.03Å; L935-L939 VanDerWaalsContact O-N 3.16Å; G936-L939 PolarHBondContact O-N 3.17Å; L937-L939 VanDerWaalsContact C-N 3.31Å; L937-L939 PolarHBondContact O-N 3.48Å; L939-M942 WeakPolarHBondContact O-CB 3.38Å; L939-M942 PolarHBondContact O-N 3.3Å; L939-R943 PolarHBondContact O-N 3.2Å
940	F	93.3	Very high	89.4	Confident	3 Å²	3	45.9 Å²	45.9	1%	0.013	23%	0.23	C	C	.	.	H	α-helix	trans	-67	-34.4	171.8	-70.2	-57.8	0	0	0	112.9	H831 F834 L835 F838 V861 Y864 A896 I897 T900 G936 L937 R943 T944	H831-F940 PolarHBondContact NE2-O 3.4Å; F834-F940 HydrophobicContact CE1-CB 4.03Å; F834-F940 HydrophobicContact CE1-CD1 4.1Å; F834-F940 AromaticContact CE1-CD2 3.79Å; F834-F940 HydrophobicContact CE1-CD2 3.79Å; F834-F940 HydrophobicContact CE1-CE2 4.23Å; F834-F940 AromaticContact CE1-CG 3.73Å; F834-F940 HydrophobicContact CE1-CG 3.73Å; F834-F940 AromaticContact CZ-CD2 3.83Å; F834-F940 HydrophobicContact CZ-CD2 3.83Å; F834-F940 AromaticContact CZ-CE2 3.93Å; F834-F940 HydrophobicContact CZ-CE2 3.93Å; F834-F940 HydrophobicContact CZ-CG 4.24Å; F834-F940 HydrophobicContact CZ-CZ 4.41Å; L835-F940 HydrophobicContact CD2-CB 3.67Å; F838-F940 HydrophobicContact CE1-CD2 4.46Å; V861-F940 HydrophobicContact CG2-CE2 4.24Å; V861-F940 HydrophobicContact CG2-CZ 4.39Å; Y864-F940 HydrophobicContact CD2-CE1 4.33Å; A896-F940 HydrophobicContact CB-CD1 3.96Å; A896-F940 HydrophobicContact CB-CD2 4.17Å; A896-F940 HydrophobicContact CB-CE1 3.69Å; A896-F940 HydrophobicContact CB-CE2 3.92Å; A896-F940 HydrophobicContact CB-CG 4.19Å; A896-F940 HydrophobicContact CB-CZ 3.67Å; I897-F940 HydrophobicContact CG1-CZ 4.33Å; T900-F940 HydrophobicContact CG2-CE2 3.95Å; G936-F940 WeakPolarHBondContact O-CD2 3.34Å; G936-F940 PolarHBondContact O-N 3.2Å; L937-F940 CarbonylContact O-C 3.58Å; L937-F940 PolarHBondContact O-N 3.35Å; L937-F940 VanDerWaalsContact O-N 3.15Å; F940-R943 WeakPolarHBondContact O-CB 3.44Å; F940-R943 PolarHBondContact O-N 3.32Å; F940-T944 PolarHBondContact O-N 2.84Å
941	Y	92.5	Very high	88.9	Confident	96 Å²	96	43.6 Å²	43.6	38%	0.376	23%	0.226	S	C	.	.	H	α-helix	trans	-64.1	-42.1	169.6	-85.7	-65.8	0	0	0	111.4	L835 L937 N938 R943 T944	L835-Y941 HydrophobicContact CB-CE1 4.09Å; L835-Y941 HydrophobicContact CD1-CD1 3.91Å; L835-Y941 HydrophobicContact CD1-CE1 4.06Å; L835-Y941 HydrophobicContact CD2-CD1 4.19Å; L835-Y941 HydrophobicContact CD2-CD2 4.4Å; L835-Y941 HydrophobicContact CD2-CE1 4.32Å; L835-Y941 HydrophobicContact CD2-CG 4.21Å; L835-Y941 HydrophobicContact CG-CD1 4.5Å; L835-Y941 HydrophobicContact CG-CE1 4.4Å; L937-Y941 HydrophobicContact CD1-CD2 3.93Å; L937-Y941 HydrophobicContact CD1-CE2 3.57Å; L937-Y941 HydrophobicContact CD2-CE2 4.02Å; L937-Y941 HydrophobicContact CG-CD2 3.82Å; L937-Y941 HydrophobicContact CG-CE2 3.62Å; L937-Y941 WeakPolarHBondContact O-CD2 3.3Å; L937-Y941 PolarHBondContact O-N 2.86Å; N938-Y941 WeakPolarHBondContact O-CB 3.38Å; N938-Y941 PolarHBondContact O-N 3.13Å; Y941-R943 PolarHBondContact O-N 3.25Å; Y941-T944 WeakPolarHBondContact O-CB 3.36Å; Y941-T944 PolarHBondContact O-N 2.97Å
942	M	89.6	Confident	88.3	Confident	112 Å²	112	44.4 Å²	44.4	55%	0.552	24%	0.235	S	C	*	.	H	α-helix	trans	-60.3	-34.5	173.5	-68.6	-67.2	-95.2	0	0	111.5	W889 N938 L939 T944 L945	W889-M942 WeakPolarHBondContact CZ3-O 3.41Å; N938-M942 WeakPolarHBondContact O-CG 3.27Å; N938-M942 PolarHBondContact O-N 3.02Å; L939-M942 WeakPolarHBondContact O-CB 3.38Å; L939-M942 PolarHBondContact O-N 3.3Å; M942-T944 PolarHBondContact O-N 3Å; M942-L945 WeakPolarHBondContact O-CB 3.27Å; M942-L945 PolarHBondContact O-N 2.85Å
943	R	88.4	Confident	87.7	Confident	20 Å²	20	48.8 Å²	48.8	8%	0.075	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-27.8	172.4	177.7	59.3	165.6	-167.3	-14.2	113.3	D893 L939 F940 Y941 L945 H946	D893-R943 WeakPolarHBondContact OD1-CD 3.46Å; D893-R943 WeakPolarHBondContact OD1-CG 3.38Å; D893-R943 IonicContact OD1-CZ 3.64Å; D893-R943 IonicContact OD1-NE 2.64Å; D893-R943 PolarHBondContact OD1-NE 3.16Å; D893-R943 IonicContact OD2-CZ 2.73Å; D893-R943 IonicContact OD2-NE 3.19Å; D893-R943 PolarHBondContact OD2-NE 2.92Å; D893-R943 VanDerWaalsContact OD2-NE 3.09Å; D893-R943 IonicContact OD2-NH1 3.81Å; D893-R943 PolarHBondContact OD2-NH1 3.33Å; D893-R943 IonicContact OD2-NH2 3.88Å; D893-R943 PolarHBondContact OD2-NH2 3.3Å; L939-R943 PolarHBondContact O-N 3.2Å; F940-R943 WeakPolarHBondContact O-CB 3.44Å; F940-R943 PolarHBondContact O-N 3.32Å; Y941-R943 PolarHBondContact O-N 3.25Å; R943-L945 PolarHBondContact O-N 3.29Å; R943-H946 VanDerWaalsContact O-CB 3.3Å; R943-H946 WeakPolarHBondContact O-CB 3.38Å; R943-H946 PolarHBondContact O-N 3.41Å
944	T	87.4	Confident	87.2	Confident	29 Å²	29	52.6 Å²	52.6	18%	0.178	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-27.4	173.7	-60.7	0	0	0	0	112.4	H831 L832 L835 F940 Y941 M942 H946 I947 T948	H831-T944 PolarHBondContact NE2-OG1 2.89Å; L832-T944 HydrophobicContact CD2-CG2 4.23Å; L835-T944 WeakPolarHBondContact CD1-OG1 3.31Å; F940-T944 PolarHBondContact O-N 2.84Å; Y941-T944 WeakPolarHBondContact O-CB 3.36Å; Y941-T944 PolarHBondContact O-N 2.97Å; M942-T944 PolarHBondContact O-N 3Å; T944-H946 PolarHBondContact O-N 2.71Å; T944-I947 WeakPolarHBondContact O-CA 3.28Å; T944-I947 WeakPolarHBondContact O-CB 3.45Å; T944-I947 PolarHBondContact O-N 3.42Å; T944-T948 PolarHBondContact O-N 3.02Å
945	L	85.4	Confident	86.7	Confident	67 Å²	67	49.4 Å²	49.4	35%	0.351	26%	0.261	S	S	.	.	H	α-helix	trans	-62.2	-32.2	174.9	-165.2	62.8	0	0	0	112.4	W889 M942 R943 I947 T948 S949 L958	W889-L945 HydrophobicContact CH2-CB 3.98Å; W889-L945 HydrophobicContact CH2-CD2 4.03Å; W889-L945 HydrophobicContact CH2-CG 4.19Å; W889-L945 HydrophobicContact CZ3-CB 4.43Å; M942-L945 WeakPolarHBondContact O-CB 3.27Å; M942-L945 PolarHBondContact O-N 2.85Å; R943-L945 PolarHBondContact O-N 3.29Å; L945-I947 VanDerWaalsContact C-N 3.31Å; L945-T948 PolarHBondContact O-N 3.43Å; L945-T948 PolarHBondContact O-OG1 3.45Å; L945-S949 PolarHBondContact O-N 2.76Å; L945-S949 VanDerWaalsContact O-N 3.15Å; L945-L958 HydrophobicContact CD1-CD1 3.39Å; L945-L958 HydrophobicContact CD1-CD2 4.23Å; L945-L958 HydrophobicContact CD1-CG 4.44Å; L945-L958 HydrophobicContact CD2-CD1 3.75Å; L945-L958 HydrophobicContact CG-CD1 3.53Å; L945-L958 HydrophobicContact CG-CD2 3.85Å; L945-L958 HydrophobicContact CG-CG 4.29Å; L945-L958 WeakPolarHBondContact O-CD2 3.42Å
946	H	82.6	Confident	86.3	Confident	16 Å²	16	45.6 Å²	45.6	7%	0.074	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-35.8	172.8	-174.7	-105.6	0	0	0	111.6	W889 R943 T944 S949 M1113 E1116	W889-H946 AromaticContact CD1-CD2 3.77Å; W889-H946 HydrophobicContact CD2-CB 4.11Å; W889-H946 AromaticContact CD2-CD2 3.95Å; W889-H946 AromaticContact CE2-CD2 3.9Å; W889-H946 HydrophobicContact CE3-CB 3.99Å; W889-H946 AromaticContact CG-CD2 3.89Å; W889-H946 HydrophobicContact CH2-CB 4.35Å; W889-H946 HydrophobicContact CZ2-CB 4.44Å; W889-H946 HydrophobicContact CZ3-CB 4.12Å; W889-H946 AromaticContact NE1-CD2 3.77Å; R943-H946 VanDerWaalsContact O-CB 3.3Å; R943-H946 WeakPolarHBondContact O-CB 3.38Å; R943-H946 PolarHBondContact O-N 3.41Å; T944-H946 PolarHBondContact O-N 2.71Å; H946-S949 VanDerWaalsContact O-CB 3.28Å; H946-S949 WeakPolarHBondContact O-CB 3.18Å; H946-S949 PolarHBondContact O-N 3.4Å; H946-S949 PolarHBondContact O-OG 3.39Å; H946-M1113 WeakPolarHBondContact NE2-CE 3.42Å; H946-E1116 IonicContact CE1-OE2 2.67Å
947	I	83.7	Confident	85.8	Confident	26 Å²	26	53 Å²	53	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-68.7	-42.6	177.2	-58.6	174.3	0	0	0	110.5	F824 S828 H831 T944 L945 S949 I950	F824-I947 HydrophobicContact CE2-CG2 3.98Å; F824-I947 HydrophobicContact CZ-CG2 3.74Å; S828-I947 WeakPolarHBondContact OG-CG2 3.37Å; H831-I947 HydrophobicContact CB-CD1 4.1Å; H831-I947 WeakPolarHBondContact CD2-CD1 3.21Å; T944-I947 WeakPolarHBondContact O-CA 3.28Å; T944-I947 WeakPolarHBondContact O-CB 3.45Å; T944-I947 PolarHBondContact O-N 3.42Å; L945-I947 VanDerWaalsContact C-N 3.31Å; I947-S949 PolarHBondContact O-N 3.43Å; I947-I950 WeakPolarHBondContact O-CG2 3.39Å; I947-I950 PolarHBondContact O-N 2.79Å
948	T	81.5	Confident	85.2	Confident	50 Å²	50	54 Å²	54	31%	0.307	28%	0.275	S	S	.	.	H	α-helix	trans	-68.2	-20.6	177.9	63.5	0	0	0	0	112.8	T944 L945 I950 S951	T944-T948 PolarHBondContact O-N 3.02Å; L945-T948 PolarHBondContact O-N 3.43Å; L945-T948 PolarHBondContact O-OG1 3.45Å; T948-I950 PolarHBondContact O-N 2.81Å; T948-I950 VanDerWaalsContact O-N 3.09Å; T948-S951 VanDerWaalsContact O-CB 3.28Å; T948-S951 WeakPolarHBondContact O-CB 3.5Å; T948-S951 PolarHBondContact O-N 3.09Å
949	S	81.8	Confident	84.7	Confident	23 Å²	23	53.1 Å²	53.1	16%	0.161	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.4	176.6	84.9	0	0	0	0	114.1	L945 H946 I947 S951 G955 W1106	L945-S949 PolarHBondContact O-N 2.76Å; L945-S949 VanDerWaalsContact O-N 3.15Å; H946-S949 VanDerWaalsContact O-CB 3.28Å; H946-S949 WeakPolarHBondContact O-CB 3.18Å; H946-S949 PolarHBondContact O-N 3.4Å; H946-S949 PolarHBondContact O-OG 3.39Å; I947-S949 PolarHBondContact O-N 3.43Å; S949-S951 VanDerWaalsContact C-N 3.26Å; S949-S951 PolarHBondContact O-N 2.79Å; S949-G955 WeakPolarHBondContact O-CA 3.44Å; S949-W1106 PolarHBondContact O-NE1 3.23Å
950	I	82	Confident	84.1	Confident	44 Å²	44	52 Å²	52	23%	0.226	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-19.8	177.1	-152	162.1	0	0	0	113.1	W677 F824 I947 T948	W677-I950 HydrophobicContact CH2-CD1 3.35Å; W677-I950 HydrophobicContact CZ2-CD1 3.47Å; W677-I950 VanDerWaalsContact CZ2-CD1 3.47Å; W677-I950 HydrophobicContact CZ3-CD1 4.24Å; F824-I950 HydrophobicContact CD1-CD1 4.48Å; F824-I950 HydrophobicContact CD2-CD1 3.98Å; F824-I950 HydrophobicContact CE1-CD1 4.4Å; F824-I950 HydrophobicContact CE1-CG2 3.98Å; F824-I950 HydrophobicContact CE2-CB 4.4Å; F824-I950 HydrophobicContact CE2-CD1 3.89Å; F824-I950 HydrophobicContact CE2-CG2 4.1Å; F824-I950 HydrophobicContact CG-CD1 4.3Å; F824-I950 HydrophobicContact CZ-CB 4.26Å; F824-I950 HydrophobicContact CZ-CD1 4.12Å; F824-I950 HydrophobicContact CZ-CG2 3.47Å; F824-I950 VanDerWaalsContact CZ-CG2 3.47Å; I947-I950 WeakPolarHBondContact O-CG2 3.39Å; I947-I950 PolarHBondContact O-N 2.79Å; T948-I950 PolarHBondContact O-N 2.81Å; T948-I950 VanDerWaalsContact O-N 3.09Å
951	S	80.2	Confident	83.7	Confident	29 Å²	29	56.7 Å²	56.7	20%	0.203	28%	0.284	C	S	.	.	S	Bend	trans	-64.6	132.1	-178.2	171.1	0	0	0	0	110.2	T948 S949 I953 I954 G955 W1106	T948-S951 VanDerWaalsContact O-CB 3.28Å; T948-S951 WeakPolarHBondContact O-CB 3.5Å; T948-S951 PolarHBondContact O-N 3.09Å; S949-S951 VanDerWaalsContact C-N 3.26Å; S949-S951 PolarHBondContact O-N 2.79Å; S951-I953 PolarHBondContact O-N 3.4Å; S951-I953 PolarHBondContact OG-N 3.48Å; S951-I954 PolarHBondContact O-N 3.46Å; S951-I954 PolarHBondContact OG-N 2.93Å; S951-G955 WeakPolarHBondContact O-CA 3.27Å; S951-G955 PolarHBondContact O-N 2.92Å; S951-W1106 WeakPolarHBondContact O-CZ2 3.49Å
952	P	78.4	Confident	83.2	Confident	84 Å²	84	54.5 Å²	54.5	55%	0.545	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.9	176.2	25.5	-32.9	0	0	0	113.9	P956 W1106	P952-P956 WeakPolarHBondContact O-CD 3.39Å; P952-W1106 HydrophobicContact CB-CH2 3.77Å; P952-W1106 HydrophobicContact CB-CZ2 4.39Å
953	I	79.8	Confident	82.7	Confident	120 Å²	120	51.1 Å²	51.1	62%	0.615	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-42.9	-177.9	-57.3	168.7	0	0	0	110.5	S951	S951-I953 PolarHBondContact O-N 3.4Å; S951-I953 PolarHBondContact OG-N 3.48Å
954	I	82.5	Confident	82.5	Confident	80 Å²	80	51.1 Å²	51.1	41%	0.41	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-33.6	-172	-58.8	164.9	0	0	0	111.2	S951 R957 L958	S951-I954 PolarHBondContact O-N 3.46Å; S951-I954 PolarHBondContact OG-N 2.93Å; I954-R957 WeakPolarHBondContact O-CB 3.37Å; I954-R957 PolarHBondContact O-N 3.14Å; I954-L958 WeakPolarHBondContact O-CB 3.37Å; I954-L958 PolarHBondContact O-N 2.72Å
955	G	83.8	Confident	82.4	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-58.4	-52	-172.8	0	0	0	0	0	115.2	S949 S951 R957 L958 K959	S949-G955 WeakPolarHBondContact O-CA 3.44Å; S951-G955 WeakPolarHBondContact O-CA 3.27Å; S951-G955 PolarHBondContact O-N 2.92Å; G955-R957 VanDerWaalsContact C-N 3.29Å; G955-R957 PolarHBondContact O-N 3.39Å; G955-L958 PolarHBondContact O-N 3.21Å; G955-K959 PolarHBondContact O-N 3.36Å
956	P	84.5	Confident	82.2	Confident	16 Å²	16	59 Å²	59	10%	0.104	30%	0.299	C	S	.	.	H	α-helix	trans	-58.9	-41.1	175.1	-25.1	34.7	0	0	0	112.4	P952 L958 K959 M960 W1106	P952-P956 WeakPolarHBondContact O-CD 3.39Å; P956-L958 PolarHBondContact O-N 3.48Å; P956-K959 PolarHBondContact O-N 3.32Å; P956-M960 WeakPolarHBondContact O-CB 3.43Å; P956-M960 PolarHBondContact O-N 3.38Å; P956-W1106 HydrophobicContact CB-CB 4.49Å; P956-W1106 HydrophobicContact CG-CB 4.21Å; P956-W1106 HydrophobicContact CG-CD2 3.83Å; P956-W1106 HydrophobicContact CG-CE3 3.95Å; P956-W1106 HydrophobicContact CG-CG 3.92Å
957	R	82.6	Confident	82.1	Confident	156 Å²	156	64 Å²	64	59%	0.589	32%	0.32	S	S	*	.	H	α-helix	trans	-65	-38.8	178.1	-64.1	-175	175.7	-172.9	-1.4	112.3	I954 G955 K959 M960 M961	I954-R957 WeakPolarHBondContact O-CB 3.37Å; I954-R957 PolarHBondContact O-N 3.14Å; G955-R957 VanDerWaalsContact C-N 3.29Å; G955-R957 PolarHBondContact O-N 3.39Å; R957-K959 VanDerWaalsContact C-N 3.33Å; R957-M960 WeakPolarHBondContact O-CB 3.37Å; R957-M960 PolarHBondContact O-N 3.16Å; R957-M961 WeakPolarHBondContact O-CB 3.22Å; R957-M961 VanDerWaalsContact O-CG 3.26Å; R957-M961 WeakPolarHBondContact O-CG 3.43Å; R957-M961 PolarHBondContact O-N 3.28Å
958	L	83.4	Confident	82.4	Confident	25 Å²	25	64 Å²	64	13%	0.131	32%	0.32	C	S	.	.	H	α-helix	trans	-65.5	-40.9	176.7	-170.7	71.3	0	0	0	111.4	L945 I954 G955 P956 M960 M961 A962	L945-L958 HydrophobicContact CD1-CD1 3.39Å; L945-L958 HydrophobicContact CD1-CD2 4.23Å; L945-L958 HydrophobicContact CD1-CG 4.44Å; L945-L958 HydrophobicContact CD2-CD1 3.75Å; L945-L958 HydrophobicContact CG-CD1 3.53Å; L945-L958 HydrophobicContact CG-CD2 3.85Å; L945-L958 HydrophobicContact CG-CG 4.29Å; L945-L958 WeakPolarHBondContact O-CD2 3.42Å; I954-L958 WeakPolarHBondContact O-CB 3.37Å; I954-L958 PolarHBondContact O-N 2.72Å; G955-L958 PolarHBondContact O-N 3.21Å; P956-L958 PolarHBondContact O-N 3.48Å; L958-M960 VanDerWaalsContact C-N 3.33Å; L958-M961 PolarHBondContact O-N 2.87Å; L958-A962 WeakPolarHBondContact O-CB 3.14Å; L958-A962 PolarHBondContact O-N 3.27Å
959	K	80.5	Confident	82.7	Confident	73 Å²	73	63.5 Å²	63.5	32%	0.317	32%	0.316	S	S	.	.	H	α-helix	trans	-64.8	-40.6	176.1	-166.3	162.4	-168.4	162.1	0	111.6	G955 P956 R957 A962 D963 H1105 W1106	G955-K959 PolarHBondContact O-N 3.36Å; P956-K959 PolarHBondContact O-N 3.32Å; R957-K959 VanDerWaalsContact C-N 3.33Å; K959-A962 PolarHBondContact O-N 3.14Å; K959-D963 PolarHBondContact O-N 3.29Å; K959-D963 VanDerWaalsContact O-N 3.16Å; K959-H1105 HydrophobicContact CD-CB 3.82Å; K959-H1105 PolarHBondContact NZ-O 3.41Å; K959-W1106 HydrophobicContact CD-CB 4.49Å
960	M	83.1	Confident	83	Confident	23 Å²	23	66.7 Å²	66.7	11%	0.113	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-49.3	172.6	-176.5	-172.5	76.9	0	0	111.5	P956 R957 L958 A962 D963 M964 V1095 I1098	P956-M960 WeakPolarHBondContact O-CB 3.43Å; P956-M960 PolarHBondContact O-N 3.38Å; R957-M960 WeakPolarHBondContact O-CB 3.37Å; R957-M960 PolarHBondContact O-N 3.16Å; L958-M960 VanDerWaalsContact C-N 3.33Å; M960-A962 PolarHBondContact O-N 2.9Å; M960-D963 PolarHBondContact O-N 3.46Å; M960-M964 HydrophobicContact CE-SD 4.13Å; M960-M964 HydrophobicContact CG-CG 4.41Å; M960-M964 HydrophobicContact CG-SD 3.9Å; M960-M964 VanDerWaalsContact O-CG 3.23Å; M960-M964 WeakPolarHBondContact O-CG 3.09Å; M960-M964 PolarHBondContact O-N 2.94Å; M960-V1095 HydrophobicContact CE-CG1 4.21Å; M960-V1095 HydrophobicContact CE-CG2 3.84Å; M960-V1095 HydrophobicContact CG-CG2 4.44Å; M960-V1095 HydrophobicContact SD-CB 4.03Å; M960-V1095 HydrophobicContact SD-CG1 3.69Å; M960-V1095 HydrophobicContact SD-CG2 3.82Å; M960-I1098 HydrophobicContact CB-CG2 4.15Å; M960-I1098 HydrophobicContact CG-CB 4.36Å; M960-I1098 HydrophobicContact CG-CG2 3.98Å
961	M	83.2	Confident	83.3	Confident	100 Å²	100	67.7 Å²	67.7	49%	0.493	34%	0.339	S	S	.	.	H	α-helix	trans	-58	-45.9	176.6	-73.3	170.5	178.4	0	0	111.9	R957 L958 D963 M964 L965	R957-M961 WeakPolarHBondContact O-CB 3.22Å; R957-M961 VanDerWaalsContact O-CG 3.26Å; R957-M961 WeakPolarHBondContact O-CG 3.43Å; R957-M961 PolarHBondContact O-N 3.28Å; L958-M961 PolarHBondContact O-N 2.87Å; M961-D963 VanDerWaalsContact C-N 3.31Å; M961-D963 PolarHBondContact O-N 3.34Å; M961-M964 PolarHBondContact O-N 2.93Å; M961-L965 WeakPolarHBondContact O-CB 3.34Å; M961-L965 WeakPolarHBondContact O-CG 3.36Å; M961-L965 PolarHBondContact O-N 2.95Å
962	A	82.1	Confident	83.6	Confident	50 Å²	50	66.8 Å²	66.8	41%	0.413	33%	0.332	S	S	.	.	H	α-helix	trans	-60.2	-40.7	179	0	0	0	0	0	112.6	L958 K959 M960 R966	L958-A962 WeakPolarHBondContact O-CB 3.14Å; L958-A962 PolarHBondContact O-N 3.27Å; K959-A962 PolarHBondContact O-N 3.14Å; M960-A962 PolarHBondContact O-N 2.9Å; A962-R966 WeakPolarHBondContact O-CB 3.44Å; A962-R966 PolarHBondContact O-N 3.33Å; A962-R966 VanDerWaalsContact O-N 3.11Å
963	D	80.5	Confident	84	Confident	42 Å²	42	67.2 Å²	67.2	23%	0.225	33%	0.33	C	S	.	.	H	α-helix	trans	-71.7	-38.9	176.5	-81.4	-7	0	0	0	112.3	K959 M960 M961 R966 K967 I1098	K959-D963 PolarHBondContact O-N 3.29Å; K959-D963 VanDerWaalsContact O-N 3.16Å; M960-D963 PolarHBondContact O-N 3.46Å; M961-D963 VanDerWaalsContact C-N 3.31Å; M961-D963 PolarHBondContact O-N 3.34Å; D963-R966 PolarHBondContact O-N 2.84Å; D963-K967 WeakPolarHBondContact O-CB 3.45Å; D963-K967 WeakPolarHBondContact O-CG 3.43Å; D963-K967 PolarHBondContact O-N 3.4Å; D963-I1098 HydrophobicContact CB-CD1 3.69Å
964	M	83	Confident	84.4	Confident	20 Å²	20	66.5 Å²	66.5	10%	0.099	33%	0.326	C	S	.	.	H	α-helix	trans	-61.1	-45	173.8	-70.7	168.9	72	0	0	111.5	M960 M961 R966 D968 L969 F1091 T1094 V1095	M960-M964 HydrophobicContact CE-SD 4.13Å; M960-M964 HydrophobicContact CG-CG 4.41Å; M960-M964 HydrophobicContact CG-SD 3.9Å; M960-M964 VanDerWaalsContact O-CG 3.23Å; M960-M964 WeakPolarHBondContact O-CG 3.09Å; M960-M964 PolarHBondContact O-N 2.94Å; M961-M964 PolarHBondContact O-N 2.93Å; M964-R966 VanDerWaalsContact C-N 3.33Å; M964-R966 PolarHBondContact O-N 3.13Å; M964-D968 WeakPolarHBondContact O-CB 3.34Å; M964-D968 PolarHBondContact O-N 3.49Å; M964-L969 PolarHBondContact O-N 3.03Å; M964-L969 VanDerWaalsContact O-N 3.13Å; M964-F1091 HydrophobicContact CB-CD1 4.13Å; M964-F1091 HydrophobicContact CB-CE1 4.04Å; M964-F1091 HydrophobicContact CE-CB 3.39Å; M964-F1091 HydrophobicContact CE-CD1 3.52Å; M964-F1091 HydrophobicContact CE-CD2 4Å; M964-F1091 HydrophobicContact CE-CE1 4.21Å; M964-F1091 HydrophobicContact CE-CG 3.37Å; M964-T1094 HydrophobicContact CG-CG2 3.75Å; M964-V1095 HydrophobicContact CE-CG2 3.46Å; M964-V1095 VanDerWaalsContact CE-CG2 3.46Å; M964-V1095 HydrophobicContact SD-CG2 3.35Å; M964-V1095 WeakPolarHBondContact SD-CG2 3.44Å
965	L	84.8	Confident	84.7	Confident	85 Å²	85	65.2 Å²	65.2	45%	0.445	32%	0.322	S	S	.	.	I	π-helix	trans	-60.5	-44.9	176.8	-69.4	171.2	0	0	0	110.6	M961 L969 I970	M961-L965 WeakPolarHBondContact O-CB 3.34Å; M961-L965 WeakPolarHBondContact O-CG 3.36Å; M961-L965 PolarHBondContact O-N 2.95Å; L965-L969 HydrophobicContact CD2-CB 4.16Å; L965-L969 HydrophobicContact CD2-CD2 3.28Å; L965-L969 HydrophobicContact CD2-CG 4.32Å; L965-L969 WeakPolarHBondContact O-CB 3.37Å; L965-L969 PolarHBondContact O-N 3.2Å; L965-I970 WeakPolarHBondContact O-CG1 3.26Å; L965-I970 PolarHBondContact O-N 2.85Å
966	R	81.9	Confident	84.8	Confident	177 Å²	177	66.3 Å²	66.3	67%	0.668	33%	0.326	S	S	*	.	I	π-helix	trans	-72.2	-43.4	-176.8	-170.3	-176.8	-60.3	-163.9	-1.6	113.4	A962 D963 M964 I970	A962-R966 WeakPolarHBondContact O-CB 3.44Å; A962-R966 PolarHBondContact O-N 3.33Å; A962-R966 VanDerWaalsContact O-N 3.11Å; D963-R966 PolarHBondContact O-N 2.84Å; M964-R966 VanDerWaalsContact C-N 3.33Å; M964-R966 PolarHBondContact O-N 3.13Å; R966-I970 HydrophobicContact CG-CD1 4.39Å
967	K	81.7	Confident	84.9	Confident	120 Å²	120	67.5 Å²	67.5	52%	0.522	34%	0.338	S	S	.	.	I	π-helix	trans	-86.5	-34.3	-171.7	-68.6	177.3	-177.5	165.3	0	113	D963 P971	D963-K967 WeakPolarHBondContact O-CB 3.45Å; D963-K967 WeakPolarHBondContact O-CG 3.43Å; D963-K967 PolarHBondContact O-N 3.4Å; K967-P971 WeakPolarHBondContact O-CG 3.49Å
968	D	88.5	Confident	85.2	Confident	25 Å²	25	65.2 Å²	65.2	13%	0.134	34%	0.336	C	S	.	.	I	π-helix	trans	-113.4	-47.9	-172.6	-48.8	-32.8	0	0	0	111.4	M964 L972 F1091 T1094	M964-D968 WeakPolarHBondContact O-CB 3.34Å; M964-D968 PolarHBondContact O-N 3.49Å; D968-L972 WeakPolarHBondContact O-CB 3.22Å; D968-L972 PolarHBondContact O-N 3.04Å; D968-L972 VanDerWaalsContact O-N 3.16Å; D968-F1091 HydrophobicContact CB-CD1 3.92Å; D968-F1091 HydrophobicContact CB-CE1 3.81Å; D968-T1094 PolarHBondContact OD1-OG1 2.92Å; D968-T1094 WeakPolarHBondContact OD2-CB 3.41Å; D968-T1094 VanDerWaalsContact OD2-CG2 3.24Å; D968-T1094 WeakPolarHBondContact OD2-CG2 3.33Å; D968-T1094 PolarHBondContact OD2-OG1 3.41Å
969	L	87.5	Confident	85.4	Confident	40 Å²	40	67.6 Å²	67.6	21%	0.209	35%	0.345	C	S	.	.	I	π-helix	trans	-68.1	-46	-176.6	-172.5	69.9	0	0	0	112.4	M964 L965 L972 L973 L1087 F1091	M964-L969 PolarHBondContact O-N 3.03Å; M964-L969 VanDerWaalsContact O-N 3.13Å; L965-L969 HydrophobicContact CD2-CB 4.16Å; L965-L969 HydrophobicContact CD2-CD2 3.28Å; L965-L969 HydrophobicContact CD2-CG 4.32Å; L965-L969 WeakPolarHBondContact O-CB 3.37Å; L965-L969 PolarHBondContact O-N 3.2Å; L969-L972 CarbonylContact O-C 3.59Å; L969-L972 PolarHBondContact O-N 3.24Å; L969-L973 HydrophobicContact CD1-CD1 4.43Å; L969-L973 HydrophobicContact CD1-CG 4.16Å; L969-L973 HydrophobicContact CD2-CD1 4.02Å; L969-L973 HydrophobicContact CG-CD1 3.8Å; L969-L973 HydrophobicContact CG-CG 3.98Å; L969-L973 WeakPolarHBondContact O-CB 3.49Å; L969-L973 WeakPolarHBondContact O-CG 3.33Å; L969-L973 PolarHBondContact O-N 2.85Å; L969-L1087 HydrophobicContact CD1-CD1 4.21Å; L969-L1087 HydrophobicContact CD1-CD2 4.05Å; L969-F1091 HydrophobicContact CB-CE1 4.31Å; L969-F1091 HydrophobicContact CB-CZ 4.04Å; L969-F1091 HydrophobicContact CD1-CZ 4.23Å
970	I	88.1	Confident	85.6	Confident	91 Å²	91	65.3 Å²	65.3	47%	0.467	34%	0.336	S	S	.	.	H	α-helix	trans	-59.8	-51.4	-177.5	-69.4	172.8	0	0	0	111.6	L965 R966 L972 L973 I974	L965-I970 WeakPolarHBondContact O-CG1 3.26Å; L965-I970 PolarHBondContact O-N 2.85Å; R966-I970 HydrophobicContact CG-CD1 4.39Å; I970-L972 VanDerWaalsContact C-N 3.29Å; I970-L972 PolarHBondContact O-N 2.71Å; I970-L973 PolarHBondContact O-N 3.26Å; I970-I974 WeakPolarHBondContact O-CG1 3.11Å; I970-I974 PolarHBondContact O-N 3.42Å
971	P	88.2	Confident	85.7	Confident	64 Å²	64	68 Å²	68	42%	0.416	35%	0.35	S	S	.	.	H	α-helix	trans	-60.1	-39.4	175.7	-25.9	36.9	0	0	0	112.6	K967 I974 V975	K967-P971 WeakPolarHBondContact O-CG 3.49Å; P971-I974 WeakPolarHBondContact O-CB 3.13Å; P971-I974 PolarHBondContact O-N 3.45Å; P971-V975 PolarHBondContact O-N 3.41Å; P971-V975 VanDerWaalsContact O-N 3.15Å
972	L	87.1	Confident	85.9	Confident	11 Å²	11	66.5 Å²	66.5	6%	0.058	35%	0.35	C	S	.	.	H	α-helix	trans	-71	-33	179	-163.5	74.8	0	0	0	112.7	D968 L969 I970 I974 V975 F976 L1083 L1086 L1087	D968-L972 WeakPolarHBondContact O-CB 3.22Å; D968-L972 PolarHBondContact O-N 3.04Å; D968-L972 VanDerWaalsContact O-N 3.16Å; L969-L972 CarbonylContact O-C 3.59Å; L969-L972 PolarHBondContact O-N 3.24Å; I970-L972 VanDerWaalsContact C-N 3.29Å; I970-L972 PolarHBondContact O-N 2.71Å; L972-I974 PolarHBondContact O-N 3.22Å; L972-V975 HydrophobicContact CD1-CB 4.31Å; L972-V975 CarbonylContact O-C 3.54Å; L972-V975 WeakPolarHBondContact O-CA 3.44Å; L972-V975 WeakPolarHBondContact O-CB 3.3Å; L972-V975 PolarHBondContact O-N 3.39Å; L972-V975 VanDerWaalsContact O-N 3.08Å; L972-F976 HydrophobicContact CD2-CD2 4.21Å; L972-F976 HydrophobicContact CD2-CE2 3.44Å; L972-F976 VanDerWaalsContact CD2-CE2 3.44Å; L972-F976 HydrophobicContact CD2-CZ 4.05Å; L972-F976 HydrophobicContact CG-CD2 3.93Å; L972-F976 HydrophobicContact CG-CE2 3.66Å; L972-F976 HydrophobicContact CG-CZ 4.45Å; L972-F976 WeakPolarHBondContact O-CD2 3.34Å; L972-F976 PolarHBondContact O-N 2.77Å; L972-L1083 HydrophobicContact CD1-CD2 4.33Å; L972-L1086 HydrophobicContact CD1-CD2 4.04Å; L972-L1087 HydrophobicContact CD2-CB 3.4Å; L972-L1087 HydrophobicContact CD2-CD1 3.53Å; L972-L1087 HydrophobicContact CD2-CD2 4.04Å; L972-L1087 HydrophobicContact CD2-CG 3.79Å
973	L	86.3	Confident	86.2	Confident	93 Å²	93	64.3 Å²	64.3	49%	0.487	33%	0.331	S	S	.	.	H	α-helix	trans	-61.9	-34.5	172.3	-82.1	172.5	0	0	0	111.5	L969 I970 F976 A977	L969-L973 HydrophobicContact CD1-CD1 4.43Å; L969-L973 HydrophobicContact CD1-CG 4.16Å; L969-L973 HydrophobicContact CD2-CD1 4.02Å; L969-L973 HydrophobicContact CG-CD1 3.8Å; L969-L973 HydrophobicContact CG-CG 3.98Å; L969-L973 WeakPolarHBondContact O-CB 3.49Å; L969-L973 WeakPolarHBondContact O-CG 3.33Å; L969-L973 PolarHBondContact O-N 2.85Å; I970-L973 PolarHBondContact O-N 3.26Å; L973-F976 PolarHBondContact O-N 2.84Å; L973-A977 WeakPolarHBondContact O-CB 3.16Å; L973-A977 PolarHBondContact O-N 2.77Å
974	I	89.1	Confident	86.5	Confident	104 Å²	104	62.3 Å²	62.3	53%	0.533	32%	0.32	S	S	.	.	H	α-helix	trans	-65.2	-43.6	172	-62.9	167.7	0	0	0	109.9	I970 P971 L972 A977 I978	I970-I974 WeakPolarHBondContact O-CG1 3.11Å; I970-I974 PolarHBondContact O-N 3.42Å; P971-I974 WeakPolarHBondContact O-CB 3.13Å; P971-I974 PolarHBondContact O-N 3.45Å; L972-I974 PolarHBondContact O-N 3.22Å; I974-A977 PolarHBondContact O-N 3.12Å; I974-I978 HydrophobicContact CG2-CD1 4.32Å; I974-I978 WeakPolarHBondContact O-CG1 3.22Å; I974-I978 PolarHBondContact O-N 3.12Å
975	V	89.5	Confident	86.7	Confident	54 Å²	54	65.3 Å²	65.3	33%	0.327	34%	0.339	S	S	.	.	H	α-helix	trans	-60.9	-47.1	174.9	177.3	0	0	0	0	111.1	P971 L972 A977 I978 F979 L1083	P971-V975 PolarHBondContact O-N 3.41Å; P971-V975 VanDerWaalsContact O-N 3.15Å; L972-V975 HydrophobicContact CD1-CB 4.31Å; L972-V975 CarbonylContact O-C 3.54Å; L972-V975 WeakPolarHBondContact O-CA 3.44Å; L972-V975 WeakPolarHBondContact O-CB 3.3Å; L972-V975 PolarHBondContact O-N 3.39Å; L972-V975 VanDerWaalsContact O-N 3.08Å; V975-A977 VanDerWaalsContact C-N 3.34Å; V975-A977 PolarHBondContact O-N 2.71Å; V975-I978 WeakPolarHBondContact O-CB 3.43Å; V975-I978 PolarHBondContact O-N 3.36Å; V975-F979 HydrophobicContact CG1-CD2 3.83Å; V975-F979 HydrophobicContact CG1-CE2 3.63Å; V975-F979 VanDerWaalsContact O-CD2 3.24Å; V975-F979 WeakPolarHBondContact O-CD2 3.02Å; V975-F979 PolarHBondContact O-N 3.32Å; V975-F979 VanDerWaalsContact O-N 3.15Å; V975-L1083 HydrophobicContact CG1-CD1 4.43Å; V975-L1083 HydrophobicContact CG1-CD2 3.87Å
976	F	86.2	Confident	86.9	Confident	23 Å²	23	67 Å²	67	10%	0.101	34%	0.34	C	S	.	.	H	α-helix	trans	-57.1	-47	173.8	-79.1	-62.5	0	0	0	111.1	L972 L973 I978 F979 I980 V1079 L1083 I1084	L972-F976 HydrophobicContact CD2-CD2 4.21Å; L972-F976 HydrophobicContact CD2-CE2 3.44Å; L972-F976 VanDerWaalsContact CD2-CE2 3.44Å; L972-F976 HydrophobicContact CD2-CZ 4.05Å; L972-F976 HydrophobicContact CG-CD2 3.93Å; L972-F976 HydrophobicContact CG-CE2 3.66Å; L972-F976 HydrophobicContact CG-CZ 4.45Å; L972-F976 WeakPolarHBondContact O-CD2 3.34Å; L972-F976 PolarHBondContact O-N 2.77Å; L973-F976 PolarHBondContact O-N 2.84Å; F976-I978 VanDerWaalsContact C-N 3.27Å; F976-I978 PolarHBondContact O-N 3.48Å; F976-F979 PolarHBondContact O-N 2.72Å; F976-F979 VanDerWaalsContact O-N 3.13Å; F976-I980 HydrophobicContact CB-CD1 4.07Å; F976-I980 WeakPolarHBondContact O-CB 3.45Å; F976-I980 VanDerWaalsContact O-CD1 3.28Å; F976-I980 WeakPolarHBondContact O-CD1 3.49Å; F976-I980 WeakPolarHBondContact O-CG1 3.15Å; F976-I980 PolarHBondContact O-N 2.83Å; F976-V1079 HydrophobicContact CD1-CG1 4.1Å; F976-V1079 HydrophobicContact CE1-CG1 3.82Å; F976-L1083 HydrophobicContact CD1-CB 4.29Å; F976-L1083 HydrophobicContact CD1-CD1 3.89Å; F976-L1083 HydrophobicContact CE1-CB 3.44Å; F976-L1083 VanDerWaalsContact CE1-CB 3.44Å; F976-L1083 HydrophobicContact CE1-CD1 3.87Å; F976-L1083 HydrophobicContact CE1-CG 4.3Å; F976-L1083 HydrophobicContact CZ-CB 3.69Å; F976-I1084 HydrophobicContact CE1-CG1 4.45Å; F976-I1084 HydrophobicContact CZ-CG1 4.12Å
977	A	86	Confident	87.1	Confident	42 Å²	42	58.6 Å²	58.6	35%	0.347	31%	0.308	S	S	.	.	H	α-helix	trans	-57.8	-39.4	178.9	0	0	0	0	0	112.3	L973 I974 V975 I980 I981	L973-A977 WeakPolarHBondContact O-CB 3.16Å; L973-A977 PolarHBondContact O-N 2.77Å; I974-A977 PolarHBondContact O-N 3.12Å; V975-A977 VanDerWaalsContact C-N 3.34Å; V975-A977 PolarHBondContact O-N 2.71Å; A977-I980 PolarHBondContact O-N 3.41Å; A977-I981 WeakPolarHBondContact O-CB 3.34Å; A977-I981 WeakPolarHBondContact O-CD1 3.14Å; A977-I981 WeakPolarHBondContact O-CG1 3.35Å; A977-I981 PolarHBondContact O-N 3.39Å
978	I	89.6	Confident	87.3	Confident	107 Å²	107	53.7 Å²	53.7	55%	0.549	29%	0.287	S	S	.	.	H	α-helix	trans	-61.9	-48.9	175.6	-66.4	163.9	0	0	0	110.7	I974 V975 F976 S982	I974-I978 HydrophobicContact CG2-CD1 4.32Å; I974-I978 WeakPolarHBondContact O-CG1 3.22Å; I974-I978 PolarHBondContact O-N 3.12Å; V975-I978 WeakPolarHBondContact O-CB 3.43Å; V975-I978 PolarHBondContact O-N 3.36Å; F976-I978 VanDerWaalsContact C-N 3.27Å; F976-I978 PolarHBondContact O-N 3.48Å; I978-S982 VanDerWaalsContact O-CB 3.23Å; I978-S982 WeakPolarHBondContact O-CB 3.3Å; I978-S982 PolarHBondContact O-N 3.05Å
979	F	86.7	Confident	87.1	Confident	75 Å²	75	54.5 Å²	54.5	33%	0.329	30%	0.302	S	S	.	.	H	α-helix	trans	-67.9	-37.4	179.2	-76.3	-71.2	0	0	0	112.8	V975 F976 S982 Y983 I1078 L1083	V975-F979 HydrophobicContact CG1-CD2 3.83Å; V975-F979 HydrophobicContact CG1-CE2 3.63Å; V975-F979 VanDerWaalsContact O-CD2 3.24Å; V975-F979 WeakPolarHBondContact O-CD2 3.02Å; V975-F979 PolarHBondContact O-N 3.32Å; V975-F979 VanDerWaalsContact O-N 3.15Å; F976-F979 PolarHBondContact O-N 2.72Å; F976-F979 VanDerWaalsContact O-N 3.13Å; F979-S982 PolarHBondContact O-N 3.5Å; F979-Y983 VanDerWaalsContact O-CB 3.29Å; F979-Y983 WeakPolarHBondContact O-CB 3.33Å; F979-Y983 PolarHBondContact O-N 2.8Å; F979-I1078 HydrophobicContact CD1-CG2 4.33Å; F979-I1078 HydrophobicContact CE1-CG2 4.11Å; F979-I1078 HydrophobicContact CZ-CG2 4.34Å; F979-L1083 HydrophobicContact CD2-CD1 3.54Å; F979-L1083 HydrophobicContact CE2-CD1 3.91Å; F979-L1083 HydrophobicContact CE2-CD2 4.41Å; F979-L1083 HydrophobicContact CG-CD1 4.24Å
980	I	84.9	Confident	87.1	Confident	25 Å²	25	55 Å²	55	13%	0.128	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-50.3	176.2	-68.3	160	0	0	0	109.9	F976 A977 S982 Y983 G984 A1036 I1040 Y1075	F976-I980 HydrophobicContact CB-CD1 4.07Å; F976-I980 WeakPolarHBondContact O-CB 3.45Å; F976-I980 VanDerWaalsContact O-CD1 3.28Å; F976-I980 WeakPolarHBondContact O-CD1 3.49Å; F976-I980 WeakPolarHBondContact O-CG1 3.15Å; F976-I980 PolarHBondContact O-N 2.83Å; A977-I980 PolarHBondContact O-N 3.41Å; I980-S982 VanDerWaalsContact C-N 3.35Å; I980-S982 PolarHBondContact O-N 3.38Å; I980-Y983 PolarHBondContact O-N 3.36Å; I980-G984 PolarHBondContact O-N 3.41Å; I980-A1036 HydrophobicContact CG2-CB 3.66Å; I980-A1036 WeakPolarHBondContact O-CB 3.48Å; I980-I1040 HydrophobicContact CD1-CD1 3.28Å; I980-I1040 HydrophobicContact CD1-CG1 4.22Å; I980-I1040 HydrophobicContact CG1-CD1 3.57Å; I980-I1040 HydrophobicContact CG1-CG1 4.01Å; I980-Y1075 WeakPolarHBondContact CG1-OH 3.37Å
981	I	85.5	Confident	86.8	Confident	79 Å²	79	50.7 Å²	50.7	41%	0.405	28%	0.282	S	S	.	.	H	α-helix	trans	-64	-42.9	178.8	-67.3	167.1	0	0	0	110.4	A977 Y983 G984 V985 F1033	A977-I981 WeakPolarHBondContact O-CB 3.34Å; A977-I981 WeakPolarHBondContact O-CD1 3.14Å; A977-I981 WeakPolarHBondContact O-CG1 3.35Å; A977-I981 PolarHBondContact O-N 3.39Å; I981-Y983 PolarHBondContact O-N 3.08Å; I981-G984 PolarHBondContact O-N 2.88Å; I981-V985 WeakPolarHBondContact O-CG2 3.4Å; I981-V985 PolarHBondContact O-N 3.29Å; I981-F1033 HydrophobicContact CG1-CE1 4.18Å
982	S	87.8	Confident	86.5	Confident	69 Å²	69	48.2 Å²	48.2	48%	0.483	26%	0.264	S	S	.	.	H	α-helix	trans	-58.7	-47.3	177	173.8	0	0	0	0	112.2	I978 F979 I980 V985 W986	I978-S982 VanDerWaalsContact O-CB 3.23Å; I978-S982 WeakPolarHBondContact O-CB 3.3Å; I978-S982 PolarHBondContact O-N 3.05Å; F979-S982 PolarHBondContact O-N 3.5Å; I980-S982 VanDerWaalsContact C-N 3.35Å; I980-S982 PolarHBondContact O-N 3.38Å; S982-V985 PolarHBondContact O-N 3.48Å; S982-W986 PolarHBondContact O-N 2.97Å; S982-W986 VanDerWaalsContact O-N 3.09Å
983	Y	88	Confident	86.2	Confident	5 Å²	5	50.9 Å²	50.9	2%	0.02	28%	0.282	C	S	.	.	H	α-helix	trans	-63.4	-45.4	175.9	170.6	-103.5	0	0	0	111.9	F979 I980 I981 V985 W986 F987 S1039 V1071 L1072 Y1075	F979-Y983 VanDerWaalsContact O-CB 3.29Å; F979-Y983 WeakPolarHBondContact O-CB 3.33Å; F979-Y983 PolarHBondContact O-N 2.8Å; I980-Y983 PolarHBondContact O-N 3.36Å; I981-Y983 PolarHBondContact O-N 3.08Å; Y983-V985 VanDerWaalsContact C-N 3.3Å; Y983-V985 PolarHBondContact O-N 3.27Å; Y983-W986 PolarHBondContact O-N 3.22Å; Y983-W986 VanDerWaalsContact O-N 3.13Å; Y983-F987 HydrophobicContact CE1-CD2 4.16Å; Y983-F987 HydrophobicContact CE2-CD2 4.19Å; Y983-F987 AromaticContact CZ-CD2 3.62Å; Y983-F987 VanDerWaalsContact O-CB 3.25Å; Y983-F987 WeakPolarHBondContact O-CB 3.19Å; Y983-F987 PolarHBondContact O-N 3.45Å; Y983-F987 VanDerWaalsContact OH-CD2 3.27Å; Y983-F987 WeakPolarHBondContact OH-CD2 3.47Å; Y983-S1039 VanDerWaalsContact CE1-CB 3.43Å; Y983-S1039 VanDerWaalsContact CE1-OG 3.3Å; Y983-S1039 WeakPolarHBondContact CE1-OG 3.47Å; Y983-S1039 PolarHBondContact OH-OG 3.22Å; Y983-V1071 HydrophobicContact CD2-CG1 3.83Å; Y983-V1071 HydrophobicContact CE2-CG1 3.81Å; Y983-L1072 WeakPolarHBondContact OH-CD1 3.44Å; Y983-Y1075 VanDerWaalsContact CB-CD2 3.44Å; Y983-Y1075 VanDerWaalsContact CB-CE2 3.5Å; Y983-Y1075 HydrophobicContact CD1-CD1 4.26Å; Y983-Y1075 HydrophobicContact CD1-CD2 4.31Å; Y983-Y1075 HydrophobicContact CD1-CE1 4.16Å; Y983-Y1075 HydrophobicContact CD1-CE2 4.18Å; Y983-Y1075 HydrophobicContact CD1-CG 4.32Å; Y983-Y1075 HydrophobicContact CD2-CD1 4.09Å; Y983-Y1075 AromaticContact CD2-CD2 3.78Å; Y983-Y1075 HydrophobicContact CD2-CD2 3.78Å; Y983-Y1075 HydrophobicContact CD2-CE2 4.44Å; Y983-Y1075 AromaticContact CD2-CG 3.55Å; Y983-Y1075 HydrophobicContact CD2-CG 3.55Å; Y983-Y1075 HydrophobicContact CE1-CD1 4.34Å; Y983-Y1075 HydrophobicContact CE1-CE1 4.37Å; Y983-Y1075 HydrophobicContact CE2-CD1 4.16Å; Y983-Y1075 AromaticContact CE2-CG 3.98Å; Y983-Y1075 HydrophobicContact CE2-CG 3.98Å; Y983-Y1075 HydrophobicContact CG-CD1 4.12Å; Y983-Y1075 AromaticContact CG-CD2 3.58Å; Y983-Y1075 HydrophobicContact CG-CD2 3.58Å; Y983-Y1075 HydrophobicContact CG-CE1 4.34Å; Y983-Y1075 AromaticContact CG-CE2 3.79Å; Y983-Y1075 HydrophobicContact CG-CE2 3.79Å; Y983-Y1075 AromaticContact CG-CG 3.73Å; Y983-Y1075 HydrophobicContact CG-CG 3.73Å
984	G	85.2	Confident	85.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-55.3	-44.5	177	0	0	0	0	0	112.8	I980 I981 Q988	I980-G984 PolarHBondContact O-N 3.41Å; I981-G984 PolarHBondContact O-N 2.88Å; G984-Q988 WeakPolarHBondContact O-CB 3.44Å; G984-Q988 PolarHBondContact O-N 3.43Å
985	V	88	Confident	85.3	Confident	82 Å²	82	48.8 Å²	48.8	50%	0.497	28%	0.275	S	S	.	.	H	α-helix	trans	-64.8	-44.6	176.7	174.8	0	0	0	0	111.1	I981 S982 Y983 G989 L1032	I981-V985 WeakPolarHBondContact O-CG2 3.4Å; I981-V985 PolarHBondContact O-N 3.29Å; S982-V985 PolarHBondContact O-N 3.48Å; Y983-V985 VanDerWaalsContact C-N 3.3Å; Y983-V985 PolarHBondContact O-N 3.27Å; V985-G989 PolarHBondContact O-N 2.98Å; V985-L1032 HydrophobicContact CB-CD1 4.39Å; V985-L1032 HydrophobicContact CG2-CD1 3.78Å
986	W	88.8	Confident	84.7	Confident	121 Å²	121	50.1 Å²	50.1	46%	0.458	28%	0.276	S	S	.	.	H	α-helix	trans	-64.6	-44.8	179.7	-167.1	0.6	0	0	0	111.8	S982 Y983 L990 V1071 L1074	S982-W986 PolarHBondContact O-N 2.97Å; S982-W986 VanDerWaalsContact O-N 3.09Å; Y983-W986 PolarHBondContact O-N 3.22Å; Y983-W986 VanDerWaalsContact O-N 3.13Å; W986-L990 WeakPolarHBondContact O-CG 3.49Å; W986-L990 PolarHBondContact O-N 2.79Å; W986-L990 VanDerWaalsContact O-N 3.16Å; W986-V1071 HydrophobicContact CB-CG1 4.48Å; W986-V1071 HydrophobicContact CD2-CB 4.46Å; W986-V1071 HydrophobicContact CD2-CG1 3.6Å; W986-V1071 HydrophobicContact CD2-CG2 4Å; W986-V1071 HydrophobicContact CE3-CG1 3.59Å; W986-V1071 HydrophobicContact CE3-CG2 4.49Å; W986-V1071 HydrophobicContact CG-CG1 4.01Å; W986-V1071 HydrophobicContact CG-CG2 4.48Å; W986-V1071 HydrophobicContact CH2-CG1 4.46Å; W986-V1071 HydrophobicContact CH2-CG2 4.22Å; W986-V1071 HydrophobicContact CZ2-CG1 4.49Å; W986-V1071 HydrophobicContact CZ2-CG2 3.7Å; W986-V1071 HydrophobicContact CZ3-CG1 4.03Å; W986-L1074 HydrophobicContact CZ3-CD2 4.25Å
987	F	86.1	Confident	84.3	Confident	1 Å²	1	51.1 Å²	51.1	0%	0.004	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-54.1	176.4	-171.7	-80.4	0	0	0	111.4	Y983 G989 L990 I991 R1035 V1046 V1067	Y983-F987 HydrophobicContact CE1-CD2 4.16Å; Y983-F987 HydrophobicContact CE2-CD2 4.19Å; Y983-F987 AromaticContact CZ-CD2 3.62Å; Y983-F987 VanDerWaalsContact O-CB 3.25Å; Y983-F987 WeakPolarHBondContact O-CB 3.19Å; Y983-F987 PolarHBondContact O-N 3.45Å; Y983-F987 VanDerWaalsContact OH-CD2 3.27Å; Y983-F987 WeakPolarHBondContact OH-CD2 3.47Å; F987-G989 VanDerWaalsContact C-N 3.32Å; F987-G989 PolarHBondContact O-N 3.49Å; F987-L990 PolarHBondContact O-N 2.78Å; F987-I991 HydrophobicContact CD1-CD1 3.49Å; F987-I991 VanDerWaalsContact CD1-CD1 3.49Å; F987-I991 HydrophobicContact CE1-CD1 3.05Å; F987-I991 HydrophobicContact CE1-CG1 4.41Å; F987-I991 HydrophobicContact CE2-CD1 4.17Å; F987-I991 HydrophobicContact CG-CD1 4.2Å; F987-I991 HydrophobicContact CZ-CD1 3.43Å; F987-I991 VanDerWaalsContact CZ-CD1 3.43Å; F987-I991 WeakPolarHBondContact O-CG1 3.21Å; F987-I991 PolarHBondContact O-N 2.88Å; F987-R1035 HydrophobicContact CD1-CB 4.19Å; F987-R1035 HydrophobicContact CD1-CG 4.42Å; F987-R1035 HydrophobicContact CE1-CB 4.12Å; F987-R1035 HydrophobicContact CE1-CG 3.97Å; F987-V1046 HydrophobicContact CE2-CB 4.43Å; F987-V1046 HydrophobicContact CE2-CG1 3.76Å; F987-V1046 HydrophobicContact CE2-CG2 3.75Å; F987-V1046 HydrophobicContact CZ-CB 4.49Å; F987-V1046 HydrophobicContact CZ-CG1 3.93Å; F987-V1046 HydrophobicContact CZ-CG2 3.94Å; F987-V1067 HydrophobicContact CD2-CB 4.42Å; F987-V1067 HydrophobicContact CD2-CG1 3.23Å; F987-V1067 HydrophobicContact CD2-CG2 4.34Å; F987-V1067 HydrophobicContact CE2-CG1 3.27Å; F987-V1067 HydrophobicContact CG-CG1 4.25Å; F987-V1067 HydrophobicContact CZ-CG1 4.31Å
988	Q	85.3	Confident	83.6	Confident	16 Å²	16	50.8 Å²	50.8	8%	0.075	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-38.2	-178.5	-174	64.7	22.6	0	0	112	G984 Y992 L1032	G984-Q988 WeakPolarHBondContact O-CB 3.44Å; G984-Q988 PolarHBondContact O-N 3.43Å; Q988-Y992 PolarHBondContact O-N 3.28Å; Q988-Y992 VanDerWaalsContact O-N 3.13Å; Q988-L1032 HydrophobicContact CB-CB 4.39Å; Q988-L1032 HydrophobicContact CB-CD1 4.26Å; Q988-L1032 HydrophobicContact CB-CG 4.48Å; Q988-L1032 HydrophobicContact CG-CB 4.46Å
989	G	85.7	Confident	82.7	Confident	43 Å²	43	48 Å²	48	44%	0.443	26%	0.259	S	S	.	.	H	α-helix	trans	-69.2	-33.5	-179.6	0	0	0	0	0	114.3	V985 F987	V985-G989 PolarHBondContact O-N 2.98Å; F987-G989 VanDerWaalsContact C-N 3.32Å; F987-G989 PolarHBondContact O-N 3.49Å
990	L	86.8	Confident	81.9	Confident	51 Å²	51	48.1 Å²	48.1	27%	0.267	26%	0.26	S	S	.	.	H	α-helix	trans	-76.9	-40.7	177.1	-76.9	175	0	0	0	112.5	W986 F987 S1060 G1063 T1066 V1067 V1071	W986-L990 WeakPolarHBondContact O-CG 3.49Å; W986-L990 PolarHBondContact O-N 2.79Å; W986-L990 VanDerWaalsContact O-N 3.16Å; F987-L990 PolarHBondContact O-N 2.78Å; L990-S1060 PolarHBondContact O-OG 3.37Å; L990-G1063 WeakPolarHBondContact O-CA 3.41Å; L990-T1066 HydrophobicContact CD1-CG2 4.15Å; L990-V1067 HydrophobicContact CB-CG2 3.94Å; L990-V1067 HydrophobicContact CD1-CG2 3.63Å; L990-V1067 HydrophobicContact CG-CG2 4.44Å; L990-V1071 HydrophobicContact CD1-CG2 3.82Å
991	I	81.3	Confident	81.1	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-73.6	-41.6	-176.4	-65.3	175.9	0	0	0	111	F987 P993 S1060 F1064 V1067	F987-I991 HydrophobicContact CD1-CD1 3.49Å; F987-I991 VanDerWaalsContact CD1-CD1 3.49Å; F987-I991 HydrophobicContact CE1-CD1 3.05Å; F987-I991 HydrophobicContact CE1-CG1 4.41Å; F987-I991 HydrophobicContact CE2-CD1 4.17Å; F987-I991 HydrophobicContact CG-CD1 4.2Å; F987-I991 HydrophobicContact CZ-CD1 3.43Å; F987-I991 VanDerWaalsContact CZ-CD1 3.43Å; F987-I991 WeakPolarHBondContact O-CG1 3.21Å; F987-I991 PolarHBondContact O-N 2.88Å; I991-P993 VanDerWaalsContact C-CD 3.48Å; I991-P993 VanDerWaalsContact O-CD 3.28Å; I991-P993 WeakPolarHBondContact O-CD 3.24Å; I991-S1060 PolarHBondContact O-N 2.88Å; I991-S1060 PolarHBondContact O-OG 3.3Å; I991-F1064 HydrophobicContact CB-CE2 4.41Å; I991-F1064 HydrophobicContact CD1-CD1 4.25Å; I991-F1064 HydrophobicContact CD1-CD2 4.2Å; I991-F1064 HydrophobicContact CD1-CE1 3.96Å; I991-F1064 HydrophobicContact CD1-CE2 3.92Å; I991-F1064 HydrophobicContact CD1-CG 4.36Å; I991-F1064 HydrophobicContact CD1-CZ 3.78Å; I991-F1064 HydrophobicContact CG1-CD2 4.06Å; I991-F1064 HydrophobicContact CG1-CE2 4.13Å; I991-F1064 HydrophobicContact CG1-CG 4.38Å; I991-F1064 HydrophobicContact CG1-CZ 4.48Å; I991-F1064 HydrophobicContact CG2-CD2 3.84Å; I991-F1064 HydrophobicContact CG2-CE2 3.39Å; I991-F1064 HydrophobicContact CG2-CZ 4.12Å; I991-V1067 HydrophobicContact CG1-CG2 4.48Å
992	Y	82.7	Confident	80.3	Confident	11 Å²	11	48.7 Å²	48.7	4%	0.043	27%	0.271	C	S	.	.	S	Bend	trans	-119.4	74.7	-179.9	-57.1	-83.3	0	0	0	110.7	Q988 N994 S995 F996 R1035 Y1057	Q988-Y992 PolarHBondContact O-N 3.28Å; Q988-Y992 VanDerWaalsContact O-N 3.13Å; Y992-N994 PolarHBondContact O-N 3.06Å; Y992-S995 WeakPolarHBondContact O-CA 3.47Å; Y992-S995 PolarHBondContact O-N 2.76Å; Y992-F996 WeakPolarHBondContact CD1-O 3.46Å; Y992-R1035 PolarHBondContact OH-NH2 3.31Å; Y992-Y1057 PolarHBondContact OH-O 2.88Å
993	P	80.2	Confident	79.5	Confident	67 Å²	67	48.3 Å²	48.3	44%	0.435	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-59	128.6	176.3	25.9	-33.7	0	0	0	109.5	I991 S995 F996	I991-P993 VanDerWaalsContact C-CD 3.48Å; I991-P993 VanDerWaalsContact O-CD 3.28Å; I991-P993 WeakPolarHBondContact O-CD 3.24Å; P993-S995 PolarHBondContact O-N 3.01Å; P993-F996 PolarHBondContact O-N 2.92Å
994	N	79.3	Confident	78.5	Confident	134 Å²	134	54.5 Å²	54.5	72%	0.717	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	55.2	20.3	-173.1	-59.8	-36.7	0	0	0	114.8	Y992 F996	Y992-N994 PolarHBondContact O-N 3.06Å; N994-F996 HydrophobicContact CB-CD2 3.68Å; N994-F996 HydrophobicContact CB-CE2 3.75Å; N994-F996 PolarHBondContact O-N 3.5Å
995	S	76.8	Confident	77.6	Confident	20 Å²	20	61.4 Å²	61.4	14%	0.14	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	66.5	18.4	179.5	-158.4	0	0	0	0	114.9	Y992 P993 R1022 L1023 S1028	Y992-S995 WeakPolarHBondContact O-CA 3.47Å; Y992-S995 PolarHBondContact O-N 2.76Å; P993-S995 PolarHBondContact O-N 3.01Å; S995-R1022 CarbonylContact O-C 3.53Å; S995-R1022 WeakPolarHBondContact O-CA 3.48Å; S995-L1023 PolarHBondContact O-N 3.25Å; S995-L1023 WeakPolarHBondContact OG-CB 3.38Å; S995-L1023 PolarHBondContact OG-O 3.1Å; S995-S1028 PolarHBondContact OG-OG 3Å
996	F	78	Confident	76.6	Confident	82 Å²	82	62.4 Å²	62.4	36%	0.36	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	143	173.6	-67.4	-71.2	0	0	0	111.1	Y992 P993 N994 M1020 R1022	Y992-F996 WeakPolarHBondContact CD1-O 3.46Å; P993-F996 PolarHBondContact O-N 2.92Å; N994-F996 HydrophobicContact CB-CD2 3.68Å; N994-F996 HydrophobicContact CB-CE2 3.75Å; N994-F996 PolarHBondContact O-N 3.5Å; F996-M1020 HydrophobicContact CB-CB 4.44Å; F996-M1020 HydrophobicContact CB-SD 4.08Å; F996-M1020 HydrophobicContact CD1-CB 3.69Å; F996-M1020 HydrophobicContact CE1-CB 4.27Å; F996-M1020 HydrophobicContact CG-CB 4.27Å; F996-M1020 HydrophobicContact CG-SD 4.48Å; F996-R1022 HydrophobicContact CD1-CB 4.34Å; F996-R1022 HydrophobicContact CE1-CB 4.19Å
997	Y	77.8	Confident	75.5	Confident	43 Å²	43	65.1 Å²	65.1	17%	0.169	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	156.1	175.5	65.8	-90.8	0	0	0	111.2	T999 Q1021 L1023	Y997-T999 HydrophobicContact CE2-CG2 4.21Å; Y997-Q1021 VanDerWaalsContact CD1-O 3.32Å; Y997-Q1021 WeakPolarHBondContact CD1-O 3.35Å; Y997-Q1021 HydrophobicContact CE1-CB 3.81Å; Y997-Q1021 HydrophobicContact CE2-CB 4.36Å; Y997-Q1021 PolarHBondContact N-O 3.34Å; Y997-Q1021 PolarHBondContact OH-OE1 2.84Å; Y997-L1023 HydrophobicContact CD1-CB 4.4Å
998	E	71.9	Confident	74.6	Confident	36 Å²	36	72.1 Å²	72.1	17%	0.168	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-101.3	144.9	171.5	-66.4	-175	170.8	0	0	109.1	K1006 M1020 C1058	E998-K1006 IonicContact OE1-NZ 2.8Å; E998-K1006 PolarHBondContact OE1-NZ 3.27Å; E998-K1006 IonicContact OE2-NZ 3.75Å; E998-M1020 HydrophobicContact CG-CE 4.34Å; E998-C1058 PolarHBondContact N-O 3.26Å; E998-C1058 WeakPolarHBondContact O-CA 3.47Å; E998-C1058 WeakPolarHBondContact O-CB 3.18Å; E998-C1058 PolarHBondContact O-N 3.43Å
999	T	70.9	Confident	73.4	Confident	48 Å²	48	76 Å²	76	29%	0.294	39%	0.389	S	S	.	.			trans	-84	152.8	170.6	54.1	0	0	0	0	110.3	Y997 G1001 Q1002 R1003	Y997-T999 HydrophobicContact CE2-CG2 4.21Å; T999-G1001 PolarHBondContact O-N 3.47Å; T999-G1001 VanDerWaalsContact O-N 3.16Å; T999-Q1002 WeakPolarHBondContact O-CA 3.35Å; T999-Q1002 WeakPolarHBondContact O-CB 3.5Å; T999-Q1002 PolarHBondContact O-N 3.25Å; T999-Q1002 VanDerWaalsContact OG1-CD 3.27Å; T999-Q1002 VanDerWaalsContact OG1-CG 3.28Å; T999-Q1002 WeakPolarHBondContact OG1-CG 3.37Å; T999-Q1002 PolarHBondContact OG1-OE1 3.49Å; T999-Q1002 VanDerWaalsContact OG1-OE1 3.07Å; T999-R1003 PolarHBondContact O-N 2.95Å; T999-R1003 VanDerWaalsContact O-N 3.13Å
1000	H	68.6	Low	71.8	Confident	78 Å²	78	80.5 Å²	80.5	36%	0.361	40%	0.403	S	S	.	.	H	α-helix	trans	-49.2	-44.7	177.8	178.2	-108.6	0	0	0	112.2	Q1002 R1003 Q1004 C1052	H1000-Q1002 VanDerWaalsContact C-N 3.31Å; H1000-Q1002 PolarHBondContact O-N 3.47Å; H1000-R1003 PolarHBondContact O-N 2.99Å; H1000-Q1004 PolarHBondContact O-N 3.36Å; H1000-Q1004 VanDerWaalsContact O-N 3.11Å; H1000-C1052 PolarHBondContact CD2-O 3.47Å
1001	G	68.2	Low	70.4	Confident	39 Å²	39	85.6 Å²	85.6	40%	0.402	43%	0.429	S	S	.	.	H	α-helix	trans	-64.4	-28	177.3	0	0	0	0	0	114.9	T999 K1005	T999-G1001 PolarHBondContact O-N 3.47Å; T999-G1001 VanDerWaalsContact O-N 3.16Å; G1001-K1005 VanDerWaalsContact O-CG 3.3Å; G1001-K1005 WeakPolarHBondContact O-CG 3.26Å; G1001-K1005 PolarHBondContact O-N 2.84Å
1002	Q	68.4	Low	69.2	Low	77 Å²	77	91.2 Å²	91.2	36%	0.36	46%	0.464	S	S	.	.	H	α-helix	trans	-74.7	-42.2	174.1	-76.6	168.7	-29.6	0	0	111.4	T999 H1000 K1005 K1006 D1019	T999-Q1002 WeakPolarHBondContact O-CA 3.35Å; T999-Q1002 WeakPolarHBondContact O-CB 3.5Å; T999-Q1002 PolarHBondContact O-N 3.25Å; T999-Q1002 VanDerWaalsContact OG1-CD 3.27Å; T999-Q1002 VanDerWaalsContact OG1-CG 3.28Å; T999-Q1002 WeakPolarHBondContact OG1-CG 3.37Å; T999-Q1002 PolarHBondContact OG1-OE1 3.49Å; T999-Q1002 VanDerWaalsContact OG1-OE1 3.07Å; H1000-Q1002 VanDerWaalsContact C-N 3.31Å; H1000-Q1002 PolarHBondContact O-N 3.47Å; Q1002-K1005 PolarHBondContact O-N 3.33Å; Q1002-K1006 PolarHBondContact O-N 2.93Å; Q1002-D1019 PolarHBondContact NE2-O 3.05Å
1003	R	70.7	Confident	68	Low	61 Å²	61	96.6 Å²	96.6	23%	0.23	49%	0.489	C	S	.	.	H	α-helix	trans	-65.8	-41.6	-178.9	-168.8	161	-179.7	-178.7	-11.2	111.9	T999 H1000 K1005 K1006 H1007 G1059 E1061	T999-R1003 PolarHBondContact O-N 2.95Å; T999-R1003 VanDerWaalsContact O-N 3.13Å; H1000-R1003 PolarHBondContact O-N 2.99Å; R1003-K1005 PolarHBondContact O-N 3.09Å; R1003-K1006 WeakPolarHBondContact O-CB 3.28Å; R1003-K1006 PolarHBondContact O-N 2.83Å; R1003-H1007 PolarHBondContact O-N 3.05Å; R1003-G1059 PolarHBondContact NH1-O 3.19Å; R1003-E1061 IonicContact CZ-OE2 3.86Å; R1003-E1061 IonicContact NE-OE2 3.93Å; R1003-E1061 VanDerWaalsContact NH2-CB 3.3Å; R1003-E1061 IonicContact NH2-OE2 2.84Å; R1003-E1061 PolarHBondContact NH2-OE2 2.79Å
1004	Q	67.4	Low	66.8	Low	135 Å²	135	98 Å²	98	63%	0.631	49%	0.492	S	S	*	.	H	α-helix	trans	-64.7	-39.6	176.1	-158.2	178.1	18.4	0	0	112.2	H1000 H1007	H1000-Q1004 PolarHBondContact O-N 3.36Å; H1000-Q1004 VanDerWaalsContact O-N 3.11Å; Q1004-H1007 PolarHBondContact O-N 2.9Å
1005	K	67.7	Low	65.5	Low	144 Å²	144	96 Å²	96	63%	0.626	49%	0.489	S	S	*	.	H	α-helix	trans	-65.5	-37.1	175.1	-79.1	179	-179.2	-178	0	113	G1001 Q1002 R1003 H1007 L1008 M1009	G1001-K1005 VanDerWaalsContact O-CG 3.3Å; G1001-K1005 WeakPolarHBondContact O-CG 3.26Å; G1001-K1005 PolarHBondContact O-N 2.84Å; Q1002-K1005 PolarHBondContact O-N 3.33Å; R1003-K1005 PolarHBondContact O-N 3.09Å; K1005-H1007 VanDerWaalsContact C-N 3.27Å; K1005-H1007 PolarHBondContact O-N 3.47Å; K1005-L1008 PolarHBondContact O-N 3.26Å; K1005-M1009 WeakPolarHBondContact O-CG 3.34Å; K1005-M1009 PolarHBondContact O-N 2.89Å; K1005-M1009 VanDerWaalsContact O-N 3.1Å
1006	K	66.6	Low	64.3	Low	103 Å²	103	105.7 Å²	105.7	45%	0.448	52%	0.523	S	S	.	.	H	α-helix	trans	-60.3	-38.2	179	-160.7	178.5	-167.8	174.4	0	112.1	E998 Q1002 R1003 L1008 L1014	E998-K1006 IonicContact OE1-NZ 2.8Å; E998-K1006 PolarHBondContact OE1-NZ 3.27Å; E998-K1006 IonicContact OE2-NZ 3.75Å; Q1002-K1006 PolarHBondContact O-N 2.93Å; R1003-K1006 WeakPolarHBondContact O-CB 3.28Å; R1003-K1006 PolarHBondContact O-N 2.83Å; K1006-L1008 PolarHBondContact O-N 3.4Å; K1006-L1014 HydrophobicContact CG-CD1 3.95Å
1007	H	65.7	Low	63	Low	179 Å²	179	109.3 Å²	109.3	83%	0.829	54%	0.54	S	S	*	.	H	α-helix	trans	-73.1	-17	178.2	-141	-68	0	0	0	113.2	R1003 Q1004 K1005	R1003-H1007 PolarHBondContact O-N 3.05Å; Q1004-H1007 PolarHBondContact O-N 2.9Å; K1005-H1007 VanDerWaalsContact C-N 3.27Å; K1005-H1007 PolarHBondContact O-N 3.47Å
1008	L	67.6	Low	61.8	Low	147 Å²	147	117 Å²	117	77%	0.77	57%	0.569	S	S	*	*	H	α-helix	trans	-96.9	-21.1	179.9	-167.2	66.7	0	0	0	113.3	K1005 K1006	K1005-L1008 PolarHBondContact O-N 3.26Å; K1006-L1008 PolarHBondContact O-N 3.4Å
1009	M	58.6	Low	60.9	Low	98 Å²	98	121.3 Å²	121.3	48%	0.483	59%	0.593	S	S	.	*	S	Bend	trans	-100.9	135.5	-172.1	-72.1	-63.7	-156.1	0	0	113.9	K1005 E1013	K1005-M1009 WeakPolarHBondContact O-CG 3.34Å; K1005-M1009 PolarHBondContact O-N 2.89Å; K1005-M1009 VanDerWaalsContact O-N 3.1Å; M1009-E1013 WeakPolarHBondContact CE-OE2 3.26Å
1010	N	52.1	Low	60.3	Low	137 Å²	137	123.5 Å²	123.5	73%	0.733	60%	0.601	S	S	*	*			trans	-73.3	150.5	172.7	-80.4	-21.4	0	0	0	112.1	T1012 E1013	N1010-T1012 PolarHBondContact O-N 3.24Å; N1010-E1013 PolarHBondContact O-N 3.42Å
1011	I	58.3	Low	60.3	Low	158 Å²	158	125.2 Å²	125.2	81%	0.81	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.1	-27.5	-168.2	-66.6	166.3	0	0	0	115.2
1012	T	56.2	Low	60.5	Low	119 Å²	119	131.9 Å²	131.9	73%	0.73	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-32.7	-174.4	46.9	0	0	0	0	114.5	N1010	N1010-T1012 PolarHBondContact O-N 3.24Å
1013	E	56.7	Low	60.8	Low	123 Å²	123	128.9 Å²	128.9	58%	0.575	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-85.8	-12.7	-178.7	-71.5	-170	166.8	0	0	113.6	M1009 N1010 S1015 R1016	M1009-E1013 WeakPolarHBondContact CE-OE2 3.26Å; N1010-E1013 PolarHBondContact O-N 3.42Å; E1013-S1015 PolarHBondContact O-N 3.16Å; E1013-R1016 PolarHBondContact O-N 3.47Å
1014	L	55.3	Low	61.2	Low	96 Å²	96	128.1 Å²	128.1	50%	0.503	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-65.5	-22.6	-174.1	-153.5	81.3	0	0	0	113.6	K1006	K1006-L1014 HydrophobicContact CG-CD1 3.95Å
1015	S	52.8	Low	61.8	Low	92 Å²	92	126.5 Å²	126.5	64%	0.643	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-78	-21.7	-173.3	62.8	0	0	0	0	114.2	E1013	E1013-S1015 PolarHBondContact O-N 3.16Å
1016	R	51.3	Low	62.3	Low	225 Å²	225	127 Å²	127	85%	0.849	63%	0.628	S	S	*	*	S	Bend	trans	-90.9	-11.7	-166.6	-151.2	176.3	74.9	104.2	-0.5	115	E1013	E1013-R1016 PolarHBondContact O-N 3.47Å
1017	Q	50.6	Low	62.8	Low	157 Å²	157	125.9 Å²	125.9	73%	0.734	63%	0.625	S	S	*	*			trans	-132.6	79.4	-169.9	-159.1	160.6	-9.2	0	0	111.8
1018	R	52.1	Low	63.5	Low	206 Å²	206	118.2 Å²	118.2	78%	0.777	59%	0.591	S	S	*	*			trans	-107	65.8	171	-71.5	-170.1	-159.8	144.1	4.4	111.2	M1020	R1018-M1020 VanDerWaalsContact C-N 3.34Å; R1018-M1020 PolarHBondContact O-N 3.06Å
1019	D	53	Low	64.2	Low	126 Å²	126	116.7 Å²	116.7	67%	0.674	58%	0.579	S	S	*	*			trans	-90.6	78.7	160.9	-66.5	-29.9	0	0	0	107.8	Q1002	Q1002-D1019 PolarHBondContact NE2-O 3.05Å
1020	M	59.5	Low	65	Low	93 Å²	93	115 Å²	115	46%	0.458	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-88.7	128.3	171.9	-73.8	-153.8	174.4	0	0	110	F996 E998 R1018	F996-M1020 HydrophobicContact CB-CB 4.44Å; F996-M1020 HydrophobicContact CB-SD 4.08Å; F996-M1020 HydrophobicContact CD1-CB 3.69Å; F996-M1020 HydrophobicContact CE1-CB 4.27Å; F996-M1020 HydrophobicContact CG-CB 4.27Å; F996-M1020 HydrophobicContact CG-SD 4.48Å; E998-M1020 HydrophobicContact CG-CE 4.34Å; R1018-M1020 VanDerWaalsContact C-N 3.34Å; R1018-M1020 PolarHBondContact O-N 3.06Å
1021	Q	66.6	Low	66.1	Low	115 Å²	115	109.5 Å²	109.5	54%	0.537	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	142.6	178.1	-69	-179.9	-19.1	0	0	110.5	Y997	Y997-Q1021 VanDerWaalsContact CD1-O 3.32Å; Y997-Q1021 WeakPolarHBondContact CD1-O 3.35Å; Y997-Q1021 HydrophobicContact CE1-CB 3.81Å; Y997-Q1021 HydrophobicContact CE2-CB 4.36Å; Y997-Q1021 PolarHBondContact N-O 3.34Å; Y997-Q1021 PolarHBondContact OH-OE1 2.84Å
1022	R	73.6	Confident	67.3	Low	179 Å²	179	102.5 Å²	102.5	68%	0.675	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.8	-177.8	-169.5	-179.6	179.6	-178.7	0.7	110.4	S995 F996	S995-R1022 CarbonylContact O-C 3.53Å; S995-R1022 WeakPolarHBondContact O-CA 3.48Å; F996-R1022 HydrophobicContact CD1-CB 4.34Å; F996-R1022 HydrophobicContact CE1-CB 4.19Å
1023	L	75.5	Confident	68.5	Low	13 Å²	13	102.1 Å²	102.1	7%	0.068	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-68.4	139.4	173.2	-163.1	67.7	0	0	0	110.5	S995 Y997 M1027 S1028	S995-L1023 PolarHBondContact O-N 3.25Å; S995-L1023 WeakPolarHBondContact OG-CB 3.38Å; S995-L1023 PolarHBondContact OG-O 3.1Å; Y997-L1023 HydrophobicContact CD1-CB 4.4Å; L1023-M1027 HydrophobicContact CD1-CB 4.49Å; L1023-M1027 HydrophobicContact CD1-CE 4.46Å; L1023-M1027 HydrophobicContact CD1-CG 4.18Å; L1023-M1027 HydrophobicContact CD1-SD 3.85Å; L1023-M1027 HydrophobicContact CG-CB 4.41Å; L1023-S1028 WeakPolarHBondContact CD2-OG 3.36Å
1024	G	78.4	Confident	69.6	Low	45 Å²	45	100 Å²	100	46%	0.464	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-71.3	146.1	179.1	0	0	0	0	0	112.5	L1026 M1027 S1028	G1024-L1026 PolarHBondContact O-N 3.45Å; G1024-M1027 PolarHBondContact O-N 3.01Å; G1024-M1027 VanDerWaalsContact O-N 3.13Å; G1024-S1028 PolarHBondContact O-N 3.04Å; G1024-S1028 PolarHBondContact O-OG 3.34Å
1025	V	79.1	Confident	70.6	Confident	101 Å²	101	95.7 Å²	95.7	61%	0.612	46%	0.463	S	S	*	.	H	α-helix	trans	-54	-48.6	-173.8	177.7	0	0	0	0	112.7	M1027 S1028 F1029	V1025-M1027 VanDerWaalsContact C-N 3.32Å; V1025-M1027 PolarHBondContact O-N 2.62Å; V1025-S1028 PolarHBondContact O-N 3.23Å; V1025-F1029 HydrophobicContact CG1-CD2 3.69Å; V1025-F1029 HydrophobicContact CG1-CE2 3.66Å; V1025-F1029 VanDerWaalsContact O-CD2 3.28Å; V1025-F1029 WeakPolarHBondContact O-CD2 3.11Å; V1025-F1029 PolarHBondContact O-N 3.33Å
1026	L	77.8	Confident	71.9	Confident	154 Å²	154	91.3 Å²	91.3	81%	0.806	43%	0.432	S	S	*	.	H	α-helix	trans	-61.4	-41.6	-178.5	-168.2	78.9	0	0	0	112	G1024 F1029 S1030	G1024-L1026 PolarHBondContact O-N 3.45Å; L1026-F1029 PolarHBondContact O-N 3.29Å; L1026-S1030 PolarHBondContact O-N 2.91Å
1027	M	78.6	Confident	73.1	Confident	81 Å²	81	86 Å²	86	40%	0.399	42%	0.415	S	S	.	.	H	α-helix	trans	-69.4	-40.1	179.6	-164.8	169	178.7	0	0	110.9	L1023 G1024 V1025 F1029 S1030 E1031 Y1057	L1023-M1027 HydrophobicContact CD1-CB 4.49Å; L1023-M1027 HydrophobicContact CD1-CE 4.46Å; L1023-M1027 HydrophobicContact CD1-CG 4.18Å; L1023-M1027 HydrophobicContact CD1-SD 3.85Å; L1023-M1027 HydrophobicContact CG-CB 4.41Å; G1024-M1027 PolarHBondContact O-N 3.01Å; G1024-M1027 VanDerWaalsContact O-N 3.13Å; V1025-M1027 VanDerWaalsContact C-N 3.32Å; V1025-M1027 PolarHBondContact O-N 2.62Å; M1027-F1029 VanDerWaalsContact C-N 3.31Å; M1027-F1029 PolarHBondContact O-N 3.36Å; M1027-S1030 WeakPolarHBondContact CA-OG 3.37Å; M1027-S1030 PolarHBondContact O-N 3.15Å; M1027-S1030 PolarHBondContact O-OG 2.95Å; M1027-E1031 WeakPolarHBondContact O-CB 3.48Å; M1027-E1031 WeakPolarHBondContact O-CG 3.46Å; M1027-E1031 PolarHBondContact O-N 2.7Å; M1027-Y1057 HydrophobicContact CE-CE1 4.09Å
1028	S	79.6	Confident	74.2	Confident	17 Å²	17	84.1 Å²	84.1	12%	0.119	40%	0.402	C	S	.	.	H	α-helix	trans	-59.7	-41.6	173.1	-58.6	0	0	0	0	112	S995 L1023 G1024 V1025 L1032	S995-S1028 PolarHBondContact OG-OG 3Å; L1023-S1028 WeakPolarHBondContact CD2-OG 3.36Å; G1024-S1028 PolarHBondContact O-N 3.04Å; G1024-S1028 PolarHBondContact O-OG 3.34Å; V1025-S1028 PolarHBondContact O-N 3.23Å; S1028-L1032 VanDerWaalsContact O-CB 3.24Å; S1028-L1032 WeakPolarHBondContact O-CB 3.47Å; S1028-L1032 PolarHBondContact O-N 2.83Å
1029	F	81.9	Confident	75.3	Confident	115 Å²	115	74.4 Å²	74.4	50%	0.504	37%	0.366	S	S	.	.	H	α-helix	trans	-69.5	-40	176	-85.5	-73.3	0	0	0	112.7	V1025 L1026 M1027 L1032 F1033	V1025-F1029 HydrophobicContact CG1-CD2 3.69Å; V1025-F1029 HydrophobicContact CG1-CE2 3.66Å; V1025-F1029 VanDerWaalsContact O-CD2 3.28Å; V1025-F1029 WeakPolarHBondContact O-CD2 3.11Å; V1025-F1029 PolarHBondContact O-N 3.33Å; L1026-F1029 PolarHBondContact O-N 3.29Å; M1027-F1029 VanDerWaalsContact C-N 3.31Å; M1027-F1029 PolarHBondContact O-N 3.36Å; F1029-L1032 WeakPolarHBondContact O-CB 3.09Å; F1029-L1032 PolarHBondContact O-N 3.4Å; F1029-F1033 VanDerWaalsContact O-CD2 3.22Å; F1029-F1033 WeakPolarHBondContact O-CD2 3.34Å; F1029-F1033 PolarHBondContact O-N 3.05Å
1030	S	76.5	Confident	76.2	Confident	62 Å²	62	69.4 Å²	69.4	43%	0.434	34%	0.339	S	S	.	.	H	α-helix	trans	-64.6	-42.7	177.2	65.4	0	0	0	0	111.6	L1026 M1027 F1033 R1034	L1026-S1030 PolarHBondContact O-N 2.91Å; M1027-S1030 WeakPolarHBondContact CA-OG 3.37Å; M1027-S1030 PolarHBondContact O-N 3.15Å; M1027-S1030 PolarHBondContact O-OG 2.95Å; S1030-F1033 PolarHBondContact O-N 3.17Å; S1030-R1034 WeakPolarHBondContact O-CB 3.45Å; S1030-R1034 PolarHBondContact O-N 3.33Å
1031	E	75.9	Confident	76.7	Confident	22 Å²	22	72.7 Å²	72.7	10%	0.103	35%	0.351	C	S	.	.	H	α-helix	trans	-64.8	-40.2	175.3	-71.1	-54.1	140.1	0	0	111.7	M1027 F1033 R1034 R1035	M1027-E1031 WeakPolarHBondContact O-CB 3.48Å; M1027-E1031 WeakPolarHBondContact O-CG 3.46Å; M1027-E1031 PolarHBondContact O-N 2.7Å; E1031-F1033 PolarHBondContact O-N 3.13Å; E1031-R1034 PolarHBondContact O-N 2.63Å; E1031-R1034 IonicContact OE1-NE 3.54Å; E1031-R1034 IonicContact OE2-CZ 2.94Å; E1031-R1034 IonicContact OE2-NE 3.07Å; E1031-R1034 PolarHBondContact OE2-NE 2.62Å; E1031-R1034 IonicContact OE2-NH2 2.92Å; E1031-R1034 PolarHBondContact OE2-NH2 3.39Å; E1031-R1035 VanDerWaalsContact O-CB 3.31Å; E1031-R1035 WeakPolarHBondContact O-CB 3.27Å; E1031-R1035 WeakPolarHBondContact O-CD 3.45Å; E1031-R1035 VanDerWaalsContact O-CG 3.25Å; E1031-R1035 WeakPolarHBondContact O-CG 3.43Å; E1031-R1035 PolarHBondContact O-N 2.79Å
1032	L	83.2	Confident	76.9	Confident	12 Å²	12	72.3 Å²	72.3	6%	0.063	35%	0.35	C	S	.	.	H	α-helix	trans	-56.1	-51.2	173.8	178.9	157	0	0	0	111.3	V985 Q988 S1028 F1029 R1035 A1036	V985-L1032 HydrophobicContact CB-CD1 4.39Å; V985-L1032 HydrophobicContact CG2-CD1 3.78Å; Q988-L1032 HydrophobicContact CB-CB 4.39Å; Q988-L1032 HydrophobicContact CB-CD1 4.26Å; Q988-L1032 HydrophobicContact CB-CG 4.48Å; Q988-L1032 HydrophobicContact CG-CB 4.46Å; S1028-L1032 VanDerWaalsContact O-CB 3.24Å; S1028-L1032 WeakPolarHBondContact O-CB 3.47Å; S1028-L1032 PolarHBondContact O-N 2.83Å; F1029-L1032 WeakPolarHBondContact O-CB 3.09Å; F1029-L1032 PolarHBondContact O-N 3.4Å; L1032-R1035 PolarHBondContact O-N 3.44Å; L1032-A1036 WeakPolarHBondContact O-CB 3.47Å; L1032-A1036 PolarHBondContact O-N 3.28Å
1033	F	80.5	Confident	76.7	Confident	111 Å²	111	66.8 Å²	66.8	49%	0.487	34%	0.336	S	S	.	.	H	α-helix	trans	-65.7	-41.6	179.9	-82.1	-67.5	0	0	0	112.2	I981 F1029 S1030 E1031 A1036 F1037	I981-F1033 HydrophobicContact CG1-CE1 4.18Å; F1029-F1033 VanDerWaalsContact O-CD2 3.22Å; F1029-F1033 WeakPolarHBondContact O-CD2 3.34Å; F1029-F1033 PolarHBondContact O-N 3.05Å; S1030-F1033 PolarHBondContact O-N 3.17Å; E1031-F1033 PolarHBondContact O-N 3.13Å; F1033-A1036 PolarHBondContact O-N 3.49Å; F1033-F1037 VanDerWaalsContact O-CB 3.3Å; F1033-F1037 WeakPolarHBondContact O-CB 3.1Å; F1033-F1037 PolarHBondContact O-N 2.9Å
1034	R	79.3	Confident	76.2	Confident	77 Å²	77	68.6 Å²	68.6	29%	0.291	35%	0.35	S	S	.	.	H	α-helix	trans	-55.7	-54.8	175.9	-171.7	-178.2	68.5	87.8	1.3	110.1	S1030 E1031 F1037 Y1038 E1049	S1030-R1034 WeakPolarHBondContact O-CB 3.45Å; S1030-R1034 PolarHBondContact O-N 3.33Å; E1031-R1034 PolarHBondContact O-N 2.63Å; E1031-R1034 IonicContact OE1-NE 3.54Å; E1031-R1034 IonicContact OE2-CZ 2.94Å; E1031-R1034 IonicContact OE2-NE 3.07Å; E1031-R1034 PolarHBondContact OE2-NE 2.62Å; E1031-R1034 IonicContact OE2-NH2 2.92Å; E1031-R1034 PolarHBondContact OE2-NH2 3.39Å; R1034-F1037 PolarHBondContact O-N 3.37Å; R1034-Y1038 HydrophobicContact CG-CD2 3.8Å; R1034-Y1038 HydrophobicContact CG-CE2 3.79Å; R1034-Y1038 WeakPolarHBondContact O-CD2 3.29Å; R1034-Y1038 PolarHBondContact O-N 3.48Å; R1034-Y1038 VanDerWaalsContact O-N 3.15Å; R1034-E1049 IonicContact CZ-OE1 3.36Å; R1034-E1049 IonicContact NH1-OE1 2.6Å; R1034-E1049 PolarHBondContact NH1-OE1 3.41Å; R1034-E1049 IonicContact NH2-OE1 2.76Å; R1034-E1049 PolarHBondContact NH2-OE1 2.97Å; R1034-E1049 IonicContact NH2-OE2 3.66Å
1035	R	76.1	Confident	75.6	Confident	7 Å²	7	68.3 Å²	68.3	3%	0.026	34%	0.337	C	S	.	.	H	α-helix	trans	-63.7	-45.3	-178.6	-71.8	161.1	164	158.2	2.4	112.3	F987 Y992 E1031 L1032 F1037 S1039 E1049	F987-R1035 HydrophobicContact CD1-CB 4.19Å; F987-R1035 HydrophobicContact CD1-CG 4.42Å; F987-R1035 HydrophobicContact CE1-CB 4.12Å; F987-R1035 HydrophobicContact CE1-CG 3.97Å; Y992-R1035 PolarHBondContact OH-NH2 3.31Å; E1031-R1035 VanDerWaalsContact O-CB 3.31Å; E1031-R1035 WeakPolarHBondContact O-CB 3.27Å; E1031-R1035 WeakPolarHBondContact O-CD 3.45Å; E1031-R1035 VanDerWaalsContact O-CG 3.25Å; E1031-R1035 WeakPolarHBondContact O-CG 3.43Å; E1031-R1035 PolarHBondContact O-N 2.79Å; L1032-R1035 PolarHBondContact O-N 3.44Å; R1035-F1037 PolarHBondContact O-N 3.19Å; R1035-S1039 VanDerWaalsContact O-CB 3.25Å; R1035-S1039 WeakPolarHBondContact O-CB 3.32Å; R1035-S1039 PolarHBondContact O-N 3.35Å; R1035-S1039 VanDerWaalsContact O-N 3.16Å; R1035-E1049 IonicContact CZ-OE2 3.97Å; R1035-E1049 IonicContact NE-OE2 2.69Å; R1035-E1049 PolarHBondContact NE-OE2 3.41Å; R1035-E1049 VanDerWaalsContact NE-OE2 3.16Å; R1035-E1049 IonicContact NH2-OE2 2.68Å; R1035-E1049 PolarHBondContact NH2-OE2 3.39Å
1036	A	80.4	Confident	75.1	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.6	-43.6	-179.4	0	0	0	0	0	112.6	I980 L1032 F1033	I980-A1036 HydrophobicContact CG2-CB 3.66Å; I980-A1036 WeakPolarHBondContact O-CB 3.48Å; L1032-A1036 WeakPolarHBondContact O-CB 3.47Å; L1032-A1036 PolarHBondContact O-N 3.28Å; F1033-A1036 PolarHBondContact O-N 3.49Å
1037	F	76.2	Confident	74.6	Confident	112 Å²	112	60.6 Å²	60.6	49%	0.491	29%	0.293	S	S	.	.	H	α-helix	trans	-72.8	-47.6	-176.7	-176.2	-96.7	0	0	0	112.2	F1033 R1034 R1035 S1039 I1040 F1041	F1033-F1037 VanDerWaalsContact O-CB 3.3Å; F1033-F1037 WeakPolarHBondContact O-CB 3.1Å; F1033-F1037 PolarHBondContact O-N 2.9Å; R1034-F1037 PolarHBondContact O-N 3.37Å; R1035-F1037 PolarHBondContact O-N 3.19Å; F1037-S1039 VanDerWaalsContact C-N 3.32Å; F1037-S1039 PolarHBondContact O-N 2.98Å; F1037-I1040 HydrophobicContact CD2-CD1 4.36Å; F1037-I1040 WeakPolarHBondContact O-CB 3.21Å; F1037-I1040 WeakPolarHBondContact O-CD1 3.29Å; F1037-I1040 WeakPolarHBondContact O-CG1 3.43Å; F1037-I1040 PolarHBondContact O-N 3.06Å; F1037-F1041 HydrophobicContact CE1-CE2 4.42Å; F1037-F1041 HydrophobicContact CZ-CE2 4.19Å
1038	Y	75.4	Confident	73.9	Confident	118 Å²	118	63.5 Å²	63.5	46%	0.463	31%	0.305	S	S	.	.	H	α-helix	trans	-69.1	-31	-176.5	-75.6	-60.7	0	0	0	113.3	R1034 I1040 F1041 E1042 I1045	R1034-Y1038 HydrophobicContact CG-CD2 3.8Å; R1034-Y1038 HydrophobicContact CG-CE2 3.79Å; R1034-Y1038 WeakPolarHBondContact O-CD2 3.29Å; R1034-Y1038 PolarHBondContact O-N 3.48Å; R1034-Y1038 VanDerWaalsContact O-N 3.15Å; Y1038-I1040 PolarHBondContact O-N 2.96Å; Y1038-F1041 PolarHBondContact O-N 3.08Å; Y1038-F1041 VanDerWaalsContact O-N 3.1Å; Y1038-E1042 PolarHBondContact O-N 3.14Å; Y1038-I1045 VanDerWaalsContact CB-CD1 3.5Å; Y1038-I1045 HydrophobicContact CD1-CD1 4.01Å; Y1038-I1045 HydrophobicContact CD2-CD1 4.3Å; Y1038-I1045 HydrophobicContact CG-CD1 3.7Å
1039	S	74.3	Confident	73.2	Confident	3 Å²	3	64 Å²	64	2%	0.021	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.5	177.6	-172.8	0	0	0	0	114.4	Y983 R1035 F1037 L1072	Y983-S1039 VanDerWaalsContact CE1-CB 3.43Å; Y983-S1039 VanDerWaalsContact CE1-OG 3.3Å; Y983-S1039 WeakPolarHBondContact CE1-OG 3.47Å; Y983-S1039 PolarHBondContact OH-OG 3.22Å; R1035-S1039 VanDerWaalsContact O-CB 3.25Å; R1035-S1039 WeakPolarHBondContact O-CB 3.32Å; R1035-S1039 PolarHBondContact O-N 3.35Å; R1035-S1039 VanDerWaalsContact O-N 3.16Å; F1037-S1039 VanDerWaalsContact C-N 3.32Å; F1037-S1039 PolarHBondContact O-N 2.98Å; S1039-L1072 WeakPolarHBondContact OG-CD1 3.19Å
1040	I	72.9	Confident	72.4	Confident	21 Å²	21	63 Å²	63	11%	0.108	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-44.8	174.5	-61	161.9	0	0	0	110.7	I980 F1037 Y1038 Y1075 V1079	I980-I1040 HydrophobicContact CD1-CD1 3.28Å; I980-I1040 HydrophobicContact CD1-CG1 4.22Å; I980-I1040 HydrophobicContact CG1-CD1 3.57Å; I980-I1040 HydrophobicContact CG1-CG1 4.01Å; F1037-I1040 HydrophobicContact CD2-CD1 4.36Å; F1037-I1040 WeakPolarHBondContact O-CB 3.21Å; F1037-I1040 WeakPolarHBondContact O-CD1 3.29Å; F1037-I1040 WeakPolarHBondContact O-CG1 3.43Å; F1037-I1040 PolarHBondContact O-N 3.06Å; Y1038-I1040 PolarHBondContact O-N 2.96Å; I1040-Y1075 WeakPolarHBondContact CG1-OH 3.4Å; I1040-V1079 HydrophobicContact CG2-CG1 4.37Å
1041	F	69.7	Low	71.7	Confident	161 Å²	161	64.2 Å²	64.2	71%	0.706	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-33.4	-168.6	-63.6	-72	0	0	0	112.1	F1037 Y1038	F1037-F1041 HydrophobicContact CE1-CE2 4.42Å; F1037-F1041 HydrophobicContact CZ-CE2 4.19Å; Y1038-F1041 PolarHBondContact O-N 3.08Å; Y1038-F1041 VanDerWaalsContact O-N 3.1Å
1042	E	70.5	Confident	71.3	Confident	107 Å²	107	64.2 Å²	64.2	50%	0.5	31%	0.31	S	S	.	.			trans	-142.7	121.8	-170.2	-159.8	169.5	-176.4	0	0	111.9	Y1038 S1044	Y1038-E1042 PolarHBondContact O-N 3.14Å; E1042-S1044 VanDerWaalsContact C-N 3.3Å; E1042-S1044 WeakPolarHBondContact CG-OG 3.27Å; E1042-S1044 PolarHBondContact OE1-OG 2.73Å
1043	V	68.5	Low	70.4	Confident	64 Å²	64	70.8 Å²	70.8	39%	0.388	34%	0.34	S	S	.	.	S	Bend	trans	-74.3	-24.3	177.1	170.1	0	0	0	0	111.3	I1045 V1046 L1047 L1072	V1043-I1045 VanDerWaalsContact C-N 3.33Å; V1043-I1045 PolarHBondContact O-N 3.06Å; V1043-V1046 PolarHBondContact O-N 3.18Å; V1043-V1046 VanDerWaalsContact O-N 3.13Å; V1043-L1047 HydrophobicContact CG1-CD1 3.55Å; V1043-L1047 WeakPolarHBondContact O-CD1 3.37Å; V1043-L1072 HydrophobicContact CG1-CD2 3.78Å; V1043-L1072 HydrophobicContact CG2-CD2 4.44Å
1044	S	65.1	Low	69.5	Low	51 Å²	51	73 Å²	73	36%	0.357	36%	0.357	S	S	.	.	H	α-helix	trans	-56.7	-38.8	-172.2	-46.5	0	0	0	0	114.1	E1042 V1046 L1047 E1048	E1042-S1044 VanDerWaalsContact C-N 3.3Å; E1042-S1044 WeakPolarHBondContact CG-OG 3.27Å; E1042-S1044 PolarHBondContact OE1-OG 2.73Å; S1044-V1046 PolarHBondContact O-N 3.42Å; S1044-L1047 PolarHBondContact O-N 3.27Å; S1044-E1048 PolarHBondContact O-N 2.87Å
1045	I	66.7	Low	68.5	Low	38 Å²	38	72.4 Å²	72.4	20%	0.195	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-29.1	-177.3	-70.7	159.7	0	0	0	111.8	Y1038 V1043	Y1038-I1045 VanDerWaalsContact CB-CD1 3.5Å; Y1038-I1045 HydrophobicContact CD1-CD1 4.01Å; Y1038-I1045 HydrophobicContact CD2-CD1 4.3Å; Y1038-I1045 HydrophobicContact CG-CD1 3.7Å; V1043-I1045 VanDerWaalsContact C-N 3.33Å; V1043-I1045 PolarHBondContact O-N 3.06Å
1046	V	67.9	Low	68	Low	5 Å²	5	80.6 Å²	80.6	3%	0.03	40%	0.396	C	S	.	.	H	α-helix	trans	-76.4	-35.2	176.3	179.7	0	0	0	0	111.2	F987 V1043 S1044 I1068	F987-V1046 HydrophobicContact CE2-CB 4.43Å; F987-V1046 HydrophobicContact CE2-CG1 3.76Å; F987-V1046 HydrophobicContact CE2-CG2 3.75Å; F987-V1046 HydrophobicContact CZ-CB 4.49Å; F987-V1046 HydrophobicContact CZ-CG1 3.93Å; F987-V1046 HydrophobicContact CZ-CG2 3.94Å; V1043-V1046 PolarHBondContact O-N 3.18Å; V1043-V1046 VanDerWaalsContact O-N 3.13Å; S1044-V1046 PolarHBondContact O-N 3.42Å; V1046-I1068 HydrophobicContact CG1-CG1 4Å
1047	L	66.5	Low	67.5	Low	89 Å²	89	83 Å²	83	47%	0.466	41%	0.405	S	S	.	.	H	α-helix	trans	-74	-39.6	179.6	-86	76.1	0	0	0	112.3	V1043 S1044 E1049 E1050	V1043-L1047 HydrophobicContact CG1-CD1 3.55Å; V1043-L1047 WeakPolarHBondContact O-CD1 3.37Å; S1044-L1047 PolarHBondContact O-N 3.27Å; L1047-E1049 PolarHBondContact O-N 2.93Å; L1047-E1050 VanDerWaalsContact O-CB 3.31Å; L1047-E1050 WeakPolarHBondContact O-CB 3.37Å; L1047-E1050 PolarHBondContact O-N 3Å; L1047-E1050 VanDerWaalsContact O-N 3.12Å
1048	E	65.1	Low	67.4	Low	142 Å²	142	77.8 Å²	77.8	66%	0.664	38%	0.382	S	S	*	.	H	α-helix	trans	-62.3	-30.1	177	-74.1	-179.1	175.3	0	0	112.1	S1044 E1050 T1051	S1044-E1048 PolarHBondContact O-N 2.87Å; E1048-E1050 VanDerWaalsContact C-N 3.33Å; E1048-T1051 PolarHBondContact O-OG1 3.45Å
1049	E	64.8	Low	67.5	Low	26 Å²	26	72.4 Å²	72.4	12%	0.121	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-11	177.3	-93.6	175.3	-154.9	0	0	114.2	R1034 R1035 L1047 T1051 F1064	R1034-E1049 IonicContact CZ-OE1 3.36Å; R1034-E1049 IonicContact NH1-OE1 2.6Å; R1034-E1049 PolarHBondContact NH1-OE1 3.41Å; R1034-E1049 IonicContact NH2-OE1 2.76Å; R1034-E1049 PolarHBondContact NH2-OE1 2.97Å; R1034-E1049 IonicContact NH2-OE2 3.66Å; R1035-E1049 IonicContact CZ-OE2 3.97Å; R1035-E1049 IonicContact NE-OE2 2.69Å; R1035-E1049 PolarHBondContact NE-OE2 3.41Å; R1035-E1049 VanDerWaalsContact NE-OE2 3.16Å; R1035-E1049 IonicContact NH2-OE2 2.68Å; R1035-E1049 PolarHBondContact NH2-OE2 3.39Å; L1047-E1049 PolarHBondContact O-N 2.93Å; E1049-T1051 VanDerWaalsContact C-N 3.34Å; E1049-F1064 HydrophobicContact CB-CE1 4.06Å; E1049-F1064 HydrophobicContact CB-CZ 3.94Å
1050	E	64.8	Low	67.7	Low	96 Å²	96	74 Å²	74	45%	0.449	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-39.8	172.1	-169.5	-178.9	167.8	0	0	110.7	L1047 E1048 C1052	L1047-E1050 VanDerWaalsContact O-CB 3.31Å; L1047-E1050 WeakPolarHBondContact O-CB 3.37Å; L1047-E1050 PolarHBondContact O-N 3Å; L1047-E1050 VanDerWaalsContact O-N 3.12Å; E1048-E1050 VanDerWaalsContact C-N 3.33Å; E1050-C1052 PolarHBondContact O-N 2.94Å
1051	T	62.6	Low	67.8	Low	87 Å²	87	78.3 Å²	78.3	53%	0.534	39%	0.394	S	S	.	.	S	Bend	trans	-78.3	98.1	175	46.8	0	0	0	0	110.1	E1048 E1049 E1053	E1048-T1051 PolarHBondContact O-OG1 3.45Å; E1049-T1051 VanDerWaalsContact C-N 3.34Å; T1051-E1053 PolarHBondContact O-N 3.12Å
1052	C	67.7	Low	68.4	Low	22 Å²	22	77.1 Å²	77.1	15%	0.149	39%	0.394	C	S	.	.			trans	-76.4	35.1	-178	-140.3	0	0	0	0	114.1	H1000 E1050 C1058	H1000-C1052 PolarHBondContact CD2-O 3.47Å; E1050-C1052 PolarHBondContact O-N 2.94Å; C1052-C1058 HydrophobicContact CB-CB 4.17Å; C1052-C1058 WeakPolarHBondContact CB-SG 3.26Å; C1052-C1058 WeakPolarHBondContact SG-CA 3.23Å; C1052-C1058 WeakPolarHBondContact SG-CB 3.07Å; C1052-C1058 CovalentContact SG-SG 2.04Å; C1052-C1058 PolarHBondContact SG-SG 2.8Å
1053	E	63.4	Low	69	Low	149 Å²	149	72.2 Å²	72.2	70%	0.696	37%	0.371	S	S	*	.	S	Bend	trans	-68.6	-43.5	-171.4	-76	-173.8	152.4	0	0	113	T1051	T1051-E1053 PolarHBondContact O-N 3.12Å
1054	D	61.2	Low	69.6	Low	157 Å²	157	69.6 Å²	69.6	84%	0.84	36%	0.355	S	S	*	.	S	Bend	trans	-114.5	-12.7	-172.9	-71.5	-35	0	0	0	114.8
1055	N	58.6	Low	70.5	Confident	66 Å²	66	69.6 Å²	69.6	35%	0.353	35%	0.351	S	S	.	.			trans	-84.9	127.7	-173.6	-86.4	-26.6	0	0	0	112.5	Y1057	N1055-Y1057 PolarHBondContact O-N 3.13Å
1056	K	65.3	Low	71.5	Confident	179 Å²	179	70.1 Å²	70.1	78%	0.778	36%	0.356	S	S	*	.	S	Bend	trans	-62.1	-23.6	-179.6	-73	-179.5	179.4	175.4	0	113.9
1057	Y	71.3	Confident	72.4	Confident	51 Å²	51	69.9 Å²	69.9	20%	0.2	35%	0.354	C	S	.	.	S	Bend	trans	-129.3	101.2	-174.3	47.3	-87.6	0	0	0	111.5	Y992 M1027 N1055	Y992-Y1057 PolarHBondContact OH-O 2.88Å; M1027-Y1057 HydrophobicContact CE-CE1 4.09Å; N1055-Y1057 PolarHBondContact O-N 3.13Å
1058	C	74.3	Confident	73.1	Confident	2 Å²	2	67 Å²	67	1%	0.014	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-83.8	136	175.8	-54.9	0	0	0	0	111.1	E998 C1052	E998-C1058 PolarHBondContact N-O 3.26Å; E998-C1058 WeakPolarHBondContact O-CA 3.47Å; E998-C1058 WeakPolarHBondContact O-CB 3.18Å; E998-C1058 PolarHBondContact O-N 3.43Å; C1052-C1058 HydrophobicContact CB-CB 4.17Å; C1052-C1058 WeakPolarHBondContact CB-SG 3.26Å; C1052-C1058 WeakPolarHBondContact SG-CA 3.23Å; C1052-C1058 WeakPolarHBondContact SG-CB 3.07Å; C1052-C1058 CovalentContact SG-SG 2.04Å; C1052-C1058 PolarHBondContact SG-SG 2.8Å
1059	G	76.8	Confident	74.1	Confident	4 Å²	4	66.9 Å²	66.9	4%	0.041	34%	0.337	C	S	.	.			trans	-83.6	179.1	171.1	0	0	0	0	0	113.5	R1003	R1003-G1059 PolarHBondContact NH1-O 3.19Å
1060	S	77.5	Confident	75.2	Confident	38 Å²	38	72.7 Å²	72.7	27%	0.266	36%	0.362	S	S	.	.			trans	-72.5	132.6	176.6	80.6	0	0	0	0	111.9	L990 I991 G1063 F1064	L990-S1060 PolarHBondContact O-OG 3.37Å; I991-S1060 PolarHBondContact O-N 2.88Å; I991-S1060 PolarHBondContact O-OG 3.3Å; S1060-G1063 PolarHBondContact O-N 2.86Å; S1060-G1063 WeakPolarHBondContact OG-CA 3.46Å; S1060-G1063 PolarHBondContact OG-N 3.31Å; S1060-F1064 PolarHBondContact O-N 3.44Å
1061	E	76.1	Confident	76.3	Confident	111 Å²	111	68.1 Å²	68.1	52%	0.519	34%	0.341	S	S	.	.	H	α-helix	trans	-63.5	-44.4	-179.3	-166.9	170.3	150	0	0	112.5	R1003 G1063 F1064 N1065	R1003-E1061 IonicContact CZ-OE2 3.86Å; R1003-E1061 IonicContact NE-OE2 3.93Å; R1003-E1061 VanDerWaalsContact NH2-CB 3.3Å; R1003-E1061 IonicContact NH2-OE2 2.84Å; R1003-E1061 PolarHBondContact NH2-OE2 2.79Å; E1061-G1063 VanDerWaalsContact C-N 3.29Å; E1061-G1063 PolarHBondContact O-N 2.94Å; E1061-F1064 PolarHBondContact O-N 3.4Å; E1061-N1065 PolarHBondContact O-N 2.88Å
1062	L	81.6	Confident	77.4	Confident	136 Å²	136	64.5 Å²	64.5	71%	0.712	32%	0.318	S	S	*	.	H	α-helix	trans	-61.9	-40.1	177.2	-174.3	70.4	0	0	0	111.3	T1066	L1062-T1066 WeakPolarHBondContact O-CB 3.41Å; L1062-T1066 PolarHBondContact O-N 3.07Å; L1062-T1066 PolarHBondContact O-OG1 3.41Å
1063	G	83.2	Confident	78.2	Confident	3 Å²	3	68 Å²	68	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-49.5	175.6	0	0	0	0	0	111.5	L990 S1060 E1061 T1066 V1067	L990-G1063 WeakPolarHBondContact O-CA 3.41Å; S1060-G1063 PolarHBondContact O-N 2.86Å; S1060-G1063 WeakPolarHBondContact OG-CA 3.46Å; S1060-G1063 PolarHBondContact OG-N 3.31Å; E1061-G1063 VanDerWaalsContact C-N 3.29Å; E1061-G1063 PolarHBondContact O-N 2.94Å; G1063-T1066 PolarHBondContact O-N 2.77Å; G1063-V1067 WeakPolarHBondContact O-CB 3.08Å; G1063-V1067 VanDerWaalsContact O-CG2 3.25Å; G1063-V1067 WeakPolarHBondContact O-CG2 3.35Å; G1063-V1067 PolarHBondContact O-N 2.86Å
1064	F	82	Confident	79.3	Confident	9 Å²	9	65.3 Å²	65.3	4%	0.039	33%	0.328	C	S	.	.	H	α-helix	trans	-57.4	-50.7	176	-98.2	-80.5	0	0	0	112.5	I991 E1049 S1060 E1061 T1066 V1067 I1068	I991-F1064 HydrophobicContact CB-CE2 4.41Å; I991-F1064 HydrophobicContact CD1-CD1 4.25Å; I991-F1064 HydrophobicContact CD1-CD2 4.2Å; I991-F1064 HydrophobicContact CD1-CE1 3.96Å; I991-F1064 HydrophobicContact CD1-CE2 3.92Å; I991-F1064 HydrophobicContact CD1-CG 4.36Å; I991-F1064 HydrophobicContact CD1-CZ 3.78Å; I991-F1064 HydrophobicContact CG1-CD2 4.06Å; I991-F1064 HydrophobicContact CG1-CE2 4.13Å; I991-F1064 HydrophobicContact CG1-CG 4.38Å; I991-F1064 HydrophobicContact CG1-CZ 4.48Å; I991-F1064 HydrophobicContact CG2-CD2 3.84Å; I991-F1064 HydrophobicContact CG2-CE2 3.39Å; I991-F1064 HydrophobicContact CG2-CZ 4.12Å; E1049-F1064 HydrophobicContact CB-CE1 4.06Å; E1049-F1064 HydrophobicContact CB-CZ 3.94Å; S1060-F1064 PolarHBondContact O-N 3.44Å; E1061-F1064 PolarHBondContact O-N 3.4Å; F1064-T1066 VanDerWaalsContact C-N 3.33Å; F1064-T1066 PolarHBondContact O-N 3.3Å; F1064-V1067 WeakPolarHBondContact O-CB 3.2Å; F1064-V1067 PolarHBondContact O-N 2.63Å; F1064-V1067 VanDerWaalsContact O-N 3.14Å; F1064-I1068 WeakPolarHBondContact O-CG1 3.05Å; F1064-I1068 PolarHBondContact O-N 2.85Å
1065	N	83.6	Confident	80.5	Confident	51 Å²	51	58.3 Å²	58.3	27%	0.273	29%	0.29	S	S	.	.	H	α-helix	trans	-59.5	-45	178.9	-72.1	-14.5	0	0	0	111.6	E1061 V1067 I1068 F1069	E1061-N1065 PolarHBondContact O-N 2.88Å; N1065-V1067 VanDerWaalsContact C-N 3.29Å; N1065-V1067 PolarHBondContact O-N 2.79Å; N1065-I1068 PolarHBondContact O-N 2.86Å; N1065-F1069 HydrophobicContact CB-CD2 4.23Å; N1065-F1069 HydrophobicContact CB-CE2 4.25Å; N1065-F1069 WeakPolarHBondContact O-CB 3.47Å; N1065-F1069 WeakPolarHBondContact O-CD2 3.38Å; N1065-F1069 PolarHBondContact O-N 3.25Å
1066	T	87.8	Confident	81.7	Confident	49 Å²	49	57 Å²	57	30%	0.301	29%	0.285	S	S	.	.	H	α-helix	trans	-61.3	-41.8	177.9	-55.6	0	0	0	0	111.2	L990 L1062 G1063 F1064 F1070 V1071	L990-T1066 HydrophobicContact CD1-CG2 4.15Å; L1062-T1066 WeakPolarHBondContact O-CB 3.41Å; L1062-T1066 PolarHBondContact O-N 3.07Å; L1062-T1066 PolarHBondContact O-OG1 3.41Å; G1063-T1066 PolarHBondContact O-N 2.77Å; F1064-T1066 VanDerWaalsContact C-N 3.33Å; F1064-T1066 PolarHBondContact O-N 3.3Å; T1066-F1070 WeakPolarHBondContact O-CB 3.41Å; T1066-F1070 PolarHBondContact O-N 3.37Å; T1066-V1071 PolarHBondContact O-N 3.11Å
1067	V	85.7	Confident	82.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.258	C	S	.	.	I	π-helix	trans	-63.6	-51.1	177.9	164.6	0	0	0	0	111.2	F987 L990 I991 G1063 F1064 N1065 V1071 L1072	F987-V1067 HydrophobicContact CD2-CB 4.42Å; F987-V1067 HydrophobicContact CD2-CG1 3.23Å; F987-V1067 HydrophobicContact CD2-CG2 4.34Å; F987-V1067 HydrophobicContact CE2-CG1 3.27Å; F987-V1067 HydrophobicContact CG-CG1 4.25Å; F987-V1067 HydrophobicContact CZ-CG1 4.31Å; L990-V1067 HydrophobicContact CB-CG2 3.94Å; L990-V1067 HydrophobicContact CD1-CG2 3.63Å; L990-V1067 HydrophobicContact CG-CG2 4.44Å; I991-V1067 HydrophobicContact CG1-CG2 4.48Å; G1063-V1067 WeakPolarHBondContact O-CB 3.08Å; G1063-V1067 VanDerWaalsContact O-CG2 3.25Å; G1063-V1067 WeakPolarHBondContact O-CG2 3.35Å; G1063-V1067 PolarHBondContact O-N 2.86Å; F1064-V1067 WeakPolarHBondContact O-CB 3.2Å; F1064-V1067 PolarHBondContact O-N 2.63Å; F1064-V1067 VanDerWaalsContact O-N 3.14Å; N1065-V1067 VanDerWaalsContact C-N 3.29Å; N1065-V1067 PolarHBondContact O-N 2.79Å; V1067-V1071 HydrophobicContact CB-CB 4.49Å; V1067-V1071 HydrophobicContact CG2-CB 4.47Å; V1067-V1071 HydrophobicContact CG2-CG2 4.31Å; V1067-V1071 PolarHBondContact O-N 3.43Å; V1067-L1072 VanDerWaalsContact O-CB 3.32Å; V1067-L1072 WeakPolarHBondContact O-CB 3.36Å; V1067-L1072 PolarHBondContact O-N 2.89Å
1068	I	82.1	Confident	83.4	Confident	28 Å²	28	49.5 Å²	49.5	14%	0.144	26%	0.261	C	S	.	.	I	π-helix	trans	-63.1	-49.5	-177	-68.8	169.6	0	0	0	110.8	V1046 F1064 N1065	V1046-I1068 HydrophobicContact CG1-CG1 4Å; F1064-I1068 WeakPolarHBondContact O-CG1 3.05Å; F1064-I1068 PolarHBondContact O-N 2.85Å; N1065-I1068 PolarHBondContact O-N 2.86Å
1069	F	84.9	Confident	83.9	Confident	140 Å²	140	49.5 Å²	49.5	61%	0.614	26%	0.261	S	S	*	.	I	π-helix	trans	-76.3	-31.9	-173.9	-68.2	-59.3	0	0	0	113.8	N1065 V1073	N1065-F1069 HydrophobicContact CB-CD2 4.23Å; N1065-F1069 HydrophobicContact CB-CE2 4.25Å; N1065-F1069 WeakPolarHBondContact O-CB 3.47Å; N1065-F1069 WeakPolarHBondContact O-CD2 3.38Å; N1065-F1069 PolarHBondContact O-N 3.25Å; F1069-V1073 WeakPolarHBondContact O-CG2 3.42Å
1070	F	88.6	Confident	83.9	Confident	148 Å²	148	52 Å²	52	65%	0.649	27%	0.273	S	S	*	.	I	π-helix	trans	-117	-59.3	-174.1	-66.2	-82.6	0	0	0	113.2	T1066 L1072 V1073 L1074	T1066-F1070 WeakPolarHBondContact O-CB 3.41Å; T1066-F1070 PolarHBondContact O-N 3.37Å; F1070-L1072 PolarHBondContact O-N 3.13Å; F1070-V1073 PolarHBondContact O-N 3.44Å; F1070-L1074 VanDerWaalsContact O-CB 3.29Å; F1070-L1074 WeakPolarHBondContact O-CB 3.3Å; F1070-L1074 PolarHBondContact O-N 3.2Å
1071	V	88	Confident	84.2	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	29%	0.288	C	S	.	.	I	π-helix	trans	-66.2	-45.1	-168.8	-173.8	0	0	0	0	111.3	Y983 W986 L990 T1066 V1067 Y1075	Y983-V1071 HydrophobicContact CD2-CG1 3.83Å; Y983-V1071 HydrophobicContact CE2-CG1 3.81Å; W986-V1071 HydrophobicContact CB-CG1 4.48Å; W986-V1071 HydrophobicContact CD2-CB 4.46Å; W986-V1071 HydrophobicContact CD2-CG1 3.6Å; W986-V1071 HydrophobicContact CD2-CG2 4Å; W986-V1071 HydrophobicContact CE3-CG1 3.59Å; W986-V1071 HydrophobicContact CE3-CG2 4.49Å; W986-V1071 HydrophobicContact CG-CG1 4.01Å; W986-V1071 HydrophobicContact CG-CG2 4.48Å; W986-V1071 HydrophobicContact CH2-CG1 4.46Å; W986-V1071 HydrophobicContact CH2-CG2 4.22Å; W986-V1071 HydrophobicContact CZ2-CG1 4.49Å; W986-V1071 HydrophobicContact CZ2-CG2 3.7Å; W986-V1071 HydrophobicContact CZ3-CG1 4.03Å; L990-V1071 HydrophobicContact CD1-CG2 3.82Å; T1066-V1071 PolarHBondContact O-N 3.11Å; V1067-V1071 HydrophobicContact CB-CB 4.49Å; V1067-V1071 HydrophobicContact CG2-CB 4.47Å; V1067-V1071 HydrophobicContact CG2-CG2 4.31Å; V1067-V1071 PolarHBondContact O-N 3.43Å; V1071-Y1075 WeakPolarHBondContact O-CB 3.34Å; V1071-Y1075 PolarHBondContact O-N 3.2Å
1072	L	84.8	Confident	84.7	Confident	10 Å²	10	54.9 Å²	54.9	5%	0.052	29%	0.287	C	S	.	.	I	π-helix	trans	-66.7	-45.7	179.2	179.7	67.9	0	0	0	111.2	Y983 S1039 V1043 V1067 F1070 L1074 Y1075 V1076	Y983-L1072 WeakPolarHBondContact OH-CD1 3.44Å; S1039-L1072 WeakPolarHBondContact OG-CD1 3.19Å; V1043-L1072 HydrophobicContact CG1-CD2 3.78Å; V1043-L1072 HydrophobicContact CG2-CD2 4.44Å; V1067-L1072 VanDerWaalsContact O-CB 3.32Å; V1067-L1072 WeakPolarHBondContact O-CB 3.36Å; V1067-L1072 PolarHBondContact O-N 2.89Å; F1070-L1072 PolarHBondContact O-N 3.13Å; L1072-L1074 VanDerWaalsContact C-N 3.32Å; L1072-L1074 PolarHBondContact O-N 2.97Å; L1072-Y1075 PolarHBondContact O-N 3.06Å; L1072-V1076 HydrophobicContact CD1-CG2 3.83Å; L1072-V1076 HydrophobicContact CG-CG2 4.21Å; L1072-V1076 WeakPolarHBondContact O-CB 3.42Å; L1072-V1076 VanDerWaalsContact O-CG2 3.29Å; L1072-V1076 WeakPolarHBondContact O-CG2 3.47Å; L1072-V1076 PolarHBondContact O-N 3.02Å
1073	V	85.4	Confident	84.9	Confident	96 Å²	96	49.1 Å²	49.1	58%	0.582	26%	0.257	S	S	*	.	H	α-helix	trans	-59.3	-45.6	177.7	176.2	0	0	0	0	110.7	F1069 F1070 G1077	F1069-V1073 WeakPolarHBondContact O-CG2 3.42Å; F1070-V1073 PolarHBondContact O-N 3.44Å; V1073-G1077 PolarHBondContact O-N 3.33Å
1074	L	86.7	Confident	84.9	Confident	92 Å²	92	52 Å²	52	48%	0.482	27%	0.271	S	S	.	.	H	α-helix	trans	-65.6	-44.4	177.8	-176.7	142.9	0	0	0	111.5	W986 F1070 L1072 G1077 I1078	W986-L1074 HydrophobicContact CZ3-CD2 4.25Å; F1070-L1074 VanDerWaalsContact O-CB 3.29Å; F1070-L1074 WeakPolarHBondContact O-CB 3.3Å; F1070-L1074 PolarHBondContact O-N 3.2Å; L1072-L1074 VanDerWaalsContact C-N 3.32Å; L1072-L1074 PolarHBondContact O-N 2.97Å; L1074-G1077 PolarHBondContact O-N 3.49Å; L1074-I1078 HydrophobicContact CD2-CD1 3.52Å; L1074-I1078 HydrophobicContact CG-CD1 4.07Å; L1074-I1078 VanDerWaalsContact O-CG1 3.31Å; L1074-I1078 WeakPolarHBondContact O-CG1 3.42Å; L1074-I1078 PolarHBondContact O-N 2.98Å
1075	Y	87	Confident	85.1	Confident	11 Å²	11	55.9 Å²	55.9	4%	0.043	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-52.1	178.2	174.7	-104.5	0	0	0	112.3	I980 Y983 I1040 V1071 L1072 G1077 I1078 V1079	I980-Y1075 WeakPolarHBondContact CG1-OH 3.37Å; Y983-Y1075 VanDerWaalsContact CB-CD2 3.44Å; Y983-Y1075 VanDerWaalsContact CB-CE2 3.5Å; Y983-Y1075 HydrophobicContact CD1-CD1 4.26Å; Y983-Y1075 HydrophobicContact CD1-CD2 4.31Å; Y983-Y1075 HydrophobicContact CD1-CE1 4.16Å; Y983-Y1075 HydrophobicContact CD1-CE2 4.18Å; Y983-Y1075 HydrophobicContact CD1-CG 4.32Å; Y983-Y1075 HydrophobicContact CD2-CD1 4.09Å; Y983-Y1075 AromaticContact CD2-CD2 3.78Å; Y983-Y1075 HydrophobicContact CD2-CD2 3.78Å; Y983-Y1075 HydrophobicContact CD2-CE2 4.44Å; Y983-Y1075 AromaticContact CD2-CG 3.55Å; Y983-Y1075 HydrophobicContact CD2-CG 3.55Å; Y983-Y1075 HydrophobicContact CE1-CD1 4.34Å; Y983-Y1075 HydrophobicContact CE1-CE1 4.37Å; Y983-Y1075 HydrophobicContact CE2-CD1 4.16Å; Y983-Y1075 AromaticContact CE2-CG 3.98Å; Y983-Y1075 HydrophobicContact CE2-CG 3.98Å; Y983-Y1075 HydrophobicContact CG-CD1 4.12Å; Y983-Y1075 AromaticContact CG-CD2 3.58Å; Y983-Y1075 HydrophobicContact CG-CD2 3.58Å; Y983-Y1075 HydrophobicContact CG-CE1 4.34Å; Y983-Y1075 AromaticContact CG-CE2 3.79Å; Y983-Y1075 HydrophobicContact CG-CE2 3.79Å; Y983-Y1075 AromaticContact CG-CG 3.73Å; Y983-Y1075 HydrophobicContact CG-CG 3.73Å; I1040-Y1075 WeakPolarHBondContact CG1-OH 3.4Å; V1071-Y1075 WeakPolarHBondContact O-CB 3.34Å; V1071-Y1075 PolarHBondContact O-N 3.2Å; L1072-Y1075 PolarHBondContact O-N 3.06Å; Y1075-G1077 VanDerWaalsContact C-N 3.28Å; Y1075-G1077 PolarHBondContact O-N 3.48Å; Y1075-I1078 PolarHBondContact O-N 3.33Å; Y1075-V1079 HydrophobicContact CD2-CG2 3.8Å; Y1075-V1079 HydrophobicContact CE1-CG2 4.21Å; Y1075-V1079 HydrophobicContact CE2-CG2 3.42Å; Y1075-V1079 VanDerWaalsContact CE2-CG2 3.42Å; Y1075-V1079 HydrophobicContact CG-CG2 4.37Å; Y1075-V1079 WeakPolarHBondContact O-CB 3.32Å; Y1075-V1079 WeakPolarHBondContact O-CG2 3.15Å; Y1075-V1079 PolarHBondContact O-N 2.94Å
1076	V	83.2	Confident	85.3	Confident	39 Å²	39	57.2 Å²	57.2	24%	0.236	30%	0.299	C	S	.	.	H	α-helix	trans	-61.3	-39.4	177.4	171.5	0	0	0	0	110.4	L1072 N1080	L1072-V1076 HydrophobicContact CD1-CG2 3.83Å; L1072-V1076 HydrophobicContact CG-CG2 4.21Å; L1072-V1076 WeakPolarHBondContact O-CB 3.42Å; L1072-V1076 VanDerWaalsContact O-CG2 3.29Å; L1072-V1076 WeakPolarHBondContact O-CG2 3.47Å; L1072-V1076 PolarHBondContact O-N 3.02Å; V1076-N1080 HydrophobicContact CG1-CB 4.36Å; V1076-N1080 WeakPolarHBondContact O-CA 3.28Å; V1076-N1080 VanDerWaalsContact O-CB 3.29Å; V1076-N1080 WeakPolarHBondContact O-CB 3.24Å; V1076-N1080 PolarHBondContact O-N 3.27Å
1077	G	85	Confident	85.3	Confident	21 Å²	21	56.1 Å²	56.1	22%	0.216	29%	0.291	C	S	.	.	I	π-helix	trans	-57.8	-50.7	172.9	0	0	0	0	0	112.3	V1073 L1074 Y1075 I1081 I1082	V1073-G1077 PolarHBondContact O-N 3.33Å; L1074-G1077 PolarHBondContact O-N 3.49Å; Y1075-G1077 VanDerWaalsContact C-N 3.28Å; Y1075-G1077 PolarHBondContact O-N 3.48Å; G1077-I1081 WeakPolarHBondContact O-CA 3.28Å; G1077-I1081 WeakPolarHBondContact O-CB 3.49Å; G1077-I1081 PolarHBondContact O-N 3.49Å; G1077-I1081 VanDerWaalsContact O-N 3.11Å; G1077-I1082 PolarHBondContact O-N 2.87Å
1078	I	87.2	Confident	85.3	Confident	51 Å²	51	60.8 Å²	60.8	26%	0.262	32%	0.315	S	S	.	.	I	π-helix	trans	-67.4	-48.8	-180	-66.3	169.6	0	0	0	111.4	F979 L1074 Y1075 I1082 L1083	F979-I1078 HydrophobicContact CD1-CG2 4.33Å; F979-I1078 HydrophobicContact CE1-CG2 4.11Å; F979-I1078 HydrophobicContact CZ-CG2 4.34Å; L1074-I1078 HydrophobicContact CD2-CD1 3.52Å; L1074-I1078 HydrophobicContact CG-CD1 4.07Å; L1074-I1078 VanDerWaalsContact O-CG1 3.31Å; L1074-I1078 WeakPolarHBondContact O-CG1 3.42Å; L1074-I1078 PolarHBondContact O-N 2.98Å; Y1075-I1078 PolarHBondContact O-N 3.33Å; I1078-I1082 WeakPolarHBondContact O-CA 3.22Å; I1078-I1082 VanDerWaalsContact O-CB 3.26Å; I1078-I1082 WeakPolarHBondContact O-CB 3.48Å; I1078-I1082 PolarHBondContact O-N 3.39Å; I1078-L1083 HydrophobicContact CG2-CD1 4.43Å; I1078-L1083 PolarHBondContact O-N 3.37Å
1079	V	84.9	Confident	85.6	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.006	33%	0.332	C	S	.	.	I	π-helix	trans	-71.7	-52.4	-174.3	174.7	0	0	0	0	111.4	F976 I1040 Y1075 L1083 I1084	F976-V1079 HydrophobicContact CD1-CG1 4.1Å; F976-V1079 HydrophobicContact CE1-CG1 3.82Å; I1040-V1079 HydrophobicContact CG2-CG1 4.37Å; Y1075-V1079 HydrophobicContact CD2-CG2 3.8Å; Y1075-V1079 HydrophobicContact CE1-CG2 4.21Å; Y1075-V1079 HydrophobicContact CE2-CG2 3.42Å; Y1075-V1079 VanDerWaalsContact CE2-CG2 3.42Å; Y1075-V1079 HydrophobicContact CG-CG2 4.37Å; Y1075-V1079 WeakPolarHBondContact O-CB 3.32Å; Y1075-V1079 WeakPolarHBondContact O-CG2 3.15Å; Y1075-V1079 PolarHBondContact O-N 2.94Å; V1079-L1083 HydrophobicContact CG2-CD1 4.35Å; V1079-L1083 WeakPolarHBondContact O-CB 3.1Å; V1079-L1083 PolarHBondContact O-N 2.88Å; V1079-I1084 WeakPolarHBondContact O-CG1 3.33Å; V1079-I1084 PolarHBondContact O-N 3.36Å
1080	N	77	Confident	85.7	Confident	56 Å²	56	58.9 Å²	58.9	30%	0.299	32%	0.32	S	S	.	.	I	π-helix	trans	-85.1	-37.3	-172.3	-67	-12.7	0	0	0	113.1	V1076 I1084	V1076-N1080 HydrophobicContact CG1-CB 4.36Å; V1076-N1080 WeakPolarHBondContact O-CA 3.28Å; V1076-N1080 VanDerWaalsContact O-CB 3.29Å; V1076-N1080 WeakPolarHBondContact O-CB 3.24Å; V1076-N1080 PolarHBondContact O-N 3.27Å; N1080-I1084 HydrophobicContact CB-CD1 4.35Å; N1080-I1084 WeakPolarHBondContact OD1-CD1 3.2Å
1081	I	84	Confident	85.7	Confident	114 Å²	114	54 Å²	54	59%	0.585	30%	0.298	S	S	*	.	I	π-helix	trans	-85.4	-40	-179	-50.3	176	0	0	0	111	G1077 N1085	G1077-I1081 WeakPolarHBondContact O-CA 3.28Å; G1077-I1081 WeakPolarHBondContact O-CB 3.49Å; G1077-I1081 PolarHBondContact O-N 3.49Å; G1077-I1081 VanDerWaalsContact O-N 3.11Å; I1081-N1085 VanDerWaalsContact O-CB 3.26Å; I1081-N1085 WeakPolarHBondContact O-CB 3.41Å; I1081-N1085 VanDerWaalsContact O-CG 3.3Å; I1081-N1085 PolarHBondContact O-ND2 3.29Å
1082	I	85.1	Confident	85.6	Confident	97 Å²	97	57.9 Å²	57.9	50%	0.497	33%	0.325	S	S	.	.	I	π-helix	trans	-93.1	-61.5	-175.4	-52.5	176.5	0	0	0	110.7	G1077 I1078 N1085 L1086	G1077-I1082 PolarHBondContact O-N 2.87Å; I1078-I1082 WeakPolarHBondContact O-CA 3.22Å; I1078-I1082 VanDerWaalsContact O-CB 3.26Å; I1078-I1082 WeakPolarHBondContact O-CB 3.48Å; I1078-I1082 PolarHBondContact O-N 3.39Å; I1082-N1085 PolarHBondContact O-N 2.73Å; I1082-L1086 WeakPolarHBondContact O-CB 3.37Å; I1082-L1086 PolarHBondContact O-N 3.06Å
1083	L	86.2	Confident	85.7	Confident	15 Å²	15	62.6 Å²	62.6	8%	0.079	35%	0.35	C	S	.	.	I	π-helix	trans	-69.2	-41	-169.7	-66.6	172.3	0	0	0	113.2	L972 V975 F976 F979 I1078 V1079 L1086 L1087	L972-L1083 HydrophobicContact CD1-CD2 4.33Å; V975-L1083 HydrophobicContact CG1-CD1 4.43Å; V975-L1083 HydrophobicContact CG1-CD2 3.87Å; F976-L1083 HydrophobicContact CD1-CB 4.29Å; F976-L1083 HydrophobicContact CD1-CD1 3.89Å; F976-L1083 HydrophobicContact CE1-CB 3.44Å; F976-L1083 VanDerWaalsContact CE1-CB 3.44Å; F976-L1083 HydrophobicContact CE1-CD1 3.87Å; F976-L1083 HydrophobicContact CE1-CG 4.3Å; F976-L1083 HydrophobicContact CZ-CB 3.69Å; F979-L1083 HydrophobicContact CD2-CD1 3.54Å; F979-L1083 HydrophobicContact CE2-CD1 3.91Å; F979-L1083 HydrophobicContact CE2-CD2 4.41Å; F979-L1083 HydrophobicContact CG-CD1 4.24Å; I1078-L1083 HydrophobicContact CG2-CD1 4.43Å; I1078-L1083 PolarHBondContact O-N 3.37Å; V1079-L1083 HydrophobicContact CG2-CD1 4.35Å; V1079-L1083 WeakPolarHBondContact O-CB 3.1Å; V1079-L1083 PolarHBondContact O-N 2.88Å; L1083-L1086 PolarHBondContact O-N 3.23Å; L1083-L1087 PolarHBondContact O-N 3.04Å
1084	I	84.6	Confident	85.6	Confident	63 Å²	63	59 Å²	59	32%	0.323	33%	0.328	S	S	.	.	H	α-helix	trans	-67.2	-43.4	176.2	-66.4	178.6	0	0	0	111.3	F976 V1079 N1080 L1086 L1087 I1088	F976-I1084 HydrophobicContact CE1-CG1 4.45Å; F976-I1084 HydrophobicContact CZ-CG1 4.12Å; V1079-I1084 WeakPolarHBondContact O-CG1 3.33Å; V1079-I1084 PolarHBondContact O-N 3.36Å; N1080-I1084 HydrophobicContact CB-CD1 4.35Å; N1080-I1084 WeakPolarHBondContact OD1-CD1 3.2Å; I1084-L1086 VanDerWaalsContact C-N 3.29Å; I1084-L1086 PolarHBondContact O-N 2.98Å; I1084-L1087 VanDerWaalsContact O-CB 3.31Å; I1084-L1087 WeakPolarHBondContact O-CB 3.31Å; I1084-L1087 PolarHBondContact O-N 3.26Å; I1084-L1087 VanDerWaalsContact O-N 3.17Å; I1084-I1088 HydrophobicContact CG2-CD1 3.97Å; I1084-I1088 WeakPolarHBondContact O-CG1 3.32Å; I1084-I1088 PolarHBondContact O-N 3.47Å
1085	N	84.8	Confident	85.6	Confident	90 Å²	90	57 Å²	57	48%	0.481	32%	0.32	S	S	.	.	H	α-helix	trans	-65.5	-35.3	176.9	-74.2	-29.8	0	0	0	112	I1081 I1082 I1088 A1089	I1081-N1085 VanDerWaalsContact O-CB 3.26Å; I1081-N1085 WeakPolarHBondContact O-CB 3.41Å; I1081-N1085 VanDerWaalsContact O-CG 3.3Å; I1081-N1085 PolarHBondContact O-ND2 3.29Å; I1082-N1085 PolarHBondContact O-N 2.73Å; N1085-I1088 PolarHBondContact O-N 3.42Å; N1085-A1089 WeakPolarHBondContact O-CB 3.32Å; N1085-A1089 PolarHBondContact O-N 3.09Å
1086	L	88	Confident	85.2	Confident	80 Å²	80	60.3 Å²	60.3	42%	0.419	35%	0.345	S	S	.	.	H	α-helix	trans	-65.8	-39.5	173	-172.9	143.1	0	0	0	111.5	L972 I1082 L1083 I1084 I1088 A1089 L1090	L972-L1086 HydrophobicContact CD1-CD2 4.04Å; I1082-L1086 WeakPolarHBondContact O-CB 3.37Å; I1082-L1086 PolarHBondContact O-N 3.06Å; L1083-L1086 PolarHBondContact O-N 3.23Å; I1084-L1086 VanDerWaalsContact C-N 3.29Å; I1084-L1086 PolarHBondContact O-N 2.98Å; L1086-I1088 PolarHBondContact O-N 3.24Å; L1086-A1089 PolarHBondContact O-N 3.2Å; L1086-L1090 HydrophobicContact CD2-CD1 3.49Å; L1086-L1090 VanDerWaalsContact CD2-CD1 3.49Å; L1086-L1090 HydrophobicContact CD2-CG 4.05Å; L1086-L1090 HydrophobicContact CG-CD1 4.47Å; L1086-L1090 WeakPolarHBondContact O-CB 3.44Å; L1086-L1090 WeakPolarHBondContact O-CG 3.4Å; L1086-L1090 PolarHBondContact O-N 3.16Å
1087	L	87.6	Confident	85.1	Confident	25 Å²	25	67.1 Å²	67.1	13%	0.131	37%	0.367	C	S	.	.	H	α-helix	trans	-58	-47.7	171.6	-175.9	53.2	0	0	0	111.3	L969 L972 L1083 I1084 A1089 L1090 F1091	L969-L1087 HydrophobicContact CD1-CD1 4.21Å; L969-L1087 HydrophobicContact CD1-CD2 4.05Å; L972-L1087 HydrophobicContact CD2-CB 3.4Å; L972-L1087 HydrophobicContact CD2-CD1 3.53Å; L972-L1087 HydrophobicContact CD2-CD2 4.04Å; L972-L1087 HydrophobicContact CD2-CG 3.79Å; L1083-L1087 PolarHBondContact O-N 3.04Å; I1084-L1087 VanDerWaalsContact O-CB 3.31Å; I1084-L1087 WeakPolarHBondContact O-CB 3.31Å; I1084-L1087 PolarHBondContact O-N 3.26Å; I1084-L1087 VanDerWaalsContact O-N 3.17Å; L1087-A1089 VanDerWaalsContact C-N 3.33Å; L1087-A1089 PolarHBondContact O-N 2.88Å; L1087-L1090 PolarHBondContact O-N 2.9Å; L1087-F1091 HydrophobicContact CD1-CD1 4Å; L1087-F1091 HydrophobicContact CD1-CD2 3.94Å; L1087-F1091 HydrophobicContact CD1-CE1 3.62Å; L1087-F1091 HydrophobicContact CD1-CE2 3.54Å; L1087-F1091 HydrophobicContact CD1-CG 4.18Å; L1087-F1091 HydrophobicContact CD1-CZ 3.38Å; L1087-F1091 HydrophobicContact CD2-CE2 4.06Å; L1087-F1091 HydrophobicContact CD2-CZ 4.45Å; L1087-F1091 HydrophobicContact CG-CD2 3.93Å; L1087-F1091 HydrophobicContact CG-CE2 3.67Å; L1087-F1091 HydrophobicContact CG-CZ 4.06Å; L1087-F1091 VanDerWaalsContact O-CB 3.27Å; L1087-F1091 WeakPolarHBondContact O-CB 3.43Å; L1087-F1091 VanDerWaalsContact O-CG 3.31Å; L1087-F1091 WeakPolarHBondContact O-CG 3.31Å; L1087-F1091 PolarHBondContact O-N 3.31Å
1088	I	87.2	Confident	84.7	Confident	99 Å²	99	66.9 Å²	66.9	51%	0.508	36%	0.36	S	S	.	.	H	α-helix	trans	-62.6	-42.5	179.6	-64.9	164.2	0	0	0	110.4	I1084 N1085 L1086 S1092	I1084-I1088 HydrophobicContact CG2-CD1 3.97Å; I1084-I1088 WeakPolarHBondContact O-CG1 3.32Å; I1084-I1088 PolarHBondContact O-N 3.47Å; N1085-I1088 PolarHBondContact O-N 3.42Å; L1086-I1088 PolarHBondContact O-N 3.24Å; I1088-S1092 WeakPolarHBondContact O-CB 3.36Å; I1088-S1092 PolarHBondContact O-N 3.49Å
1089	A	88.1	Confident	84.3	Confident	61 Å²	61	68.7 Å²	68.7	50%	0.504	37%	0.37	S	S	.	.	H	α-helix	trans	-65.6	-45.7	178	0	0	0	0	0	112.4	N1085 L1086 L1087 S1092 N1093	N1085-A1089 WeakPolarHBondContact O-CB 3.32Å; N1085-A1089 PolarHBondContact O-N 3.09Å; L1086-A1089 PolarHBondContact O-N 3.2Å; L1087-A1089 VanDerWaalsContact C-N 3.33Å; L1087-A1089 PolarHBondContact O-N 2.88Å; A1089-S1092 PolarHBondContact O-N 3.26Å; A1089-N1093 PolarHBondContact O-N 3.2Å
1090	L	87	Confident	83.7	Confident	67 Å²	67	76.2 Å²	76.2	35%	0.351	41%	0.406	S	S	.	.	H	α-helix	trans	-60.9	-47.9	175.5	-75	178.9	0	0	0	110.9	L1086 L1087 S1092 N1093 T1094	L1086-L1090 HydrophobicContact CD2-CD1 3.49Å; L1086-L1090 VanDerWaalsContact CD2-CD1 3.49Å; L1086-L1090 HydrophobicContact CD2-CG 4.05Å; L1086-L1090 HydrophobicContact CG-CD1 4.47Å; L1086-L1090 WeakPolarHBondContact O-CB 3.44Å; L1086-L1090 WeakPolarHBondContact O-CG 3.4Å; L1086-L1090 PolarHBondContact O-N 3.16Å; L1087-L1090 PolarHBondContact O-N 2.9Å; L1090-S1092 VanDerWaalsContact C-N 3.33Å; L1090-S1092 PolarHBondContact O-N 3.13Å; L1090-N1093 PolarHBondContact O-N 3.09Å; L1090-T1094 WeakPolarHBondContact O-CB 3.34Å; L1090-T1094 PolarHBondContact O-N 3.42Å; L1090-T1094 PolarHBondContact O-OG1 3.03Å; L1090-T1094 VanDerWaalsContact O-OG1 3.07Å
1091	F	88.6	Confident	83.7	Confident	46 Å²	46	79.6 Å²	79.6	20%	0.202	42%	0.418	C	S	.	.	H	α-helix	trans	-58.2	-43.7	175.4	-80.1	-12.3	0	0	0	112.3	M964 D968 L969 L1087 N1093 T1094 V1095	M964-F1091 HydrophobicContact CB-CD1 4.13Å; M964-F1091 HydrophobicContact CB-CE1 4.04Å; M964-F1091 HydrophobicContact CE-CB 3.39Å; M964-F1091 HydrophobicContact CE-CD1 3.52Å; M964-F1091 HydrophobicContact CE-CD2 4Å; M964-F1091 HydrophobicContact CE-CE1 4.21Å; M964-F1091 HydrophobicContact CE-CG 3.37Å; D968-F1091 HydrophobicContact CB-CD1 3.92Å; D968-F1091 HydrophobicContact CB-CE1 3.81Å; L969-F1091 HydrophobicContact CB-CE1 4.31Å; L969-F1091 HydrophobicContact CB-CZ 4.04Å; L969-F1091 HydrophobicContact CD1-CZ 4.23Å; L1087-F1091 HydrophobicContact CD1-CD1 4Å; L1087-F1091 HydrophobicContact CD1-CD2 3.94Å; L1087-F1091 HydrophobicContact CD1-CE1 3.62Å; L1087-F1091 HydrophobicContact CD1-CE2 3.54Å; L1087-F1091 HydrophobicContact CD1-CG 4.18Å; L1087-F1091 HydrophobicContact CD1-CZ 3.38Å; L1087-F1091 HydrophobicContact CD2-CE2 4.06Å; L1087-F1091 HydrophobicContact CD2-CZ 4.45Å; L1087-F1091 HydrophobicContact CG-CD2 3.93Å; L1087-F1091 HydrophobicContact CG-CE2 3.67Å; L1087-F1091 HydrophobicContact CG-CZ 4.06Å; L1087-F1091 VanDerWaalsContact O-CB 3.27Å; L1087-F1091 WeakPolarHBondContact O-CB 3.43Å; L1087-F1091 VanDerWaalsContact O-CG 3.31Å; L1087-F1091 WeakPolarHBondContact O-CG 3.31Å; L1087-F1091 PolarHBondContact O-N 3.31Å; F1091-N1093 PolarHBondContact O-N 3.31Å; F1091-T1094 PolarHBondContact O-N 2.87Å; F1091-V1095 WeakPolarHBondContact O-CB 3.5Å; F1091-V1095 WeakPolarHBondContact O-CG2 3.29Å; F1091-V1095 PolarHBondContact O-N 3.17Å
1092	S	86.2	Confident	83.4	Confident	82 Å²	82	74.3 Å²	74.3	57%	0.573	39%	0.39	S	S	*	.	H	α-helix	trans	-59.7	-45.8	177.3	-175.4	0	0	0	0	112.2	I1088 A1089 L1090 V1095 S1096	I1088-S1092 WeakPolarHBondContact O-CB 3.36Å; I1088-S1092 PolarHBondContact O-N 3.49Å; A1089-S1092 PolarHBondContact O-N 3.26Å; L1090-S1092 VanDerWaalsContact C-N 3.33Å; L1090-S1092 PolarHBondContact O-N 3.13Å; S1092-V1095 PolarHBondContact O-N 2.89Å; S1092-S1096 PolarHBondContact O-N 2.83Å; S1092-S1096 VanDerWaalsContact O-N 3.1Å
1093	N	85.1	Confident	83.1	Confident	108 Å²	108	72.6 Å²	72.6	58%	0.578	39%	0.385	S	S	*	.	H	α-helix	trans	-64.6	-45.7	176.5	-173	9.5	0	0	0	111.7	A1089 L1090 F1091 V1095 S1096 R1097	A1089-N1093 PolarHBondContact O-N 3.2Å; L1090-N1093 PolarHBondContact O-N 3.09Å; F1091-N1093 PolarHBondContact O-N 3.31Å; N1093-V1095 PolarHBondContact O-N 3.25Å; N1093-S1096 PolarHBondContact O-N 2.9Å; N1093-R1097 PolarHBondContact O-N 2.9Å
1094	T	85	Confident	82.8	Confident	20 Å²	20	72.6 Å²	72.6	12%	0.123	39%	0.387	C	S	.	.	H	α-helix	trans	-63.4	-41.5	178.8	-64.2	0	0	0	0	111.7	M964 D968 L1090 F1091 S1096 R1097 I1098	M964-T1094 HydrophobicContact CG-CG2 3.75Å; D968-T1094 PolarHBondContact OD1-OG1 2.92Å; D968-T1094 WeakPolarHBondContact OD2-CB 3.41Å; D968-T1094 VanDerWaalsContact OD2-CG2 3.24Å; D968-T1094 WeakPolarHBondContact OD2-CG2 3.33Å; D968-T1094 PolarHBondContact OD2-OG1 3.41Å; L1090-T1094 WeakPolarHBondContact O-CB 3.34Å; L1090-T1094 PolarHBondContact O-N 3.42Å; L1090-T1094 PolarHBondContact O-OG1 3.03Å; L1090-T1094 VanDerWaalsContact O-OG1 3.07Å; F1091-T1094 PolarHBondContact O-N 2.87Å; T1094-S1096 PolarHBondContact O-N 3.41Å; T1094-R1097 PolarHBondContact O-N 3.43Å; T1094-I1098 HydrophobicContact CG2-CD1 3.32Å; T1094-I1098 HydrophobicContact CG2-CG1 3.98Å; T1094-I1098 WeakPolarHBondContact O-CB 3.48Å; T1094-I1098 WeakPolarHBondContact O-CG1 3.49Å; T1094-I1098 PolarHBondContact O-N 2.9Å
1095	V	85.1	Confident	82.5	Confident	50 Å²	50	72.7 Å²	72.7	30%	0.303	39%	0.386	S	S	.	.	H	α-helix	trans	-56.2	-51.6	173.1	165.2	0	0	0	0	110.3	M960 M964 F1091 S1092 N1093 R1097 I1098 D1099	M960-V1095 HydrophobicContact CE-CG1 4.21Å; M960-V1095 HydrophobicContact CE-CG2 3.84Å; M960-V1095 HydrophobicContact CG-CG2 4.44Å; M960-V1095 HydrophobicContact SD-CB 4.03Å; M960-V1095 HydrophobicContact SD-CG1 3.69Å; M960-V1095 HydrophobicContact SD-CG2 3.82Å; M964-V1095 HydrophobicContact CE-CG2 3.46Å; M964-V1095 VanDerWaalsContact CE-CG2 3.46Å; M964-V1095 HydrophobicContact SD-CG2 3.35Å; M964-V1095 WeakPolarHBondContact SD-CG2 3.44Å; F1091-V1095 WeakPolarHBondContact O-CB 3.5Å; F1091-V1095 WeakPolarHBondContact O-CG2 3.29Å; F1091-V1095 PolarHBondContact O-N 3.17Å; S1092-V1095 PolarHBondContact O-N 2.89Å; N1093-V1095 PolarHBondContact O-N 3.25Å; V1095-R1097 PolarHBondContact O-N 2.89Å; V1095-I1098 PolarHBondContact O-N 3.33Å; V1095-D1099 VanDerWaalsContact O-CB 3.31Å; V1095-D1099 WeakPolarHBondContact O-CB 3.49Å; V1095-D1099 PolarHBondContact O-N 3.49Å
1096	S	80.2	Confident	82.5	Confident	82 Å²	82	69.7 Å²	69.7	57%	0.573	37%	0.368	S	S	*	.	H	α-helix	trans	-59.4	-45.6	-179.1	-177.6	0	0	0	0	112.5	S1092 N1093 T1094	S1092-S1096 PolarHBondContact O-N 2.83Å; S1092-S1096 VanDerWaalsContact O-N 3.1Å; N1093-S1096 PolarHBondContact O-N 2.9Å; T1094-S1096 PolarHBondContact O-N 3.41Å
1097	R	79.9	Confident	82.2	Confident	182 Å²	182	67.6 Å²	67.6	69%	0.687	36%	0.357	S	S	*	.	H	α-helix	trans	-69.7	-36.1	179.2	-176.9	176.7	173.6	163.2	-0	113	N1093 T1094 V1095	N1093-R1097 PolarHBondContact O-N 2.9Å; T1094-R1097 PolarHBondContact O-N 3.43Å; V1095-R1097 PolarHBondContact O-N 2.89Å
1098	I	76.7	Confident	81.8	Confident	15 Å²	15	67 Å²	67	8%	0.077	36%	0.356	C	S	.	.	H	α-helix	trans	-84.3	-33.4	-175.2	-67.8	-175.9	0	0	0	111.6	M960 D963 T1094 V1095 Q1100 K1101 S1102	M960-I1098 HydrophobicContact CB-CG2 4.15Å; M960-I1098 HydrophobicContact CG-CB 4.36Å; M960-I1098 HydrophobicContact CG-CG2 3.98Å; D963-I1098 HydrophobicContact CB-CD1 3.69Å; T1094-I1098 HydrophobicContact CG2-CD1 3.32Å; T1094-I1098 HydrophobicContact CG2-CG1 3.98Å; T1094-I1098 WeakPolarHBondContact O-CB 3.48Å; T1094-I1098 WeakPolarHBondContact O-CG1 3.49Å; T1094-I1098 PolarHBondContact O-N 2.9Å; V1095-I1098 PolarHBondContact O-N 3.33Å; I1098-Q1100 PolarHBondContact O-N 3.16Å; I1098-Q1100 VanDerWaalsContact O-N 3.16Å; I1098-K1101 CarbonylContact O-C 3.59Å; I1098-K1101 PolarHBondContact O-N 3.47Å; I1098-S1102 VanDerWaalsContact O-CB 3.27Å; I1098-S1102 WeakPolarHBondContact O-CB 3.24Å; I1098-S1102 PolarHBondContact O-N 3.33Å
1099	D	79	Confident	81.5	Confident	89 Å²	89	63.6 Å²	63.6	48%	0.476	35%	0.345	S	S	.	.	H	α-helix	trans	-51.6	-45.2	-176.5	-171.6	55	0	0	0	111.7	V1095 K1101 S1102	V1095-D1099 VanDerWaalsContact O-CB 3.31Å; V1095-D1099 WeakPolarHBondContact O-CB 3.49Å; V1095-D1099 PolarHBondContact O-N 3.49Å; D1099-K1101 VanDerWaalsContact C-N 3.33Å; D1099-K1101 PolarHBondContact O-N 2.96Å; D1099-S1102 PolarHBondContact O-N 3.17Å; D1099-S1102 PolarHBondContact O-OG 2.88Å
1100	Q	73.4	Confident	81.2	Confident	160 Å²	160	63.7 Å²	63.7	75%	0.748	33%	0.332	S	S	*	.	H	α-helix	trans	-59.1	-37.6	176.6	-64.4	-176.8	-8.4	0	0	113.8	I1098	I1098-Q1100 PolarHBondContact O-N 3.16Å; I1098-Q1100 VanDerWaalsContact O-N 3.16Å
1101	K	76.9	Confident	81	Confident	127 Å²	127	61.6 Å²	61.6	55%	0.552	32%	0.32	S	S	*	.	H	α-helix	trans	-90.9	-26.3	-179.4	-62.8	-170.6	179.8	-168.2	0	112.9	I1098 D1099 T1103 A1104 H1105	I1098-K1101 CarbonylContact O-C 3.59Å; I1098-K1101 PolarHBondContact O-N 3.47Å; D1099-K1101 VanDerWaalsContact C-N 3.33Å; D1099-K1101 PolarHBondContact O-N 2.96Å; K1101-T1103 VanDerWaalsContact C-N 3.31Å; K1101-T1103 PolarHBondContact O-N 3.31Å; K1101-A1104 PolarHBondContact O-N 2.9Å; K1101-H1105 WeakPolarHBondContact O-CB 3.37Å; K1101-H1105 PolarHBondContact O-CD2 3.35Å; K1101-H1105 PolarHBondContact O-N 2.97Å
1102	S	76.6	Confident	80.5	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.014	33%	0.329	C	S	.	.	H	α-helix	trans	-64.1	-37.6	-172.3	75.2	0	0	0	0	111.8	I1098 D1099 H1105 W1106	I1098-S1102 VanDerWaalsContact O-CB 3.27Å; I1098-S1102 WeakPolarHBondContact O-CB 3.24Å; I1098-S1102 PolarHBondContact O-N 3.33Å; D1099-S1102 PolarHBondContact O-N 3.17Å; D1099-S1102 PolarHBondContact O-OG 2.88Å; S1102-H1105 CarbonylContact O-C 3.47Å; S1102-H1105 PolarHBondContact O-N 2.89Å; S1102-W1106 WeakPolarHBondContact O-CB 3.31Å; S1102-W1106 PolarHBondContact O-N 3.24Å
1103	T	79.5	Confident	80.2	Confident	62 Å²	62	60.9 Å²	60.9	38%	0.38	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-50.8	178.6	57.2	0	0	0	0	110.6	K1101 H1105 W1106 L1107	K1101-T1103 VanDerWaalsContact C-N 3.31Å; K1101-T1103 PolarHBondContact O-N 3.31Å; T1103-H1105 VanDerWaalsContact C-N 3.34Å; T1103-H1105 PolarHBondContact O-N 2.97Å; T1103-W1106 PolarHBondContact O-N 3.29Å; T1103-L1107 WeakPolarHBondContact O-CB 3.38Å; T1103-L1107 WeakPolarHBondContact O-CG 3.36Å; T1103-L1107 PolarHBondContact O-N 3.29Å
1104	A	79.2	Confident	80	Confident	14 Å²	14	56.4 Å²	56.4	12%	0.116	28%	0.283	C	S	.	.	H	α-helix	trans	-61.3	-43.9	175.9	0	0	0	0	0	111.6	K1101 W1106 L1107 A1108	K1101-A1104 PolarHBondContact O-N 2.9Å; A1104-W1106 VanDerWaalsContact C-N 3.32Å; A1104-W1106 PolarHBondContact O-N 3.45Å; A1104-L1107 PolarHBondContact O-N 2.92Å; A1104-A1108 WeakPolarHBondContact O-CB 3.46Å; A1104-A1108 PolarHBondContact O-N 3.15Å
1105	H	79	Confident	79.7	Confident	66 Å²	66	59.6 Å²	59.6	31%	0.306	30%	0.296	S	S	.	.	H	α-helix	trans	-63.9	-34.8	176.5	-83.4	-50.5	0	0	0	113.5	K959 K1101 S1102 T1103 G1109	K959-H1105 HydrophobicContact CD-CB 3.82Å; K959-H1105 PolarHBondContact NZ-O 3.41Å; K1101-H1105 WeakPolarHBondContact O-CB 3.37Å; K1101-H1105 PolarHBondContact O-CD2 3.35Å; K1101-H1105 PolarHBondContact O-N 2.97Å; S1102-H1105 CarbonylContact O-C 3.47Å; S1102-H1105 PolarHBondContact O-N 2.89Å; T1103-H1105 VanDerWaalsContact C-N 3.34Å; T1103-H1105 PolarHBondContact O-N 2.97Å; H1105-G1109 PolarHBondContact O-N 3.03Å; H1105-G1109 VanDerWaalsContact O-N 3.09Å
1106	W	84.7	Confident	79.5	Confident	26 Å²	26	59 Å²	59	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-75.5	-42.9	176.3	172.2	82.6	0	0	0	111.2	S949 S951 P952 P956 K959 S1102 T1103 A1104 A1108 G1109 R1110	S949-W1106 PolarHBondContact O-NE1 3.23Å; S951-W1106 WeakPolarHBondContact O-CZ2 3.49Å; P952-W1106 HydrophobicContact CB-CH2 3.77Å; P952-W1106 HydrophobicContact CB-CZ2 4.39Å; P956-W1106 HydrophobicContact CB-CB 4.49Å; P956-W1106 HydrophobicContact CG-CB 4.21Å; P956-W1106 HydrophobicContact CG-CD2 3.83Å; P956-W1106 HydrophobicContact CG-CE3 3.95Å; P956-W1106 HydrophobicContact CG-CG 3.92Å; K959-W1106 HydrophobicContact CD-CB 4.49Å; S1102-W1106 WeakPolarHBondContact O-CB 3.31Å; S1102-W1106 PolarHBondContact O-N 3.24Å; T1103-W1106 PolarHBondContact O-N 3.29Å; A1104-W1106 VanDerWaalsContact C-N 3.32Å; A1104-W1106 PolarHBondContact O-N 3.45Å; W1106-A1108 VanDerWaalsContact C-N 3.3Å; W1106-A1108 PolarHBondContact O-N 3.01Å; W1106-G1109 CarbonylContact O-C 3.59Å; W1106-G1109 VanDerWaalsContact O-CA 3.28Å; W1106-G1109 WeakPolarHBondContact O-CA 3.17Å; W1106-G1109 PolarHBondContact O-N 3.3Å; W1106-R1110 HydrophobicContact CZ2-CG 4.42Å; W1106-R1110 PolarHBondContact O-N 2.77Å
1107	L	81.1	Confident	79.6	Confident	36 Å²	36	55.4 Å²	55.4	19%	0.188	26%	0.263	C	S	.	.	H	α-helix	trans	-59.3	-40.3	173.8	-72.8	171.4	0	0	0	111.7	Q670 T1103 A1104 G1109 R1110	Q670-L1107 HydrophobicContact CG-CD2 4.08Å; Q670-L1107 PolarHBondContact NE2-O 2.89Å; T1103-L1107 WeakPolarHBondContact O-CB 3.38Å; T1103-L1107 WeakPolarHBondContact O-CG 3.36Å; T1103-L1107 PolarHBondContact O-N 3.29Å; A1104-L1107 PolarHBondContact O-N 2.92Å; L1107-G1109 VanDerWaalsContact C-N 3.33Å; L1107-R1110 WeakPolarHBondContact O-CB 3.4Å; L1107-R1110 PolarHBondContact O-N 2.85Å
1108	A	79.5	Confident	79.5	Confident	14 Å²	14	49.5 Å²	49.5	12%	0.116	25%	0.25	C	C	.	.	H	α-helix	trans	-66.7	-35.5	171	0	0	0	0	0	112.1	T661 L664 A1104 W1106 R1110 Y1111	T661-A1108 HydrophobicContact CG2-CB 3.92Å; L664-A1108 HydrophobicContact CB-CB 4.08Å; L664-A1108 HydrophobicContact CD1-CB 4.14Å; A1104-A1108 WeakPolarHBondContact O-CB 3.46Å; A1104-A1108 PolarHBondContact O-N 3.15Å; W1106-A1108 VanDerWaalsContact C-N 3.3Å; W1106-A1108 PolarHBondContact O-N 3.01Å; A1108-R1110 VanDerWaalsContact C-N 3.26Å; A1108-R1110 PolarHBondContact O-N 3.24Å; A1108-Y1111 WeakPolarHBondContact O-CB 3.26Å; A1108-Y1111 PolarHBondContact O-N 3.44Å
1109	G	79.9	Confident	79.5	Confident	27 Å²	27	52 Å²	52	28%	0.278	26%	0.261	S	S	.	.	H	α-helix	trans	-60.8	-31.7	173.5	0	0	0	0	0	113.5	H1105 W1106 L1107 Y1111 K1112 M1113	H1105-G1109 PolarHBondContact O-N 3.03Å; H1105-G1109 VanDerWaalsContact O-N 3.09Å; W1106-G1109 CarbonylContact O-C 3.59Å; W1106-G1109 VanDerWaalsContact O-CA 3.28Å; W1106-G1109 WeakPolarHBondContact O-CA 3.17Å; W1106-G1109 PolarHBondContact O-N 3.3Å; L1107-G1109 VanDerWaalsContact C-N 3.33Å; G1109-Y1111 VanDerWaalsContact C-N 3.26Å; G1109-Y1111 PolarHBondContact O-N 2.88Å; G1109-K1112 WeakPolarHBondContact O-CB 3.23Å; G1109-K1112 PolarHBondContact O-N 2.92Å; G1109-M1113 PolarHBondContact O-N 3.34Å
1110	R	82.1	Confident	79.6	Confident	63 Å²	63	48.7 Å²	48.7	24%	0.238	24%	0.242	C	C	.	.	H	α-helix	trans	-58	-36.6	174.8	-70.4	177.5	161.3	-167.8	-13.3	112.9	W1106 L1107 A1108 K1112 M1113 V1114	W1106-R1110 HydrophobicContact CZ2-CG 4.42Å; W1106-R1110 PolarHBondContact O-N 2.77Å; L1107-R1110 WeakPolarHBondContact O-CB 3.4Å; L1107-R1110 PolarHBondContact O-N 2.85Å; A1108-R1110 VanDerWaalsContact C-N 3.26Å; A1108-R1110 PolarHBondContact O-N 3.24Å; R1110-K1112 VanDerWaalsContact C-N 3.29Å; R1110-K1112 PolarHBondContact O-N 3.46Å; R1110-M1113 PolarHBondContact O-N 2.91Å; R1110-V1114 VanDerWaalsContact O-CG2 3.28Å; R1110-V1114 WeakPolarHBondContact O-CG2 3.23Å; R1110-V1114 PolarHBondContact O-N 3.35Å
1111	Y	83.3	Confident	80	Confident	23 Å²	23	41.3 Å²	41.3	9%	0.09	21%	0.208	C	C	.	.	H	α-helix	trans	-58.2	-44.8	174.8	170.1	-80.7	0	0	0	110.9	I652 D653 A656 L664 L673 A1108 G1109 M1113 V1114 K1115	I652-Y1111 HydrophobicContact CG1-CD2 4.19Å; I652-Y1111 HydrophobicContact CG1-CE2 4.35Å; D653-Y1111 VanDerWaalsContact CA-OH 3.31Å; D653-Y1111 WeakPolarHBondContact CA-OH 3.06Å; D653-Y1111 WeakPolarHBondContact CB-OH 3.48Å; D653-Y1111 WeakPolarHBondContact OD1-CE2 3.49Å; D653-Y1111 PolarHBondContact OD1-OH 3.37Å; A656-Y1111 HydrophobicContact CB-CD1 3.26Å; A656-Y1111 HydrophobicContact CB-CD2 3.93Å; A656-Y1111 HydrophobicContact CB-CE1 3.05Å; A656-Y1111 HydrophobicContact CB-CE2 3.75Å; A656-Y1111 HydrophobicContact CB-CG 3.74Å; L664-Y1111 HydrophobicContact CD2-CD2 4.5Å; L673-Y1111 HydrophobicContact CD2-CD2 3.83Å; L673-Y1111 HydrophobicContact CD2-CG 4.37Å; A1108-Y1111 WeakPolarHBondContact O-CB 3.26Å; A1108-Y1111 PolarHBondContact O-N 3.44Å; G1109-Y1111 VanDerWaalsContact C-N 3.26Å; G1109-Y1111 PolarHBondContact O-N 2.88Å; Y1111-M1113 VanDerWaalsContact C-N 3.29Å; Y1111-M1113 PolarHBondContact O-N 3.19Å; Y1111-V1114 PolarHBondContact O-N 3.42Å; Y1111-K1115 HydrophobicContact CE1-CB 4.24Å; Y1111-K1115 HydrophobicContact CE1-CD 4.08Å; Y1111-K1115 WeakPolarHBondContact O-CB 3.2Å; Y1111-K1115 PolarHBondContact O-N 2.61Å
1112	K	79.2	Confident	80	Confident	92 Å²	92	38.5 Å²	38.5	40%	0.4	20%	0.199	S	C	.	.	H	α-helix	trans	-59.5	-43.8	179.8	-169.9	-176.8	179.3	-171.2	0	110.4	D887 G1109 R1110 K1115 E1116	D887-K1112 IonicContact OD1-NZ 3.11Å; D887-K1112 PolarHBondContact OD1-NZ 3.13Å; D887-K1112 IonicContact OD2-NZ 3.1Å; D887-K1112 PolarHBondContact OD2-NZ 2.83Å; G1109-K1112 WeakPolarHBondContact O-CB 3.23Å; G1109-K1112 PolarHBondContact O-N 2.92Å; R1110-K1112 VanDerWaalsContact C-N 3.29Å; R1110-K1112 PolarHBondContact O-N 3.46Å; K1112-K1115 PolarHBondContact O-N 2.91Å; K1112-E1116 WeakPolarHBondContact O-CB 3.49Å; K1112-E1116 PolarHBondContact O-N 3.43Å
1113	M	78.8	Confident	80.3	Confident	21 Å²	21	41.7 Å²	41.7	10%	0.103	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-47.4	175.8	-64	-66.3	100.9	0	0	112.4	H946 G1109 R1110 Y1111 K1115 E1116 Y1117	H946-M1113 WeakPolarHBondContact NE2-CE 3.42Å; G1109-M1113 PolarHBondContact O-N 3.34Å; R1110-M1113 PolarHBondContact O-N 2.91Å; Y1111-M1113 VanDerWaalsContact C-N 3.29Å; Y1111-M1113 PolarHBondContact O-N 3.19Å; M1113-K1115 VanDerWaalsContact C-N 3.26Å; M1113-K1115 PolarHBondContact O-N 3.14Å; M1113-E1116 VanDerWaalsContact CE-OE2 3.22Å; M1113-E1116 WeakPolarHBondContact CE-OE2 3.4Å; M1113-E1116 PolarHBondContact O-N 3.45Å; M1113-Y1117 WeakPolarHBondContact O-CD2 3.46Å; M1113-Y1117 PolarHBondContact O-N 3.06Å
1114	V	81.8	Confident	80.6	Confident	14 Å²	14	38.9 Å²	38.9	9%	0.085	20%	0.198	C	C	.	.	H	α-helix	trans	-58.5	-42.6	177.8	173.9	0	0	0	0	110.4	L673 R676 W677 R1110 Y1111 S1118	L673-V1114 HydrophobicContact CD2-CB 4.48Å; L673-V1114 HydrophobicContact CD2-CG2 4.37Å; R676-V1114 HydrophobicContact CB-CG1 3.85Å; W677-V1114 HydrophobicContact CB-CG2 4.2Å; W677-V1114 HydrophobicContact CD2-CG2 4.48Å; W677-V1114 HydrophobicContact CE3-CB 4.47Å; W677-V1114 HydrophobicContact CE3-CG2 3.8Å; R1110-V1114 VanDerWaalsContact O-CG2 3.28Å; R1110-V1114 WeakPolarHBondContact O-CG2 3.23Å; R1110-V1114 PolarHBondContact O-N 3.35Å; Y1111-V1114 PolarHBondContact O-N 3.42Å; V1114-S1118 VanDerWaalsContact O-CB 3.24Å; V1114-S1118 WeakPolarHBondContact O-CB 3.49Å; V1114-S1118 PolarHBondContact O-N 2.85Å; V1114-S1118 PolarHBondContact O-OG 3.13Å
1115	K	78.9	Confident	80.8	Confident	87 Å²	87	38.4 Å²	38.4	38%	0.378	19%	0.194	S	C	.	.	H	α-helix	trans	-65.7	-49.1	177	-173.2	-178	175.5	-165.9	0	111.7	Y1111 K1112 M1113 Y1117 S1118 E1119	Y1111-K1115 HydrophobicContact CE1-CB 4.24Å; Y1111-K1115 HydrophobicContact CE1-CD 4.08Å; Y1111-K1115 WeakPolarHBondContact O-CB 3.2Å; Y1111-K1115 PolarHBondContact O-N 2.61Å; K1112-K1115 PolarHBondContact O-N 2.91Å; M1113-K1115 VanDerWaalsContact C-N 3.26Å; M1113-K1115 PolarHBondContact O-N 3.14Å; K1115-Y1117 PolarHBondContact O-N 3.41Å; K1115-S1118 WeakPolarHBondContact CA-OG 3.26Å; K1115-S1118 WeakPolarHBondContact O-CB 3.2Å; K1115-S1118 PolarHBondContact O-N 2.86Å; K1115-S1118 VanDerWaalsContact O-N 3.12Å; K1115-S1118 PolarHBondContact O-OG 3.13Å; K1115-E1119 VanDerWaalsContact CE-OE1 3.3Å; K1115-E1119 WeakPolarHBondContact CE-OE1 3.45Å; K1115-E1119 PolarHBondContact O-N 3.27Å
1116	E	79.2	Confident	81	Confident	36 Å²	36	36.1 Å²	36.1	17%	0.168	19%	0.185	C	C	.	.	H	α-helix	trans	-56.2	-51.8	178.9	-171.8	-171.2	152.6	0	0	111.2	H946 K1112 M1113 S1118 E1119 R1120	H946-E1116 IonicContact CE1-OE2 2.67Å; K1112-E1116 WeakPolarHBondContact O-CB 3.49Å; K1112-E1116 PolarHBondContact O-N 3.43Å; M1113-E1116 VanDerWaalsContact CE-OE2 3.22Å; M1113-E1116 WeakPolarHBondContact CE-OE2 3.4Å; M1113-E1116 PolarHBondContact O-N 3.45Å; E1116-S1118 VanDerWaalsContact C-N 3.28Å; E1116-S1118 PolarHBondContact O-N 3.23Å; E1116-E1119 CarbonylContact O-C 3.58Å; E1116-E1119 PolarHBondContact O-N 2.73Å; E1116-E1119 VanDerWaalsContact O-N 3.11Å; E1116-R1120 WeakPolarHBondContact O-CG 3.38Å; E1116-R1120 PolarHBondContact O-N 2.77Å; E1116-R1120 IonicContact OE1-CZ 3.72Å; E1116-R1120 IonicContact OE1-NE 3.18Å; E1116-R1120 PolarHBondContact OE1-NE 3.08Å; E1116-R1120 VanDerWaalsContact OE1-NE 3.13Å; E1116-R1120 IonicContact OE1-NH2 2.87Å; E1116-R1120 PolarHBondContact OE1-NH2 3.2Å
1117	Y	82.3	Confident	81	Confident	7 Å²	7	40 Å²	40	3%	0.027	20%	0.202	C	C	.	.	H	α-helix	trans	-71.5	-21	178.4	-76.6	-79.8	0	0	0	113.5	W677 K823 F824 H827 M1113 K1115	W677-Y1117 HydrophobicContact CH2-CD2 4.42Å; W677-Y1117 HydrophobicContact CZ3-CD2 4.29Å; W677-Y1117 HydrophobicContact CZ3-CG 4.44Å; K823-Y1117 HydrophobicContact CB-CD1 4.41Å; K823-Y1117 WeakPolarHBondContact CD-O 3.37Å; K823-Y1117 PolarHBondContact NZ-O 3.08Å; F824-Y1117 HydrophobicContact CB-CD1 4.08Å; F824-Y1117 HydrophobicContact CB-CE1 4.14Å; F824-Y1117 HydrophobicContact CB-CG 4.34Å; F824-Y1117 HydrophobicContact CD2-CD2 4.34Å; F824-Y1117 HydrophobicContact CD2-CE1 4.06Å; F824-Y1117 AromaticContact CD2-CE2 3.73Å; F824-Y1117 HydrophobicContact CD2-CE2 3.73Å; F824-Y1117 AromaticContact CD2-CZ 3.58Å; F824-Y1117 HydrophobicContact CE2-CE2 4.47Å; H827-Y1117 HydrophobicContact CB-CE1 4.28Å; M1113-Y1117 WeakPolarHBondContact O-CD2 3.46Å; M1113-Y1117 PolarHBondContact O-N 3.06Å; K1115-Y1117 PolarHBondContact O-N 3.41Å
1118	S	77.8	Confident	81.1	Confident	58 Å²	58	38.2 Å²	38.2	41%	0.406	19%	0.193	S	C	.	.	H	α-helix	trans	-68.6	-37.2	169.3	77.7	0	0	0	0	111.9	K823 V1114 K1115 E1116	K823-S1118 PolarHBondContact NZ-O 3.47Å; K823-S1118 VanDerWaalsContact NZ-O 3.16Å; V1114-S1118 VanDerWaalsContact O-CB 3.24Å; V1114-S1118 WeakPolarHBondContact O-CB 3.49Å; V1114-S1118 PolarHBondContact O-N 2.85Å; V1114-S1118 PolarHBondContact O-OG 3.13Å; K1115-S1118 WeakPolarHBondContact CA-OG 3.26Å; K1115-S1118 WeakPolarHBondContact O-CB 3.2Å; K1115-S1118 PolarHBondContact O-N 2.86Å; K1115-S1118 VanDerWaalsContact O-N 3.12Å; K1115-S1118 PolarHBondContact O-OG 3.13Å; E1116-S1118 VanDerWaalsContact C-N 3.28Å; E1116-S1118 PolarHBondContact O-N 3.23Å
1119	E	76.6	Confident	81.1	Confident	68 Å²	68	39.1 Å²	39.1	32%	0.318	20%	0.198	S	C	.	.	H	α-helix	trans	-89.7	-17.5	-178.7	-63.8	-173.3	179.3	0	0	113.4	R870 R878 K1115 E1116	R870-E1119 PolarHBondContact NH1-O 3.45Å; R870-E1119 PolarHBondContact NH2-O 3.04Å; R878-E1119 IonicContact NH1-OE1 2.79Å; R878-E1119 IonicContact NH1-OE2 3.3Å; R878-E1119 PolarHBondContact NH1-OE2 3.39Å; R878-E1119 IonicContact NH2-OE1 3.3Å; R878-E1119 PolarHBondContact NH2-OE1 3.37Å; K1115-E1119 VanDerWaalsContact CE-OE1 3.3Å; K1115-E1119 WeakPolarHBondContact CE-OE1 3.45Å; K1115-E1119 PolarHBondContact O-N 3.27Å; E1116-E1119 CarbonylContact O-C 3.58Å; E1116-E1119 PolarHBondContact O-N 2.73Å; E1116-E1119 VanDerWaalsContact O-N 3.11Å
1120	R	81	Confident	81.2	Confident	19 Å²	19	43 Å²	43	7%	0.072	21%	0.211	C	C	.	.	S	Bend	trans	-63.2	151	172.9	-82.6	-171.1	-175.9	-137.1	-0.3	112.6	K823 E1116	K823-R1120 PolarHBondContact NZ-O 2.72Å; E1116-R1120 WeakPolarHBondContact O-CG 3.38Å; E1116-R1120 PolarHBondContact O-N 2.77Å; E1116-R1120 IonicContact OE1-CZ 3.72Å; E1116-R1120 IonicContact OE1-NE 3.18Å; E1116-R1120 PolarHBondContact OE1-NE 3.08Å; E1116-R1120 VanDerWaalsContact OE1-NE 3.13Å; E1116-R1120 IonicContact OE1-NH2 2.87Å; E1116-R1120 PolarHBondContact OE1-NH2 3.2Å
1121	T	82.4	Confident	81.2	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.031	21%	0.208	C	C	.	.			trans	-63.9	157.3	176.5	58.2	0	0	0	0	112.2	H827 L1123 N1128 I1132	H827-T1121 PolarHBondContact NE2-O 3.25Å; T1121-L1123 PolarHBondContact OG1-O 2.74Å; T1121-N1128 WeakPolarHBondContact CB-OD1 3.38Å; T1121-N1128 WeakPolarHBondContact CG2-OD1 3.42Å; T1121-N1128 VanDerWaalsContact OG1-CG 3.24Å; T1121-N1128 PolarHBondContact OG1-OD1 3.27Å; T1121-I1132 HydrophobicContact CG2-CG1 4.38Å
1122	L	77.3	Confident	80.9	Confident	69 Å²	69	41.2 Å²	41.2	36%	0.361	21%	0.209	S	C	.	.	S	Bend	trans	-70.3	-39.9	-175.7	-151.9	96.7	0	0	0	112	L818	L818-L1122 HydrophobicContact CB-CD1 4.27Å; L818-L1122 HydrophobicContact CD1-CD1 3.69Å
1123	L	83.1	Confident	80.9	Confident	68 Å²	68	40.6 Å²	40.6	36%	0.356	21%	0.21	S	C	.	.	S	Bend	trans	-93.6	132.5	-177.9	-69.4	173.7	0	0	0	110.9	T1121 F1127 C1131	T1121-L1123 PolarHBondContact OG1-O 2.74Å; L1123-F1127 HydrophobicContact CB-CB 4.08Å; L1123-F1127 HydrophobicContact CD1-CB 4.2Å; L1123-C1131 VanDerWaalsContact CD1-SG 3.51Å
1124	P	85.3	Confident	81	Confident	4 Å²	4	47 Å²	47	3%	0.026	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-69.8	158.8	174.8	29.7	-33.7	0	0	0	111.6	L826 F830 F1127 N1128	L826-P1124 HydrophobicContact CB-CG 4.45Å; F830-P1124 HydrophobicContact CB-CB 3.78Å; F830-P1124 HydrophobicContact CB-CG 4.04Å; F830-P1124 HydrophobicContact CD1-CB 4.29Å; F830-P1124 HydrophobicContact CD1-CG 3.81Å; F830-P1124 HydrophobicContact CD2-CB 4.1Å; F830-P1124 HydrophobicContact CD2-CG 3.41Å; F830-P1124 VanDerWaalsContact CD2-CG 3.41Å; F830-P1124 HydrophobicContact CE1-CG 4.08Å; F830-P1124 HydrophobicContact CE2-CG 3.69Å; F830-P1124 HydrophobicContact CG-CB 3.8Å; F830-P1124 HydrophobicContact CG-CG 3.46Å; F830-P1124 VanDerWaalsContact CG-CG 3.46Å; F830-P1124 HydrophobicContact CZ-CG 4.01Å; P1124-F1127 PolarHBondContact O-N 3.38Å; P1124-N1128 PolarHBondContact O-N 3.24Å
1125	P	84.3	Confident	80.6	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.019	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	139.9	167.9	-25.2	36	0	0	0	111.1	Y860 Y864	Y860-P1125 WeakPolarHBondContact CD1-O 3.02Å; Y860-P1125 WeakPolarHBondContact CE1-O 3.17Å; Y864-P1125 HydrophobicContact CD1-CB 4.37Å; Y864-P1125 HydrophobicContact CD1-CG 3.89Å; Y864-P1125 HydrophobicContact CE1-CB 4.31Å; Y864-P1125 HydrophobicContact CE1-CG 3.87Å; Y864-P1125 HydrophobicContact CG-CG 4.48Å
1126	P	81.7	Confident	80.5	Confident	19 Å²	19	52 Å²	52	12%	0.123	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	cis	-86.2	-12.7	6.2	34.6	-37.2	0	0	0	114.6	S859 Y860 N1128 T1129	S859-P1126 WeakPolarHBondContact O-CB 3.38Å; Y860-P1126 HydrophobicContact CD2-CG 4.22Å; Y860-P1126 VanDerWaalsContact CE1-CD 3.48Å; Y860-P1126 HydrophobicContact CE2-CG 4.13Å; Y860-P1126 HydrophobicContact CG-CG 4.5Å; Y860-P1126 VanDerWaalsContact CZ-CD 3.45Å; P1126-N1128 PolarHBondContact O-N 3.24Å; P1126-N1128 VanDerWaalsContact O-N 3.08Å; P1126-T1129 PolarHBondContact O-N 3.07Å; P1126-T1129 PolarHBondContact O-OG1 2.87Å; P1126-T1129 VanDerWaalsContact O-OG1 3.09Å
1127	F	84.4	Confident	80.4	Confident	106 Å²	106	56.7 Å²	56.7	47%	0.465	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.6	-174.7	-62	-63.1	0	0	0	114.3	F830 L1123 P1124 T1129 L1130	F830-F1127 HydrophobicContact CE1-CD2 4.11Å; F830-F1127 AromaticContact CE1-CE2 3.97Å; F830-F1127 HydrophobicContact CE1-CE2 3.97Å; L1123-F1127 HydrophobicContact CB-CB 4.08Å; L1123-F1127 HydrophobicContact CD1-CB 4.2Å; P1124-F1127 PolarHBondContact O-N 3.38Å; F1127-T1129 PolarHBondContact O-N 3.15Å; F1127-T1129 VanDerWaalsContact O-N 3.14Å; F1127-L1130 WeakPolarHBondContact O-CB 3.33Å; F1127-L1130 PolarHBondContact O-N 2.87Å
1128	N	83.5	Confident	80	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-49.5	-35.5	172.4	-173.5	25.4	0	0	0	113.4	E867 T1121 P1124 P1126 L1130 C1131 I1132	E867-N1128 WeakPolarHBondContact CB-ND2 3.29Å; E867-N1128 PolarHBondContact OE2-ND2 3.24Å; T1121-N1128 WeakPolarHBondContact CB-OD1 3.38Å; T1121-N1128 WeakPolarHBondContact CG2-OD1 3.42Å; T1121-N1128 VanDerWaalsContact OG1-CG 3.24Å; T1121-N1128 PolarHBondContact OG1-OD1 3.27Å; P1124-N1128 PolarHBondContact O-N 3.24Å; P1126-N1128 PolarHBondContact O-N 3.24Å; P1126-N1128 VanDerWaalsContact O-N 3.08Å; N1128-L1130 PolarHBondContact O-N 3.19Å; N1128-C1131 WeakPolarHBondContact O-CA 3.14Å; N1128-C1131 WeakPolarHBondContact O-CB 3.34Å; N1128-C1131 PolarHBondContact O-N 3.2Å; N1128-I1132 WeakPolarHBondContact O-CG1 3.5Å; N1128-I1132 PolarHBondContact O-N 3.47Å
1129	T	80.1	Confident	79.5	Confident	33 Å²	33	65.1 Å²	65.1	20%	0.202	32%	0.316	C	S	.	.	H	α-helix	trans	-54.7	-40.1	178.4	55.9	0	0	0	0	112.2	F866 P1126 F1127 I1132 I1133	F866-T1129 HydrophobicContact CD2-CG2 3.45Å; F866-T1129 VanDerWaalsContact CD2-CG2 3.45Å; F866-T1129 HydrophobicContact CE2-CG2 3.97Å; F866-T1129 HydrophobicContact CG-CG2 4.45Å; P1126-T1129 PolarHBondContact O-N 3.07Å; P1126-T1129 PolarHBondContact O-OG1 2.87Å; P1126-T1129 VanDerWaalsContact O-OG1 3.09Å; F1127-T1129 PolarHBondContact O-N 3.15Å; F1127-T1129 VanDerWaalsContact O-N 3.14Å; T1129-I1132 PolarHBondContact O-N 2.95Å; T1129-I1133 VanDerWaalsContact O-CB 3.29Å; T1129-I1133 WeakPolarHBondContact O-CB 3.32Å; T1129-I1133 WeakPolarHBondContact O-CD1 3.46Å; T1129-I1133 WeakPolarHBondContact O-CG1 3.16Å; T1129-I1133 PolarHBondContact O-N 3.21Å
1130	L	83	Confident	79.4	Confident	107 Å²	107	68.6 Å²	68.6	56%	0.56	33%	0.331	S	S	*	.	H	α-helix	trans	-66.6	-38.3	176.6	-61	177.5	0	0	0	112.2	F1127 N1128 Y1134	F1127-L1130 WeakPolarHBondContact O-CB 3.33Å; F1127-L1130 PolarHBondContact O-N 2.87Å; N1128-L1130 PolarHBondContact O-N 3.19Å; L1130-Y1134 VanDerWaalsContact O-CB 3.26Å; L1130-Y1134 WeakPolarHBondContact O-CB 3.37Å; L1130-Y1134 PolarHBondContact O-N 3.34Å
1131	C	81.1	Confident	78.9	Confident	25 Å²	25	75.7 Å²	75.7	17%	0.169	36%	0.359	C	S	.	.	H	α-helix	trans	-63.6	-46.9	174.3	-83.4	0	0	0	0	111.5	L1123 N1128 Y1134 E1135	L1123-C1131 VanDerWaalsContact CD1-SG 3.51Å; N1128-C1131 WeakPolarHBondContact O-CA 3.14Å; N1128-C1131 WeakPolarHBondContact O-CB 3.34Å; N1128-C1131 PolarHBondContact O-N 3.2Å; C1131-Y1134 PolarHBondContact O-N 2.96Å; C1131-E1135 WeakPolarHBondContact O-CG 3.38Å; C1131-E1135 PolarHBondContact O-N 2.96Å
1132	I	77.1	Confident	78	Confident	25 Å²	25	78.9 Å²	78.9	13%	0.128	37%	0.374	C	S	.	.	H	α-helix	trans	-64.1	-45.3	-180	-63.4	172.6	0	0	0	110.2	F866 R870 T1121 N1128 T1129 Y1134 E1135 L1136	F866-I1132 HydrophobicContact CB-CD1 4.05Å; R870-I1132 HydrophobicContact CB-CD1 4.38Å; T1121-I1132 HydrophobicContact CG2-CG1 4.38Å; N1128-I1132 WeakPolarHBondContact O-CG1 3.5Å; N1128-I1132 PolarHBondContact O-N 3.47Å; T1129-I1132 PolarHBondContact O-N 2.95Å; I1132-Y1134 VanDerWaalsContact C-N 3.32Å; I1132-Y1134 PolarHBondContact O-N 3.42Å; I1132-E1135 PolarHBondContact O-N 3.16Å; I1132-L1136 HydrophobicContact CG2-CD1 4.12Å; I1132-L1136 HydrophobicContact CG2-CG 4.44Å; I1132-L1136 WeakPolarHBondContact O-CB 3.49Å; I1132-L1136 VanDerWaalsContact O-CG 3.32Å; I1132-L1136 WeakPolarHBondContact O-CG 3.35Å; I1132-L1136 PolarHBondContact O-N 3.42Å
1133	I	79.1	Confident	77.1	Confident	79 Å²	79	77.4 Å²	77.4	41%	0.405	38%	0.376	S	S	.	.	H	α-helix	trans	-59.4	-44.3	175.5	-70.2	167.1	0	0	0	110.2	T1129 L1136 F1137	T1129-I1133 VanDerWaalsContact O-CB 3.29Å; T1129-I1133 WeakPolarHBondContact O-CB 3.32Å; T1129-I1133 WeakPolarHBondContact O-CD1 3.46Å; T1129-I1133 WeakPolarHBondContact O-CG1 3.16Å; T1129-I1133 PolarHBondContact O-N 3.21Å; I1133-L1136 PolarHBondContact O-N 3.16Å; I1133-F1137 HydrophobicContact CG2-CD2 3.44Å; I1133-F1137 VanDerWaalsContact CG2-CD2 3.44Å; I1133-F1137 HydrophobicContact CG2-CE2 3.41Å; I1133-F1137 VanDerWaalsContact CG2-CE2 3.41Å; I1133-F1137 WeakPolarHBondContact O-CB 3.34Å; I1133-F1137 WeakPolarHBondContact O-CD2 3.41Å; I1133-F1137 PolarHBondContact O-N 3.47Å
1134	Y	80	Confident	75.8	Confident	154 Å²	154	77 Å²	77	60%	0.604	38%	0.377	S	S	*	.	H	α-helix	trans	-62.9	-42	175.3	177.2	-97.8	0	0	0	112.8	L1130 C1131 I1132 L1136 F1137 R1138	L1130-Y1134 VanDerWaalsContact O-CB 3.26Å; L1130-Y1134 WeakPolarHBondContact O-CB 3.37Å; L1130-Y1134 PolarHBondContact O-N 3.34Å; C1131-Y1134 PolarHBondContact O-N 2.96Å; I1132-Y1134 VanDerWaalsContact C-N 3.32Å; I1132-Y1134 PolarHBondContact O-N 3.42Å; Y1134-L1136 VanDerWaalsContact C-N 3.34Å; Y1134-F1137 PolarHBondContact O-N 2.78Å; Y1134-R1138 WeakPolarHBondContact O-CB 3.46Å; Y1134-R1138 PolarHBondContact O-N 3.4Å
1135	E	74.1	Confident	74	Confident	94 Å²	94	79 Å²	79	44%	0.439	39%	0.39	S	S	.	.	H	α-helix	trans	-63.4	-40	175.4	-75.7	-174.7	173.2	0	0	111.7	C1131 I1132 R1138 C1139	C1131-E1135 WeakPolarHBondContact O-CG 3.38Å; C1131-E1135 PolarHBondContact O-N 2.96Å; I1132-E1135 PolarHBondContact O-N 3.16Å; E1135-R1138 PolarHBondContact O-N 2.94Å; E1135-C1139 WeakPolarHBondContact O-CB 3.33Å; E1135-C1139 PolarHBondContact O-N 3.45Å; E1135-C1139 PolarHBondContact O-SG 3.49Å
1136	L	76.2	Confident	72.3	Confident	112 Å²	112	85.5 Å²	85.5	59%	0.586	42%	0.421	S	S	*	.	H	α-helix	trans	-66.4	-45.5	174.2	-71.3	173.9	0	0	0	111.6	I1132 I1133 Y1134 R1138 C1139 F1140	I1132-L1136 HydrophobicContact CG2-CD1 4.12Å; I1132-L1136 HydrophobicContact CG2-CG 4.44Å; I1132-L1136 WeakPolarHBondContact O-CB 3.49Å; I1132-L1136 VanDerWaalsContact O-CG 3.32Å; I1132-L1136 WeakPolarHBondContact O-CG 3.35Å; I1132-L1136 PolarHBondContact O-N 3.42Å; I1133-L1136 PolarHBondContact O-N 3.16Å; Y1134-L1136 VanDerWaalsContact C-N 3.34Å; L1136-R1138 VanDerWaalsContact C-N 3.31Å; L1136-R1138 PolarHBondContact O-N 3Å; L1136-C1139 PolarHBondContact O-N 3.09Å; L1136-F1140 VanDerWaalsContact O-CB 3.29Å; L1136-F1140 WeakPolarHBondContact O-CB 3.28Å; L1136-F1140 PolarHBondContact O-N 2.7Å
1137	F	78.1	Confident	70.1	Confident	136 Å²	136	90 Å²	90	60%	0.596	45%	0.452	S	S	*	.	H	α-helix	trans	-62.2	-39.4	174.2	-89.3	-66.6	0	0	0	111.6	I1133 Y1134 F1140 Y1141	I1133-F1137 HydrophobicContact CG2-CD2 3.44Å; I1133-F1137 VanDerWaalsContact CG2-CD2 3.44Å; I1133-F1137 HydrophobicContact CG2-CE2 3.41Å; I1133-F1137 VanDerWaalsContact CG2-CE2 3.41Å; I1133-F1137 WeakPolarHBondContact O-CB 3.34Å; I1133-F1137 WeakPolarHBondContact O-CD2 3.41Å; I1133-F1137 PolarHBondContact O-N 3.47Å; Y1134-F1137 PolarHBondContact O-N 2.78Å; F1137-F1140 PolarHBondContact O-N 3.05Å; F1137-Y1141 WeakPolarHBondContact O-CA 3.38Å; F1137-Y1141 WeakPolarHBondContact O-CB 3.26Å; F1137-Y1141 PolarHBondContact O-N 2.77Å
1138	R	73	Confident	67.8	Low	152 Å²	152	94 Å²	94	57%	0.574	47%	0.469	S	S	*	.	H	α-helix	trans	-66.8	-42.1	175.9	-174.7	178.4	177.8	-165.3	0.7	110.8	Y1134 E1135 L1136 F1140 Y1141 I1142	Y1134-R1138 WeakPolarHBondContact O-CB 3.46Å; Y1134-R1138 PolarHBondContact O-N 3.4Å; E1135-R1138 PolarHBondContact O-N 2.94Å; L1136-R1138 VanDerWaalsContact C-N 3.31Å; L1136-R1138 PolarHBondContact O-N 3Å; R1138-F1140 VanDerWaalsContact C-N 3.35Å; R1138-Y1141 PolarHBondContact O-N 3.13Å; R1138-I1142 HydrophobicContact CG-CD1 3.71Å; R1138-I1142 HydrophobicContact CG-CG1 4.41Å; R1138-I1142 VanDerWaalsContact O-CB 3.29Å; R1138-I1142 WeakPolarHBondContact O-CB 3.39Å; R1138-I1142 WeakPolarHBondContact O-CD1 3.29Å; R1138-I1142 WeakPolarHBondContact O-CG1 3.46Å; R1138-I1142 PolarHBondContact O-N 3.41Å
1139	C	68.3	Low	65.3	Low	89 Å²	89	98.1 Å²	98.1	60%	0.601	50%	0.497	S	S	*	.	H	α-helix	trans	-64.1	-40.4	174	-70.1	0	0	0	0	111.6	E1135 L1136 G1143	E1135-C1139 WeakPolarHBondContact O-CB 3.33Å; E1135-C1139 PolarHBondContact O-N 3.45Å; E1135-C1139 PolarHBondContact O-SG 3.49Å; L1136-C1139 PolarHBondContact O-N 3.09Å; C1139-G1143 PolarHBondContact O-N 2.82Å
1140	F	75	Confident	62.8	Low	142 Å²	142	106 Å²	106	62%	0.623	53%	0.529	S	S	*	.	H	α-helix	trans	-68.9	-42.2	176.4	-174.3	-97	0	0	0	111.8	L1136 F1137 R1138 G1143 T1144	L1136-F1140 VanDerWaalsContact O-CB 3.29Å; L1136-F1140 WeakPolarHBondContact O-CB 3.28Å; L1136-F1140 PolarHBondContact O-N 2.7Å; F1137-F1140 PolarHBondContact O-N 3.05Å; R1138-F1140 VanDerWaalsContact C-N 3.35Å; F1140-G1143 PolarHBondContact O-N 3.03Å; F1140-T1144 HydrophobicContact CD1-CG2 4.04Å; F1140-T1144 HydrophobicContact CD2-CG2 4.4Å; F1140-T1144 HydrophobicContact CE1-CG2 3.66Å; F1140-T1144 HydrophobicContact CE2-CG2 4.04Å; F1140-T1144 HydrophobicContact CG-CG2 4.41Å; F1140-T1144 HydrophobicContact CZ-CG2 3.65Å; F1140-T1144 WeakPolarHBondContact O-CB 3.39Å; F1140-T1144 VanDerWaalsContact O-CG2 3.3Å; F1140-T1144 WeakPolarHBondContact O-CG2 3.44Å; F1140-T1144 PolarHBondContact O-N 3.3Å; F1140-T1144 PolarHBondContact O-OG1 3.41Å
1141	Y	70.3	Confident	60.2	Low	168 Å²	168	107.8 Å²	107.8	66%	0.659	54%	0.539	S	S	*	.	H	α-helix	trans	-67.1	-42.9	177.7	-173.4	-95.9	0	0	0	111.2	F1137 R1138 T1144 S1145	F1137-Y1141 WeakPolarHBondContact O-CA 3.38Å; F1137-Y1141 WeakPolarHBondContact O-CB 3.26Å; F1137-Y1141 PolarHBondContact O-N 2.77Å; R1138-Y1141 PolarHBondContact O-N 3.13Å; Y1141-T1144 WeakPolarHBondContact CA-OG1 3.2Å; Y1141-T1144 PolarHBondContact O-N 3.45Å; Y1141-T1144 PolarHBondContact O-OG1 2.92Å; Y1141-S1145 WeakPolarHBondContact O-CB 3.26Å; Y1141-S1145 PolarHBondContact O-N 3.43Å; Y1141-S1145 PolarHBondContact O-OG 2.84Å
1142	I	63.9	Low	57.6	Low	71 Å²	71	114 Å²	114	36%	0.364	57%	0.569	S	S	.	*	H	α-helix	trans	-66.9	-39.2	173.6	-66.9	166.1	0	0	0	110.5	R1138 S1145 Q1146	R1138-I1142 HydrophobicContact CG-CD1 3.71Å; R1138-I1142 HydrophobicContact CG-CG1 4.41Å; R1138-I1142 VanDerWaalsContact O-CB 3.29Å; R1138-I1142 WeakPolarHBondContact O-CB 3.39Å; R1138-I1142 WeakPolarHBondContact O-CD1 3.29Å; R1138-I1142 WeakPolarHBondContact O-CG1 3.46Å; R1138-I1142 PolarHBondContact O-N 3.41Å; I1142-S1145 PolarHBondContact O-OG 2.81Å; I1142-Q1146 WeakPolarHBondContact O-CB 3.16Å; I1142-Q1146 VanDerWaalsContact O-CG 3.24Å; I1142-Q1146 WeakPolarHBondContact O-CG 3.33Å; I1142-Q1146 PolarHBondContact O-N 3.24Å; I1142-Q1146 VanDerWaalsContact O-N 3.08Å
1143	G	58.5	Low	55	Low	39 Å²	39	119.9 Å²	119.9	40%	0.402	59%	0.593	S	S	.	*	H	α-helix	trans	-66.3	-38.7	176.9	0	0	0	0	0	113.3	C1139 F1140	C1139-G1143 PolarHBondContact O-N 2.82Å; F1140-G1143 PolarHBondContact O-N 3.03Å
1144	T	54.7	Low	52.4	Low	59 Å²	59	125.3 Å²	125.3	36%	0.362	61%	0.614	S	S	.	*	H	α-helix	trans	-81.1	-36.4	178.6	51.2	0	0	0	0	112.3	F1140 Y1141 Q1146 C1147 F1148	F1140-T1144 HydrophobicContact CD1-CG2 4.04Å; F1140-T1144 HydrophobicContact CD2-CG2 4.4Å; F1140-T1144 HydrophobicContact CE1-CG2 3.66Å; F1140-T1144 HydrophobicContact CE2-CG2 4.04Å; F1140-T1144 HydrophobicContact CG-CG2 4.41Å; F1140-T1144 HydrophobicContact CZ-CG2 3.65Å; F1140-T1144 WeakPolarHBondContact O-CB 3.39Å; F1140-T1144 VanDerWaalsContact O-CG2 3.3Å; F1140-T1144 WeakPolarHBondContact O-CG2 3.44Å; F1140-T1144 PolarHBondContact O-N 3.3Å; F1140-T1144 PolarHBondContact O-OG1 3.41Å; Y1141-T1144 WeakPolarHBondContact CA-OG1 3.2Å; Y1141-T1144 PolarHBondContact O-N 3.45Å; Y1141-T1144 PolarHBondContact O-OG1 2.92Å; T1144-Q1146 VanDerWaalsContact C-N 3.29Å; T1144-Q1146 PolarHBondContact O-N 3.34Å; T1144-C1147 WeakPolarHBondContact O-CB 3.48Å; T1144-C1147 PolarHBondContact O-N 3.01Å; T1144-F1148 PolarHBondContact O-N 2.84Å; T1144-F1148 VanDerWaalsContact O-N 3.12Å
1145	S	48.5	Very low	50.1	Low	45 Å²	45	122.3 Å²	122.3	32%	0.315	61%	0.613	S	S	.	*	H	α-helix	trans	-68.2	-29.6	174.9	85.4	0	0	0	0	112.2	Y1141 I1142 C1147 F1148 C1149	Y1141-S1145 WeakPolarHBondContact O-CB 3.26Å; Y1141-S1145 PolarHBondContact O-N 3.43Å; Y1141-S1145 PolarHBondContact O-OG 2.84Å; I1142-S1145 PolarHBondContact O-OG 2.81Å; S1145-C1147 VanDerWaalsContact C-N 3.26Å; S1145-C1147 PolarHBondContact O-N 2.8Å; S1145-F1148 PolarHBondContact O-N 2.87Å; S1145-C1149 PolarHBondContact O-N 3.11Å
1146	Q	47	Very low	47.7	Very low	141 Å²	141	128 Å²	128	66%	0.659	64%	0.637	S	S	*	*	H	α-helix	trans	-68.8	-22.7	170.9	-78.4	180	4.6	0	0	113.2	I1142 T1144	I1142-Q1146 WeakPolarHBondContact O-CB 3.16Å; I1142-Q1146 VanDerWaalsContact O-CG 3.24Å; I1142-Q1146 WeakPolarHBondContact O-CG 3.33Å; I1142-Q1146 PolarHBondContact O-N 3.24Å; I1142-Q1146 VanDerWaalsContact O-N 3.08Å; T1144-Q1146 VanDerWaalsContact C-N 3.29Å; T1144-Q1146 PolarHBondContact O-N 3.34Å
1147	C	37	Very low	45.3	Very low	114 Å²	114	125.8 Å²	125.8	77%	0.77	64%	0.641	S	S	*	*	H	α-helix	trans	-82.8	-31.4	171	-84.2	0	0	0	0	113.1	T1144 S1145	T1144-C1147 WeakPolarHBondContact O-CB 3.48Å; T1144-C1147 PolarHBondContact O-N 3.01Å; S1145-C1147 VanDerWaalsContact C-N 3.26Å; S1145-C1147 PolarHBondContact O-N 2.8Å
1148	F	35.9	Very low	42.6	Very low	189 Å²	189	130.7 Å²	130.7	83%	0.829	66%	0.656	S	S	*	*	H	α-helix	trans	-93.7	-24.9	-173.4	-131.8	-90	0	0	0	115	T1144 S1145	T1144-F1148 PolarHBondContact O-N 2.84Å; T1144-F1148 VanDerWaalsContact O-N 3.12Å; S1145-F1148 PolarHBondContact O-N 2.87Å
1149	C	29.9	Very low	40.4	Very low	87 Å²	87	130.8 Å²	130.8	59%	0.588	67%	0.668	S	S	*	*			trans	-111.8	78.4	-178.3	-64.6	0	0	0	0	111.4	S1145 N1151	S1145-C1149 PolarHBondContact O-N 3.11Å; C1149-N1151 PolarHBondContact O-N 2.96Å
1150	K	28.7	Very low	38.4	Very low	199 Å²	199	135.9 Å²	135.9	87%	0.865	68%	0.68	S	S	*	*			trans	-69.4	9.2	174.2	-129.5	178.9	-171.9	175.9	0	114.6
1151	N	27.3	Very low	36	Very low	144 Å²	144	138.2 Å²	138.2	77%	0.77	69%	0.69	S	S	*	*	S	Bend	trans	-142.3	122.1	171.9	-81.3	-37	0	0	0	109.8	C1149	C1149-N1151 PolarHBondContact O-N 2.96Å
1152	I	26.2	Very low	33.8	Very low	156 Å²	156	137.7 Å²	137.7	80%	0.8	70%	0.697	S	S	*	*	S	Bend	trans	104.9	107.6	175.9	-54.9	161.4	0	0	0	113.7
1153	K	23.7	Very low	31.9	Very low	147 Å²	147	144 Å²	144	64%	0.639	72%	0.723	S	S	*	*			trans	-73.8	138	-172.2	-66.2	170.5	177.2	173	0	112.4
1154	F	24.9	Very low	30.2	Very low	194 Å²	194	150.1 Å²	150.1	85%	0.851	74%	0.738	S	S	*	*			trans	-119.5	144.3	162.2	-90.4	-83.7	0	0	0	111.1
1155	P	30.1	Very low	28.6	Very low	90 Å²	90	154.2 Å²	154.2	58%	0.584	76%	0.763	S	S	*	*			trans	-95.8	125.5	179.1	35	-26.9	0	0	0	111.3
1156	F	24.7	Very low	27.4	Very low	213 Å²	213	160.6 Å²	160.6	93%	0.934	79%	0.788	S	S	*	*			trans	174.8	104.7	131.3	-114.3	-90.3	0	0	0	108.2
1157	G	25	Very low	26.2	Very low	66 Å²	66	159.4 Å²	159.4	68%	0.68	80%	0.796	S	S	*	*			trans	-96.7	130.5	-175	0	0	0	0	0	113.4
1158	R	22.9	Very low	25.4	Very low	239 Å²	239	160.9 Å²	160.9	90%	0.902	80%	0.796	S	S	*	*			trans	-138.2	95	148.9	-88.7	-172.9	175.5	169.7	0.2	106.8
1159	N	26.1	Very low	24.7	Very low	155 Å²	155	158.9 Å²	158.9	83%	0.829	79%	0.794	S	S	*	*			trans	-93.5	128.6	-174.1	-89.1	-10	0	0	0	112.6
1160	K	25.1	Very low	24.4	Very low	195 Å²	195	161.4 Å²	161.4	85%	0.848	80%	0.801	S	S	*	*			trans	-72.7	158.9	160.7	-70.5	175	170.8	179.6	0	111.6
1161	K	24.8	Very low	24.1	Very low	192 Å²	192	159.1 Å²	159.1	84%	0.835	80%	0.798	S	S	*	*			trans	168	96.1	139.9	-92.8	175.8	-175.6	-166.2	0	105.9
1162	L	23.9	Very low	23.7	Very low	156 Å²	156	160.8 Å²	160.8	82%	0.817	80%	0.801	S	S	*	*				44.3	89.3	80	-156.5	80.7	0	0	0	112.4
1163	F	24.9	Very low	23.5	Very low	205 Å²	205	162 Å²	162	90%	0.899	80%	0.803	S	S	*	*			trans	-102.7	113.4	156.5	-101.1	-88.3	0	0	0	106.5
1164	K	22.1	Very low	23.5	Very low	166 Å²	166	163 Å²	163	72%	0.722	81%	0.81	S	S	*	*			trans	-71.8	128	170.8	-97.6	179.7	168	-173.4	0	108.2	E1166	K1164-E1166 PolarHBondContact O-N 3.46Å
1165	T	21.8	Very low	23.2	Very low	146 Å²	146	162.6 Å²	162.6	90%	0.896	81%	0.811	S	S	*	*			trans	-57.4	115	155	7.7	0	0	0	0	108.5
1166	E	23.5	Very low	23	Very low	178 Å²	178	165.6 Å²	165.6	83%	0.832	82%	0.822	S	S	*	*			trans	-110.2	129.4	159.3	-88.6	173.5	-177.7	0	0	107.5	K1164	K1164-E1166 PolarHBondContact O-N 3.46Å
1167	S	21.3	Very low	22.9	Very low	117 Å²	117	164.9 Å²	164.9	82%	0.818	82%	0.822	S	S	*	*			trans	-72.8	151.9	-166.6	41.5	0	0	0	0	112.9
1168	N	21.2	Very low	22.9	Very low	144 Å²	144	167 Å²	167	77%	0.77	83%	0.826	S	S	*	*			trans	-41.5	137.5	158.1	-57.1	-30.2	0	0	0	111.2
1169	D	20.8	Very low	23.4	Very low	148 Å²	148	161.3 Å²	161.3	79%	0.791	82%	0.82	S	S	*	*				-178.7	153.9	122.6	-84.6	-23.6	0	0	0	109.5
1170	D	23.1	Very low	23.6	Very low	139 Å²	139	161.9 Å²	161.9	74%	0.743	82%	0.823	S	S	*	*			trans	96.3	92.9	161.9	-52.8	-30.9	0	0	0	120.4
1171	L	22.6	Very low	23.9	Very low	152 Å²	152	157.5 Å²	157.5	80%	0.796	81%	0.806	S	S	*	*				77.3	109.1	121.3	-65.5	165.5	0	0	0	119.9
1172	E	19.6	Very low	24.4	Very low	178 Å²	178	157 Å²	157	83%	0.832	81%	0.806	S	S	*	*			trans	-7.6	126.8	138.8	-60.9	174.4	163	0	0	116.1
1173	E	22.3	Very low	25	Very low	181 Å²	181	156.3 Å²	156.3	85%	0.846	80%	0.804	S	S	*	*			trans	-166.9	115.2	131.9	-109.2	171.1	-166.5	0	0	112.2
1174	Q	22.3	Very low	25.9	Very low	169 Å²	169	148.4 Å²	148.4	79%	0.79	77%	0.773	S	S	*	*			trans	56.3	104.2	141.6	-74.3	176.4	-14.1	0	0	121.1
1175	E	19.3	Very low	26.7	Very low	185 Å²	185	144.5 Å²	144.5	86%	0.864	76%	0.76	S	S	*	*			trans	-52.5	128.3	146.8	-66.2	169.8	154.6	0	0	111.6
1176	N	25.6	Very low	27.6	Very low	153 Å²	153	143 Å²	143	82%	0.818	75%	0.746	S	S	*	*			trans	-144.5	94.3	153.2	-92.7	-38.6	0	0	0	107.8
1177	E	21.8	Very low	28.6	Very low	199 Å²	199	142.4 Å²	142.4	93%	0.93	74%	0.741	S	S	*	*			trans	-64.6	123.8	171.3	-67.8	-179.7	141.1	0	0	110.1
1178	S	25.7	Very low	29.7	Very low	110 Å²	110	142 Å²	142	77%	0.769	73%	0.725	S	S	*	*			trans	-138.1	128.7	155.1	54.4	0	0	0	0	108.8	D1180	S1178-D1180 PolarHBondContact O-N 3.15Å
1179	P	34.3	Very low	30.8	Very low	120 Å²	120	140.5 Å²	140.5	78%	0.779	71%	0.713	S	S	*	*			trans	-99.7	95.4	-161.8	35.3	-27.1	0	0	0	110.6
1180	D	30.5	Very low	32.1	Very low	167 Å²	167	138.1 Å²	138.1	89%	0.893	70%	0.699	S	S	*	*			trans	-145.9	13.3	165.3	-86.2	-40.9	0	0	0	114	S1178	S1178-D1180 PolarHBondContact O-N 3.15Å
1181	E	31.6	Very low	33.7	Very low	103 Å²	103	135 Å²	135	48%	0.481	69%	0.686	S	S	.	*			trans	-111.3	14.7	-176.8	-90.4	-144.1	121.3	0	0	116	N1183 S1184 N1185 K1188	E1181-N1183 VanDerWaalsContact C-N 3.29Å; E1181-N1183 PolarHBondContact O-N 3.21Å; E1181-S1184 PolarHBondContact O-N 3.43Å; E1181-S1184 PolarHBondContact OE1-OG 2.83Å; E1181-N1185 WeakPolarHBondContact O-CB 3.24Å; E1181-N1185 PolarHBondContact O-N 3.26Å; E1181-K1188 IonicContact OE1-NZ 3.99Å
1182	E	34.9	Very low	35.1	Very low	181 Å²	181	136.7 Å²	136.7	85%	0.846	68%	0.682	S	S	*	*	H	α-helix	trans	-61.9	-32.7	-179.4	-80	-165.4	147.3	0	0	113.5	L1186	E1182-L1186 PolarHBondContact O-N 3.03Å
1183	N	36.9	Very low	36.6	Very low	142 Å²	142	132.9 Å²	132.9	76%	0.759	66%	0.664	S	S	*	*	H	α-helix	trans	-84.2	-22.1	179.8	-112.5	-15.8	0	0	0	114	E1181	E1181-N1183 VanDerWaalsContact C-N 3.29Å; E1181-N1183 PolarHBondContact O-N 3.21Å
1184	S	43.2	Very low	38	Very low	38 Å²	38	128.2 Å²	128.2	27%	0.266	65%	0.645	S	S	.	*	H	α-helix	trans	-77.2	-39.9	173.8	130.6	0	0	0	0	110.2	E1181 K1187 K1188	E1181-S1184 PolarHBondContact O-N 3.43Å; E1181-S1184 PolarHBondContact OE1-OG 2.83Å; S1184-K1187 PolarHBondContact O-N 2.94Å; S1184-K1188 WeakPolarHBondContact O-CB 3.49Å; S1184-K1188 WeakPolarHBondContact O-CG 3.43Å; S1184-K1188 PolarHBondContact O-N 3.39Å; S1184-K1188 PolarHBondContact OG-NZ 3.11Å
1185	N	39.6	Very low	39.7	Very low	84 Å²	84	125.8 Å²	125.8	45%	0.449	63%	0.633	S	S	.	*	H	α-helix	trans	-71.7	-36	-179.7	-78.8	-30.6	0	0	0	113.6	E1181 K1187 K1188 H1189	E1181-N1185 WeakPolarHBondContact O-CB 3.24Å; E1181-N1185 PolarHBondContact O-N 3.26Å; N1185-K1187 VanDerWaalsContact C-N 3.32Å; N1185-K1187 PolarHBondContact O-N 2.96Å; N1185-K1188 PolarHBondContact O-N 3.1Å; N1185-H1189 WeakPolarHBondContact O-CB 3.33Å; N1185-H1189 PolarHBondContact O-N 3.45Å
1186	L	40.7	Very low	41.3	Very low	115 Å²	115	122.4 Å²	122.4	60%	0.602	62%	0.62	S	S	*	*	H	α-helix	trans	-64.4	-39	173.3	-170.5	66.2	0	0	0	111.5	E1182 H1189 L1190	E1182-L1186 PolarHBondContact O-N 3.03Å; L1186-H1189 PolarHBondContact O-N 3.48Å; L1186-L1190 WeakPolarHBondContact O-CB 3.34Å; L1186-L1190 PolarHBondContact O-N 2.83Å
1187	K	44.4	Very low	42.7	Very low	165 Å²	165	119.2 Å²	119.2	72%	0.717	60%	0.603	S	S	*	*	H	α-helix	trans	-70.5	-39.7	178	-137.5	174.3	-172.3	176.3	0	111.8	S1184 N1185 T1191	S1184-K1187 PolarHBondContact O-N 2.94Å; N1185-K1187 VanDerWaalsContact C-N 3.32Å; N1185-K1187 PolarHBondContact O-N 2.96Å; K1187-T1191 WeakPolarHBondContact O-CB 3.27Å; K1187-T1191 PolarHBondContact O-N 3.3Å; K1187-T1191 PolarHBondContact O-OG1 2.86Å
1188	K	44.1	Very low	44.4	Very low	110 Å²	110	116.6 Å²	116.6	48%	0.478	59%	0.588	S	S	.	*	H	α-helix	trans	-66.5	-38.9	172.3	-78.4	173.5	-177.1	161.1	0	112.1	E1181 S1184 N1185 T1191 R1192	E1181-K1188 IonicContact OE1-NZ 3.99Å; S1184-K1188 WeakPolarHBondContact O-CB 3.49Å; S1184-K1188 WeakPolarHBondContact O-CG 3.43Å; S1184-K1188 PolarHBondContact O-N 3.39Å; S1184-K1188 PolarHBondContact OG-NZ 3.11Å; N1185-K1188 PolarHBondContact O-N 3.1Å; K1188-T1191 VanDerWaalsContact CA-OG1 3.29Å; K1188-T1191 WeakPolarHBondContact CA-OG1 3.48Å; K1188-T1191 PolarHBondContact O-N 3.31Å; K1188-T1191 PolarHBondContact O-OG1 3.44Å; K1188-R1192 VanDerWaalsContact O-CB 3.31Å; K1188-R1192 WeakPolarHBondContact O-CB 3.16Å; K1188-R1192 PolarHBondContact O-N 3.43Å
1189	H	43.9	Very low	46	Very low	112 Å²	112	115.8 Å²	115.8	52%	0.519	57%	0.574	S	S	.	*	H	α-helix	trans	-69.4	-43.8	178.2	-163.9	-80.3	0	0	0	111.1	N1185 L1186 T1191 R1192 E1193	N1185-H1189 WeakPolarHBondContact O-CB 3.33Å; N1185-H1189 PolarHBondContact O-N 3.45Å; L1186-H1189 PolarHBondContact O-N 3.48Å; H1189-T1191 VanDerWaalsContact C-N 3.35Å; H1189-T1191 PolarHBondContact O-N 2.93Å; H1189-R1192 PolarHBondContact O-N 2.99Å; H1189-E1193 IonicContact ND1-OE2 3.09Å; H1189-E1193 WeakPolarHBondContact O-CB 3.37Å; H1189-E1193 PolarHBondContact O-N 2.89Å
1190	L	48	Very low	46.7	Very low	97 Å²	97	116.7 Å²	116.7	51%	0.508	57%	0.566	S	S	.	*	H	α-helix	trans	-67.5	-35	176.3	-147.4	84.7	0	0	0	111.8	L1186 N1194	L1186-L1190 WeakPolarHBondContact O-CB 3.34Å; L1186-L1190 PolarHBondContact O-N 2.83Å; L1190-N1194 WeakPolarHBondContact O-CB 3.45Å; L1190-N1194 PolarHBondContact O-N 3.1Å; L1190-N1194 PolarHBondContact O-ND2 3.35Å
1191	T	55.6	Low	47.3	Very low	75 Å²	75	114.5 Å²	114.5	46%	0.46	55%	0.55	S	S	.	*	H	α-helix	trans	-71.7	-38.3	172	35.3	0	0	0	0	112.2	K1187 K1188 H1189 N1194 Q1195	K1187-T1191 WeakPolarHBondContact O-CB 3.27Å; K1187-T1191 PolarHBondContact O-N 3.3Å; K1187-T1191 PolarHBondContact O-OG1 2.86Å; K1188-T1191 VanDerWaalsContact CA-OG1 3.29Å; K1188-T1191 WeakPolarHBondContact CA-OG1 3.48Å; K1188-T1191 PolarHBondContact O-N 3.31Å; K1188-T1191 PolarHBondContact O-OG1 3.44Å; H1189-T1191 VanDerWaalsContact C-N 3.35Å; H1189-T1191 PolarHBondContact O-N 2.93Å; T1191-N1194 PolarHBondContact O-N 3.04Å; T1191-Q1195 VanDerWaalsContact O-CB 3.25Å; T1191-Q1195 WeakPolarHBondContact O-CB 3.29Å; T1191-Q1195 WeakPolarHBondContact O-CG 3.43Å; T1191-Q1195 PolarHBondContact O-N 2.79Å
1192	R	52.5	Low	48.2	Very low	187 Å²	187	114.8 Å²	114.8	71%	0.706	55%	0.552	S	S	*	*	H	α-helix	trans	-62.6	-46	171.9	-98.9	-176.7	170	173.9	-2	111.5	K1188 H1189 Q1195 L1196	K1188-R1192 VanDerWaalsContact O-CB 3.31Å; K1188-R1192 WeakPolarHBondContact O-CB 3.16Å; K1188-R1192 PolarHBondContact O-N 3.43Å; H1189-R1192 PolarHBondContact O-N 2.99Å; R1192-Q1195 CarbonylContact O-C 3.57Å; R1192-Q1195 PolarHBondContact O-N 3.3Å; R1192-L1196 WeakPolarHBondContact O-CB 3.27Å; R1192-L1196 PolarHBondContact O-N 3.05Å
1193	E	50.7	Low	48.5	Very low	98 Å²	98	109.8 Å²	109.8	46%	0.458	53%	0.53	S	S	.	.	H	α-helix	trans	-62.6	-45.8	175.6	-88.4	-170.6	134.4	0	0	111.4	H1189 Q1195 L1196 I1197	H1189-E1193 IonicContact ND1-OE2 3.09Å; H1189-E1193 WeakPolarHBondContact O-CB 3.37Å; H1189-E1193 PolarHBondContact O-N 2.89Å; E1193-Q1195 VanDerWaalsContact C-N 3.3Å; E1193-Q1195 PolarHBondContact O-N 3.06Å; E1193-L1196 CarbonylContact O-C 3.59Å; E1193-L1196 PolarHBondContact O-N 3.27Å; E1193-L1196 VanDerWaalsContact O-N 3.15Å; E1193-I1197 WeakPolarHBondContact O-CB 3.38Å; E1193-I1197 WeakPolarHBondContact O-CG1 3.12Å; E1193-I1197 PolarHBondContact O-N 2.88Å
1194	N	53.4	Low	48.6	Very low	83 Å²	83	107.6 Å²	107.6	44%	0.444	52%	0.519	S	S	.	.	H	α-helix	trans	-64.9	-34.7	177	-76.9	-38.8	0	0	0	112.3	L1190 T1191 K1198	L1190-N1194 WeakPolarHBondContact O-CB 3.45Å; L1190-N1194 PolarHBondContact O-N 3.1Å; L1190-N1194 PolarHBondContact O-ND2 3.35Å; T1191-N1194 PolarHBondContact O-N 3.04Å; N1194-K1198 VanDerWaalsContact O-CB 3.31Å; N1194-K1198 WeakPolarHBondContact O-CB 3.49Å; N1194-K1198 WeakPolarHBondContact O-CG 3.29Å; N1194-K1198 PolarHBondContact O-N 3.27Å
1195	Q	56.6	Low	48.5	Very low	118 Å²	118	114.7 Å²	114.7	55%	0.551	54%	0.54	S	S	*	.	H	α-helix	trans	-69.1	-40.6	171.4	-77.3	177.5	-4.7	0	0	111.3	T1191 R1192 E1193 K1198 I1199	T1191-Q1195 VanDerWaalsContact O-CB 3.25Å; T1191-Q1195 WeakPolarHBondContact O-CB 3.29Å; T1191-Q1195 WeakPolarHBondContact O-CG 3.43Å; T1191-Q1195 PolarHBondContact O-N 2.79Å; R1192-Q1195 CarbonylContact O-C 3.57Å; R1192-Q1195 PolarHBondContact O-N 3.3Å; E1193-Q1195 VanDerWaalsContact C-N 3.3Å; E1193-Q1195 PolarHBondContact O-N 3.06Å; Q1195-K1198 PolarHBondContact O-N 3.39Å; Q1195-I1199 VanDerWaalsContact O-CB 3.28Å; Q1195-I1199 WeakPolarHBondContact O-CB 3.33Å; Q1195-I1199 WeakPolarHBondContact O-CD1 3.4Å; Q1195-I1199 WeakPolarHBondContact O-CG1 3.42Å; Q1195-I1199 PolarHBondContact O-N 2.93Å
1196	L	53.8	Low	48.3	Very low	113 Å²	113	118 Å²	118	59%	0.592	55%	0.546	S	S	*	.	H	α-helix	trans	-66.5	-40.1	177.2	-128.8	133	0	0	0	111.1	R1192 E1193 I1199 K1200	R1192-L1196 WeakPolarHBondContact O-CB 3.27Å; R1192-L1196 PolarHBondContact O-N 3.05Å; E1193-L1196 CarbonylContact O-C 3.59Å; E1193-L1196 PolarHBondContact O-N 3.27Å; E1193-L1196 VanDerWaalsContact O-N 3.15Å; L1196-I1199 PolarHBondContact O-N 3.44Å; L1196-K1200 WeakPolarHBondContact O-CB 3.31Å; L1196-K1200 PolarHBondContact O-N 2.82Å
1197	I	55.6	Low	48.1	Very low	87 Å²	87	116.8 Å²	116.8	45%	0.446	54%	0.539	S	S	.	.	H	α-helix	trans	-64.6	-47.5	173.6	-67.9	164.3	0	0	0	109.6	E1193 I1199 K1200 E1201	E1193-I1197 WeakPolarHBondContact O-CB 3.38Å; E1193-I1197 WeakPolarHBondContact O-CG1 3.12Å; E1193-I1197 PolarHBondContact O-N 2.88Å; I1197-I1199 PolarHBondContact O-N 3.39Å; I1197-K1200 CarbonylContact O-C 3.6Å; I1197-K1200 PolarHBondContact O-N 3.26Å; I1197-E1201 HydrophobicContact CG2-CG 4.45Å; I1197-E1201 WeakPolarHBondContact O-CB 3.46Å; I1197-E1201 WeakPolarHBondContact O-CG 3.44Å; I1197-E1201 PolarHBondContact O-N 2.92Å
1198	K	56.9	Low	47.5	Very low	143 Å²	143	116 Å²	116	62%	0.622	54%	0.536	S	S	*	.	H	α-helix	trans	-61.4	-43.6	175.3	-82.5	-178	177.5	179.6	0	112.3	N1194 Q1195 K1200 E1201 E1202	N1194-K1198 VanDerWaalsContact O-CB 3.31Å; N1194-K1198 WeakPolarHBondContact O-CB 3.49Å; N1194-K1198 WeakPolarHBondContact O-CG 3.29Å; N1194-K1198 PolarHBondContact O-N 3.27Å; Q1195-K1198 PolarHBondContact O-N 3.39Å; K1198-K1200 VanDerWaalsContact C-N 3.3Å; K1198-K1200 PolarHBondContact O-N 3.5Å; K1198-E1201 PolarHBondContact O-N 2.91Å; K1198-E1202 WeakPolarHBondContact O-CB 3.22Å; K1198-E1202 PolarHBondContact O-N 3.4Å
1199	I	59.8	Low	46.9	Very low	93 Å²	93	115.6 Å²	115.6	48%	0.477	54%	0.538	S	S	.	.	H	α-helix	trans	-64.5	-37.5	175.8	-70.6	163.8	0	0	0	110.1	Q1195 L1196 I1197 N1203	Q1195-I1199 VanDerWaalsContact O-CB 3.28Å; Q1195-I1199 WeakPolarHBondContact O-CB 3.33Å; Q1195-I1199 WeakPolarHBondContact O-CD1 3.4Å; Q1195-I1199 WeakPolarHBondContact O-CG1 3.42Å; Q1195-I1199 PolarHBondContact O-N 2.93Å; L1196-I1199 PolarHBondContact O-N 3.44Å; I1197-I1199 PolarHBondContact O-N 3.39Å; I1199-N1203 WeakPolarHBondContact CG2-ND2 3.4Å; I1199-N1203 WeakPolarHBondContact O-CA 3.15Å; I1199-N1203 WeakPolarHBondContact O-CB 3.33Å; I1199-N1203 PolarHBondContact O-N 2.81Å; I1199-N1203 PolarHBondContact O-ND2 3.19Å
1200	K	47.5	Very low	46.3	Very low	139 Å²	139	116.9 Å²	116.9	60%	0.604	55%	0.548	S	S	*	.	H	α-helix	trans	-71.9	-37.1	177.6	-159	175	-166.7	175.5	0	111.6	L1196 I1197 K1198 N1204	L1196-K1200 WeakPolarHBondContact O-CB 3.31Å; L1196-K1200 PolarHBondContact O-N 2.82Å; I1197-K1200 CarbonylContact O-C 3.6Å; I1197-K1200 PolarHBondContact O-N 3.26Å; K1198-K1200 VanDerWaalsContact C-N 3.3Å; K1198-K1200 PolarHBondContact O-N 3.5Å; K1200-N1204 WeakPolarHBondContact O-CB 3.28Å; K1200-N1204 PolarHBondContact O-N 3.28Å; K1200-N1204 PolarHBondContact O-ND2 2.93Å
1201	E	44.1	Very low	45.3	Very low	122 Å²	122	117.2 Å²	117.2	57%	0.57	55%	0.548	S	S	*	.	H	α-helix	trans	-70.3	-40.5	172.6	-77.3	-167.8	153.7	0	0	112.2	I1197 K1198 N1204 R1205	I1197-E1201 HydrophobicContact CG2-CG 4.45Å; I1197-E1201 WeakPolarHBondContact O-CB 3.46Å; I1197-E1201 WeakPolarHBondContact O-CG 3.44Å; I1197-E1201 PolarHBondContact O-N 2.92Å; K1198-E1201 PolarHBondContact O-N 2.91Å; E1201-N1204 CarbonylContact O-C 3.53Å; E1201-N1204 PolarHBondContact O-N 3.39Å; E1201-R1205 WeakPolarHBondContact O-CB 3.09Å; E1201-R1205 PolarHBondContact O-N 2.87Å
1202	E	50.9	Low	44	Very low	109 Å²	109	115.2 Å²	115.2	51%	0.509	54%	0.543	S	S	.	.	H	α-helix	trans	-71.5	-37.6	177	-166.1	171.1	-171.8	0	0	111.1	K1198 R1205 R1206	K1198-E1202 WeakPolarHBondContact O-CB 3.22Å; K1198-E1202 PolarHBondContact O-N 3.4Å; E1202-R1205 PolarHBondContact O-N 3.28Å; E1202-R1206 WeakPolarHBondContact O-CB 3.35Å; E1202-R1206 PolarHBondContact O-N 3.05Å
1203	N	39.4	Very low	42.8	Very low	75 Å²	75	115.1 Å²	115.1	40%	0.401	55%	0.55	S	S	.	*	H	α-helix	trans	-66.5	-38.4	168.8	-76.4	-23.2	0	0	0	111.2	I1199 R1206 I1207	I1199-N1203 WeakPolarHBondContact CG2-ND2 3.4Å; I1199-N1203 WeakPolarHBondContact O-CA 3.15Å; I1199-N1203 WeakPolarHBondContact O-CB 3.33Å; I1199-N1203 PolarHBondContact O-N 2.81Å; I1199-N1203 PolarHBondContact O-ND2 3.19Å; N1203-R1206 PolarHBondContact O-N 3.1Å; N1203-I1207 VanDerWaalsContact O-CB 3.24Å; N1203-I1207 WeakPolarHBondContact O-CB 3.22Å; N1203-I1207 WeakPolarHBondContact O-CD1 3.38Å; N1203-I1207 WeakPolarHBondContact O-CG1 3.49Å; N1203-I1207 PolarHBondContact O-N 3.34Å
1204	N	40.3	Very low	42	Very low	96 Å²	96	113.5 Å²	113.5	51%	0.513	55%	0.55	S	S	.	*	H	α-helix	trans	-66.8	-36.9	173.3	-85.1	-23.9	0	0	0	112	K1200 E1201 K1208	K1200-N1204 WeakPolarHBondContact O-CB 3.28Å; K1200-N1204 PolarHBondContact O-N 3.28Å; K1200-N1204 PolarHBondContact O-ND2 2.93Å; E1201-N1204 CarbonylContact O-C 3.53Å; E1201-N1204 PolarHBondContact O-N 3.39Å; N1204-K1208 WeakPolarHBondContact O-CB 3.48Å; N1204-K1208 WeakPolarHBondContact O-CG 3.46Å; N1204-K1208 PolarHBondContact O-N 3.05Å
1205	R	40	Very low	41.3	Very low	187 Å²	187	116.9 Å²	116.9	71%	0.706	57%	0.568	S	S	*	*	H	α-helix	trans	-68.3	-42.1	172.4	-82.5	-177.9	172.1	174.5	-0.2	111.5	E1201 E1202 K1208 L1209	E1201-R1205 WeakPolarHBondContact O-CB 3.09Å; E1201-R1205 PolarHBondContact O-N 2.87Å; E1202-R1205 PolarHBondContact O-N 3.28Å; R1205-K1208 PolarHBondContact O-N 2.92Å; R1205-L1209 WeakPolarHBondContact O-CB 3.16Å; R1205-L1209 PolarHBondContact O-N 3.47Å
1206	R	36.4	Very low	40.6	Very low	153 Å²	153	116.4 Å²	116.4	58%	0.577	57%	0.569	S	S	*	*	H	α-helix	trans	-65.5	-40	174.3	-89.5	179.6	172.3	165.6	1.1	112	E1202 N1203 L1209 L1210	E1202-R1206 WeakPolarHBondContact O-CB 3.35Å; E1202-R1206 PolarHBondContact O-N 3.05Å; N1203-R1206 PolarHBondContact O-N 3.1Å; R1206-L1209 PolarHBondContact O-N 3.29Å; R1206-L1210 VanDerWaalsContact O-CB 3.23Å; R1206-L1210 WeakPolarHBondContact O-CB 2.99Å; R1206-L1210 WeakPolarHBondContact O-CD1 3.23Å; R1206-L1210 VanDerWaalsContact O-CG 3.31Å; R1206-L1210 WeakPolarHBondContact O-CG 3.41Å; R1206-L1210 PolarHBondContact O-N 2.88Å
1207	I	35.6	Very low	40.2	Very low	90 Å²	90	117.7 Å²	117.7	46%	0.462	57%	0.566	S	S	.	*	H	α-helix	trans	-66.4	-42.1	173.9	-70.2	165.3	0	0	0	109.7	N1203 L1209 L1210 M1211	N1203-I1207 VanDerWaalsContact O-CB 3.24Å; N1203-I1207 WeakPolarHBondContact O-CB 3.22Å; N1203-I1207 WeakPolarHBondContact O-CD1 3.38Å; N1203-I1207 WeakPolarHBondContact O-CG1 3.49Å; N1203-I1207 PolarHBondContact O-N 3.34Å; I1207-L1209 VanDerWaalsContact C-N 3.34Å; I1207-L1209 PolarHBondContact O-N 3.13Å; I1207-L1210 PolarHBondContact O-N 3.46Å; I1207-M1211 HydrophobicContact CG2-CG 4.03Å; I1207-M1211 WeakPolarHBondContact O-CB 3.4Å; I1207-M1211 WeakPolarHBondContact O-CG 3.44Å; I1207-M1211 PolarHBondContact O-N 2.92Å
1208	K	32.5	Very low	40	Very low	148 Å²	148	115.7 Å²	115.7	64%	0.643	57%	0.568	S	S	*	*	H	α-helix	trans	-61.5	-40.4	172.5	-85.3	-175.9	173.9	-175.6	0	112.3	N1204 R1205 M1211	N1204-K1208 WeakPolarHBondContact O-CB 3.48Å; N1204-K1208 WeakPolarHBondContact O-CG 3.46Å; N1204-K1208 PolarHBondContact O-N 3.05Å; R1205-K1208 PolarHBondContact O-N 2.92Å; K1208-M1211 PolarHBondContact O-N 2.79Å
1209	L	32.2	Very low	39.8	Very low	103 Å²	103	115.6 Å²	115.6	54%	0.539	57%	0.567	S	S	.	*	H	α-helix	trans	-71.1	-35.6	177.1	-87.6	163.2	0	0	0	113.5	R1205 R1206 I1207 M1211	R1205-L1209 WeakPolarHBondContact O-CB 3.16Å; R1205-L1209 PolarHBondContact O-N 3.47Å; R1206-L1209 PolarHBondContact O-N 3.29Å; I1207-L1209 VanDerWaalsContact C-N 3.34Å; I1207-L1209 PolarHBondContact O-N 3.13Å; L1209-M1211 VanDerWaalsContact C-N 3.34Å
1210	L	30.9	Very low	39.5	Very low	138 Å²	138	115.1 Å²	115.1	72%	0.723	57%	0.565	S	S	*	*	H	α-helix	trans	-73.5	-25.7	174.5	-81.5	160.5	0	0	0	112.1	R1206 I1207 G1212	R1206-L1210 VanDerWaalsContact O-CB 3.23Å; R1206-L1210 WeakPolarHBondContact O-CB 2.99Å; R1206-L1210 WeakPolarHBondContact O-CD1 3.23Å; R1206-L1210 VanDerWaalsContact O-CG 3.31Å; R1206-L1210 WeakPolarHBondContact O-CG 3.41Å; R1206-L1210 PolarHBondContact O-N 2.88Å; I1207-L1210 PolarHBondContact O-N 3.46Å; L1210-G1212 VanDerWaalsContact C-N 3.34Å; L1210-G1212 PolarHBondContact O-N 3.46Å
1211	M	27.3	Very low	40.1	Very low	104 Å²	104	112.6 Å²	112.6	51%	0.512	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.4	15.2	-175.2	-74.8	-93.1	-86.4	0	0	114.7	I1207 K1208 L1209 R1217	I1207-M1211 HydrophobicContact CG2-CG 4.03Å; I1207-M1211 WeakPolarHBondContact O-CB 3.4Å; I1207-M1211 WeakPolarHBondContact O-CG 3.44Å; I1207-M1211 PolarHBondContact O-N 2.92Å; K1208-M1211 PolarHBondContact O-N 2.79Å; L1209-M1211 VanDerWaalsContact C-N 3.34Å; M1211-R1217 PolarHBondContact O-NH2 3.49Å; M1211-R1217 VanDerWaalsContact O-NH2 3.16Å
1212	G	28.2	Very low	41	Very low	34 Å²	34	114.4 Å²	114.4	35%	0.351	56%	0.559	S	S	.	*			trans	42.3	88.8	166.2	0	0	0	0	0	114.5	L1210 S1214	L1210-G1212 VanDerWaalsContact C-N 3.34Å; L1210-G1212 PolarHBondContact O-N 3.46Å; G1212-S1214 VanDerWaalsContact C-N 3.31Å; G1212-S1214 PolarHBondContact O-N 3.34Å
1213	E	26.8	Very low	41.7	Very low	184 Å²	184	115.2 Å²	115.2	86%	0.86	56%	0.562	S	S	*	*			trans	-65.8	90.7	165.2	-78.8	174.7	160.9	0	0	109.3
1214	S	32.7	Very low	43	Very low	65 Å²	65	111.9 Å²	111.9	46%	0.455	54%	0.544	S	S	.	.			trans	-120.6	141.6	159.2	62.3	0	0	0	0	109.1	G1212 D1216	G1212-S1214 VanDerWaalsContact C-N 3.31Å; G1212-S1214 PolarHBondContact O-N 3.34Å; S1214-D1216 PolarHBondContact O-N 2.98Å
1215	D	40.4	Very low	44.2	Very low	154 Å²	154	108.5 Å²	108.5	82%	0.824	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-5.1	-167.2	-80.6	-42.9	0	0	0	117.4	R1217 G1218	D1215-R1217 VanDerWaalsContact C-N 3.29Å; D1215-R1217 PolarHBondContact O-N 3.28Å; D1215-G1218 PolarHBondContact O-N 3.24Å
1216	D	42.1	Very low	45.5	Very low	107 Å²	107	103 Å²	103	57%	0.572	51%	0.511	S	S	*	.	H	α-helix	trans	-68.2	-24.7	-177.6	-68.1	-35.7	0	0	0	113.5	S1214 G1218 K1219 L1220	S1214-D1216 PolarHBondContact O-N 2.98Å; D1216-G1218 VanDerWaalsContact C-N 3.3Å; D1216-G1218 PolarHBondContact O-N 3.44Å; D1216-K1219 PolarHBondContact O-N 3.27Å; D1216-L1220 PolarHBondContact O-N 2.81Å
1217	R	44.7	Very low	47	Very low	140 Å²	140	96 Å²	96	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-63.8	-33.8	177.3	-78.1	-169.8	-173	-176.6	6.7	113.2	M1211 D1215 Y1221	M1211-R1217 PolarHBondContact O-NH2 3.49Å; M1211-R1217 VanDerWaalsContact O-NH2 3.16Å; D1215-R1217 VanDerWaalsContact C-N 3.29Å; D1215-R1217 PolarHBondContact O-N 3.28Å; R1217-Y1221 VanDerWaalsContact O-CB 3.3Å; R1217-Y1221 WeakPolarHBondContact O-CB 3.41Å; R1217-Y1221 PolarHBondContact O-N 2.95Å; R1217-Y1221 VanDerWaalsContact O-N 3.14Å
1218	G	50.8	Low	48.6	Very low	46 Å²	46	91.7 Å²	91.7	47%	0.474	46%	0.463	S	S	.	.	H	α-helix	trans	-68.1	-39.1	-179.1	0	0	0	0	0	112	D1215 D1216 K1222	D1215-G1218 PolarHBondContact O-N 3.24Å; D1216-G1218 VanDerWaalsContact C-N 3.3Å; D1216-G1218 PolarHBondContact O-N 3.44Å; G1218-K1222 WeakPolarHBondContact O-CB 3.33Å; G1218-K1222 PolarHBondContact O-N 3.42Å
1219	K	52.9	Low	50.3	Low	141 Å²	141	88.4 Å²	88.4	61%	0.613	45%	0.452	S	S	*	.	H	α-helix	trans	-65.7	-48.9	177.7	-69.9	178.2	-177	168	0	111.9	D1216 Y1221 K1222 Q1223	D1216-K1219 PolarHBondContact O-N 3.27Å; K1219-Y1221 VanDerWaalsContact C-N 3.33Å; K1219-Y1221 PolarHBondContact O-N 3Å; K1219-K1222 PolarHBondContact O-N 3.24Å; K1219-Q1223 WeakPolarHBondContact O-CG 3.45Å; K1219-Q1223 PolarHBondContact O-N 2.84Å
1220	L	54.6	Low	52.1	Low	83 Å²	83	87.7 Å²	87.7	44%	0.435	45%	0.445	S	S	.	.	H	α-helix	trans	-64.1	-39.8	-179.5	-164.4	75.7	0	0	0	111.7	D1216 Q1223 E1224	D1216-L1220 PolarHBondContact O-N 2.81Å; L1220-Q1223 PolarHBondContact O-N 3.45Å; L1220-E1224 WeakPolarHBondContact O-CB 3.33Å; L1220-E1224 PolarHBondContact O-N 3.43Å
1221	Y	60.3	Low	54.2	Low	86 Å²	86	81.2 Å²	81.2	34%	0.337	41%	0.411	S	S	.	.	H	α-helix	trans	-63.8	-43.2	175.8	175.8	-113.9	0	0	0	112.2	L538 S539 R1217 K1219 Q1223 E1224 I1225	L538-Y1221 HydrophobicContact CD1-CD2 4.31Å; L538-Y1221 HydrophobicContact CD1-CE2 3.79Å; S539-Y1221 PolarHBondContact O-OH 2.98Å; R1217-Y1221 VanDerWaalsContact O-CB 3.3Å; R1217-Y1221 WeakPolarHBondContact O-CB 3.41Å; R1217-Y1221 PolarHBondContact O-N 2.95Å; R1217-Y1221 VanDerWaalsContact O-N 3.14Å; K1219-Y1221 VanDerWaalsContact C-N 3.33Å; K1219-Y1221 PolarHBondContact O-N 3Å; Y1221-Q1223 VanDerWaalsContact C-N 3.33Å; Y1221-Q1223 PolarHBondContact O-N 3.34Å; Y1221-E1224 PolarHBondContact O-N 3.17Å; Y1221-I1225 HydrophobicContact CD1-CD1 3.81Å; Y1221-I1225 HydrophobicContact CD2-CD1 3.91Å; Y1221-I1225 HydrophobicContact CD2-CG1 4.47Å; Y1221-I1225 HydrophobicContact CE1-CD1 3.36Å; Y1221-I1225 HydrophobicContact CE2-CD1 3.47Å; Y1221-I1225 VanDerWaalsContact CE2-CD1 3.47Å; Y1221-I1225 HydrophobicContact CE2-CG1 4.19Å; Y1221-I1225 HydrophobicContact CG-CD1 4.09Å; Y1221-I1225 WeakPolarHBondContact O-CG1 3.41Å; Y1221-I1225 PolarHBondContact O-N 2.97Å
1222	K	62.6	Low	56.2	Low	160 Å²	160	77 Å²	77	70%	0.696	39%	0.39	S	S	*	.	H	α-helix	trans	-63.8	-38.6	176.1	-171.1	175.1	-178.4	176.9	0	111.9	G1218 K1219 D1226	G1218-K1222 WeakPolarHBondContact O-CB 3.33Å; G1218-K1222 PolarHBondContact O-N 3.42Å; K1219-K1222 PolarHBondContact O-N 3.24Å; K1222-D1226 VanDerWaalsContact O-CB 3.27Å; K1222-D1226 WeakPolarHBondContact O-CB 3.32Å; K1222-D1226 PolarHBondContact O-N 3.46Å
1223	Q	65.8	Low	58.1	Low	125 Å²	125	80.4 Å²	80.4	58%	0.584	40%	0.4	S	S	*	.	H	α-helix	trans	-67.2	-43.4	176.3	-73.6	173.2	-13.8	0	0	112.5	K1219 L1220 Y1221 D1226 A1227	K1219-Q1223 WeakPolarHBondContact O-CG 3.45Å; K1219-Q1223 PolarHBondContact O-N 2.84Å; L1220-Q1223 PolarHBondContact O-N 3.45Å; Y1221-Q1223 VanDerWaalsContact C-N 3.33Å; Y1221-Q1223 PolarHBondContact O-N 3.34Å; Q1223-D1226 PolarHBondContact O-N 3.43Å; Q1223-A1227 VanDerWaalsContact O-CB 3.28Å; Q1223-A1227 WeakPolarHBondContact O-CB 3.42Å; Q1223-A1227 PolarHBondContact O-N 2.87Å
1224	E	65.4	Low	60.2	Low	5 Å²	5	73.1 Å²	73.1	2%	0.023	37%	0.366	C	S	.	.	H	α-helix	trans	-58.7	-48.9	175.6	-175.7	-178.3	-176.5	0	0	110.5	R644 L1220 Y1221 A1227 V1228	R644-E1224 WeakPolarHBondContact CD-OE2 3.49Å; R644-E1224 WeakPolarHBondContact CG-OE2 3.44Å; R644-E1224 PolarHBondContact N-OE1 3.29Å; R644-E1224 IonicContact NE-OE2 3.83Å; L1220-E1224 WeakPolarHBondContact O-CB 3.33Å; L1220-E1224 PolarHBondContact O-N 3.43Å; Y1221-E1224 PolarHBondContact O-N 3.17Å; E1224-A1227 PolarHBondContact O-N 2.77Å; E1224-V1228 WeakPolarHBondContact O-CB 3.39Å; E1224-V1228 WeakPolarHBondContact O-CG2 3.39Å; E1224-V1228 PolarHBondContact O-N 3.48Å
1225	I	65.8	Low	62.1	Low	25 Å²	25	70 Å²	70	13%	0.128	34%	0.344	C	S	.	.	H	α-helix	trans	-61.7	-48.4	178.2	-72.2	164.9	0	0	0	111.7	L538 T540 I545 Y1221 A1227 V1228 L1229	L538-I1225 HydrophobicContact CD1-CG1 4.14Å; L538-I1225 HydrophobicContact CD2-CG1 4.33Å; L538-I1225 HydrophobicContact CG-CG1 4.44Å; T540-I1225 HydrophobicContact CG2-CB 4.42Å; T540-I1225 HydrophobicContact CG2-CD1 3.51Å; T540-I1225 HydrophobicContact CG2-CG1 3.91Å; T540-I1225 HydrophobicContact CG2-CG2 3.62Å; I545-I1225 HydrophobicContact CD1-CG2 4.31Å; Y1221-I1225 HydrophobicContact CD1-CD1 3.81Å; Y1221-I1225 HydrophobicContact CD2-CD1 3.91Å; Y1221-I1225 HydrophobicContact CD2-CG1 4.47Å; Y1221-I1225 HydrophobicContact CE1-CD1 3.36Å; Y1221-I1225 HydrophobicContact CE2-CD1 3.47Å; Y1221-I1225 VanDerWaalsContact CE2-CD1 3.47Å; Y1221-I1225 HydrophobicContact CE2-CG1 4.19Å; Y1221-I1225 HydrophobicContact CG-CD1 4.09Å; Y1221-I1225 WeakPolarHBondContact O-CG1 3.41Å; Y1221-I1225 PolarHBondContact O-N 2.97Å; I1225-A1227 VanDerWaalsContact C-N 3.33Å; I1225-A1227 PolarHBondContact O-N 3.2Å; I1225-V1228 PolarHBondContact O-N 3.13Å; I1225-L1229 WeakPolarHBondContact O-CB 3.46Å; I1225-L1229 PolarHBondContact O-N 3.23Å
1226	D	67.6	Low	63.4	Low	73 Å²	73	64.4 Å²	64.4	39%	0.39	32%	0.318	S	S	.	.	H	α-helix	trans	-64.2	-39.9	-176.7	-174.2	42.2	0	0	0	111.4	K1222 Q1223 K1230	K1222-D1226 VanDerWaalsContact O-CB 3.27Å; K1222-D1226 WeakPolarHBondContact O-CB 3.32Å; K1222-D1226 PolarHBondContact O-N 3.46Å; Q1223-D1226 PolarHBondContact O-N 3.43Å; D1226-K1230 VanDerWaalsContact CG-NZ 3.27Å; D1226-K1230 WeakPolarHBondContact O-CB 3.2Å; D1226-K1230 WeakPolarHBondContact O-CD 3.25Å; D1226-K1230 VanDerWaalsContact O-CG 3.25Å; D1226-K1230 WeakPolarHBondContact O-CG 3.3Å; D1226-K1230 PolarHBondContact O-N 2.98Å; D1226-K1230 WeakPolarHBondContact OD1-CE 3.27Å; D1226-K1230 IonicContact OD1-NZ 3.63Å; D1226-K1230 PolarHBondContact OD1-NZ 3.16Å; D1226-K1230 VanDerWaalsContact OD1-NZ 3.14Å; D1226-K1230 IonicContact OD2-NZ 2.8Å; D1226-K1230 PolarHBondContact OD2-NZ 3.42Å
1227	A	68.7	Low	64.5	Low	4 Å²	4	65.3 Å²	65.3	3%	0.033	32%	0.317	C	S	.	.	H	α-helix	trans	-63.3	-50.3	175.4	0	0	0	0	0	112	S637 A641 Q1223 E1224 I1225 F1231	S637-A1227 WeakPolarHBondContact OG-CB 3.5Å; A641-A1227 HydrophobicContact CB-CB 4.25Å; Q1223-A1227 VanDerWaalsContact O-CB 3.28Å; Q1223-A1227 WeakPolarHBondContact O-CB 3.42Å; Q1223-A1227 PolarHBondContact O-N 2.87Å; E1224-A1227 PolarHBondContact O-N 2.77Å; I1225-A1227 VanDerWaalsContact C-N 3.33Å; I1225-A1227 PolarHBondContact O-N 3.2Å; A1227-F1231 WeakPolarHBondContact O-CB 3.29Å; A1227-F1231 PolarHBondContact O-N 3.15Å
1228	V	68.6	Low	65.5	Low	1 Å²	1	58.9 Å²	58.9	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-43.8	-178.8	171.7	0	0	0	0	110.5	I545 L546 M638 L643 E1224 I1225 F1231 I1232	I545-V1228 HydrophobicContact CG2-CG1 3.73Å; L546-V1228 HydrophobicContact CD1-CG1 3.9Å; L546-V1228 HydrophobicContact CD1-CG2 4.34Å; L546-V1228 HydrophobicContact CG-CG1 4.48Å; M638-V1228 HydrophobicContact CE-CG2 4.43Å; M638-V1228 HydrophobicContact SD-CB 4.46Å; M638-V1228 HydrophobicContact SD-CG2 3.88Å; L643-V1228 HydrophobicContact CD2-CG2 3.98Å; E1224-V1228 WeakPolarHBondContact O-CB 3.39Å; E1224-V1228 WeakPolarHBondContact O-CG2 3.39Å; E1224-V1228 PolarHBondContact O-N 3.48Å; I1225-V1228 PolarHBondContact O-N 3.13Å; V1228-F1231 PolarHBondContact O-N 3.45Å; V1228-I1232 HydrophobicContact CG1-CD1 3.56Å; V1228-I1232 HydrophobicContact CG1-CG1 4.26Å; V1228-I1232 WeakPolarHBondContact O-CB 3.29Å; V1228-I1232 WeakPolarHBondContact O-CG1 3.3Å; V1228-I1232 PolarHBondContact O-N 2.98Å
1229	L	68	Low	66.3	Low	78 Å²	78	56.9 Å²	56.9	41%	0.408	27%	0.272	S	S	.	.	H	α-helix	trans	-65.2	-44.8	-179.2	-174.6	65.5	0	0	0	112.1	I1225 F1231 I1232 L1233	I1225-L1229 WeakPolarHBondContact O-CB 3.46Å; I1225-L1229 PolarHBondContact O-N 3.23Å; L1229-F1231 VanDerWaalsContact C-N 3.32Å; L1229-F1231 PolarHBondContact O-N 3.49Å; L1229-I1232 PolarHBondContact O-N 3.49Å; L1229-L1233 HydrophobicContact CG-CD1 4.37Å; L1229-L1233 WeakPolarHBondContact O-CG 3.39Å; L1229-L1233 PolarHBondContact O-N 2.86Å
1230	K	70.5	Confident	66.7	Low	89 Å²	89	56.7 Å²	56.7	39%	0.387	27%	0.273	S	S	.	.	H	α-helix	trans	-61.3	-41.7	175.5	-76	170.3	176.3	161.8	0	111.8	I634 D1226 L1233 I1234	I634-K1230 HydrophobicContact CD1-CB 4.42Å; I634-K1230 HydrophobicContact CG1-CB 4.38Å; I634-K1230 HydrophobicContact CG2-CB 3.89Å; D1226-K1230 VanDerWaalsContact CG-NZ 3.27Å; D1226-K1230 WeakPolarHBondContact O-CB 3.2Å; D1226-K1230 WeakPolarHBondContact O-CD 3.25Å; D1226-K1230 VanDerWaalsContact O-CG 3.25Å; D1226-K1230 WeakPolarHBondContact O-CG 3.3Å; D1226-K1230 PolarHBondContact O-N 2.98Å; D1226-K1230 WeakPolarHBondContact OD1-CE 3.27Å; D1226-K1230 IonicContact OD1-NZ 3.63Å; D1226-K1230 PolarHBondContact OD1-NZ 3.16Å; D1226-K1230 VanDerWaalsContact OD1-NZ 3.14Å; D1226-K1230 IonicContact OD2-NZ 2.8Å; D1226-K1230 PolarHBondContact OD2-NZ 3.42Å; K1230-L1233 PolarHBondContact O-N 2.99Å; K1230-I1234 WeakPolarHBondContact O-CG1 3.1Å; K1230-I1234 PolarHBondContact O-N 3.39Å; K1230-I1234 VanDerWaalsContact O-N 3.14Å
1231	F	74.2	Confident	66.8	Low	2 Å²	2	60.3 Å²	60.3	1%	0.009	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-45.8	176.7	-179.8	-95.9	0	0	0	111.7	L578 V623 I634 M638 A1227 V1228 L1229 L1233 I1234 Q1235	L578-F1231 HydrophobicContact CB-CE1 4.49Å; L578-F1231 HydrophobicContact CB-CZ 4.42Å; L578-F1231 HydrophobicContact CD2-CE1 4.32Å; L578-F1231 HydrophobicContact CD2-CE2 4.39Å; L578-F1231 HydrophobicContact CD2-CZ 3.64Å; V623-F1231 HydrophobicContact CB-CE2 4.45Å; V623-F1231 HydrophobicContact CG1-CD2 4.11Å; V623-F1231 HydrophobicContact CG1-CE2 3.74Å; V623-F1231 HydrophobicContact CG1-CZ 4.49Å; I634-F1231 HydrophobicContact CG2-CB 4.31Å; M638-F1231 HydrophobicContact CB-CB 3.9Å; M638-F1231 HydrophobicContact CB-CD2 3.61Å; M638-F1231 HydrophobicContact CB-CE2 4.27Å; M638-F1231 HydrophobicContact CB-CG 3.77Å; M638-F1231 HydrophobicContact CE-CD1 3.95Å; M638-F1231 HydrophobicContact CE-CE1 4.24Å; M638-F1231 HydrophobicContact CG-CB 3.95Å; M638-F1231 HydrophobicContact CG-CD1 3.78Å; M638-F1231 HydrophobicContact CG-CD2 3.63Å; M638-F1231 HydrophobicContact CG-CE1 4.16Å; M638-F1231 HydrophobicContact CG-CE2 4.03Å; M638-F1231 HydrophobicContact CG-CG 3.5Å; M638-F1231 VanDerWaalsContact CG-CG 3.5Å; M638-F1231 HydrophobicContact CG-CZ 4.29Å; M638-F1231 HydrophobicContact SD-CB 4.09Å; M638-F1231 HydrophobicContact SD-CD1 4.06Å; M638-F1231 HydrophobicContact SD-CG 4.06Å; A1227-F1231 WeakPolarHBondContact O-CB 3.29Å; A1227-F1231 PolarHBondContact O-N 3.15Å; V1228-F1231 PolarHBondContact O-N 3.45Å; L1229-F1231 VanDerWaalsContact C-N 3.32Å; L1229-F1231 PolarHBondContact O-N 3.49Å; F1231-L1233 VanDerWaalsContact C-N 3.3Å; F1231-L1233 PolarHBondContact O-N 2.87Å; F1231-I1234 PolarHBondContact O-N 3.48Å; F1231-Q1235 HydrophobicContact CE1-CB 4.43Å; F1231-Q1235 WeakPolarHBondContact O-CB 3.33Å; F1231-Q1235 PolarHBondContact O-N 3.44Å
1232	I	70	Confident	66.6	Low	14 Å²	14	56.8 Å²	56.8	7%	0.072	28%	0.281	C	S	.	.	H	α-helix	trans	-57.7	-43.9	176.8	-73.3	168.1	0	0	0	111.1	I545 F575 V1228 L1229 I1234 Q1235 S1236	I545-I1232 HydrophobicContact CG2-CD1 3.41Å; I545-I1232 VanDerWaalsContact CG2-CD1 3.41Å; F575-I1232 HydrophobicContact CB-CD1 4.18Å; F575-I1232 HydrophobicContact CB-CG1 4.29Å; F575-I1232 HydrophobicContact CB-CG2 4.05Å; F575-I1232 HydrophobicContact CD1-CG2 3.44Å; F575-I1232 VanDerWaalsContact CD1-CG2 3.44Å; F575-I1232 HydrophobicContact CE1-CG2 4.32Å; F575-I1232 HydrophobicContact CG-CG2 4.11Å; F575-I1232 WeakPolarHBondContact O-CG1 3.11Å; V1228-I1232 HydrophobicContact CG1-CD1 3.56Å; V1228-I1232 HydrophobicContact CG1-CG1 4.26Å; V1228-I1232 WeakPolarHBondContact O-CB 3.29Å; V1228-I1232 WeakPolarHBondContact O-CG1 3.3Å; V1228-I1232 PolarHBondContact O-N 2.98Å; L1229-I1232 PolarHBondContact O-N 3.49Å; I1232-I1234 PolarHBondContact O-N 3.48Å; I1232-Q1235 PolarHBondContact O-N 3Å; I1232-S1236 WeakPolarHBondContact O-CB 3.44Å; I1232-S1236 PolarHBondContact O-N 3.48Å; I1232-S1236 PolarHBondContact O-OG 3.27Å
1233	L	67.1	Low	66.4	Low	107 Å²	107	52.8 Å²	52.8	56%	0.56	26%	0.261	S	S	*	.	H	α-helix	trans	-62.2	-40.6	177.7	-74.4	167.3	0	0	0	112.5	L1229 K1230 F1231 S1236 F1237	L1229-L1233 HydrophobicContact CG-CD1 4.37Å; L1229-L1233 WeakPolarHBondContact O-CG 3.39Å; L1229-L1233 PolarHBondContact O-N 2.86Å; K1230-L1233 PolarHBondContact O-N 2.99Å; F1231-L1233 VanDerWaalsContact C-N 3.3Å; F1231-L1233 PolarHBondContact O-N 2.87Å; L1233-S1236 PolarHBondContact O-OG 3.33Å; L1233-F1237 WeakPolarHBondContact O-CB 3.4Å; L1233-F1237 PolarHBondContact O-N 3.3Å
1234	I	71	Confident	65.9	Low	30 Å²	30	53.9 Å²	53.9	15%	0.154	27%	0.266	C	S	.	.	H	α-helix	trans	-72.6	-39.8	176.5	-64.6	-173.6	0	0	0	110.9	V623 K626 D627 I634 K1230 F1231 I1232 F1237 A1238	V623-I1234 HydrophobicContact CG1-CB 4.39Å; V623-I1234 HydrophobicContact CG1-CG2 3.73Å; K626-I1234 HydrophobicContact CB-CG2 4.4Å; D627-I1234 HydrophobicContact CB-CD1 4.45Å; I634-I1234 HydrophobicContact CB-CD1 4.03Å; I634-I1234 HydrophobicContact CD1-CD1 3.32Å; I634-I1234 HydrophobicContact CD1-CG1 4.41Å; I634-I1234 HydrophobicContact CG1-CD1 4.26Å; I634-I1234 HydrophobicContact CG2-CD1 3.88Å; K1230-I1234 WeakPolarHBondContact O-CG1 3.1Å; K1230-I1234 PolarHBondContact O-N 3.39Å; K1230-I1234 VanDerWaalsContact O-N 3.14Å; F1231-I1234 PolarHBondContact O-N 3.48Å; I1232-I1234 PolarHBondContact O-N 3.48Å; I1234-F1237 CarbonylContact O-C 3.56Å; I1234-F1237 PolarHBondContact O-N 3.09Å; I1234-A1238 WeakPolarHBondContact O-CB 3.32Å; I1234-A1238 PolarHBondContact O-N 2.64Å
1235	Q	73.1	Confident	65.4	Low	0 Å²	0	57 Å²	57	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-45.6	178.4	-176.7	-174.7	-38.5	0	0	111.6	V577 V619 V623 F1231 I1232 F1237 A1238 L1239	V577-Q1235 VanDerWaalsContact CG2-NE2 3.35Å; V619-Q1235 HydrophobicContact CG1-CG 4.2Å; V623-Q1235 HydrophobicContact CG2-CB 3.99Å; V623-Q1235 HydrophobicContact CG2-CG 4.19Å; F1231-Q1235 HydrophobicContact CE1-CB 4.43Å; F1231-Q1235 WeakPolarHBondContact O-CB 3.33Å; F1231-Q1235 PolarHBondContact O-N 3.44Å; I1232-Q1235 PolarHBondContact O-N 3Å; Q1235-F1237 VanDerWaalsContact C-N 3.3Å; Q1235-F1237 PolarHBondContact O-N 2.8Å; Q1235-A1238 PolarHBondContact O-N 3.27Å; Q1235-A1238 VanDerWaalsContact O-N 3.1Å; Q1235-L1239 HydrophobicContact CG-CD1 3.67Å; Q1235-L1239 HydrophobicContact CG-CG 4.23Å; Q1235-L1239 WeakPolarHBondContact O-CB 3.42Å; Q1235-L1239 WeakPolarHBondContact O-CG 3.06Å; Q1235-L1239 PolarHBondContact O-N 3.33Å
1236	S	66.7	Low	64.9	Low	37 Å²	37	56 Å²	56	26%	0.259	28%	0.281	S	S	.	.	H	α-helix	trans	-61.6	-41.8	178	64.8	0	0	0	0	111	I1232 L1233 Q1240	I1232-S1236 WeakPolarHBondContact O-CB 3.44Å; I1232-S1236 PolarHBondContact O-N 3.48Å; I1232-S1236 PolarHBondContact O-OG 3.27Å; L1233-S1236 PolarHBondContact O-OG 3.33Å; S1236-Q1240 PolarHBondContact O-N 2.94Å
1237	F	65.8	Low	64.3	Low	126 Å²	126	53.3 Å²	53.3	55%	0.553	27%	0.27	S	S	*	.	H	α-helix	trans	-66.7	-35.8	172.7	-174	-103.4	0	0	0	112.7	K626 L1233 I1234 Q1235	K626-F1237 HydrophobicContact CD-CD1 3.7Å; K626-F1237 HydrophobicContact CD-CE1 3.91Å; K626-F1237 PolarHBondContact NZ-O 3.37Å; L1233-F1237 WeakPolarHBondContact O-CB 3.4Å; L1233-F1237 PolarHBondContact O-N 3.3Å; I1234-F1237 CarbonylContact O-C 3.56Å; I1234-F1237 PolarHBondContact O-N 3.09Å; Q1235-F1237 VanDerWaalsContact C-N 3.3Å; Q1235-F1237 PolarHBondContact O-N 2.8Å
1238	A	67	Low	63.5	Low	5 Å²	5	56.7 Å²	56.7	4%	0.041	29%	0.291	C	S	.	.	H	α-helix	trans	-66	-44.9	179.1	0	0	0	0	0	112.3	L622 V623 K626 I1234 Q1235	L622-A1238 HydrophobicContact CB-CB 4.43Å; V623-A1238 HydrophobicContact CG2-CB 4.15Å; K626-A1238 HydrophobicContact CD-CB 3.97Å; K626-A1238 HydrophobicContact CG-CB 4.39Å; K626-A1238 PolarHBondContact NZ-O 2.88Å; I1234-A1238 WeakPolarHBondContact O-CB 3.32Å; I1234-A1238 PolarHBondContact O-N 2.64Å; Q1235-A1238 PolarHBondContact O-N 3.27Å; Q1235-A1238 VanDerWaalsContact O-N 3.1Å
1239	L	67.8	Low	62.1	Low	3 Å²	3	60 Å²	60	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-86.7	-7.9	-171.3	-67.2	177.8	0	0	0	114.6	V619 L622 Q1235 N1241 S1242 R1243 L1246	V619-L1239 HydrophobicContact CG2-CD2 4.41Å; L622-L1239 HydrophobicContact CD1-CD2 3.91Å; Q1235-L1239 HydrophobicContact CG-CD1 3.67Å; Q1235-L1239 HydrophobicContact CG-CG 4.23Å; Q1235-L1239 WeakPolarHBondContact O-CB 3.42Å; Q1235-L1239 WeakPolarHBondContact O-CG 3.06Å; Q1235-L1239 PolarHBondContact O-N 3.33Å; L1239-N1241 PolarHBondContact O-N 2.89Å; L1239-S1242 PolarHBondContact O-N 3.23Å; L1239-S1242 VanDerWaalsContact O-N 3.07Å; L1239-R1243 HydrophobicContact CB-CG 3.97Å; L1239-R1243 VanDerWaalsContact O-CG 3.31Å; L1239-R1243 WeakPolarHBondContact O-CG 3.43Å; L1239-L1246 HydrophobicContact CD2-CD1 3.99Å; L1239-L1246 HydrophobicContact CD2-CD2 3.99Å; L1239-L1246 HydrophobicContact CD2-CG 4.43Å
1240	Q	60.5	Low	60.4	Low	138 Å²	138	62.1 Å²	62.1	65%	0.645	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-35.9	-169.9	-167.7	172.8	0.9	0	0	114.5	S1236	S1236-Q1240 PolarHBondContact O-N 2.94Å
1241	N	55.7	Low	58.5	Low	158 Å²	158	63.1 Å²	63.1	85%	0.845	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-1.7	-176.5	-61.6	-7.8	0	0	0	114.9	L1239	L1239-N1241 PolarHBondContact O-N 2.89Å
1242	S	56.6	Low	56.2	Low	13 Å²	13	70.9 Å²	70.9	9%	0.091	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.2	17.1	-166.4	71.8	0	0	0	0	114.9	L1239 Q1244 T1245	L1239-S1242 PolarHBondContact O-N 3.23Å; L1239-S1242 VanDerWaalsContact O-N 3.07Å; S1242-Q1244 VanDerWaalsContact C-N 3.28Å; S1242-Q1244 PolarHBondContact O-N 2.88Å; S1242-T1245 PolarHBondContact O-N 2.76Å; S1242-T1245 PolarHBondContact O-OG1 3Å
1243	R	58.5	Low	54.1	Low	76 Å²	76	82 Å²	82	29%	0.287	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-61.6	-34.2	-176.1	-69.1	-176	-174.9	-179.2	0	113.4	L1239 T1245	L1239-R1243 HydrophobicContact CB-CG 3.97Å; L1239-R1243 VanDerWaalsContact O-CG 3.31Å; L1239-R1243 WeakPolarHBondContact O-CG 3.43Å; R1243-T1245 VanDerWaalsContact C-N 3.35Å
1244	Q	55.9	Low	52.1	Low	147 Å²	147	79.5 Å²	79.5	69%	0.687	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-77.6	-18.5	-178.1	-66.9	-179.9	-11.6	0	0	113.4	S1242	S1242-Q1244 VanDerWaalsContact C-N 3.28Å; S1242-Q1244 PolarHBondContact O-N 2.88Å
1245	T	54.4	Low	50.3	Low	72 Å²	72	83.2 Å²	83.2	44%	0.442	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-95.4	4.9	-175.7	63	0	0	0	0	113.8	S1242 R1243 T1248	S1242-T1245 PolarHBondContact O-N 2.76Å; S1242-T1245 PolarHBondContact O-OG1 3Å; R1243-T1245 VanDerWaalsContact C-N 3.35Å; T1245-T1248 PolarHBondContact O-OG1 3.46Å
1246	L	55.4	Low	48	Very low	3 Å²	3	93.4 Å²	93.4	2%	0.016	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	130.3	-179.7	-66.2	170	0	0	0	110.9	R571 I615 D618 V619 L622 L1239 T1248	R571-L1246 PolarHBondContact NH2-O 3.41Å; I615-L1246 HydrophobicContact CG1-CB 4.49Å; I615-L1246 HydrophobicContact CG2-CB 4.34Å; D618-L1246 HydrophobicContact CB-CD2 3.74Å; V619-L1246 HydrophobicContact CG2-CD1 4Å; V619-L1246 HydrophobicContact CG2-CD2 3.96Å; L622-L1246 HydrophobicContact CD1-CD2 3.94Å; L1239-L1246 HydrophobicContact CD2-CD1 3.99Å; L1239-L1246 HydrophobicContact CD2-CD2 3.99Å; L1239-L1246 HydrophobicContact CD2-CG 4.43Å; L1246-T1248 VanDerWaalsContact C-N 3.34Å; L1246-T1248 PolarHBondContact O-N 3.25Å
1247	G	54.6	Low	45.9	Very low	16 Å²	16	98.3 Å²	98.3	17%	0.165	53%	0.529	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	-1.2	173.7	0	0	0	0	0	115.8	D618 G1249	D618-G1247 WeakPolarHBondContact OD2-CA 3.36Å; D618-G1247 PolarHBondContact OD2-N 2.88Å; G1247-G1249 VanDerWaalsContact C-N 3.26Å; G1247-G1249 PolarHBondContact O-N 2.89Å
1248	T	52.7	Low	43.9	Very low	75 Å²	75	97.2 Å²	97.2	46%	0.46	54%	0.537	S	S	.	.	S	Bend	trans	-82.1	2	-179.4	58.2	0	0	0	0	114	T1245 L1246 V1250	T1245-T1248 PolarHBondContact O-OG1 3.46Å; L1246-T1248 VanDerWaalsContact C-N 3.34Å; L1246-T1248 PolarHBondContact O-N 3.25Å; T1248-V1250 PolarHBondContact O-N 3.11Å
1249	G	38.5	Very low	41.9	Very low	70 Å²	70	105 Å²	105	72%	0.722	57%	0.572	S	S	*	*			trans	69	-1.8	175.1	0	0	0	0	0	115.1	G1247 S1251	G1247-G1249 VanDerWaalsContact C-N 3.26Å; G1247-G1249 PolarHBondContact O-N 2.89Å; G1249-S1251 VanDerWaalsContact C-N 3.31Å; G1249-S1251 PolarHBondContact O-N 2.97Å
1250	V	33.3	Very low	39.9	Very low	123 Å²	123	111.9 Å²	111.9	75%	0.745	61%	0.61	S	S	*	*			trans	-79.7	85.1	174.8	-172	0	0	0	0	108.2	T1248 F1252	T1248-V1250 PolarHBondContact O-N 3.11Å; V1250-F1252 PolarHBondContact O-N 3.02Å
1251	S	29.9	Very low	38	Very low	111 Å²	111	110.2 Å²	110.2	78%	0.776	62%	0.619	S	S	*	*			trans	-55.9	120.1	179.4	-163	0	0	0	0	111.1	G1249 R1253	G1249-S1251 VanDerWaalsContact C-N 3.31Å; G1249-S1251 PolarHBondContact O-N 2.97Å; S1251-R1253 PolarHBondContact O-N 3Å; S1251-R1253 VanDerWaalsContact O-N 3.12Å
1252	F	26.4	Very low	36.5	Very low	164 Å²	164	108.2 Å²	108.2	72%	0.719	62%	0.617	S	S	*	*			trans	-58.6	106	174.3	-129.7	-95.2	0	0	0	110.2	V1250	V1250-F1252 PolarHBondContact O-N 3.02Å
1253	R	24.4	Very low	35.1	Very low	248 Å²	248	113.4 Å²	113.4	94%	0.936	65%	0.654	S	S	*	*			trans	-121.5	96.9	167	-153.7	-176.2	-158.6	-161.8	5.8	109.3	S1251	S1251-R1253 PolarHBondContact O-N 3Å; S1251-R1253 VanDerWaalsContact O-N 3.12Å
1254	G	26.7	Very low	33.6	Very low	55 Å²	55	115 Å²	115	57%	0.567	68%	0.676	S	S	*	*			trans	82.1	144.6	164.7	0	0	0	0	0	116
1255	P	33.1	Very low	32.2	Very low	108 Å²	108	115 Å²	115	70%	0.701	68%	0.682	S	S	*	*	S	Bend	trans	-74.8	156.7	170.2	34.2	-30.6	0	0	0	109.2
1256	Y	24.2	Very low	31	Very low	214 Å²	214	114.6 Å²	114.6	84%	0.839	69%	0.691	S	S	*	*			trans	79.5	86.4	-169.9	-45.1	-71.6	0	0	0	114
1257	T	23.7	Very low	30.1	Very low	139 Å²	139	120.9 Å²	120.9	85%	0.853	73%	0.73	S	S	*	*				178.8	120.2	102.7	35.4	0	0	0	0	108.4
1258	S	23.5	Very low	29	Very low	104 Å²	104	125.9 Å²	125.9	73%	0.727	76%	0.758	S	S	*	*			trans	-57.1	153.1	158.4	49.4	0	0	0	0	110.8
1259	Q	24	Very low	28.2	Very low	167 Å²	167	125.9 Å²	125.9	78%	0.78	76%	0.757	S	S	*	*			trans	107	110.3	157.8	-62.9	-175.5	-9.9	0	0	117.8
1260	N	25.5	Very low	28.1	Very low	149 Å²	149	126.1 Å²	126.1	80%	0.797	75%	0.748	S	S	*	*			trans	82.5	80	130.5	-56.8	-0.7	0	0	0	116.7
1261	A	22.2	Very low	28.3	Very low	102 Å²	102	127.4 Å²	127.4	84%	0.843	75%	0.746	S	S	*	*			trans	-122	101.5	157.1	0	0	0	0	0	109.1
1262	S	23.9	Very low	28.8	Very low	116 Å²	116	125.3 Å²	125.3	81%	0.811	73%	0.731	S	S	*	*			trans	176.5	105.5	143.4	55.2	0	0	0	0	110.2
1263	S	27	Very low	29.9	Very low	123 Å²	123	121.9 Å²	121.9	86%	0.86	72%	0.72	S	S	*	*				-174.8	126.3	121.6	51.5	0	0	0	0	110.6
1264	S	27.3	Very low	31.1	Very low	108 Å²	108	116 Å²	116	76%	0.755	70%	0.703	S	S	*	*			trans	-75.3	123.8	164.3	47.5	0	0	0	0	109.1
1265	D	26.6	Very low	32.8	Very low	149 Å²	149	118.8 Å²	118.8	80%	0.797	70%	0.704	S	S	*	*			trans	-156.7	120.8	132.4	-95.8	-23.2	0	0	0	108.6	T1267	D1265-T1267 PolarHBondContact O-N 2.97Å
1266	G	28.8	Very low	33.8	Very low	63 Å²	63	122.1 Å²	122.1	65%	0.649	70%	0.703	S	S	*	*			trans	-78.1	120.5	-173.2	0	0	0	0	0	110.6
1267	T	35.2	Very low	35.6	Very low	134 Å²	134	115.7 Å²	115.7	82%	0.822	68%	0.683	S	S	*	*	S	Bend		172.2	-3.7	120	33.8	0	0	0	0	113	D1265	D1265-T1267 PolarHBondContact O-N 2.97Å
1268	T	33.3	Very low	37.9	Very low	122 Å²	122	114 Å²	114	75%	0.748	67%	0.669	S	S	*	*	S	Bend	trans	-107.7	0.1	174.9	50.6	0	0	0	0	114.5
1269	T	35.3	Very low	40.1	Very low	74 Å²	74	114.6 Å²	114.6	45%	0.454	66%	0.66	S	S	.	*	H	α-helix	trans	-78.5	-12.9	178.1	42.7	0	0	0	0	114.6	E1271 S1272 I1273	T1269-E1271 PolarHBondContact O-N 3.18Å; T1269-S1272 PolarHBondContact O-OG 2.88Å; T1269-I1273 VanDerWaalsContact O-CB 3.3Å; T1269-I1273 WeakPolarHBondContact O-CB 3.5Å; T1269-I1273 WeakPolarHBondContact O-CD1 3.37Å; T1269-I1273 WeakPolarHBondContact O-CG1 3.45Å; T1269-I1273 PolarHBondContact O-N 3.06Å
1270	S	36.9	Very low	42.1	Very low	75 Å²	75	111 Å²	111	52%	0.524	65%	0.645	S	S	.	*	H	α-helix	trans	-66.9	-38	179.6	58.4	0	0	0	0	112.5	Q1274	S1270-Q1274 WeakPolarHBondContact O-CB 3.41Å; S1270-Q1274 PolarHBondContact O-N 3.35Å
1271	E	37.4	Very low	44.3	Very low	150 Å²	150	108 Å²	108	70%	0.701	63%	0.629	S	S	*	*	H	α-helix	trans	-75.9	-37.9	-179.9	-70.7	-170.6	163.2	0	0	112.5	T1269 Q1274 L1275	T1269-E1271 PolarHBondContact O-N 3.18Å; E1271-Q1274 PolarHBondContact O-N 3.14Å; E1271-L1275 WeakPolarHBondContact O-CB 3.48Å; E1271-L1275 PolarHBondContact O-N 2.91Å
1272	S	39.8	Very low	46.9	Very low	68 Å²	68	105.4 Å²	105.4	48%	0.476	61%	0.605	S	S	.	*	H	α-helix	trans	-70.8	-33.5	176.2	65.8	0	0	0	0	112.2	T1269 R1276	T1269-S1272 PolarHBondContact O-OG 2.88Å; S1272-R1276 VanDerWaalsContact O-CB 3.25Å; S1272-R1276 WeakPolarHBondContact O-CB 3.41Å; S1272-R1276 PolarHBondContact O-N 3.16Å
1273	I	48.4	Very low	49.1	Very low	92 Å²	92	108.5 Å²	108.5	47%	0.472	60%	0.598	S	S	.	*	H	α-helix	trans	-68.1	-40.4	170.4	-67.5	168	0	0	0	110.5	T1269 R1276 N1277	T1269-I1273 VanDerWaalsContact O-CB 3.3Å; T1269-I1273 WeakPolarHBondContact O-CB 3.5Å; T1269-I1273 WeakPolarHBondContact O-CD1 3.37Å; T1269-I1273 WeakPolarHBondContact O-CG1 3.45Å; T1269-I1273 PolarHBondContact O-N 3.06Å; I1273-R1276 PolarHBondContact O-N 3.48Å; I1273-N1277 VanDerWaalsContact O-CB 3.29Å; I1273-N1277 WeakPolarHBondContact O-CB 3.25Å; I1273-N1277 PolarHBondContact O-N 2.88Å
1274	Q	50.6	Low	51.1	Low	123 Å²	123	107.1 Å²	107.1	58%	0.575	58%	0.581	S	S	*	*	H	α-helix	trans	-63.9	-43.5	174.4	-88.1	-174.2	-14.4	0	0	112.4	S1270 E1271 R1276 N1277 N1278	S1270-Q1274 WeakPolarHBondContact O-CB 3.41Å; S1270-Q1274 PolarHBondContact O-N 3.35Å; E1271-Q1274 PolarHBondContact O-N 3.14Å; Q1274-R1276 VanDerWaalsContact C-N 3.31Å; Q1274-R1276 PolarHBondContact O-N 2.8Å; Q1274-N1277 PolarHBondContact O-N 3.48Å; Q1274-N1278 WeakPolarHBondContact O-CB 3.49Å; Q1274-N1278 PolarHBondContact O-N 3.35Å; Q1274-N1278 PolarHBondContact O-ND2 3.48Å; Q1274-N1278 PolarHBondContact O-OD1 2.93Å
1275	L	62.7	Low	53.5	Low	114 Å²	114	108.2 Å²	108.2	60%	0.597	57%	0.574	S	S	*	*	H	α-helix	trans	-62.6	-40.8	176.6	-163.3	100.4	0	0	0	111.3	E1271 N1278 Q1279	E1271-L1275 WeakPolarHBondContact O-CB 3.48Å; E1271-L1275 PolarHBondContact O-N 2.91Å; L1275-N1278 PolarHBondContact O-N 2.81Å; L1275-Q1279 PolarHBondContact O-N 3.13Å
1276	R	54.8	Low	55.9	Low	179 Å²	179	109.8 Å²	109.8	68%	0.675	57%	0.569	S	S	*	*	H	α-helix	trans	-71.3	-36.2	178.5	-161.4	175.1	-114.6	174.2	-3.1	111.9	S1272 I1273 Q1274 Q1279 I1280	S1272-R1276 VanDerWaalsContact O-CB 3.25Å; S1272-R1276 WeakPolarHBondContact O-CB 3.41Å; S1272-R1276 PolarHBondContact O-N 3.16Å; I1273-R1276 PolarHBondContact O-N 3.48Å; Q1274-R1276 VanDerWaalsContact C-N 3.31Å; Q1274-R1276 PolarHBondContact O-N 2.8Å; R1276-Q1279 PolarHBondContact O-N 2.95Å; R1276-I1280 HydrophobicContact CG-CD1 4.49Å; R1276-I1280 VanDerWaalsContact O-CG1 3.24Å; R1276-I1280 WeakPolarHBondContact O-CG1 3.33Å; R1276-I1280 PolarHBondContact O-N 2.94Å
1277	N	61.8	Low	57.8	Low	79 Å²	79	111.8 Å²	111.8	42%	0.422	56%	0.564	S	S	.	*	H	α-helix	trans	-66.9	-43.7	172.5	-74	-11	0	0	0	111.1	I1273 Q1274 Q1279 I1280 D1281	I1273-N1277 VanDerWaalsContact O-CB 3.29Å; I1273-N1277 WeakPolarHBondContact O-CB 3.25Å; I1273-N1277 PolarHBondContact O-N 2.88Å; Q1274-N1277 PolarHBondContact O-N 3.48Å; N1277-Q1279 VanDerWaalsContact C-N 3.28Å; N1277-Q1279 PolarHBondContact O-N 3.33Å; N1277-I1280 CarbonylContact O-C 3.51Å; N1277-I1280 PolarHBondContact O-N 3.38Å; N1277-D1281 WeakPolarHBondContact O-CB 3.25Å; N1277-D1281 PolarHBondContact O-N 2.94Å
1278	N	70.2	Confident	59.3	Low	104 Å²	104	111.1 Å²	111.1	56%	0.556	55%	0.551	S	S	*	*	H	α-helix	trans	-62	-36.4	174.6	-67.2	-12	0	0	0	111.8	Q1274 L1275 S1282	Q1274-N1278 WeakPolarHBondContact O-CB 3.49Å; Q1274-N1278 PolarHBondContact O-N 3.35Å; Q1274-N1278 PolarHBondContact O-ND2 3.48Å; Q1274-N1278 PolarHBondContact O-OD1 2.93Å; L1275-N1278 PolarHBondContact O-N 2.81Å; N1278-S1282 WeakPolarHBondContact O-CB 3.31Å; N1278-S1282 PolarHBondContact O-N 3.33Å; N1278-S1282 PolarHBondContact O-OG 2.92Å
1279	Q	71.1	Confident	61.4	Low	116 Å²	116	107.5 Å²	107.5	54%	0.542	53%	0.534	S	S	.	.	H	α-helix	trans	-66	-42	171.8	-83.9	-176	-21	0	0	112	L1275 R1276 N1277 S1282 R1283	L1275-Q1279 PolarHBondContact O-N 3.13Å; R1276-Q1279 PolarHBondContact O-N 2.95Å; N1277-Q1279 VanDerWaalsContact C-N 3.28Å; N1277-Q1279 PolarHBondContact O-N 3.33Å; Q1279-S1282 PolarHBondContact O-N 2.92Å; Q1279-S1282 PolarHBondContact O-OG 3.14Å; Q1279-R1283 WeakPolarHBondContact O-CG 3.21Å; Q1279-R1283 PolarHBondContact O-N 3.49Å
1280	I	64.7	Low	63.4	Low	90 Å²	90	109.1 Å²	109.1	46%	0.462	54%	0.539	S	S	.	.	H	α-helix	trans	-64	-45.3	175.9	-69.9	164.2	0	0	0	110.2	R1276 N1277 S1282 R1283 L1284	R1276-I1280 HydrophobicContact CG-CD1 4.49Å; R1276-I1280 VanDerWaalsContact O-CG1 3.24Å; R1276-I1280 WeakPolarHBondContact O-CG1 3.33Å; R1276-I1280 PolarHBondContact O-N 2.94Å; N1277-I1280 CarbonylContact O-C 3.51Å; N1277-I1280 PolarHBondContact O-N 3.38Å; I1280-S1282 PolarHBondContact O-N 3.01Å; I1280-R1283 CarbonylContact O-C 3.58Å; I1280-R1283 PolarHBondContact O-N 3.41Å; I1280-R1283 VanDerWaalsContact O-N 3.08Å; I1280-L1284 WeakPolarHBondContact O-CB 3.36Å; I1280-L1284 PolarHBondContact O-N 3.18Å
1281	D	72.4	Confident	64.7	Low	87 Å²	87	110.6 Å²	110.6	47%	0.465	54%	0.54	S	S	.	.	H	α-helix	trans	-62.3	-43.6	178.6	-70.6	-20.5	0	0	0	110.7	N1277 R1283 L1284 E1285	N1277-D1281 WeakPolarHBondContact O-CB 3.25Å; N1277-D1281 PolarHBondContact O-N 2.94Å; D1281-R1283 VanDerWaalsContact C-N 3.26Å; D1281-R1283 PolarHBondContact O-N 3.08Å; D1281-L1284 PolarHBondContact O-N 3.28Å; D1281-L1284 VanDerWaalsContact O-N 3.12Å; D1281-E1285 WeakPolarHBondContact O-CG 3.43Å; D1281-E1285 PolarHBondContact O-N 3.28Å
1282	S	77.1	Confident	66.5	Low	48 Å²	48	110 Å²	110	34%	0.336	54%	0.537	S	S	.	.	H	α-helix	trans	-64.1	-29.5	174.6	75.5	0	0	0	0	113.5	N1278 Q1279 I1280 R1286	N1278-S1282 WeakPolarHBondContact O-CB 3.31Å; N1278-S1282 PolarHBondContact O-N 3.33Å; N1278-S1282 PolarHBondContact O-OG 2.92Å; Q1279-S1282 PolarHBondContact O-N 2.92Å; Q1279-S1282 PolarHBondContact O-OG 3.14Å; I1280-S1282 PolarHBondContact O-N 3.01Å; S1282-R1286 WeakPolarHBondContact O-CG 3.24Å; S1282-R1286 PolarHBondContact O-N 3.28Å
1283	R	70.6	Confident	68.1	Low	180 Å²	180	114 Å²	114	68%	0.679	55%	0.546	S	S	*	.	H	α-helix	trans	-78.2	-35.6	174	-71.5	-168.2	89	172.3	8	111.2	Q1279 I1280 D1281 R1286 I1287	Q1279-R1283 WeakPolarHBondContact O-CG 3.21Å; Q1279-R1283 PolarHBondContact O-N 3.49Å; I1280-R1283 CarbonylContact O-C 3.58Å; I1280-R1283 PolarHBondContact O-N 3.41Å; I1280-R1283 VanDerWaalsContact O-N 3.08Å; D1281-R1283 VanDerWaalsContact C-N 3.26Å; D1281-R1283 PolarHBondContact O-N 3.08Å; R1283-R1286 PolarHBondContact O-N 2.99Å; R1283-I1287 VanDerWaalsContact O-CG1 3.23Å; R1283-I1287 WeakPolarHBondContact O-CG1 3.28Å; R1283-I1287 PolarHBondContact O-N 3.43Å
1284	L	68.9	Low	69	Low	94 Å²	94	113.2 Å²	113.2	49%	0.492	55%	0.545	S	S	.	.	H	α-helix	trans	-65.1	-45.5	175.3	-145.2	86.4	0	0	0	110	I1280 D1281 R1286 I1287 E1288	I1280-L1284 WeakPolarHBondContact O-CB 3.36Å; I1280-L1284 PolarHBondContact O-N 3.18Å; D1281-L1284 PolarHBondContact O-N 3.28Å; D1281-L1284 VanDerWaalsContact O-N 3.12Å; L1284-R1286 VanDerWaalsContact C-N 3.35Å; L1284-R1286 PolarHBondContact O-N 3.08Å; L1284-I1287 CarbonylContact O-C 3.58Å; L1284-I1287 PolarHBondContact O-N 3.03Å; L1284-I1287 VanDerWaalsContact O-N 3.08Å; L1284-E1288 PolarHBondContact O-N 3.25Å
1285	E	76.6	Confident	70	Confident	132 Å²	132	110.6 Å²	110.6	62%	0.617	54%	0.538	S	S	*	.	H	α-helix	trans	-60.4	-40.6	173.9	-76.3	-178	172.5	0	0	112.1	D1281 I1287 E1288 A1289	D1281-E1285 WeakPolarHBondContact O-CG 3.43Å; D1281-E1285 PolarHBondContact O-N 3.28Å; E1285-I1287 VanDerWaalsContact C-N 3.34Å; E1285-I1287 PolarHBondContact O-N 3.5Å; E1285-E1288 PolarHBondContact O-N 3.13Å; E1285-A1289 VanDerWaalsContact O-CB 3.31Å; E1285-A1289 WeakPolarHBondContact O-CB 3.43Å; E1285-A1289 PolarHBondContact O-N 3.39Å
1286	R	76.7	Confident	70.3	Confident	181 Å²	181	109.7 Å²	109.7	68%	0.683	53%	0.533	S	S	*	.	H	α-helix	trans	-63.7	-39.7	172.9	-81.6	-174.8	-155.1	-175.7	6.2	112.3	S1282 R1283 L1284 I1290	S1282-R1286 WeakPolarHBondContact O-CG 3.24Å; S1282-R1286 PolarHBondContact O-N 3.28Å; R1283-R1286 PolarHBondContact O-N 2.99Å; L1284-R1286 VanDerWaalsContact C-N 3.35Å; L1284-R1286 PolarHBondContact O-N 3.08Å; R1286-I1290 WeakPolarHBondContact O-CB 3.08Å; R1286-I1290 WeakPolarHBondContact O-CD1 3.25Å; R1286-I1290 WeakPolarHBondContact O-CG1 3.31Å; R1286-I1290 PolarHBondContact O-N 2.88Å
1287	I	68.7	Low	70.4	Confident	106 Å²	106	110.2 Å²	110.2	54%	0.544	54%	0.536	S	S	.	.	H	α-helix	trans	-69	-41.1	178.5	-70.3	165.9	0	0	0	110	R1283 L1284 E1285 I1290 L1291	R1283-I1287 VanDerWaalsContact O-CG1 3.23Å; R1283-I1287 WeakPolarHBondContact O-CG1 3.28Å; R1283-I1287 PolarHBondContact O-N 3.43Å; L1284-I1287 CarbonylContact O-C 3.58Å; L1284-I1287 PolarHBondContact O-N 3.03Å; L1284-I1287 VanDerWaalsContact O-N 3.08Å; E1285-I1287 VanDerWaalsContact C-N 3.34Å; E1285-I1287 PolarHBondContact O-N 3.5Å; I1287-I1290 PolarHBondContact O-N 3.12Å; I1287-L1291 VanDerWaalsContact O-CB 3.3Å; I1287-L1291 WeakPolarHBondContact O-CB 3.22Å; I1287-L1291 PolarHBondContact O-N 3.29Å
1288	E	68.3	Low	70	Confident	119 Å²	119	110.6 Å²	110.6	56%	0.556	54%	0.541	S	S	*	.	H	α-helix	trans	-63	-44.3	174	-79.8	-173.4	157.1	0	0	111.4	L1284 E1285 I1290 L1291 E1292	L1284-E1288 PolarHBondContact O-N 3.25Å; E1285-E1288 PolarHBondContact O-N 3.13Å; E1288-I1290 VanDerWaalsContact C-N 3.31Å; E1288-I1290 PolarHBondContact O-N 3.38Å; E1288-L1291 CarbonylContact O-C 3.46Å; E1288-L1291 PolarHBondContact O-N 2.95Å; E1288-L1291 VanDerWaalsContact O-N 3.1Å; E1288-E1292 PolarHBondContact O-N 3.38Å
1289	A	76.1	Confident	68.9	Low	47 Å²	47	111.1 Å²	111.1	39%	0.388	54%	0.543	S	S	.	.	H	α-helix	trans	-64.1	-34.3	175.8	0	0	0	0	0	112.9	E1285 K1293	E1285-A1289 VanDerWaalsContact O-CB 3.31Å; E1285-A1289 WeakPolarHBondContact O-CB 3.43Å; E1285-A1289 PolarHBondContact O-N 3.39Å; A1289-K1293 WeakPolarHBondContact O-CG 3.35Å; A1289-K1293 PolarHBondContact O-N 3.34Å; A1289-K1293 VanDerWaalsContact O-N 3.1Å
1290	I	77.5	Confident	67.8	Low	107 Å²	107	112.8 Å²	112.8	55%	0.549	55%	0.551	S	S	.	*	H	α-helix	trans	-69.6	-42	172.5	-69.7	163.9	0	0	0	110	R1286 I1287 E1288 K1293 V1294	R1286-I1290 WeakPolarHBondContact O-CB 3.08Å; R1286-I1290 WeakPolarHBondContact O-CD1 3.25Å; R1286-I1290 WeakPolarHBondContact O-CG1 3.31Å; R1286-I1290 PolarHBondContact O-N 2.88Å; I1287-I1290 PolarHBondContact O-N 3.12Å; E1288-I1290 VanDerWaalsContact C-N 3.31Å; E1288-I1290 PolarHBondContact O-N 3.38Å; I1290-K1293 PolarHBondContact O-N 2.72Å; I1290-V1294 HydrophobicContact CG2-CG2 4.48Å; I1290-V1294 VanDerWaalsContact O-CG2 3.3Å; I1290-V1294 WeakPolarHBondContact O-CG2 3.43Å; I1290-V1294 PolarHBondContact O-N 2.96Å
1291	L	63.5	Low	66.6	Low	107 Å²	107	114 Å²	114	56%	0.56	56%	0.558	S	S	*	*	H	α-helix	trans	-66.3	-40.9	179.9	-164.5	71	0	0	0	111	I1287 E1288 V1294 V1295	I1287-L1291 VanDerWaalsContact O-CB 3.3Å; I1287-L1291 WeakPolarHBondContact O-CB 3.22Å; I1287-L1291 PolarHBondContact O-N 3.29Å; E1288-L1291 CarbonylContact O-C 3.46Å; E1288-L1291 PolarHBondContact O-N 2.95Å; E1288-L1291 VanDerWaalsContact O-N 3.1Å; L1291-V1294 PolarHBondContact O-N 2.86Å; L1291-V1295 WeakPolarHBondContact O-CB 3.47Å; L1291-V1295 VanDerWaalsContact O-CG2 3.24Å; L1291-V1295 WeakPolarHBondContact O-CG2 3.44Å; L1291-V1295 PolarHBondContact O-N 3.16Å
1292	E	75.2	Confident	64.7	Low	137 Å²	137	118.5 Å²	118.5	64%	0.64	57%	0.573	S	S	*	*	H	α-helix	trans	-60.4	-46.1	171.4	-99.5	-174.9	160.2	0	0	111.3	E1288 V1294 V1295 D1296	E1288-E1292 PolarHBondContact O-N 3.38Å; E1292-V1294 VanDerWaalsContact C-N 3.26Å; E1292-V1294 PolarHBondContact O-N 3.27Å; E1292-V1295 PolarHBondContact O-N 3.03Å; E1292-D1296 WeakPolarHBondContact O-CB 3.32Å; E1292-D1296 PolarHBondContact O-N 3.37Å
1293	K	74.5	Confident	62.7	Low	152 Å²	152	124 Å²	124	66%	0.661	60%	0.597	S	S	*	*	H	α-helix	trans	-59.9	-35.5	174.5	-82.7	178.2	178.2	174.6	0	113.1	A1289 I1290 R1297	A1289-K1293 WeakPolarHBondContact O-CG 3.35Å; A1289-K1293 PolarHBondContact O-N 3.34Å; A1289-K1293 VanDerWaalsContact O-N 3.1Å; I1290-K1293 PolarHBondContact O-N 2.72Å; K1293-R1297 WeakPolarHBondContact O-CB 3.41Å; K1293-R1297 WeakPolarHBondContact O-CG 3.41Å; K1293-R1297 PolarHBondContact O-N 3.19Å
1294	V	67.4	Low	60.7	Low	75 Å²	75	120.1 Å²	120.1	46%	0.455	59%	0.593	S	S	.	*	H	α-helix	trans	-72.9	-42.2	176.7	171.7	0	0	0	0	110.5	I1290 L1291 E1292 R1297 V1298	I1290-V1294 HydrophobicContact CG2-CG2 4.48Å; I1290-V1294 VanDerWaalsContact O-CG2 3.3Å; I1290-V1294 WeakPolarHBondContact O-CG2 3.43Å; I1290-V1294 PolarHBondContact O-N 2.96Å; L1291-V1294 PolarHBondContact O-N 2.86Å; E1292-V1294 VanDerWaalsContact C-N 3.26Å; E1292-V1294 PolarHBondContact O-N 3.27Å; V1294-R1297 PolarHBondContact O-N 3.37Å; V1294-V1298 HydrophobicContact CG1-CG2 4.43Å; V1294-V1298 VanDerWaalsContact O-CG2 3.26Å; V1294-V1298 WeakPolarHBondContact O-CG2 3.45Å; V1294-V1298 PolarHBondContact O-N 2.69Å
1295	V	71.3	Confident	58.7	Low	69 Å²	69	122.1 Å²	122.1	42%	0.418	60%	0.604	S	S	.	*	H	α-helix	trans	-64	-41.8	176.3	170.2	0	0	0	0	110.7	L1291 E1292 V1298 N1299	L1291-V1295 WeakPolarHBondContact O-CB 3.47Å; L1291-V1295 VanDerWaalsContact O-CG2 3.24Å; L1291-V1295 WeakPolarHBondContact O-CG2 3.44Å; L1291-V1295 PolarHBondContact O-N 3.16Å; E1292-V1295 PolarHBondContact O-N 3.03Å; V1295-V1298 PolarHBondContact O-N 3.31Å; V1295-N1299 WeakPolarHBondContact O-CB 3.42Å; V1295-N1299 PolarHBondContact O-N 3.28Å; V1295-N1299 PolarHBondContact O-ND2 3.41Å
1296	D	68.1	Low	56.4	Low	94 Å²	94	121.7 Å²	121.7	50%	0.503	61%	0.611	S	S	.	*	H	α-helix	trans	-63.4	-41.6	173.6	-81.8	-12.7	0	0	0	111.8	E1292 V1298 N1299 Q1300	E1292-D1296 WeakPolarHBondContact O-CB 3.32Å; E1292-D1296 PolarHBondContact O-N 3.37Å; D1296-V1298 VanDerWaalsContact C-N 3.33Å; D1296-V1298 PolarHBondContact O-N 3.13Å; D1296-N1299 PolarHBondContact O-N 3.4Å; D1296-Q1300 WeakPolarHBondContact O-CB 2.98Å; D1296-Q1300 VanDerWaalsContact O-CG 3.28Å; D1296-Q1300 WeakPolarHBondContact O-CG 3.38Å; D1296-Q1300 PolarHBondContact O-N 3.15Å
1297	R	58.2	Low	54.2	Low	191 Å²	191	121.2 Å²	121.2	72%	0.721	62%	0.621	S	S	*	*	H	α-helix	trans	-62.9	-40	173	-84.2	-164.3	-164.8	-171.4	5.8	112.3	K1293 V1294 Q1300 I1301	K1293-R1297 WeakPolarHBondContact O-CB 3.41Å; K1293-R1297 WeakPolarHBondContact O-CG 3.41Å; K1293-R1297 PolarHBondContact O-N 3.19Å; V1294-R1297 PolarHBondContact O-N 3.37Å; R1297-Q1300 PolarHBondContact O-N 2.68Å; R1297-I1301 WeakPolarHBondContact O-CG1 3.43Å; R1297-I1301 PolarHBondContact O-N 3.28Å
1298	V	52.2	Low	52.3	Low	87 Å²	87	120.9 Å²	120.9	53%	0.527	63%	0.628	S	S	.	*	H	α-helix	trans	-68.4	-38.5	178.2	170.9	0	0	0	0	110.5	V1294 V1295 D1296 Q1300 I1301	V1294-V1298 HydrophobicContact CG1-CG2 4.43Å; V1294-V1298 VanDerWaalsContact O-CG2 3.26Å; V1294-V1298 WeakPolarHBondContact O-CG2 3.45Å; V1294-V1298 PolarHBondContact O-N 2.69Å; V1295-V1298 PolarHBondContact O-N 3.31Å; D1296-V1298 VanDerWaalsContact C-N 3.33Å; D1296-V1298 PolarHBondContact O-N 3.13Å; V1298-Q1300 VanDerWaalsContact C-N 3.3Å; V1298-Q1300 PolarHBondContact O-N 2.91Å; V1298-I1301 WeakPolarHBondContact O-CB 3.16Å; V1298-I1301 PolarHBondContact O-N 3.13Å
1299	N	48	Very low	50.4	Low	115 Å²	115	120.3 Å²	120.3	62%	0.615	64%	0.637	S	S	*	*	H	α-helix	trans	-71.2	-25.1	176	-69.5	-23.1	0	0	0	112.8	V1295 D1296 I1301	V1295-N1299 WeakPolarHBondContact O-CB 3.42Å; V1295-N1299 PolarHBondContact O-N 3.28Å; V1295-N1299 PolarHBondContact O-ND2 3.41Å; D1296-N1299 PolarHBondContact O-N 3.4Å; N1299-I1301 VanDerWaalsContact C-N 3.26Å; N1299-I1301 PolarHBondContact O-N 3.39Å
1300	Q	48.4	Very low	48.2	Very low	151 Å²	151	127.8 Å²	127.8	71%	0.706	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-9.6	172.4	-76.7	178.7	8.8	0	0	113.7	D1296 R1297 V1298 K1302	D1296-Q1300 WeakPolarHBondContact O-CB 2.98Å; D1296-Q1300 VanDerWaalsContact O-CG 3.28Å; D1296-Q1300 WeakPolarHBondContact O-CG 3.38Å; D1296-Q1300 PolarHBondContact O-N 3.15Å; R1297-Q1300 PolarHBondContact O-N 2.68Å; V1298-Q1300 VanDerWaalsContact C-N 3.3Å; V1298-Q1300 PolarHBondContact O-N 2.91Å; Q1300-K1302 PolarHBondContact O-N 2.94Å
1301	I	39.3	Very low	46	Very low	116 Å²	116	127.2 Å²	127.2	60%	0.595	68%	0.675	S	S	*	*			trans	-75.2	76.8	170.1	-57.1	168.9	0	0	0	107.5	R1297 V1298 N1299 I1303	R1297-I1301 WeakPolarHBondContact O-CG1 3.43Å; R1297-I1301 PolarHBondContact O-N 3.28Å; V1298-I1301 WeakPolarHBondContact O-CB 3.16Å; V1298-I1301 PolarHBondContact O-N 3.13Å; N1299-I1301 VanDerWaalsContact C-N 3.26Å; N1299-I1301 PolarHBondContact O-N 3.39Å; I1301-I1303 VanDerWaalsContact C-N 3.34Å; I1301-I1303 HydrophobicContact CG2-CG1 4.12Å; I1301-I1303 PolarHBondContact O-N 3.35Å
1302	K	31.5	Very low	44.2	Very low	181 Å²	181	128.3 Å²	128.3	79%	0.787	69%	0.687	S	S	*	*			trans	-64.7	93.8	167.9	-81.2	179.6	173.9	177.6	0	108	Q1300 T1304	Q1300-K1302 PolarHBondContact O-N 2.94Å; K1302-T1304 PolarHBondContact O-N 3Å
1303	I	35.9	Very low	42	Very low	164 Å²	164	127.6 Å²	127.6	84%	0.841	69%	0.694	S	S	*	*			trans	-74.3	89.1	164.1	-58.3	175.6	0	0	0	106	I1301	I1301-I1303 VanDerWaalsContact C-N 3.34Å; I1301-I1303 HydrophobicContact CG2-CG1 4.12Å; I1301-I1303 PolarHBondContact O-N 3.35Å
1304	T	28.9	Very low	39.8	Very low	98 Å²	98	126.5 Å²	126.5	60%	0.601	70%	0.7	S	S	*	*			trans	-74.4	144.7	169.3	39.5	0	0	0	0	110.2	K1302	K1302-T1304 PolarHBondContact O-N 3Å
1305	D	27.3	Very low	38	Very low	135 Å²	135	130.6 Å²	130.6	72%	0.722	72%	0.718	S	S	*	*			trans	95	105.5	152.4	-57.8	-21.9	0	0	0	119.3
1306	T	28.1	Very low	35.8	Very low	123 Å²	123	139.1 Å²	139.1	76%	0.755	74%	0.742	S	S	*	*			trans	80.7	101.4	138.6	64	0	0	0	0	117.6
1307	L	29.6	Very low	34.2	Very low	172 Å²	172	139.8 Å²	139.8	90%	0.901	76%	0.755	S	S	*	*				-174.2	128.1	105.6	-96.8	144	0	0	0	110.9
1308	S	29.8	Very low	33	Very low	99 Å²	99	136.5 Å²	136.5	69%	0.692	76%	0.758	S	S	*	*			trans	-70.4	139.2	-169.3	48.5	0	0	0	0	114.8
1309	S	27.7	Very low	31.9	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	77%	0.772	S	S	*	*			trans	34.6	112.2	140.4	66.8	0	0	0	0	119.1
1310	Q	30	Very low	31.1	Very low	204 Å²	204	138.8 Å²	138.8	95%	0.953	78%	0.778	S	S	*	*			trans	-149	135.3	137.4	-109.5	173.4	21.1	0	0	110.7
1311	A	31.6	Very low	30.2	Very low	95 Å²	95	139.4 Å²	139.4	79%	0.785	79%	0.785	S	S	*	*			trans	-76.9	150	-159.5	0	0	0	0	0	114.7
1312	T	25.1	Very low	29.6	Very low	130 Å²	130	145 Å²	145	80%	0.798	80%	0.798	S	S	*	*			trans	-53.4	143.4	170.9	47.8	0	0	0	0	115
1313	P	28.9	Very low	29.3	Very low	121 Å²	121	144.5 Å²	144.5	79%	0.786	80%	0.8	S	S	*	*			trans	-115	124.4	144.3	31.9	-19.8	0	0	0	111
1314	T	28.6	Very low	29	Very low	129 Å²	129	142.8 Å²	142.8	79%	0.791	80%	0.8	S	S	*	*			trans	-64.2	122.2	174.6	46.6	0	0	0	0	112.3
1315	I	30.6	Very low	28.9	Very low	161 Å²	161	142.8 Å²	142.8	83%	0.826	80%	0.804	S	S	*	*			trans	-128.9	107.4	157.5	-61.8	-179.6	0	0	0	108.3
1316	R	25.2	Very low	28.9	Very low	248 Å²	248	142.7 Å²	142.7	94%	0.936	81%	0.808	S	S	*	*			trans	-64.9	129.7	171.3	-79.1	175.5	171.3	174.6	-2.9	109.7
1317	S	32.6	Very low	28.8	Very low	109 Å²	109	146 Å²	146	76%	0.762	81%	0.812	S	S	*	*			trans	-134.4	150.4	157.6	63.7	0	0	0	0	109.6
1318	P	32.9	Very low	28.7	Very low	122 Å²	122	145.2 Å²	145.2	79%	0.792	81%	0.808	S	S	*	*			trans	-82.9	151.5	-147.8	32.9	-34.7	0	0	0	113.9	P1320	P1318-P1320 VanDerWaalsContact O-CD 3.31Å; P1318-P1320 WeakPolarHBondContact O-CD 3.28Å
1319	V	30.6	Very low	28.7	Very low	135 Å²	135	146.8 Å²	146.8	82%	0.818	81%	0.814	S	S	*	*			trans	-53.3	115	-178.5	-179.6	0	0	0	0	112.3
1320	P	30.3	Very low	28.8	Very low	114 Å²	114	150.6 Å²	150.6	74%	0.74	82%	0.819	S	S	*	*			trans	-88.2	127.3	159.3	31.4	-22.4	0	0	0	109.2	P1318 R1322	P1318-P1320 VanDerWaalsContact O-CD 3.31Å; P1318-P1320 WeakPolarHBondContact O-CD 3.28Å; P1320-R1322 PolarHBondContact O-N 3.05Å
1321	I	30.4	Very low	28.9	Very low	165 Å²	165	145 Å²	145	85%	0.846	81%	0.807	S	S	*	*			trans	-56.3	118.1	177.4	-65.1	164.7	0	0	0	109.4	M1323	I1321-M1323 PolarHBondContact O-N 3.3Å
1322	R	27.1	Very low	29	Very low	234 Å²	234	146.4 Å²	146.4	88%	0.883	81%	0.809	S	S	*	*			trans	-62.2	113.9	-179.7	-116.8	176.5	177.9	174.1	0	110.6	P1320	P1320-R1322 PolarHBondContact O-N 3.05Å
1323	M	24.1	Very low	29.3	Very low	169 Å²	169	146.4 Å²	146.4	83%	0.833	81%	0.809	S	S	*	*			trans	-78.8	145.3	142	-74.6	-171.8	-169.3	0	0	107.7	I1321 S1325	I1321-M1323 PolarHBondContact O-N 3.3Å; M1323-S1325 PolarHBondContact O-N 3.1Å
1324	P	29.2	Very low	29.4	Very low	129 Å²	129	148.3 Å²	148.3	84%	0.838	81%	0.812	S	S	*	*			trans	-68.2	99.5	-178.8	28.1	-31.4	0	0	0	109	V1326	P1324-V1326 PolarHBondContact O-N 2.9Å
1325	S	26.7	Very low	29.5	Very low	97 Å²	97	148.4 Å²	148.4	68%	0.678	81%	0.813	S	S	*	*			trans	-79.4	110.3	172.5	57.5	0	0	0	0	108.9	M1323 K1327	M1323-S1325 PolarHBondContact O-N 3.1Å; S1325-K1327 PolarHBondContact O-N 3.19Å
1326	V	28.5	Very low	29.4	Very low	134 Å²	134	149.5 Å²	149.5	81%	0.812	81%	0.814	S	S	*	*			trans	-50.8	117.3	159.1	176	0	0	0	0	107.5	P1324 L1328	P1324-V1326 PolarHBondContact O-N 2.9Å; V1326-L1328 PolarHBondContact O-N 3.4Å
1327	K	24.9	Very low	29.5	Very low	193 Å²	193	147.5 Å²	147.5	84%	0.839	81%	0.812	S	S	*	*			trans	-68.1	99.5	-179.3	-75.7	179.2	176.1	178.1	0	109.4	S1325	S1325-K1327 PolarHBondContact O-N 3.19Å
1328	L	28.8	Very low	29.5	Very low	154 Å²	154	149.1 Å²	149.1	81%	0.806	81%	0.811	S	S	*	*			trans	-87.4	105.8	154.2	-80.1	155.4	0	0	0	106.4	V1326 H1330	V1326-L1328 PolarHBondContact O-N 3.4Å; L1328-H1330 PolarHBondContact O-N 3.3Å
1329	T	28.5	Very low	29.3	Very low	133 Å²	133	149 Å²	149	82%	0.816	81%	0.81	S	S	*	*			trans	-65.2	114.1	177.9	37.8	0	0	0	0	109.7	A1331	T1329-A1331 PolarHBondContact O-N 3.21Å
1330	H	29.6	Very low	29.1	Very low	187 Å²	187	148.4 Å²	148.4	87%	0.866	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-72.2	116.3	168.6	-84.5	-88.6	0	0	0	109.2	L1328	L1328-H1330 PolarHBondContact O-N 3.3Å
1331	A	32.7	Very low	29.2	Very low	85 Å²	85	152.3 Å²	152.3	70%	0.702	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-71.1	145.6	165.1	0	0	0	0	0	110.1	T1329	T1329-A1331 PolarHBondContact O-N 3.21Å
1332	P	32.8	Very low	29.4	Very low	126 Å²	126	151.5 Å²	151.5	82%	0.818	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-76.2	137.8	-168.3	30.7	-32.9	0	0	0	112.1	D1334	P1332-D1334 PolarHBondContact O-N 2.04Å
1333	T	32.5	Very low	29.8	Very low	130 Å²	130	143.1 Å²	143.1	80%	0.798	78%	0.784	S	S	*	*			trans	-72	108.6	170.8	46.4	0	0	0	0	109.8
1334	D	30.1	Very low	30.4	Very low	161 Å²	161	139.2 Å²	139.2	86%	0.861	77%	0.77	S	S	*	*			trans	-173.9	77.6	149.4	-89.7	-21.6	0	0	0	108.4	P1332	P1332-D1334 PolarHBondContact O-N 2.04Å
1335	V	31.7	Very low	30.7	Very low	131 Å²	131	137.3 Å²	137.3	79%	0.794	76%	0.76	S	S	*	*			trans	-128	111.7	166.9	-175.9	0	0	0	0	107.8	F1337	V1335-F1337 PolarHBondContact O-N 2.85Å
1336	Q	28.4	Very low	31.8	Very low	183 Å²	183	140.8 Å²	140.8	86%	0.855	76%	0.763	S	S	*	*			trans	-54.2	128	176.6	-72.8	174.5	-16.9	0	0	110.2	I1338	Q1336-I1338 PolarHBondContact O-N 3.39Å
1337	F	28.1	Very low	33.2	Very low	206 Å²	206	138.7 Å²	138.7	90%	0.904	74%	0.744	S	S	*	*			trans	-65.1	98.9	177	-86	-93.3	0	0	0	110.4	V1335	V1335-F1337 PolarHBondContact O-N 2.85Å
1338	I	31.9	Very low	34.1	Very low	144 Å²	144	133.6 Å²	133.6	74%	0.738	73%	0.725	S	S	*	*			trans	-79.9	117.3	157.6	-57.5	173.4	0	0	0	105.8	Q1336 T1340	Q1336-I1338 PolarHBondContact O-N 3.39Å; I1338-T1340 PolarHBondContact O-N 3.01Å
1339	P	27.7	Very low	35	Very low	118 Å²	118	133.2 Å²	133.2	77%	0.766	72%	0.717	S	S	*	*			trans	-68.2	101.2	-177.9	27.6	-31.7	0	0	0	108.9	K1341	P1339-K1341 PolarHBondContact O-N 3.29Å; P1339-K1341 VanDerWaalsContact O-N 3.11Å
1340	T	28.1	Very low	36.6	Very low	124 Å²	124	132.6 Å²	132.6	76%	0.761	71%	0.706	S	S	*	*			trans	-68.1	106.6	173.9	41.1	0	0	0	0	108.9	I1338 I1342	I1338-T1340 PolarHBondContact O-N 3.01Å; T1340-I1342 PolarHBondContact O-N 3.25Å; T1340-I1342 VanDerWaalsContact O-N 3.15Å
1341	K	31.9	Very low	37.7	Very low	196 Å²	196	129.2 Å²	129.2	85%	0.852	69%	0.69	S	S	*	*			trans	-70.1	106.6	172.2	-146.2	-178.5	-176.1	-170.2	0	106.7	P1339 P1343	P1339-K1341 PolarHBondContact O-N 3.29Å; P1339-K1341 VanDerWaalsContact O-N 3.11Å; K1341-P1343 WeakPolarHBondContact O-CD 3.43Å
1342	I	33.2	Very low	38.7	Very low	148 Å²	148	129.7 Å²	129.7	76%	0.759	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-67.3	120.3	177.9	-60.9	168.6	0	0	0	107.1	T1340 T1344	T1340-I1342 PolarHBondContact O-N 3.25Å; T1340-I1342 VanDerWaalsContact O-N 3.15Å; I1342-T1344 PolarHBondContact O-N 3.33Å
1343	P	36.1	Very low	40	Very low	58 Å²	58	128.6 Å²	128.6	38%	0.377	67%	0.667	S	S	.	*	P	Polyproline II helix	trans	-65.3	134.9	-173.8	23.6	-30.8	0	0	0	110.2	K1341 E1347	K1341-P1343 WeakPolarHBondContact O-CD 3.43Å; P1343-E1347 WeakPolarHBondContact CA-OE2 3.48Å; P1343-E1347 HydrophobicContact CB-CB 3.99Å; P1343-E1347 WeakPolarHBondContact CB-OE2 3.49Å
1344	T	37.9	Very low	41.3	Very low	86 Å²	86	128 Å²	128	53%	0.528	66%	0.656	S	S	.	*	P	Polyproline II helix	trans	-70.1	153.7	178.2	49.6	0	0	0	0	109.7	I1342 K1346 E1347 L1348	I1342-T1344 PolarHBondContact O-N 3.33Å; T1344-K1346 PolarHBondContact O-N 2.89Å; T1344-E1347 PolarHBondContact N-OE2 3.17Å; T1344-E1347 WeakPolarHBondContact O-CB 3.32Å; T1344-E1347 PolarHBondContact O-N 2.83Å; T1344-E1347 PolarHBondContact OG1-OE2 2.93Å; T1344-L1348 PolarHBondContact O-N 2.97Å
1345	S	34.2	Very low	42.2	Very low	89 Å²	89	126.2 Å²	126.2	62%	0.622	64%	0.642	S	S	*	*	H	α-helix	trans	-50.3	-28.1	-177.8	53.5	0	0	0	0	113.3	L1348 F1349	S1345-L1348 PolarHBondContact O-N 2.72Å; S1345-F1349 WeakPolarHBondContact O-CB 3.44Å; S1345-F1349 VanDerWaalsContact O-CD2 3.26Å; S1345-F1349 WeakPolarHBondContact O-CD2 3.32Å; S1345-F1349 PolarHBondContact O-N 3.07Å
1346	K	50.5	Low	43	Very low	170 Å²	170	122.8 Å²	122.8	74%	0.739	62%	0.624	S	S	*	*	H	α-helix	trans	-66.1	-40.2	174.9	-136	-178.3	-176.9	-172.9	0	113.4	T1344 Q1350	T1344-K1346 PolarHBondContact O-N 2.89Å; K1346-Q1350 WeakPolarHBondContact O-CB 3.4Å; K1346-Q1350 PolarHBondContact O-N 3.15Å
1347	E	57.3	Low	43.7	Very low	91 Å²	91	120.5 Å²	120.5	43%	0.425	61%	0.613	S	S	.	*	H	α-helix	trans	-71.6	-37.4	176.1	-69.7	164	151.1	0	0	110.9	P1343 T1344 Q1350 Q1351	P1343-E1347 WeakPolarHBondContact CA-OE2 3.48Å; P1343-E1347 HydrophobicContact CB-CB 3.99Å; P1343-E1347 WeakPolarHBondContact CB-OE2 3.49Å; T1344-E1347 PolarHBondContact N-OE2 3.17Å; T1344-E1347 WeakPolarHBondContact O-CB 3.32Å; T1344-E1347 PolarHBondContact O-N 2.83Å; T1344-E1347 PolarHBondContact OG1-OE2 2.93Å; E1347-Q1350 PolarHBondContact O-N 2.76Å; E1347-Q1351 PolarHBondContact O-N 3.35Å
1348	L	43.5	Very low	44.3	Very low	85 Å²	85	113.7 Å²	113.7	45%	0.445	59%	0.591	S	S	.	*	H	α-helix	trans	-63.6	-42.1	172.5	-93.2	160.8	0	0	0	112.2	T1344 S1345 Q1350 Q1351 L1352	T1344-L1348 PolarHBondContact O-N 2.97Å; S1345-L1348 PolarHBondContact O-N 2.72Å; L1348-Q1350 VanDerWaalsContact C-N 3.31Å; L1348-Q1351 PolarHBondContact O-N 3.31Å; L1348-L1352 WeakPolarHBondContact O-CB 3.28Å; L1348-L1352 WeakPolarHBondContact O-CG 3.42Å; L1348-L1352 PolarHBondContact O-N 3.38Å
1349	F	49.2	Very low	44.6	Very low	146 Å²	146	113 Å²	113	64%	0.64	59%	0.585	S	S	*	*	H	α-helix	trans	-68.3	-31.6	174.8	-93.3	-72.4	0	0	0	112.5	S1345 N1353	S1345-F1349 WeakPolarHBondContact O-CB 3.44Å; S1345-F1349 VanDerWaalsContact O-CD2 3.26Å; S1345-F1349 WeakPolarHBondContact O-CD2 3.32Å; S1345-F1349 PolarHBondContact O-N 3.07Å; F1349-N1353 WeakPolarHBondContact O-CB 3.49Å; F1349-N1353 PolarHBondContact O-N 3.46Å
1350	Q	60.5	Low	45.2	Very low	121 Å²	121	112.4 Å²	112.4	57%	0.565	58%	0.579	S	S	*	*	H	α-helix	trans	-72	-41.1	176	-161.9	167.6	-3.7	0	0	111.4	K1346 E1347 L1348 N1353 E1354	K1346-Q1350 WeakPolarHBondContact O-CB 3.4Å; K1346-Q1350 PolarHBondContact O-N 3.15Å; E1347-Q1350 PolarHBondContact O-N 2.76Å; L1348-Q1350 VanDerWaalsContact C-N 3.31Å; Q1350-N1353 PolarHBondContact O-N 3.39Å; Q1350-E1354 PolarHBondContact O-N 3.11Å
1351	Q	52.9	Low	45.6	Very low	115 Å²	115	114 Å²	114	54%	0.537	58%	0.578	S	S	.	*	H	α-helix	trans	-64.3	-40.4	172.8	-79.8	-176	-33.1	0	0	112.7	E1347 L1348 N1353 E1354 E1355	E1347-Q1351 PolarHBondContact O-N 3.35Å; L1348-Q1351 PolarHBondContact O-N 3.31Å; Q1351-N1353 VanDerWaalsContact C-N 3.3Å; Q1351-N1353 PolarHBondContact O-N 3.36Å; Q1351-E1354 PolarHBondContact O-N 2.96Å; Q1351-E1355 PolarHBondContact O-N 3.3Å
1352	L	54.6	Low	45.8	Very low	95 Å²	95	109.3 Å²	109.3	50%	0.497	57%	0.566	S	S	.	*	H	α-helix	trans	-65.2	-33.8	174.3	-80.2	162.8	0	0	0	112.4	L1348 S1356	L1348-L1352 WeakPolarHBondContact O-CB 3.28Å; L1348-L1352 WeakPolarHBondContact O-CG 3.42Å; L1348-L1352 PolarHBondContact O-N 3.38Å; L1352-S1356 WeakPolarHBondContact O-CB 3.3Å; L1352-S1356 PolarHBondContact O-N 3.49Å; L1352-S1356 PolarHBondContact O-OG 2.84Å
1353	N	60.4	Low	45.8	Very low	103 Å²	103	108.7 Å²	108.7	55%	0.551	56%	0.564	S	S	*	*	H	α-helix	trans	-71.2	-34.2	173.2	-94.4	6.8	0	0	0	112.5	F1349 Q1350 Q1351 S1356 Q1357	F1349-N1353 WeakPolarHBondContact O-CB 3.49Å; F1349-N1353 PolarHBondContact O-N 3.46Å; Q1350-N1353 PolarHBondContact O-N 3.39Å; Q1351-N1353 VanDerWaalsContact C-N 3.3Å; Q1351-N1353 PolarHBondContact O-N 3.36Å; N1353-S1356 WeakPolarHBondContact CA-OG 3.44Å; N1353-S1356 PolarHBondContact O-OG 3.16Å; N1353-S1356 VanDerWaalsContact O-OG 3.11Å; N1353-Q1357 WeakPolarHBondContact O-CG 3.13Å; N1353-Q1357 PolarHBondContact O-N 3.25Å
1354	E	59.7	Low	45.6	Very low	119 Å²	119	109.5 Å²	109.5	56%	0.556	58%	0.576	S	S	*	*	H	α-helix	trans	-71.9	-39.8	174.2	-73.7	174.8	-174.8	0	0	111.7	Q1350 Q1351 Q1357 S1358	Q1350-E1354 PolarHBondContact O-N 3.11Å; Q1351-E1354 PolarHBondContact O-N 2.96Å; E1354-Q1357 PolarHBondContact O-N 3.32Å; E1354-S1358 PolarHBondContact O-N 3.48Å
1355	E	48.9	Very low	45.2	Very low	123 Å²	123	113.8 Å²	113.8	58%	0.575	59%	0.59	S	S	*	*	H	α-helix	trans	-64.7	-42.6	175.4	-80.7	-178	162.4	0	0	111.7	Q1351 Q1357 S1358 E1359	Q1351-E1355 PolarHBondContact O-N 3.3Å; E1355-Q1357 VanDerWaalsContact C-N 3.31Å; E1355-Q1357 PolarHBondContact O-N 3.13Å; E1355-S1358 PolarHBondContact O-N 3.34Å; E1355-S1358 VanDerWaalsContact O-N 3.1Å; E1355-S1358 PolarHBondContact O-OG 3.41Å; E1355-E1359 PolarHBondContact O-N 3.01Å
1356	S	48	Very low	44.9	Very low	58 Å²	58	114.4 Å²	114.4	41%	0.406	59%	0.594	S	S	.	*	H	α-helix	trans	-67.5	-28.4	177	55.8	0	0	0	0	113.8	L1352 N1353 T1360	L1352-S1356 WeakPolarHBondContact O-CB 3.3Å; L1352-S1356 PolarHBondContact O-N 3.49Å; L1352-S1356 PolarHBondContact O-OG 2.84Å; N1353-S1356 WeakPolarHBondContact CA-OG 3.44Å; N1353-S1356 PolarHBondContact O-OG 3.16Å; N1353-S1356 VanDerWaalsContact O-OG 3.11Å; S1356-T1360 PolarHBondContact O-N 3.4Å; S1356-T1360 PolarHBondContact O-OG1 3.23Å
1357	Q	42.1	Very low	43.7	Very low	135 Å²	135	114.3 Å²	114.3	63%	0.631	60%	0.601	S	S	*	*	H	α-helix	trans	-72.1	-34.5	170.3	-74.1	-178.4	0.2	0	0	111.8	N1353 E1354 E1355 T1360 E1361	N1353-Q1357 WeakPolarHBondContact O-CG 3.13Å; N1353-Q1357 PolarHBondContact O-N 3.25Å; E1354-Q1357 PolarHBondContact O-N 3.32Å; E1355-Q1357 VanDerWaalsContact C-N 3.31Å; E1355-Q1357 PolarHBondContact O-N 3.13Å; Q1357-T1360 PolarHBondContact O-N 2.88Å; Q1357-T1360 PolarHBondContact O-OG1 3.07Å; Q1357-E1361 PolarHBondContact O-N 2.83Å
1358	S	42.1	Very low	42.1	Very low	64 Å²	64	116.4 Å²	116.4	45%	0.448	62%	0.62	S	S	.	*	H	α-helix	trans	-71.6	-31.6	176.1	77.3	0	0	0	0	113.7	E1354 E1355 T1360 T1362	E1354-S1358 PolarHBondContact O-N 3.48Å; E1355-S1358 PolarHBondContact O-N 3.34Å; E1355-S1358 VanDerWaalsContact O-N 3.1Å; E1355-S1358 PolarHBondContact O-OG 3.41Å; S1358-T1360 VanDerWaalsContact C-N 3.33Å; S1358-T1362 PolarHBondContact O-N 3.1Å; S1358-T1362 PolarHBondContact O-OG1 3.07Å
1359	E	38.6	Very low	41.4	Very low	129 Å²	129	117.8 Å²	117.8	60%	0.603	64%	0.636	S	S	*	*	H	α-helix	trans	-75.2	-21.6	175.9	-74.3	-170.8	162	0	0	113.1	E1355 N1363	E1355-E1359 PolarHBondContact O-N 3.01Å; E1359-N1363 PolarHBondContact O-ND2 3.33Å
1360	T	39.6	Very low	40.5	Very low	105 Å²	105	120.7 Å²	120.7	64%	0.644	65%	0.649	S	S	*	*	H	α-helix	trans	-81.7	-27.1	174.8	26	0	0	0	0	113	S1356 Q1357 S1358	S1356-T1360 PolarHBondContact O-N 3.4Å; S1356-T1360 PolarHBondContact O-OG1 3.23Å; Q1357-T1360 PolarHBondContact O-N 2.88Å; Q1357-T1360 PolarHBondContact O-OG1 3.07Å; S1358-T1360 VanDerWaalsContact C-N 3.33Å
1361	E	37.1	Very low	38.9	Very low	157 Å²	157	123.1 Å²	123.1	73%	0.734	67%	0.665	S	S	*	*	H	α-helix	trans	-83	-26	174.6	-71.8	-171.5	163.8	0	0	113.6	Q1357	Q1357-E1361 PolarHBondContact O-N 2.83Å
1362	T	36.1	Very low	37.8	Very low	98 Å²	98	123.1 Å²	123.1	60%	0.601	68%	0.675	S	S	*	*	H	α-helix	trans	-82.7	-20.2	-177.3	42.4	0	0	0	0	114.6	S1358 A1364	S1358-T1362 PolarHBondContact O-N 3.1Å; S1358-T1362 PolarHBondContact O-OG1 3.07Å; T1362-A1364 PolarHBondContact O-N 3.49Å
1363	N	31.6	Very low	36.5	Very low	135 Å²	135	124 Å²	124	72%	0.722	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-2.5	177.4	-78.7	-41.9	0	0	0	114.9	E1359	E1359-N1363 PolarHBondContact O-ND2 3.33Å
1364	A	32.9	Very low	35	Very low	76 Å²	76	126.6 Å²	126.6	63%	0.628	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-8.8	179.3	0	0	0	0	0	114.8	T1362	T1362-A1364 PolarHBondContact O-N 3.49Å
1365	H	30.1	Very low	33.5	Very low	176 Å²	176	130.2 Å²	130.2	82%	0.815	72%	0.715	S	S	*	*	S	Bend	trans	-122.9	17.1	-167.3	-89.4	-55.5	0	0	0	118.4
1366	S	27.8	Very low	32.6	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	73%	0.726	S	S	*	*			trans	-131	23	178.6	70.7	0	0	0	0	117.1
1367	L	25.2	Very low	31.7	Very low	168 Å²	168	138 Å²	138	88%	0.88	75%	0.748	S	S	*	*	S	Bend	trans	-104.4	56.1	168.2	-84	165.1	0	0	0	111.6
1368	T	24.1	Very low	31	Very low	134 Å²	134	141.3 Å²	141.3	82%	0.822	76%	0.761	S	S	*	*			trans	-169.7	92	159.9	35.7	0	0	0	0	111.2
1369	S	27.5	Very low	30.5	Very low	114 Å²	114	143.1 Å²	143.1	80%	0.797	77%	0.774	S	S	*	*			trans	-178.2	112.2	142.5	54.2	0	0	0	0	113.9
1370	K	30	Very low	30.2	Very low	207 Å²	207	146.3 Å²	146.3	90%	0.9	81%	0.81	S	S	*	*			trans	58.4	101.8	138.5	-66.9	179.9	176.5	176.6	0	119.7
1371	L	27.7	Very low	29.8	Very low	172 Å²	172	148.4 Å²	148.4	90%	0.901	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-55.7	137.7	156.6	-105.5	85.1	0	0	0	112.1
1372	P	30	Very low	29.4	Very low	116 Å²	116	147.9 Å²	147.9	75%	0.753	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-89.8	133.2	174	33.3	-28.2	0	0	0	112
1373	S	27.9	Very low	29	Very low	113 Å²	113	150.7 Å²	150.7	79%	0.79	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-68	118.7	177.2	51.2	0	0	0	0	112.7	K1375	S1373-K1375 PolarHBondContact O-N 3.17Å
1374	I	28.1	Very low	28.8	Very low	158 Å²	158	151.6 Å²	151.6	81%	0.81	84%	0.841	S	S	*	*			trans	-80	111.4	171.5	-64.1	168.6	0	0	0	108.5
1375	K	27.6	Very low	28.6	Very low	195 Å²	195	156.3 Å²	156.3	85%	0.848	86%	0.855	S	S	*	*			trans	-79.1	115.9	174.2	-84.7	179.1	173.7	177.2	0	110	S1373	S1373-K1375 PolarHBondContact O-N 3.17Å
1376	I	30.3	Very low	28.5	Very low	157 Å²	157	155 Å²	155	81%	0.805	86%	0.857	S	S	*	*			trans	-88.2	113.4	165.3	-63.7	169.1	0	0	0	107.1
1377	Q	30	Very low	28.5	Very low	186 Å²	186	158.8 Å²	158.8	87%	0.869	87%	0.868	S	S	*	*			trans	-86.1	110.7	-175.5	-151.3	168.2	-5.9	0	0	108.9
1378	K	26.2	Very low	28.8	Very low	206 Å²	206	158.1 Å²	158.1	90%	0.896	87%	0.867	S	S	*	*			trans	-77.5	126.6	164.4	-80.6	178.6	172.4	-179.9	0	108.5
1379	S	32.1	Very low	29.2	Very low	102 Å²	102	160.1 Å²	160.1	71%	0.713	87%	0.871	S	S	*	*			trans	-142.5	114.8	160.5	56.8	0	0	0	0	108.3
1380	S	32.8	Very low	29.3	Very low	195 Å²	195	164.3 Å²	164.3	100%	1.364	88%	0.877	S	S	*	*			trans	47.4	0	167.9	63.3	0	0	0	0	118.2

Retrieved 1,380 of 1,380 residues in 395.7 ms (Link to these results)

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