A0A087XW37_POEFO Loading...

Integrator complex subunit 3

AlphaFold DB , UniProt , Accession A0A087XW37, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,037 aa.

						>A0A087XW37_POEFO|A0A087XW37
MEPAPAKAKPQGRLLVSTQLDAKDELEERLERCVVIVQALTNGLSEREANDALTANVCKGQQQHEEVCLGLFTLVLTEPTQAQRCYRDLTLVNRDGMNIVLVKINQILMEKFLKLQDNPRTQLVWLVRELVKSGVIGADGVIMTLLKQIAGGDISAKNIWLAESVLDILLEQKEWVLKSGMLIAMSVYTYLRLIVDHGTPNLLPLRQKEVDFCISMLREKFMECLIIGRDLVRLLQNVARIPEMELLWRDLLHNPQVLSPQFTGILQLLTARTSRKFLACRLTPDMETKLLFMTSRVRFGQQKRYQDWFQRQYLSTAESQSLRCDLIRYICGVVHPSNEVLSSDILPRWAIIGWLLTTCTSNVAASNAKLALFYDWLFFNPEKDSIMNIEPAILVMHHSMKPHPAITATLLDFMCRIIPHFFPPLETQVRQGVFNSLNFIMEKRVLAHLAPLFDNPKLDRELRSMLRERFPEFCSPPSPPTEVKMEEAVSMEMDNHVLDKEEGCYDHTEAAFSDDEEEVNNKGKKREFRFHPIKEAVIEEPADITPWLDQLDDTMKEKVQQIQKTRKYGCLHSDQVSDVCPPLSDTETQCEVMQEVVDLIMEDDFDTEQMSALASCLAELFKDHFRGEVLPEEITEESLEESVSKPVCLIFRNLVTMQEDNSGFSVLLDMLAELYQKQPKIGYHLLYYLKASKAANGKMMLYESFAQATALGDLHTCLMMDMKACQEDDVRLLCYLTPSIYSEFPDETLRSGELLNMIVAVIDSMQLQELMCHVMMGNLVMFRKDSVLNILIQSLEWETFEQYSTWQLFLAHSIPLETIIPILQHLKYKEHPEALSCLLLQLRREKPSEEMVKMVLSRPCHPEDQFTTSILRHWASKYDDTLGEHIKAQLIKNNNQPRKRQSLRSSSSKLAQLTLEQILEHLDNLRLSLSNMKNNFFTQTPILQALQHVQASCDEAHKMRFSDLFALAEEYEDSQAKPLKSRRKAPASSPRSRKGVAPPTNNEEESASSSASEEEDSKPKAPKRKRKGSSAVGSDSD
					

Structure Viewer

Loading PAE data...

(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	38.2	Very low	42.4	Very low	244 Å²	244	148.3 Å²	148.3	100%	1.202	84%	0.842	S	S	*	*				0	122.6	0	-73.3	170.9	171.9	0	0	106.5
2	E	29.3	Very low	45.5	Very low	186 Å²	186	136.9 Å²	136.9	87%	0.869	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-71.2	150.8	166.7	-67.8	173.7	120.8	0	0	109.2	A4	E2-A4 PolarHBondContact O-N 3.36Å
3	P	40.7	Very low	48.7	Very low	123 Å²	123	138.2 Å²	138.2	80%	0.799	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-64.3	127.3	169	28.4	-32.9	0	0	0	108.8
4	A	35.6	Very low	51.9	Low	90 Å²	90	128.6 Å²	128.6	74%	0.744	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-58.4	137.8	175.7	0	0	0	0	0	109.9	E2 A6	E2-A4 PolarHBondContact O-N 3.36Å; A4-A6 PolarHBondContact O-N 3.25Å
5	P	40.8	Very low	54.8	Low	122 Å²	122	120.2 Å²	120.2	79%	0.792	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-59	129.4	-179.4	24.3	-33.7	0	0	0	109.6	K7	P5-K7 PolarHBondContact O-N 3.15Å; P5-K7 VanDerWaalsContact O-N 3.15Å
6	A	38.2	Very low	57.1	Low	99 Å²	99	117.6 Å²	117.6	82%	0.818	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-56	122.6	176.1	0	0	0	0	0	108.8	A4 A8	A4-A6 PolarHBondContact O-N 3.25Å; A6-A8 PolarHBondContact O-N 3.31Å
7	K	37.9	Very low	59	Low	207 Å²	207	112.9 Å²	112.9	90%	0.9	63%	0.632	S	S	*	*			trans	-56.2	115	177.5	-74.7	-176.3	175.9	-179.2	0	108.3	P5 K9	P5-K7 PolarHBondContact O-N 3.15Å; P5-K7 VanDerWaalsContact O-N 3.15Å; K7-K9 PolarHBondContact O-N 3Å
8	A	41.7	Very low	60.6	Low	95 Å²	95	111.2 Å²	111.2	79%	0.785	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-53	132.2	172.1	0	0	0	0	0	108.7	A6	A6-A8 PolarHBondContact O-N 3.31Å
9	K	46.8	Very low	62	Low	189 Å²	189	116.2 Å²	116.2	82%	0.822	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-56.5	141	169.2	-70.6	178.8	178.4	175.6	0	107.8	K7 Q11	K7-K9 PolarHBondContact O-N 3Å; K9-Q11 PolarHBondContact O-N 3.09Å; K9-Q11 VanDerWaalsContact O-N 3.09Å
10	P	52.4	Low	63.3	Low	132 Å²	132	119 Å²	119	86%	0.857	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-57.5	120.7	172.8	25.2	-33.1	0	0	0	108.6
11	Q	65.2	Low	64.5	Low	144 Å²	144	115.8 Å²	115.8	67%	0.673	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-78.3	132.8	177.9	-167.1	170.1	10.2	0	0	108.4	K9	K9-Q11 PolarHBondContact O-N 3.09Å; K9-Q11 VanDerWaalsContact O-N 3.09Å
12	G	78.8	Confident	66.9	Low	12 Å²	12	108.4 Å²	108.4	12%	0.124	62%	0.615	C	S	.	*	P	Polyproline II helix	trans	-58.7	154	178.1	0	0	0	0	0	112.1	E27 Q116	G12-E27 VanDerWaalsContact CA-OE1 3.29Å; G12-E27 WeakPolarHBondContact CA-OE1 3.15Å; G12-Q116 PolarHBondContact O-NE2 3.44Å
13	R	87.8	Confident	69.6	Low	153 Å²	153	105.3 Å²	105.3	58%	0.577	60%	0.599	S	S	*	*	S	Bend	trans	-96.3	-9.5	-180	-64	-169	-172.4	-165.4	2.5	113.9	E27 T77 E78 P119	R13-E27 PolarHBondContact N-OE1 3.33Å; R13-T77 HydrophobicContact CB-CG2 3.73Å; R13-E78 IonicContact CZ-OE1 3.15Å; R13-E78 IonicContact NH1-OE1 3.86Å; R13-E78 PolarHBondContact NH1-OE1 3.44Å; R13-P119 WeakPolarHBondContact O-CG 3.45Å
14	L	93.1	Very high	72.1	Confident	5 Å²	5	100.8 Å²	100.8	3%	0.026	57%	0.568	C	S	.	*	S	Bend	trans	-103.5	-47.7	-176.1	-172.3	70.3	0	0	0	110.8	E27 L30 L76 I107 L115 Q116 P119	L14-E27 WeakPolarHBondContact CA-OE1 3.27Å; L14-E27 HydrophobicContact CB-CG 4.05Å; L14-E27 VanDerWaalsContact CB-OE1 3.29Å; L14-E27 WeakPolarHBondContact CB-OE1 3.42Å; L14-E27 PolarHBondContact N-OE1 2.92Å; L14-L30 HydrophobicContact CD2-CD1 3.69Å; L14-L76 HydrophobicContact CD1-CB 4.2Å; L14-L76 HydrophobicContact CD1-CD1 3.75Å; L14-I107 HydrophobicContact CD2-CD1 4.36Å; L14-L115 HydrophobicContact CD1-CD1 3.85Å; L14-L115 HydrophobicContact CG-CD1 4.03Å; L14-Q116 PolarHBondContact O-N 3.19Å; L14-P119 HydrophobicContact CD1-CB 4.01Å; L14-P119 HydrophobicContact CD1-CG 4.41Å
15	L	95.1	Very high	74.9	Confident	2 Å²	2	103.9 Å²	103.9	1%	0.01	57%	0.567	C	S	.	*	B	Isolated β-bridge	trans	-113.8	146.5	-170.4	-55.6	-178.1	0	0	0	113.1	S17 D24 E27 K111 K114 L115 Q116	L15-S17 PolarHBondContact O-N 3.31Å; L15-D24 HydrophobicContact CD1-CB 3.71Å; L15-E27 HydrophobicContact CD1-CB 4.14Å; L15-E27 HydrophobicContact CG-CB 4.42Å; L15-E27 PolarHBondContact N-OE1 3.18Å; L15-K111 HydrophobicContact CD1-CD 4.38Å; L15-K111 HydrophobicContact CD2-CB 3.98Å; L15-K114 CarbonylContact C-O 3.57Å; L15-K114 WeakPolarHBondContact CA-O 3.34Å; L15-K114 HydrophobicContact CD2-CB 4.49Å; L15-L115 HydrophobicContact CD2-CD1 4.17Å; L15-Q116 PolarHBondContact O-NE2 3.49Å
16	V	92.6	Very high	77.4	Confident	79 Å²	79	98.7 Å²	98.7	48%	0.479	53%	0.533	S	S	.	.			trans	-73.8	110.4	167.6	-179.2	0	0	0	0	107.5	K114 Q116	V16-K114 PolarHBondContact N-O 2.72Å; V16-Q116 HydrophobicContact CG2-CG 3.78Å
17	S	88.8	Confident	80.1	Confident	37 Å²	37	94.3 Å²	94.3	26%	0.259	50%	0.495	S	S	.	.			trans	-118.9	129	175	-64.7	0	0	0	0	110.2	L15	L15-S17 PolarHBondContact O-N 3.31Å
18	T	88.8	Confident	82.8	Confident	82 Å²	82	88.1 Å²	88.1	50%	0.503	47%	0.47	S	S	.	.			trans	-87.5	-178.1	171.6	72.7	0	0	0	0	111.1	L20 D21	T18-L20 PolarHBondContact O-N 3.44Å; T18-L20 PolarHBondContact OG1-N 2.57Å; T18-L20 VanDerWaalsContact OG1-N 3.15Å; T18-D21 WeakPolarHBondContact CA-OD2 3.43Å; T18-D21 VanDerWaalsContact CB-OD2 3.27Å; T18-D21 WeakPolarHBondContact CB-OD2 3.45Å; T18-D21 WeakPolarHBondContact CG2-OD2 3.3Å; T18-D21 PolarHBondContact N-OD2 2.73Å; T18-D21 PolarHBondContact OG1-N 2.93Å; T18-D21 PolarHBondContact OG1-OD2 3.15Å
19	Q	85.5	Confident	85.4	Confident	207 Å²	207	87.7 Å²	87.7	97%	0.967	45%	0.448	S	S	*	.	S	Bend	trans	-71.1	-14.7	172	-61.5	-174	11.1	0	0	113.6
20	L	89.4	Confident	87.7	Confident	171 Å²	171	78.8 Å²	78.8	90%	0.895	41%	0.409	S	S	*	.	S	Bend	trans	-94.1	-18.3	179.1	-73.8	164.8	0	0	0	112.9	T18	T18-L20 PolarHBondContact O-N 3.44Å; T18-L20 PolarHBondContact OG1-N 2.57Å; T18-L20 VanDerWaalsContact OG1-N 3.15Å
21	D	87.3	Confident	89.8	Confident	52 Å²	52	75.5 Å²	75.5	28%	0.278	38%	0.382	S	S	.	.	S	Bend	trans	-72.4	136.3	178.5	-71.6	-84.3	0	0	0	111.6	T18 K114	T18-D21 WeakPolarHBondContact CA-OD2 3.43Å; T18-D21 VanDerWaalsContact CB-OD2 3.27Å; T18-D21 WeakPolarHBondContact CB-OD2 3.45Å; T18-D21 WeakPolarHBondContact CG2-OD2 3.3Å; T18-D21 PolarHBondContact N-OD2 2.73Å; T18-D21 PolarHBondContact OG1-N 2.93Å; T18-D21 PolarHBondContact OG1-OD2 3.15Å; D21-K114 IonicContact OD1-NZ 3.25Å; D21-K114 PolarHBondContact OD1-NZ 3.12Å
22	A	88.9	Confident	91.2	Very high	90 Å²	90	74.9 Å²	74.9	74%	0.744	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-67.7	152.7	163.4	0	0	0	0	0	110.2	D24	A22-D24 PolarHBondContact O-N 3.37Å
23	K	87	Confident	92.1	Very high	120 Å²	120	74.5 Å²	74.5	52%	0.522	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-64.8	130.5	174.7	-167.5	-179.6	-174.5	-172.6	0	109.3	E28 E31	K23-E28 HydrophobicContact CD-CB 4.29Å; K23-E28 WeakPolarHBondContact CD-OE1 3.32Å; K23-E28 WeakPolarHBondContact CE-OE1 3.35Å; K23-E28 IonicContact NZ-OE1 2.75Å; K23-E28 PolarHBondContact NZ-OE1 2.72Å; K23-E31 IonicContact NZ-OE2 2.73Å; K23-E31 PolarHBondContact NZ-OE2 3.31Å; K23-E31 VanDerWaalsContact NZ-OE2 3.15Å
24	D	92.7	Very high	92.5	Very high	28 Å²	28	68 Å²	68	15%	0.15	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-78.6	127.2	-179.8	-167.6	-79.5	0	0	0	111.5	L15 A22 L26 E27 E28 K111	L15-D24 HydrophobicContact CD1-CB 3.71Å; A22-D24 PolarHBondContact O-N 3.37Å; D24-L26 VanDerWaalsContact C-N 3.33Å; D24-L26 PolarHBondContact O-N 2.94Å; D24-L26 WeakPolarHBondContact OD1-CA 3.37Å; D24-L26 VanDerWaalsContact OD1-CB 3.29Å; D24-L26 WeakPolarHBondContact OD1-CB 3.24Å; D24-L26 PolarHBondContact OD1-N 3.23Å; D24-E27 HydrophobicContact CB-CB 4.11Å; D24-E27 PolarHBondContact O-N 3.09Å; D24-E27 PolarHBondContact OD1-N 2.87Å; D24-E28 PolarHBondContact O-N 3.49Å; D24-K111 IonicContact OD1-NZ 3.74Å; D24-K111 WeakPolarHBondContact OD2-CE 3.35Å; D24-K111 IonicContact OD2-NZ 2.64Å; D24-K111 PolarHBondContact OD2-NZ 3.28Å
25	E	94.1	Very high	92.7	Very high	155 Å²	155	72.2 Å²	72.2	72%	0.724	37%	0.372	S	S	*	.	H	α-helix	trans	-66.6	-33.1	-177.4	-169.3	-173.4	168	0	0	112.5	R29	E25-R29 WeakPolarHBondContact O-CB 3.49Å; E25-R29 PolarHBondContact O-N 3.28Å
26	L	93.9	Very high	92.8	Very high	14 Å²	14	74.7 Å²	74.7	7%	0.073	38%	0.384	C	S	.	.	H	α-helix	trans	-71.4	-43.9	178.1	-178.9	61.8	0	0	0	110.1	D24 R29 L30 K103 Q106 I107 K111	D24-L26 VanDerWaalsContact C-N 3.33Å; D24-L26 PolarHBondContact O-N 2.94Å; D24-L26 WeakPolarHBondContact OD1-CA 3.37Å; D24-L26 VanDerWaalsContact OD1-CB 3.29Å; D24-L26 WeakPolarHBondContact OD1-CB 3.24Å; D24-L26 PolarHBondContact OD1-N 3.23Å; L26-R29 PolarHBondContact O-N 2.68Å; L26-L30 HydrophobicContact CD1-CD1 4.16Å; L26-L30 HydrophobicContact CD1-CG 4.27Å; L26-L30 HydrophobicContact CG-CD1 4.04Å; L26-L30 WeakPolarHBondContact O-CB 3.36Å; L26-L30 VanDerWaalsContact O-CG 3.22Å; L26-L30 WeakPolarHBondContact O-CG 3.42Å; L26-L30 PolarHBondContact O-N 3.28Å; L26-K103 HydrophobicContact CD1-CD 4.31Å; L26-Q106 HydrophobicContact CD2-CG 4.21Å; L26-I107 HydrophobicContact CD2-CG1 3.87Å; L26-K111 HydrophobicContact CD2-CG 4.23Å
27	E	94.8	Very high	93	Very high	6 Å²	6	71 Å²	71	3%	0.028	36%	0.362	C	S	.	.	H	α-helix	trans	-59	-47.9	172.2	-174.2	168	-138.6	0	0	110.9	G12 R13 L14 L15 D24 R29 L30 E31	G12-E27 VanDerWaalsContact CA-OE1 3.29Å; G12-E27 WeakPolarHBondContact CA-OE1 3.15Å; R13-E27 PolarHBondContact N-OE1 3.33Å; L14-E27 WeakPolarHBondContact CA-OE1 3.27Å; L14-E27 HydrophobicContact CB-CG 4.05Å; L14-E27 VanDerWaalsContact CB-OE1 3.29Å; L14-E27 WeakPolarHBondContact CB-OE1 3.42Å; L14-E27 PolarHBondContact N-OE1 2.92Å; L15-E27 HydrophobicContact CD1-CB 4.14Å; L15-E27 HydrophobicContact CG-CB 4.42Å; L15-E27 PolarHBondContact N-OE1 3.18Å; D24-E27 HydrophobicContact CB-CB 4.11Å; D24-E27 PolarHBondContact O-N 3.09Å; D24-E27 PolarHBondContact OD1-N 2.87Å; E27-R29 VanDerWaalsContact C-N 3.32Å; E27-R29 PolarHBondContact O-N 3.35Å; E27-L30 PolarHBondContact O-N 2.89Å; E27-L30 VanDerWaalsContact O-N 3.16Å; E27-E31 HydrophobicContact CG-CG 4.35Å; E27-E31 WeakPolarHBondContact O-CB 3.19Å; E27-E31 WeakPolarHBondContact O-CG 3.46Å; E27-E31 PolarHBondContact O-N 3.14Å
28	E	94.3	Very high	93.3	Very high	78 Å²	78	73.4 Å²	73.4	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-33.2	177.7	-178.3	158.9	-107.1	0	0	113.7	K23 D24 R32	K23-E28 HydrophobicContact CD-CB 4.29Å; K23-E28 WeakPolarHBondContact CD-OE1 3.32Å; K23-E28 WeakPolarHBondContact CE-OE1 3.35Å; K23-E28 IonicContact NZ-OE1 2.75Å; K23-E28 PolarHBondContact NZ-OE1 2.72Å; D24-E28 PolarHBondContact O-N 3.49Å; E28-R32 WeakPolarHBondContact O-CG 3.42Å; E28-R32 PolarHBondContact O-N 3.37Å; E28-R32 PolarHBondContact O-NE 3.28Å
29	R	95.6	Very high	93.6	Very high	86 Å²	86	73.7 Å²	73.7	33%	0.325	38%	0.38	S	S	.	.	H	α-helix	trans	-68.1	-44.6	173.3	-171.7	174.4	-176	-145.9	-8.6	111	E25 L26 E27 R32 C33 E65	E25-R29 WeakPolarHBondContact O-CB 3.49Å; E25-R29 PolarHBondContact O-N 3.28Å; L26-R29 PolarHBondContact O-N 2.68Å; E27-R29 VanDerWaalsContact C-N 3.32Å; E27-R29 PolarHBondContact O-N 3.35Å; R29-R32 PolarHBondContact O-N 2.96Å; R29-C33 PolarHBondContact O-N 2.9Å; R29-C33 VanDerWaalsContact O-N 3.16Å; R29-C33 PolarHBondContact O-SG 3.44Å; R29-E65 IonicContact CZ-OE1 3.38Å; R29-E65 VanDerWaalsContact CZ-OE1 3.27Å; R29-E65 IonicContact NH1-OE1 2.93Å; R29-E65 PolarHBondContact NH1-OE1 3.27Å; R29-E65 IonicContact NH2-OE1 2.76Å; R29-E65 PolarHBondContact NH2-OE1 2.74Å; R29-E65 IonicContact NH2-OE2 3.47Å; R29-E65 PolarHBondContact NH2-OE2 3.17Å
30	L	96.4	Very high	94	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-67.5	-41	-180	-69.4	175.7	0	0	0	112.1	L14 L26 E27 R32 C33 V34 L69 F72 T73 I107	L14-L30 HydrophobicContact CD2-CD1 3.69Å; L26-L30 HydrophobicContact CD1-CD1 4.16Å; L26-L30 HydrophobicContact CD1-CG 4.27Å; L26-L30 HydrophobicContact CG-CD1 4.04Å; L26-L30 WeakPolarHBondContact O-CB 3.36Å; L26-L30 VanDerWaalsContact O-CG 3.22Å; L26-L30 WeakPolarHBondContact O-CG 3.42Å; L26-L30 PolarHBondContact O-N 3.28Å; E27-L30 PolarHBondContact O-N 2.89Å; E27-L30 VanDerWaalsContact O-N 3.16Å; L30-R32 VanDerWaalsContact C-N 3.33Å; L30-R32 PolarHBondContact O-N 3.41Å; L30-C33 WeakPolarHBondContact O-CB 3.37Å; L30-C33 PolarHBondContact O-N 3.4Å; L30-C33 VanDerWaalsContact O-N 3.14Å; L30-V34 PolarHBondContact O-N 2.76Å; L30-L69 HydrophobicContact CD2-CB 3.99Å; L30-L69 HydrophobicContact CD2-CD1 4.27Å; L30-L69 HydrophobicContact CD2-CD2 4.5Å; L30-L69 HydrophobicContact CD2-CG 4.49Å; L30-F72 HydrophobicContact CD2-CD1 4.33Å; L30-F72 HydrophobicContact CD2-CE1 4.48Å; L30-T73 HydrophobicContact CB-CG2 4.06Å; L30-T73 WeakPolarHBondContact CB-OG1 3.21Å; L30-T73 WeakPolarHBondContact CD2-OG1 3.45Å; L30-I107 HydrophobicContact CD1-CD1 4.1Å
31	E	95	Very high	94.2	Very high	63 Å²	63	59 Å²	59	29%	0.294	31%	0.31	S	S	.	.	H	α-helix	trans	-56.5	-43.4	171.6	-74.5	-176.8	148.8	0	0	112.2	K23 E27 C33 V34 V35	K23-E31 IonicContact NZ-OE2 2.73Å; K23-E31 PolarHBondContact NZ-OE2 3.31Å; K23-E31 VanDerWaalsContact NZ-OE2 3.15Å; E27-E31 HydrophobicContact CG-CG 4.35Å; E27-E31 WeakPolarHBondContact O-CB 3.19Å; E27-E31 WeakPolarHBondContact O-CG 3.46Å; E27-E31 PolarHBondContact O-N 3.14Å; E31-C33 VanDerWaalsContact C-N 3.34Å; E31-C33 PolarHBondContact O-N 3.31Å; E31-V34 WeakPolarHBondContact O-CB 3.44Å; E31-V34 PolarHBondContact O-N 3.38Å; E31-V35 PolarHBondContact O-N 3.33Å; E31-V35 VanDerWaalsContact O-N 3.09Å
32	R	96.1	Very high	94.4	Very high	132 Å²	132	63.4 Å²	63.4	50%	0.498	33%	0.333	S	S	.	.	H	α-helix	trans	-62.6	-39.9	175.7	-76.7	175.6	-73.9	173.9	-4.8	112.1	E28 R29 L30 V35 I36	E28-R32 WeakPolarHBondContact O-CG 3.42Å; E28-R32 PolarHBondContact O-N 3.37Å; E28-R32 PolarHBondContact O-NE 3.28Å; R29-R32 PolarHBondContact O-N 2.96Å; L30-R32 VanDerWaalsContact C-N 3.33Å; L30-R32 PolarHBondContact O-N 3.41Å; R32-V35 PolarHBondContact O-N 3.45Å; R32-I36 WeakPolarHBondContact O-CG1 3.36Å; R32-I36 PolarHBondContact O-N 3.34Å; R32-I36 VanDerWaalsContact O-N 3.14Å
33	C	97.5	Very high	94.4	Very high	4 Å²	4	62.8 Å²	62.8	3%	0.027	34%	0.336	C	S	.	.	H	α-helix	trans	-63.7	-38	174.3	-63.8	0	0	0	0	112.4	R29 L30 E31 I36 V37 E66 L69 G70	R29-C33 PolarHBondContact O-N 2.9Å; R29-C33 VanDerWaalsContact O-N 3.16Å; R29-C33 PolarHBondContact O-SG 3.44Å; L30-C33 WeakPolarHBondContact O-CB 3.37Å; L30-C33 PolarHBondContact O-N 3.4Å; L30-C33 VanDerWaalsContact O-N 3.14Å; E31-C33 VanDerWaalsContact C-N 3.34Å; E31-C33 PolarHBondContact O-N 3.31Å; C33-I36 PolarHBondContact O-N 3.14Å; C33-V37 PolarHBondContact O-N 3.16Å; C33-E66 WeakPolarHBondContact CB-O 3.27Å; C33-L69 HydrophobicContact CB-CB 4.21Å; C33-G70 WeakPolarHBondContact O-CA 3.49Å
34	V	96.7	Very high	94.7	Very high	17 Å²	17	60.7 Å²	60.7	10%	0.103	33%	0.33	C	S	.	.	H	α-helix	trans	-60.6	-45.1	173	174.6	0	0	0	0	111.4	L30 E31 I36 V37 Q38 T73 L74	L30-V34 PolarHBondContact O-N 2.76Å; E31-V34 WeakPolarHBondContact O-CB 3.44Å; E31-V34 PolarHBondContact O-N 3.38Å; V34-I36 VanDerWaalsContact C-N 3.29Å; V34-I36 PolarHBondContact O-N 3.14Å; V34-V37 PolarHBondContact O-N 3.3Å; V34-Q38 HydrophobicContact CG1-CG 4.15Å; V34-Q38 WeakPolarHBondContact O-CB 3.5Å; V34-Q38 WeakPolarHBondContact O-CG 3.29Å; V34-Q38 PolarHBondContact O-N 2.88Å; V34-T73 VanDerWaalsContact CG2-CB 3.44Å; V34-T73 HydrophobicContact CG2-CG2 3.46Å; V34-T73 VanDerWaalsContact CG2-CG2 3.46Å; V34-L74 HydrophobicContact CG1-CD2 3.8Å; V34-L74 HydrophobicContact CG1-CG 4.06Å; V34-L74 HydrophobicContact CG2-CG 4.3Å
35	V	96.7	Very high	94.6	Very high	93 Å²	93	62.1 Å²	62.1	56%	0.564	34%	0.342	S	S	*	.	H	α-helix	trans	-60.4	-39.2	178.2	173.8	0	0	0	0	111.5	E31 R32 A39	E31-V35 PolarHBondContact O-N 3.33Å; E31-V35 VanDerWaalsContact O-N 3.09Å; R32-V35 PolarHBondContact O-N 3.45Å; V35-A39 VanDerWaalsContact O-CB 3.3Å; V35-A39 WeakPolarHBondContact O-CB 3.36Å; V35-A39 PolarHBondContact O-N 3.47Å
36	I	96.3	Very high	94.3	Very high	53 Å²	53	59 Å²	59	27%	0.272	33%	0.328	S	S	.	.	H	α-helix	trans	-63.1	-48.3	175.4	-66.6	166.2	0	0	0	111	R32 C33 V34 Q38 A39 L40 E66	R32-I36 WeakPolarHBondContact O-CG1 3.36Å; R32-I36 PolarHBondContact O-N 3.34Å; R32-I36 VanDerWaalsContact O-N 3.14Å; C33-I36 PolarHBondContact O-N 3.14Å; V34-I36 VanDerWaalsContact C-N 3.29Å; V34-I36 PolarHBondContact O-N 3.14Å; I36-Q38 PolarHBondContact O-N 3.35Å; I36-A39 PolarHBondContact O-N 2.61Å; I36-L40 HydrophobicContact CG2-CD1 4.07Å; I36-L40 WeakPolarHBondContact O-CG 3.29Å; I36-L40 PolarHBondContact O-N 2.8Å; I36-L40 VanDerWaalsContact O-N 3.14Å; I36-E66 HydrophobicContact CD1-CB 4.09Å; I36-E66 HydrophobicContact CD1-CG 4.04Å
37	V	96.4	Very high	94	Very high	2 Å²	2	67.4 Å²	67.4	1%	0.012	36%	0.359	C	S	.	.	H	α-helix	trans	-64.4	-40.6	178.8	170.3	0	0	0	0	111.8	C33 V34 L40 T41 L53 V67 L71 L74	C33-V37 PolarHBondContact O-N 3.16Å; V34-V37 PolarHBondContact O-N 3.3Å; V37-L40 PolarHBondContact O-N 3.15Å; V37-T41 WeakPolarHBondContact O-CB 3.48Å; V37-T41 WeakPolarHBondContact O-CG2 3.46Å; V37-T41 PolarHBondContact O-N 3.29Å; V37-T41 PolarHBondContact O-OG1 2.76Å; V37-L53 HydrophobicContact CG1-CD2 4.29Å; V37-L53 HydrophobicContact CG2-CD2 4.47Å; V37-V67 HydrophobicContact CG2-CB 4.48Å; V37-V67 HydrophobicContact CG2-CG1 4.47Å; V37-V67 WeakPolarHBondContact CG2-O 3.42Å; V37-L71 HydrophobicContact CG1-CD2 3.83Å; V37-L71 HydrophobicContact CG1-CG 4.12Å; V37-L71 HydrophobicContact CG2-CG 4.36Å; V37-L74 HydrophobicContact CB-CD1 4.48Å; V37-L74 HydrophobicContact CG1-CD1 3.82Å
38	Q	95.2	Very high	93.9	Very high	88 Å²	88	72 Å²	72	41%	0.411	38%	0.38	S	S	.	.	H	α-helix	trans	-64.5	-42.4	175.5	-72.7	177.5	-8.9	0	0	111.7	V34 I36 L40 T41 N42	V34-Q38 HydrophobicContact CG1-CG 4.15Å; V34-Q38 WeakPolarHBondContact O-CB 3.5Å; V34-Q38 WeakPolarHBondContact O-CG 3.29Å; V34-Q38 PolarHBondContact O-N 2.88Å; I36-Q38 PolarHBondContact O-N 3.35Å; Q38-L40 PolarHBondContact O-N 3.38Å; Q38-T41 PolarHBondContact O-N 2.97Å; Q38-N42 VanDerWaalsContact O-CB 3.24Å; Q38-N42 WeakPolarHBondContact O-CB 3.37Å; Q38-N42 PolarHBondContact O-N 3.07Å
39	A	95.3	Very high	93.8	Very high	87 Å²	87	68.3 Å²	68.3	72%	0.719	36%	0.363	S	S	*	.	H	α-helix	trans	-63.3	-26.8	176.3	0	0	0	0	0	113.6	V35 I36	V35-A39 VanDerWaalsContact O-CB 3.3Å; V35-A39 WeakPolarHBondContact O-CB 3.36Å; V35-A39 PolarHBondContact O-N 3.47Å; I36-A39 PolarHBondContact O-N 2.61Å
40	L	93.6	Very high	93.7	Very high	41 Å²	41	65.5 Å²	65.5	22%	0.215	35%	0.354	C	S	.	.	H	α-helix	trans	-85.3	-11.8	176.7	-70.1	168.7	0	0	0	114.4	I36 V37 Q38 L44 L53 N56 V67	I36-L40 HydrophobicContact CG2-CD1 4.07Å; I36-L40 WeakPolarHBondContact O-CG 3.29Å; I36-L40 PolarHBondContact O-N 2.8Å; I36-L40 VanDerWaalsContact O-N 3.14Å; V37-L40 PolarHBondContact O-N 3.15Å; Q38-L40 PolarHBondContact O-N 3.38Å; L40-L44 WeakPolarHBondContact O-CD1 3.48Å; L40-L53 HydrophobicContact CB-CD2 4.05Å; L40-L53 HydrophobicContact CD1-CD2 4.07Å; L40-N56 HydrophobicContact CD1-CB 3.84Å; L40-N56 HydrophobicContact CD2-CB 4.29Å; L40-V67 HydrophobicContact CD1-CG2 4.06Å
41	T	93.9	Very high	93.5	Very high	30 Å²	30	69.5 Å²	69.5	18%	0.184	38%	0.376	C	S	.	.	H	α-helix	trans	-130.4	-18.2	-168	57.2	0	0	0	0	115.1	V37 Q38 G43 L44 A49 L53	V37-T41 WeakPolarHBondContact O-CB 3.48Å; V37-T41 WeakPolarHBondContact O-CG2 3.46Å; V37-T41 PolarHBondContact O-N 3.29Å; V37-T41 PolarHBondContact O-OG1 2.76Å; Q38-T41 PolarHBondContact O-N 2.97Å; T41-G43 PolarHBondContact O-N 2.8Å; T41-L44 PolarHBondContact O-N 3.25Å; T41-A49 HydrophobicContact CG2-CB 3.87Å; T41-L53 HydrophobicContact CG2-CD1 3.76Å; T41-L53 HydrophobicContact CG2-CD2 3.91Å; T41-L53 HydrophobicContact CG2-CG 3.77Å
42	N	92.3	Very high	93.5	Very high	143 Å²	143	68 Å²	68	77%	0.765	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	130.5	-177.3	-171.3	15.7	0	0	0	111.9	Q38 L44	Q38-N42 VanDerWaalsContact O-CB 3.24Å; Q38-N42 WeakPolarHBondContact O-CB 3.37Å; Q38-N42 PolarHBondContact O-N 3.07Å; N42-L44 VanDerWaalsContact C-N 3.29Å; N42-L44 PolarHBondContact O-N 2.9Å
43	G	88.8	Confident	93.5	Very high	78 Å²	78	61.7 Å²	61.7	80%	0.804	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	0.4	-178.8	0	0	0	0	0	115.9	T41	T41-G43 PolarHBondContact O-N 2.8Å
44	L	92.6	Very high	93.4	Very high	76 Å²	76	64 Å²	64	40%	0.398	36%	0.364	S	S	.	.	S	Bend	trans	-97	155.1	178.7	-59.8	-175.6	0	0	0	112.4	L40 T41 N42 E48 A49 A52	L40-L44 WeakPolarHBondContact O-CD1 3.48Å; T41-L44 PolarHBondContact O-N 3.25Å; N42-L44 VanDerWaalsContact C-N 3.29Å; N42-L44 PolarHBondContact O-N 2.9Å; L44-E48 HydrophobicContact CB-CB 3.97Å; L44-E48 HydrophobicContact CD1-CB 4.35Å; L44-E48 HydrophobicContact CD2-CB 4.39Å; L44-E48 HydrophobicContact CG-CB 4.47Å; L44-A49 HydrophobicContact CB-CB 4.27Å; L44-A52 HydrophobicContact CD1-CB 4.24Å
45	S	91.4	Very high	93.2	Very high	58 Å²	58	66 Å²	66	41%	0.406	38%	0.382	S	S	.	.			trans	-67.9	165.2	165.9	70.2	0	0	0	0	111.6	R47 E48 A49	S45-R47 PolarHBondContact O-N 2.83Å; S45-E48 WeakPolarHBondContact CB-OE2 3.44Å; S45-E48 PolarHBondContact N-OE2 3.07Å; S45-E48 PolarHBondContact O-N 3.22Å; S45-E48 VanDerWaalsContact OG-CD 3.28Å; S45-E48 WeakPolarHBondContact OG-CG 3.36Å; S45-E48 PolarHBondContact OG-N 3Å; S45-E48 PolarHBondContact OG-OE2 3.44Å; S45-A49 VanDerWaalsContact O-CB 3.27Å; S45-A49 WeakPolarHBondContact O-CB 3.26Å; S45-A49 PolarHBondContact O-N 2.93Å
46	E	86.8	Confident	93.1	Very high	88 Å²	88	62.3 Å²	62.3	41%	0.411	36%	0.359	S	S	.	.	H	α-helix	trans	-56.4	-36.3	-179.6	-53.3	-135	144.7	0	0	113	N50 R84 R87	E46-N50 WeakPolarHBondContact O-CB 3.36Å; E46-N50 PolarHBondContact O-N 3.49Å; E46-R84 VanDerWaalsContact OE1-CD 3.23Å; E46-R84 WeakPolarHBondContact OE1-CD 3.39Å; E46-R84 IonicContact OE1-CZ 3.6Å; E46-R84 IonicContact OE1-NE 3.24Å; E46-R84 PolarHBondContact OE1-NE 3.21Å; E46-R84 IonicContact OE1-NH1 2.68Å; E46-R84 PolarHBondContact OE1-NH1 3.17Å; E46-R87 IonicContact OE2-CZ 3.77Å; E46-R87 VanDerWaalsContact OE2-CZ 3.25Å; E46-R87 IonicContact OE2-NH1 2.81Å; E46-R87 PolarHBondContact OE2-NH1 3.48Å; E46-R87 IonicContact OE2-NH2 2.74Å; E46-R87 PolarHBondContact OE2-NH2 3.27Å
47	R	89.2	Confident	93.1	Very high	192 Å²	192	60 Å²	60	73%	0.725	35%	0.348	S	S	*	.	H	α-helix	trans	-71.4	-51.3	179.4	179.1	176.4	176.6	168.1	3.7	111.3	S45 A49 N50 D51	S45-R47 PolarHBondContact O-N 2.83Å; R47-A49 VanDerWaalsContact C-N 3.25Å; R47-A49 PolarHBondContact O-N 3.43Å; R47-N50 PolarHBondContact O-N 2.92Å; R47-N50 VanDerWaalsContact O-N 3.08Å; R47-D51 WeakPolarHBondContact CG-OD2 3.23Å; R47-D51 IonicContact NE-OD2 3.68Å; R47-D51 WeakPolarHBondContact O-CB 3.43Å; R47-D51 PolarHBondContact O-N 3.49Å
48	E	92.8	Very high	92.9	Very high	103 Å²	103	63.7 Å²	63.7	48%	0.481	37%	0.372	S	S	.	.	H	α-helix	trans	-61.5	-36.9	179.5	-68.1	160.3	135.6	0	0	111.3	L44 S45 A52	L44-E48 HydrophobicContact CB-CB 3.97Å; L44-E48 HydrophobicContact CD1-CB 4.35Å; L44-E48 HydrophobicContact CD2-CB 4.39Å; L44-E48 HydrophobicContact CG-CB 4.47Å; S45-E48 WeakPolarHBondContact CB-OE2 3.44Å; S45-E48 PolarHBondContact N-OE2 3.07Å; S45-E48 PolarHBondContact O-N 3.22Å; S45-E48 VanDerWaalsContact OG-CD 3.28Å; S45-E48 WeakPolarHBondContact OG-CG 3.36Å; S45-E48 PolarHBondContact OG-N 3Å; S45-E48 PolarHBondContact OG-OE2 3.44Å; E48-A52 WeakPolarHBondContact O-CB 3.44Å; E48-A52 PolarHBondContact O-N 2.9Å
49	A	92.1	Very high	92.8	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-62.1	-46	171.7	0	0	0	0	0	112.1	T41 L44 S45 R47 A52 L53	T41-A49 HydrophobicContact CG2-CB 3.87Å; L44-A49 HydrophobicContact CB-CB 4.27Å; S45-A49 VanDerWaalsContact O-CB 3.27Å; S45-A49 WeakPolarHBondContact O-CB 3.26Å; S45-A49 PolarHBondContact O-N 2.93Å; R47-A49 VanDerWaalsContact C-N 3.25Å; R47-A49 PolarHBondContact O-N 3.43Å; A49-A52 PolarHBondContact O-N 3.42Å; A49-L53 WeakPolarHBondContact O-CB 3.41Å; A49-L53 VanDerWaalsContact O-CG 3.23Å; A49-L53 WeakPolarHBondContact O-CG 3.47Å; A49-L53 PolarHBondContact O-N 2.85Å
50	N	92.7	Very high	92.7	Very high	27 Å²	27	63.5 Å²	63.5	14%	0.144	36%	0.362	C	S	.	.	H	α-helix	trans	-68.6	-41	178.9	-164.6	-83.2	0	0	0	112.3	E46 R47 A52 L53 T54	E46-N50 WeakPolarHBondContact O-CB 3.36Å; E46-N50 PolarHBondContact O-N 3.49Å; R47-N50 PolarHBondContact O-N 2.92Å; R47-N50 VanDerWaalsContact O-N 3.08Å; N50-A52 PolarHBondContact O-N 3.32Å; N50-L53 PolarHBondContact O-N 2.8Å; N50-T54 VanDerWaalsContact O-CB 3.31Å; N50-T54 WeakPolarHBondContact O-CB 3.47Å; N50-T54 PolarHBondContact O-N 2.99Å; N50-T54 PolarHBondContact O-OG1 2.9Å
51	D	92.9	Very high	92.7	Very high	85 Å²	85	67.6 Å²	67.6	46%	0.455	38%	0.381	S	S	.	.	H	α-helix	trans	-60.3	-43.8	173.6	-72.8	-31.7	0	0	0	110.5	R47 A55	R47-D51 WeakPolarHBondContact CG-OD2 3.23Å; R47-D51 IonicContact NE-OD2 3.68Å; R47-D51 WeakPolarHBondContact O-CB 3.43Å; R47-D51 PolarHBondContact O-N 3.49Å; D51-A55 VanDerWaalsContact O-CB 3.26Å; D51-A55 WeakPolarHBondContact O-CB 3.23Å; D51-A55 PolarHBondContact O-N 3.34Å
52	A	94.8	Very high	92.8	Very high	30 Å²	30	71.8 Å²	71.8	25%	0.248	40%	0.398	C	S	.	.	H	α-helix	trans	-67.4	-42.5	177.5	0	0	0	0	0	113.4	L44 E48 A49 N50 A55 N56	L44-A52 HydrophobicContact CD1-CB 4.24Å; E48-A52 WeakPolarHBondContact O-CB 3.44Å; E48-A52 PolarHBondContact O-N 2.9Å; A49-A52 PolarHBondContact O-N 3.42Å; N50-A52 PolarHBondContact O-N 3.32Å; A52-A55 PolarHBondContact O-N 3.34Å; A52-N56 WeakPolarHBondContact O-CB 3.25Å; A52-N56 PolarHBondContact O-N 2.83Å
53	L	95.9	Very high	93	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.005	37%	0.372	C	S	.	.	H	α-helix	trans	-62.8	-48	174.6	-71.1	171.7	0	0	0	110.9	V37 L40 T41 A49 N50 A55 N56 V57 V67 L71 V92	V37-L53 HydrophobicContact CG1-CD2 4.29Å; V37-L53 HydrophobicContact CG2-CD2 4.47Å; L40-L53 HydrophobicContact CB-CD2 4.05Å; L40-L53 HydrophobicContact CD1-CD2 4.07Å; T41-L53 HydrophobicContact CG2-CD1 3.76Å; T41-L53 HydrophobicContact CG2-CD2 3.91Å; T41-L53 HydrophobicContact CG2-CG 3.77Å; A49-L53 WeakPolarHBondContact O-CB 3.41Å; A49-L53 VanDerWaalsContact O-CG 3.23Å; A49-L53 WeakPolarHBondContact O-CG 3.47Å; A49-L53 PolarHBondContact O-N 2.85Å; N50-L53 PolarHBondContact O-N 2.8Å; L53-A55 PolarHBondContact O-N 3.17Å; L53-N56 PolarHBondContact O-N 2.8Å; L53-N56 VanDerWaalsContact O-N 3.07Å; L53-V57 WeakPolarHBondContact O-CG2 3.44Å; L53-V57 PolarHBondContact O-N 2.9Å; L53-V67 HydrophobicContact CB-CG1 4.47Å; L53-V67 HydrophobicContact CD2-CG1 3.89Å; L53-V67 HydrophobicContact CD2-CG2 4.24Å; L53-L71 HydrophobicContact CD1-CD1 4.41Å; L53-L71 HydrophobicContact CD1-CD2 4.41Å; L53-V92 HydrophobicContact CB-CG1 4.15Å
54	T	94.2	Very high	93.3	Very high	53 Å²	53	63.5 Å²	63.5	33%	0.325	33%	0.334	S	S	.	.	H	α-helix	trans	-58.4	-46.5	176.9	-58.5	0	0	0	0	111.2	N50 N56 V57 C58	N50-T54 VanDerWaalsContact O-CB 3.31Å; N50-T54 WeakPolarHBondContact O-CB 3.47Å; N50-T54 PolarHBondContact O-N 2.99Å; N50-T54 PolarHBondContact O-OG1 2.9Å; T54-N56 VanDerWaalsContact C-N 3.27Å; T54-N56 PolarHBondContact O-N 3.08Å; T54-V57 PolarHBondContact O-N 3.05Å; T54-C58 PolarHBondContact O-N 3.11Å; T54-C58 PolarHBondContact O-SG 3.45Å
55	A	94.2	Very high	93.6	Very high	58 Å²	58	61.8 Å²	61.8	48%	0.479	32%	0.324	S	S	.	.	H	α-helix	trans	-63.9	-29.2	176	0	0	0	0	0	113.3	D51 A52 L53	D51-A55 VanDerWaalsContact O-CB 3.26Å; D51-A55 WeakPolarHBondContact O-CB 3.23Å; D51-A55 PolarHBondContact O-N 3.34Å; A52-A55 PolarHBondContact O-N 3.34Å; L53-A55 PolarHBondContact O-N 3.17Å
56	N	94.4	Very high	93.9	Very high	16 Å²	16	60.9 Å²	60.9	9%	0.086	31%	0.313	C	S	.	.	H	α-helix	trans	-75.7	-46	174.4	-163.4	67	0	0	0	112.4	L40 A52 L53 T54 C58 K59 Q63	L40-N56 HydrophobicContact CD1-CB 3.84Å; L40-N56 HydrophobicContact CD2-CB 4.29Å; A52-N56 WeakPolarHBondContact O-CB 3.25Å; A52-N56 PolarHBondContact O-N 2.83Å; L53-N56 PolarHBondContact O-N 2.8Å; L53-N56 VanDerWaalsContact O-N 3.07Å; T54-N56 VanDerWaalsContact C-N 3.27Å; T54-N56 PolarHBondContact O-N 3.08Å; N56-C58 PolarHBondContact O-N 3.07Å; N56-K59 VanDerWaalsContact O-CB 3.29Å; N56-K59 WeakPolarHBondContact O-CB 3.29Å; N56-K59 WeakPolarHBondContact O-CG 3.39Å; N56-K59 PolarHBondContact O-N 3.32Å; N56-K59 PolarHBondContact OD1-NZ 3.32Å; N56-Q63 VanDerWaalsContact O-CB 3.31Å; N56-Q63 WeakPolarHBondContact O-CB 3.47Å
57	V	95.4	Very high	94.4	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.03	29%	0.294	C	S	.	.	H	α-helix	trans	-58.3	-35.1	176.6	168.7	0	0	0	0	111.8	L53 T54 K59 H64 V67 V92 R94	L53-V57 WeakPolarHBondContact O-CG2 3.44Å; L53-V57 PolarHBondContact O-N 2.9Å; T54-V57 PolarHBondContact O-N 3.05Å; V57-K59 PolarHBondContact O-N 2.9Å; V57-K59 VanDerWaalsContact O-N 3.12Å; V57-H64 HydrophobicContact CG1-CB 3.97Å; V57-V67 HydrophobicContact CG2-CB 3.69Å; V57-V67 HydrophobicContact CG2-CG1 3.65Å; V57-V67 HydrophobicContact CG2-CG2 4Å; V57-V92 WeakPolarHBondContact CG1-O 3.03Å; V57-V92 HydrophobicContact CG2-CB 4.24Å; V57-V92 HydrophobicContact CG2-CG2 4.39Å; V57-R94 HydrophobicContact CG1-CG 3.99Å
58	C	93.3	Very high	94.8	Very high	78 Å²	78	47.6 Å²	47.6	53%	0.527	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-9	175.5	-74.9	0	0	0	0	115.4	T54 N56 R94	T54-C58 PolarHBondContact O-N 3.11Å; T54-C58 PolarHBondContact O-SG 3.45Å; N56-C58 PolarHBondContact O-N 3.07Å; C58-R94 PolarHBondContact SG-NH1 3.41Å
59	K	93.4	Very high	95.1	Very high	141 Å²	141	42.7 Å²	42.7	61%	0.613	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-24.1	-177.3	-63	170.7	-172.8	167.2	0	113.9	N56 V57 Q63	N56-K59 VanDerWaalsContact O-CB 3.29Å; N56-K59 WeakPolarHBondContact O-CB 3.29Å; N56-K59 WeakPolarHBondContact O-CG 3.39Å; N56-K59 PolarHBondContact O-N 3.32Å; N56-K59 PolarHBondContact OD1-NZ 3.32Å; V57-K59 PolarHBondContact O-N 2.9Å; V57-K59 VanDerWaalsContact O-N 3.12Å; K59-Q63 HydrophobicContact CB-CB 4.38Å; K59-Q63 HydrophobicContact CB-CG 4.15Å
60	G	92.6	Very high	95.3	Very high	30 Å²	30	42.7 Å²	42.7	31%	0.309	24%	0.236	S	C	.	.			trans	159.3	168.8	-179	0	0	0	0	0	113.9	Q62 Q63 H64	G60-Q62 VanDerWaalsContact C-N 3.26Å; G60-Q62 PolarHBondContact O-N 3.24Å; G60-Q63 PolarHBondContact O-N 3.31Å; G60-Q63 VanDerWaalsContact O-N 3.11Å; G60-H64 PolarHBondContact O-N 2.86Å
61	Q	93.6	Very high	95.6	Very high	128 Å²	128	41.6 Å²	41.6	60%	0.598	23%	0.23	S	C	*	.	H	α-helix	trans	-60.9	-32.8	-175.5	-172.5	61.5	20.1	0	0	113.4	H64 E65	Q61-H64 PolarHBondContact NE2-CE1 3Å; Q61-H64 WeakPolarHBondContact O-CB 3.29Å; Q61-H64 PolarHBondContact O-N 3.07Å; Q61-E65 PolarHBondContact O-N 3.28Å
62	Q	95.1	Very high	95.8	Very high	117 Å²	117	37.5 Å²	37.5	55%	0.547	21%	0.209	S	C	.	.	H	α-helix	trans	-64.7	-46.1	175.2	178.5	-178.1	-9.5	0	0	111.1	G60 H64 E65 E66	G60-Q62 VanDerWaalsContact C-N 3.26Å; G60-Q62 PolarHBondContact O-N 3.24Å; Q62-H64 VanDerWaalsContact C-N 3.29Å; Q62-H64 PolarHBondContact O-N 2.81Å; Q62-E65 PolarHBondContact O-N 3.47Å; Q62-E66 HydrophobicContact CG-CG 4.37Å; Q62-E66 VanDerWaalsContact CG-OE1 3.32Å; Q62-E66 WeakPolarHBondContact CG-OE1 3.33Å; Q62-E66 PolarHBondContact NE2-OE1 3.22Å; Q62-E66 WeakPolarHBondContact O-CB 3.36Å; Q62-E66 VanDerWaalsContact O-CG 3.3Å; Q62-E66 WeakPolarHBondContact O-CG 3.41Å; Q62-E66 PolarHBondContact O-N 3.01Å
63	Q	95.9	Very high	96	Very high	46 Å²	46	36.4 Å²	36.4	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-70.7	-28.6	-179.6	-68	69.9	42.8	0	0	111.9	N56 K59 G60 V67	N56-Q63 VanDerWaalsContact O-CB 3.31Å; N56-Q63 WeakPolarHBondContact O-CB 3.47Å; K59-Q63 HydrophobicContact CB-CB 4.38Å; K59-Q63 HydrophobicContact CB-CG 4.15Å; G60-Q63 PolarHBondContact O-N 3.31Å; G60-Q63 VanDerWaalsContact O-N 3.11Å; Q63-V67 WeakPolarHBondContact O-CB 3.22Å; Q63-V67 WeakPolarHBondContact O-CG2 3.4Å; Q63-V67 PolarHBondContact O-N 2.93Å; Q63-V67 VanDerWaalsContact O-N 3.15Å
64	H	96.9	Very high	96.1	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.009	20%	0.2	C	C	.	.	H	α-helix	trans	-61.4	-54.6	165.9	171.3	-97.6	0	0	0	111.6	V57 G60 Q61 Q62 E66 V67 C68 D95 I99	V57-H64 HydrophobicContact CG1-CB 3.97Å; G60-H64 PolarHBondContact O-N 2.86Å; Q61-H64 PolarHBondContact NE2-CE1 3Å; Q61-H64 WeakPolarHBondContact O-CB 3.29Å; Q61-H64 PolarHBondContact O-N 3.07Å; Q62-H64 VanDerWaalsContact C-N 3.29Å; Q62-H64 PolarHBondContact O-N 2.81Å; H64-E66 PolarHBondContact O-N 2.7Å; H64-V67 PolarHBondContact O-N 2.95Å; H64-C68 WeakPolarHBondContact O-CB 3.35Å; H64-C68 PolarHBondContact O-N 3.28Å; H64-C68 PolarHBondContact O-SG 2.76Å; H64-D95 VanDerWaalsContact NE2-CB 3.26Å; H64-D95 WeakPolarHBondContact NE2-CB 3.3Å; H64-D95 IonicContact NE2-OD1 2.7Å; H64-D95 PolarHBondContact NE2-OD1 2.93Å; H64-D95 IonicContact NE2-OD2 2.8Å; H64-D95 PolarHBondContact NE2-OD2 2.8Å; H64-I99 WeakPolarHBondContact NE2-CG2 3.45Å
65	E	97.3	Very high	96.2	Very high	40 Å²	40	34.1 Å²	34.1	19%	0.187	18%	0.184	C	C	.	.	H	α-helix	trans	-59.6	-45.8	178.4	177.3	175.4	-165	0	0	111.9	R29 Q61 Q62 V67 C68 L69 I99	R29-E65 IonicContact CZ-OE1 3.38Å; R29-E65 VanDerWaalsContact CZ-OE1 3.27Å; R29-E65 IonicContact NH1-OE1 2.93Å; R29-E65 PolarHBondContact NH1-OE1 3.27Å; R29-E65 IonicContact NH2-OE1 2.76Å; R29-E65 PolarHBondContact NH2-OE1 2.74Å; R29-E65 IonicContact NH2-OE2 3.47Å; R29-E65 PolarHBondContact NH2-OE2 3.17Å; Q61-E65 PolarHBondContact O-N 3.28Å; Q62-E65 PolarHBondContact O-N 3.47Å; E65-V67 PolarHBondContact O-N 3.16Å; E65-C68 PolarHBondContact O-N 3.11Å; E65-L69 HydrophobicContact CG-CD1 3.58Å; E65-L69 HydrophobicContact CG-CG 3.99Å; E65-L69 VanDerWaalsContact O-CB 3.25Å; E65-L69 WeakPolarHBondContact O-CB 3.29Å; E65-L69 VanDerWaalsContact O-CG 3.29Å; E65-L69 WeakPolarHBondContact O-CG 3.25Å; E65-L69 PolarHBondContact O-N 3.26Å; E65-I99 HydrophobicContact CB-CG1 4.43Å; E65-I99 HydrophobicContact CG-CD1 4.37Å; E65-I99 HydrophobicContact CG-CG1 3.82Å
66	E	97.5	Very high	96.4	Very high	39 Å²	39	31.3 Å²	31.3	18%	0.182	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-43.2	179.3	-73.6	166.3	172.6	0	0	112.3	C33 I36 Q62 H64 G70	C33-E66 WeakPolarHBondContact CB-O 3.27Å; I36-E66 HydrophobicContact CD1-CB 4.09Å; I36-E66 HydrophobicContact CD1-CG 4.04Å; Q62-E66 HydrophobicContact CG-CG 4.37Å; Q62-E66 VanDerWaalsContact CG-OE1 3.32Å; Q62-E66 WeakPolarHBondContact CG-OE1 3.33Å; Q62-E66 PolarHBondContact NE2-OE1 3.22Å; Q62-E66 WeakPolarHBondContact O-CB 3.36Å; Q62-E66 VanDerWaalsContact O-CG 3.3Å; Q62-E66 WeakPolarHBondContact O-CG 3.41Å; Q62-E66 PolarHBondContact O-N 3.01Å; H64-E66 PolarHBondContact O-N 2.7Å; E66-G70 PolarHBondContact O-N 2.86Å
67	V	97.9	Very high	96.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-71.2	-47.9	177.3	166.5	0	0	0	0	111.7	V37 L40 L53 V57 Q63 H64 E65 L69 G70 L71 V92	V37-V67 HydrophobicContact CG2-CB 4.48Å; V37-V67 HydrophobicContact CG2-CG1 4.47Å; V37-V67 WeakPolarHBondContact CG2-O 3.42Å; L40-V67 HydrophobicContact CD1-CG2 4.06Å; L53-V67 HydrophobicContact CB-CG1 4.47Å; L53-V67 HydrophobicContact CD2-CG1 3.89Å; L53-V67 HydrophobicContact CD2-CG2 4.24Å; V57-V67 HydrophobicContact CG2-CB 3.69Å; V57-V67 HydrophobicContact CG2-CG1 3.65Å; V57-V67 HydrophobicContact CG2-CG2 4Å; Q63-V67 WeakPolarHBondContact O-CB 3.22Å; Q63-V67 WeakPolarHBondContact O-CG2 3.4Å; Q63-V67 PolarHBondContact O-N 2.93Å; Q63-V67 VanDerWaalsContact O-N 3.15Å; H64-V67 PolarHBondContact O-N 2.95Å; E65-V67 PolarHBondContact O-N 3.16Å; V67-L69 PolarHBondContact O-N 3.15Å; V67-G70 PolarHBondContact O-N 3.43Å; V67-L71 HydrophobicContact CG1-CD1 3.86Å; V67-L71 WeakPolarHBondContact O-CG 3.31Å; V67-L71 PolarHBondContact O-N 3.42Å; V67-V92 HydrophobicContact CG1-CG2 3.92Å
68	C	98	Very high	96.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.9	-40.8	-178.7	-73.7	0	0	0	0	112.1	H64 E65 F72 L89 I99 V100	H64-C68 WeakPolarHBondContact O-CB 3.35Å; H64-C68 PolarHBondContact O-N 3.28Å; H64-C68 PolarHBondContact O-SG 2.76Å; E65-C68 PolarHBondContact O-N 3.11Å; C68-F72 WeakPolarHBondContact O-CB 3.49Å; C68-F72 PolarHBondContact O-N 3.36Å; C68-L89 HydrophobicContact CB-CD1 3.76Å; C68-I99 HydrophobicContact CB-CG2 4.15Å; C68-V100 HydrophobicContact CB-CG2 4.38Å
69	L	98.2	Very high	96.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-72.8	-30.1	176.1	-65.5	-172.6	0	0	0	112.9	L30 C33 E65 V67 F72 T73 I99 K103	L30-L69 HydrophobicContact CD2-CB 3.99Å; L30-L69 HydrophobicContact CD2-CD1 4.27Å; L30-L69 HydrophobicContact CD2-CD2 4.5Å; L30-L69 HydrophobicContact CD2-CG 4.49Å; C33-L69 HydrophobicContact CB-CB 4.21Å; E65-L69 HydrophobicContact CG-CD1 3.58Å; E65-L69 HydrophobicContact CG-CG 3.99Å; E65-L69 VanDerWaalsContact O-CB 3.25Å; E65-L69 WeakPolarHBondContact O-CB 3.29Å; E65-L69 VanDerWaalsContact O-CG 3.29Å; E65-L69 WeakPolarHBondContact O-CG 3.25Å; E65-L69 PolarHBondContact O-N 3.26Å; V67-L69 PolarHBondContact O-N 3.15Å; L69-F72 HydrophobicContact CD2-CD1 4.18Å; L69-T73 WeakPolarHBondContact O-CB 3.49Å; L69-T73 PolarHBondContact O-N 3.46Å; L69-T73 PolarHBondContact O-OG1 3.05Å; L69-I99 HydrophobicContact CD2-CG1 4.32Å; L69-I99 HydrophobicContact CG-CG1 4.46Å; L69-K103 HydrophobicContact CD1-CG 4.07Å; L69-K103 HydrophobicContact CD2-CB 4.01Å; L69-K103 HydrophobicContact CD2-CG 3.55Å; L69-K103 HydrophobicContact CG-CG 4.49Å
70	G	97.8	Very high	96.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-67.8	-45.1	173.4	0	0	0	0	0	112.3	C33 E66 V67 T73 L74	C33-G70 WeakPolarHBondContact O-CA 3.49Å; E66-G70 PolarHBondContact O-N 2.86Å; V67-G70 PolarHBondContact O-N 3.43Å; G70-T73 PolarHBondContact O-N 2.85Å; G70-L74 WeakPolarHBondContact O-CG 3.31Å; G70-L74 PolarHBondContact O-N 3.29Å
71	L	97.9	Very high	96.7	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-64.9	-42.8	174.4	-70.9	167.4	0	0	0	112	V37 L53 V67 T73 L74 V75 C85 L89 V92	V37-L71 HydrophobicContact CG1-CD2 3.83Å; V37-L71 HydrophobicContact CG1-CG 4.12Å; V37-L71 HydrophobicContact CG2-CG 4.36Å; L53-L71 HydrophobicContact CD1-CD1 4.41Å; L53-L71 HydrophobicContact CD1-CD2 4.41Å; V67-L71 HydrophobicContact CG1-CD1 3.86Å; V67-L71 WeakPolarHBondContact O-CG 3.31Å; V67-L71 PolarHBondContact O-N 3.42Å; L71-T73 VanDerWaalsContact C-N 3.34Å; L71-T73 PolarHBondContact O-N 3.44Å; L71-L74 PolarHBondContact O-N 3.19Å; L71-V75 WeakPolarHBondContact O-CG2 3.42Å; L71-V75 PolarHBondContact O-N 3.47Å; L71-C85 HydrophobicContact CD2-CB 4.29Å; L71-L89 HydrophobicContact CB-CB 4.15Å; L71-L89 HydrophobicContact CB-CD1 4.24Å; L71-L89 HydrophobicContact CD1-CB 4.16Å; L71-L89 HydrophobicContact CD1-CD1 4.42Å; L71-V92 HydrophobicContact CD1-CG2 3.8Å
72	F	98.2	Very high	96.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-56.4	-45.4	172.1	163.4	-114.3	0	0	0	112.3	L30 C68 L69 V75 L76 V100 K103 I104 I107 L126	L30-F72 HydrophobicContact CD2-CD1 4.33Å; L30-F72 HydrophobicContact CD2-CE1 4.48Å; C68-F72 WeakPolarHBondContact O-CB 3.49Å; C68-F72 PolarHBondContact O-N 3.36Å; L69-F72 HydrophobicContact CD2-CD1 4.18Å; F72-V75 WeakPolarHBondContact O-CB 3.38Å; F72-V75 PolarHBondContact O-N 2.91Å; F72-L76 HydrophobicContact CE1-CD1 4.17Å; F72-L76 HydrophobicContact CE2-CD1 3.87Å; F72-L76 HydrophobicContact CE2-CD2 4.41Å; F72-L76 HydrophobicContact CE2-CG 4.14Å; F72-L76 HydrophobicContact CZ-CD1 3.64Å; F72-L76 HydrophobicContact CZ-CG 4.38Å; F72-L76 PolarHBondContact O-N 3.22Å; F72-L76 VanDerWaalsContact O-N 3.17Å; F72-V100 HydrophobicContact CB-CG1 4.28Å; F72-V100 HydrophobicContact CD2-CG1 3.65Å; F72-V100 HydrophobicContact CE2-CG1 4.2Å; F72-V100 HydrophobicContact CG-CG1 4.08Å; F72-K103 HydrophobicContact CE1-CB 4.06Å; F72-I104 HydrophobicContact CE2-CD1 4.2Å; F72-I104 HydrophobicContact CE2-CG1 3.56Å; F72-I104 HydrophobicContact CZ-CG1 3.9Å; F72-I107 HydrophobicContact CE1-CD1 3.9Å; F72-I107 HydrophobicContact CZ-CD1 3.85Å; F72-L126 HydrophobicContact CD2-CD2 3.53Å; F72-L126 HydrophobicContact CE2-CD2 3.61Å
73	T	97.9	Very high	96.8	Very high	6 Å²	6	30 Å²	30	4%	0.037	16%	0.157	C	C	.	.	H	α-helix	trans	-67.8	-40.6	-179.9	-52.8	0	0	0	0	111.1	L30 V34 L69 G70 L71 V75 L76 T77	L30-T73 HydrophobicContact CB-CG2 4.06Å; L30-T73 WeakPolarHBondContact CB-OG1 3.21Å; L30-T73 WeakPolarHBondContact CD2-OG1 3.45Å; V34-T73 VanDerWaalsContact CG2-CB 3.44Å; V34-T73 HydrophobicContact CG2-CG2 3.46Å; V34-T73 VanDerWaalsContact CG2-CG2 3.46Å; L69-T73 WeakPolarHBondContact O-CB 3.49Å; L69-T73 PolarHBondContact O-N 3.46Å; L69-T73 PolarHBondContact O-OG1 3.05Å; G70-T73 PolarHBondContact O-N 2.85Å; L71-T73 VanDerWaalsContact C-N 3.34Å; L71-T73 PolarHBondContact O-N 3.44Å; T73-V75 VanDerWaalsContact C-N 3.3Å; T73-V75 PolarHBondContact O-N 3.12Å; T73-L76 PolarHBondContact O-N 2.89Å; T73-T77 HydrophobicContact CG2-CG2 4.25Å; T73-T77 PolarHBondContact O-N 3.37Å; T73-T77 PolarHBondContact O-OG1 2.67Å
74	L	97.4	Very high	96.7	Very high	6 Å²	6	31.9 Å²	31.9	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-60.4	-36.8	172	-74.8	167.8	0	0	0	112.6	V34 V37 G70 L71 L76 T77 E78 C85	V34-L74 HydrophobicContact CG1-CD2 3.8Å; V34-L74 HydrophobicContact CG1-CG 4.06Å; V34-L74 HydrophobicContact CG2-CG 4.3Å; V37-L74 HydrophobicContact CB-CD1 4.48Å; V37-L74 HydrophobicContact CG1-CD1 3.82Å; G70-L74 WeakPolarHBondContact O-CG 3.31Å; G70-L74 PolarHBondContact O-N 3.29Å; L71-L74 PolarHBondContact O-N 3.19Å; L74-L76 VanDerWaalsContact C-N 3.27Å; L74-L76 PolarHBondContact O-N 3.27Å; L74-T77 PolarHBondContact O-N 3.05Å; L74-E78 HydrophobicContact CD2-CG 3.84Å; L74-E78 WeakPolarHBondContact O-CB 3.43Å; L74-E78 PolarHBondContact O-N 3.25Å; L74-C85 HydrophobicContact CB-CB 4.41Å
75	V	98.1	Very high	96.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-38.7	171.6	164.8	0	0	0	0	111.6	L71 F72 T73 A82 C85 Q122 W125 L126	L71-V75 WeakPolarHBondContact O-CG2 3.42Å; L71-V75 PolarHBondContact O-N 3.47Å; F72-V75 WeakPolarHBondContact O-CB 3.38Å; F72-V75 PolarHBondContact O-N 2.91Å; T73-V75 VanDerWaalsContact C-N 3.3Å; T73-V75 PolarHBondContact O-N 3.12Å; V75-A82 HydrophobicContact CB-CB 4.44Å; V75-A82 HydrophobicContact CG1-CB 4.28Å; V75-A82 HydrophobicContact CG2-CB 4.45Å; V75-C85 HydrophobicContact CG2-CB 3.66Å; V75-Q122 WeakPolarHBondContact O-CB 3.33Å; V75-Q122 WeakPolarHBondContact O-CG 3.45Å; V75-Q122 PolarHBondContact O-NE2 2.63Å; V75-W125 HydrophobicContact CG1-CE3 4.03Å; V75-W125 HydrophobicContact CG1-CZ3 3.68Å; V75-L126 HydrophobicContact CG1-CB 4.02Å; V75-L126 HydrophobicContact CG1-CD1 4.23Å; V75-L126 HydrophobicContact CG1-CD2 4.05Å; V75-L126 HydrophobicContact CG1-CG 4.33Å
76	L	97.7	Very high	96.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-77	-37.5	178.5	-61.2	-172	0	0	0	113.6	L14 F72 T73 L74 I107 N118 P119 Q122 L123	L14-L76 HydrophobicContact CD1-CB 4.2Å; L14-L76 HydrophobicContact CD1-CD1 3.75Å; F72-L76 HydrophobicContact CE1-CD1 4.17Å; F72-L76 HydrophobicContact CE2-CD1 3.87Å; F72-L76 HydrophobicContact CE2-CD2 4.41Å; F72-L76 HydrophobicContact CE2-CG 4.14Å; F72-L76 HydrophobicContact CZ-CD1 3.64Å; F72-L76 HydrophobicContact CZ-CG 4.38Å; F72-L76 PolarHBondContact O-N 3.22Å; F72-L76 VanDerWaalsContact O-N 3.17Å; T73-L76 PolarHBondContact O-N 2.89Å; L74-L76 VanDerWaalsContact C-N 3.27Å; L74-L76 PolarHBondContact O-N 3.27Å; L76-I107 HydrophobicContact CD1-CD1 4.38Å; L76-N118 PolarHBondContact O-ND2 3.22Å; L76-P119 HydrophobicContact CB-CB 4.31Å; L76-P119 WeakPolarHBondContact O-CA 3.4Å; L76-Q122 HydrophobicContact CD2-CB 4.15Å; L76-L123 HydrophobicContact CD1-CD1 4.46Å; L76-L123 HydrophobicContact CD2-CB 3.88Å; L76-L123 HydrophobicContact CD2-CD1 4Å
77	T	96.3	Very high	96.6	Very high	19 Å²	19	34.3 Å²	34.3	12%	0.117	17%	0.169	C	C	.	.	H	α-helix	trans	-95.4	-25.8	-172.1	62.3	0	0	0	0	114.5	R13 T73 L74 P79	R13-T77 HydrophobicContact CB-CG2 3.73Å; T73-T77 HydrophobicContact CG2-CG2 4.25Å; T73-T77 PolarHBondContact O-N 3.37Å; T73-T77 PolarHBondContact O-OG1 2.67Å; L74-T77 PolarHBondContact O-N 3.05Å; T77-P79 WeakPolarHBondContact O-CD 3.36Å
78	E	95.2	Very high	96.5	Very high	39 Å²	39	34.5 Å²	34.5	18%	0.182	17%	0.17	C	C	.	.			trans	-124.6	79.7	-171.7	-54.2	-64.5	144.8	0	0	111.8	R13 L74 T80 Q81 A82	R13-E78 IonicContact CZ-OE1 3.15Å; R13-E78 IonicContact NH1-OE1 3.86Å; R13-E78 PolarHBondContact NH1-OE1 3.44Å; L74-E78 HydrophobicContact CD2-CG 3.84Å; L74-E78 WeakPolarHBondContact O-CB 3.43Å; L74-E78 PolarHBondContact O-N 3.25Å; E78-T80 PolarHBondContact O-N 3.05Å; E78-T80 VanDerWaalsContact O-N 3.11Å; E78-Q81 HydrophobicContact CB-CB 4.15Å; E78-Q81 HydrophobicContact CB-CG 4.39Å; E78-Q81 PolarHBondContact O-N 2.94Å; E78-A82 PolarHBondContact O-N 3.45Å
79	P	94.4	Very high	96.4	Very high	55 Å²	55	34.5 Å²	34.5	36%	0.357	17%	0.17	S	C	.	.	H	α-helix	trans	-56.7	-34	-173.1	-24.6	31.8	0	0	0	114.7	T77 Q81 A82 N118 Q122	T77-P79 WeakPolarHBondContact O-CD 3.36Å; P79-Q81 PolarHBondContact O-N 2.93Å; P79-A82 PolarHBondContact O-N 2.76Å; P79-N118 WeakPolarHBondContact CG-OD1 3.26Å; P79-Q122 HydrophobicContact CB-CG 4.43Å; P79-Q122 HydrophobicContact CG-CG 4.01Å
80	T	95.4	Very high	96.3	Very high	134 Å²	134	37.5 Å²	37.5	82%	0.822	19%	0.188	S	C	*	.	H	α-helix	trans	-65.7	-20.7	177.3	51.6	0	0	0	0	113.4	E78	E78-T80 PolarHBondContact O-N 3.05Å; E78-T80 VanDerWaalsContact O-N 3.11Å
81	Q	93.3	Very high	96.1	Very high	90 Å²	90	42.7 Å²	42.7	42%	0.421	22%	0.215	S	C	.	.	H	α-helix	trans	-107	-14.1	178.7	-60.7	-178.8	74.1	0	0	112.3	E78 P79 Q83 R84 C85	E78-Q81 HydrophobicContact CB-CB 4.15Å; E78-Q81 HydrophobicContact CB-CG 4.39Å; E78-Q81 PolarHBondContact O-N 2.94Å; P79-Q81 PolarHBondContact O-N 2.93Å; Q81-Q83 PolarHBondContact O-N 2.97Å; Q81-R84 PolarHBondContact O-N 3.44Å; Q81-C85 PolarHBondContact O-N 2.97Å; Q81-C85 PolarHBondContact O-SG 2.94Å
82	A	95.5	Very high	96	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-57.1	-41.7	-170	0	0	0	0	0	114.4	V75 E78 P79 R84 C85 Y86 W125	V75-A82 HydrophobicContact CB-CB 4.44Å; V75-A82 HydrophobicContact CG1-CB 4.28Å; V75-A82 HydrophobicContact CG2-CB 4.45Å; E78-A82 PolarHBondContact O-N 3.45Å; P79-A82 PolarHBondContact O-N 2.76Å; A82-R84 VanDerWaalsContact C-N 3.34Å; A82-R84 PolarHBondContact O-N 2.89Å; A82-C85 PolarHBondContact O-N 3.03Å; A82-Y86 VanDerWaalsContact O-CB 3.29Å; A82-Y86 WeakPolarHBondContact O-CB 3.44Å; A82-Y86 PolarHBondContact O-N 3.41Å; A82-W125 HydrophobicContact CB-CE3 4.45Å; A82-W125 HydrophobicContact CB-CH2 4.37Å; A82-W125 HydrophobicContact CB-CZ3 3.97Å
83	Q	95.6	Very high	95.8	Very high	150 Å²	150	44.3 Å²	44.3	70%	0.701	22%	0.224	S	C	*	.	H	α-helix	trans	-60.7	-42.1	176.5	-70.8	-175	-6.5	0	0	112.3	Q81 R87 W125	Q81-Q83 PolarHBondContact O-N 2.97Å; Q83-R87 WeakPolarHBondContact O-CB 3.46Å; Q83-R87 PolarHBondContact O-N 3.04Å; Q83-W125 HydrophobicContact CG-CH2 4.34Å; Q83-W125 HydrophobicContact CG-CZ2 3.94Å
84	R	94.1	Very high	95.6	Very high	85 Å²	85	52 Å²	52	32%	0.321	25%	0.253	S	S	.	.	H	α-helix	trans	-68.8	-46.8	175	169.8	168.9	169.6	-169.6	-15.7	111.3	E46 Q81 A82 Y86 R87 D88	E46-R84 VanDerWaalsContact OE1-CD 3.23Å; E46-R84 WeakPolarHBondContact OE1-CD 3.39Å; E46-R84 IonicContact OE1-CZ 3.6Å; E46-R84 IonicContact OE1-NE 3.24Å; E46-R84 PolarHBondContact OE1-NE 3.21Å; E46-R84 IonicContact OE1-NH1 2.68Å; E46-R84 PolarHBondContact OE1-NH1 3.17Å; Q81-R84 PolarHBondContact O-N 3.44Å; A82-R84 VanDerWaalsContact C-N 3.34Å; A82-R84 PolarHBondContact O-N 2.89Å; R84-Y86 VanDerWaalsContact C-N 3.25Å; R84-Y86 PolarHBondContact O-N 3.46Å; R84-R87 WeakPolarHBondContact O-CB 3.49Å; R84-R87 PolarHBondContact O-N 3.18Å; R84-D88 VanDerWaalsContact CG-OD2 3.25Å; R84-D88 WeakPolarHBondContact CG-OD2 3.39Å; R84-D88 IonicContact NE-OD2 2.67Å; R84-D88 PolarHBondContact NE-OD2 3.09Å; R84-D88 WeakPolarHBondContact O-CB 3.39Å; R84-D88 PolarHBondContact O-N 3.46Å
85	C	96.4	Very high	95.4	Very high	9 Å²	9	54 Å²	54	6%	0.061	26%	0.263	C	S	.	.	H	α-helix	trans	-62	-35.1	180	-63.6	0	0	0	0	111.6	L71 L74 V75 Q81 A82 L89	L71-C85 HydrophobicContact CD2-CB 4.29Å; L74-C85 HydrophobicContact CB-CB 4.41Å; V75-C85 HydrophobicContact CG2-CB 3.66Å; Q81-C85 PolarHBondContact O-N 2.97Å; Q81-C85 PolarHBondContact O-SG 2.94Å; A82-C85 PolarHBondContact O-N 3.03Å; C85-L89 WeakPolarHBondContact O-CB 3.29Å; C85-L89 PolarHBondContact O-N 3.24Å
86	Y	97.4	Very high	95.1	Very high	19 Å²	19	56.1 Å²	56.1	8%	0.075	29%	0.285	C	S	.	.	H	α-helix	trans	-70.1	-42.3	173.5	-176.6	-105.7	0	0	0	112.9	A82 R84 L89 T90 M97 W125 L126 E129 L130 S133	A82-Y86 VanDerWaalsContact O-CB 3.29Å; A82-Y86 WeakPolarHBondContact O-CB 3.44Å; A82-Y86 PolarHBondContact O-N 3.41Å; R84-Y86 VanDerWaalsContact C-N 3.25Å; R84-Y86 PolarHBondContact O-N 3.46Å; Y86-L89 PolarHBondContact O-N 3.25Å; Y86-T90 WeakPolarHBondContact O-CB 3.34Å; Y86-T90 PolarHBondContact O-N 2.88Å; Y86-T90 PolarHBondContact O-OG1 2.85Å; Y86-M97 HydrophobicContact CE2-CE 4.18Å; Y86-W125 HydrophobicContact CG-CH2 4.33Å; Y86-L126 HydrophobicContact CD2-CD1 3.42Å; Y86-L126 VanDerWaalsContact CD2-CD1 3.42Å; Y86-L126 HydrophobicContact CE2-CD1 3.56Å; Y86-E129 HydrophobicContact CD1-CB 4.21Å; Y86-E129 HydrophobicContact CE1-CB 3.72Å; Y86-E129 HydrophobicContact CE2-CB 4.38Å; Y86-E129 PolarHBondContact OH-O 2.87Å; Y86-L130 HydrophobicContact CE2-CD2 3.95Å; Y86-L130 HydrophobicContact CE2-CG 4.29Å; Y86-S133 WeakPolarHBondContact OH-CB 3.49Å; Y86-S133 PolarHBondContact OH-OG 1.94Å
87	R	95.8	Very high	95	Very high	104 Å²	104	56.4 Å²	56.4	39%	0.392	29%	0.287	S	S	.	.	H	α-helix	trans	-57.5	-50.3	171.4	179.5	-161.1	71.7	-170.7	1.4	110.8	E46 Q83 R84 T90 L91	E46-R87 IonicContact OE2-CZ 3.77Å; E46-R87 VanDerWaalsContact OE2-CZ 3.25Å; E46-R87 IonicContact OE2-NH1 2.81Å; E46-R87 PolarHBondContact OE2-NH1 3.48Å; E46-R87 IonicContact OE2-NH2 2.74Å; E46-R87 PolarHBondContact OE2-NH2 3.27Å; Q83-R87 WeakPolarHBondContact O-CB 3.46Å; Q83-R87 PolarHBondContact O-N 3.04Å; R84-R87 WeakPolarHBondContact O-CB 3.49Å; R84-R87 PolarHBondContact O-N 3.18Å; R87-T90 WeakPolarHBondContact O-CB 3.42Å; R87-T90 PolarHBondContact O-N 3.08Å; R87-L91 HydrophobicContact CG-CD1 4.4Å; R87-L91 WeakPolarHBondContact O-CG 3.5Å; R87-L91 PolarHBondContact O-N 3.42Å; R87-L91 VanDerWaalsContact O-N 3.09Å
88	D	95.5	Very high	95	Very high	4 Å²	4	60 Å²	60	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-66.6	-39.8	-176.9	-64.3	-14.9	0	0	0	110.3	R84 T90 L91 V92	R84-D88 VanDerWaalsContact CG-OD2 3.25Å; R84-D88 WeakPolarHBondContact CG-OD2 3.39Å; R84-D88 IonicContact NE-OD2 2.67Å; R84-D88 PolarHBondContact NE-OD2 3.09Å; R84-D88 WeakPolarHBondContact O-CB 3.39Å; R84-D88 PolarHBondContact O-N 3.46Å; D88-T90 PolarHBondContact O-N 2.79Å; D88-L91 PolarHBondContact O-N 2.72Å; D88-V92 WeakPolarHBondContact O-CG1 3.39Å; D88-V92 WeakPolarHBondContact O-CG2 3.45Å; D88-V92 PolarHBondContact O-N 2.84Å
89	L	96.6	Very high	95	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.5	-42.1	170.4	178	66	0	0	0	112.7	C68 L71 C85 Y86 L91 V92 N93 M97 V100	C68-L89 HydrophobicContact CB-CD1 3.76Å; L71-L89 HydrophobicContact CB-CB 4.15Å; L71-L89 HydrophobicContact CB-CD1 4.24Å; L71-L89 HydrophobicContact CD1-CB 4.16Å; L71-L89 HydrophobicContact CD1-CD1 4.42Å; C85-L89 WeakPolarHBondContact O-CB 3.29Å; C85-L89 PolarHBondContact O-N 3.24Å; Y86-L89 PolarHBondContact O-N 3.25Å; L89-L91 PolarHBondContact O-N 2.83Å; L89-V92 PolarHBondContact O-N 3.32Å; L89-N93 WeakPolarHBondContact O-CB 3.48Å; L89-N93 PolarHBondContact O-N 3.19Å; L89-N93 PolarHBondContact O-ND2 3.04Å; L89-M97 HydrophobicContact CD1-SD 4.36Å; L89-M97 HydrophobicContact CD2-CE 4.29Å; L89-M97 HydrophobicContact CD2-SD 4.03Å; L89-M97 HydrophobicContact CG-CE 3.99Å; L89-M97 HydrophobicContact CG-SD 3.77Å; L89-V100 HydrophobicContact CD1-CG2 4.22Å; L89-V100 HydrophobicContact CD2-CG2 4.29Å
90	T	95.7	Very high	95.2	Very high	63 Å²	63	56.7 Å²	56.7	39%	0.387	29%	0.286	S	S	.	.	H	α-helix	trans	-65.5	-27	177.4	-55.6	0	0	0	0	112.2	Y86 R87 D88 N93 M97	Y86-T90 WeakPolarHBondContact O-CB 3.34Å; Y86-T90 PolarHBondContact O-N 2.88Å; Y86-T90 PolarHBondContact O-OG1 2.85Å; R87-T90 WeakPolarHBondContact O-CB 3.42Å; R87-T90 PolarHBondContact O-N 3.08Å; D88-T90 PolarHBondContact O-N 2.79Å; T90-N93 PolarHBondContact O-ND2 3.32Å; T90-N93 VanDerWaalsContact O-ND2 3.12Å; T90-M97 HydrophobicContact CG2-CE 4.4Å; T90-M97 WeakPolarHBondContact OG1-CE 3.34Å
91	L	94.6	Very high	95.3	Very high	109 Å²	109	50.8 Å²	50.8	57%	0.571	25%	0.249	S	C	*	.	H	α-helix	trans	-83	-33.4	175.1	-68.1	168.5	0	0	0	113.5	R87 D88 L89	R87-L91 HydrophobicContact CG-CD1 4.4Å; R87-L91 WeakPolarHBondContact O-CG 3.5Å; R87-L91 PolarHBondContact O-N 3.42Å; R87-L91 VanDerWaalsContact O-N 3.09Å; D88-L91 PolarHBondContact O-N 2.72Å; L89-L91 PolarHBondContact O-N 2.83Å
92	V	95.4	Very high	95.5	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.024	25%	0.249	C	C	.	.	H	α-helix	trans	-101.2	-15.5	-172.8	-52.7	0	0	0	0	115.6	L53 V57 V67 L71 D88 L89	L53-V92 HydrophobicContact CB-CG1 4.15Å; V57-V92 WeakPolarHBondContact CG1-O 3.03Å; V57-V92 HydrophobicContact CG2-CB 4.24Å; V57-V92 HydrophobicContact CG2-CG2 4.39Å; V67-V92 HydrophobicContact CG1-CG2 3.92Å; L71-V92 HydrophobicContact CD1-CG2 3.8Å; D88-V92 WeakPolarHBondContact O-CG1 3.39Å; D88-V92 WeakPolarHBondContact O-CG2 3.45Å; D88-V92 PolarHBondContact O-N 2.84Å; L89-V92 PolarHBondContact O-N 3.32Å
93	N	93.4	Very high	95.5	Very high	33 Å²	33	51 Å²	51	18%	0.176	25%	0.254	C	S	.	.			trans	-64.1	146.3	176.1	79.9	96.1	0	0	0	111.6	L89 T90 G96 M97	L89-N93 WeakPolarHBondContact O-CB 3.48Å; L89-N93 PolarHBondContact O-N 3.19Å; L89-N93 PolarHBondContact O-ND2 3.04Å; T90-N93 PolarHBondContact O-ND2 3.32Å; T90-N93 VanDerWaalsContact O-ND2 3.12Å; N93-G96 WeakPolarHBondContact OD1-CA 3.44Å; N93-G96 PolarHBondContact OD1-N 2.83Å; N93-M97 HydrophobicContact CB-SD 4.03Å; N93-M97 PolarHBondContact OD1-N 2.67Å; N93-M97 VanDerWaalsContact OD1-N 3.17Å
94	R	93.1	Very high	95.7	Very high	169 Å²	169	43.9 Å²	43.9	64%	0.638	22%	0.221	S	C	*	.	S	Bend	trans	-126.9	2.4	-176.4	-59.8	-174.1	66.7	153.9	1.1	113.7	V57 C58	V57-R94 HydrophobicContact CG1-CG 3.99Å; C58-R94 PolarHBondContact SG-NH1 3.41Å
95	D	93.9	Very high	95.8	Very high	46 Å²	46	42 Å²	42	25%	0.246	22%	0.217	C	C	.	.	S	Bend	trans	-119.3	8.8	-175.6	69.2	-18.4	0	0	0	113.1	H64 M97 N98 I99	H64-D95 VanDerWaalsContact NE2-CB 3.26Å; H64-D95 WeakPolarHBondContact NE2-CB 3.3Å; H64-D95 IonicContact NE2-OD1 2.7Å; H64-D95 PolarHBondContact NE2-OD1 2.93Å; H64-D95 IonicContact NE2-OD2 2.8Å; H64-D95 PolarHBondContact NE2-OD2 2.8Å; D95-M97 WeakPolarHBondContact OD1-CA 3.48Å; D95-M97 PolarHBondContact OD1-N 2.79Å; D95-N98 HydrophobicContact CB-CB 4.15Å; D95-N98 VanDerWaalsContact CG-N 3.35Å; D95-N98 WeakPolarHBondContact O-CB 3.43Å; D95-N98 PolarHBondContact O-N 2.99Å; D95-N98 PolarHBondContact OD1-N 2.75Å; D95-N98 PolarHBondContact OD2-N 3.36Å; D95-I99 WeakPolarHBondContact OD2-CB 3.45Å; D95-I99 VanDerWaalsContact OD2-CG2 3.32Å; D95-I99 WeakPolarHBondContact OD2-CG2 3.33Å; D95-I99 PolarHBondContact OD2-N 3.06Å
96	G	92	Very high	95.9	Very high	46 Å²	46	43.9 Å²	43.9	47%	0.474	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	69	36.3	-175	0	0	0	0	0	112.9	N93 N98	N93-G96 WeakPolarHBondContact OD1-CA 3.44Å; N93-G96 PolarHBondContact OD1-N 2.83Å; G96-N98 PolarHBondContact O-N 3.05Å
97	M	95.6	Very high	95.9	Very high	5 Å²	5	43 Å²	43	3%	0.025	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	11.4	-174.2	-53.9	-73.6	-160.2	0	0	115.1	Y86 L89 T90 N93 D95 I99 V100 L101 L130 V135	Y86-M97 HydrophobicContact CE2-CE 4.18Å; L89-M97 HydrophobicContact CD1-SD 4.36Å; L89-M97 HydrophobicContact CD2-CE 4.29Å; L89-M97 HydrophobicContact CD2-SD 4.03Å; L89-M97 HydrophobicContact CG-CE 3.99Å; L89-M97 HydrophobicContact CG-SD 3.77Å; T90-M97 HydrophobicContact CG2-CE 4.4Å; T90-M97 WeakPolarHBondContact OG1-CE 3.34Å; N93-M97 HydrophobicContact CB-SD 4.03Å; N93-M97 PolarHBondContact OD1-N 2.67Å; N93-M97 VanDerWaalsContact OD1-N 3.17Å; D95-M97 WeakPolarHBondContact OD1-CA 3.48Å; D95-M97 PolarHBondContact OD1-N 2.79Å; M97-I99 PolarHBondContact O-N 3.42Å; M97-V100 HydrophobicContact CB-CB 4.47Å; M97-V100 WeakPolarHBondContact O-CA 3.46Å; M97-V100 WeakPolarHBondContact O-CB 3.36Å; M97-V100 PolarHBondContact O-N 3.33Å; M97-L101 WeakPolarHBondContact O-CG 3.46Å; M97-L101 PolarHBondContact O-N 3.44Å; M97-L130 HydrophobicContact CB-CD2 4.42Å; M97-L130 HydrophobicContact CG-CD2 4.14Å; M97-V135 HydrophobicContact CB-CG1 4Å; M97-V135 HydrophobicContact CG-CG1 4.29Å; M97-V135 HydrophobicContact CG-CG2 4.37Å
98	N	95.7	Very high	95.9	Very high	94 Å²	94	38 Å²	38	50%	0.503	20%	0.203	S	C	.	.	H	α-helix	trans	-53.1	-47.8	-172.3	-173.7	-90.7	0	0	0	113.2	D95 G96 V100 L101 V102	D95-N98 HydrophobicContact CB-CB 4.15Å; D95-N98 VanDerWaalsContact CG-N 3.35Å; D95-N98 WeakPolarHBondContact O-CB 3.43Å; D95-N98 PolarHBondContact O-N 2.99Å; D95-N98 PolarHBondContact OD1-N 2.75Å; D95-N98 PolarHBondContact OD2-N 3.36Å; G96-N98 PolarHBondContact O-N 3.05Å; N98-V100 PolarHBondContact O-N 3.32Å; N98-L101 PolarHBondContact O-N 3.32Å; N98-V102 WeakPolarHBondContact O-CG2 3.46Å; N98-V102 PolarHBondContact O-N 3.19Å
99	I	96.3	Very high	95.9	Very high	26 Å²	26	41.6 Å²	41.6	13%	0.133	22%	0.22	C	C	.	.	H	α-helix	trans	-63.9	-30.7	179.5	-165.9	51.7	0	0	0	112.9	H64 E65 C68 L69 D95 M97 K103	H64-I99 WeakPolarHBondContact NE2-CG2 3.45Å; E65-I99 HydrophobicContact CB-CG1 4.43Å; E65-I99 HydrophobicContact CG-CD1 4.37Å; E65-I99 HydrophobicContact CG-CG1 3.82Å; C68-I99 HydrophobicContact CB-CG2 4.15Å; L69-I99 HydrophobicContact CD2-CG1 4.32Å; L69-I99 HydrophobicContact CG-CG1 4.46Å; D95-I99 WeakPolarHBondContact OD2-CB 3.45Å; D95-I99 VanDerWaalsContact OD2-CG2 3.32Å; D95-I99 WeakPolarHBondContact OD2-CG2 3.33Å; D95-I99 PolarHBondContact OD2-N 3.06Å; M97-I99 PolarHBondContact O-N 3.42Å; I99-K103 WeakPolarHBondContact O-CG 3.43Å; I99-K103 PolarHBondContact O-N 3.01Å; I99-K103 VanDerWaalsContact O-N 3.08Å
100	V	97.9	Very high	95.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-72.4	-45	176	-178	0	0	0	0	110.1	C68 F72 L89 M97 N98 V102 K103 I104	C68-V100 HydrophobicContact CB-CG2 4.38Å; F72-V100 HydrophobicContact CB-CG1 4.28Å; F72-V100 HydrophobicContact CD2-CG1 3.65Å; F72-V100 HydrophobicContact CE2-CG1 4.2Å; F72-V100 HydrophobicContact CG-CG1 4.08Å; L89-V100 HydrophobicContact CD1-CG2 4.22Å; L89-V100 HydrophobicContact CD2-CG2 4.29Å; M97-V100 HydrophobicContact CB-CB 4.47Å; M97-V100 WeakPolarHBondContact O-CA 3.46Å; M97-V100 WeakPolarHBondContact O-CB 3.36Å; M97-V100 PolarHBondContact O-N 3.33Å; N98-V100 PolarHBondContact O-N 3.32Å; V100-V102 VanDerWaalsContact C-N 3.32Å; V100-V102 PolarHBondContact O-N 2.86Å; V100-K103 PolarHBondContact O-N 3.44Å; V100-I104 HydrophobicContact CG1-CD1 3.97Å; V100-I104 HydrophobicContact CG1-CG1 4.45Å; V100-I104 VanDerWaalsContact O-CG1 3.3Å; V100-I104 WeakPolarHBondContact O-CG1 3.44Å; V100-I104 PolarHBondContact O-N 3.17Å
101	L	97.5	Very high	95.8	Very high	10 Å²	10	45.7 Å²	45.7	5%	0.052	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-41	174.4	-60.9	170.5	0	0	0	111.8	M97 N98 I104 N105 L130 V135 I136 V141	M97-L101 WeakPolarHBondContact O-CG 3.46Å; M97-L101 PolarHBondContact O-N 3.44Å; N98-L101 PolarHBondContact O-N 3.32Å; L101-I104 PolarHBondContact O-N 2.86Å; L101-N105 WeakPolarHBondContact O-CB 3.36Å; L101-N105 PolarHBondContact O-N 2.98Å; L101-N105 PolarHBondContact O-ND2 2.81Å; L101-L130 HydrophobicContact CD2-CD1 4.09Å; L101-V135 HydrophobicContact CD1-CG1 3.96Å; L101-V135 HydrophobicContact CD2-CG1 4.33Å; L101-V135 HydrophobicContact CG-CG1 4.48Å; L101-I136 WeakPolarHBondContact CD1-O 3.47Å; L101-V141 HydrophobicContact CB-CG2 4.37Å; L101-V141 HydrophobicContact CD2-CG2 3.76Å
102	V	96.8	Very high	95.8	Very high	69 Å²	69	41.2 Å²	41.2	42%	0.418	21%	0.21	S	C	.	.	H	α-helix	trans	-60.9	-44.2	175	168.7	0	0	0	0	111.1	N98 V100 N105 Q106	N98-V102 WeakPolarHBondContact O-CG2 3.46Å; N98-V102 PolarHBondContact O-N 3.19Å; V100-V102 VanDerWaalsContact C-N 3.32Å; V100-V102 PolarHBondContact O-N 2.86Å; V102-N105 PolarHBondContact O-N 3.19Å; V102-Q106 PolarHBondContact O-N 3.05Å
103	K	97.3	Very high	95.7	Very high	27 Å²	27	46.1 Å²	46.1	12%	0.117	24%	0.236	C	C	.	.	H	α-helix	trans	-75.1	-29.9	177.8	-67.5	-45.4	-171.2	-170	0	114.3	L26 L69 F72 I99 V100 Q106 I107	L26-K103 HydrophobicContact CD1-CD 4.31Å; L69-K103 HydrophobicContact CD1-CG 4.07Å; L69-K103 HydrophobicContact CD2-CB 4.01Å; L69-K103 HydrophobicContact CD2-CG 3.55Å; L69-K103 HydrophobicContact CG-CG 4.49Å; F72-K103 HydrophobicContact CE1-CB 4.06Å; I99-K103 WeakPolarHBondContact O-CG 3.43Å; I99-K103 PolarHBondContact O-N 3.01Å; I99-K103 VanDerWaalsContact O-N 3.08Å; V100-K103 PolarHBondContact O-N 3.44Å; K103-Q106 PolarHBondContact O-N 3.46Å; K103-I107 WeakPolarHBondContact O-CB 3.39Å; K103-I107 WeakPolarHBondContact O-CG1 3.35Å; K103-I107 PolarHBondContact O-N 2.68Å
104	I	98.3	Very high	95.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-52.3	167.6	-70.8	167	0	0	0	109.7	F72 V100 L101 Q106 I107 L108 L123 L126 V127 L130 V141	F72-I104 HydrophobicContact CE2-CD1 4.2Å; F72-I104 HydrophobicContact CE2-CG1 3.56Å; F72-I104 HydrophobicContact CZ-CG1 3.9Å; V100-I104 HydrophobicContact CG1-CD1 3.97Å; V100-I104 HydrophobicContact CG1-CG1 4.45Å; V100-I104 VanDerWaalsContact O-CG1 3.3Å; V100-I104 WeakPolarHBondContact O-CG1 3.44Å; V100-I104 PolarHBondContact O-N 3.17Å; L101-I104 PolarHBondContact O-N 2.86Å; I104-Q106 VanDerWaalsContact C-N 3.31Å; I104-Q106 PolarHBondContact O-N 2.96Å; I104-I107 PolarHBondContact O-N 2.94Å; I104-L108 HydrophobicContact CG2-CD1 3.74Å; I104-L108 HydrophobicContact CG2-CG 4.26Å; I104-L108 VanDerWaalsContact O-CG 3.29Å; I104-L108 WeakPolarHBondContact O-CG 3.47Å; I104-L108 PolarHBondContact O-N 2.79Å; I104-L123 HydrophobicContact CB-CD1 4.44Å; I104-L123 HydrophobicContact CG1-CD1 3.93Å; I104-L123 HydrophobicContact CG2-CD1 4.05Å; I104-L126 HydrophobicContact CD1-CD2 3.97Å; I104-L126 HydrophobicContact CD1-CG 4.36Å; I104-V127 HydrophobicContact CD1-CG2 4.46Å; I104-V127 HydrophobicContact CG2-CG2 4.19Å; I104-L130 HydrophobicContact CD1-CD1 3.55Å; I104-V141 HydrophobicContact CG2-CG1 3.51Å; I104-V141 HydrophobicContact CG2-CG2 4.38Å
105	N	97.6	Very high	95.8	Very high	45 Å²	45	41.3 Å²	41.3	24%	0.241	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-36.6	179.1	-74.4	-33	0	0	0	112.4	L101 V102 L108 M109 T144	L101-N105 WeakPolarHBondContact O-CB 3.36Å; L101-N105 PolarHBondContact O-N 2.98Å; L101-N105 PolarHBondContact O-ND2 2.81Å; V102-N105 PolarHBondContact O-N 3.19Å; N105-L108 PolarHBondContact O-N 3.44Å; N105-M109 WeakPolarHBondContact O-CB 3.26Å; N105-M109 WeakPolarHBondContact O-CG 3.44Å; N105-M109 PolarHBondContact O-N 2.96Å; N105-T144 WeakPolarHBondContact OD1-CB 3.36Å; N105-T144 PolarHBondContact OD1-OG1 2.74Å
106	Q	96.7	Very high	95.8	Very high	48 Å²	48	41.6 Å²	41.6	22%	0.224	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-48.5	173.1	-165.4	-178.3	0.8	0	0	111.8	L26 V102 K103 I104 L108 M109 E110	L26-Q106 HydrophobicContact CD2-CG 4.21Å; V102-Q106 PolarHBondContact O-N 3.05Å; K103-Q106 PolarHBondContact O-N 3.46Å; I104-Q106 VanDerWaalsContact C-N 3.31Å; I104-Q106 PolarHBondContact O-N 2.96Å; Q106-L108 VanDerWaalsContact C-N 3.33Å; Q106-L108 PolarHBondContact O-N 3.47Å; Q106-M109 PolarHBondContact O-N 2.97Å; Q106-E110 VanDerWaalsContact CG-CD 3.41Å; Q106-E110 HydrophobicContact CG-CG 4.25Å; Q106-E110 WeakPolarHBondContact CG-OE1 3.32Å; Q106-E110 VanDerWaalsContact NE2-CD 3.32Å; Q106-E110 PolarHBondContact NE2-OE1 3Å; Q106-E110 PolarHBondContact NE2-OE2 2.99Å; Q106-E110 WeakPolarHBondContact O-CB 3.39Å; Q106-E110 PolarHBondContact O-N 3.46Å
107	I	97.4	Very high	95.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.216	C	C	.	.	I	π-helix	trans	-63	-40.4	178.5	-72.9	167.9	0	0	0	111.1	L14 L26 L30 F72 L76 K103 I104 K111 F112 L115 L123	L14-I107 HydrophobicContact CD2-CD1 4.36Å; L26-I107 HydrophobicContact CD2-CG1 3.87Å; L30-I107 HydrophobicContact CD1-CD1 4.1Å; F72-I107 HydrophobicContact CE1-CD1 3.9Å; F72-I107 HydrophobicContact CZ-CD1 3.85Å; L76-I107 HydrophobicContact CD1-CD1 4.38Å; K103-I107 WeakPolarHBondContact O-CB 3.39Å; K103-I107 WeakPolarHBondContact O-CG1 3.35Å; K103-I107 PolarHBondContact O-N 2.68Å; I104-I107 PolarHBondContact O-N 2.94Å; I107-K111 HydrophobicContact CG2-CB 4.45Å; I107-K111 CarbonylContact O-C 3.53Å; I107-K111 WeakPolarHBondContact O-CA 3.44Å; I107-K111 PolarHBondContact O-N 2.9Å; I107-F112 PolarHBondContact O-N 2.51Å; I107-L115 HydrophobicContact CG2-CD1 4.12Å; I107-L115 HydrophobicContact CG2-CD2 4.22Å; I107-L123 HydrophobicContact CG2-CD2 4.14Å
108	L	97.2	Very high	95.9	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	23%	0.232	C	C	.	.	I	π-helix	trans	-62.6	-47.1	176	-69	170.8	0	0	0	111.8	I104 N105 Q106 F112 L123 V141 T144 L145 Q148	I104-L108 HydrophobicContact CG2-CD1 3.74Å; I104-L108 HydrophobicContact CG2-CG 4.26Å; I104-L108 VanDerWaalsContact O-CG 3.29Å; I104-L108 WeakPolarHBondContact O-CG 3.47Å; I104-L108 PolarHBondContact O-N 2.79Å; N105-L108 PolarHBondContact O-N 3.44Å; Q106-L108 VanDerWaalsContact C-N 3.33Å; Q106-L108 PolarHBondContact O-N 3.47Å; L108-F112 HydrophobicContact CD2-CD2 3.8Å; L108-F112 HydrophobicContact CD2-CE2 4.19Å; L108-F112 WeakPolarHBondContact O-CB 3.46Å; L108-L123 HydrophobicContact CD2-CD2 3.79Å; L108-L123 HydrophobicContact CG-CD2 4.32Å; L108-V141 HydrophobicContact CD1-CG1 4.21Å; L108-T144 HydrophobicContact CB-CG2 3.7Å; L108-T144 HydrophobicContact CD1-CG2 3.87Å; L108-T144 HydrophobicContact CG-CG2 4.45Å; L108-L145 HydrophobicContact CD1-CD2 4.5Å; L108-L145 HydrophobicContact CD1-CG 3.95Å; L108-L145 HydrophobicContact CD2-CD2 3.56Å; L108-L145 HydrophobicContact CD2-CG 3.94Å; L108-Q148 HydrophobicContact CD2-CG 4.13Å; L108-Q148 PolarHBondContact O-NE2 2.8Å; L108-Q148 PolarHBondContact O-OE1 3.47Å
109	M	95.2	Very high	95.9	Very high	79 Å²	79	41.9 Å²	41.9	39%	0.389	21%	0.209	S	C	.	.	I	π-helix	trans	-76.5	-36.1	-175.9	-69.6	-62.5	-65.9	0	0	114	N105 Q106 T144 K147 P284	N105-M109 WeakPolarHBondContact O-CB 3.26Å; N105-M109 WeakPolarHBondContact O-CG 3.44Å; N105-M109 PolarHBondContact O-N 2.96Å; Q106-M109 PolarHBondContact O-N 2.97Å; M109-T144 HydrophobicContact CG-CG2 3.88Å; M109-T144 HydrophobicContact SD-CG2 3.85Å; M109-K147 HydrophobicContact SD-CD 4.43Å; M109-P284 HydrophobicContact CE-CB 4.02Å; M109-P284 HydrophobicContact CE-CG 3.89Å; M109-P284 VanDerWaalsContact O-CB 3.3Å; M109-P284 WeakPolarHBondContact O-CB 3.49Å; M109-P284 HydrophobicContact SD-CB 4.44Å; M109-P284 HydrophobicContact SD-CG 3.71Å
110	E	94.4	Very high	95.9	Very high	110 Å²	110	41.7 Å²	41.7	51%	0.514	21%	0.206	S	C	.	.	I	π-helix	trans	-104.4	-31.7	-172.6	-63.4	174.2	-163.1	0	0	114.4	Q106	Q106-E110 VanDerWaalsContact CG-CD 3.41Å; Q106-E110 HydrophobicContact CG-CG 4.25Å; Q106-E110 WeakPolarHBondContact CG-OE1 3.32Å; Q106-E110 VanDerWaalsContact NE2-CD 3.32Å; Q106-E110 PolarHBondContact NE2-OE1 3Å; Q106-E110 PolarHBondContact NE2-OE2 2.99Å; Q106-E110 WeakPolarHBondContact O-CB 3.39Å; Q106-E110 PolarHBondContact O-N 3.46Å
111	K	94.9	Very high	95.9	Very high	39 Å²	39	45 Å²	45	17%	0.17	23%	0.226	C	C	.	.	I	π-helix	trans	-123.7	-8.5	-162.6	-47.6	-60.3	173.6	178.6	0	114.5	L15 D24 L26 I107 L113 K114 L115	L15-K111 HydrophobicContact CD1-CD 4.38Å; L15-K111 HydrophobicContact CD2-CB 3.98Å; D24-K111 IonicContact OD1-NZ 3.74Å; D24-K111 WeakPolarHBondContact OD2-CE 3.35Å; D24-K111 IonicContact OD2-NZ 2.64Å; D24-K111 PolarHBondContact OD2-NZ 3.28Å; L26-K111 HydrophobicContact CD2-CG 4.23Å; I107-K111 HydrophobicContact CG2-CB 4.45Å; I107-K111 CarbonylContact O-C 3.53Å; I107-K111 WeakPolarHBondContact O-CA 3.44Å; I107-K111 PolarHBondContact O-N 2.9Å; K111-L113 VanDerWaalsContact C-N 3.28Å; K111-L113 PolarHBondContact O-N 3.29Å; K111-L113 VanDerWaalsContact O-N 3.12Å; K111-K114 CarbonylContact O-C 2.99Å; K111-K114 WeakPolarHBondContact O-CA 3.31Å; K111-K114 PolarHBondContact O-N 3.12Å; K111-L115 PolarHBondContact O-N 2.99Å
112	F	95.9	Very high	95.9	Very high	14 Å²	14	45.6 Å²	45.6	6%	0.061	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-56.1	-37.8	-167.3	-173.3	-104.1	0	0	0	114.2	I107 L108 L115 R120 Q148 L161	I107-F112 PolarHBondContact O-N 2.51Å; L108-F112 HydrophobicContact CD2-CD2 3.8Å; L108-F112 HydrophobicContact CD2-CE2 4.19Å; L108-F112 WeakPolarHBondContact O-CB 3.46Å; F112-L115 HydrophobicContact CD2-CD2 4.18Å; F112-L115 HydrophobicContact CE2-CD2 4.47Å; F112-L115 VanDerWaalsContact O-CB 3.31Å; F112-L115 WeakPolarHBondContact O-CB 3.11Å; F112-L115 PolarHBondContact O-N 3.33Å; F112-R120 HydrophobicContact CE2-CG 3.78Å; F112-R120 HydrophobicContact CZ-CG 3.85Å; F112-R120 PolarHBondContact O-NH2 3.28Å; F112-Q148 HydrophobicContact CB-CG 4.4Å; F112-Q148 HydrophobicContact CD1-CB 3.75Å; F112-Q148 HydrophobicContact CD1-CG 3.9Å; F112-Q148 HydrophobicContact CD2-CG 4.43Å; F112-Q148 HydrophobicContact CE1-CB 3.8Å; F112-Q148 HydrophobicContact CE1-CG 4.3Å; F112-Q148 HydrophobicContact CG-CB 4.34Å; F112-Q148 HydrophobicContact CG-CG 3.98Å; F112-Q148 HydrophobicContact CZ-CB 4.4Å; F112-L161 HydrophobicContact CE1-CD2 3.8Å; F112-L161 HydrophobicContact CZ-CD1 4.04Å; F112-L161 HydrophobicContact CZ-CD2 3.76Å; F112-L161 HydrophobicContact CZ-CG 4.48Å
113	L	92.1	Very high	96	Very high	108 Å²	108	42.3 Å²	42.3	57%	0.565	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-66.3	-36	176.7	-61.3	179.5	0	0	0	112.5	K111 R120 D285	K111-L113 VanDerWaalsContact C-N 3.28Å; K111-L113 PolarHBondContact O-N 3.29Å; K111-L113 VanDerWaalsContact O-N 3.12Å; L113-R120 PolarHBondContact O-NH2 3.04Å; L113-D285 HydrophobicContact CD1-CB 3.79Å
114	K	93.8	Very high	96	Very high	100 Å²	100	41.3 Å²	41.3	44%	0.435	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-83	-7.5	175.5	-66.8	-161	-179.7	-171	0	113.9	L15 V16 D21 K111 Q116	L15-K114 CarbonylContact C-O 3.57Å; L15-K114 WeakPolarHBondContact CA-O 3.34Å; L15-K114 HydrophobicContact CD2-CB 4.49Å; V16-K114 PolarHBondContact N-O 2.72Å; D21-K114 IonicContact OD1-NZ 3.25Å; D21-K114 PolarHBondContact OD1-NZ 3.12Å; K111-K114 CarbonylContact O-C 2.99Å; K111-K114 WeakPolarHBondContact O-CA 3.31Å; K111-K114 PolarHBondContact O-N 3.12Å; K114-Q116 PolarHBondContact O-N 2.88Å
115	L	95	Very high	96	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-63.9	131.4	-178.3	-164.9	64.4	0	0	0	111	L14 L15 I107 K111 F112 P119 R120 L123	L14-L115 HydrophobicContact CD1-CD1 3.85Å; L14-L115 HydrophobicContact CG-CD1 4.03Å; L15-L115 HydrophobicContact CD2-CD1 4.17Å; I107-L115 HydrophobicContact CG2-CD1 4.12Å; I107-L115 HydrophobicContact CG2-CD2 4.22Å; K111-L115 PolarHBondContact O-N 2.99Å; F112-L115 HydrophobicContact CD2-CD2 4.18Å; F112-L115 HydrophobicContact CE2-CD2 4.47Å; F112-L115 VanDerWaalsContact O-CB 3.31Å; F112-L115 WeakPolarHBondContact O-CB 3.11Å; F112-L115 PolarHBondContact O-N 3.33Å; L115-P119 HydrophobicContact CD1-CB 3.75Å; L115-P119 HydrophobicContact CG-CB 4.01Å; L115-R120 HydrophobicContact CD2-CB 3.9Å; L115-R120 HydrophobicContact CD2-CG 4.37Å; L115-R120 HydrophobicContact CG-CB 4.17Å; L115-R120 VanDerWaalsContact O-CZ 3.31Å; L115-R120 PolarHBondContact O-NH1 3.35Å; L115-R120 PolarHBondContact O-NH2 3.09Å; L115-R120 VanDerWaalsContact O-NH2 3.09Å; L115-L123 HydrophobicContact CD2-CB 4.5Å; L115-L123 HydrophobicContact CD2-CD2 3.79Å
116	Q	94.9	Very high	96	Very high	52 Å²	52	42.1 Å²	42.1	24%	0.243	21%	0.205	C	C	.	.			trans	-65	151.9	175.2	-67.6	-177.2	28.8	0	0	110.6	G12 L14 L15 V16 K114 N118 P119 R120	G12-Q116 PolarHBondContact O-NE2 3.44Å; L14-Q116 PolarHBondContact O-N 3.19Å; L15-Q116 PolarHBondContact O-NE2 3.49Å; V16-Q116 HydrophobicContact CG2-CG 3.78Å; K114-Q116 PolarHBondContact O-N 2.88Å; Q116-N118 VanDerWaalsContact C-N 3.32Å; Q116-N118 PolarHBondContact O-N 3.41Å; Q116-P119 HydrophobicContact CB-CG 4.05Å; Q116-P119 WeakPolarHBondContact O-CD 3.23Å; Q116-R120 WeakPolarHBondContact O-CB 3.31Å; Q116-R120 PolarHBondContact O-N 3.33Å
117	D	93.6	Very high	96.1	Very high	80 Å²	80	39.8 Å²	39.8	43%	0.428	19%	0.194	S	C	.	.	H	α-helix	trans	-64.4	-32.5	-170.2	-67	-40.4	0	0	0	114	R120 T121 K157	D117-R120 IonicContact OD1-NH1 3.34Å; D117-R120 PolarHBondContact OD1-NH1 3.37Å; D117-T121 WeakPolarHBondContact O-CB 3.37Å; D117-T121 PolarHBondContact O-N 2.84Å; D117-T121 PolarHBondContact O-OG1 2.86Å; D117-K157 WeakPolarHBondContact OD1-CE 3.45Å; D117-K157 IonicContact OD1-NZ 3.98Å; D117-K157 PolarHBondContact OD1-NZ 3.32Å; D117-K157 IonicContact OD2-NZ 3.27Å; D117-K157 PolarHBondContact OD2-NZ 2.81Å
118	N	95.4	Very high	96.1	Very high	70 Å²	70	41.8 Å²	41.8	37%	0.374	20%	0.202	S	C	.	.	H	α-helix	trans	-67.7	-56.6	173.6	177.6	83.1	0	0	0	112.1	L76 P79 Q116 R120 T121 Q122	L76-N118 PolarHBondContact O-ND2 3.22Å; P79-N118 WeakPolarHBondContact CG-OD1 3.26Å; Q116-N118 VanDerWaalsContact C-N 3.32Å; Q116-N118 PolarHBondContact O-N 3.41Å; N118-R120 VanDerWaalsContact C-N 3.26Å; N118-R120 PolarHBondContact O-N 2.73Å; N118-T121 PolarHBondContact O-N 3.01Å; N118-T121 VanDerWaalsContact O-N 3.08Å; N118-Q122 WeakPolarHBondContact O-CG 3.33Å; N118-Q122 PolarHBondContact O-N 3Å
119	P	96.7	Very high	96.1	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-51.3	-36.6	167.9	-31.8	36.4	0	0	0	115.5	R13 L14 L76 L115 Q116 Q122 L123	R13-P119 WeakPolarHBondContact O-CG 3.45Å; L14-P119 HydrophobicContact CD1-CB 4.01Å; L14-P119 HydrophobicContact CD1-CG 4.41Å; L76-P119 HydrophobicContact CB-CB 4.31Å; L76-P119 WeakPolarHBondContact O-CA 3.4Å; L115-P119 HydrophobicContact CD1-CB 3.75Å; L115-P119 HydrophobicContact CG-CB 4.01Å; Q116-P119 HydrophobicContact CB-CG 4.05Å; Q116-P119 WeakPolarHBondContact O-CD 3.23Å; P119-Q122 PolarHBondContact O-N 2.71Å; P119-L123 VanDerWaalsContact O-CB 3.23Å; P119-L123 WeakPolarHBondContact O-CB 3.4Å; P119-L123 PolarHBondContact O-N 3.18Å
120	R	96.4	Very high	96.2	Very high	22 Å²	22	39.8 Å²	39.8	8%	0.083	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-43.7	175.3	-173.8	-178.7	-75.3	118.3	-0.3	111.6	F112 L113 L115 Q116 D117 N118 L123 V124 W160	F112-R120 HydrophobicContact CE2-CG 3.78Å; F112-R120 HydrophobicContact CZ-CG 3.85Å; F112-R120 PolarHBondContact O-NH2 3.28Å; L113-R120 PolarHBondContact O-NH2 3.04Å; L115-R120 HydrophobicContact CD2-CB 3.9Å; L115-R120 HydrophobicContact CD2-CG 4.37Å; L115-R120 HydrophobicContact CG-CB 4.17Å; L115-R120 VanDerWaalsContact O-CZ 3.31Å; L115-R120 PolarHBondContact O-NH1 3.35Å; L115-R120 PolarHBondContact O-NH2 3.09Å; L115-R120 VanDerWaalsContact O-NH2 3.09Å; Q116-R120 WeakPolarHBondContact O-CB 3.31Å; Q116-R120 PolarHBondContact O-N 3.33Å; D117-R120 IonicContact OD1-NH1 3.34Å; D117-R120 PolarHBondContact OD1-NH1 3.37Å; N118-R120 VanDerWaalsContact C-N 3.26Å; N118-R120 PolarHBondContact O-N 2.73Å; R120-L123 PolarHBondContact O-N 3.46Å; R120-V124 PolarHBondContact O-N 3.2Å; R120-W160 HydrophobicContact CG-CH2 4.02Å; R120-W160 HydrophobicContact CG-CZ3 3.73Å
121	T	96.8	Very high	96.4	Very high	68 Å²	68	34.6 Å²	34.6	42%	0.417	17%	0.167	S	C	.	.	H	α-helix	trans	-66.1	-45.8	176.8	-54.7	0	0	0	0	111.1	D117 N118 L123 V124 W125 W160	D117-T121 WeakPolarHBondContact O-CB 3.37Å; D117-T121 PolarHBondContact O-N 2.84Å; D117-T121 PolarHBondContact O-OG1 2.86Å; N118-T121 PolarHBondContact O-N 3.01Å; N118-T121 VanDerWaalsContact O-N 3.08Å; T121-L123 VanDerWaalsContact C-N 3.32Å; T121-L123 PolarHBondContact O-N 3.44Å; T121-V124 PolarHBondContact O-N 2.86Å; T121-W125 PolarHBondContact O-N 3.42Å; T121-W160 HydrophobicContact CG2-CZ2 4.33Å
122	Q	98.1	Very high	96.5	Very high	23 Å²	23	37.4 Å²	37.4	11%	0.107	18%	0.179	C	C	.	.	H	α-helix	trans	-65.7	-30	177.1	-71.9	-61.2	111.4	0	0	113.6	V75 L76 P79 N118 P119 L126	V75-Q122 WeakPolarHBondContact O-CB 3.33Å; V75-Q122 WeakPolarHBondContact O-CG 3.45Å; V75-Q122 PolarHBondContact O-NE2 2.63Å; L76-Q122 HydrophobicContact CD2-CB 4.15Å; P79-Q122 HydrophobicContact CB-CG 4.43Å; P79-Q122 HydrophobicContact CG-CG 4.01Å; N118-Q122 WeakPolarHBondContact O-CG 3.33Å; N118-Q122 PolarHBondContact O-N 3Å; P119-Q122 PolarHBondContact O-N 2.71Å; Q122-L126 VanDerWaalsContact O-CB 3.31Å; Q122-L126 WeakPolarHBondContact O-CB 3.45Å; Q122-L126 PolarHBondContact O-N 3.08Å
123	L	98.1	Very high	96.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.6	-44.5	175	-174.3	63.4	0	0	0	111.2	L76 I104 I107 L108 L115 P119 R120 T121 L126 V127	L76-L123 HydrophobicContact CD1-CD1 4.46Å; L76-L123 HydrophobicContact CD2-CB 3.88Å; L76-L123 HydrophobicContact CD2-CD1 4Å; I104-L123 HydrophobicContact CB-CD1 4.44Å; I104-L123 HydrophobicContact CG1-CD1 3.93Å; I104-L123 HydrophobicContact CG2-CD1 4.05Å; I107-L123 HydrophobicContact CG2-CD2 4.14Å; L108-L123 HydrophobicContact CD2-CD2 3.79Å; L108-L123 HydrophobicContact CG-CD2 4.32Å; L115-L123 HydrophobicContact CD2-CB 4.5Å; L115-L123 HydrophobicContact CD2-CD2 3.79Å; P119-L123 VanDerWaalsContact O-CB 3.23Å; P119-L123 WeakPolarHBondContact O-CB 3.4Å; P119-L123 PolarHBondContact O-N 3.18Å; R120-L123 PolarHBondContact O-N 3.46Å; T121-L123 VanDerWaalsContact C-N 3.32Å; T121-L123 PolarHBondContact O-N 3.44Å; L123-L126 PolarHBondContact O-N 3.38Å; L123-V127 WeakPolarHBondContact O-CG2 3.47Å; L123-V127 PolarHBondContact O-N 3.43Å
124	V	97.6	Very high	96.5	Very high	6 Å²	6	36.8 Å²	36.8	4%	0.036	19%	0.193	C	C	.	.	H	α-helix	trans	-68.8	-37.1	176.6	178.6	0	0	0	0	111.2	R120 T121 V127 R128 L145 W160 L161 I168	R120-V124 PolarHBondContact O-N 3.2Å; T121-V124 PolarHBondContact O-N 2.86Å; V124-V127 PolarHBondContact O-N 2.95Å; V124-R128 PolarHBondContact O-N 2.86Å; V124-L145 HydrophobicContact CG2-CD2 4.22Å; V124-W160 HydrophobicContact CB-CH2 4.12Å; V124-W160 HydrophobicContact CB-CZ2 4.44Å; V124-W160 HydrophobicContact CG2-CH2 3.63Å; V124-W160 HydrophobicContact CG2-CZ2 4.4Å; V124-W160 HydrophobicContact CG2-CZ3 4.29Å; V124-L161 HydrophobicContact CG2-CD1 4Å; V124-I168 HydrophobicContact CG1-CD1 3.95Å
125	W	98.1	Very high	96.6	Very high	61 Å²	61	33 Å²	33	23%	0.231	18%	0.178	C	C	.	.	H	α-helix	trans	-59.3	-49.6	170.1	175.4	78.4	0	0	0	112.1	V75 A82 Q83 Y86 T121 V127 R128 E129	V75-W125 HydrophobicContact CG1-CE3 4.03Å; V75-W125 HydrophobicContact CG1-CZ3 3.68Å; A82-W125 HydrophobicContact CB-CE3 4.45Å; A82-W125 HydrophobicContact CB-CH2 4.37Å; A82-W125 HydrophobicContact CB-CZ3 3.97Å; Q83-W125 HydrophobicContact CG-CH2 4.34Å; Q83-W125 HydrophobicContact CG-CZ2 3.94Å; Y86-W125 HydrophobicContact CG-CH2 4.33Å; T121-W125 PolarHBondContact O-N 3.42Å; W125-V127 VanDerWaalsContact C-N 3.34Å; W125-V127 PolarHBondContact O-N 3.46Å; W125-R128 WeakPolarHBondContact O-CB 3.2Å; W125-R128 PolarHBondContact O-N 3.36Å; W125-R128 VanDerWaalsContact O-N 3.11Å; W125-E129 HydrophobicContact CD2-CG 4.22Å; W125-E129 HydrophobicContact CH2-CG 4.02Å; W125-E129 HydrophobicContact CZ2-CG 3.53Å; W125-E129 PolarHBondContact O-N 3.22Å
126	L	98.1	Very high	96.5	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-60.1	-43.3	179.2	171.6	59.8	0	0	0	111.6	F72 V75 Y86 I104 Q122 L123 R128 E129 L130	F72-L126 HydrophobicContact CD2-CD2 3.53Å; F72-L126 HydrophobicContact CE2-CD2 3.61Å; V75-L126 HydrophobicContact CG1-CB 4.02Å; V75-L126 HydrophobicContact CG1-CD1 4.23Å; V75-L126 HydrophobicContact CG1-CD2 4.05Å; V75-L126 HydrophobicContact CG1-CG 4.33Å; Y86-L126 HydrophobicContact CD2-CD1 3.42Å; Y86-L126 VanDerWaalsContact CD2-CD1 3.42Å; Y86-L126 HydrophobicContact CE2-CD1 3.56Å; I104-L126 HydrophobicContact CD1-CD2 3.97Å; I104-L126 HydrophobicContact CD1-CG 4.36Å; Q122-L126 VanDerWaalsContact O-CB 3.31Å; Q122-L126 WeakPolarHBondContact O-CB 3.45Å; Q122-L126 PolarHBondContact O-N 3.08Å; L123-L126 PolarHBondContact O-N 3.38Å; L126-R128 VanDerWaalsContact C-N 3.31Å; L126-R128 PolarHBondContact O-N 3.4Å; L126-E129 PolarHBondContact O-N 3.09Å; L126-L130 HydrophobicContact CD1-CD1 4.15Å; L126-L130 HydrophobicContact CD1-CG 4.08Å; L126-L130 HydrophobicContact CG-CD1 4.01Å; L126-L130 HydrophobicContact CG-CG 4.41Å; L126-L130 VanDerWaalsContact O-CG 3.32Å; L126-L130 WeakPolarHBondContact O-CG 3.18Å; L126-L130 PolarHBondContact O-N 3.39Å
127	V	98	Very high	96.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-38	176.2	175.6	0	0	0	0	111.5	I104 L123 V124 W125 E129 L130 V131 V141 I142 L145	I104-V127 HydrophobicContact CD1-CG2 4.46Å; I104-V127 HydrophobicContact CG2-CG2 4.19Å; L123-V127 WeakPolarHBondContact O-CG2 3.47Å; L123-V127 PolarHBondContact O-N 3.43Å; V124-V127 PolarHBondContact O-N 2.95Å; W125-V127 VanDerWaalsContact C-N 3.34Å; W125-V127 PolarHBondContact O-N 3.46Å; V127-E129 VanDerWaalsContact C-N 3.35Å; V127-E129 PolarHBondContact O-N 2.99Å; V127-L130 PolarHBondContact O-N 3.16Å; V127-V131 HydrophobicContact CG1-CG2 4.46Å; V127-V131 WeakPolarHBondContact O-CG2 3.46Å; V127-V131 PolarHBondContact O-N 3.45Å; V127-V141 HydrophobicContact CB-CG1 4.43Å; V127-V141 HydrophobicContact CG1-CG1 3.92Å; V127-V141 HydrophobicContact CG2-CG1 3.54Å; V127-I142 HydrophobicContact CG1-CD1 3.55Å; V127-I142 HydrophobicContact CG1-CG1 4.24Å; V127-L145 HydrophobicContact CB-CD1 4.07Å; V127-L145 HydrophobicContact CG1-CD1 3.83Å; V127-L145 HydrophobicContact CG2-CD1 4.04Å
128	R	98.1	Very high	96.6	Very high	42 Å²	42	35.8 Å²	35.8	16%	0.158	20%	0.201	C	C	.	.	H	α-helix	trans	-59.4	-42.7	172.9	-173.2	176.6	-67.7	-142.3	3.2	112.1	V124 W125 L126 V131 K132 S164 I168 E171	V124-R128 PolarHBondContact O-N 2.86Å; W125-R128 WeakPolarHBondContact O-CB 3.2Å; W125-R128 PolarHBondContact O-N 3.36Å; W125-R128 VanDerWaalsContact O-N 3.11Å; L126-R128 VanDerWaalsContact C-N 3.31Å; L126-R128 PolarHBondContact O-N 3.4Å; R128-V131 PolarHBondContact O-N 3.48Å; R128-K132 WeakPolarHBondContact O-CG 3.38Å; R128-K132 PolarHBondContact O-N 2.86Å; R128-S164 PolarHBondContact NH2-O 3.48Å; R128-I168 HydrophobicContact CB-CD1 3.93Å; R128-I168 HydrophobicContact CB-CG1 3.91Å; R128-I168 HydrophobicContact CG-CG1 3.96Å; R128-I168 VanDerWaalsContact NE-CG1 3.33Å; R128-E171 IonicContact CZ-OE1 2.51Å; R128-E171 IonicContact CZ-OE2 2.79Å; R128-E171 IonicContact NH1-OE1 2.71Å; R128-E171 PolarHBondContact NH1-OE1 2.84Å; R128-E171 IonicContact NH1-OE2 3.18Å; R128-E171 PolarHBondContact NH1-OE2 3.31Å
129	E	97.8	Very high	96.6	Very high	36 Å²	36	34.6 Å²	34.6	17%	0.168	19%	0.194	C	C	.	.	H	α-helix	trans	-70.9	-35.6	176.7	-58.7	-48.2	129.1	0	0	113.2	Y86 W125 L126 V127 K132 S133	Y86-E129 HydrophobicContact CD1-CB 4.21Å; Y86-E129 HydrophobicContact CE1-CB 3.72Å; Y86-E129 HydrophobicContact CE2-CB 4.38Å; Y86-E129 PolarHBondContact OH-O 2.87Å; W125-E129 HydrophobicContact CD2-CG 4.22Å; W125-E129 HydrophobicContact CH2-CG 4.02Å; W125-E129 HydrophobicContact CZ2-CG 3.53Å; W125-E129 PolarHBondContact O-N 3.22Å; L126-E129 PolarHBondContact O-N 3.09Å; V127-E129 VanDerWaalsContact C-N 3.35Å; V127-E129 PolarHBondContact O-N 2.99Å; E129-K132 PolarHBondContact O-N 2.81Å; E129-K132 IonicContact OE1-NZ 3.19Å; E129-K132 PolarHBondContact OE1-NZ 3.11Å; E129-K132 VanDerWaalsContact OE2-CD 3.31Å; E129-K132 WeakPolarHBondContact OE2-CD 3.19Å; E129-K132 IonicContact OE2-NZ 2.98Å; E129-K132 PolarHBondContact OE2-NZ 3.18Å; E129-S133 VanDerWaalsContact O-CB 3.25Å; E129-S133 WeakPolarHBondContact O-CB 3.47Å; E129-S133 PolarHBondContact O-N 3.06Å; E129-S133 PolarHBondContact O-OG 3.43Å
130	L	97.4	Very high	96.6	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-62.9	-39.7	173.3	-70.3	168.1	0	0	0	111.9	Y86 M97 L101 I104 L126 V127 S133 G134 V135	Y86-L130 HydrophobicContact CE2-CD2 3.95Å; Y86-L130 HydrophobicContact CE2-CG 4.29Å; M97-L130 HydrophobicContact CB-CD2 4.42Å; M97-L130 HydrophobicContact CG-CD2 4.14Å; L101-L130 HydrophobicContact CD2-CD1 4.09Å; I104-L130 HydrophobicContact CD1-CD1 3.55Å; L126-L130 HydrophobicContact CD1-CD1 4.15Å; L126-L130 HydrophobicContact CD1-CG 4.08Å; L126-L130 HydrophobicContact CG-CD1 4.01Å; L126-L130 HydrophobicContact CG-CG 4.41Å; L126-L130 VanDerWaalsContact O-CG 3.32Å; L126-L130 WeakPolarHBondContact O-CG 3.18Å; L126-L130 PolarHBondContact O-N 3.39Å; V127-L130 PolarHBondContact O-N 3.16Å; L130-S133 PolarHBondContact O-N 3.14Å; L130-G134 PolarHBondContact O-N 3.11Å; L130-V135 HydrophobicContact CB-CB 4.45Å; L130-V135 HydrophobicContact CB-CG2 4.43Å; L130-V135 HydrophobicContact CD2-CB 4.34Å; L130-V135 HydrophobicContact CD2-CG1 4.39Å; L130-V135 HydrophobicContact CD2-CG2 3.87Å; L130-V135 WeakPolarHBondContact O-CB 3.09Å; L130-V135 WeakPolarHBondContact O-CG2 3.37Å; L130-V135 PolarHBondContact O-N 3.42Å; L130-V135 VanDerWaalsContact O-N 3.09Å
131	V	97.5	Very high	96.7	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-50.1	174.1	173.1	0	0	0	0	111.1	V127 R128 S133 G134 A138 I142 I168 Q172 W175	V127-V131 HydrophobicContact CG1-CG2 4.46Å; V127-V131 WeakPolarHBondContact O-CG2 3.46Å; V127-V131 PolarHBondContact O-N 3.45Å; R128-V131 PolarHBondContact O-N 3.48Å; V131-S133 PolarHBondContact O-N 2.96Å; V131-G134 PolarHBondContact O-N 3.28Å; V131-A138 HydrophobicContact CG2-CB 4.1Å; V131-I142 HydrophobicContact CG2-CD1 4.21Å; V131-I142 HydrophobicContact CG2-CG1 4.11Å; V131-I168 HydrophobicContact CG1-CG2 4.49Å; V131-I168 HydrophobicContact CG2-CG2 4.36Å; V131-Q172 HydrophobicContact CG1-CB 3.77Å; V131-Q172 HydrophobicContact CG1-CG 3.71Å; V131-W175 HydrophobicContact CB-CH2 4.46Å; V131-W175 HydrophobicContact CG1-CD2 3.66Å; V131-W175 HydrophobicContact CG1-CE3 3.5Å; V131-W175 HydrophobicContact CG1-CG 4.25Å; V131-W175 HydrophobicContact CG1-CH2 4.01Å; V131-W175 HydrophobicContact CG1-CZ2 4.18Å; V131-W175 HydrophobicContact CG1-CZ3 3.68Å; V131-W175 HydrophobicContact CG2-CH2 3.7Å; V131-W175 HydrophobicContact CG2-CZ2 4.13Å; V131-W175 HydrophobicContact CG2-CZ3 3.98Å
132	K	96.4	Very high	96.7	Very high	98 Å²	98	31.5 Å²	31.5	43%	0.426	18%	0.183	S	C	.	.	H	α-helix	trans	-55.7	-36.5	175.1	-73.5	167.2	177	174.7	0	112.7	R128 E129 G134	R128-K132 WeakPolarHBondContact O-CG 3.38Å; R128-K132 PolarHBondContact O-N 2.86Å; E129-K132 PolarHBondContact O-N 2.81Å; E129-K132 IonicContact OE1-NZ 3.19Å; E129-K132 PolarHBondContact OE1-NZ 3.11Å; E129-K132 VanDerWaalsContact OE2-CD 3.31Å; E129-K132 WeakPolarHBondContact OE2-CD 3.19Å; E129-K132 IonicContact OE2-NZ 2.98Å; E129-K132 PolarHBondContact OE2-NZ 3.18Å; K132-G134 PolarHBondContact O-N 2.84Å
133	S	94.6	Very high	96.7	Very high	64 Å²	64	32 Å²	32	45%	0.448	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-0.9	179.1	-52.7	0	0	0	0	113.2	Y86 E129 L130 V131 V135	Y86-S133 WeakPolarHBondContact OH-CB 3.49Å; Y86-S133 PolarHBondContact OH-OG 1.94Å; E129-S133 VanDerWaalsContact O-CB 3.25Å; E129-S133 WeakPolarHBondContact O-CB 3.47Å; E129-S133 PolarHBondContact O-N 3.06Å; E129-S133 PolarHBondContact O-OG 3.43Å; L130-S133 PolarHBondContact O-N 3.14Å; V131-S133 PolarHBondContact O-N 2.96Å; S133-V135 VanDerWaalsContact C-N 3.32Å; S133-V135 PolarHBondContact O-N 3.01Å
134	G	94.2	Very high	96.7	Very high	44 Å²	44	33.2 Å²	33.2	45%	0.454	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	24.5	176.5	0	0	0	0	0	114.6	L130 V131 K132 I136	L130-G134 PolarHBondContact O-N 3.11Å; V131-G134 PolarHBondContact O-N 3.28Å; K132-G134 PolarHBondContact O-N 2.84Å; G134-I136 PolarHBondContact O-N 2.84Å
135	V	96.1	Very high	96.7	Very high	21 Å²	21	33 Å²	33	13%	0.127	19%	0.192	C	C	.	.			trans	-65.2	129.9	-172.9	177.6	0	0	0	0	111.4	M97 L101 L130 S133 G137 A138	M97-V135 HydrophobicContact CB-CG1 4Å; M97-V135 HydrophobicContact CG-CG1 4.29Å; M97-V135 HydrophobicContact CG-CG2 4.37Å; L101-V135 HydrophobicContact CD1-CG1 3.96Å; L101-V135 HydrophobicContact CD2-CG1 4.33Å; L101-V135 HydrophobicContact CG-CG1 4.48Å; L130-V135 HydrophobicContact CB-CB 4.45Å; L130-V135 HydrophobicContact CB-CG2 4.43Å; L130-V135 HydrophobicContact CD2-CB 4.34Å; L130-V135 HydrophobicContact CD2-CG1 4.39Å; L130-V135 HydrophobicContact CD2-CG2 3.87Å; L130-V135 WeakPolarHBondContact O-CB 3.09Å; L130-V135 WeakPolarHBondContact O-CG2 3.37Å; L130-V135 PolarHBondContact O-N 3.42Å; L130-V135 VanDerWaalsContact O-N 3.09Å; S133-V135 VanDerWaalsContact C-N 3.32Å; S133-V135 PolarHBondContact O-N 3.01Å; V135-G137 PolarHBondContact O-N 2.88Å; V135-A138 VanDerWaalsContact O-CB 3.28Å; V135-A138 WeakPolarHBondContact O-CB 3.15Å; V135-A138 PolarHBondContact O-N 2.97Å
136	I	93.7	Very high	96.7	Very high	157 Å²	157	30 Å²	30	81%	0.805	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	126	-177.7	-59	176.1	0	0	0	109.6	L101 G134	L101-I136 WeakPolarHBondContact CD1-O 3.47Å; G134-I136 PolarHBondContact O-N 2.84Å
137	G	92.9	Very high	96.7	Very high	33 Å²	33	31.1 Å²	31.1	34%	0.34	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	1.1	-177.9	0	0	0	0	0	115.2	V135 D139 G140 V141	V135-G137 PolarHBondContact O-N 2.88Å; G137-D139 PolarHBondContact O-N 3.37Å; G137-G140 PolarHBondContact O-N 2.61Å; G137-V141 PolarHBondContact O-N 2.77Å
138	A	96.8	Very high	96.7	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-63.5	-22.6	171.7	0	0	0	0	0	112.9	V131 V135 V141 I142 W175	V131-A138 HydrophobicContact CG2-CB 4.1Å; V135-A138 VanDerWaalsContact O-CB 3.28Å; V135-A138 WeakPolarHBondContact O-CB 3.15Å; V135-A138 PolarHBondContact O-N 2.97Å; A138-V141 WeakPolarHBondContact O-CB 3.49Å; A138-V141 PolarHBondContact O-N 3.34Å; A138-I142 WeakPolarHBondContact O-CG1 3.37Å; A138-I142 PolarHBondContact O-N 3.07Å; A138-W175 HydrophobicContact CB-CH2 4.41Å; A138-W175 HydrophobicContact CB-CZ2 4.03Å
139	D	95.5	Very high	96.7	Very high	45 Å²	45	29.7 Å²	29.7	24%	0.241	18%	0.181	C	C	.	.	H	α-helix	trans	-68.5	-38.2	172.4	65.8	-31.5	0	0	0	112.4	G137 V141 I142 M143 W175 S179 L182	G137-D139 PolarHBondContact O-N 3.37Å; D139-V141 VanDerWaalsContact C-N 3.29Å; D139-V141 PolarHBondContact O-N 3.47Å; D139-I142 PolarHBondContact O-N 2.91Å; D139-M143 HydrophobicContact CB-CE 4.36Å; D139-M143 WeakPolarHBondContact O-CG 3.15Å; D139-M143 PolarHBondContact O-N 3.45Å; D139-W175 HydrophobicContact CB-CH2 3.73Å; D139-W175 HydrophobicContact CB-CZ2 4Å; D139-S179 WeakPolarHBondContact OD2-CB 3.4Å; D139-S179 PolarHBondContact OD2-OG 3.49Å; D139-L182 HydrophobicContact CB-CB 4.48Å; D139-L182 HydrophobicContact CB-CD2 3.97Å
140	G	96.3	Very high	96.6	Very high	26 Å²	26	28.4 Å²	28.4	27%	0.268	18%	0.176	S	C	.	.	H	α-helix	trans	-61.3	-35.7	169.2	0	0	0	0	0	113.2	G137 M143 T144	G137-G140 PolarHBondContact O-N 2.61Å; G140-M143 PolarHBondContact O-N 3.06Å; G140-T144 PolarHBondContact O-N 3.08Å; G140-T144 PolarHBondContact O-OG1 2.95Å
141	V	97.9	Very high	96.6	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-67.5	-42.4	173.6	174.9	0	0	0	0	111.5	L101 I104 L108 V127 G137 A138 D139 M143 T144 L145	L101-V141 HydrophobicContact CB-CG2 4.37Å; L101-V141 HydrophobicContact CD2-CG2 3.76Å; I104-V141 HydrophobicContact CG2-CG1 3.51Å; I104-V141 HydrophobicContact CG2-CG2 4.38Å; L108-V141 HydrophobicContact CD1-CG1 4.21Å; V127-V141 HydrophobicContact CB-CG1 4.43Å; V127-V141 HydrophobicContact CG1-CG1 3.92Å; V127-V141 HydrophobicContact CG2-CG1 3.54Å; G137-V141 PolarHBondContact O-N 2.77Å; A138-V141 WeakPolarHBondContact O-CB 3.49Å; A138-V141 PolarHBondContact O-N 3.34Å; D139-V141 VanDerWaalsContact C-N 3.29Å; D139-V141 PolarHBondContact O-N 3.47Å; V141-M143 PolarHBondContact O-N 2.98Å; V141-T144 PolarHBondContact O-N 2.6Å; V141-T144 VanDerWaalsContact O-N 3.15Å; V141-L145 PolarHBondContact O-N 2.9Å
142	I	98.3	Very high	96.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.9	-42.6	173.9	-63.9	-72	0	0	0	110.9	V127 V131 A138 D139 T144 L145 L146 V165 I168 L169 W175 L182	V127-I142 HydrophobicContact CG1-CD1 3.55Å; V127-I142 HydrophobicContact CG1-CG1 4.24Å; V131-I142 HydrophobicContact CG2-CD1 4.21Å; V131-I142 HydrophobicContact CG2-CG1 4.11Å; A138-I142 WeakPolarHBondContact O-CG1 3.37Å; A138-I142 PolarHBondContact O-N 3.07Å; D139-I142 PolarHBondContact O-N 2.91Å; I142-T144 PolarHBondContact O-N 2.88Å; I142-L145 HydrophobicContact CD1-CD1 4.43Å; I142-L145 WeakPolarHBondContact O-CB 3.4Å; I142-L145 PolarHBondContact O-N 3.34Å; I142-L146 HydrophobicContact CG2-CD1 4.15Å; I142-L146 HydrophobicContact CG2-CG 4.3Å; I142-L146 WeakPolarHBondContact O-CG 3.44Å; I142-L146 PolarHBondContact O-N 2.89Å; I142-V165 HydrophobicContact CG2-CG1 4.32Å; I142-I168 HydrophobicContact CD1-CD1 4.45Å; I142-I168 HydrophobicContact CD1-CG2 3.93Å; I142-L169 HydrophobicContact CG2-CD2 4.04Å; I142-W175 HydrophobicContact CG1-CH2 4.34Å; I142-W175 HydrophobicContact CG1-CZ3 4.49Å; I142-L182 HydrophobicContact CB-CD1 4.05Å; I142-L182 HydrophobicContact CG2-CD1 3.71Å
143	M	97.8	Very high	96.5	Very high	32 Å²	32	26.9 Å²	26.9	16%	0.158	17%	0.174	C	C	.	.	H	α-helix	trans	-59.4	-36.1	174.2	-67.8	179.5	-138.3	0	0	112.5	D139 G140 V141 L146 K147 M181 L182 M185	D139-M143 HydrophobicContact CB-CE 4.36Å; D139-M143 WeakPolarHBondContact O-CG 3.15Å; D139-M143 PolarHBondContact O-N 3.45Å; G140-M143 PolarHBondContact O-N 3.06Å; V141-M143 PolarHBondContact O-N 2.98Å; M143-L146 PolarHBondContact O-N 3.49Å; M143-K147 PolarHBondContact O-N 3.49Å; M143-M181 HydrophobicContact CE-CB 4.19Å; M143-M181 HydrophobicContact CE-CG 3.98Å; M143-M181 HydrophobicContact SD-CG 4.01Å; M143-L182 HydrophobicContact CE-CB 3.98Å; M143-L182 HydrophobicContact CE-CD1 4.37Å; M143-L182 HydrophobicContact CG-CD1 3.95Å; M143-M185 HydrophobicContact CB-CE 4.12Å; M143-M185 HydrophobicContact CG-CB 4.22Å; M143-M185 HydrophobicContact CG-CE 4.24Å; M143-M185 HydrophobicContact CG-CG 4.29Å; M143-M185 HydrophobicContact SD-CE 4.41Å; M143-M185 HydrophobicContact SD-CG 4.06Å
144	T	97.5	Very high	96.6	Very high	27 Å²	27	26.3 Å²	26.3	17%	0.166	17%	0.165	C	C	.	.	H	α-helix	trans	-74.4	-32	177.9	-54.3	0	0	0	0	112.3	N105 L108 M109 G140 V141 I142 Q148	N105-T144 WeakPolarHBondContact OD1-CB 3.36Å; N105-T144 PolarHBondContact OD1-OG1 2.74Å; L108-T144 HydrophobicContact CB-CG2 3.7Å; L108-T144 HydrophobicContact CD1-CG2 3.87Å; L108-T144 HydrophobicContact CG-CG2 4.45Å; M109-T144 HydrophobicContact CG-CG2 3.88Å; M109-T144 HydrophobicContact SD-CG2 3.85Å; G140-T144 PolarHBondContact O-N 3.08Å; G140-T144 PolarHBondContact O-OG1 2.95Å; V141-T144 PolarHBondContact O-N 2.6Å; V141-T144 VanDerWaalsContact O-N 3.15Å; I142-T144 PolarHBondContact O-N 2.88Å; T144-Q148 WeakPolarHBondContact O-CG 3.31Å; T144-Q148 PolarHBondContact O-NE2 3.46Å; T144-Q148 VanDerWaalsContact O-NE2 3.09Å
145	L	97.3	Very high	96.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.1	-44.9	168.3	-90.5	166.1	0	0	0	112.2	L108 V124 V127 V141 I142 K147 Q148 L161 V165	L108-L145 HydrophobicContact CD1-CD2 4.5Å; L108-L145 HydrophobicContact CD1-CG 3.95Å; L108-L145 HydrophobicContact CD2-CD2 3.56Å; L108-L145 HydrophobicContact CD2-CG 3.94Å; V124-L145 HydrophobicContact CG2-CD2 4.22Å; V127-L145 HydrophobicContact CB-CD1 4.07Å; V127-L145 HydrophobicContact CG1-CD1 3.83Å; V127-L145 HydrophobicContact CG2-CD1 4.04Å; V141-L145 PolarHBondContact O-N 2.9Å; I142-L145 HydrophobicContact CD1-CD1 4.43Å; I142-L145 WeakPolarHBondContact O-CB 3.4Å; I142-L145 PolarHBondContact O-N 3.34Å; L145-K147 PolarHBondContact O-N 2.94Å; L145-Q148 WeakPolarHBondContact O-CB 3.15Å; L145-Q148 PolarHBondContact O-N 3.37Å; L145-L161 HydrophobicContact CD2-CD1 4.02Å; L145-V165 HydrophobicContact CB-CG2 4.23Å; L145-V165 HydrophobicContact CD1-CG2 4.49Å
146	L	98.3	Very high	96.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.3	-36.4	177.2	-70.9	168.8	0	0	0	111.2	I142 M143 Q148 I149 V165 L169 T189 Y190 R281	I142-L146 HydrophobicContact CG2-CD1 4.15Å; I142-L146 HydrophobicContact CG2-CG 4.3Å; I142-L146 WeakPolarHBondContact O-CG 3.44Å; I142-L146 PolarHBondContact O-N 2.89Å; M143-L146 PolarHBondContact O-N 3.49Å; L146-Q148 VanDerWaalsContact C-N 3.26Å; L146-Q148 PolarHBondContact O-N 2.94Å; L146-I149 HydrophobicContact CD2-CD1 3.99Å; L146-I149 PolarHBondContact O-N 2.94Å; L146-V165 HydrophobicContact CD2-CG1 3.66Å; L146-V165 HydrophobicContact CG-CG1 4.16Å; L146-L169 HydrophobicContact CD2-CD1 4.42Å; L146-T189 HydrophobicContact CB-CG2 4.3Å; L146-T189 HydrophobicContact CD2-CG2 3.76Å; L146-Y190 HydrophobicContact CD2-CE2 3.74Å; L146-R281 PolarHBondContact O-NH2 3.36Å
147	K	97.9	Very high	96.7	Very high	23 Å²	23	27.4 Å²	27.4	10%	0.1	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-16.1	174	-174.3	172.1	166.4	63.9	0	114.3	M109 M143 L145 A279 L282 T283 E287	M109-K147 HydrophobicContact SD-CD 4.43Å; M143-K147 PolarHBondContact O-N 3.49Å; L145-K147 PolarHBondContact O-N 2.94Å; K147-A279 PolarHBondContact NZ-O 3.19Å; K147-L282 WeakPolarHBondContact CG-O 3.36Å; K147-L282 PolarHBondContact NZ-O 3.45Å; K147-T283 WeakPolarHBondContact O-CA 3.45Å; K147-E287 VanDerWaalsContact CE-OE2 3.29Å; K147-E287 WeakPolarHBondContact CE-OE2 3.39Å; K147-E287 IonicContact NZ-OE2 2.59Å; K147-E287 PolarHBondContact NZ-OE2 3.41Å
148	Q	97.7	Very high	96.9	Very high	12 Å²	12	26.2 Å²	26.2	6%	0.056	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-19.2	172	-52.7	-45.1	-50	0	0	113.2	L108 F112 T144 L145 L146 A150 L161	L108-Q148 HydrophobicContact CD2-CG 4.13Å; L108-Q148 PolarHBondContact O-NE2 2.8Å; L108-Q148 PolarHBondContact O-OE1 3.47Å; F112-Q148 HydrophobicContact CB-CG 4.4Å; F112-Q148 HydrophobicContact CD1-CB 3.75Å; F112-Q148 HydrophobicContact CD1-CG 3.9Å; F112-Q148 HydrophobicContact CD2-CG 4.43Å; F112-Q148 HydrophobicContact CE1-CB 3.8Å; F112-Q148 HydrophobicContact CE1-CG 4.3Å; F112-Q148 HydrophobicContact CG-CB 4.34Å; F112-Q148 HydrophobicContact CG-CG 3.98Å; F112-Q148 HydrophobicContact CZ-CB 4.4Å; T144-Q148 WeakPolarHBondContact O-CG 3.31Å; T144-Q148 PolarHBondContact O-NE2 3.46Å; T144-Q148 VanDerWaalsContact O-NE2 3.09Å; L145-Q148 WeakPolarHBondContact O-CB 3.15Å; L145-Q148 PolarHBondContact O-N 3.37Å; L146-Q148 VanDerWaalsContact C-N 3.26Å; L146-Q148 PolarHBondContact O-N 2.94Å; Q148-A150 PolarHBondContact O-N 2.83Å; Q148-L161 HydrophobicContact CB-CD2 3.78Å
149	I	98.3	Very high	97	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	17%	0.165	C	C	.	.	S	Bend	trans	-75.7	106.6	176.4	-47.7	162.3	0	0	0	108.3	L146 N158 L161 A162 T189 L193 R281	L146-I149 HydrophobicContact CD2-CD1 3.99Å; L146-I149 PolarHBondContact O-N 2.94Å; I149-N158 WeakPolarHBondContact CA-OD1 3.41Å; I149-L161 HydrophobicContact CG1-CD2 3.79Å; I149-L161 HydrophobicContact CG1-CG 3.89Å; I149-A162 HydrophobicContact CD1-CB 4.41Å; I149-A162 HydrophobicContact CG2-CB 3.88Å; I149-T189 HydrophobicContact CD1-CG2 4.34Å; I149-L193 HydrophobicContact CB-CD1 4.3Å; I149-L193 HydrophobicContact CD1-CD1 4.26Å; I149-L193 HydrophobicContact CG2-CD1 3.64Å; I149-L193 HydrophobicContact CG2-CD2 3.79Å; I149-L193 HydrophobicContact CG2-CG 4.39Å; I149-R281 PolarHBondContact O-NH1 3.42Å
150	A	97.1	Very high	97.1	Very high	8 Å²	8	29.2 Å²	29.2	7%	0.066	17%	0.167	C	C	.	.			trans	-73.1	136.1	-179.2	0	0	0	0	0	111.1	Q148 D153 N158 T283 M286	Q148-A150 PolarHBondContact O-N 2.83Å; A150-D153 HydrophobicContact CB-CB 3.92Å; A150-N158 PolarHBondContact N-OD1 3.04Å; A150-N158 PolarHBondContact O-ND2 3.2Å; A150-T283 HydrophobicContact CB-CG2 3.86Å; A150-M286 HydrophobicContact CB-CE 4.22Å
151	G	95.8	Very high	97.2	Very high	2 Å²	2	28 Å²	28	2%	0.021	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	142.9	166.8	0	0	0	0	0	110.8	D153	G151-D153 VanDerWaalsContact C-N 3.3Å; G151-D153 PolarHBondContact O-N 3.08Å
152	G	95.7	Very high	97.3	Very high	5 Å²	5	28 Å²	28	5%	0.052	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	9.8	-179.3	0	0	0	0	0	115.5	D196 E318 S319 S321	G152-D196 PolarHBondContact N-OD2 3.25Å; G152-E318 WeakPolarHBondContact CA-O 3.33Å; G152-E318 CarbonylContact O-C 3.38Å; G152-S319 PolarHBondContact O-N 3.04Å; G152-S321 WeakPolarHBondContact CA-OG 3.28Å
153	D	96.4	Very high	97.3	Very high	62 Å²	62	31.3 Å²	31.3	33%	0.332	17%	0.17	S	C	.	.			trans	-113.6	107.7	177.9	176.2	4.9	0	0	0	110.5	A150 G151 S155 N158	A150-D153 HydrophobicContact CB-CB 3.92Å; G151-D153 VanDerWaalsContact C-N 3.3Å; G151-D153 PolarHBondContact O-N 3.08Å; D153-S155 WeakPolarHBondContact OD1-CA 3.16Å; D153-S155 WeakPolarHBondContact OD1-CB 3.46Å; D153-S155 PolarHBondContact OD1-N 2.93Å; D153-S155 PolarHBondContact OD1-OG 3.21Å; D153-S155 PolarHBondContact OD2-OG 3.42Å; D153-N158 HydrophobicContact CB-CB 4.33Å; D153-N158 PolarHBondContact O-ND2 3.31Å; D153-N158 WeakPolarHBondContact OD2-CB 3.49Å
154	I	96.5	Very high	97.3	Very high	53 Å²	53	30.6 Å²	30.6	27%	0.272	17%	0.169	S	C	.	.			trans	-98	24.2	174.9	65.1	157.9	0	0	0	113	I159 L202 E318	I154-I159 HydrophobicContact CB-CD1 4.24Å; I154-I159 WeakPolarHBondContact O-CD1 3.36Å; I154-L202 HydrophobicContact CB-CD1 4.4Å; I154-L202 HydrophobicContact CG2-CD1 4.2Å; I154-E318 HydrophobicContact CD1-CG 3.73Å; I154-E318 HydrophobicContact CG1-CB 4.38Å; I154-E318 HydrophobicContact CG1-CG 3.84Å; I154-E318 HydrophobicContact CG2-CB 4.36Å; I154-E318 HydrophobicContact CG2-CG 4.26Å
155	S	95.7	Very high	97.4	Very high	51 Å²	51	29.3 Å²	29.3	36%	0.357	16%	0.161	S	C	.	.			trans	-64.9	145.7	172.3	70.2	0	0	0	0	110.9	D153 K157 N158 I159	D153-S155 WeakPolarHBondContact OD1-CA 3.16Å; D153-S155 WeakPolarHBondContact OD1-CB 3.46Å; D153-S155 PolarHBondContact OD1-N 2.93Å; D153-S155 PolarHBondContact OD1-OG 3.21Å; D153-S155 PolarHBondContact OD2-OG 3.42Å; S155-K157 PolarHBondContact O-N 2.97Å; S155-N158 PolarHBondContact O-N 3.28Å; S155-N158 PolarHBondContact OG-N 2.97Å; S155-I159 PolarHBondContact O-N 3.17Å
156	A	95.8	Very high	97.4	Very high	83 Å²	83	29.3 Å²	29.3	69%	0.686	16%	0.161	S	C	*	.	H	α-helix	trans	-56.6	-25.8	-178.5	0	0	0	0	0	113.4	W160	A156-W160 WeakPolarHBondContact O-CB 3.3Å; A156-W160 PolarHBondContact O-N 3.3Å; A156-W160 VanDerWaalsContact O-N 3.08Å
157	K	95.9	Very high	97.4	Very high	110 Å²	110	31.4 Å²	31.4	48%	0.478	17%	0.172	S	C	.	.	H	α-helix	trans	-78.2	-34.2	177.5	-62.4	-168.9	177.4	-163.8	0	112.8	D117 S155 L161	D117-K157 WeakPolarHBondContact OD1-CE 3.45Å; D117-K157 IonicContact OD1-NZ 3.98Å; D117-K157 PolarHBondContact OD1-NZ 3.32Å; D117-K157 IonicContact OD2-NZ 3.27Å; D117-K157 PolarHBondContact OD2-NZ 2.81Å; S155-K157 PolarHBondContact O-N 2.97Å; K157-L161 PolarHBondContact O-N 3.24Å
158	N	97.4	Very high	97.5	Very high	9 Å²	9	30.3 Å²	30.3	5%	0.048	17%	0.167	C	C	.	.	H	α-helix	trans	-76.1	-43.2	174.9	-166.5	56	0	0	0	111.3	I149 A150 D153 S155 W160 L161 A162	I149-N158 WeakPolarHBondContact CA-OD1 3.41Å; A150-N158 PolarHBondContact N-OD1 3.04Å; A150-N158 PolarHBondContact O-ND2 3.2Å; D153-N158 HydrophobicContact CB-CB 4.33Å; D153-N158 PolarHBondContact O-ND2 3.31Å; D153-N158 WeakPolarHBondContact OD2-CB 3.49Å; S155-N158 PolarHBondContact O-N 3.28Å; S155-N158 PolarHBondContact OG-N 2.97Å; N158-W160 PolarHBondContact O-N 3.35Å; N158-L161 WeakPolarHBondContact O-CB 3.35Å; N158-L161 PolarHBondContact O-N 3.43Å; N158-L161 VanDerWaalsContact O-N 3.14Å; N158-A162 PolarHBondContact O-N 3.31Å
159	I	98.3	Very high	97.5	Very high	29 Å²	29	29.9 Å²	29.9	15%	0.149	17%	0.165	C	C	.	.	H	α-helix	trans	-58	-48.4	173.9	-66.7	165.5	0	0	0	111.1	I154 S155 L161 A162 E163 L202 L205	I154-I159 HydrophobicContact CB-CD1 4.24Å; I154-I159 WeakPolarHBondContact O-CD1 3.36Å; S155-I159 PolarHBondContact O-N 3.17Å; I159-L161 VanDerWaalsContact C-N 3.25Å; I159-L161 PolarHBondContact O-N 3.39Å; I159-A162 PolarHBondContact O-N 2.88Å; I159-E163 PolarHBondContact O-N 3.34Å; I159-L202 HydrophobicContact CD1-CD1 4.03Å; I159-L202 HydrophobicContact CD1-CD2 3.74Å; I159-L202 HydrophobicContact CG2-CD2 4.43Å; I159-L205 HydrophobicContact CG2-CD2 3.86Å
160	W	98	Very high	97.5	Very high	79 Å²	79	33.2 Å²	33.2	30%	0.299	18%	0.183	S	C	.	.	H	α-helix	trans	-56.8	-39.3	176.2	165.9	80.7	0	0	0	112.3	R120 T121 V124 A156 N158 S164	R120-W160 HydrophobicContact CG-CH2 4.02Å; R120-W160 HydrophobicContact CG-CZ3 3.73Å; T121-W160 HydrophobicContact CG2-CZ2 4.33Å; V124-W160 HydrophobicContact CB-CH2 4.12Å; V124-W160 HydrophobicContact CB-CZ2 4.44Å; V124-W160 HydrophobicContact CG2-CH2 3.63Å; V124-W160 HydrophobicContact CG2-CZ2 4.4Å; V124-W160 HydrophobicContact CG2-CZ3 4.29Å; A156-W160 WeakPolarHBondContact O-CB 3.3Å; A156-W160 PolarHBondContact O-N 3.3Å; A156-W160 VanDerWaalsContact O-N 3.08Å; N158-W160 PolarHBondContact O-N 3.35Å; W160-S164 PolarHBondContact NE1-OG 3.43Å; W160-S164 WeakPolarHBondContact O-CB 3.37Å; W160-S164 PolarHBondContact O-N 3.15Å; W160-S164 PolarHBondContact O-OG 2.9Å
161	L	98.4	Very high	97.5	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-69.7	-44.3	178.8	-177.7	66.8	0	0	0	111.2	F112 V124 L145 Q148 I149 K157 N158 I159 S164 V165	F112-L161 HydrophobicContact CE1-CD2 3.8Å; F112-L161 HydrophobicContact CZ-CD1 4.04Å; F112-L161 HydrophobicContact CZ-CD2 3.76Å; F112-L161 HydrophobicContact CZ-CG 4.48Å; V124-L161 HydrophobicContact CG2-CD1 4Å; L145-L161 HydrophobicContact CD2-CD1 4.02Å; Q148-L161 HydrophobicContact CB-CD2 3.78Å; I149-L161 HydrophobicContact CG1-CD2 3.79Å; I149-L161 HydrophobicContact CG1-CG 3.89Å; K157-L161 PolarHBondContact O-N 3.24Å; N158-L161 WeakPolarHBondContact O-CB 3.35Å; N158-L161 PolarHBondContact O-N 3.43Å; N158-L161 VanDerWaalsContact O-N 3.14Å; I159-L161 VanDerWaalsContact C-N 3.25Å; I159-L161 PolarHBondContact O-N 3.39Å; L161-S164 PolarHBondContact O-N 3.15Å; L161-V165 HydrophobicContact CD1-CG2 4.04Å; L161-V165 HydrophobicContact CG-CG2 4.45Å; L161-V165 WeakPolarHBondContact O-CB 3.49Å; L161-V165 VanDerWaalsContact O-CG2 3.32Å; L161-V165 WeakPolarHBondContact O-CG2 3.3Å; L161-V165 PolarHBondContact O-N 3.18Å
162	A	98.5	Very high	97.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-50.5	176.4	0	0	0	0	0	111.3	I149 N158 I159 L166 Y190 L193	I149-A162 HydrophobicContact CD1-CB 4.41Å; I149-A162 HydrophobicContact CG2-CB 3.88Å; N158-A162 PolarHBondContact O-N 3.31Å; I159-A162 PolarHBondContact O-N 2.88Å; A162-L166 VanDerWaalsContact O-CB 3.24Å; A162-L166 WeakPolarHBondContact O-CB 3.46Å; A162-L166 PolarHBondContact O-N 3.27Å; A162-Y190 PolarHBondContact O-OH 2.91Å; A162-L193 HydrophobicContact CB-CD1 4.49Å
163	E	98.6	Very high	97.5	Very high	69 Å²	69	42.6 Å²	42.6	32%	0.322	22%	0.222	S	C	.	.	H	α-helix	trans	-64.2	-45.6	177.2	-176.4	155.7	-133.3	0	0	112.4	I159 V165 L166 D167 L205 K208	I159-E163 PolarHBondContact O-N 3.34Å; E163-V165 VanDerWaalsContact C-N 3.31Å; E163-V165 PolarHBondContact O-N 3.4Å; E163-L166 PolarHBondContact O-N 3.45Å; E163-D167 WeakPolarHBondContact O-CB 3.49Å; E163-D167 PolarHBondContact O-N 2.85Å; E163-L205 HydrophobicContact CB-CD1 3.8Å; E163-L205 HydrophobicContact CB-CD2 4.4Å; E163-L205 HydrophobicContact CG-CD1 4.14Å; E163-K208 IonicContact OE1-NZ 3.66Å; E163-K208 PolarHBondContact OE1-NZ 3Å
164	S	98.4	Very high	97.5	Very high	18 Å²	18	47.4 Å²	47.4	13%	0.126	24%	0.243	C	C	.	.	H	α-helix	trans	-66.4	-31	-176	-60.9	0	0	0	0	113.6	R128 W160 L161 I168	R128-S164 PolarHBondContact NH2-O 3.48Å; W160-S164 PolarHBondContact NE1-OG 3.43Å; W160-S164 WeakPolarHBondContact O-CB 3.37Å; W160-S164 PolarHBondContact O-N 3.15Å; W160-S164 PolarHBondContact O-OG 2.9Å; L161-S164 PolarHBondContact O-N 3.15Å; S164-I168 WeakPolarHBondContact O-CG1 3.44Å
165	V	98.6	Very high	97.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-79.9	-38.2	174.4	177.3	0	0	0	0	111	I142 L145 L146 L161 E163 D167 I168 L169	I142-V165 HydrophobicContact CG2-CG1 4.32Å; L145-V165 HydrophobicContact CB-CG2 4.23Å; L145-V165 HydrophobicContact CD1-CG2 4.49Å; L146-V165 HydrophobicContact CD2-CG1 3.66Å; L146-V165 HydrophobicContact CG-CG1 4.16Å; L161-V165 HydrophobicContact CD1-CG2 4.04Å; L161-V165 HydrophobicContact CG-CG2 4.45Å; L161-V165 WeakPolarHBondContact O-CB 3.49Å; L161-V165 VanDerWaalsContact O-CG2 3.32Å; L161-V165 WeakPolarHBondContact O-CG2 3.3Å; L161-V165 PolarHBondContact O-N 3.18Å; E163-V165 VanDerWaalsContact C-N 3.31Å; E163-V165 PolarHBondContact O-N 3.4Å; V165-D167 VanDerWaalsContact C-N 3.32Å; V165-D167 PolarHBondContact O-N 3.31Å; V165-I168 PolarHBondContact O-N 2.9Å; V165-L169 HydrophobicContact CG1-CD1 4.38Å; V165-L169 WeakPolarHBondContact O-CG 3.49Å; V165-L169 PolarHBondContact O-N 2.98Å; V165-L169 VanDerWaalsContact O-N 3.13Å
166	L	98.7	Very high	97.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-42.2	173.5	-177.7	63.5	0	0	0	111.5	A162 E163 I168 L169 L170 Y190 L205 K208 E209 F212	A162-L166 VanDerWaalsContact O-CB 3.24Å; A162-L166 WeakPolarHBondContact O-CB 3.46Å; A162-L166 PolarHBondContact O-N 3.27Å; E163-L166 PolarHBondContact O-N 3.45Å; L166-I168 VanDerWaalsContact C-N 3.32Å; L166-I168 PolarHBondContact O-N 3.24Å; L166-L169 WeakPolarHBondContact O-CB 3.38Å; L166-L169 PolarHBondContact O-N 3.19Å; L166-L169 VanDerWaalsContact O-N 3.12Å; L166-L170 HydrophobicContact CD1-CD1 4.39Å; L166-L170 HydrophobicContact CD1-CG 4.45Å; L166-L170 HydrophobicContact CG-CD1 3.96Å; L166-L170 HydrophobicContact CG-CG 4.44Å; L166-L170 WeakPolarHBondContact O-CG 3.34Å; L166-L170 PolarHBondContact O-N 3.43Å; L166-Y190 HydrophobicContact CB-CE1 4.05Å; L166-Y190 HydrophobicContact CD1-CD1 4.43Å; L166-Y190 HydrophobicContact CD1-CD2 4.14Å; L166-Y190 HydrophobicContact CD1-CE1 4.28Å; L166-Y190 HydrophobicContact CD1-CE2 4.01Å; L166-Y190 HydrophobicContact CD1-CG 4.37Å; L166-Y190 PolarHBondContact N-OH 3.28Å; L166-Y190 VanDerWaalsContact N-OH 3.15Å; L166-L205 HydrophobicContact CD2-CD1 3.99Å; L166-K208 HydrophobicContact CD2-CB 3.68Å; L166-E209 HydrophobicContact CD2-CB 4.48Å; L166-E209 HydrophobicContact CD2-CG 3.74Å; L166-F212 HydrophobicContact CD1-CB 3.81Å; L166-F212 HydrophobicContact CD1-CD1 4.03Å; L166-F212 HydrophobicContact CD1-CD2 4.21Å; L166-F212 HydrophobicContact CD1-CG 3.74Å
167	D	98.6	Very high	97.6	Very high	43 Å²	43	42.9 Å²	42.9	23%	0.23	20%	0.2	C	C	.	.	H	α-helix	trans	-63	-35.5	176.5	-74.1	-12.6	0	0	0	112.5	E163 V165 E171 K208	E163-D167 WeakPolarHBondContact O-CB 3.49Å; E163-D167 PolarHBondContact O-N 2.85Å; V165-D167 VanDerWaalsContact C-N 3.32Å; V165-D167 PolarHBondContact O-N 3.31Å; D167-E171 VanDerWaalsContact O-CB 3.27Å; D167-E171 WeakPolarHBondContact O-CB 3.29Å; D167-E171 WeakPolarHBondContact O-CG 3.45Å; D167-E171 PolarHBondContact O-N 2.67Å; D167-K208 VanDerWaalsContact OD1-CE 3.24Å; D167-K208 WeakPolarHBondContact OD1-CE 3.4Å; D167-K208 IonicContact OD1-NZ 3.78Å; D167-K208 PolarHBondContact OD1-NZ 3.13Å; D167-K208 IonicContact OD2-NZ 3.44Å
168	I	98.4	Very high	97.5	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-63.6	-44.5	172.5	-65.4	166.2	0	0	0	110.3	V124 R128 V131 I142 S164 V165 L166 Q172	V124-I168 HydrophobicContact CG1-CD1 3.95Å; R128-I168 HydrophobicContact CB-CD1 3.93Å; R128-I168 HydrophobicContact CB-CG1 3.91Å; R128-I168 HydrophobicContact CG-CG1 3.96Å; R128-I168 VanDerWaalsContact NE-CG1 3.33Å; V131-I168 HydrophobicContact CG1-CG2 4.49Å; V131-I168 HydrophobicContact CG2-CG2 4.36Å; I142-I168 HydrophobicContact CD1-CD1 4.45Å; I142-I168 HydrophobicContact CD1-CG2 3.93Å; S164-I168 WeakPolarHBondContact O-CG1 3.44Å; V165-I168 PolarHBondContact O-N 2.9Å; L166-I168 VanDerWaalsContact C-N 3.32Å; L166-I168 PolarHBondContact O-N 3.24Å; I168-Q172 VanDerWaalsContact O-CB 3.25Å; I168-Q172 WeakPolarHBondContact O-CB 3.36Å; I168-Q172 WeakPolarHBondContact O-CG 3.25Å; I168-Q172 PolarHBondContact O-N 2.74Å
169	L	98.4	Very high	97.5	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-35.7	-179.5	-67.9	166.9	0	0	0	112.5	I142 L146 V165 L166 K173 V176 L182 Y190 F212	I142-L169 HydrophobicContact CG2-CD2 4.04Å; L146-L169 HydrophobicContact CD2-CD1 4.42Å; V165-L169 HydrophobicContact CG1-CD1 4.38Å; V165-L169 WeakPolarHBondContact O-CG 3.49Å; V165-L169 PolarHBondContact O-N 2.98Å; V165-L169 VanDerWaalsContact O-N 3.13Å; L166-L169 WeakPolarHBondContact O-CB 3.38Å; L166-L169 PolarHBondContact O-N 3.19Å; L166-L169 VanDerWaalsContact O-N 3.12Å; L169-K173 WeakPolarHBondContact O-CA 3.32Å; L169-K173 PolarHBondContact O-N 3.48Å; L169-V176 HydrophobicContact CB-CG2 4.37Å; L169-V176 HydrophobicContact CD2-CG1 4.21Å; L169-V176 HydrophobicContact CD2-CG2 3.54Å; L169-L182 HydrophobicContact CD2-CD1 4.47Å; L169-L182 HydrophobicContact CD2-CD2 4.25Å; L169-L182 HydrophobicContact CD2-CG 4.39Å; L169-Y190 HydrophobicContact CD1-CE2 3.63Å; L169-F212 HydrophobicContact CB-CE2 3.91Å; L169-F212 HydrophobicContact CB-CZ 4.26Å; L169-F212 HydrophobicContact CD1-CZ 4.19Å
170	L	97.8	Very high	97.4	Very high	71 Å²	71	46.1 Å²	46.1	37%	0.372	22%	0.223	S	C	.	.	H	α-helix	trans	-72.1	-50.7	175.7	-72.7	169.9	0	0	0	111.8	L166 Q172 K173 F212	L166-L170 HydrophobicContact CD1-CD1 4.39Å; L166-L170 HydrophobicContact CD1-CG 4.45Å; L166-L170 HydrophobicContact CG-CD1 3.96Å; L166-L170 HydrophobicContact CG-CG 4.44Å; L166-L170 WeakPolarHBondContact O-CG 3.34Å; L166-L170 PolarHBondContact O-N 3.43Å; L170-Q172 PolarHBondContact O-N 2.79Å; L170-K173 PolarHBondContact O-N 3.14Å; L170-F212 HydrophobicContact CD2-CB 4.23Å; L170-F212 HydrophobicContact CD2-CD2 3.98Å; L170-F212 HydrophobicContact CG-CD2 4.43Å
171	E	97.3	Very high	97.3	Very high	103 Å²	103	45.5 Å²	45.5	48%	0.481	23%	0.225	S	C	.	.	H	α-helix	trans	-61.7	-30.7	178.1	-77.8	173.8	-158.2	0	0	112.8	R128 D167	R128-E171 IonicContact CZ-OE1 2.51Å; R128-E171 IonicContact CZ-OE2 2.79Å; R128-E171 IonicContact NH1-OE1 2.71Å; R128-E171 PolarHBondContact NH1-OE1 2.84Å; R128-E171 IonicContact NH1-OE2 3.18Å; R128-E171 PolarHBondContact NH1-OE2 3.31Å; D167-E171 VanDerWaalsContact O-CB 3.27Å; D167-E171 WeakPolarHBondContact O-CB 3.29Å; D167-E171 WeakPolarHBondContact O-CG 3.45Å; D167-E171 PolarHBondContact O-N 2.67Å
172	Q	96.7	Very high	97.3	Very high	45 Å²	45	45.4 Å²	45.4	21%	0.21	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	28.1	-175	-55.3	-65	-68.5	0	0	112.2	V131 I168 L170 E174 W175 V176	V131-Q172 HydrophobicContact CG1-CB 3.77Å; V131-Q172 HydrophobicContact CG1-CG 3.71Å; I168-Q172 VanDerWaalsContact O-CB 3.25Å; I168-Q172 WeakPolarHBondContact O-CB 3.36Å; I168-Q172 WeakPolarHBondContact O-CG 3.25Å; I168-Q172 PolarHBondContact O-N 2.74Å; L170-Q172 PolarHBondContact O-N 2.79Å; Q172-E174 VanDerWaalsContact C-N 3.3Å; Q172-E174 PolarHBondContact O-N 2.98Å; Q172-E174 VanDerWaalsContact O-N 3.16Å; Q172-W175 HydrophobicContact CB-CB 4.44Å; Q172-W175 WeakPolarHBondContact O-CA 3.46Å; Q172-W175 WeakPolarHBondContact O-CB 3.47Å; Q172-W175 PolarHBondContact O-N 2.93Å; Q172-V176 PolarHBondContact O-N 3.48Å
173	K	95.7	Very high	97.3	Very high	65 Å²	65	45.5 Å²	45.5	28%	0.283	23%	0.225	S	C	.	.	H	α-helix	trans	-48.1	-45.3	-177.4	177.5	173	169.6	173.6	0	113.5	L169 L170 W175 V176 L177 S215 M216 E219	L169-K173 WeakPolarHBondContact O-CA 3.32Å; L169-K173 PolarHBondContact O-N 3.48Å; L170-K173 PolarHBondContact O-N 3.14Å; K173-W175 PolarHBondContact O-N 3.3Å; K173-V176 PolarHBondContact O-N 3.04Å; K173-V176 VanDerWaalsContact O-N 3.15Å; K173-L177 HydrophobicContact CG-CD1 4.05Å; K173-L177 HydrophobicContact CG-CG 4.25Å; K173-L177 WeakPolarHBondContact O-CB 3.46Å; K173-L177 VanDerWaalsContact O-CG 3.25Å; K173-L177 WeakPolarHBondContact O-CG 3.48Å; K173-L177 PolarHBondContact O-N 2.67Å; K173-S215 PolarHBondContact NZ-OG 2.98Å; K173-M216 HydrophobicContact CD-CE 4.23Å; K173-M216 HydrophobicContact CG-CE 4.33Å; K173-E219 WeakPolarHBondContact CE-OE2 3.03Å; K173-E219 IonicContact NZ-OE1 3.59Å; K173-E219 PolarHBondContact NZ-OE1 3.32Å; K173-E219 IonicContact NZ-OE2 2.91Å; K173-E219 PolarHBondContact NZ-OE2 3.01Å
174	E	95.6	Very high	97.3	Very high	162 Å²	162	42.2 Å²	42.2	76%	0.757	21%	0.209	S	C	*	.	H	α-helix	trans	-61.8	-27	177.8	-68.9	-167.3	175.4	0	0	114.2	Q172 K178	Q172-E174 VanDerWaalsContact C-N 3.3Å; Q172-E174 PolarHBondContact O-N 2.98Å; Q172-E174 VanDerWaalsContact O-N 3.16Å; E174-K178 VanDerWaalsContact O-CE 3.22Å; E174-K178 WeakPolarHBondContact O-CE 3.34Å
175	W	97.1	Very high	97.3	Very high	41 Å²	41	42.1 Å²	42.1	16%	0.155	21%	0.207	C	C	.	.	H	α-helix	trans	-81.3	-41.4	173.2	173.5	96.5	0	0	0	111.1	V131 A138 D139 I142 Q172 K173 L177 K178 L182	V131-W175 HydrophobicContact CB-CH2 4.46Å; V131-W175 HydrophobicContact CG1-CD2 3.66Å; V131-W175 HydrophobicContact CG1-CE3 3.5Å; V131-W175 HydrophobicContact CG1-CG 4.25Å; V131-W175 HydrophobicContact CG1-CH2 4.01Å; V131-W175 HydrophobicContact CG1-CZ2 4.18Å; V131-W175 HydrophobicContact CG1-CZ3 3.68Å; V131-W175 HydrophobicContact CG2-CH2 3.7Å; V131-W175 HydrophobicContact CG2-CZ2 4.13Å; V131-W175 HydrophobicContact CG2-CZ3 3.98Å; A138-W175 HydrophobicContact CB-CH2 4.41Å; A138-W175 HydrophobicContact CB-CZ2 4.03Å; D139-W175 HydrophobicContact CB-CH2 3.73Å; D139-W175 HydrophobicContact CB-CZ2 4Å; I142-W175 HydrophobicContact CG1-CH2 4.34Å; I142-W175 HydrophobicContact CG1-CZ3 4.49Å; Q172-W175 HydrophobicContact CB-CB 4.44Å; Q172-W175 WeakPolarHBondContact O-CA 3.46Å; Q172-W175 WeakPolarHBondContact O-CB 3.47Å; Q172-W175 PolarHBondContact O-N 2.93Å; K173-W175 PolarHBondContact O-N 3.3Å; W175-L177 VanDerWaalsContact C-N 3.26Å; W175-L177 PolarHBondContact O-N 3.04Å; W175-K178 WeakPolarHBondContact O-CB 3.17Å; W175-K178 PolarHBondContact O-N 3.05Å; W175-L182 HydrophobicContact CE3-CD2 4.24Å; W175-L182 HydrophobicContact CH2-CD2 4Å; W175-L182 HydrophobicContact CZ3-CD2 3.49Å; W175-L182 VanDerWaalsContact CZ3-CD2 3.49Å
176	V	96.6	Very high	97.3	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-57.1	-41.5	174.7	178.5	0	0	0	0	111.3	L169 Q172 K173 K178 S179 L182 I183	L169-V176 HydrophobicContact CB-CG2 4.37Å; L169-V176 HydrophobicContact CD2-CG1 4.21Å; L169-V176 HydrophobicContact CD2-CG2 3.54Å; Q172-V176 PolarHBondContact O-N 3.48Å; K173-V176 PolarHBondContact O-N 3.04Å; K173-V176 VanDerWaalsContact O-N 3.15Å; V176-K178 PolarHBondContact O-N 3.11Å; V176-S179 PolarHBondContact O-N 3.44Å; V176-L182 HydrophobicContact CB-CD2 4.4Å; V176-L182 HydrophobicContact CG1-CD2 4.11Å; V176-L182 HydrophobicContact CG1-CG 4.24Å; V176-L182 HydrophobicContact CG2-CD2 4.17Å; V176-I183 HydrophobicContact CG1-CG1 4.19Å
177	L	95.9	Very high	97.3	Very high	50 Å²	50	42.1 Å²	42.1	26%	0.262	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-8.7	178.2	-71.7	174.5	0	0	0	114.8	K173 W175 I183 M216 K220	K173-L177 HydrophobicContact CG-CD1 4.05Å; K173-L177 HydrophobicContact CG-CG 4.25Å; K173-L177 WeakPolarHBondContact O-CB 3.46Å; K173-L177 VanDerWaalsContact O-CG 3.25Å; K173-L177 WeakPolarHBondContact O-CG 3.48Å; K173-L177 PolarHBondContact O-N 2.67Å; W175-L177 VanDerWaalsContact C-N 3.26Å; W175-L177 PolarHBondContact O-N 3.04Å; L177-I183 HydrophobicContact CD2-CD1 4.3Å; L177-M216 HydrophobicContact CD2-CE 4.12Å; L177-M216 HydrophobicContact CD2-SD 4.31Å; L177-K220 HydrophobicContact CD2-CD 4.1Å; L177-K220 HydrophobicContact CD2-CG 3.52Å
178	K	95.3	Very high	97.3	Very high	165 Å²	165	40.2 Å²	40.2	72%	0.717	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-16.7	176.4	-60.1	167.5	-173.6	161.9	0	113.4	E174 W175 V176	E174-K178 VanDerWaalsContact O-CE 3.22Å; E174-K178 WeakPolarHBondContact O-CE 3.34Å; W175-K178 WeakPolarHBondContact O-CB 3.17Å; W175-K178 PolarHBondContact O-N 3.05Å; V176-K178 PolarHBondContact O-N 3.11Å
179	S	96.6	Very high	97.3	Very high	25 Å²	25	40.1 Å²	40.1	18%	0.175	20%	0.196	C	C	.	.			trans	-120.3	95.5	-178.4	-174.1	0	0	0	0	110.7	D139 V176 M181 L182 I183	D139-S179 WeakPolarHBondContact OD2-CB 3.4Å; D139-S179 PolarHBondContact OD2-OG 3.49Å; V176-S179 PolarHBondContact O-N 3.44Å; S179-M181 PolarHBondContact O-N 2.9Å; S179-L182 WeakPolarHBondContact O-CA 3.34Å; S179-L182 WeakPolarHBondContact O-CB 3.31Å; S179-L182 PolarHBondContact O-N 3.08Å; S179-I183 PolarHBondContact O-N 2.91Å; S179-I183 VanDerWaalsContact O-N 3.07Å
180	G	96.3	Very high	97.3	Very high	26 Å²	26	40 Å²	40	27%	0.268	20%	0.196	S	C	.	.	H	α-helix	trans	-58.4	-31.1	-178.5	0	0	0	0	0	114.1	I183 A184	G180-I183 PolarHBondContact O-N 2.97Å; G180-A184 PolarHBondContact O-N 2.66Å
181	M	96.6	Very high	97.3	Very high	67 Å²	67	36.7 Å²	36.7	33%	0.33	18%	0.178	S	C	.	.	H	α-helix	trans	-68.1	-37.2	172.7	-174	58.5	53.4	0	0	111.9	M143 S179 A184 M185 I226 F277	M143-M181 HydrophobicContact CE-CB 4.19Å; M143-M181 HydrophobicContact CE-CG 3.98Å; M143-M181 HydrophobicContact SD-CG 4.01Å; S179-M181 PolarHBondContact O-N 2.9Å; M181-A184 PolarHBondContact O-N 3.41Å; M181-M185 HydrophobicContact CG-CG 4.3Å; M181-M185 VanDerWaalsContact O-CB 3.27Å; M181-M185 WeakPolarHBondContact O-CB 3.3Å; M181-M185 WeakPolarHBondContact O-CG 3.17Å; M181-M185 PolarHBondContact O-N 3.12Å; M181-M185 HydrophobicContact SD-CG 4.09Å; M181-I226 HydrophobicContact CE-CD1 3.83Å; M181-F277 HydrophobicContact SD-CE1 4.39Å; M181-F277 HydrophobicContact SD-CZ 4.14Å
182	L	97.7	Very high	97.4	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67	-40.7	175.3	-177.2	62.2	0	0	0	111.4	D139 I142 M143 L169 W175 V176 S179 S186	D139-L182 HydrophobicContact CB-CB 4.48Å; D139-L182 HydrophobicContact CB-CD2 3.97Å; I142-L182 HydrophobicContact CB-CD1 4.05Å; I142-L182 HydrophobicContact CG2-CD1 3.71Å; M143-L182 HydrophobicContact CE-CB 3.98Å; M143-L182 HydrophobicContact CE-CD1 4.37Å; M143-L182 HydrophobicContact CG-CD1 3.95Å; L169-L182 HydrophobicContact CD2-CD1 4.47Å; L169-L182 HydrophobicContact CD2-CD2 4.25Å; L169-L182 HydrophobicContact CD2-CG 4.39Å; W175-L182 HydrophobicContact CE3-CD2 4.24Å; W175-L182 HydrophobicContact CH2-CD2 4Å; W175-L182 HydrophobicContact CZ3-CD2 3.49Å; W175-L182 VanDerWaalsContact CZ3-CD2 3.49Å; V176-L182 HydrophobicContact CB-CD2 4.4Å; V176-L182 HydrophobicContact CG1-CD2 4.11Å; V176-L182 HydrophobicContact CG1-CG 4.24Å; V176-L182 HydrophobicContact CG2-CD2 4.17Å; S179-L182 WeakPolarHBondContact O-CA 3.34Å; S179-L182 WeakPolarHBondContact O-CB 3.31Å; S179-L182 PolarHBondContact O-N 3.08Å; L182-S186 VanDerWaalsContact O-CB 3.23Å; L182-S186 WeakPolarHBondContact O-CB 3.11Å; L182-S186 PolarHBondContact O-N 3.3Å; L182-S186 PolarHBondContact O-OG 2.7Å
183	I	98.4	Very high	97.5	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-56.2	-56.3	173	-59.7	169.8	0	0	0	109.6	V176 L177 S179 G180 M185 S186 V187 M216 K220 E223	V176-I183 HydrophobicContact CG1-CG1 4.19Å; L177-I183 HydrophobicContact CD2-CD1 4.3Å; S179-I183 PolarHBondContact O-N 2.91Å; S179-I183 VanDerWaalsContact O-N 3.07Å; G180-I183 PolarHBondContact O-N 2.97Å; I183-M185 PolarHBondContact O-N 2.71Å; I183-S186 PolarHBondContact O-N 2.9Å; I183-V187 HydrophobicContact CG2-CG2 4.44Å; I183-V187 WeakPolarHBondContact O-CB 3.17Å; I183-V187 WeakPolarHBondContact O-CG2 3.34Å; I183-V187 PolarHBondContact O-N 3Å; I183-M216 HydrophobicContact CG1-SD 4.39Å; I183-M216 HydrophobicContact CG2-CB 4.12Å; I183-M216 HydrophobicContact CG2-CG 4.29Å; I183-M216 HydrophobicContact CG2-SD 3.98Å; I183-K220 HydrophobicContact CD1-CB 4.13Å; I183-K220 HydrophobicContact CD1-CD 3.97Å; I183-K220 HydrophobicContact CD1-CG 3.94Å; I183-K220 HydrophobicContact CG2-CB 4.16Å; I183-E223 HydrophobicContact CD1-CB 4.21Å; I183-E223 HydrophobicContact CD1-CG 4.29Å; I183-E223 HydrophobicContact CG2-CB 4.46Å
184	A	98.3	Very high	97.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.3	-46.4	-178.8	0	0	0	0	0	112.7	G180 M181 S186 V187 Y188 I226 I227 F277	G180-A184 PolarHBondContact O-N 2.66Å; M181-A184 PolarHBondContact O-N 3.41Å; A184-S186 PolarHBondContact O-N 3.46Å; A184-V187 PolarHBondContact O-N 2.79Å; A184-Y188 VanDerWaalsContact O-CB 3.32Å; A184-Y188 WeakPolarHBondContact O-CB 3.31Å; A184-Y188 PolarHBondContact O-N 2.97Å; A184-I226 HydrophobicContact CB-CD1 3.86Å; A184-I226 HydrophobicContact CB-CG1 3.92Å; A184-I227 HydrophobicContact CB-CD1 4.31Å; A184-I227 HydrophobicContact CB-CG1 4.08Å; A184-F277 HydrophobicContact CB-CE1 3.77Å; A184-F277 HydrophobicContact CB-CZ 3.84Å
185	M	98.3	Very high	97.6	Very high	17 Å²	17	21.9 Å²	21.9	8%	0.084	11%	0.114	C	C	.	.	H	α-helix	trans	-65.4	-37.6	178.7	-73.3	-78.8	-74.6	0	0	112.5	M143 M181 I183 T189 F277 C280	M143-M185 HydrophobicContact CB-CE 4.12Å; M143-M185 HydrophobicContact CG-CB 4.22Å; M143-M185 HydrophobicContact CG-CE 4.24Å; M143-M185 HydrophobicContact CG-CG 4.29Å; M143-M185 HydrophobicContact SD-CE 4.41Å; M143-M185 HydrophobicContact SD-CG 4.06Å; M181-M185 HydrophobicContact CG-CG 4.3Å; M181-M185 VanDerWaalsContact O-CB 3.27Å; M181-M185 WeakPolarHBondContact O-CB 3.3Å; M181-M185 WeakPolarHBondContact O-CG 3.17Å; M181-M185 PolarHBondContact O-N 3.12Å; M181-M185 HydrophobicContact SD-CG 4.09Å; I183-M185 PolarHBondContact O-N 2.71Å; M185-T189 WeakPolarHBondContact O-CB 3.38Å; M185-T189 PolarHBondContact O-N 3.23Å; M185-T189 PolarHBondContact O-OG1 2.87Å; M185-F277 HydrophobicContact CG-CD1 4.39Å; M185-F277 HydrophobicContact CG-CE1 3.96Å; M185-F277 HydrophobicContact SD-CD1 3.72Å; M185-F277 HydrophobicContact SD-CE1 3.85Å; M185-C280 HydrophobicContact CE-CB 3.46Å; M185-C280 VanDerWaalsContact CE-CB 3.46Å; M185-C280 HydrophobicContact SD-CB 4.02Å
186	S	98.6	Very high	97.6	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-70	-45.1	177.4	-55.1	0	0	0	0	111.1	L182 I183 A184 T189 Y190	L182-S186 VanDerWaalsContact O-CB 3.23Å; L182-S186 WeakPolarHBondContact O-CB 3.11Å; L182-S186 PolarHBondContact O-N 3.3Å; L182-S186 PolarHBondContact O-OG 2.7Å; I183-S186 PolarHBondContact O-N 2.9Å; A184-S186 PolarHBondContact O-N 3.46Å; S186-T189 WeakPolarHBondContact O-CB 3.44Å; S186-T189 PolarHBondContact O-N 3.31Å; S186-T189 VanDerWaalsContact O-N 3.16Å; S186-Y190 VanDerWaalsContact O-CD2 3.23Å; S186-Y190 WeakPolarHBondContact O-CD2 3.3Å; S186-Y190 PolarHBondContact O-N 3.22Å
187	V	98.8	Very high	97.6	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-62.4	-44.3	175.9	170.8	0	0	0	0	111.1	I183 A184 T189 L191 M216 L217 L231	I183-V187 HydrophobicContact CG2-CG2 4.44Å; I183-V187 WeakPolarHBondContact O-CB 3.17Å; I183-V187 WeakPolarHBondContact O-CG2 3.34Å; I183-V187 PolarHBondContact O-N 3Å; A184-V187 PolarHBondContact O-N 2.79Å; V187-T189 PolarHBondContact O-N 3.42Å; V187-L191 HydrophobicContact CG1-CD1 3.64Å; V187-L191 HydrophobicContact CG1-CG 4.01Å; V187-L191 VanDerWaalsContact O-CB 3.24Å; V187-L191 WeakPolarHBondContact O-CB 3.43Å; V187-L191 VanDerWaalsContact O-CG 3.26Å; V187-L191 WeakPolarHBondContact O-CG 3.1Å; V187-L191 PolarHBondContact O-N 3.26Å; V187-M216 HydrophobicContact CG2-CB 3.44Å; V187-M216 VanDerWaalsContact CG2-CB 3.44Å; V187-M216 HydrophobicContact CG2-CG 3.99Å; V187-L217 HydrophobicContact CG1-CD1 4.17Å; V187-L217 HydrophobicContact CG1-CD2 4.01Å; V187-L217 HydrophobicContact CG1-CG 4.03Å; V187-L231 HydrophobicContact CG1-CD1 4.49Å
188	Y	98.8	Very high	97.3	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.008	12%	0.117	C	C	.	.	H	α-helix	trans	-62.2	-32.9	175	-162	-97.9	0	0	0	112.8	A184 R192 I227 D230 R233 L234 F277 R281	A184-Y188 VanDerWaalsContact O-CB 3.32Å; A184-Y188 WeakPolarHBondContact O-CB 3.31Å; A184-Y188 PolarHBondContact O-N 2.97Å; Y188-R192 WeakPolarHBondContact O-CB 3.28Å; Y188-I227 HydrophobicContact CD2-CD1 4.3Å; Y188-I227 HydrophobicContact CD2-CG1 4.47Å; Y188-I227 HydrophobicContact CD2-CG2 3.45Å; Y188-I227 VanDerWaalsContact CD2-CG2 3.45Å; Y188-I227 HydrophobicContact CE2-CG2 3.69Å; Y188-D230 HydrophobicContact CE2-CB 3.88Å; Y188-R233 PolarHBondContact OH-NH2 3.31Å; Y188-L234 HydrophobicContact CD1-CD1 4.27Å; Y188-L234 HydrophobicContact CD2-CD1 3.41Å; Y188-L234 VanDerWaalsContact CD2-CD1 3.41Å; Y188-L234 HydrophobicContact CD2-CG 4.46Å; Y188-L234 HydrophobicContact CE1-CD1 4.35Å; Y188-L234 HydrophobicContact CE2-CD1 3.53Å; Y188-L234 HydrophobicContact CE2-CG 4.17Å; Y188-L234 HydrophobicContact CG-CD1 3.82Å; Y188-L234 VanDerWaalsContact O-CD1 3.3Å; Y188-L234 WeakPolarHBondContact O-CD1 3.25Å; Y188-F277 HydrophobicContact CD1-CB 3.89Å; Y188-F277 HydrophobicContact CD2-CB 4.13Å; Y188-F277 HydrophobicContact CD2-CG 4.5Å; Y188-F277 HydrophobicContact CE1-CB 3.83Å; Y188-F277 WeakPolarHBondContact CE1-O 3.35Å; Y188-F277 HydrophobicContact CE2-CB 4.07Å; Y188-F277 HydrophobicContact CG-CB 4.04Å; Y188-F277 HydrophobicContact CG-CD1 4.16Å; Y188-F277 HydrophobicContact CG-CG 4.42Å; Y188-R281 HydrophobicContact CD1-CG 3.81Å; Y188-R281 HydrophobicContact CE1-CG 3.58Å
189	T	98.8	Very high	97.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-70.2	-57.4	176	-61.9	0	0	0	0	111.4	L146 I149 M185 S186 V187 R192 L193 R281	L146-T189 HydrophobicContact CB-CG2 4.3Å; L146-T189 HydrophobicContact CD2-CG2 3.76Å; I149-T189 HydrophobicContact CD1-CG2 4.34Å; M185-T189 WeakPolarHBondContact O-CB 3.38Å; M185-T189 PolarHBondContact O-N 3.23Å; M185-T189 PolarHBondContact O-OG1 2.87Å; S186-T189 WeakPolarHBondContact O-CB 3.44Å; S186-T189 PolarHBondContact O-N 3.31Å; S186-T189 VanDerWaalsContact O-N 3.16Å; V187-T189 PolarHBondContact O-N 3.42Å; T189-R192 WeakPolarHBondContact O-CB 3.4Å; T189-R192 PolarHBondContact O-N 2.89Å; T189-L193 HydrophobicContact CG2-CD1 3.63Å; T189-L193 HydrophobicContact CG2-CG 4.43Å; T189-L193 WeakPolarHBondContact O-CG 3.39Å; T189-L193 PolarHBondContact O-N 3.12Å; T189-R281 PolarHBondContact OG1-NH2 3.46Å
190	Y	98.8	Very high	96.8	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-75.7	-33.2	-172.5	-67.6	-67.5	0	0	0	113.5	L146 A162 L166 L169 S186 R192 L193 I194 E209 F212 C213	L146-Y190 HydrophobicContact CD2-CE2 3.74Å; A162-Y190 PolarHBondContact O-OH 2.91Å; L166-Y190 HydrophobicContact CB-CE1 4.05Å; L166-Y190 HydrophobicContact CD1-CD1 4.43Å; L166-Y190 HydrophobicContact CD1-CD2 4.14Å; L166-Y190 HydrophobicContact CD1-CE1 4.28Å; L166-Y190 HydrophobicContact CD1-CE2 4.01Å; L166-Y190 HydrophobicContact CD1-CG 4.37Å; L166-Y190 PolarHBondContact N-OH 3.28Å; L166-Y190 VanDerWaalsContact N-OH 3.15Å; L169-Y190 HydrophobicContact CD1-CE2 3.63Å; S186-Y190 VanDerWaalsContact O-CD2 3.23Å; S186-Y190 WeakPolarHBondContact O-CD2 3.3Å; S186-Y190 PolarHBondContact O-N 3.22Å; Y190-R192 PolarHBondContact O-N 3.38Å; Y190-R192 VanDerWaalsContact O-N 3.14Å; Y190-L193 HydrophobicContact CD1-CD1 3.87Å; Y190-L193 HydrophobicContact CE1-CD1 3.95Å; Y190-L193 PolarHBondContact O-N 3.14Å; Y190-L193 VanDerWaalsContact O-N 3.13Å; Y190-I194 WeakPolarHBondContact O-CB 3.42Å; Y190-I194 WeakPolarHBondContact O-CD1 3.33Å; Y190-I194 WeakPolarHBondContact O-CG1 3.5Å; Y190-I194 PolarHBondContact O-N 3.48Å; Y190-E209 HydrophobicContact CD1-CB 4.45Å; Y190-E209 HydrophobicContact CD1-CG 3.76Å; Y190-E209 WeakPolarHBondContact CD1-OE1 3.48Å; Y190-E209 HydrophobicContact CE1-CG 4.47Å; Y190-E209 HydrophobicContact CG-CG 4.45Å; Y190-F212 AromaticContact CD2-CD1 3.98Å; Y190-F212 HydrophobicContact CD2-CD1 3.98Å; Y190-F212 AromaticContact CD2-CE1 3.89Å; Y190-F212 HydrophobicContact CD2-CE1 3.89Å; Y190-C213 VanDerWaalsContact CB-SG 3.59Å
191	L	98.6	Very high	96.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.7	-29.1	169.3	-73.4	179.8	0	0	0	112.5	V187 C213 L217 L231 L234 L235 V238 M244	V187-L191 HydrophobicContact CG1-CD1 3.64Å; V187-L191 HydrophobicContact CG1-CG 4.01Å; V187-L191 VanDerWaalsContact O-CB 3.24Å; V187-L191 WeakPolarHBondContact O-CB 3.43Å; V187-L191 VanDerWaalsContact O-CG 3.26Å; V187-L191 WeakPolarHBondContact O-CG 3.1Å; V187-L191 PolarHBondContact O-N 3.26Å; L191-C213 HydrophobicContact CD2-CB 3.85Å; L191-C213 HydrophobicContact CG-CB 4.32Å; L191-L217 HydrophobicContact CD1-CD1 4.22Å; L191-L217 HydrophobicContact CD2-CD1 4.23Å; L191-L231 HydrophobicContact CD1-CD1 3.57Å; L191-L234 HydrophobicContact CB-CB 3.91Å; L191-L234 HydrophobicContact CB-CD1 4.05Å; L191-L234 HydrophobicContact CD1-CB 4.27Å; L191-L235 HydrophobicContact CD1-CD2 3.92Å; L191-L235 HydrophobicContact CD1-CG 4.16Å; L191-L235 HydrophobicContact CD2-CD2 3.97Å; L191-V238 HydrophobicContact CD2-CG2 4.26Å; L191-M244 HydrophobicContact CD2-CE 3.63Å; L191-M244 HydrophobicContact CD2-SD 4.06Å
192	R	98.3	Very high	96.6	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.015	14%	0.137	C	C	.	.	H	α-helix	trans	-79.9	-42.3	174.8	174.5	54.9	-170.4	79.3	11.3	112.3	Y188 T189 Y190 V195 D196 L234 R281 S321 D325	Y188-R192 WeakPolarHBondContact O-CB 3.28Å; T189-R192 WeakPolarHBondContact O-CB 3.4Å; T189-R192 PolarHBondContact O-N 2.89Å; Y190-R192 PolarHBondContact O-N 3.38Å; Y190-R192 VanDerWaalsContact O-N 3.14Å; R192-V195 WeakPolarHBondContact O-CB 3.44Å; R192-V195 PolarHBondContact O-N 2.94Å; R192-D196 IonicContact CZ-OD1 2.66Å; R192-D196 IonicContact CZ-OD2 3.75Å; R192-D196 IonicContact NH1-OD1 3.61Å; R192-D196 PolarHBondContact NH1-OD1 3.04Å; R192-D196 IonicContact NH1-OD2 2.92Å; R192-D196 PolarHBondContact NH1-OD2 2.85Å; R192-D196 IonicContact NH2-OD2 3.15Å; R192-L234 HydrophobicContact CB-CD1 4.3Å; R192-L234 HydrophobicContact CB-CD2 3.93Å; R192-L234 HydrophobicContact CG-CD2 4.49Å; R192-R281 HydrophobicContact CG-CG 4.45Å; R192-S321 PolarHBondContact NH1-OG 3.4Å; R192-S321 VanDerWaalsContact NH2-C 3.27Å; R192-S321 PolarHBondContact NH2-O 3.38Å; R192-S321 PolarHBondContact NH2-OG 2.89Å; R192-D325 WeakPolarHBondContact CD-OD1 3.43Å; R192-D325 IonicContact CZ-OD2 3.94Å; R192-D325 VanDerWaalsContact NE-CG 3.33Å; R192-D325 IonicContact NE-OD1 3.39Å; R192-D325 PolarHBondContact NE-OD1 2.87Å; R192-D325 IonicContact NE-OD2 2.98Å; R192-D325 PolarHBondContact NE-OD2 3.26Å; R192-D325 IonicContact NH2-OD2 2.77Å; R192-D325 PolarHBondContact NH2-OD2 3.41Å
193	L	98.2	Very high	96.6	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-71.4	-31.1	-177.4	-66.4	168.5	0	0	0	113.5	I149 A162 T189 Y190 V195 D196 H197 E209	I149-L193 HydrophobicContact CB-CD1 4.3Å; I149-L193 HydrophobicContact CD1-CD1 4.26Å; I149-L193 HydrophobicContact CG2-CD1 3.64Å; I149-L193 HydrophobicContact CG2-CD2 3.79Å; I149-L193 HydrophobicContact CG2-CG 4.39Å; A162-L193 HydrophobicContact CB-CD1 4.49Å; T189-L193 HydrophobicContact CG2-CD1 3.63Å; T189-L193 HydrophobicContact CG2-CG 4.43Å; T189-L193 WeakPolarHBondContact O-CG 3.39Å; T189-L193 PolarHBondContact O-N 3.12Å; Y190-L193 HydrophobicContact CD1-CD1 3.87Å; Y190-L193 HydrophobicContact CE1-CD1 3.95Å; Y190-L193 PolarHBondContact O-N 3.14Å; Y190-L193 VanDerWaalsContact O-N 3.13Å; L193-V195 PolarHBondContact O-N 3.07Å; L193-D196 PolarHBondContact O-N 3.01Å; L193-H197 PolarHBondContact O-N 3.44Å; L193-E209 WeakPolarHBondContact CB-OE1 3.26Å
194	I	98.5	Very high	96.5	Very high	3 Å²	3	30 Å²	30	2%	0.015	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-29.4	174.6	-75.6	162.4	0	0	0	112.7	Y190 D196 R206 E209 V210 V238 I241 M244	Y190-I194 WeakPolarHBondContact O-CB 3.42Å; Y190-I194 WeakPolarHBondContact O-CD1 3.33Å; Y190-I194 WeakPolarHBondContact O-CG1 3.5Å; Y190-I194 PolarHBondContact O-N 3.48Å; I194-D196 VanDerWaalsContact C-N 3.33Å; I194-R206 HydrophobicContact CB-CG 4.29Å; I194-R206 HydrophobicContact CG1-CG 4.31Å; I194-R206 HydrophobicContact CG2-CG 3.88Å; I194-R206 WeakPolarHBondContact O-CD 3.43Å; I194-E209 HydrophobicContact CD1-CB 3.83Å; I194-E209 HydrophobicContact CG1-CB 3.47Å; I194-E209 VanDerWaalsContact CG1-CB 3.47Å; I194-E209 HydrophobicContact CG1-CG 4.42Å; I194-V210 HydrophobicContact CD1-CB 4.47Å; I194-V210 HydrophobicContact CD1-CG2 3.77Å; I194-V210 HydrophobicContact CG1-CG2 4.17Å; I194-V210 HydrophobicContact CG2-CG2 4.11Å; I194-V238 HydrophobicContact CB-CG1 4.08Å; I194-V238 HydrophobicContact CG2-CB 4.22Å; I194-V238 HydrophobicContact CG2-CG1 3.55Å; I194-I241 HydrophobicContact CG2-CD1 3.36Å; I194-M244 HydrophobicContact CD1-CE 4.12Å
195	V	95.9	Very high	96.5	Very high	56 Å²	56	30.3 Å²	30.3	34%	0.339	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-35.4	177	-177.6	0	0	0	0	111.9	R192 L193 N237 V238	R192-V195 WeakPolarHBondContact O-CB 3.44Å; R192-V195 PolarHBondContact O-N 2.94Å; L193-V195 PolarHBondContact O-N 3.07Å; V195-N237 HydrophobicContact CG2-CB 3.96Å; V195-V238 HydrophobicContact CG2-CG1 3.91Å
196	D	96.1	Very high	96.5	Very high	15 Å²	15	32.1 Å²	32.1	8%	0.08	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-32	-175.5	-55.9	-32.4	0	0	0	111.4	G152 R192 L193 I194 G198 S321	G152-D196 PolarHBondContact N-OD2 3.25Å; R192-D196 IonicContact CZ-OD1 2.66Å; R192-D196 IonicContact CZ-OD2 3.75Å; R192-D196 IonicContact NH1-OD1 3.61Å; R192-D196 PolarHBondContact NH1-OD1 3.04Å; R192-D196 IonicContact NH1-OD2 2.92Å; R192-D196 PolarHBondContact NH1-OD2 2.85Å; R192-D196 IonicContact NH2-OD2 3.15Å; L193-D196 PolarHBondContact O-N 3.01Å; I194-D196 VanDerWaalsContact C-N 3.33Å; D196-G198 PolarHBondContact O-N 2.76Å; D196-S321 WeakPolarHBondContact OD1-CB 3.31Å; D196-S321 PolarHBondContact OD1-OG 3.42Å
197	H	96.8	Very high	96.5	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	27.9	-179.7	-57.9	147.6	0	0	0	114.4	L193 T199 L202 R206 E209	L193-H197 PolarHBondContact O-N 3.44Å; H197-T199 VanDerWaalsContact C-N 3.31Å; H197-T199 PolarHBondContact O-N 2.96Å; H197-L202 HydrophobicContact CB-CB 4.07Å; H197-R206 HydrophobicContact CB-CB 3.94Å; H197-R206 HydrophobicContact CB-CG 4.05Å; H197-R206 WeakPolarHBondContact O-CD 3.43Å; H197-E209 IonicContact CE1-OE1 2.67Å; H197-E209 PolarHBondContact CE1-OE1 3.47Å; H197-E209 IonicContact CE1-OE2 3.15Å; H197-E209 IonicContact CG-OE2 2.72Å; H197-E209 IonicContact ND1-OE1 3.37Å; H197-E209 PolarHBondContact ND1-OE1 3.27Å; H197-E209 IonicContact ND1-OE2 3.3Å; H197-E209 PolarHBondContact ND1-OE2 3.16Å
198	G	89.8	Confident	96.5	Very high	39 Å²	39	38 Å²	38	40%	0.402	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-18.8	-179.8	0	0	0	0	0	115.6	D196	D196-G198 PolarHBondContact O-N 2.76Å
199	T	90.8	Very high	96.5	Very high	61 Å²	61	38 Å²	38	37%	0.374	22%	0.216	S	C	.	.	S	Bend	trans	-67.1	141.1	-176.4	-56.3	0	0	0	0	112.2	H197 N201 L202 L203	H197-T199 VanDerWaalsContact C-N 3.31Å; H197-T199 PolarHBondContact O-N 2.96Å; T199-N201 VanDerWaalsContact C-N 3.27Å; T199-N201 PolarHBondContact O-N 3.04Å; T199-L202 PolarHBondContact O-N 3.24Å; T199-L203 PolarHBondContact O-N 3.22Å
200	P	91	Very high	96.5	Very high	97 Å²	97	38 Å²	38	63%	0.63	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-49.6	-39.2	-174.7	-33	37.2	0	0	0	116.1	L202 L203	P200-L202 PolarHBondContact O-N 2.85Å; P200-L203 PolarHBondContact O-N 3.03Å
201	N	93	Very high	96.5	Very high	146 Å²	146	42 Å²	42	78%	0.781	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-70.4	-17.3	179.7	-63.6	-6.4	0	0	0	113.6	T199	T199-N201 VanDerWaalsContact C-N 3.27Å; T199-N201 PolarHBondContact O-N 3.04Å
202	L	96.5	Very high	96.5	Very high	25 Å²	25	42.3 Å²	42.3	13%	0.131	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-104.8	-5.6	-176.8	-52.7	-176.7	0	0	0	112.8	I154 I159 H197 T199 P200 P204 L205 R206	I154-L202 HydrophobicContact CB-CD1 4.4Å; I154-L202 HydrophobicContact CG2-CD1 4.2Å; I159-L202 HydrophobicContact CD1-CD1 4.03Å; I159-L202 HydrophobicContact CD1-CD2 3.74Å; I159-L202 HydrophobicContact CG2-CD2 4.43Å; H197-L202 HydrophobicContact CB-CB 4.07Å; T199-L202 PolarHBondContact O-N 3.24Å; P200-L202 PolarHBondContact O-N 2.85Å; L202-P204 VanDerWaalsContact C-N 3.3Å; L202-L205 PolarHBondContact O-N 3.13Å; L202-R206 PolarHBondContact O-N 3Å
203	L	96.1	Very high	96.5	Very high	75 Å²	75	42.1 Å²	42.1	39%	0.393	24%	0.239	S	C	.	.	H	α-helix	trans	-53.8	-35.2	177	-63.6	177.2	0	0	0	114.4	T199 P200 R206 Q207	T199-L203 PolarHBondContact O-N 3.22Å; P200-L203 PolarHBondContact O-N 3.03Å; L203-R206 PolarHBondContact O-N 3.12Å; L203-Q207 PolarHBondContact O-N 2.77Å
204	P	97.7	Very high	96.5	Very high	87 Å²	87	43.2 Å²	43.2	57%	0.565	24%	0.244	S	C	*	.	H	α-helix	trans	-62.8	-40.8	174.2	-23.9	35.5	0	0	0	113.3	L202 K208	L202-P204 VanDerWaalsContact C-N 3.3Å; P204-K208 WeakPolarHBondContact O-CG 3.32Å; P204-K208 PolarHBondContact O-N 3.16Å
205	L	98.2	Very high	96.5	Very high	7 Å²	7	44.3 Å²	44.3	4%	0.037	25%	0.252	C	S	.	.	H	α-helix	trans	-67.7	-46.7	173.5	175.9	57	0	0	0	110.2	I159 E163 L166 L202 Q207 K208 E209	I159-L205 HydrophobicContact CG2-CD2 3.86Å; E163-L205 HydrophobicContact CB-CD1 3.8Å; E163-L205 HydrophobicContact CB-CD2 4.4Å; E163-L205 HydrophobicContact CG-CD1 4.14Å; L166-L205 HydrophobicContact CD2-CD1 3.99Å; L202-L205 PolarHBondContact O-N 3.13Å; L205-Q207 PolarHBondContact O-N 3.32Å; L205-K208 WeakPolarHBondContact O-CB 3.39Å; L205-K208 PolarHBondContact O-N 3.41Å; L205-E209 HydrophobicContact CD1-CG 4.24Å; L205-E209 HydrophobicContact CG-CG 4.42Å; L205-E209 WeakPolarHBondContact O-CG 3.36Å; L205-E209 PolarHBondContact O-N 3.43Å
206	R	98.3	Very high	96.6	Very high	56 Å²	56	41.7 Å²	41.7	21%	0.211	24%	0.237	C	C	.	.	H	α-helix	trans	-57	-36.3	178.7	-156.2	-170.5	85.1	-177.8	3.2	112.4	I194 H197 L202 L203 E209 V210	I194-R206 HydrophobicContact CB-CG 4.29Å; I194-R206 HydrophobicContact CG1-CG 4.31Å; I194-R206 HydrophobicContact CG2-CG 3.88Å; I194-R206 WeakPolarHBondContact O-CD 3.43Å; H197-R206 HydrophobicContact CB-CB 3.94Å; H197-R206 HydrophobicContact CB-CG 4.05Å; H197-R206 WeakPolarHBondContact O-CD 3.43Å; L202-R206 PolarHBondContact O-N 3Å; L203-R206 PolarHBondContact O-N 3.12Å; R206-E209 PolarHBondContact O-N 2.97Å; R206-V210 WeakPolarHBondContact O-CB 3.4Å; R206-V210 WeakPolarHBondContact O-CG2 3.49Å; R206-V210 PolarHBondContact O-N 2.87Å
207	Q	98.3	Very high	96.7	Very high	69 Å²	69	41 Å²	41	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-67.2	-45.9	174.7	-166.1	67.9	43.6	0	0	111.5	L203 L205 E209 V210 D211 E243	L203-Q207 PolarHBondContact O-N 2.77Å; L205-Q207 PolarHBondContact O-N 3.32Å; Q207-E209 PolarHBondContact O-N 3.01Å; Q207-V210 PolarHBondContact O-N 2.94Å; Q207-V210 VanDerWaalsContact O-N 3.15Å; Q207-D211 PolarHBondContact NE2-OD1 3.49Å; Q207-D211 WeakPolarHBondContact O-CB 3.47Å; Q207-D211 PolarHBondContact O-N 3.27Å; Q207-E243 PolarHBondContact NE2-OE1 3.3Å
208	K	98.4	Very high	96.7	Very high	55 Å²	55	44.9 Å²	44.9	24%	0.239	25%	0.247	C	C	.	.	H	α-helix	trans	-56	-40.3	174.7	-68.5	169.5	58.2	173.5	0	111.8	E163 L166 D167 P204 L205 F212	E163-K208 IonicContact OE1-NZ 3.66Å; E163-K208 PolarHBondContact OE1-NZ 3Å; L166-K208 HydrophobicContact CD2-CB 3.68Å; D167-K208 VanDerWaalsContact OD1-CE 3.24Å; D167-K208 WeakPolarHBondContact OD1-CE 3.4Å; D167-K208 IonicContact OD1-NZ 3.78Å; D167-K208 PolarHBondContact OD1-NZ 3.13Å; D167-K208 IonicContact OD2-NZ 3.44Å; P204-K208 WeakPolarHBondContact O-CG 3.32Å; P204-K208 PolarHBondContact O-N 3.16Å; L205-K208 WeakPolarHBondContact O-CB 3.39Å; L205-K208 PolarHBondContact O-N 3.41Å; K208-F212 WeakPolarHBondContact O-CB 3.47Å; K208-F212 PolarHBondContact O-N 3.15Å; K208-F212 VanDerWaalsContact O-N 3.08Å
209	E	98.7	Very high	97	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.2	-45.4	176.1	-65.4	176.5	134.5	0	0	112.2	L166 Y190 L193 I194 H197 L205 R206 Q207 F212 C213	L166-E209 HydrophobicContact CD2-CB 4.48Å; L166-E209 HydrophobicContact CD2-CG 3.74Å; Y190-E209 HydrophobicContact CD1-CB 4.45Å; Y190-E209 HydrophobicContact CD1-CG 3.76Å; Y190-E209 WeakPolarHBondContact CD1-OE1 3.48Å; Y190-E209 HydrophobicContact CE1-CG 4.47Å; Y190-E209 HydrophobicContact CG-CG 4.45Å; L193-E209 WeakPolarHBondContact CB-OE1 3.26Å; I194-E209 HydrophobicContact CD1-CB 3.83Å; I194-E209 HydrophobicContact CG1-CB 3.47Å; I194-E209 VanDerWaalsContact CG1-CB 3.47Å; I194-E209 HydrophobicContact CG1-CG 4.42Å; H197-E209 IonicContact CE1-OE1 2.67Å; H197-E209 PolarHBondContact CE1-OE1 3.47Å; H197-E209 IonicContact CE1-OE2 3.15Å; H197-E209 IonicContact CG-OE2 2.72Å; H197-E209 IonicContact ND1-OE1 3.37Å; H197-E209 PolarHBondContact ND1-OE1 3.27Å; H197-E209 IonicContact ND1-OE2 3.3Å; H197-E209 PolarHBondContact ND1-OE2 3.16Å; L205-E209 HydrophobicContact CD1-CG 4.24Å; L205-E209 HydrophobicContact CG-CG 4.42Å; L205-E209 WeakPolarHBondContact O-CG 3.36Å; L205-E209 PolarHBondContact O-N 3.43Å; R206-E209 PolarHBondContact O-N 2.97Å; Q207-E209 PolarHBondContact O-N 3.01Å; E209-F212 PolarHBondContact O-N 3.46Å; E209-C213 WeakPolarHBondContact O-CB 3.49Å; E209-C213 PolarHBondContact O-N 3.07Å; E209-C213 PolarHBondContact O-SG 2.71Å; E209-C213 VanDerWaalsContact O-SG 3.38Å
210	V	98.8	Very high	97.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.7	-50.7	176	164.8	0	0	0	0	110.5	I194 R206 Q207 F212 C213 I214 I241 E243 M244	I194-V210 HydrophobicContact CD1-CB 4.47Å; I194-V210 HydrophobicContact CD1-CG2 3.77Å; I194-V210 HydrophobicContact CG1-CG2 4.17Å; I194-V210 HydrophobicContact CG2-CG2 4.11Å; R206-V210 WeakPolarHBondContact O-CB 3.4Å; R206-V210 WeakPolarHBondContact O-CG2 3.49Å; R206-V210 PolarHBondContact O-N 2.87Å; Q207-V210 PolarHBondContact O-N 2.94Å; Q207-V210 VanDerWaalsContact O-N 3.15Å; V210-F212 VanDerWaalsContact C-N 3.33Å; V210-F212 PolarHBondContact O-N 2.88Å; V210-C213 PolarHBondContact O-N 3.15Å; V210-I214 HydrophobicContact CG1-CG1 4.17Å; V210-I214 WeakPolarHBondContact O-CB 3.27Å; V210-I214 WeakPolarHBondContact O-CG1 3.32Å; V210-I214 PolarHBondContact O-N 2.83Å; V210-I241 HydrophobicContact CG1-CG2 4.09Å; V210-I241 HydrophobicContact CG2-CD1 3.95Å; V210-I241 HydrophobicContact CG2-CG2 3.97Å; V210-E243 HydrophobicContact CG1-CB 3.88Å; V210-E243 HydrophobicContact CG1-CG 4.08Å; V210-M244 HydrophobicContact CB-CE 4.46Å; V210-M244 HydrophobicContact CG1-CE 4.29Å; V210-M244 HydrophobicContact CG2-CE 4.24Å
211	D	98.6	Very high	97.6	Very high	86 Å²	86	43.2 Å²	43.2	46%	0.46	22%	0.215	S	C	.	.	H	α-helix	trans	-60.3	-43	-179.1	-65.2	-13.5	0	0	0	111.2	Q207 S215	Q207-D211 PolarHBondContact NE2-OD1 3.49Å; Q207-D211 WeakPolarHBondContact O-CB 3.47Å; Q207-D211 PolarHBondContact O-N 3.27Å; D211-S215 VanDerWaalsContact O-CB 3.24Å; D211-S215 WeakPolarHBondContact O-CB 3.46Å; D211-S215 PolarHBondContact O-N 3.32Å
212	F	98.6	Very high	97.7	Very high	6 Å²	6	38.8 Å²	38.8	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-51.2	173.8	173.9	-97.8	0	0	0	112.1	L166 L169 L170 Y190 K208 E209 V210 I214 S215 M216	L166-F212 HydrophobicContact CD1-CB 3.81Å; L166-F212 HydrophobicContact CD1-CD1 4.03Å; L166-F212 HydrophobicContact CD1-CD2 4.21Å; L166-F212 HydrophobicContact CD1-CG 3.74Å; L169-F212 HydrophobicContact CB-CE2 3.91Å; L169-F212 HydrophobicContact CB-CZ 4.26Å; L169-F212 HydrophobicContact CD1-CZ 4.19Å; L170-F212 HydrophobicContact CD2-CB 4.23Å; L170-F212 HydrophobicContact CD2-CD2 3.98Å; L170-F212 HydrophobicContact CG-CD2 4.43Å; Y190-F212 AromaticContact CD2-CD1 3.98Å; Y190-F212 HydrophobicContact CD2-CD1 3.98Å; Y190-F212 AromaticContact CD2-CE1 3.89Å; Y190-F212 HydrophobicContact CD2-CE1 3.89Å; K208-F212 WeakPolarHBondContact O-CB 3.47Å; K208-F212 PolarHBondContact O-N 3.15Å; K208-F212 VanDerWaalsContact O-N 3.08Å; E209-F212 PolarHBondContact O-N 3.46Å; V210-F212 VanDerWaalsContact C-N 3.33Å; V210-F212 PolarHBondContact O-N 2.88Å; F212-I214 PolarHBondContact O-N 2.91Å; F212-S215 PolarHBondContact O-N 3.43Å; F212-M216 HydrophobicContact CD2-CG 4.42Å; F212-M216 HydrophobicContact CE1-CG 4.13Å; F212-M216 HydrophobicContact CE2-CG 3.97Å; F212-M216 HydrophobicContact CE2-SD 4.39Å; F212-M216 HydrophobicContact CZ-CG 3.81Å; F212-M216 HydrophobicContact CZ-SD 4.47Å; F212-M216 WeakPolarHBondContact O-CG 3.43Å; F212-M216 PolarHBondContact O-N 3.09Å
213	C	98.8	Very high	97.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-45	179.3	-76.8	0	0	0	0	111.7	Y190 L191 E209 V210 M216 L217 M244	Y190-C213 VanDerWaalsContact CB-SG 3.59Å; L191-C213 HydrophobicContact CD2-CB 3.85Å; L191-C213 HydrophobicContact CG-CB 4.32Å; E209-C213 WeakPolarHBondContact O-CB 3.49Å; E209-C213 PolarHBondContact O-N 3.07Å; E209-C213 PolarHBondContact O-SG 2.71Å; E209-C213 VanDerWaalsContact O-SG 3.38Å; V210-C213 PolarHBondContact O-N 3.15Å; C213-M216 PolarHBondContact O-N 3.01Å; C213-L217 HydrophobicContact CB-CD1 4.42Å; C213-L217 VanDerWaalsContact O-CB 3.25Å; C213-L217 WeakPolarHBondContact O-CB 3.31Å; C213-L217 VanDerWaalsContact O-CD1 3.31Å; C213-L217 WeakPolarHBondContact O-CD1 3.35Å; C213-L217 WeakPolarHBondContact O-CG 3.41Å; C213-L217 PolarHBondContact O-N 3.19Å; C213-M244 HydrophobicContact CB-CE 4Å
214	I	98.5	Very high	97.8	Very high	23 Å²	23	36.6 Å²	36.6	12%	0.118	18%	0.178	C	C	.	.	H	α-helix	trans	-65.2	-41.2	179	-68.2	-70.9	0	0	0	111.3	V210 F212 L217 R218 E243 M244 L247	V210-I214 HydrophobicContact CG1-CG1 4.17Å; V210-I214 WeakPolarHBondContact O-CB 3.27Å; V210-I214 WeakPolarHBondContact O-CG1 3.32Å; V210-I214 PolarHBondContact O-N 2.83Å; F212-I214 PolarHBondContact O-N 2.91Å; I214-L217 PolarHBondContact O-N 2.81Å; I214-R218 HydrophobicContact CG2-CG 4.48Å; I214-R218 WeakPolarHBondContact O-CB 3.13Å; I214-R218 WeakPolarHBondContact O-CG 3.27Å; I214-R218 PolarHBondContact O-N 3.22Å; I214-E243 HydrophobicContact CD1-CB 4.07Å; I214-E243 WeakPolarHBondContact CD1-O 3.41Å; I214-E243 HydrophobicContact CG1-CB 3.9Å; I214-M244 HydrophobicContact CD1-CE 4.11Å; I214-M244 HydrophobicContact CD1-CG 4.48Å; I214-M244 HydrophobicContact CD1-SD 3.73Å; I214-M244 HydrophobicContact CG1-CE 4.06Å; I214-M244 HydrophobicContact CG1-SD 4.35Å; I214-L247 HydrophobicContact CD1-CB 4.02Å; I214-L247 HydrophobicContact CD1-CD2 4.07Å
215	S	97.9	Very high	97.8	Very high	27 Å²	27	33.7 Å²	33.7	19%	0.189	16%	0.157	C	C	.	.	H	α-helix	trans	-59.1	-51.2	173.7	172.2	0	0	0	0	111.3	K173 D211 F212 R218 E219	K173-S215 PolarHBondContact NZ-OG 2.98Å; D211-S215 VanDerWaalsContact O-CB 3.24Å; D211-S215 WeakPolarHBondContact O-CB 3.46Å; D211-S215 PolarHBondContact O-N 3.32Å; F212-S215 PolarHBondContact O-N 3.43Å; S215-R218 PolarHBondContact O-N 2.73Å; S215-E219 VanDerWaalsContact O-CB 3.29Å; S215-E219 WeakPolarHBondContact O-CB 3.29Å; S215-E219 WeakPolarHBondContact O-CG 3.46Å; S215-E219 PolarHBondContact O-N 2.67Å; S215-E219 PolarHBondContact OG-OE1 3.43Å
216	M	98.1	Very high	97.7	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-42.3	178.2	-65.9	-61	97.2	0	0	112.5	K173 L177 I183 V187 F212 C213 R218 K220	K173-M216 HydrophobicContact CD-CE 4.23Å; K173-M216 HydrophobicContact CG-CE 4.33Å; L177-M216 HydrophobicContact CD2-CE 4.12Å; L177-M216 HydrophobicContact CD2-SD 4.31Å; I183-M216 HydrophobicContact CG1-SD 4.39Å; I183-M216 HydrophobicContact CG2-CB 4.12Å; I183-M216 HydrophobicContact CG2-CG 4.29Å; I183-M216 HydrophobicContact CG2-SD 3.98Å; V187-M216 HydrophobicContact CG2-CB 3.44Å; V187-M216 VanDerWaalsContact CG2-CB 3.44Å; V187-M216 HydrophobicContact CG2-CG 3.99Å; F212-M216 HydrophobicContact CD2-CG 4.42Å; F212-M216 HydrophobicContact CE1-CG 4.13Å; F212-M216 HydrophobicContact CE2-CG 3.97Å; F212-M216 HydrophobicContact CE2-SD 4.39Å; F212-M216 HydrophobicContact CZ-CG 3.81Å; F212-M216 HydrophobicContact CZ-SD 4.47Å; F212-M216 WeakPolarHBondContact O-CG 3.43Å; F212-M216 PolarHBondContact O-N 3.09Å; C213-M216 PolarHBondContact O-N 3.01Å; M216-R218 VanDerWaalsContact C-N 3.3Å; M216-R218 PolarHBondContact O-N 3.29Å; M216-K220 CarbonylContact O-C 2.98Å; M216-K220 VanDerWaalsContact O-C 3.27Å; M216-K220 VanDerWaalsContact O-CA 3.23Å; M216-K220 WeakPolarHBondContact O-CA 3.47Å; M216-K220 VanDerWaalsContact O-CB 3.3Å; M216-K220 WeakPolarHBondContact O-CB 3.46Å; M216-K220 PolarHBondContact O-N 3.4Å
217	L	98.1	Very high	97.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-70	-23.7	-179.6	-72.8	160.7	0	0	0	113.3	V187 L191 C213 I214 F221 C224 L231 L235 L247	V187-L217 HydrophobicContact CG1-CD1 4.17Å; V187-L217 HydrophobicContact CG1-CD2 4.01Å; V187-L217 HydrophobicContact CG1-CG 4.03Å; L191-L217 HydrophobicContact CD1-CD1 4.22Å; L191-L217 HydrophobicContact CD2-CD1 4.23Å; C213-L217 HydrophobicContact CB-CD1 4.42Å; C213-L217 VanDerWaalsContact O-CB 3.25Å; C213-L217 WeakPolarHBondContact O-CB 3.31Å; C213-L217 VanDerWaalsContact O-CD1 3.31Å; C213-L217 WeakPolarHBondContact O-CD1 3.35Å; C213-L217 WeakPolarHBondContact O-CG 3.41Å; C213-L217 PolarHBondContact O-N 3.19Å; I214-L217 PolarHBondContact O-N 2.81Å; L217-F221 HydrophobicContact CD2-CD2 4.37Å; L217-F221 HydrophobicContact CD2-CE2 4.47Å; L217-F221 WeakPolarHBondContact O-CB 3.45Å; L217-F221 WeakPolarHBondContact O-CD2 3.36Å; L217-C224 HydrophobicContact CD2-CB 3.88Å; L217-L231 HydrophobicContact CD2-CD1 4.39Å; L217-L231 HydrophobicContact CD2-CD2 4.48Å; L217-L235 HydrophobicContact CD1-CD2 4.06Å; L217-L247 HydrophobicContact CB-CD2 4Å; L217-L247 HydrophobicContact CD1-CD2 3.66Å; L217-L247 HydrophobicContact CG-CD2 4.36Å
218	R	96.9	Very high	97.6	Very high	83 Å²	83	31.3 Å²	31.3	31%	0.313	15%	0.151	S	C	.	.	H	α-helix	trans	-94.6	-31.6	177.1	-68.7	-178.8	174.8	-79	-0.2	113.7	I214 S215 M216 L246 L247 D250 L258	I214-R218 HydrophobicContact CG2-CG 4.48Å; I214-R218 WeakPolarHBondContact O-CB 3.13Å; I214-R218 WeakPolarHBondContact O-CG 3.27Å; I214-R218 PolarHBondContact O-N 3.22Å; S215-R218 PolarHBondContact O-N 2.73Å; M216-R218 VanDerWaalsContact C-N 3.3Å; M216-R218 PolarHBondContact O-N 3.29Å; R218-L246 PolarHBondContact NH2-O 2.98Å; R218-L247 HydrophobicContact CG-CD1 4.34Å; R218-D250 IonicContact CZ-OD2 3.73Å; R218-D250 VanDerWaalsContact CZ-OD2 3.23Å; R218-D250 IonicContact NH1-OD2 2.71Å; R218-D250 PolarHBondContact NH1-OD2 3.29Å; R218-D250 IonicContact NH2-OD2 3.6Å; R218-D250 PolarHBondContact NH2-OD2 2.97Å; R218-L258 HydrophobicContact CG-CD2 4.13Å
219	E	95.6	Very high	97.6	Very high	102 Å²	102	28.9 Å²	28.9	48%	0.477	14%	0.14	S	C	.	.	H	α-helix	trans	-90	-25.7	179.1	-65.6	166.3	-133	0	0	113.1	K173 S215	K173-E219 WeakPolarHBondContact CE-OE2 3.03Å; K173-E219 IonicContact NZ-OE1 3.59Å; K173-E219 PolarHBondContact NZ-OE1 3.32Å; K173-E219 IonicContact NZ-OE2 2.91Å; K173-E219 PolarHBondContact NZ-OE2 3.01Å; S215-E219 VanDerWaalsContact O-CB 3.29Å; S215-E219 WeakPolarHBondContact O-CB 3.29Å; S215-E219 WeakPolarHBondContact O-CG 3.46Å; S215-E219 PolarHBondContact O-N 2.67Å; S215-E219 PolarHBondContact OG-OE1 3.43Å
220	K	96.9	Very high	97.6	Very high	56 Å²	56	28.9 Å²	28.9	24%	0.243	14%	0.14	C	C	.	.			trans	-141.7	43.3	-165.6	-70	-74.9	158.2	-179	0	112.7	L177 I183 M216 M222 E223 C224	L177-K220 HydrophobicContact CD2-CD 4.1Å; L177-K220 HydrophobicContact CD2-CG 3.52Å; I183-K220 HydrophobicContact CD1-CB 4.13Å; I183-K220 HydrophobicContact CD1-CD 3.97Å; I183-K220 HydrophobicContact CD1-CG 3.94Å; I183-K220 HydrophobicContact CG2-CB 4.16Å; M216-K220 CarbonylContact O-C 2.98Å; M216-K220 VanDerWaalsContact O-C 3.27Å; M216-K220 VanDerWaalsContact O-CA 3.23Å; M216-K220 WeakPolarHBondContact O-CA 3.47Å; M216-K220 VanDerWaalsContact O-CB 3.3Å; M216-K220 WeakPolarHBondContact O-CB 3.46Å; M216-K220 PolarHBondContact O-N 3.4Å; K220-M222 PolarHBondContact O-N 2.94Å; K220-E223 WeakPolarHBondContact CA-OE2 3.41Å; K220-E223 HydrophobicContact CB-CB 4.44Å; K220-E223 HydrophobicContact CD-CG 4.21Å; K220-E223 WeakPolarHBondContact CD-OE1 3.48Å; K220-E223 WeakPolarHBondContact CD-OE2 3.34Å; K220-E223 WeakPolarHBondContact CE-OE1 3.3Å; K220-E223 IonicContact NZ-OE1 3.78Å; K220-E223 PolarHBondContact NZ-OE1 3.38Å; K220-E223 PolarHBondContact O-N 3.36Å; K220-C224 PolarHBondContact O-N 3.07Å; K220-C224 VanDerWaalsContact O-N 3.14Å; K220-C224 PolarHBondContact O-SG 2.7Å
221	F	97.3	Very high	97.6	Very high	3 Å²	3	28.9 Å²	28.9	1%	0.013	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-37.4	-176.1	-167.9	-102.4	0	0	0	113.6	L217 C224 L225 L251 L258 F262 L268	L217-F221 HydrophobicContact CD2-CD2 4.37Å; L217-F221 HydrophobicContact CD2-CE2 4.47Å; L217-F221 WeakPolarHBondContact O-CB 3.45Å; L217-F221 WeakPolarHBondContact O-CD2 3.36Å; F221-C224 CarbonylContact O-C 3.3Å; F221-C224 WeakPolarHBondContact O-CB 3.46Å; F221-C224 PolarHBondContact O-N 3.42Å; F221-C224 VanDerWaalsContact O-N 3.15Å; F221-L225 HydrophobicContact CE1-CD1 4.07Å; F221-L225 WeakPolarHBondContact O-CB 3.46Å; F221-L225 PolarHBondContact O-N 2.92Å; F221-L251 HydrophobicContact CE2-CD2 3.73Å; F221-L251 HydrophobicContact CZ-CD2 3.6Å; F221-L258 HydrophobicContact CB-CB 4.1Å; F221-L258 WeakPolarHBondContact CB-O 3.17Å; F221-L258 HydrophobicContact CD1-CB 4.1Å; F221-L258 HydrophobicContact CD2-CB 4.06Å; F221-L258 HydrophobicContact CD2-CD1 4.2Å; F221-L258 HydrophobicContact CE2-CD1 4.04Å; F221-L258 HydrophobicContact CG-CB 3.8Å; F221-L258 HydrophobicContact CZ-CD1 4.38Å; F221-F262 HydrophobicContact CD1-CB 4.19Å; F221-F262 HydrophobicContact CD1-CD1 4.28Å; F221-F262 HydrophobicContact CD1-CG 4.12Å; F221-F262 HydrophobicContact CE1-CB 3.98Å; F221-F262 AromaticContact CE1-CD1 3.51Å; F221-F262 HydrophobicContact CE1-CD1 3.51Å; F221-F262 AromaticContact CE1-CD2 3.62Å; F221-F262 HydrophobicContact CE1-CD2 3.62Å; F221-F262 AromaticContact CE1-CE1 3.82Å; F221-F262 HydrophobicContact CE1-CE1 3.82Å; F221-F262 AromaticContact CE1-CE2 3.89Å; F221-F262 HydrophobicContact CE1-CE2 3.89Å; F221-F262 AromaticContact CE1-CG 3.42Å; F221-F262 HydrophobicContact CE1-CG 3.42Å; F221-F262 VanDerWaalsContact CE1-CG 3.42Å; F221-F262 AromaticContact CE1-CZ 3.99Å; F221-F262 HydrophobicContact CE1-CZ 3.99Å; F221-F262 AromaticContact CZ-CD1 4Å; F221-F262 HydrophobicContact CZ-CD1 4Å; F221-F262 HydrophobicContact CZ-CD2 4.35Å; F221-F262 AromaticContact CZ-CE1 3.84Å; F221-F262 HydrophobicContact CZ-CE1 3.84Å; F221-F262 HydrophobicContact CZ-CE2 4.18Å; F221-F262 HydrophobicContact CZ-CG 4.28Å; F221-F262 AromaticContact CZ-CZ 3.92Å; F221-F262 HydrophobicContact CZ-CZ 3.92Å; F221-L268 HydrophobicContact CZ-CD1 4.11Å
222	M	95.9	Very high	97.6	Very high	53 Å²	53	25 Å²	25	26%	0.261	12%	0.119	S	C	.	.	H	α-helix	trans	-69	-35.6	-179.6	-66.5	-52.7	-60.3	0	0	112.4	K220 C224 L225 S259 Q261	K220-M222 PolarHBondContact O-N 2.94Å; M222-C224 VanDerWaalsContact C-N 3.3Å; M222-L225 HydrophobicContact CE-CD1 4.28Å; M222-L225 PolarHBondContact O-N 2.93Å; M222-L225 HydrophobicContact SD-CD1 4.28Å; M222-S259 VanDerWaalsContact CG-OG 3.23Å; M222-S259 WeakPolarHBondContact CG-OG 3.23Å; M222-S259 VanDerWaalsContact SD-CB 3.56Å; M222-S259 PolarHBondContact SD-OG 3.3Å; M222-Q261 HydrophobicContact CE-CB 4Å; M222-Q261 HydrophobicContact SD-CB 3.96Å
223	E	97.3	Very high	97.5	Very high	54 Å²	54	25 Å²	25	25%	0.252	12%	0.119	S	C	.	.	H	α-helix	trans	-66.2	-33.5	171.6	-64.5	87.6	155.3	0	0	111.3	I183 K220 I226	I183-E223 HydrophobicContact CD1-CB 4.21Å; I183-E223 HydrophobicContact CD1-CG 4.29Å; I183-E223 HydrophobicContact CG2-CB 4.46Å; K220-E223 WeakPolarHBondContact CA-OE2 3.41Å; K220-E223 HydrophobicContact CB-CB 4.44Å; K220-E223 HydrophobicContact CD-CG 4.21Å; K220-E223 WeakPolarHBondContact CD-OE1 3.48Å; K220-E223 WeakPolarHBondContact CD-OE2 3.34Å; K220-E223 WeakPolarHBondContact CE-OE1 3.3Å; K220-E223 IonicContact NZ-OE1 3.78Å; K220-E223 PolarHBondContact NZ-OE1 3.38Å; K220-E223 PolarHBondContact O-N 3.36Å; E223-I226 WeakPolarHBondContact O-CD1 3.36Å; E223-I226 WeakPolarHBondContact O-CG1 3.42Å
224	C	98	Very high	97.5	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-74.3	-31.1	172.5	-60	0	0	0	0	113.3	L217 K220 F221 M222 I226 I227 L231	L217-C224 HydrophobicContact CD2-CB 3.88Å; K220-C224 PolarHBondContact O-N 3.07Å; K220-C224 VanDerWaalsContact O-N 3.14Å; K220-C224 PolarHBondContact O-SG 2.7Å; F221-C224 CarbonylContact O-C 3.3Å; F221-C224 WeakPolarHBondContact O-CB 3.46Å; F221-C224 PolarHBondContact O-N 3.42Å; F221-C224 VanDerWaalsContact O-N 3.15Å; M222-C224 VanDerWaalsContact C-N 3.3Å; C224-I226 PolarHBondContact O-N 3.23Å; C224-I226 VanDerWaalsContact O-N 3.11Å; C224-I227 WeakPolarHBondContact O-CB 3.32Å; C224-I227 WeakPolarHBondContact O-CD1 3.48Å; C224-I227 WeakPolarHBondContact O-CG1 3.48Å; C224-I227 PolarHBondContact O-N 2.95Å; C224-I227 VanDerWaalsContact O-N 3.08Å; C224-L231 HydrophobicContact CB-CD2 4.45Å
225	L	96.6	Very high	97.5	Very high	26 Å²	26	23.9 Å²	23.9	14%	0.136	11%	0.113	C	C	.	.	H	α-helix	trans	-61.1	-24.3	-174.8	-175.4	145.7	0	0	0	113.2	F221 M222 I227 G228 F262 L268	F221-L225 HydrophobicContact CE1-CD1 4.07Å; F221-L225 WeakPolarHBondContact O-CB 3.46Å; F221-L225 PolarHBondContact O-N 2.92Å; M222-L225 HydrophobicContact CE-CD1 4.28Å; M222-L225 PolarHBondContact O-N 2.93Å; M222-L225 HydrophobicContact SD-CD1 4.28Å; L225-I227 PolarHBondContact O-N 2.78Å; L225-I227 VanDerWaalsContact O-N 3.08Å; L225-G228 PolarHBondContact O-N 3.43Å; L225-F262 HydrophobicContact CD1-CD2 3.69Å; L225-F262 HydrophobicContact CD1-CE2 4.22Å; L225-L268 HydrophobicContact CB-CD2 4.44Å; L225-L268 HydrophobicContact CG-CD2 3.94Å
226	I	96.4	Very high	97.4	Very high	82 Å²	82	25.2 Å²	25.2	42%	0.421	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-12.3	176.2	79.2	-174.1	0	0	0	113.8	M181 A184 E223 C224 G228 F277	M181-I226 HydrophobicContact CE-CD1 3.83Å; A184-I226 HydrophobicContact CB-CD1 3.86Å; A184-I226 HydrophobicContact CB-CG1 3.92Å; E223-I226 WeakPolarHBondContact O-CD1 3.36Å; E223-I226 WeakPolarHBondContact O-CG1 3.42Å; C224-I226 PolarHBondContact O-N 3.23Å; C224-I226 VanDerWaalsContact O-N 3.11Å; I226-G228 VanDerWaalsContact C-N 3.3Å; I226-F277 HydrophobicContact CD1-CZ 4.41Å; I226-F277 HydrophobicContact CG1-CE2 4.41Å; I226-F277 HydrophobicContact CG1-CZ 4.01Å
227	I	98.3	Very high	97.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-32.2	172.7	-64	166.4	0	0	0	111	A184 Y188 C224 L225 L231 T273 F277	A184-I227 HydrophobicContact CB-CD1 4.31Å; A184-I227 HydrophobicContact CB-CG1 4.08Å; Y188-I227 HydrophobicContact CD2-CD1 4.3Å; Y188-I227 HydrophobicContact CD2-CG1 4.47Å; Y188-I227 HydrophobicContact CD2-CG2 3.45Å; Y188-I227 VanDerWaalsContact CD2-CG2 3.45Å; Y188-I227 HydrophobicContact CE2-CG2 3.69Å; C224-I227 WeakPolarHBondContact O-CB 3.32Å; C224-I227 WeakPolarHBondContact O-CD1 3.48Å; C224-I227 WeakPolarHBondContact O-CG1 3.48Å; C224-I227 PolarHBondContact O-N 2.95Å; C224-I227 VanDerWaalsContact O-N 3.08Å; L225-I227 PolarHBondContact O-N 2.78Å; L225-I227 VanDerWaalsContact O-N 3.08Å; I227-L231 HydrophobicContact CB-CB 4.02Å; I227-L231 HydrophobicContact CD1-CD1 4.06Å; I227-L231 HydrophobicContact CG2-CB 3.67Å; I227-T273 VanDerWaalsContact O-CA 3.28Å; I227-T273 WeakPolarHBondContact O-CA 3.3Å; I227-T273 VanDerWaalsContact O-CB 3.25Å; I227-T273 WeakPolarHBondContact O-CB 3.42Å; I227-T273 WeakPolarHBondContact O-CG2 3.38Å; I227-T273 PolarHBondContact O-OG1 2.83Å; I227-F277 HydrophobicContact CB-CE2 4.41Å; I227-F277 HydrophobicContact CG1-CD1 4.24Å; I227-F277 HydrophobicContact CG1-CD2 4.43Å; I227-F277 HydrophobicContact CG1-CE1 3.94Å; I227-F277 HydrophobicContact CG1-CE2 4.14Å; I227-F277 HydrophobicContact CG1-CG 4.49Å; I227-F277 HydrophobicContact CG1-CZ 3.89Å
228	G	97.1	Very high	97.2	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.01	13%	0.13	C	C	.	.			trans	68.5	-152.9	-175.7	0	0	0	0	0	113.7	L225 I226 D230 L231 L268 A271	L225-G228 PolarHBondContact O-N 3.43Å; I226-G228 VanDerWaalsContact C-N 3.3Å; G228-D230 PolarHBondContact O-N 2.96Å; G228-L231 VanDerWaalsContact O-CB 3.24Å; G228-L231 WeakPolarHBondContact O-CB 3.28Å; G228-L231 PolarHBondContact O-N 2.87Å; G228-L268 CarbonylContact C-O 3.58Å; G228-A271 CarbonylContact C-O 3.58Å; G228-A271 VanDerWaalsContact CA-O 3.29Å; G228-A271 WeakPolarHBondContact CA-O 3.37Å
229	R	97.5	Very high	97.1	Very high	3 Å²	3	25.1 Å²	25.1	1%	0.011	13%	0.127	C	C	.	.	H	α-helix	trans	-56.4	-36.7	-166	63.8	173.7	70.5	120	-6.2	115.5	L231 V232 R233 L268 L269 A271 T273 Y374 D375 D384	R229-L231 PolarHBondContact O-N 3.36Å; R229-L231 VanDerWaalsContact O-N 3.16Å; R229-V232 VanDerWaalsContact O-CB 3.29Å; R229-V232 WeakPolarHBondContact O-CB 3.47Å; R229-V232 PolarHBondContact O-N 2.98Å; R229-R233 PolarHBondContact O-N 3.22Å; R229-L268 VanDerWaalsContact CA-O 3.28Å; R229-L268 WeakPolarHBondContact CA-O 3.46Å; R229-L268 PolarHBondContact N-O 3.2Å; R229-L269 WeakPolarHBondContact CB-O 3.49Å; R229-L269 PolarHBondContact NE-O 2.91Å; R229-A271 PolarHBondContact N-O 2.86Å; R229-T273 PolarHBondContact N-OG1 3.15Å; R229-Y374 HydrophobicContact CB-CE1 4.31Å; R229-Y374 HydrophobicContact CG-CD1 4.36Å; R229-Y374 WeakPolarHBondContact O-CE1 3.29Å; R229-D375 WeakPolarHBondContact CD-OD1 3.01Å; R229-D375 IonicContact CZ-OD1 2.68Å; R229-D375 IonicContact NE-OD1 3.83Å; R229-D375 IonicContact NH1-OD1 3.27Å; R229-D375 PolarHBondContact NH1-OD1 3.09Å; R229-D384 IonicContact CZ-OD1 2.69Å; R229-D384 IonicContact CZ-OD2 3.85Å; R229-D384 IonicContact NH1-OD1 3.96Å; R229-D384 PolarHBondContact NH1-OD1 2.84Å; R229-D384 IonicContact NH1-OD2 2.84Å; R229-D384 VanDerWaalsContact NH2-CG 3.34Å; R229-D384 IonicContact NH2-OD1 2.66Å; R229-D384 PolarHBondContact NH2-OD1 3.05Å; R229-D384 IonicContact NH2-OD2 2.85Å; R229-D384 PolarHBondContact NH2-OD2 3.3Å
230	D	98.1	Very high	97.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.1	-16.4	177	-82.6	-106.6	0	0	0	113.6	Y188 G228 V232 R233 L234 T273 L278 R328	Y188-D230 HydrophobicContact CE2-CB 3.88Å; G228-D230 PolarHBondContact O-N 2.96Å; D230-V232 PolarHBondContact O-N 2.93Å; D230-R233 WeakPolarHBondContact O-CB 3.17Å; D230-R233 PolarHBondContact O-N 3.09Å; D230-R233 IonicContact OD1-CZ 2.73Å; D230-R233 IonicContact OD1-NE 2.68Å; D230-R233 PolarHBondContact OD1-NE 2.89Å; D230-R233 IonicContact OD1-NH2 3.23Å; D230-R233 PolarHBondContact OD1-NH2 3.19Å; D230-L234 PolarHBondContact O-N 3.37Å; D230-T273 HydrophobicContact CB-CG2 3.94Å; D230-T273 WeakPolarHBondContact CB-OG1 3.48Å; D230-T273 PolarHBondContact N-OG1 3.25Å; D230-T273 PolarHBondContact OD2-OG1 2.89Å; D230-L278 HydrophobicContact CB-CD2 4.49Å; D230-R328 IonicContact OD1-CZ 2.79Å; D230-R328 IonicContact OD1-NE 3.82Å; D230-R328 PolarHBondContact OD1-NE 3.32Å; D230-R328 IonicContact OD2-CZ 2.59Å; D230-R328 IonicContact OD2-NE 2.83Å; D230-R328 PolarHBondContact OD2-NE 3.08Å; D230-R328 IonicContact OD2-NH2 2.7Å; D230-R328 PolarHBondContact OD2-NH2 3.26Å
231	L	98.6	Very high	97.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.1	-41.1	168.5	-179	54.8	0	0	0	110.5	V187 L191 L217 C224 I227 G228 R229 R233 L234 L235 L268	V187-L231 HydrophobicContact CG1-CD1 4.49Å; L191-L231 HydrophobicContact CD1-CD1 3.57Å; L217-L231 HydrophobicContact CD2-CD1 4.39Å; L217-L231 HydrophobicContact CD2-CD2 4.48Å; C224-L231 HydrophobicContact CB-CD2 4.45Å; I227-L231 HydrophobicContact CB-CB 4.02Å; I227-L231 HydrophobicContact CD1-CD1 4.06Å; I227-L231 HydrophobicContact CG2-CB 3.67Å; G228-L231 VanDerWaalsContact O-CB 3.24Å; G228-L231 WeakPolarHBondContact O-CB 3.28Å; G228-L231 PolarHBondContact O-N 2.87Å; R229-L231 PolarHBondContact O-N 3.36Å; R229-L231 VanDerWaalsContact O-N 3.16Å; L231-R233 VanDerWaalsContact C-N 3.32Å; L231-L234 PolarHBondContact O-N 3.05Å; L231-L235 HydrophobicContact CD1-CD1 4.1Å; L231-L235 HydrophobicContact CD1-CG 4.23Å; L231-L235 HydrophobicContact CG-CD1 3.9Å; L231-L235 HydrophobicContact CG-CG 4.47Å; L231-L235 WeakPolarHBondContact O-CB 3.22Å; L231-L235 VanDerWaalsContact O-CG 3.27Å; L231-L235 WeakPolarHBondContact O-CG 3.48Å; L231-L235 PolarHBondContact O-N 3.34Å; L231-L268 HydrophobicContact CD2-CD1 4.21Å; L231-L268 HydrophobicContact CD2-CD2 4.05Å
232	V	98.4	Very high	97.1	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.024	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-40.9	176.2	-167.6	0	0	0	0	110.1	R229 D230 L234 L235 Q236 W248 I265 L268 L269	R229-V232 VanDerWaalsContact O-CB 3.29Å; R229-V232 WeakPolarHBondContact O-CB 3.47Å; R229-V232 PolarHBondContact O-N 2.98Å; D230-V232 PolarHBondContact O-N 2.93Å; V232-L234 VanDerWaalsContact C-N 3.34Å; V232-L234 PolarHBondContact O-N 3.15Å; V232-L235 PolarHBondContact O-N 3.18Å; V232-Q236 WeakPolarHBondContact O-CG 3.49Å; V232-Q236 PolarHBondContact O-N 3.3Å; V232-W248 HydrophobicContact CG1-CH2 3.7Å; V232-W248 HydrophobicContact CG1-CZ2 4.37Å; V232-I265 HydrophobicContact CG1-CD1 4.04Å; V232-I265 HydrophobicContact CG1-CG1 4.37Å; V232-I265 HydrophobicContact CG2-CD1 3.8Å; V232-I265 HydrophobicContact CG2-CG1 4.45Å; V232-L268 HydrophobicContact CG2-CB 3.72Å; V232-L268 HydrophobicContact CG2-CD1 4.2Å; V232-L269 HydrophobicContact CB-CD2 4.1Å; V232-L269 HydrophobicContact CG1-CD2 4.06Å; V232-L269 HydrophobicContact CG2-CD2 4.02Å; V232-L269 HydrophobicContact CG2-CG 4.24Å
233	R	98.1	Very high	97.2	Very high	6 Å²	6	33.4 Å²	33.4	2%	0.023	16%	0.163	C	C	.	.	H	α-helix	trans	-60.3	-39.2	175.7	-167.9	-179.4	56.8	78.7	1.8	112.9	Y188 R229 D230 L231 Q236 N237 Y374	Y188-R233 PolarHBondContact OH-NH2 3.31Å; R229-R233 PolarHBondContact O-N 3.22Å; D230-R233 WeakPolarHBondContact O-CB 3.17Å; D230-R233 PolarHBondContact O-N 3.09Å; D230-R233 IonicContact OD1-CZ 2.73Å; D230-R233 IonicContact OD1-NE 2.68Å; D230-R233 PolarHBondContact OD1-NE 2.89Å; D230-R233 IonicContact OD1-NH2 3.23Å; D230-R233 PolarHBondContact OD1-NH2 3.19Å; L231-R233 VanDerWaalsContact C-N 3.32Å; R233-Q236 WeakPolarHBondContact O-CG 3.32Å; R233-N237 VanDerWaalsContact O-CG 3.3Å; R233-N237 PolarHBondContact O-ND2 3.18Å; R233-N237 PolarHBondContact O-OD1 3.43Å; R233-Y374 WeakPolarHBondContact CA-OH 3.49Å; R233-Y374 HydrophobicContact CB-CD1 4.38Å; R233-Y374 HydrophobicContact CB-CD2 4.25Å; R233-Y374 HydrophobicContact CB-CE1 3.88Å; R233-Y374 HydrophobicContact CB-CE2 3.73Å; R233-Y374 HydrophobicContact CG-CD2 4Å; R233-Y374 HydrophobicContact CG-CE2 3.75Å; R233-Y374 PolarHBondContact N-OH 2.95Å; R233-Y374 VanDerWaalsContact N-OH 3.11Å
234	L	98.3	Very high	97.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-73.3	-45	176	-63.8	-174.7	0	0	0	111.3	Y188 L191 R192 D230 L231 V232 Q236 N237 V238	Y188-L234 HydrophobicContact CD1-CD1 4.27Å; Y188-L234 HydrophobicContact CD2-CD1 3.41Å; Y188-L234 VanDerWaalsContact CD2-CD1 3.41Å; Y188-L234 HydrophobicContact CD2-CG 4.46Å; Y188-L234 HydrophobicContact CE1-CD1 4.35Å; Y188-L234 HydrophobicContact CE2-CD1 3.53Å; Y188-L234 HydrophobicContact CE2-CG 4.17Å; Y188-L234 HydrophobicContact CG-CD1 3.82Å; Y188-L234 VanDerWaalsContact O-CD1 3.3Å; Y188-L234 WeakPolarHBondContact O-CD1 3.25Å; L191-L234 HydrophobicContact CB-CB 3.91Å; L191-L234 HydrophobicContact CB-CD1 4.05Å; L191-L234 HydrophobicContact CD1-CB 4.27Å; R192-L234 HydrophobicContact CB-CD1 4.3Å; R192-L234 HydrophobicContact CB-CD2 3.93Å; R192-L234 HydrophobicContact CG-CD2 4.49Å; D230-L234 PolarHBondContact O-N 3.37Å; L231-L234 PolarHBondContact O-N 3.05Å; V232-L234 VanDerWaalsContact C-N 3.34Å; V232-L234 PolarHBondContact O-N 3.15Å; L234-Q236 VanDerWaalsContact C-N 3.31Å; L234-Q236 PolarHBondContact O-N 3.49Å; L234-N237 PolarHBondContact O-N 3.44Å; L234-V238 PolarHBondContact O-N 3.28Å
235	L	98.3	Very high	97.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-34.7	179.9	-72.7	170.8	0	0	0	113.3	L191 L217 L231 V232 N237 V238 A239 M244 L247 W248 L251	L191-L235 HydrophobicContact CD1-CD2 3.92Å; L191-L235 HydrophobicContact CD1-CG 4.16Å; L191-L235 HydrophobicContact CD2-CD2 3.97Å; L217-L235 HydrophobicContact CD1-CD2 4.06Å; L231-L235 HydrophobicContact CD1-CD1 4.1Å; L231-L235 HydrophobicContact CD1-CG 4.23Å; L231-L235 HydrophobicContact CG-CD1 3.9Å; L231-L235 HydrophobicContact CG-CG 4.47Å; L231-L235 WeakPolarHBondContact O-CB 3.22Å; L231-L235 VanDerWaalsContact O-CG 3.27Å; L231-L235 WeakPolarHBondContact O-CG 3.48Å; L231-L235 PolarHBondContact O-N 3.34Å; V232-L235 PolarHBondContact O-N 3.18Å; L235-N237 VanDerWaalsContact C-N 3.35Å; L235-V238 PolarHBondContact O-N 3.37Å; L235-A239 PolarHBondContact O-N 2.8Å; L235-A239 VanDerWaalsContact O-N 3.08Å; L235-M244 HydrophobicContact CD2-SD 4.22Å; L235-L247 HydrophobicContact CD2-CD2 3.98Å; L235-W248 HydrophobicContact CB-CZ2 3.77Å; L235-W248 PolarHBondContact O-NE1 3.38Å; L235-L251 HydrophobicContact CD1-CD1 3.87Å
236	Q	95.6	Very high	97.2	Very high	56 Å²	56	39.5 Å²	39.5	26%	0.262	19%	0.193	S	C	.	.	H	α-helix	trans	-68.8	-34.3	177.7	61.9	172.8	101	0	0	112.2	V232 R233 L234 V238 A239 W248 Y374	V232-Q236 WeakPolarHBondContact O-CG 3.49Å; V232-Q236 PolarHBondContact O-N 3.3Å; R233-Q236 WeakPolarHBondContact O-CG 3.32Å; L234-Q236 VanDerWaalsContact C-N 3.31Å; L234-Q236 PolarHBondContact O-N 3.49Å; Q236-V238 PolarHBondContact O-N 3.36Å; Q236-A239 WeakPolarHBondContact O-CB 3.41Å; Q236-A239 PolarHBondContact O-N 3.42Å; Q236-W248 HydrophobicContact CB-CZ2 4.04Å; Q236-Y374 PolarHBondContact OE1-OH 3.28Å
237	N	94	Very high	97.3	Very high	48 Å²	48	35.6 Å²	35.6	26%	0.257	17%	0.173	S	C	.	.	H	α-helix	trans	-68.1	-25.5	-179.9	-68.2	-8.4	0	0	0	112.1	V195 R233 L234 L235	V195-N237 HydrophobicContact CG2-CB 3.96Å; R233-N237 VanDerWaalsContact O-CG 3.3Å; R233-N237 PolarHBondContact O-ND2 3.18Å; R233-N237 PolarHBondContact O-OD1 3.43Å; L234-N237 PolarHBondContact O-N 3.44Å; L235-N237 VanDerWaalsContact C-N 3.35Å
238	V	97.3	Very high	97.2	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.03	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	5.8	178.2	-57.1	0	0	0	0	113.5	L191 I194 V195 L234 L235 Q236 R240 I241 M244	L191-V238 HydrophobicContact CD2-CG2 4.26Å; I194-V238 HydrophobicContact CB-CG1 4.08Å; I194-V238 HydrophobicContact CG2-CB 4.22Å; I194-V238 HydrophobicContact CG2-CG1 3.55Å; V195-V238 HydrophobicContact CG2-CG1 3.91Å; L234-V238 PolarHBondContact O-N 3.28Å; L235-V238 PolarHBondContact O-N 3.37Å; Q236-V238 PolarHBondContact O-N 3.36Å; V238-R240 PolarHBondContact O-N 3.16Å; V238-I241 HydrophobicContact CB-CD1 4.12Å; V238-I241 WeakPolarHBondContact O-CB 3.37Å; V238-I241 WeakPolarHBondContact O-CG1 3.32Å; V238-I241 PolarHBondContact O-N 3.19Å; V238-M244 HydrophobicContact CB-CG 4.24Å; V238-M244 HydrophobicContact CG2-CB 4.32Å; V238-M244 HydrophobicContact CG2-CE 4.29Å; V238-M244 HydrophobicContact CG2-CG 3.77Å; V238-M244 HydrophobicContact CG2-SD 3.8Å; V238-M244 WeakPolarHBondContact O-CB 3.32Å
239	A	96.4	Very high	97.2	Very high	29 Å²	29	43.6 Å²	43.6	24%	0.24	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.8	-171.1	0	0	0	0	0	115.3	L235 Q236 I241	L235-A239 PolarHBondContact O-N 2.8Å; L235-A239 VanDerWaalsContact O-N 3.08Å; Q236-A239 WeakPolarHBondContact O-CB 3.41Å; Q236-A239 PolarHBondContact O-N 3.42Å; A239-I241 VanDerWaalsContact C-N 3.29Å; A239-I241 PolarHBondContact O-N 2.66Å
240	R	94.1	Very high	97.2	Very high	241 Å²	241	44 Å²	44	91%	0.909	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	5.2	178.2	-62.1	-174.8	65.1	-164.2	-1.8	114.2	V238	V238-R240 PolarHBondContact O-N 3.16Å
241	I	97.4	Very high	97	Very high	12 Å²	12	44.1 Å²	44.1	6%	0.062	21%	0.205	C	C	.	.	S	Bend	trans	-87.5	130.1	171.8	-62.1	-176.7	0	0	0	107.7	I194 V210 V238 A239 E243 M244 E245	I194-I241 HydrophobicContact CG2-CD1 3.36Å; V210-I241 HydrophobicContact CG1-CG2 4.09Å; V210-I241 HydrophobicContact CG2-CD1 3.95Å; V210-I241 HydrophobicContact CG2-CG2 3.97Å; V238-I241 HydrophobicContact CB-CD1 4.12Å; V238-I241 WeakPolarHBondContact O-CB 3.37Å; V238-I241 WeakPolarHBondContact O-CG1 3.32Å; V238-I241 PolarHBondContact O-N 3.19Å; A239-I241 VanDerWaalsContact C-N 3.29Å; A239-I241 PolarHBondContact O-N 2.66Å; I241-E243 VanDerWaalsContact C-N 3.3Å; I241-E243 WeakPolarHBondContact CG2-OE2 3.44Å; I241-E243 PolarHBondContact O-N 2.94Å; I241-E243 VanDerWaalsContact O-N 3.15Å; I241-M244 HydrophobicContact CB-CB 4.13Å; I241-M244 HydrophobicContact CB-CG 3.93Å; I241-M244 HydrophobicContact CG2-CG 4.19Å; I241-M244 CarbonylContact O-C 3.45Å; I241-M244 WeakPolarHBondContact O-CA 3.46Å; I241-M244 WeakPolarHBondContact O-CB 3.48Å; I241-M244 PolarHBondContact O-N 2.85Å; I241-E245 PolarHBondContact O-N 3.19Å
242	P	96.8	Very high	96.9	Very high	81 Å²	81	47 Å²	47	53%	0.526	22%	0.22	S	C	.	.	H	α-helix	trans	-54.5	-39.9	-169.2	-28.5	35.7	0	0	0	115	M244 E245 L246	P242-M244 VanDerWaalsContact C-N 3.34Å; P242-E245 PolarHBondContact O-N 3.25Å; P242-L246 VanDerWaalsContact O-CG 3.31Å; P242-L246 WeakPolarHBondContact O-CG 3.23Å; P242-L246 PolarHBondContact O-N 3.49Å
243	E	98.1	Very high	96.7	Very high	54 Å²	54	53.2 Å²	53.2	25%	0.252	25%	0.249	S	C	.	.	H	α-helix	trans	-69	-34.7	178.8	-57	85.2	165.3	0	0	111.6	Q207 V210 I214 I241 L247	Q207-E243 PolarHBondContact NE2-OE1 3.3Å; V210-E243 HydrophobicContact CG1-CB 3.88Å; V210-E243 HydrophobicContact CG1-CG 4.08Å; I214-E243 HydrophobicContact CD1-CB 4.07Å; I214-E243 WeakPolarHBondContact CD1-O 3.41Å; I214-E243 HydrophobicContact CG1-CB 3.9Å; I241-E243 VanDerWaalsContact C-N 3.3Å; I241-E243 WeakPolarHBondContact CG2-OE2 3.44Å; I241-E243 PolarHBondContact O-N 2.94Å; I241-E243 VanDerWaalsContact O-N 3.15Å; E243-L247 PolarHBondContact O-N 3.09Å
244	M	97.6	Very high	96.5	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-74.9	-35.9	174.9	-61.1	-70.7	173.9	0	0	111.4	L191 I194 V210 C213 I214 L235 V238 I241 P242 L246 L247 W248	L191-M244 HydrophobicContact CD2-CE 3.63Å; L191-M244 HydrophobicContact CD2-SD 4.06Å; I194-M244 HydrophobicContact CD1-CE 4.12Å; V210-M244 HydrophobicContact CB-CE 4.46Å; V210-M244 HydrophobicContact CG1-CE 4.29Å; V210-M244 HydrophobicContact CG2-CE 4.24Å; C213-M244 HydrophobicContact CB-CE 4Å; I214-M244 HydrophobicContact CD1-CE 4.11Å; I214-M244 HydrophobicContact CD1-CG 4.48Å; I214-M244 HydrophobicContact CD1-SD 3.73Å; I214-M244 HydrophobicContact CG1-CE 4.06Å; I214-M244 HydrophobicContact CG1-SD 4.35Å; L235-M244 HydrophobicContact CD2-SD 4.22Å; V238-M244 HydrophobicContact CB-CG 4.24Å; V238-M244 HydrophobicContact CG2-CB 4.32Å; V238-M244 HydrophobicContact CG2-CE 4.29Å; V238-M244 HydrophobicContact CG2-CG 3.77Å; V238-M244 HydrophobicContact CG2-SD 3.8Å; V238-M244 WeakPolarHBondContact O-CB 3.32Å; I241-M244 HydrophobicContact CB-CB 4.13Å; I241-M244 HydrophobicContact CB-CG 3.93Å; I241-M244 HydrophobicContact CG2-CG 4.19Å; I241-M244 CarbonylContact O-C 3.45Å; I241-M244 WeakPolarHBondContact O-CA 3.46Å; I241-M244 WeakPolarHBondContact O-CB 3.48Å; I241-M244 PolarHBondContact O-N 2.85Å; P242-M244 VanDerWaalsContact C-N 3.34Å; M244-L246 VanDerWaalsContact C-N 3.35Å; M244-L247 CarbonylContact O-C 3.47Å; M244-L247 WeakPolarHBondContact O-CB 3.46Å; M244-L247 PolarHBondContact O-N 3.28Å; M244-W248 WeakPolarHBondContact O-CB 3.37Å; M244-W248 VanDerWaalsContact O-CD1 3.25Å; M244-W248 PolarHBondContact O-N 3.22Å
245	E	97.2	Very high	96.3	Very high	127 Å²	127	57.9 Å²	57.9	59%	0.593	28%	0.276	S	S	*	.	H	α-helix	trans	-61.2	-44.2	172.2	-170.7	-173.4	151.3	0	0	110.7	I241 P242 L247 W248 R249	I241-E245 PolarHBondContact O-N 3.19Å; P242-E245 PolarHBondContact O-N 3.25Å; E245-L247 VanDerWaalsContact C-N 3.34Å; E245-L247 PolarHBondContact O-N 3.41Å; E245-W248 PolarHBondContact O-N 2.86Å; E245-R249 PolarHBondContact O-N 2.99Å
246	L	97.4	Very high	96.2	Very high	81 Å²	81	62.8 Å²	62.8	42%	0.424	30%	0.299	S	S	.	.	H	α-helix	trans	-62.6	-38.4	173.1	-69.3	170.5	0	0	0	112.2	R218 P242 M244 D250	R218-L246 PolarHBondContact NH2-O 2.98Å; P242-L246 VanDerWaalsContact O-CG 3.31Å; P242-L246 WeakPolarHBondContact O-CG 3.23Å; P242-L246 PolarHBondContact O-N 3.49Å; M244-L246 VanDerWaalsContact C-N 3.35Å; L246-D250 PolarHBondContact O-N 2.93Å
247	L	98.1	Very high	96.2	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-66.4	-41.1	173.1	-178.3	66.1	0	0	0	112	I214 L217 R218 L235 E243 M244 E245 D250 L251 L258	I214-L247 HydrophobicContact CD1-CB 4.02Å; I214-L247 HydrophobicContact CD1-CD2 4.07Å; L217-L247 HydrophobicContact CB-CD2 4Å; L217-L247 HydrophobicContact CD1-CD2 3.66Å; L217-L247 HydrophobicContact CG-CD2 4.36Å; R218-L247 HydrophobicContact CG-CD1 4.34Å; L235-L247 HydrophobicContact CD2-CD2 3.98Å; E243-L247 PolarHBondContact O-N 3.09Å; M244-L247 CarbonylContact O-C 3.47Å; M244-L247 WeakPolarHBondContact O-CB 3.46Å; M244-L247 PolarHBondContact O-N 3.28Å; E245-L247 VanDerWaalsContact C-N 3.34Å; E245-L247 PolarHBondContact O-N 3.41Å; L247-D250 PolarHBondContact O-N 3.44Å; L247-D250 VanDerWaalsContact O-N 3.16Å; L247-L251 HydrophobicContact CG-CD1 4.05Å; L247-L251 HydrophobicContact CG-CG 4.39Å; L247-L251 WeakPolarHBondContact O-CG 3.49Å; L247-L251 PolarHBondContact O-N 3.09Å; L247-L258 HydrophobicContact CD1-CD1 3.95Å; L247-L258 HydrophobicContact CD1-CD2 3.64Å; L247-L258 HydrophobicContact CD1-CG 4.47Å
248	W	97.8	Very high	96.2	Very high	40 Å²	40	63.2 Å²	63.2	15%	0.152	31%	0.306	C	S	.	.	H	α-helix	trans	-61.8	-42.4	176.4	-92.8	109.2	0	0	0	112.7	V232 L235 Q236 M244 E245 D250 L251 L252 I265	V232-W248 HydrophobicContact CG1-CH2 3.7Å; V232-W248 HydrophobicContact CG1-CZ2 4.37Å; L235-W248 HydrophobicContact CB-CZ2 3.77Å; L235-W248 PolarHBondContact O-NE1 3.38Å; Q236-W248 HydrophobicContact CB-CZ2 4.04Å; M244-W248 WeakPolarHBondContact O-CB 3.37Å; M244-W248 VanDerWaalsContact O-CD1 3.25Å; M244-W248 PolarHBondContact O-N 3.22Å; E245-W248 PolarHBondContact O-N 2.86Å; W248-D250 VanDerWaalsContact C-N 3.26Å; W248-D250 PolarHBondContact O-N 3.29Å; W248-L251 HydrophobicContact CD2-CD1 4.38Å; W248-L251 HydrophobicContact CE3-CD1 4.36Å; W248-L251 PolarHBondContact O-N 3.29Å; W248-L252 HydrophobicContact CE3-CD1 3.98Å; W248-L252 HydrophobicContact CE3-CD2 4.37Å; W248-L252 HydrophobicContact CE3-CG 4.01Å; W248-L252 HydrophobicContact CZ3-CD1 4.44Å; W248-L252 HydrophobicContact CZ3-CD2 4.24Å; W248-L252 HydrophobicContact CZ3-CG 4.39Å; W248-L252 WeakPolarHBondContact O-CB 3.33Å; W248-L252 WeakPolarHBondContact O-CG 3.27Å; W248-L252 PolarHBondContact O-N 3.06Å; W248-I265 HydrophobicContact CZ3-CD1 4.22Å
249	R	96.6	Very high	96.2	Very high	128 Å²	128	63.5 Å²	63.5	48%	0.483	31%	0.308	S	S	.	.	H	α-helix	trans	-58.6	-40.2	173.1	-171.5	-168.2	65.7	-160.2	-5.2	111.6	E245 H253	E245-R249 PolarHBondContact O-N 2.99Å; R249-H253 WeakPolarHBondContact O-CB 3.24Å; R249-H253 PolarHBondContact O-CD2 3.23Å; R249-H253 PolarHBondContact O-N 2.78Å
250	D	96.4	Very high	96.1	Very high	13 Å²	13	67.4 Å²	67.4	7%	0.07	33%	0.331	C	S	.	.	H	α-helix	trans	-73.2	-41.2	178.6	-58.8	-19.7	0	0	0	111.3	R218 L246 L247 W248 L252 N254 P255	R218-D250 IonicContact CZ-OD2 3.73Å; R218-D250 VanDerWaalsContact CZ-OD2 3.23Å; R218-D250 IonicContact NH1-OD2 2.71Å; R218-D250 PolarHBondContact NH1-OD2 3.29Å; R218-D250 IonicContact NH2-OD2 3.6Å; R218-D250 PolarHBondContact NH2-OD2 2.97Å; L246-D250 PolarHBondContact O-N 2.93Å; L247-D250 PolarHBondContact O-N 3.44Å; L247-D250 VanDerWaalsContact O-N 3.16Å; W248-D250 VanDerWaalsContact C-N 3.26Å; W248-D250 PolarHBondContact O-N 3.29Å; D250-L252 VanDerWaalsContact C-N 3.3Å; D250-L252 PolarHBondContact O-N 3.44Å; D250-N254 CarbonylContact O-C 3.26Å; D250-N254 WeakPolarHBondContact O-CA 3.46Å; D250-N254 PolarHBondContact O-N 3.49Å; D250-P255 WeakPolarHBondContact O-CA 3.24Å
251	L	95.4	Very high	96.1	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-57.5	-37.6	174	-78.1	165.3	0	0	0	113.6	F221 L235 L247 W248 L258 F262	F221-L251 HydrophobicContact CE2-CD2 3.73Å; F221-L251 HydrophobicContact CZ-CD2 3.6Å; L235-L251 HydrophobicContact CD1-CD1 3.87Å; L247-L251 HydrophobicContact CG-CD1 4.05Å; L247-L251 HydrophobicContact CG-CG 4.39Å; L247-L251 WeakPolarHBondContact O-CG 3.49Å; L247-L251 PolarHBondContact O-N 3.09Å; W248-L251 HydrophobicContact CD2-CD1 4.38Å; W248-L251 HydrophobicContact CE3-CD1 4.36Å; W248-L251 PolarHBondContact O-N 3.29Å; L251-L258 HydrophobicContact CD2-CD1 3.55Å; L251-L258 HydrophobicContact CG-CD1 3.74Å; L251-F262 HydrophobicContact CD2-CE1 3.74Å; L251-F262 HydrophobicContact CD2-CZ 4.05Å
252	L	95.1	Very high	96	Very high	60 Å²	60	61.6 Å²	61.6	31%	0.314	31%	0.314	S	S	.	.	H	α-helix	trans	-92.2	-33.8	-174.6	-65.8	177.4	0	0	0	113.7	W248 D250 I265 F422	W248-L252 HydrophobicContact CE3-CD1 3.98Å; W248-L252 HydrophobicContact CE3-CD2 4.37Å; W248-L252 HydrophobicContact CE3-CG 4.01Å; W248-L252 HydrophobicContact CZ3-CD1 4.44Å; W248-L252 HydrophobicContact CZ3-CD2 4.24Å; W248-L252 HydrophobicContact CZ3-CG 4.39Å; W248-L252 WeakPolarHBondContact O-CB 3.33Å; W248-L252 WeakPolarHBondContact O-CG 3.27Å; W248-L252 PolarHBondContact O-N 3.06Å; D250-L252 VanDerWaalsContact C-N 3.3Å; D250-L252 PolarHBondContact O-N 3.44Å; L252-I265 HydrophobicContact CD2-CB 4.25Å; L252-I265 HydrophobicContact CD2-CG2 4.08Å; L252-F422 HydrophobicContact CD1-CE2 4.24Å; L252-F422 HydrophobicContact CD2-CE2 3.77Å; L252-F422 HydrophobicContact CD2-CZ 3.75Å
253	H	94.8	Very high	95.9	Very high	135 Å²	135	63 Å²	63	63%	0.625	32%	0.321	S	S	*	.	H	α-helix	trans	-115.1	-26.3	-173	-55.6	-62.1	0	0	0	114.4	R249	R249-H253 WeakPolarHBondContact O-CB 3.24Å; R249-H253 PolarHBondContact O-CD2 3.23Å; R249-H253 PolarHBondContact O-N 2.78Å
254	N	94.4	Very high	95.6	Very high	83 Å²	83	60.9 Å²	60.9	44%	0.444	31%	0.314	S	S	.	.			trans	-134.6	48.1	-176.2	-60.1	-67.5	0	0	0	112.7	D250 Q256 V257	D250-N254 CarbonylContact O-C 3.26Å; D250-N254 WeakPolarHBondContact O-CA 3.46Å; D250-N254 PolarHBondContact O-N 3.49Å; N254-Q256 PolarHBondContact O-N 3.01Å; N254-V257 HydrophobicContact CB-CB 4.49Å; N254-V257 HydrophobicContact CB-CG2 3.88Å; N254-V257 WeakPolarHBondContact O-CB 3.07Å; N254-V257 PolarHBondContact O-N 3.47Å
255	P	94.5	Very high	95.6	Very high	22 Å²	22	61.6 Å²	61.6	14%	0.143	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-57.3	-30	-169.1	21.4	-34.1	0	0	0	113.9	D250 V257 L258 S259 F262	D250-P255 WeakPolarHBondContact O-CA 3.24Å; P255-V257 PolarHBondContact O-N 3.38Å; P255-V257 VanDerWaalsContact O-N 3.16Å; P255-L258 PolarHBondContact O-N 3.13Å; P255-S259 PolarHBondContact O-N 3.22Å; P255-F262 HydrophobicContact CB-CD1 3.34Å; P255-F262 HydrophobicContact CB-CE1 3.57Å; P255-F262 HydrophobicContact CB-CG 4.27Å
256	Q	95	Very high	95.5	Very high	103 Å²	103	58.6 Å²	58.6	48%	0.481	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-62	-18.9	177.1	-56	-58.8	-32.7	0	0	114.2	N254 L258 S259 P260 F262	N254-Q256 PolarHBondContact O-N 3.01Å; Q256-L258 VanDerWaalsContact C-N 3.32Å; Q256-S259 WeakPolarHBondContact CA-O 3.49Å; Q256-S259 CarbonylContact O-C 3.41Å; Q256-S259 PolarHBondContact OE1-O 3.32Å; Q256-P260 VanDerWaalsContact OE1-CA 3.27Å; Q256-P260 PolarHBondContact OE1-O 3.17Å; Q256-F262 PolarHBondContact NE2-O 3.23Å
257	V	95.8	Very high	95.5	Very high	100 Å²	100	57.3 Å²	57.3	61%	0.606	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-73	-25.7	175.4	176.4	0	0	0	0	111.7	N254 P255	N254-V257 HydrophobicContact CB-CB 4.49Å; N254-V257 HydrophobicContact CB-CG2 3.88Å; N254-V257 WeakPolarHBondContact O-CB 3.07Å; N254-V257 PolarHBondContact O-N 3.47Å; P255-V257 PolarHBondContact O-N 3.38Å; P255-V257 VanDerWaalsContact O-N 3.16Å
258	L	95	Very high	95.4	Very high	12 Å²	12	57.3 Å²	57.3	6%	0.063	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-34.5	176.7	-57	173.7	0	0	0	111.5	R218 F221 L247 L251 P255 Q256	R218-L258 HydrophobicContact CG-CD2 4.13Å; F221-L258 HydrophobicContact CB-CB 4.1Å; F221-L258 WeakPolarHBondContact CB-O 3.17Å; F221-L258 HydrophobicContact CD1-CB 4.1Å; F221-L258 HydrophobicContact CD2-CB 4.06Å; F221-L258 HydrophobicContact CD2-CD1 4.2Å; F221-L258 HydrophobicContact CE2-CD1 4.04Å; F221-L258 HydrophobicContact CG-CB 3.8Å; F221-L258 HydrophobicContact CZ-CD1 4.38Å; L247-L258 HydrophobicContact CD1-CD1 3.95Å; L247-L258 HydrophobicContact CD1-CD2 3.64Å; L247-L258 HydrophobicContact CD1-CG 4.47Å; L251-L258 HydrophobicContact CD2-CD1 3.55Å; L251-L258 HydrophobicContact CG-CD1 3.74Å; P255-L258 PolarHBondContact O-N 3.13Å; Q256-L258 VanDerWaalsContact C-N 3.32Å
259	S	95.6	Very high	95.4	Very high	12 Å²	12	55.6 Å²	55.6	8%	0.084	29%	0.291	C	S	.	.			trans	-164	138.4	167.8	171.6	0	0	0	0	111	M222 P255 Q256 Q261 F262	M222-S259 VanDerWaalsContact CG-OG 3.23Å; M222-S259 WeakPolarHBondContact CG-OG 3.23Å; M222-S259 VanDerWaalsContact SD-CB 3.56Å; M222-S259 PolarHBondContact SD-OG 3.3Å; P255-S259 PolarHBondContact O-N 3.22Å; Q256-S259 WeakPolarHBondContact CA-O 3.49Å; Q256-S259 CarbonylContact O-C 3.41Å; Q256-S259 PolarHBondContact OE1-O 3.32Å; S259-Q261 PolarHBondContact O-N 3.01Å; S259-Q261 PolarHBondContact OG-N 3.23Å; S259-Q261 VanDerWaalsContact OG-N 3.11Å; S259-F262 PolarHBondContact O-N 2.88Å
260	P	94.4	Very high	95.3	Very high	110 Å²	110	52.8 Å²	52.8	71%	0.714	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	2	172.4	31.2	-37.2	0	0	0	114	Q256	Q256-P260 VanDerWaalsContact OE1-CA 3.27Å; Q256-P260 PolarHBondContact OE1-O 3.17Å
261	Q	93.9	Very high	95.3	Very high	132 Å²	132	53.8 Å²	53.8	62%	0.617	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-3.3	175.6	-59.5	178.2	0.7	0	0	112.9	M222 S259	M222-Q261 HydrophobicContact CE-CB 4Å; M222-Q261 HydrophobicContact SD-CB 3.96Å; S259-Q261 PolarHBondContact O-N 3.01Å; S259-Q261 PolarHBondContact OG-N 3.23Å; S259-Q261 VanDerWaalsContact OG-N 3.11Å
262	F	96.3	Very high	95.2	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.329	C	S	.	.			trans	-94	113.7	-178.4	178.9	-129.1	0	0	0	110.8	F221 L225 L251 P255 Q256 S259 G264 Q267 L268	F221-F262 HydrophobicContact CD1-CB 4.19Å; F221-F262 HydrophobicContact CD1-CD1 4.28Å; F221-F262 HydrophobicContact CD1-CG 4.12Å; F221-F262 HydrophobicContact CE1-CB 3.98Å; F221-F262 AromaticContact CE1-CD1 3.51Å; F221-F262 HydrophobicContact CE1-CD1 3.51Å; F221-F262 AromaticContact CE1-CD2 3.62Å; F221-F262 HydrophobicContact CE1-CD2 3.62Å; F221-F262 AromaticContact CE1-CE1 3.82Å; F221-F262 HydrophobicContact CE1-CE1 3.82Å; F221-F262 AromaticContact CE1-CE2 3.89Å; F221-F262 HydrophobicContact CE1-CE2 3.89Å; F221-F262 AromaticContact CE1-CG 3.42Å; F221-F262 HydrophobicContact CE1-CG 3.42Å; F221-F262 VanDerWaalsContact CE1-CG 3.42Å; F221-F262 AromaticContact CE1-CZ 3.99Å; F221-F262 HydrophobicContact CE1-CZ 3.99Å; F221-F262 AromaticContact CZ-CD1 4Å; F221-F262 HydrophobicContact CZ-CD1 4Å; F221-F262 HydrophobicContact CZ-CD2 4.35Å; F221-F262 AromaticContact CZ-CE1 3.84Å; F221-F262 HydrophobicContact CZ-CE1 3.84Å; F221-F262 HydrophobicContact CZ-CE2 4.18Å; F221-F262 HydrophobicContact CZ-CG 4.28Å; F221-F262 AromaticContact CZ-CZ 3.92Å; F221-F262 HydrophobicContact CZ-CZ 3.92Å; L225-F262 HydrophobicContact CD1-CD2 3.69Å; L225-F262 HydrophobicContact CD1-CE2 4.22Å; L251-F262 HydrophobicContact CD2-CE1 3.74Å; L251-F262 HydrophobicContact CD2-CZ 4.05Å; P255-F262 HydrophobicContact CB-CD1 3.34Å; P255-F262 HydrophobicContact CB-CE1 3.57Å; P255-F262 HydrophobicContact CB-CG 4.27Å; Q256-F262 PolarHBondContact NE2-O 3.23Å; S259-F262 PolarHBondContact O-N 2.88Å; F262-G264 WeakPolarHBondContact CE2-O 3.13Å; F262-G264 WeakPolarHBondContact CZ-O 3.49Å; F262-Q267 HydrophobicContact CD2-CB 4.43Å; F262-Q267 VanDerWaalsContact CD2-OE1 3.3Å; F262-Q267 HydrophobicContact CE2-CB 4.22Å; F262-L268 HydrophobicContact CE2-CD1 4.17Å; F262-L268 HydrophobicContact CE2-CG 4.13Å; F262-L268 HydrophobicContact CZ-CD1 4.12Å
263	T	93.8	Very high	95.3	Very high	109 Å²	109	59.8 Å²	59.8	67%	0.669	32%	0.319	S	S	*	.			trans	-84	-11.2	-175.6	59.9	0	0	0	0	113.7	Q267	T263-Q267 PolarHBondContact OG1-OE1 2.84Å
264	G	93.7	Very high	95.3	Very high	11 Å²	11	55.9 Å²	55.9	11%	0.113	31%	0.307	C	S	.	.			trans	127.9	176.6	177.8	0	0	0	0	0	113.3	F262 L266 Q267	F262-G264 WeakPolarHBondContact CE2-O 3.13Å; F262-G264 WeakPolarHBondContact CZ-O 3.49Å; G264-L266 PolarHBondContact O-N 3.01Å; G264-Q267 VanDerWaalsContact O-CB 3.31Å; G264-Q267 WeakPolarHBondContact O-CB 3.48Å; G264-Q267 PolarHBondContact O-N 3.4Å
265	I	96.1	Very high	95.4	Very high	15 Å²	15	58.1 Å²	58.1	8%	0.077	31%	0.309	C	S	.	.	H	α-helix	trans	-54.3	-29.8	-167.1	-160.6	65.4	0	0	0	115	V232 W248 L252 Q267 L268 L269 F422 L425	V232-I265 HydrophobicContact CG1-CD1 4.04Å; V232-I265 HydrophobicContact CG1-CG1 4.37Å; V232-I265 HydrophobicContact CG2-CD1 3.8Å; V232-I265 HydrophobicContact CG2-CG1 4.45Å; W248-I265 HydrophobicContact CZ3-CD1 4.22Å; L252-I265 HydrophobicContact CD2-CB 4.25Å; L252-I265 HydrophobicContact CD2-CG2 4.08Å; I265-Q267 PolarHBondContact O-N 2.9Å; I265-L268 HydrophobicContact CD1-CD1 4.27Å; I265-L268 PolarHBondContact O-N 3.32Å; I265-L268 VanDerWaalsContact O-N 3.09Å; I265-L269 HydrophobicContact CG1-CD1 4.02Å; I265-L269 HydrophobicContact CG1-CG 4.43Å; I265-L269 HydrophobicContact CG2-CD1 4.29Å; I265-L269 WeakPolarHBondContact O-CG 3.15Å; I265-L269 PolarHBondContact O-N 3.35Å; I265-L269 VanDerWaalsContact O-N 3.09Å; I265-F422 HydrophobicContact CG2-CE1 4.26Å; I265-L425 HydrophobicContact CG2-CD1 4.3Å
266	L	96.4	Very high	95.4	Very high	64 Å²	64	63.6 Å²	63.6	34%	0.335	33%	0.33	S	S	.	.	H	α-helix	trans	-59.2	-32.1	175.9	-176.4	64.5	0	0	0	112.9	G264 L268 L269 T270 F378 L425	G264-L266 PolarHBondContact O-N 3.01Å; L266-L268 VanDerWaalsContact C-N 3.3Å; L266-L268 PolarHBondContact O-N 3.06Å; L266-L269 PolarHBondContact O-N 3.48Å; L266-T270 HydrophobicContact CD1-CG2 3.77Å; L266-T270 HydrophobicContact CG-CG2 4.24Å; L266-T270 WeakPolarHBondContact O-CB 3.28Å; L266-T270 WeakPolarHBondContact O-CG2 3.32Å; L266-T270 PolarHBondContact O-N 3.05Å; L266-T270 PolarHBondContact O-OG1 2.68Å; L266-F378 HydrophobicContact CD1-CD1 3.94Å; L266-F378 HydrophobicContact CD1-CE1 3.66Å; L266-L425 HydrophobicContact CB-CD1 4.26Å; L266-L425 HydrophobicContact CD1-CD1 4.07Å; L266-L425 HydrophobicContact CD1-CD2 4.32Å; L266-L425 HydrophobicContact CD2-CD2 4.46Å
267	Q	95.8	Very high	95.5	Very high	54 Å²	54	58.8 Å²	58.8	25%	0.252	31%	0.308	S	S	.	.	H	α-helix	trans	-65.7	-32.2	176.9	-173.6	179.9	3	0	0	112.3	F262 T263 G264 I265 A271	F262-Q267 HydrophobicContact CD2-CB 4.43Å; F262-Q267 VanDerWaalsContact CD2-OE1 3.3Å; F262-Q267 HydrophobicContact CE2-CB 4.22Å; T263-Q267 PolarHBondContact OG1-OE1 2.84Å; G264-Q267 VanDerWaalsContact O-CB 3.31Å; G264-Q267 WeakPolarHBondContact O-CB 3.48Å; G264-Q267 PolarHBondContact O-N 3.4Å; I265-Q267 PolarHBondContact O-N 2.9Å; Q267-A271 WeakPolarHBondContact O-CB 3.41Å
268	L	96.3	Very high	95.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-78.1	-46.7	173.1	-77.8	168.4	0	0	0	111.3	F221 L225 G228 R229 L231 V232 F262 I265 L266 T270 A271	F221-L268 HydrophobicContact CZ-CD1 4.11Å; L225-L268 HydrophobicContact CB-CD2 4.44Å; L225-L268 HydrophobicContact CG-CD2 3.94Å; G228-L268 CarbonylContact C-O 3.58Å; R229-L268 VanDerWaalsContact CA-O 3.28Å; R229-L268 WeakPolarHBondContact CA-O 3.46Å; R229-L268 PolarHBondContact N-O 3.2Å; L231-L268 HydrophobicContact CD2-CD1 4.21Å; L231-L268 HydrophobicContact CD2-CD2 4.05Å; V232-L268 HydrophobicContact CG2-CB 3.72Å; V232-L268 HydrophobicContact CG2-CD1 4.2Å; F262-L268 HydrophobicContact CE2-CD1 4.17Å; F262-L268 HydrophobicContact CE2-CG 4.13Å; F262-L268 HydrophobicContact CZ-CD1 4.12Å; I265-L268 HydrophobicContact CD1-CD1 4.27Å; I265-L268 PolarHBondContact O-N 3.32Å; I265-L268 VanDerWaalsContact O-N 3.09Å; L266-L268 VanDerWaalsContact C-N 3.3Å; L266-L268 PolarHBondContact O-N 3.06Å; L268-T270 VanDerWaalsContact C-N 3.32Å; L268-T270 PolarHBondContact O-N 2.7Å; L268-A271 PolarHBondContact O-N 3.04Å
269	L	97.5	Very high	95.7	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.016	28%	0.284	C	S	.	.	H	α-helix	trans	-62.3	-36.5	-176	-70.3	165.5	0	0	0	113.2	R229 V232 I265 L266 F378 F421 L425	R229-L269 WeakPolarHBondContact CB-O 3.49Å; R229-L269 PolarHBondContact NE-O 2.91Å; V232-L269 HydrophobicContact CB-CD2 4.1Å; V232-L269 HydrophobicContact CG1-CD2 4.06Å; V232-L269 HydrophobicContact CG2-CD2 4.02Å; V232-L269 HydrophobicContact CG2-CG 4.24Å; I265-L269 HydrophobicContact CG1-CD1 4.02Å; I265-L269 HydrophobicContact CG1-CG 4.43Å; I265-L269 HydrophobicContact CG2-CD1 4.29Å; I265-L269 WeakPolarHBondContact O-CG 3.15Å; I265-L269 PolarHBondContact O-N 3.35Å; I265-L269 VanDerWaalsContact O-N 3.09Å; L266-L269 PolarHBondContact O-N 3.48Å; L269-F378 HydrophobicContact CB-CD1 4.29Å; L269-F378 HydrophobicContact CB-CD2 3.75Å; L269-F378 HydrophobicContact CB-CE1 4.38Å; L269-F378 HydrophobicContact CB-CE2 3.88Å; L269-F378 HydrophobicContact CB-CG 3.98Å; L269-F378 HydrophobicContact CB-CZ 4.2Å; L269-F378 HydrophobicContact CD1-CD2 4.49Å; L269-F378 HydrophobicContact CD1-CE1 4.48Å; L269-F378 HydrophobicContact CD1-CE2 3.76Å; L269-F378 HydrophobicContact CD1-CZ 3.75Å; L269-F378 HydrophobicContact CD2-CD2 4.21Å; L269-F378 HydrophobicContact CD2-CE2 4Å; L269-F378 HydrophobicContact CG-CD2 4.36Å; L269-F378 HydrophobicContact CG-CE2 4.09Å; L269-F378 HydrophobicContact CG-CZ 4.45Å; L269-F421 HydrophobicContact CD1-CE1 4.15Å; L269-F421 HydrophobicContact CD2-CE1 3.82Å; L269-F421 HydrophobicContact CD2-CZ 3.82Å; L269-L425 HydrophobicContact CD1-CD1 4.15Å
270	T	95.8	Very high	95.6	Very high	69 Å²	69	54.2 Å²	54.2	42%	0.423	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-7.6	175.9	56.2	0	0	0	0	114.2	L266 L268 F378	L266-T270 HydrophobicContact CD1-CG2 3.77Å; L266-T270 HydrophobicContact CG-CG2 4.24Å; L266-T270 WeakPolarHBondContact O-CB 3.28Å; L266-T270 WeakPolarHBondContact O-CG2 3.32Å; L266-T270 PolarHBondContact O-N 3.05Å; L266-T270 PolarHBondContact O-OG1 2.68Å; L268-T270 VanDerWaalsContact C-N 3.32Å; L268-T270 PolarHBondContact O-N 2.7Å; T270-F378 HydrophobicContact CG2-CB 4.45Å; T270-F378 HydrophobicContact CG2-CD1 4.2Å
271	A	95.2	Very high	95.8	Very high	34 Å²	34	49.1 Å²	49.1	28%	0.281	25%	0.248	S	C	.	.	S	Bend	trans	-92.2	112.3	175	0	0	0	0	0	110.4	G228 R229 Q267 L268	G228-A271 CarbonylContact C-O 3.58Å; G228-A271 VanDerWaalsContact CA-O 3.29Å; G228-A271 WeakPolarHBondContact CA-O 3.37Å; R229-A271 PolarHBondContact N-O 2.86Å; Q267-A271 WeakPolarHBondContact O-CB 3.41Å; L268-A271 PolarHBondContact O-N 3.04Å
272	R	93.6	Very high	96	Very high	171 Å²	171	42.8 Å²	42.8	65%	0.645	22%	0.219	S	C	*	.	P	Polyproline II helix	trans	-60	137.7	177	74.3	-174	-173.7	-173.2	2.5	111.6	K383	R272-K383 WeakPolarHBondContact CD-O 3.38Å; R272-K383 PolarHBondContact NH1-O 2.71Å
273	T	97.2	Very high	96	Very high	17 Å²	17	43.3 Å²	43.3	10%	0.104	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-75.5	135.9	177.8	-70.2	0	0	0	0	111.7	I227 R229 D230 F277 L278	I227-T273 VanDerWaalsContact O-CA 3.28Å; I227-T273 WeakPolarHBondContact O-CA 3.3Å; I227-T273 VanDerWaalsContact O-CB 3.25Å; I227-T273 WeakPolarHBondContact O-CB 3.42Å; I227-T273 WeakPolarHBondContact O-CG2 3.38Å; I227-T273 PolarHBondContact O-OG1 2.83Å; R229-T273 PolarHBondContact N-OG1 3.15Å; D230-T273 HydrophobicContact CB-CG2 3.94Å; D230-T273 WeakPolarHBondContact CB-OG1 3.48Å; D230-T273 PolarHBondContact N-OG1 3.25Å; D230-T273 PolarHBondContact OD2-OG1 2.89Å; T273-F277 HydrophobicContact CG2-CB 4.08Å; T273-F277 HydrophobicContact CG2-CD2 4.26Å; T273-L278 HydrophobicContact CG2-CD2 3.69Å; T273-L278 HydrophobicContact CG2-CG 4.05Å
274	S	95.8	Very high	96.2	Very high	53 Å²	53	38.7 Å²	38.7	37%	0.371	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-68.2	135.6	176	-178.9	0	0	0	0	111.7	K276 F277	S274-K276 PolarHBondContact O-N 3.29Å; S274-F277 PolarHBondContact O-N 3.28Å
275	R	96.3	Very high	96.3	Very high	129 Å²	129	40 Å²	40	49%	0.487	20%	0.198	S	C	.	.	H	α-helix	trans	-48.2	-29.5	174.4	-70.4	-172	-178.6	155.9	3.7	113.4	F277 L278 A279 G332 V333 H335	R275-F277 VanDerWaalsContact C-N 3.3Å; R275-F277 PolarHBondContact O-N 2.88Å; R275-L278 PolarHBondContact O-N 2.52Å; R275-A279 VanDerWaalsContact O-CB 3.27Å; R275-A279 WeakPolarHBondContact O-CB 3.39Å; R275-A279 PolarHBondContact O-N 2.63Å; R275-G332 VanDerWaalsContact CG-O 3.31Å; R275-G332 WeakPolarHBondContact CG-O 3.45Å; R275-G332 PolarHBondContact NE-O 3.31Å; R275-G332 VanDerWaalsContact NE-O 3.15Å; R275-V333 HydrophobicContact CB-CG2 4.16Å; R275-V333 HydrophobicContact CG-CG2 4.23Å; R275-H335 PolarHBondContact NH2-ND1 3.37Å
276	K	94.8	Very high	96.4	Very high	137 Å²	137	39.7 Å²	39.7	60%	0.596	20%	0.196	S	C	*	.	H	α-helix	trans	-56.7	-38.8	176.7	-68	-171.6	176.2	-174.4	0	113.3	S274 C280	S274-K276 PolarHBondContact O-N 3.29Å; K276-C280 WeakPolarHBondContact O-CB 3.43Å; K276-C280 PolarHBondContact O-N 3.15Å
277	F	97.4	Very high	96.5	Very high	3 Å²	3	38.3 Å²	38.3	1%	0.013	19%	0.188	C	C	.	.	H	α-helix	trans	-75.8	-44.4	178.9	-60.1	-65.4	0	0	0	111.1	M181 A184 M185 Y188 I226 I227 T273 S274 R275 A279 C280	M181-F277 HydrophobicContact SD-CE1 4.39Å; M181-F277 HydrophobicContact SD-CZ 4.14Å; A184-F277 HydrophobicContact CB-CE1 3.77Å; A184-F277 HydrophobicContact CB-CZ 3.84Å; M185-F277 HydrophobicContact CG-CD1 4.39Å; M185-F277 HydrophobicContact CG-CE1 3.96Å; M185-F277 HydrophobicContact SD-CD1 3.72Å; M185-F277 HydrophobicContact SD-CE1 3.85Å; Y188-F277 HydrophobicContact CD1-CB 3.89Å; Y188-F277 HydrophobicContact CD2-CB 4.13Å; Y188-F277 HydrophobicContact CD2-CG 4.5Å; Y188-F277 HydrophobicContact CE1-CB 3.83Å; Y188-F277 WeakPolarHBondContact CE1-O 3.35Å; Y188-F277 HydrophobicContact CE2-CB 4.07Å; Y188-F277 HydrophobicContact CG-CB 4.04Å; Y188-F277 HydrophobicContact CG-CD1 4.16Å; Y188-F277 HydrophobicContact CG-CG 4.42Å; I226-F277 HydrophobicContact CD1-CZ 4.41Å; I226-F277 HydrophobicContact CG1-CE2 4.41Å; I226-F277 HydrophobicContact CG1-CZ 4.01Å; I227-F277 HydrophobicContact CB-CE2 4.41Å; I227-F277 HydrophobicContact CG1-CD1 4.24Å; I227-F277 HydrophobicContact CG1-CD2 4.43Å; I227-F277 HydrophobicContact CG1-CE1 3.94Å; I227-F277 HydrophobicContact CG1-CE2 4.14Å; I227-F277 HydrophobicContact CG1-CG 4.49Å; I227-F277 HydrophobicContact CG1-CZ 3.89Å; T273-F277 HydrophobicContact CG2-CB 4.08Å; T273-F277 HydrophobicContact CG2-CD2 4.26Å; S274-F277 PolarHBondContact O-N 3.28Å; R275-F277 VanDerWaalsContact C-N 3.3Å; R275-F277 PolarHBondContact O-N 2.88Å; F277-A279 VanDerWaalsContact C-N 3.33Å; F277-A279 PolarHBondContact O-N 2.81Å; F277-C280 PolarHBondContact O-N 3.02Å; F277-C280 VanDerWaalsContact O-N 3.14Å; F277-C280 PolarHBondContact O-SG 2.98Å
278	L	97.2	Very high	96.5	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-59.7	-44.5	177.4	-51.8	-174.8	0	0	0	111.3	D230 T273 R275 C280 R328 V333	D230-L278 HydrophobicContact CB-CD2 4.49Å; T273-L278 HydrophobicContact CG2-CD2 3.69Å; T273-L278 HydrophobicContact CG2-CG 4.05Å; R275-L278 PolarHBondContact O-N 2.52Å; L278-C280 VanDerWaalsContact C-N 3.34Å; L278-C280 PolarHBondContact O-N 2.67Å; L278-R328 HydrophobicContact CD2-CB 4.18Å; L278-V333 HydrophobicContact CB-CG2 3.56Å; L278-V333 HydrophobicContact CD1-CG2 4.13Å; L278-V333 HydrophobicContact CG-CG2 4.44Å
279	A	96.2	Very high	96.6	Very high	18 Å²	18	43.4 Å²	43.4	15%	0.149	22%	0.218	C	C	.	.	H	α-helix	trans	-72.9	-18.2	177.6	0	0	0	0	0	114.3	K147 R275 F277 R281 Y329	K147-A279 PolarHBondContact NZ-O 3.19Å; R275-A279 VanDerWaalsContact O-CB 3.27Å; R275-A279 WeakPolarHBondContact O-CB 3.39Å; R275-A279 PolarHBondContact O-N 2.63Å; F277-A279 VanDerWaalsContact C-N 3.33Å; F277-A279 PolarHBondContact O-N 2.81Å; A279-R281 VanDerWaalsContact C-N 3.33Å; A279-R281 PolarHBondContact O-N 3.37Å; A279-Y329 HydrophobicContact CB-CD2 4.28Å; A279-Y329 HydrophobicContact CB-CE2 3.87Å
280	C	94.9	Very high	96.6	Very high	4 Å²	4	43.3 Å²	43.3	3%	0.027	22%	0.217	C	C	.	.	H	α-helix	trans	-79.9	-13	-178.6	86.6	0	0	0	0	114	M185 K276 F277 L278	M185-C280 HydrophobicContact CE-CB 3.46Å; M185-C280 VanDerWaalsContact CE-CB 3.46Å; M185-C280 HydrophobicContact SD-CB 4.02Å; K276-C280 WeakPolarHBondContact O-CB 3.43Å; K276-C280 PolarHBondContact O-N 3.15Å; F277-C280 PolarHBondContact O-N 3.02Å; F277-C280 VanDerWaalsContact O-N 3.14Å; F277-C280 PolarHBondContact O-SG 2.98Å; L278-C280 VanDerWaalsContact C-N 3.34Å; L278-C280 PolarHBondContact O-N 2.67Å
281	R	97	Very high	96.6	Very high	3 Å²	3	43.4 Å²	43.4	1%	0.011	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-7.7	178.9	-61.8	-65.9	77.9	-127.4	-6.9	114.7	L146 I149 Y188 T189 R192 A279 D325	L146-R281 PolarHBondContact O-NH2 3.36Å; I149-R281 PolarHBondContact O-NH1 3.42Å; Y188-R281 HydrophobicContact CD1-CG 3.81Å; Y188-R281 HydrophobicContact CE1-CG 3.58Å; T189-R281 PolarHBondContact OG1-NH2 3.46Å; R192-R281 HydrophobicContact CG-CG 4.45Å; A279-R281 VanDerWaalsContact C-N 3.33Å; A279-R281 PolarHBondContact O-N 3.37Å; R281-D325 HydrophobicContact CB-CB 4.26Å
282	L	97.9	Very high	96.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.221	C	C	.	.	S	Bend	trans	-94.7	136.3	166.6	-79.3	69.9	0	0	0	109.2	K147 M286 E287 L290 D325 L326 Y329	K147-L282 WeakPolarHBondContact CG-O 3.36Å; K147-L282 PolarHBondContact NZ-O 3.45Å; L282-M286 HydrophobicContact CB-CB 4.31Å; L282-E287 HydrophobicContact CB-CB 4.49Å; L282-L290 HydrophobicContact CD2-CD1 3.86Å; L282-D325 HydrophobicContact CD1-CB 4.3Å; L282-L326 HydrophobicContact CD1-CD2 4.35Å; L282-L326 HydrophobicContact CD2-CD2 3.85Å; L282-L326 HydrophobicContact CG-CD2 3.87Å; L282-Y329 HydrophobicContact CD1-CD2 3.95Å; L282-Y329 HydrophobicContact CD1-CG 3.96Å; L282-Y329 HydrophobicContact CD2-CD1 3.64Å; L282-Y329 HydrophobicContact CD2-CD2 3.74Å; L282-Y329 HydrophobicContact CD2-CE1 4.09Å; L282-Y329 HydrophobicContact CD2-CE2 4.16Å; L282-Y329 HydrophobicContact CD2-CG 3.47Å; L282-Y329 VanDerWaalsContact CD2-CG 3.47Å; L282-Y329 HydrophobicContact CG-CD2 4.35Å; L282-Y329 HydrophobicContact CG-CG 4.35Å
283	T	97.8	Very high	96.8	Very high	10 Å²	10	38.3 Å²	38.3	6%	0.061	19%	0.191	C	C	.	.			trans	-69.1	160.3	170.2	69.2	0	0	0	0	110.7	K147 A150 D285 M286 E287	K147-T283 WeakPolarHBondContact O-CA 3.45Å; A150-T283 HydrophobicContact CB-CG2 3.86Å; T283-D285 PolarHBondContact O-N 3.32Å; T283-M286 HydrophobicContact CG2-CE 4.3Å; T283-M286 HydrophobicContact CG2-SD 4.08Å; T283-M286 PolarHBondContact O-N 3.48Å; T283-M286 VanDerWaalsContact OG1-CG 3.32Å; T283-M286 WeakPolarHBondContact OG1-CG 3.45Å; T283-M286 PolarHBondContact OG1-N 3.32Å; T283-E287 WeakPolarHBondContact O-CB 3.31Å; T283-E287 PolarHBondContact O-N 2.93Å
284	P	96.9	Very high	96.7	Very high	12 Å²	12	37.9 Å²	37.9	8%	0.078	19%	0.188	C	C	.	.	H	α-helix	trans	-57.7	-33	179.2	-24.2	34.4	0	0	0	113.5	M109 T288	M109-P284 HydrophobicContact CE-CB 4.02Å; M109-P284 HydrophobicContact CE-CG 3.89Å; M109-P284 VanDerWaalsContact O-CB 3.3Å; M109-P284 WeakPolarHBondContact O-CB 3.49Å; M109-P284 HydrophobicContact SD-CB 4.44Å; M109-P284 HydrophobicContact SD-CG 3.71Å; P284-T288 VanDerWaalsContact O-CB 3.3Å; P284-T288 WeakPolarHBondContact O-CB 3.47Å; P284-T288 PolarHBondContact O-N 3.41Å; P284-T288 PolarHBondContact O-OG1 3.49Å
285	D	96.5	Very high	96.4	Very high	40 Å²	40	37.3 Å²	37.3	21%	0.214	19%	0.185	C	C	.	.	H	α-helix	trans	-70.2	-43.5	178.3	-171.7	32.4	0	0	0	111.5	L113 T283 K289 Q312 Y313	L113-D285 HydrophobicContact CD1-CB 3.79Å; T283-D285 PolarHBondContact O-N 3.32Å; D285-K289 WeakPolarHBondContact O-CB 3.1Å; D285-K289 WeakPolarHBondContact O-CD 3.29Å; D285-K289 WeakPolarHBondContact O-CG 3.33Å; D285-K289 PolarHBondContact O-N 2.88Å; D285-K289 WeakPolarHBondContact OD1-CE 3.32Å; D285-K289 IonicContact OD1-NZ 3.05Å; D285-K289 PolarHBondContact OD1-NZ 2.91Å; D285-K289 IonicContact OD2-NZ 2.67Å; D285-K289 PolarHBondContact OD2-NZ 3.45Å; D285-Q312 PolarHBondContact OD2-NE2 3.15Å; D285-Y313 PolarHBondContact OD2-OH 3.5Å
286	M	98.2	Very high	96.2	Very high	7 Å²	7	39.5 Å²	39.5	3%	0.034	19%	0.193	C	C	.	.	H	α-helix	trans	-62.4	-45.8	173.7	-67.4	165.7	179.2	0	0	111.8	A150 L282 T283 K289 L290 F309 Y313 L322	A150-M286 HydrophobicContact CB-CE 4.22Å; L282-M286 HydrophobicContact CB-CB 4.31Å; T283-M286 HydrophobicContact CG2-CE 4.3Å; T283-M286 HydrophobicContact CG2-SD 4.08Å; T283-M286 PolarHBondContact O-N 3.48Å; T283-M286 VanDerWaalsContact OG1-CG 3.32Å; T283-M286 WeakPolarHBondContact OG1-CG 3.45Å; T283-M286 PolarHBondContact OG1-N 3.32Å; M286-K289 PolarHBondContact O-N 2.76Å; M286-L290 PolarHBondContact O-N 3.07Å; M286-F309 HydrophobicContact CB-CZ 4.4Å; M286-F309 HydrophobicContact CG-CZ 4.44Å; M286-Y313 HydrophobicContact CE-CD1 3.48Å; M286-Y313 VanDerWaalsContact CE-CD1 3.48Å; M286-Y313 HydrophobicContact CE-CE1 3.92Å; M286-Y313 HydrophobicContact CE-CG 4.05Å; M286-Y313 HydrophobicContact CG-CD1 3.99Å; M286-Y313 HydrophobicContact CG-CD2 4.3Å; M286-Y313 HydrophobicContact CG-CE1 3.7Å; M286-Y313 HydrophobicContact CG-CE2 4.03Å; M286-Y313 HydrophobicContact CG-CG 4.25Å; M286-L322 HydrophobicContact CE-CD1 4.37Å; M286-L322 HydrophobicContact CE-CD2 3.59Å; M286-L322 HydrophobicContact SD-CD1 4.21Å; M286-L322 HydrophobicContact SD-CD2 4.19Å
287	E	97.4	Very high	96.1	Very high	35 Å²	35	33.1 Å²	33.1	16%	0.164	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-47.7	178.3	171.9	154.7	-127.3	0	0	111.6	K147 L282 T283 K289 L290 L291 Y329	K147-E287 VanDerWaalsContact CE-OE2 3.29Å; K147-E287 WeakPolarHBondContact CE-OE2 3.39Å; K147-E287 IonicContact NZ-OE2 2.59Å; K147-E287 PolarHBondContact NZ-OE2 3.41Å; L282-E287 HydrophobicContact CB-CB 4.49Å; T283-E287 WeakPolarHBondContact O-CB 3.31Å; T283-E287 PolarHBondContact O-N 2.93Å; E287-K289 VanDerWaalsContact C-N 3.31Å; E287-K289 PolarHBondContact O-N 3.45Å; E287-L290 PolarHBondContact O-N 3.05Å; E287-L291 HydrophobicContact CG-CD1 3.81Å; E287-L291 HydrophobicContact CG-CG 4.47Å; E287-L291 WeakPolarHBondContact O-CB 3.33Å; E287-L291 VanDerWaalsContact O-CG 3.29Å; E287-L291 WeakPolarHBondContact O-CG 3.39Å; E287-L291 PolarHBondContact O-N 3.12Å; E287-Y329 WeakPolarHBondContact CG-OH 3.36Å; E287-Y329 VanDerWaalsContact OE1-CE2 3.3Å; E287-Y329 WeakPolarHBondContact OE1-CE2 3.22Å; E287-Y329 PolarHBondContact OE1-OH 3.48Å
288	T	96.7	Very high	95.8	Very high	94 Å²	94	39.2 Å²	39.2	58%	0.577	19%	0.188	S	C	*	.	H	α-helix	trans	-58.5	-42.3	176.4	-58.3	0	0	0	0	111.8	P284 F292	P284-T288 VanDerWaalsContact O-CB 3.3Å; P284-T288 WeakPolarHBondContact O-CB 3.47Å; P284-T288 PolarHBondContact O-N 3.41Å; P284-T288 PolarHBondContact O-OG1 3.49Å; T288-F292 WeakPolarHBondContact O-CB 3.33Å; T288-F292 PolarHBondContact O-N 3.42Å
289	K	97.9	Very high	95.5	Very high	68 Å²	68	43.6 Å²	43.6	30%	0.296	21%	0.207	S	C	.	.	H	α-helix	trans	-71.1	-43.1	-179.9	-76.3	162.1	178.7	158.9	0	112.9	D285 M286 E287 F292 M293 F309 Y313	D285-K289 WeakPolarHBondContact O-CB 3.1Å; D285-K289 WeakPolarHBondContact O-CD 3.29Å; D285-K289 WeakPolarHBondContact O-CG 3.33Å; D285-K289 PolarHBondContact O-N 2.88Å; D285-K289 WeakPolarHBondContact OD1-CE 3.32Å; D285-K289 IonicContact OD1-NZ 3.05Å; D285-K289 PolarHBondContact OD1-NZ 2.91Å; D285-K289 IonicContact OD2-NZ 2.67Å; D285-K289 PolarHBondContact OD2-NZ 3.45Å; M286-K289 PolarHBondContact O-N 2.76Å; E287-K289 VanDerWaalsContact C-N 3.31Å; E287-K289 PolarHBondContact O-N 3.45Å; K289-F292 PolarHBondContact O-N 3.13Å; K289-M293 WeakPolarHBondContact O-CG 3.39Å; K289-M293 PolarHBondContact O-N 3.12Å; K289-F309 HydrophobicContact CB-CD2 4Å; K289-F309 HydrophobicContact CB-CE2 4.12Å; K289-Y313 HydrophobicContact CD-CE2 4.03Å; K289-Y313 WeakPolarHBondContact CD-OH 3.3Å; K289-Y313 PolarHBondContact NZ-OH 3.01Å; K289-Y313 VanDerWaalsContact NZ-OH 3.08Å
290	L	97.4	Very high	95.1	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-64.7	-44.5	175.1	-79	-170.7	0	0	0	111.9	L282 M286 E287 F292 M293 T294 F309 L326 Y329 I330 I351	L282-L290 HydrophobicContact CD2-CD1 3.86Å; M286-L290 PolarHBondContact O-N 3.07Å; E287-L290 PolarHBondContact O-N 3.05Å; L290-F292 VanDerWaalsContact C-N 3.31Å; L290-F292 PolarHBondContact O-N 3.21Å; L290-M293 WeakPolarHBondContact O-CB 3.4Å; L290-M293 PolarHBondContact O-N 3.43Å; L290-M293 VanDerWaalsContact O-N 3.13Å; L290-T294 PolarHBondContact O-N 3.06Å; L290-T294 PolarHBondContact O-OG1 3.13Å; L290-T294 VanDerWaalsContact O-OG1 3.14Å; L290-F309 HydrophobicContact CD2-CE2 4.08Å; L290-F309 HydrophobicContact CD2-CZ 4.28Å; L290-F309 HydrophobicContact CG-CE2 3.97Å; L290-F309 HydrophobicContact CG-CZ 4.18Å; L290-L326 HydrophobicContact CD1-CD2 3.91Å; L290-Y329 HydrophobicContact CD1-CD1 4.15Å; L290-I330 HydrophobicContact CD1-CD1 4.29Å; L290-I330 HydrophobicContact CD1-CG1 4.21Å; L290-I351 HydrophobicContact CD2-CG2 4.37Å
291	L	96.5	Very high	94.9	Very high	71 Å²	71	51.5 Å²	51.5	37%	0.372	26%	0.255	S	S	.	.	H	α-helix	trans	-62.9	-38	177.7	-70.5	172.8	0	0	0	111.9	E287 T294 S295 V334	E287-L291 HydrophobicContact CG-CD1 3.81Å; E287-L291 HydrophobicContact CG-CG 4.47Å; E287-L291 WeakPolarHBondContact O-CB 3.33Å; E287-L291 VanDerWaalsContact O-CG 3.29Å; E287-L291 WeakPolarHBondContact O-CG 3.39Å; E287-L291 PolarHBondContact O-N 3.12Å; L291-T294 PolarHBondContact O-N 3.47Å; L291-T294 PolarHBondContact O-OG1 3.05Å; L291-S295 WeakPolarHBondContact O-CB 3.37Å; L291-S295 PolarHBondContact O-N 2.86Å; L291-S295 PolarHBondContact O-OG 3.02Å; L291-V334 HydrophobicContact CD2-CG2 4.18Å
292	F	97.1	Very high	94.7	Very high	94 Å²	94	53 Å²	53	41%	0.412	26%	0.262	S	S	.	.	H	α-helix	trans	-62.6	-45.4	171.3	-176.7	-89.7	0	0	0	111.7	T288 K289 L290 T294 S295 R296 V297 Y305	T288-F292 WeakPolarHBondContact O-CB 3.33Å; T288-F292 PolarHBondContact O-N 3.42Å; K289-F292 PolarHBondContact O-N 3.13Å; L290-F292 VanDerWaalsContact C-N 3.31Å; L290-F292 PolarHBondContact O-N 3.21Å; F292-T294 VanDerWaalsContact C-N 3.35Å; F292-T294 PolarHBondContact O-N 3.07Å; F292-S295 PolarHBondContact O-N 2.93Å; F292-R296 HydrophobicContact CD1-CB 4.44Å; F292-R296 HydrophobicContact CD2-CB 3.79Å; F292-R296 HydrophobicContact CD2-CG 3.88Å; F292-R296 HydrophobicContact CE1-CB 4.25Å; F292-R296 HydrophobicContact CE2-CB 3.57Å; F292-R296 HydrophobicContact CE2-CG 3.91Å; F292-R296 HydrophobicContact CG-CB 4.23Å; F292-R296 HydrophobicContact CZ-CB 3.81Å; F292-R296 WeakPolarHBondContact O-CB 3.43Å; F292-R296 PolarHBondContact O-N 3.29Å; F292-V297 HydrophobicContact CD1-CG2 3.71Å; F292-V297 HydrophobicContact CE1-CG2 3.52Å; F292-V297 PolarHBondContact O-N 3.39Å; F292-Y305 HydrophobicContact CD1-CE1 4.35Å; F292-Y305 HydrophobicContact CE1-CD1 4.25Å; F292-Y305 AromaticContact CE1-CE1 3.67Å; F292-Y305 HydrophobicContact CE1-CE1 3.67Å
293	M	96.8	Very high	94.4	Very high	4 Å²	4	57.4 Å²	57.4	2%	0.02	28%	0.281	C	S	.	.	H	α-helix	trans	-58.5	-43.4	175.8	-75.7	175.5	69.6	0	0	112.2	K289 L290 S295 V297 Q306 L346 I351 W354	K289-M293 WeakPolarHBondContact O-CG 3.39Å; K289-M293 PolarHBondContact O-N 3.12Å; L290-M293 WeakPolarHBondContact O-CB 3.4Å; L290-M293 PolarHBondContact O-N 3.43Å; L290-M293 VanDerWaalsContact O-N 3.13Å; M293-S295 VanDerWaalsContact C-N 3.35Å; M293-S295 PolarHBondContact O-N 3.43Å; M293-V297 HydrophobicContact CG-CG2 4.32Å; M293-Q306 HydrophobicContact CE-CG 3.78Å; M293-L346 HydrophobicContact CB-CD2 4.1Å; M293-L346 HydrophobicContact CE-CD2 4.01Å; M293-I351 HydrophobicContact CB-CD1 4.1Å; M293-I351 HydrophobicContact CE-CD1 4.39Å; M293-W354 HydrophobicContact CE-CZ3 4.25Å
294	T	93.9	Very high	94.2	Very high	7 Å²	7	64.6 Å²	64.6	4%	0.043	31%	0.308	C	S	.	.	H	α-helix	trans	-87.8	12.9	-179.2	60.3	0	0	0	0	115.1	L290 L291 F292 V334 I351	L290-T294 PolarHBondContact O-N 3.06Å; L290-T294 PolarHBondContact O-OG1 3.13Å; L290-T294 VanDerWaalsContact O-OG1 3.14Å; L291-T294 PolarHBondContact O-N 3.47Å; L291-T294 PolarHBondContact O-OG1 3.05Å; F292-T294 VanDerWaalsContact C-N 3.35Å; F292-T294 PolarHBondContact O-N 3.07Å; T294-V334 HydrophobicContact CG2-CG1 4.14Å; T294-V334 WeakPolarHBondContact OG1-CG1 3.26Å; T294-I351 HydrophobicContact CG2-CD1 3.38Å
295	S	90.2	Very high	94.2	Very high	42 Å²	42	67.9 Å²	67.9	29%	0.294	32%	0.319	S	S	.	.	H	α-helix	trans	-146.8	-11.2	178.3	66.3	0	0	0	0	115.9	L291 F292 M293	L291-S295 WeakPolarHBondContact O-CB 3.37Å; L291-S295 PolarHBondContact O-N 2.86Å; L291-S295 PolarHBondContact O-OG 3.02Å; F292-S295 PolarHBondContact O-N 2.93Å; M293-S295 VanDerWaalsContact C-N 3.35Å; M293-S295 PolarHBondContact O-N 3.43Å
296	R	91.3	Very high	94.2	Very high	175 Å²	175	66.6 Å²	66.6	66%	0.66	31%	0.312	S	S	*	.	H	α-helix	trans	-137.8	-15.6	-175.6	-57.8	-64	172.5	-161.3	0.6	114.8	F292	F292-R296 HydrophobicContact CD1-CB 4.44Å; F292-R296 HydrophobicContact CD2-CB 3.79Å; F292-R296 HydrophobicContact CD2-CG 3.88Å; F292-R296 HydrophobicContact CE1-CB 4.25Å; F292-R296 HydrophobicContact CE2-CB 3.57Å; F292-R296 HydrophobicContact CE2-CG 3.91Å; F292-R296 HydrophobicContact CG-CB 4.23Å; F292-R296 HydrophobicContact CZ-CB 3.81Å; F292-R296 WeakPolarHBondContact O-CB 3.43Å; F292-R296 PolarHBondContact O-N 3.29Å
297	V	92.1	Very high	94	Very high	3 Å²	3	68.4 Å²	68.4	2%	0.018	32%	0.322	C	S	.	.	S	Bend	trans	-93	123	176.8	177.4	0	0	0	0	108.7	F292 M293 Q302 Y305 L346	F292-V297 HydrophobicContact CD1-CG2 3.71Å; F292-V297 HydrophobicContact CE1-CG2 3.52Å; F292-V297 PolarHBondContact O-N 3.39Å; M293-V297 HydrophobicContact CG-CG2 4.32Å; V297-Q302 HydrophobicContact CG1-CB 4.23Å; V297-Y305 HydrophobicContact CB-CD2 4.47Å; V297-Y305 HydrophobicContact CG1-CD2 3.7Å; V297-Y305 HydrophobicContact CG1-CE2 3.89Å; V297-Y305 HydrophobicContact CG1-CG 4.44Å; V297-Y305 HydrophobicContact CG2-CD1 4.03Å; V297-Y305 HydrophobicContact CG2-CD2 3.82Å; V297-Y305 HydrophobicContact CG2-CE1 4.05Å; V297-Y305 HydrophobicContact CG2-CE2 3.84Å; V297-Y305 HydrophobicContact CG2-CG 3.92Å; V297-L346 HydrophobicContact CG1-CD2 4.3Å; V297-L346 VanDerWaalsContact O-CB 3.27Å; V297-L346 WeakPolarHBondContact O-CB 3.4Å; V297-L346 PolarHBondContact O-N 3.45Å
298	R	91.3	Very high	93.9	Very high	131 Å²	131	73.1 Å²	73.1	49%	0.494	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-71.6	147.2	174.5	-67.8	179.6	163.3	-138.3	5.9	111.3	Q301 D344 I345	R298-Q301 HydrophobicContact CB-CG 4.33Å; R298-Q301 WeakPolarHBondContact O-CB 3.31Å; R298-Q301 PolarHBondContact O-N 3.4Å; R298-Q301 VanDerWaalsContact O-N 3.12Å; R298-D344 CarbonylContact C-O 3.54Å; R298-D344 VanDerWaalsContact CA-O 3.31Å; R298-D344 WeakPolarHBondContact CA-O 3.17Å; R298-D344 WeakPolarHBondContact CD-OD2 3.45Å; R298-D344 WeakPolarHBondContact CG-OD1 3.4Å; R298-D344 WeakPolarHBondContact CG-OD2 3.45Å; R298-D344 IonicContact CZ-OD1 3.58Å; R298-D344 IonicContact CZ-OD2 3.48Å; R298-D344 IonicContact NE-OD1 3.87Å; R298-D344 PolarHBondContact NE-OD1 3.43Å; R298-D344 IonicContact NE-OD2 3.28Å; R298-D344 PolarHBondContact NE-OD2 3.31Å; R298-D344 IonicContact NH1-OD1 2.72Å; R298-D344 IonicContact NH1-OD2 2.89Å; R298-D344 PolarHBondContact NH1-OD2 3.19Å; R298-D344 IonicContact NH2-OD1 3.08Å; R298-I345 HydrophobicContact CG-CD1 4.45Å
299	F	92.4	Very high	94	Very high	96 Å²	96	68.8 Å²	68.8	42%	0.421	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	151.3	173.8	-168.2	-134.6	0	0	0	110.5	Q301 D344 L346 P347 W349 A350	F299-Q301 PolarHBondContact O-N 2.81Å; F299-Q301 VanDerWaalsContact O-N 3.11Å; F299-D344 PolarHBondContact N-O 2.87Å; F299-L346 HydrophobicContact CD2-CD1 3.85Å; F299-L346 HydrophobicContact CE2-CD1 4.41Å; F299-P347 HydrophobicContact CD2-CG 4.5Å; F299-W349 HydrophobicContact CE1-CH2 4.35Å; F299-W349 HydrophobicContact CE1-CZ2 4.37Å; F299-W349 HydrophobicContact CE2-CH2 4.39Å; F299-W349 AromaticContact CZ-CH2 3.69Å; F299-W349 HydrophobicContact CZ-CH2 3.69Å; F299-W349 HydrophobicContact CZ-CZ2 4.05Å; F299-A350 HydrophobicContact CD2-CB 4.32Å; F299-A350 HydrophobicContact CE2-CB 3.7Å; F299-A350 HydrophobicContact CZ-CB 4.48Å
300	G	87.6	Confident	93.9	Very high	54 Å²	54	68.8 Å²	68.8	56%	0.557	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	-34.7	-162.1	0	0	0	0	0	114.1	Q302	G300-Q302 VanDerWaalsContact C-OE1 3.32Å
301	Q	90.5	Very high	93.8	Very high	135 Å²	135	76.4 Å²	76.4	63%	0.631	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	1.7	-175.2	-54.7	-61.5	-20.4	0	0	114.4	R298 F299 K303	R298-Q301 HydrophobicContact CB-CG 4.33Å; R298-Q301 WeakPolarHBondContact O-CB 3.31Å; R298-Q301 PolarHBondContact O-N 3.4Å; R298-Q301 VanDerWaalsContact O-N 3.12Å; F299-Q301 PolarHBondContact O-N 2.81Å; F299-Q301 VanDerWaalsContact O-N 3.11Å; Q301-K303 VanDerWaalsContact C-N 3.33Å; Q301-K303 PolarHBondContact O-N 3.2Å
302	Q	92.5	Very high	93.8	Very high	33 Å²	33	77.7 Å²	77.7	15%	0.154	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-23.2	-173.1	66.5	-82.4	-4	0	0	116	V297 G300 R304 Y305 Q306 L346	V297-Q302 HydrophobicContact CG1-CB 4.23Å; G300-Q302 VanDerWaalsContact C-OE1 3.32Å; Q302-R304 PolarHBondContact O-N 3.38Å; Q302-Y305 WeakPolarHBondContact O-CB 3.35Å; Q302-Y305 PolarHBondContact O-N 2.68Å; Q302-Q306 HydrophobicContact CB-CG 4.36Å; Q302-Q306 HydrophobicContact CG-CG 4.35Å; Q302-Q306 VanDerWaalsContact CG-OE1 3.31Å; Q302-Q306 PolarHBondContact O-N 3.34Å; Q302-L346 HydrophobicContact CB-CD1 3.72Å; Q302-L346 HydrophobicContact CB-CD2 3.56Å; Q302-L346 HydrophobicContact CB-CG 4.2Å; Q302-L346 HydrophobicContact CG-CD1 3.78Å; Q302-L346 HydrophobicContact CG-CD2 4.44Å
303	K	91.4	Very high	93.8	Very high	93 Å²	93	74.4 Å²	74.4	40%	0.404	33%	0.33	S	S	.	.	H	α-helix	trans	-50.7	-50.4	-167.2	171	160.5	171.5	44.7	0	113.1	Q301 Y305 Q306 D307	Q301-K303 VanDerWaalsContact C-N 3.33Å; Q301-K303 PolarHBondContact O-N 3.2Å; K303-Y305 VanDerWaalsContact C-N 3.29Å; K303-Y305 PolarHBondContact O-N 3.44Å; K303-Q306 WeakPolarHBondContact O-CB 3.47Å; K303-Q306 PolarHBondContact O-N 3.47Å; K303-D307 VanDerWaalsContact CG-OD2 3.29Å; K303-D307 WeakPolarHBondContact CG-OD2 3.2Å; K303-D307 IonicContact NZ-OD1 2.74Å; K303-D307 PolarHBondContact NZ-OD1 2.98Å; K303-D307 IonicContact NZ-OD2 2.66Å; K303-D307 PolarHBondContact NZ-OD2 3.41Å; K303-D307 WeakPolarHBondContact O-CB 3.45Å; K303-D307 PolarHBondContact O-N 3.36Å
304	R	93.7	Very high	93.8	Very high	162 Å²	162	74.3 Å²	74.3	61%	0.611	33%	0.33	S	S	*	.	H	α-helix	trans	-63.3	-33.8	-177.7	-168.6	178.7	-172.9	-170.9	1.7	113.2	Q302 W308	Q302-R304 PolarHBondContact O-N 3.38Å; R304-W308 HydrophobicContact CG-CD2 4.21Å; R304-W308 HydrophobicContact CG-CE3 4.46Å; R304-W308 HydrophobicContact CG-CH2 4.28Å; R304-W308 HydrophobicContact CG-CZ2 4.01Å; R304-W308 HydrophobicContact CG-CZ3 4.48Å; R304-W308 WeakPolarHBondContact O-CB 3.31Å; R304-W308 PolarHBondContact O-N 3.04Å
305	Y	96.4	Very high	93.8	Very high	81 Å²	81	77.7 Å²	77.7	32%	0.318	35%	0.354	S	S	.	.	H	α-helix	trans	-74.4	-39.5	177.9	-58	-86.3	0	0	0	111.3	F292 V297 Q302 K303 W308 F309	F292-Y305 HydrophobicContact CD1-CE1 4.35Å; F292-Y305 HydrophobicContact CE1-CD1 4.25Å; F292-Y305 AromaticContact CE1-CE1 3.67Å; F292-Y305 HydrophobicContact CE1-CE1 3.67Å; V297-Y305 HydrophobicContact CB-CD2 4.47Å; V297-Y305 HydrophobicContact CG1-CD2 3.7Å; V297-Y305 HydrophobicContact CG1-CE2 3.89Å; V297-Y305 HydrophobicContact CG1-CG 4.44Å; V297-Y305 HydrophobicContact CG2-CD1 4.03Å; V297-Y305 HydrophobicContact CG2-CD2 3.82Å; V297-Y305 HydrophobicContact CG2-CE1 4.05Å; V297-Y305 HydrophobicContact CG2-CE2 3.84Å; V297-Y305 HydrophobicContact CG2-CG 3.92Å; Q302-Y305 WeakPolarHBondContact O-CB 3.35Å; Q302-Y305 PolarHBondContact O-N 2.68Å; K303-Y305 VanDerWaalsContact C-N 3.29Å; K303-Y305 PolarHBondContact O-N 3.44Å; Y305-W308 HydrophobicContact CD1-CE3 4.06Å; Y305-W308 HydrophobicContact CD1-CZ3 4.01Å; Y305-W308 AromaticContact CE1-CZ3 3.99Å; Y305-W308 HydrophobicContact CE1-CZ3 3.99Å; Y305-W308 PolarHBondContact O-N 2.89Å; Y305-F309 WeakPolarHBondContact O-CB 3.41Å; Y305-F309 PolarHBondContact O-N 2.88Å
306	Q	95.9	Very high	93.9	Very high	13 Å²	13	78.8 Å²	78.8	6%	0.061	36%	0.359	C	S	.	.	H	α-helix	trans	-61.4	-49.9	170.8	-71.1	175.5	-35.8	0	0	111.1	M293 Q302 K303 W308 F309 Q310 W354	M293-Q306 HydrophobicContact CE-CG 3.78Å; Q302-Q306 HydrophobicContact CB-CG 4.36Å; Q302-Q306 HydrophobicContact CG-CG 4.35Å; Q302-Q306 VanDerWaalsContact CG-OE1 3.31Å; Q302-Q306 PolarHBondContact O-N 3.34Å; K303-Q306 WeakPolarHBondContact O-CB 3.47Å; K303-Q306 PolarHBondContact O-N 3.47Å; Q306-W308 VanDerWaalsContact C-N 3.32Å; Q306-W308 PolarHBondContact O-N 3.46Å; Q306-F309 PolarHBondContact O-N 2.95Å; Q306-Q310 WeakPolarHBondContact O-CB 3.48Å; Q306-Q310 PolarHBondContact O-N 3.24Å; Q306-W354 HydrophobicContact CB-CD2 4.13Å; Q306-W354 HydrophobicContact CB-CH2 4.39Å; Q306-W354 HydrophobicContact CB-CZ2 3.78Å; Q306-W354 HydrophobicContact CG-CD2 3.7Å; Q306-W354 HydrophobicContact CG-CE3 3.98Å; Q306-W354 HydrophobicContact CG-CG 4.13Å; Q306-W354 HydrophobicContact CG-CH2 4.28Å; Q306-W354 HydrophobicContact CG-CZ2 4.04Å; Q306-W354 HydrophobicContact CG-CZ3 4.26Å; Q306-W354 VanDerWaalsContact NE2-CB 3.31Å; Q306-W354 VanDerWaalsContact NE2-CG 3.34Å; Q306-W354 WeakPolarHBondContact O-CZ2 3.47Å
307	D	94	Very high	93.9	Very high	45 Å²	45	74 Å²	74	24%	0.241	36%	0.357	C	S	.	.	H	α-helix	trans	-57	-43.3	177.4	-63.7	-28.3	0	0	0	111.4	K303 R311	K303-D307 VanDerWaalsContact CG-OD2 3.29Å; K303-D307 WeakPolarHBondContact CG-OD2 3.2Å; K303-D307 IonicContact NZ-OD1 2.74Å; K303-D307 PolarHBondContact NZ-OD1 2.98Å; K303-D307 IonicContact NZ-OD2 2.66Å; K303-D307 PolarHBondContact NZ-OD2 3.41Å; K303-D307 WeakPolarHBondContact O-CB 3.45Å; K303-D307 PolarHBondContact O-N 3.36Å; D307-R311 VanDerWaalsContact O-CB 3.31Å; D307-R311 WeakPolarHBondContact O-CB 3.37Å; D307-R311 WeakPolarHBondContact O-CD 3.32Å; D307-R311 WeakPolarHBondContact O-CG 3.24Å; D307-R311 PolarHBondContact O-N 3.24Å
308	W	97.3	Very high	93.8	Very high	133 Å²	133	77.4 Å²	77.4	50%	0.504	37%	0.372	S	S	.	.	H	α-helix	trans	-64.4	-48.6	175.4	-74.2	-23.6	0	0	0	113.1	R304 Y305 Q306 Q310 R311 Q312	R304-W308 HydrophobicContact CG-CD2 4.21Å; R304-W308 HydrophobicContact CG-CE3 4.46Å; R304-W308 HydrophobicContact CG-CH2 4.28Å; R304-W308 HydrophobicContact CG-CZ2 4.01Å; R304-W308 HydrophobicContact CG-CZ3 4.48Å; R304-W308 WeakPolarHBondContact O-CB 3.31Å; R304-W308 PolarHBondContact O-N 3.04Å; Y305-W308 HydrophobicContact CD1-CE3 4.06Å; Y305-W308 HydrophobicContact CD1-CZ3 4.01Å; Y305-W308 AromaticContact CE1-CZ3 3.99Å; Y305-W308 HydrophobicContact CE1-CZ3 3.99Å; Y305-W308 PolarHBondContact O-N 2.89Å; Q306-W308 VanDerWaalsContact C-N 3.32Å; Q306-W308 PolarHBondContact O-N 3.46Å; W308-Q310 VanDerWaalsContact C-N 3.32Å; W308-Q310 PolarHBondContact O-N 2.86Å; W308-R311 PolarHBondContact O-N 3.25Å; W308-Q312 WeakPolarHBondContact O-CB 3.5Å; W308-Q312 PolarHBondContact O-N 3.37Å; W308-Q312 VanDerWaalsContact O-N 3.07Å
309	F	98.2	Very high	93.9	Very high	3 Å²	3	71.3 Å²	71.3	1%	0.013	35%	0.349	C	S	.	.	H	α-helix	trans	-64.6	-39.6	179.4	-165.5	-75.1	0	0	0	111	M286 K289 L290 Y305 Q306 Q312 Y313 L314 L326 W354	M286-F309 HydrophobicContact CB-CZ 4.4Å; M286-F309 HydrophobicContact CG-CZ 4.44Å; K289-F309 HydrophobicContact CB-CD2 4Å; K289-F309 HydrophobicContact CB-CE2 4.12Å; L290-F309 HydrophobicContact CD2-CE2 4.08Å; L290-F309 HydrophobicContact CD2-CZ 4.28Å; L290-F309 HydrophobicContact CG-CE2 3.97Å; L290-F309 HydrophobicContact CG-CZ 4.18Å; Y305-F309 WeakPolarHBondContact O-CB 3.41Å; Y305-F309 PolarHBondContact O-N 2.88Å; Q306-F309 PolarHBondContact O-N 2.95Å; F309-Q312 PolarHBondContact O-N 2.93Å; F309-Y313 AromaticContact CD1-CD2 3.62Å; F309-Y313 HydrophobicContact CD1-CD2 3.62Å; F309-Y313 HydrophobicContact CD1-CE2 4.36Å; F309-Y313 AromaticContact CD2-CD2 3.79Å; F309-Y313 HydrophobicContact CD2-CD2 3.79Å; F309-Y313 AromaticContact CD2-CE2 3.68Å; F309-Y313 HydrophobicContact CD2-CE2 3.68Å; F309-Y313 AromaticContact CE1-CD2 3.57Å; F309-Y313 HydrophobicContact CE1-CD2 3.57Å; F309-Y313 HydrophobicContact CE1-CE2 4.3Å; F309-Y313 HydrophobicContact CE1-CG 4.32Å; F309-Y313 AromaticContact CE2-CD2 3.75Å; F309-Y313 HydrophobicContact CE2-CD2 3.75Å; F309-Y313 AromaticContact CE2-CE2 3.63Å; F309-Y313 HydrophobicContact CE2-CE2 3.63Å; F309-Y313 AromaticContact CG-CD2 3.72Å; F309-Y313 HydrophobicContact CG-CD2 3.72Å; F309-Y313 HydrophobicContact CG-CE2 4.05Å; F309-Y313 AromaticContact CZ-CD2 3.63Å; F309-Y313 HydrophobicContact CZ-CD2 3.63Å; F309-Y313 AromaticContact CZ-CE2 3.95Å; F309-Y313 HydrophobicContact CZ-CE2 3.95Å; F309-Y313 WeakPolarHBondContact O-CD2 3.11Å; F309-Y313 PolarHBondContact O-N 2.97Å; F309-L314 HydrophobicContact CD1-CD1 3.86Å; F309-L314 HydrophobicContact CD1-CG 4.23Å; F309-L314 HydrophobicContact CE1-CD1 4.02Å; F309-L314 HydrophobicContact CE1-CG 4.24Å; F309-L326 HydrophobicContact CE1-CD1 3.71Å; F309-L326 HydrophobicContact CE1-CD2 4.48Å; F309-L326 HydrophobicContact CZ-CD1 4.11Å; F309-L326 HydrophobicContact CZ-CD2 4.06Å; F309-W354 HydrophobicContact CB-CH2 4Å; F309-W354 HydrophobicContact CB-CZ2 4.49Å; F309-W354 AromaticContact CD1-CH2 3.77Å; F309-W354 HydrophobicContact CD1-CH2 3.77Å; F309-W354 HydrophobicContact CG-CH2 4.07Å
310	Q	95.8	Very high	93.9	Very high	69 Å²	69	67.4 Å²	67.4	32%	0.322	33%	0.333	S	S	.	.	H	α-helix	trans	-64.6	-49.1	178.2	-175.2	166.3	-33.4	0	0	111.5	Q306 W308 Q312 L314 S315 W354 T358	Q306-Q310 WeakPolarHBondContact O-CB 3.48Å; Q306-Q310 PolarHBondContact O-N 3.24Å; W308-Q310 VanDerWaalsContact C-N 3.32Å; W308-Q310 PolarHBondContact O-N 2.86Å; Q310-Q312 VanDerWaalsContact C-N 3.31Å; Q310-Q312 PolarHBondContact O-N 3Å; Q310-L314 HydrophobicContact CG-CB 4.37Å; Q310-L314 CarbonylContact O-C 3.45Å; Q310-L314 PolarHBondContact O-N 3.17Å; Q310-S315 WeakPolarHBondContact O-CB 3.22Å; Q310-S315 PolarHBondContact O-N 3.48Å; Q310-S315 VanDerWaalsContact O-N 3.09Å; Q310-W354 HydrophobicContact CB-CZ2 4.2Å; Q310-W354 VanDerWaalsContact OE1-NE1 3.11Å; Q310-T358 VanDerWaalsContact OE1-CG2 3.23Å
311	R	95.6	Very high	94.2	Very high	160 Å²	160	65.9 Å²	65.9	60%	0.604	31%	0.313	S	S	*	.	H	α-helix	trans	-59.2	-40	176.6	-73.3	168.3	-178.4	-161.6	-3.7	112	D307 W308 S315 D515	D307-R311 VanDerWaalsContact O-CB 3.31Å; D307-R311 WeakPolarHBondContact O-CB 3.37Å; D307-R311 WeakPolarHBondContact O-CD 3.32Å; D307-R311 WeakPolarHBondContact O-CG 3.24Å; D307-R311 PolarHBondContact O-N 3.24Å; W308-R311 PolarHBondContact O-N 3.25Å; R311-S315 PolarHBondContact O-OG 2.98Å; R311-D515 IonicContact NH2-OD2 3.56Å; R311-D515 PolarHBondContact NH2-OD2 3.23Å; R311-D515 VanDerWaalsContact NH2-OD2 3.15Å
312	Q	96	Very high	94.6	Very high	98 Å²	98	59.5 Å²	59.5	46%	0.458	28%	0.283	S	S	.	.	H	α-helix	trans	-78.8	-38	-177.8	-168.3	-177.7	-13.7	0	0	114.4	D285 W308 F309 Q310	D285-Q312 PolarHBondContact OD2-NE2 3.15Å; W308-Q312 WeakPolarHBondContact O-CB 3.5Å; W308-Q312 PolarHBondContact O-N 3.37Å; W308-Q312 VanDerWaalsContact O-N 3.07Å; F309-Q312 PolarHBondContact O-N 2.93Å; Q310-Q312 VanDerWaalsContact C-N 3.31Å; Q310-Q312 PolarHBondContact O-N 3Å
313	Y	97.6	Very high	94.8	Very high	25 Å²	25	58 Å²	58	10%	0.098	28%	0.277	C	S	.	.	H	α-helix	trans	-129.2	-13.6	-168	-46.5	-69.8	0	0	0	116.5	D285 M286 K289 F309 S319	D285-Y313 PolarHBondContact OD2-OH 3.5Å; M286-Y313 HydrophobicContact CE-CD1 3.48Å; M286-Y313 VanDerWaalsContact CE-CD1 3.48Å; M286-Y313 HydrophobicContact CE-CE1 3.92Å; M286-Y313 HydrophobicContact CE-CG 4.05Å; M286-Y313 HydrophobicContact CG-CD1 3.99Å; M286-Y313 HydrophobicContact CG-CD2 4.3Å; M286-Y313 HydrophobicContact CG-CE1 3.7Å; M286-Y313 HydrophobicContact CG-CE2 4.03Å; M286-Y313 HydrophobicContact CG-CG 4.25Å; K289-Y313 HydrophobicContact CD-CE2 4.03Å; K289-Y313 WeakPolarHBondContact CD-OH 3.3Å; K289-Y313 PolarHBondContact NZ-OH 3.01Å; K289-Y313 VanDerWaalsContact NZ-OH 3.08Å; F309-Y313 AromaticContact CD1-CD2 3.62Å; F309-Y313 HydrophobicContact CD1-CD2 3.62Å; F309-Y313 HydrophobicContact CD1-CE2 4.36Å; F309-Y313 AromaticContact CD2-CD2 3.79Å; F309-Y313 HydrophobicContact CD2-CD2 3.79Å; F309-Y313 AromaticContact CD2-CE2 3.68Å; F309-Y313 HydrophobicContact CD2-CE2 3.68Å; F309-Y313 AromaticContact CE1-CD2 3.57Å; F309-Y313 HydrophobicContact CE1-CD2 3.57Å; F309-Y313 HydrophobicContact CE1-CE2 4.3Å; F309-Y313 HydrophobicContact CE1-CG 4.32Å; F309-Y313 AromaticContact CE2-CD2 3.75Å; F309-Y313 HydrophobicContact CE2-CD2 3.75Å; F309-Y313 AromaticContact CE2-CE2 3.63Å; F309-Y313 HydrophobicContact CE2-CE2 3.63Å; F309-Y313 AromaticContact CG-CD2 3.72Å; F309-Y313 HydrophobicContact CG-CD2 3.72Å; F309-Y313 HydrophobicContact CG-CE2 4.05Å; F309-Y313 AromaticContact CZ-CD2 3.63Å; F309-Y313 HydrophobicContact CZ-CD2 3.63Å; F309-Y313 AromaticContact CZ-CE2 3.95Å; F309-Y313 HydrophobicContact CZ-CE2 3.95Å; F309-Y313 WeakPolarHBondContact O-CD2 3.11Å; F309-Y313 PolarHBondContact O-N 2.97Å; Y313-S319 WeakPolarHBondContact O-CB 3.31Å
314	L	97	Very high	95.1	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.016	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	10.2	-169.5	-57	175.9	0	0	0	113.5	F309 Q310 S319 L322 R323 L326 W354 L355	F309-L314 HydrophobicContact CD1-CD1 3.86Å; F309-L314 HydrophobicContact CD1-CG 4.23Å; F309-L314 HydrophobicContact CE1-CD1 4.02Å; F309-L314 HydrophobicContact CE1-CG 4.24Å; Q310-L314 HydrophobicContact CG-CB 4.37Å; Q310-L314 CarbonylContact O-C 3.45Å; Q310-L314 PolarHBondContact O-N 3.17Å; L314-S319 VanDerWaalsContact CA-OG 3.32Å; L314-S319 WeakPolarHBondContact CA-OG 3.4Å; L314-S319 PolarHBondContact O-OG 2.73Å; L314-L322 HydrophobicContact CD2-CB 4.47Å; L314-L322 HydrophobicContact CD2-CD2 4.13Å; L314-L322 HydrophobicContact CD2-CG 4.43Å; L314-R323 HydrophobicContact CD2-CG 3.92Å; L314-R323 PolarHBondContact O-NH1 3.48Å; L314-R323 PolarHBondContact O-NH2 3.24Å; L314-L326 HydrophobicContact CD1-CD1 4.3Å; L314-L326 HydrophobicContact CD2-CD1 3.9Å; L314-W354 HydrophobicContact CD1-CH2 4.15Å; L314-W354 HydrophobicContact CD1-CZ2 4.19Å; L314-L355 HydrophobicContact CD1-CD2 3.65Å
315	S	93.3	Very high	95.4	Very high	78 Å²	78	46.4 Å²	46.4	55%	0.545	23%	0.231	S	C	.	.	S	Bend	trans	-88.4	-14.8	-171.1	47.9	0	0	0	0	115	Q310 R311	Q310-S315 WeakPolarHBondContact O-CB 3.22Å; Q310-S315 PolarHBondContact O-N 3.48Å; Q310-S315 VanDerWaalsContact O-N 3.09Å; R311-S315 PolarHBondContact O-OG 2.98Å
316	T	92.8	Very high	95.5	Very high	65 Å²	65	42.5 Å²	42.5	40%	0.399	22%	0.216	S	C	.	.	S	Bend	trans	-99.9	167	-178.8	78	0	0	0	0	112.9	E318 S319	T316-E318 VanDerWaalsContact C-N 3.3Å; T316-E318 VanDerWaalsContact CB-OE2 3.23Å; T316-E318 WeakPolarHBondContact CB-OE2 3.33Å; T316-E318 PolarHBondContact O-N 3.03Å; T316-E318 PolarHBondContact OG1-N 3.26Å; T316-E318 PolarHBondContact OG1-OE2 3.45Å; T316-E318 VanDerWaalsContact OG1-OE2 3.06Å; T316-S319 PolarHBondContact N-OG 2.73Å; T316-S319 PolarHBondContact O-OG 2.91Å; T316-S319 WeakPolarHBondContact OG1-CB 3.31Å; T316-S319 PolarHBondContact OG1-N 3.46Å; T316-S319 VanDerWaalsContact OG1-N 3.09Å
317	A	89.7	Confident	95.6	Very high	75 Å²	75	41.9 Å²	41.9	62%	0.62	21%	0.213	S	C	*	.	S	Bend	trans	-67.6	-31.6	175.3	0	0	0	0	0	112.4	Q320	A317-Q320 WeakPolarHBondContact O-CB 3.04Å; A317-Q320 WeakPolarHBondContact O-CG 3.45Å
318	E	89.8	Confident	95.8	Very high	74 Å²	74	39.9 Å²	39.9	35%	0.346	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-77.7	-31.7	-179.4	-54.3	80.3	-172	0	0	111.5	G152 I154 T316 Q320 S321	G152-E318 WeakPolarHBondContact CA-O 3.33Å; G152-E318 CarbonylContact O-C 3.38Å; I154-E318 HydrophobicContact CD1-CG 3.73Å; I154-E318 HydrophobicContact CG1-CB 4.38Å; I154-E318 HydrophobicContact CG1-CG 3.84Å; I154-E318 HydrophobicContact CG2-CB 4.36Å; I154-E318 HydrophobicContact CG2-CG 4.26Å; T316-E318 VanDerWaalsContact C-N 3.3Å; T316-E318 VanDerWaalsContact CB-OE2 3.23Å; T316-E318 WeakPolarHBondContact CB-OE2 3.33Å; T316-E318 PolarHBondContact O-N 3.03Å; T316-E318 PolarHBondContact OG1-N 3.26Å; T316-E318 PolarHBondContact OG1-OE2 3.45Å; T316-E318 VanDerWaalsContact OG1-OE2 3.06Å; E318-Q320 PolarHBondContact O-N 2.86Å; E318-S321 PolarHBondContact O-N 3.22Å; E318-S321 PolarHBondContact O-OG 2.84Å
319	S	94.3	Very high	95.9	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.014	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-60.3	-11	176	77.7	0	0	0	0	115	G152 Y313 L314 T316 S321 L322 R323	G152-S319 PolarHBondContact O-N 3.04Å; Y313-S319 WeakPolarHBondContact O-CB 3.31Å; L314-S319 VanDerWaalsContact CA-OG 3.32Å; L314-S319 WeakPolarHBondContact CA-OG 3.4Å; L314-S319 PolarHBondContact O-OG 2.73Å; T316-S319 PolarHBondContact N-OG 2.73Å; T316-S319 PolarHBondContact O-OG 2.91Å; T316-S319 WeakPolarHBondContact OG1-CB 3.31Å; T316-S319 PolarHBondContact OG1-N 3.46Å; T316-S319 VanDerWaalsContact OG1-N 3.09Å; S319-S321 PolarHBondContact O-N 3.37Å; S319-L322 WeakPolarHBondContact O-CB 3.36Å; S319-L322 PolarHBondContact O-N 3.13Å; S319-R323 PolarHBondContact O-NH1 3.02Å; S319-R323 PolarHBondContact OG-NH1 3.33Å
320	Q	92.9	Very high	95.9	Very high	15 Å²	15	33.5 Å²	33.5	7%	0.07	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-61.6	-28.3	-179.7	-65	-60.6	-46.1	0	0	112.4	A317 E318 T360 A364	A317-Q320 WeakPolarHBondContact O-CB 3.04Å; A317-Q320 WeakPolarHBondContact O-CG 3.45Å; E318-Q320 PolarHBondContact O-N 2.86Å; Q320-T360 PolarHBondContact NE2-OG1 3.16Å; Q320-T360 VanDerWaalsContact NE2-OG1 3.09Å; Q320-T360 PolarHBondContact OE1-OG1 3.3Å; Q320-A364 HydrophobicContact CB-CB 3.82Å; Q320-A364 HydrophobicContact CG-CB 4.49Å
321	S	93.9	Very high	96	Very high	21 Å²	21	30.2 Å²	30.2	15%	0.147	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-37.1	176.5	66	0	0	0	0	113.1	G152 R192 D196 E318 S319 R323 C324	G152-S321 WeakPolarHBondContact CA-OG 3.28Å; R192-S321 PolarHBondContact NH1-OG 3.4Å; R192-S321 VanDerWaalsContact NH2-C 3.27Å; R192-S321 PolarHBondContact NH2-O 3.38Å; R192-S321 PolarHBondContact NH2-OG 2.89Å; D196-S321 WeakPolarHBondContact OD1-CB 3.31Å; D196-S321 PolarHBondContact OD1-OG 3.42Å; E318-S321 PolarHBondContact O-N 3.22Å; E318-S321 PolarHBondContact O-OG 2.84Å; S319-S321 PolarHBondContact O-N 3.37Å; S321-R323 PolarHBondContact O-N 3.45Å; S321-C324 WeakPolarHBondContact O-CB 3.38Å; S321-C324 PolarHBondContact O-N 2.99Å
322	L	97.9	Very high	96.1	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-59.4	-31.8	-176	-179.7	61.2	0	0	0	112.7	M286 L314 S319 C324 D325 L326	M286-L322 HydrophobicContact CE-CD1 4.37Å; M286-L322 HydrophobicContact CE-CD2 3.59Å; M286-L322 HydrophobicContact SD-CD1 4.21Å; M286-L322 HydrophobicContact SD-CD2 4.19Å; L314-L322 HydrophobicContact CD2-CB 4.47Å; L314-L322 HydrophobicContact CD2-CD2 4.13Å; L314-L322 HydrophobicContact CD2-CG 4.43Å; S319-L322 WeakPolarHBondContact O-CB 3.36Å; S319-L322 PolarHBondContact O-N 3.13Å; L322-C324 PolarHBondContact O-N 3.43Å; L322-C324 VanDerWaalsContact O-N 3.13Å; L322-D325 PolarHBondContact O-N 2.89Å; L322-L326 HydrophobicContact CD1-CD2 4.42Å; L322-L326 HydrophobicContact CD1-CG 4.44Å; L322-L326 HydrophobicContact CG-CD1 4.14Å; L322-L326 HydrophobicContact CG-CD2 4.42Å; L322-L326 HydrophobicContact CG-CG 4.1Å; L322-L326 WeakPolarHBondContact O-CG 3.36Å; L322-L326 PolarHBondContact O-N 3.33Å; L322-L326 VanDerWaalsContact O-N 3.08Å
323	R	98.1	Very high	96.1	Very high	3 Å²	3	19.3 Å²	19.3	1%	0.011	12%	0.121	C	C	.	.	H	α-helix	trans	-53.9	-35.2	179.2	-67	169.7	170.7	71.9	-12.8	112.4	L314 S319 S321 I327 T358	L314-R323 HydrophobicContact CD2-CG 3.92Å; L314-R323 PolarHBondContact O-NH1 3.48Å; L314-R323 PolarHBondContact O-NH2 3.24Å; S319-R323 PolarHBondContact O-NH1 3.02Å; S319-R323 PolarHBondContact OG-NH1 3.33Å; S321-R323 PolarHBondContact O-N 3.45Å; R323-I327 WeakPolarHBondContact O-CB 3.38Å; R323-I327 WeakPolarHBondContact O-CD1 3.27Å; R323-I327 VanDerWaalsContact O-CG1 3.23Å; R323-I327 WeakPolarHBondContact O-CG1 3.29Å; R323-I327 PolarHBondContact O-N 3.42Å; R323-T358 PolarHBondContact NE-O 2.83Å; R323-T358 PolarHBondContact NE-OG1 2.89Å; R323-T358 PolarHBondContact NH2-O 3.46Å
324	C	98.1	Very high	96.1	Very high	6 Å²	6	18.6 Å²	18.6	4%	0.041	12%	0.119	C	C	.	.	H	α-helix	trans	-64.7	-40.2	176.4	-64.1	0	0	0	0	112.4	S321 L322 R328 N367 A371	S321-C324 WeakPolarHBondContact O-CB 3.38Å; S321-C324 PolarHBondContact O-N 2.99Å; L322-C324 PolarHBondContact O-N 3.43Å; L322-C324 VanDerWaalsContact O-N 3.13Å; C324-R328 WeakPolarHBondContact O-CG 3.45Å; C324-R328 PolarHBondContact O-N 3.06Å; C324-N367 VanDerWaalsContact SG-C 3.59Å; C324-N367 VanDerWaalsContact SG-CB 3.58Å; C324-A371 HydrophobicContact CB-CB 4.24Å
325	D	98.5	Very high	96	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-73.4	-39.5	-178.7	-47.2	-62.4	0	0	0	110.9	R192 R281 L282 L322 R328 Y329	R192-D325 WeakPolarHBondContact CD-OD1 3.43Å; R192-D325 IonicContact CZ-OD2 3.94Å; R192-D325 VanDerWaalsContact NE-CG 3.33Å; R192-D325 IonicContact NE-OD1 3.39Å; R192-D325 PolarHBondContact NE-OD1 2.87Å; R192-D325 IonicContact NE-OD2 2.98Å; R192-D325 PolarHBondContact NE-OD2 3.26Å; R192-D325 IonicContact NH2-OD2 2.77Å; R192-D325 PolarHBondContact NH2-OD2 3.41Å; R281-D325 HydrophobicContact CB-CB 4.26Å; L282-D325 HydrophobicContact CD1-CB 4.3Å; L322-D325 PolarHBondContact O-N 2.89Å; D325-R328 PolarHBondContact O-N 3.34Å; D325-Y329 VanDerWaalsContact O-CB 3.3Å; D325-Y329 WeakPolarHBondContact O-CB 3.29Å; D325-Y329 PolarHBondContact O-N 3.12Å
326	L	98.8	Very high	95.7	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.4	-44.2	173	-56.8	176.4	0	0	0	111.3	L282 L290 F309 L314 L322 Y329 I330 L355	L282-L326 HydrophobicContact CD1-CD2 4.35Å; L282-L326 HydrophobicContact CD2-CD2 3.85Å; L282-L326 HydrophobicContact CG-CD2 3.87Å; L290-L326 HydrophobicContact CD1-CD2 3.91Å; F309-L326 HydrophobicContact CE1-CD1 3.71Å; F309-L326 HydrophobicContact CE1-CD2 4.48Å; F309-L326 HydrophobicContact CZ-CD1 4.11Å; F309-L326 HydrophobicContact CZ-CD2 4.06Å; L314-L326 HydrophobicContact CD1-CD1 4.3Å; L314-L326 HydrophobicContact CD2-CD1 3.9Å; L322-L326 HydrophobicContact CD1-CD2 4.42Å; L322-L326 HydrophobicContact CD1-CG 4.44Å; L322-L326 HydrophobicContact CG-CD1 4.14Å; L322-L326 HydrophobicContact CG-CD2 4.42Å; L322-L326 HydrophobicContact CG-CG 4.1Å; L322-L326 WeakPolarHBondContact O-CG 3.36Å; L322-L326 PolarHBondContact O-N 3.33Å; L322-L326 VanDerWaalsContact O-N 3.08Å; L326-Y329 PolarHBondContact O-N 3.31Å; L326-I330 WeakPolarHBondContact O-CD1 3.39Å; L326-I330 VanDerWaalsContact O-CG1 3.25Å; L326-I330 WeakPolarHBondContact O-CG1 3.45Å; L326-I330 PolarHBondContact O-N 2.8Å; L326-L355 HydrophobicContact CB-CD1 3.85Å; L326-L355 HydrophobicContact CD1-CD2 3.91Å
327	I	98.8	Very high	95.3	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.5	-48.7	175.7	-73.5	167.5	0	0	0	111.2	R323 Y329 I330 C331 I352 L355 A368 A371 L372	R323-I327 WeakPolarHBondContact O-CB 3.38Å; R323-I327 WeakPolarHBondContact O-CD1 3.27Å; R323-I327 VanDerWaalsContact O-CG1 3.23Å; R323-I327 WeakPolarHBondContact O-CG1 3.29Å; R323-I327 PolarHBondContact O-N 3.42Å; I327-Y329 VanDerWaalsContact C-N 3.29Å; I327-Y329 PolarHBondContact O-N 2.81Å; I327-I330 PolarHBondContact O-N 3.29Å; I327-C331 PolarHBondContact O-N 2.98Å; I327-C331 PolarHBondContact O-SG 3.47Å; I327-I352 HydrophobicContact CB-CD1 4.16Å; I327-I352 HydrophobicContact CG1-CD1 3.85Å; I327-I352 HydrophobicContact CG2-CD1 4.13Å; I327-L355 HydrophobicContact CG1-CB 4.45Å; I327-L355 HydrophobicContact CG1-CD1 4.15Å; I327-A368 HydrophobicContact CD1-CB 3.62Å; I327-A371 HydrophobicContact CB-CB 4.45Å; I327-A371 HydrophobicContact CG2-CB 3.99Å; I327-L372 HydrophobicContact CG2-CB 3.89Å; I327-L372 HydrophobicContact CG2-CD1 4.44Å
328	R	98.6	Very high	94.7	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-62.1	-36.3	176.7	-66.4	-58.4	-65.1	137.1	-0.3	112.4	D230 L278 C324 D325 G332 A371 D375	D230-R328 IonicContact OD1-CZ 2.79Å; D230-R328 IonicContact OD1-NE 3.82Å; D230-R328 PolarHBondContact OD1-NE 3.32Å; D230-R328 IonicContact OD2-CZ 2.59Å; D230-R328 IonicContact OD2-NE 2.83Å; D230-R328 PolarHBondContact OD2-NE 3.08Å; D230-R328 IonicContact OD2-NH2 2.7Å; D230-R328 PolarHBondContact OD2-NH2 3.26Å; L278-R328 HydrophobicContact CD2-CB 4.18Å; C324-R328 WeakPolarHBondContact O-CG 3.45Å; C324-R328 PolarHBondContact O-N 3.06Å; D325-R328 PolarHBondContact O-N 3.34Å; R328-G332 PolarHBondContact O-N 3.02Å; R328-A371 WeakPolarHBondContact CD-O 3.34Å; R328-A371 HydrophobicContact CG-CB 4.14Å; R328-A371 PolarHBondContact NH1-O 2.88Å; R328-D375 IonicContact CZ-OD1 2.69Å; R328-D375 IonicContact CZ-OD2 2.61Å; R328-D375 VanDerWaalsContact CZ-OD2 3.3Å; R328-D375 IonicContact NH1-OD1 3.69Å; R328-D375 IonicContact NH1-OD2 2.69Å; R328-D375 PolarHBondContact NH1-OD2 3.2Å; R328-D375 VanDerWaalsContact NH2-CG 3.31Å; R328-D375 IonicContact NH2-OD1 3.61Å; R328-D375 PolarHBondContact NH2-OD1 3.28Å; R328-D375 IonicContact NH2-OD2 2.72Å; R328-D375 PolarHBondContact NH2-OD2 2.9Å
329	Y	98.8	Very high	93.7	Very high	3 Å²	3	19.5 Å²	19.5	1%	0.012	11%	0.109	C	C	.	.	H	α-helix	trans	-65.7	-48	175.8	-176.1	-89.6	0	0	0	112	A279 L282 E287 L290 D325 L326 I327 C331 V333 V334	A279-Y329 HydrophobicContact CB-CD2 4.28Å; A279-Y329 HydrophobicContact CB-CE2 3.87Å; L282-Y329 HydrophobicContact CD1-CD2 3.95Å; L282-Y329 HydrophobicContact CD1-CG 3.96Å; L282-Y329 HydrophobicContact CD2-CD1 3.64Å; L282-Y329 HydrophobicContact CD2-CD2 3.74Å; L282-Y329 HydrophobicContact CD2-CE1 4.09Å; L282-Y329 HydrophobicContact CD2-CE2 4.16Å; L282-Y329 HydrophobicContact CD2-CG 3.47Å; L282-Y329 VanDerWaalsContact CD2-CG 3.47Å; L282-Y329 HydrophobicContact CG-CD2 4.35Å; L282-Y329 HydrophobicContact CG-CG 4.35Å; E287-Y329 WeakPolarHBondContact CG-OH 3.36Å; E287-Y329 VanDerWaalsContact OE1-CE2 3.3Å; E287-Y329 WeakPolarHBondContact OE1-CE2 3.22Å; E287-Y329 PolarHBondContact OE1-OH 3.48Å; L290-Y329 HydrophobicContact CD1-CD1 4.15Å; D325-Y329 VanDerWaalsContact O-CB 3.3Å; D325-Y329 WeakPolarHBondContact O-CB 3.29Å; D325-Y329 PolarHBondContact O-N 3.12Å; L326-Y329 PolarHBondContact O-N 3.31Å; I327-Y329 VanDerWaalsContact C-N 3.29Å; I327-Y329 PolarHBondContact O-N 2.81Å; Y329-C331 PolarHBondContact O-N 3.37Å; Y329-V333 HydrophobicContact CD2-CB 3.84Å; Y329-V333 HydrophobicContact CD2-CG1 4.17Å; Y329-V333 HydrophobicContact CD2-CG2 3.72Å; Y329-V333 HydrophobicContact CE2-CB 3.83Å; Y329-V333 HydrophobicContact CE2-CG1 3.64Å; Y329-V333 HydrophobicContact CE2-CG2 4.04Å; Y329-V333 HydrophobicContact CG-CB 4.2Å; Y329-V333 HydrophobicContact CG-CG2 4.29Å; Y329-V333 WeakPolarHBondContact O-CA 3.33Å; Y329-V333 VanDerWaalsContact O-CB 3.28Å; Y329-V333 WeakPolarHBondContact O-CB 3.3Å; Y329-V333 PolarHBondContact O-N 2.78Å; Y329-V334 HydrophobicContact CD1-CG2 3.63Å; Y329-V334 HydrophobicContact CE1-CG2 3.3Å; Y329-V334 PolarHBondContact O-N 2.9Å; Y329-V334 VanDerWaalsContact O-N 3.08Å
330	I	98.6	Very high	92.6	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.8	-41.8	179.2	-68.2	161	0	0	0	111.2	L290 L326 I327 V334 R348 I351 I352 L355	L290-I330 HydrophobicContact CD1-CD1 4.29Å; L290-I330 HydrophobicContact CD1-CG1 4.21Å; L326-I330 WeakPolarHBondContact O-CD1 3.39Å; L326-I330 VanDerWaalsContact O-CG1 3.25Å; L326-I330 WeakPolarHBondContact O-CG1 3.45Å; L326-I330 PolarHBondContact O-N 2.8Å; I327-I330 PolarHBondContact O-N 3.29Å; I330-V334 VanDerWaalsContact O-O 3.13Å; I330-R348 HydrophobicContact CG2-CB 3.83Å; I330-R348 HydrophobicContact CG2-CG 4.25Å; I330-R348 PolarHBondContact O-NH1 3.14Å; I330-I351 HydrophobicContact CD1-CB 4.3Å; I330-I351 HydrophobicContact CD1-CG2 3.61Å; I330-I352 HydrophobicContact CB-CD1 3.94Å; I330-I352 HydrophobicContact CD1-CD1 4.12Å; I330-I352 HydrophobicContact CG2-CD1 3.79Å; I330-I352 HydrophobicContact CG2-CG1 4.01Å; I330-L355 HydrophobicContact CD1-CD1 3.63Å
331	C	98.1	Very high	91.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-73.3	-46.7	177.8	-63	0	0	0	0	113	I327 Y329 H335 R348 M387 N388	I327-C331 PolarHBondContact O-N 2.98Å; I327-C331 PolarHBondContact O-SG 3.47Å; Y329-C331 PolarHBondContact O-N 3.37Å; C331-H335 PolarHBondContact O-CD2 3.42Å; C331-H335 PolarHBondContact O-NE2 2.77Å; C331-R348 PolarHBondContact O-NH1 2.92Å; C331-M387 VanDerWaalsContact O-O 3.12Å; C331-N388 WeakPolarHBondContact O-CA 3.38Å
332	G	95.9	Very high	90.7	Very high	4 Å²	4	28 Å²	28	4%	0.041	16%	0.161	C	C	.	.	H	α-helix	trans	-96	-22.9	-169	0	0	0	0	0	116.3	R275 R328	R275-G332 VanDerWaalsContact CG-O 3.31Å; R275-G332 WeakPolarHBondContact CG-O 3.45Å; R275-G332 PolarHBondContact NE-O 3.31Å; R275-G332 VanDerWaalsContact NE-O 3.15Å; R328-G332 PolarHBondContact O-N 3.02Å
333	V	97.6	Very high	89.9	Confident	25 Å²	25	29.8 Å²	29.8	15%	0.152	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-48.7	-175.7	-171	0	0	0	0	111.9	R275 L278 Y329 H335	R275-V333 HydrophobicContact CB-CG2 4.16Å; R275-V333 HydrophobicContact CG-CG2 4.23Å; L278-V333 HydrophobicContact CB-CG2 3.56Å; L278-V333 HydrophobicContact CD1-CG2 4.13Å; L278-V333 HydrophobicContact CG-CG2 4.44Å; Y329-V333 HydrophobicContact CD2-CB 3.84Å; Y329-V333 HydrophobicContact CD2-CG1 4.17Å; Y329-V333 HydrophobicContact CD2-CG2 3.72Å; Y329-V333 HydrophobicContact CE2-CB 3.83Å; Y329-V333 HydrophobicContact CE2-CG1 3.64Å; Y329-V333 HydrophobicContact CE2-CG2 4.04Å; Y329-V333 HydrophobicContact CG-CB 4.2Å; Y329-V333 HydrophobicContact CG-CG2 4.29Å; Y329-V333 WeakPolarHBondContact O-CA 3.33Å; Y329-V333 VanDerWaalsContact O-CB 3.28Å; Y329-V333 WeakPolarHBondContact O-CB 3.3Å; Y329-V333 PolarHBondContact O-N 2.78Å; V333-H335 PolarHBondContact O-N 3.44Å
334	V	96.8	Very high	89.4	Confident	9 Å²	9	33.1 Å²	33.1	6%	0.055	19%	0.192	C	C	.	.			trans	-78.3	91	179.9	-171.6	0	0	0	0	109.6	L291 T294 Y329 I330 P336 R348	L291-V334 HydrophobicContact CD2-CG2 4.18Å; T294-V334 HydrophobicContact CG2-CG1 4.14Å; T294-V334 WeakPolarHBondContact OG1-CG1 3.26Å; Y329-V334 HydrophobicContact CD1-CG2 3.63Å; Y329-V334 HydrophobicContact CE1-CG2 3.3Å; Y329-V334 PolarHBondContact O-N 2.9Å; Y329-V334 VanDerWaalsContact O-N 3.08Å; I330-V334 VanDerWaalsContact O-O 3.13Å; V334-P336 HydrophobicContact CG1-CG 4.46Å; V334-R348 WeakPolarHBondContact O-CD 3.43Å; V334-R348 PolarHBondContact O-NE 3.13Å; V334-R348 PolarHBondContact O-NH1 3.4Å
335	H	95.7	Very high	89.2	Confident	48 Å²	48	34 Å²	34	22%	0.222	20%	0.197	C	C	.	.			trans	-110.3	100.4	170	-64.1	179	0	0	0	107.1	R275 C331 V333 M387 N388	R275-H335 PolarHBondContact NH2-ND1 3.37Å; C331-H335 PolarHBondContact O-CD2 3.42Å; C331-H335 PolarHBondContact O-NE2 2.77Å; V333-H335 PolarHBondContact O-N 3.44Å; H335-M387 HydrophobicContact CB-CB 4.3Å; H335-M387 HydrophobicContact CB-CE 4.37Å; H335-M387 HydrophobicContact CB-CG 4.29Å; H335-M387 VanDerWaalsContact CD2-CB 3.41Å; H335-M387 WeakPolarHBondContact CD2-CB 3.44Å; H335-M387 WeakPolarHBondContact NE2-CB 3.16Å; H335-N388 PolarHBondContact CE1-OD1 2.69Å; H335-N388 PolarHBondContact NE2-OD1 2.97Å
336	P	87.4	Confident	89	Confident	25 Å²	25	34 Å²	34	16%	0.162	20%	0.196	C	C	.	.			trans	-68.3	161.3	-179	-16.1	31.2	0	0	0	111.9	V334 V340 L341 R348	V334-P336 HydrophobicContact CG1-CG 4.46Å; P336-V340 HydrophobicContact CB-CB 3.77Å; P336-V340 HydrophobicContact CB-CG1 3.77Å; P336-L341 HydrophobicContact CB-CD2 4.12Å; P336-L341 HydrophobicContact CB-CG 4.27Å; P336-L341 HydrophobicContact CG-CD2 4.02Å; P336-R348 HydrophobicContact CG-CG 4.23Å
337	S	83.6	Confident	88.8	Confident	51 Å²	51	35.7 Å²	35.7	36%	0.357	21%	0.207	S	C	.	.			trans	-73	162.6	168.3	59.8	0	0	0	0	110.9	E339 V340 L341	S337-E339 WeakPolarHBondContact CB-OE1 3.47Å; S337-E339 PolarHBondContact O-N 3.02Å; S337-E339 PolarHBondContact OG-OE1 2.96Å; S337-V340 PolarHBondContact O-N 3.23Å; S337-L341 PolarHBondContact O-N 3.21Å; S337-L341 VanDerWaalsContact O-N 3.11Å
338	N	77.4	Confident	88.8	Confident	124 Å²	124	36.1 Å²	36.1	66%	0.663	21%	0.209	S	C	*	.	H	α-helix	trans	-56.1	-39.5	178.5	-64.1	-16.9	0	0	0	111.5	V340 L341 S342	N338-V340 VanDerWaalsContact C-N 3.26Å; N338-V340 PolarHBondContact O-N 2.69Å; N338-L341 PolarHBondContact O-N 3.29Å; N338-S342 PolarHBondContact O-N 3.11Å; N338-S342 PolarHBondContact O-OG 2.76Å; N338-S342 VanDerWaalsContact O-OG 3.13Å
339	E	68.4	Low	88.7	Confident	67 Å²	67	38.1 Å²	38.1	31%	0.313	22%	0.217	S	C	.	.	H	α-helix	trans	-48.8	-45.9	171.6	-54.7	150.3	-93.6	0	0	112.3	S337 S342 S343	S337-E339 WeakPolarHBondContact CB-OE1 3.47Å; S337-E339 PolarHBondContact O-N 3.02Å; S337-E339 PolarHBondContact OG-OE1 2.96Å; E339-S342 PolarHBondContact O-OG 3.43Å; E339-S343 WeakPolarHBondContact O-CB 3.46Å; E339-S343 PolarHBondContact O-N 3.12Å; E339-S343 PolarHBondContact O-OG 2.78Å
340	V	71.5	Confident	88.7	Confident	34 Å²	34	38.6 Å²	38.6	21%	0.206	22%	0.221	C	C	.	.	H	α-helix	trans	-76.9	-28.7	-177.1	179.5	0	0	0	0	111.1	P336 S337 N338 S343 I345	P336-V340 HydrophobicContact CB-CB 3.77Å; P336-V340 HydrophobicContact CB-CG1 3.77Å; S337-V340 PolarHBondContact O-N 3.23Å; N338-V340 VanDerWaalsContact C-N 3.26Å; N338-V340 PolarHBondContact O-N 2.69Å; V340-S343 WeakPolarHBondContact CA-OG 3.45Å; V340-S343 PolarHBondContact O-OG 2.83Å; V340-I345 HydrophobicContact CG1-CB 4.09Å; V340-I345 HydrophobicContact CG1-CG2 3.88Å
341	L	74.1	Confident	88.6	Confident	82 Å²	82	38.6 Å²	38.6	43%	0.429	22%	0.221	S	C	.	.	H	α-helix	trans	-75.6	-28.3	176.1	-62.3	173.5	0	0	0	113.1	P336 S337 N338 M387	P336-L341 HydrophobicContact CB-CD2 4.12Å; P336-L341 HydrophobicContact CB-CG 4.27Å; P336-L341 HydrophobicContact CG-CD2 4.02Å; S337-L341 PolarHBondContact O-N 3.21Å; S337-L341 VanDerWaalsContact O-N 3.11Å; N338-L341 PolarHBondContact O-N 3.29Å; L341-M387 HydrophobicContact CD1-CE 3.86Å; L341-M387 HydrophobicContact CD2-CE 4.32Å
342	S	71.4	Confident	88.7	Confident	99 Å²	99	38.6 Å²	38.6	69%	0.692	22%	0.221	S	C	*	.	H	α-helix	trans	-90.8	-17.7	174.3	58.1	0	0	0	0	114.1	N338 E339	N338-S342 PolarHBondContact O-N 3.11Å; N338-S342 PolarHBondContact O-OG 2.76Å; N338-S342 VanDerWaalsContact O-OG 3.13Å; E339-S342 PolarHBondContact O-OG 3.43Å
343	S	81.5	Confident	88.7	Confident	39 Å²	39	38.9 Å²	38.9	27%	0.273	22%	0.224	S	C	.	.	S	Bend	trans	-75.2	171.5	178.4	71.8	0	0	0	0	114.8	E339 V340 I345	E339-S343 WeakPolarHBondContact O-CB 3.46Å; E339-S343 PolarHBondContact O-N 3.12Å; E339-S343 PolarHBondContact O-OG 2.78Å; V340-S343 WeakPolarHBondContact CA-OG 3.45Å; V340-S343 PolarHBondContact O-OG 2.83Å; S343-I345 PolarHBondContact O-N 3.43Å; S343-I345 VanDerWaalsContact O-N 3.16Å; S343-I345 WeakPolarHBondContact OG-CB 3.23Å; S343-I345 VanDerWaalsContact OG-CG1 3.28Å; S343-I345 WeakPolarHBondContact OG-CG1 3.49Å; S343-I345 PolarHBondContact OG-N 2.89Å
344	D	87.9	Confident	88.7	Confident	74 Å²	74	38 Å²	38	40%	0.396	22%	0.218	S	C	.	.	S	Bend	trans	-76.7	14.8	171.7	80.7	-29.1	0	0	0	114.7	R298 F299	R298-D344 CarbonylContact C-O 3.54Å; R298-D344 VanDerWaalsContact CA-O 3.31Å; R298-D344 WeakPolarHBondContact CA-O 3.17Å; R298-D344 WeakPolarHBondContact CD-OD2 3.45Å; R298-D344 WeakPolarHBondContact CG-OD1 3.4Å; R298-D344 WeakPolarHBondContact CG-OD2 3.45Å; R298-D344 IonicContact CZ-OD1 3.58Å; R298-D344 IonicContact CZ-OD2 3.48Å; R298-D344 IonicContact NE-OD1 3.87Å; R298-D344 PolarHBondContact NE-OD1 3.43Å; R298-D344 IonicContact NE-OD2 3.28Å; R298-D344 PolarHBondContact NE-OD2 3.31Å; R298-D344 IonicContact NH1-OD1 2.72Å; R298-D344 IonicContact NH1-OD2 2.89Å; R298-D344 PolarHBondContact NH1-OD2 3.19Å; R298-D344 IonicContact NH2-OD1 3.08Å; F299-D344 PolarHBondContact N-O 2.87Å
345	I	93	Very high	88.7	Confident	25 Å²	25	37.6 Å²	37.6	13%	0.128	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-70.3	142	176.7	-65.6	-61.3	0	0	0	111.7	R298 V340 S343 P347	R298-I345 HydrophobicContact CG-CD1 4.45Å; V340-I345 HydrophobicContact CG1-CB 4.09Å; V340-I345 HydrophobicContact CG1-CG2 3.88Å; S343-I345 PolarHBondContact O-N 3.43Å; S343-I345 VanDerWaalsContact O-N 3.16Å; S343-I345 WeakPolarHBondContact OG-CB 3.23Å; S343-I345 VanDerWaalsContact OG-CG1 3.28Å; S343-I345 WeakPolarHBondContact OG-CG1 3.49Å; S343-I345 PolarHBondContact OG-N 2.89Å; I345-P347 WeakPolarHBondContact O-CD 3.43Å
346	L	94.6	Very high	88.7	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	21%	0.211	C	C	.	.			trans	-48.3	107.6	177.5	173.3	63.1	0	0	0	111.8	M293 V297 F299 Q302 A350 I351	M293-L346 HydrophobicContact CB-CD2 4.1Å; M293-L346 HydrophobicContact CE-CD2 4.01Å; V297-L346 HydrophobicContact CG1-CD2 4.3Å; V297-L346 VanDerWaalsContact O-CB 3.27Å; V297-L346 WeakPolarHBondContact O-CB 3.4Å; V297-L346 PolarHBondContact O-N 3.45Å; F299-L346 HydrophobicContact CD2-CD1 3.85Å; F299-L346 HydrophobicContact CE2-CD1 4.41Å; Q302-L346 HydrophobicContact CB-CD1 3.72Å; Q302-L346 HydrophobicContact CB-CD2 3.56Å; Q302-L346 HydrophobicContact CB-CG 4.2Å; Q302-L346 HydrophobicContact CG-CD1 3.78Å; Q302-L346 HydrophobicContact CG-CD2 4.44Å; L346-A350 HydrophobicContact CD1-CB 3.83Å; L346-I351 HydrophobicContact CD1-CG1 4.3Å; L346-I351 HydrophobicContact CD2-CD1 3.76Å; L346-I351 HydrophobicContact CD2-CG1 3.79Å; L346-I351 HydrophobicContact CG-CD1 4.07Å; L346-I351 HydrophobicContact CG-CG1 3.85Å
347	P	95.1	Very high	89	Confident	36 Å²	36	38.3 Å²	38.3	23%	0.234	22%	0.222	C	C	.	.			trans	-75.6	153.2	-171.9	30.1	-35.7	0	0	0	111.4	F299 I345 W349 A350 I351	F299-P347 HydrophobicContact CD2-CG 4.5Å; I345-P347 WeakPolarHBondContact O-CD 3.43Å; P347-W349 HydrophobicContact CB-CG 4.41Å; P347-W349 HydrophobicContact CG-CD2 4.23Å; P347-W349 HydrophobicContact CG-CG 4.42Å; P347-W349 HydrophobicContact CG-CZ2 3.84Å; P347-W349 PolarHBondContact O-N 2.62Å; P347-A350 HydrophobicContact CG-CB 4.05Å; P347-A350 WeakPolarHBondContact O-CB 3.42Å; P347-A350 PolarHBondContact O-N 2.66Å; P347-I351 PolarHBondContact O-N 3.42Å
348	R	98.1	Very high	89.4	Confident	9 Å²	9	36.6 Å²	36.6	3%	0.034	21%	0.209	C	C	.	.	H	α-helix	trans	-55.4	-39.4	-176	-62.2	-167.8	-63.7	144.3	1.4	112.9	I330 C331 V334 P336 A350 I351 I352 M387 E390	I330-R348 HydrophobicContact CG2-CB 3.83Å; I330-R348 HydrophobicContact CG2-CG 4.25Å; I330-R348 PolarHBondContact O-NH1 3.14Å; C331-R348 PolarHBondContact O-NH1 2.92Å; V334-R348 WeakPolarHBondContact O-CD 3.43Å; V334-R348 PolarHBondContact O-NE 3.13Å; V334-R348 PolarHBondContact O-NH1 3.4Å; P336-R348 HydrophobicContact CG-CG 4.23Å; R348-A350 VanDerWaalsContact C-N 3.31Å; R348-A350 PolarHBondContact O-N 2.77Å; R348-I351 PolarHBondContact O-N 3.01Å; R348-I352 WeakPolarHBondContact O-CG1 3.25Å; R348-I352 PolarHBondContact O-N 3.45Å; R348-M387 VanDerWaalsContact CZ-O 3.3Å; R348-M387 PolarHBondContact NH1-O 2.94Å; R348-M387 PolarHBondContact NH2-O 2.63Å; R348-E390 IonicContact CZ-OE1 2.64Å; R348-E390 IonicContact NE-OE1 3.48Å; R348-E390 VanDerWaalsContact NH2-CG 3.25Å; R348-E390 IonicContact NH2-OE1 2.65Å; R348-E390 PolarHBondContact NH2-OE1 2.83Å
349	W	97.8	Very high	90.1	Very high	45 Å²	45	31.8 Å²	31.8	17%	0.17	19%	0.185	C	C	.	.	H	α-helix	trans	-61	-37.4	178.4	68.5	-107.1	0	0	0	112.2	F299 P347 I351 I352 G353 L394 V395 H398	F299-W349 HydrophobicContact CE1-CH2 4.35Å; F299-W349 HydrophobicContact CE1-CZ2 4.37Å; F299-W349 HydrophobicContact CE2-CH2 4.39Å; F299-W349 AromaticContact CZ-CH2 3.69Å; F299-W349 HydrophobicContact CZ-CH2 3.69Å; F299-W349 HydrophobicContact CZ-CZ2 4.05Å; P347-W349 HydrophobicContact CB-CG 4.41Å; P347-W349 HydrophobicContact CG-CD2 4.23Å; P347-W349 HydrophobicContact CG-CG 4.42Å; P347-W349 HydrophobicContact CG-CZ2 3.84Å; P347-W349 PolarHBondContact O-N 2.62Å; W349-I351 VanDerWaalsContact C-N 3.32Å; W349-I351 PolarHBondContact O-N 3Å; W349-I352 PolarHBondContact O-N 3.22Å; W349-G353 PolarHBondContact O-N 2.8Å; W349-L394 HydrophobicContact CB-CB 3.7Å; W349-L394 HydrophobicContact CG-CB 3.78Å; W349-V395 HydrophobicContact CB-CG2 3.88Å; W349-V395 WeakPolarHBondContact O-CG2 3.39Å; W349-H398 AromaticContact CD1-CD2 3.95Å; W349-H398 HydrophobicContact CD2-CB 4.31Å; W349-H398 AromaticContact CD2-CD2 3.65Å; W349-H398 AromaticContact CE2-CD2 3.21Å; W349-H398 AromaticContact CE2-CG 3.77Å; W349-H398 AromaticContact CE2-NE2 3.77Å; W349-H398 HydrophobicContact CE3-CB 3.95Å; W349-H398 HydrophobicContact CH2-CB 3.45Å; W349-H398 VanDerWaalsContact CH2-CB 3.45Å; W349-H398 AromaticContact CH2-CG 3.73Å; W349-H398 HydrophobicContact CZ2-CB 3.8Å; W349-H398 AromaticContact CZ2-CD2 3.46Å; W349-H398 VanDerWaalsContact CZ2-CD2 3.46Å; W349-H398 WeakPolarHBondContact CZ2-CD2 3.38Å; W349-H398 AromaticContact CZ2-CG 3.52Å; W349-H398 AromaticContact CZ2-NE2 3.98Å; W349-H398 HydrophobicContact CZ3-CB 3.52Å; W349-H398 AromaticContact NE1-CD2 3.37Å; W349-H398 PolarHBondContact NE1-CD2 3.21Å; W349-H398 AromaticContact NE1-NE2 3.53Å
350	A	97.4	Very high	91.2	Very high	12 Å²	12	33.7 Å²	33.7	10%	0.099	20%	0.202	C	C	.	.	H	α-helix	trans	-67.3	-34.2	179.5	0	0	0	0	0	112	F299 L346 P347 R348 W354	F299-A350 HydrophobicContact CD2-CB 4.32Å; F299-A350 HydrophobicContact CE2-CB 3.7Å; F299-A350 HydrophobicContact CZ-CB 4.48Å; L346-A350 HydrophobicContact CD1-CB 3.83Å; P347-A350 HydrophobicContact CG-CB 4.05Å; P347-A350 WeakPolarHBondContact O-CB 3.42Å; P347-A350 PolarHBondContact O-N 2.66Å; R348-A350 VanDerWaalsContact C-N 3.31Å; R348-A350 PolarHBondContact O-N 2.77Å; A350-W354 PolarHBondContact O-N 2.75Å; A350-W354 VanDerWaalsContact O-N 3.13Å
351	I	98.1	Very high	92.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.9	-42.4	173.3	-53	-172.5	0	0	0	110.8	L290 M293 T294 I330 L346 P347 R348 W349 G353 W354 L355	L290-I351 HydrophobicContact CD2-CG2 4.37Å; M293-I351 HydrophobicContact CB-CD1 4.1Å; M293-I351 HydrophobicContact CE-CD1 4.39Å; T294-I351 HydrophobicContact CG2-CD1 3.38Å; I330-I351 HydrophobicContact CD1-CB 4.3Å; I330-I351 HydrophobicContact CD1-CG2 3.61Å; L346-I351 HydrophobicContact CD1-CG1 4.3Å; L346-I351 HydrophobicContact CD2-CD1 3.76Å; L346-I351 HydrophobicContact CD2-CG1 3.79Å; L346-I351 HydrophobicContact CG-CD1 4.07Å; L346-I351 HydrophobicContact CG-CG1 3.85Å; P347-I351 PolarHBondContact O-N 3.42Å; R348-I351 PolarHBondContact O-N 3.01Å; W349-I351 VanDerWaalsContact C-N 3.32Å; W349-I351 PolarHBondContact O-N 3Å; I351-G353 VanDerWaalsContact C-N 3.34Å; I351-G353 PolarHBondContact O-N 3.5Å; I351-W354 HydrophobicContact CG2-CE3 3.82Å; I351-W354 HydrophobicContact CG2-CZ3 3.9Å; I351-W354 PolarHBondContact O-N 3.44Å; I351-L355 HydrophobicContact CG2-CD1 4.23Å; I351-L355 HydrophobicContact CG2-CG 4.43Å; I351-L355 WeakPolarHBondContact O-CG 3.4Å; I351-L355 PolarHBondContact O-N 2.94Å
352	I	98.4	Very high	92.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.2	-44.3	174	-62.3	-66.2	0	0	0	111	I327 I330 R348 W349 W354 L355 L356 L372 P391 V395	I327-I352 HydrophobicContact CB-CD1 4.16Å; I327-I352 HydrophobicContact CG1-CD1 3.85Å; I327-I352 HydrophobicContact CG2-CD1 4.13Å; I330-I352 HydrophobicContact CB-CD1 3.94Å; I330-I352 HydrophobicContact CD1-CD1 4.12Å; I330-I352 HydrophobicContact CG2-CD1 3.79Å; I330-I352 HydrophobicContact CG2-CG1 4.01Å; R348-I352 WeakPolarHBondContact O-CG1 3.25Å; R348-I352 PolarHBondContact O-N 3.45Å; W349-I352 PolarHBondContact O-N 3.22Å; I352-W354 PolarHBondContact O-N 3.26Å; I352-L355 PolarHBondContact O-N 3.28Å; I352-L356 HydrophobicContact CG2-CD1 4.04Å; I352-L356 HydrophobicContact CG2-CG 4.4Å; I352-L356 WeakPolarHBondContact O-CG 3.21Å; I352-L356 PolarHBondContact O-N 2.99Å; I352-L372 HydrophobicContact CG2-CD1 3.83Å; I352-L372 HydrophobicContact CG2-CD2 3.71Å; I352-L372 HydrophobicContact CG2-CG 4.37Å; I352-P391 HydrophobicContact CG1-CB 4.1Å; I352-V395 HydrophobicContact CB-CG2 3.9Å; I352-V395 HydrophobicContact CG2-CG2 3.85Å
353	G	96.5	Very high	93.7	Very high	11 Å²	11	37.4 Å²	37.4	11%	0.113	22%	0.22	C	C	.	.	H	α-helix	trans	-56.8	-48.7	177.2	0	0	0	0	0	112.4	W349 I351 L356 T357	W349-G353 PolarHBondContact O-N 2.8Å; I351-G353 VanDerWaalsContact C-N 3.34Å; I351-G353 PolarHBondContact O-N 3.5Å; G353-L356 WeakPolarHBondContact O-CB 3.42Å; G353-L356 PolarHBondContact O-N 3.5Å; G353-T357 WeakPolarHBondContact O-CG2 3.42Å; G353-T357 PolarHBondContact O-N 3.22Å
354	W	97.6	Very high	94.1	Very high	7 Å²	7	35.9 Å²	35.9	3%	0.027	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-44	173.4	159.5	67.7	0	0	0	113	M293 Q306 F309 Q310 L314 A350 I351 I352 L356 T357 T358	M293-W354 HydrophobicContact CE-CZ3 4.25Å; Q306-W354 HydrophobicContact CB-CD2 4.13Å; Q306-W354 HydrophobicContact CB-CH2 4.39Å; Q306-W354 HydrophobicContact CB-CZ2 3.78Å; Q306-W354 HydrophobicContact CG-CD2 3.7Å; Q306-W354 HydrophobicContact CG-CE3 3.98Å; Q306-W354 HydrophobicContact CG-CG 4.13Å; Q306-W354 HydrophobicContact CG-CH2 4.28Å; Q306-W354 HydrophobicContact CG-CZ2 4.04Å; Q306-W354 HydrophobicContact CG-CZ3 4.26Å; Q306-W354 VanDerWaalsContact NE2-CB 3.31Å; Q306-W354 VanDerWaalsContact NE2-CG 3.34Å; Q306-W354 WeakPolarHBondContact O-CZ2 3.47Å; F309-W354 HydrophobicContact CB-CH2 4Å; F309-W354 HydrophobicContact CB-CZ2 4.49Å; F309-W354 AromaticContact CD1-CH2 3.77Å; F309-W354 HydrophobicContact CD1-CH2 3.77Å; F309-W354 HydrophobicContact CG-CH2 4.07Å; Q310-W354 HydrophobicContact CB-CZ2 4.2Å; Q310-W354 VanDerWaalsContact OE1-NE1 3.11Å; L314-W354 HydrophobicContact CD1-CH2 4.15Å; L314-W354 HydrophobicContact CD1-CZ2 4.19Å; A350-W354 PolarHBondContact O-N 2.75Å; A350-W354 VanDerWaalsContact O-N 3.13Å; I351-W354 HydrophobicContact CG2-CE3 3.82Å; I351-W354 HydrophobicContact CG2-CZ3 3.9Å; I351-W354 PolarHBondContact O-N 3.44Å; I352-W354 PolarHBondContact O-N 3.26Å; W354-L356 PolarHBondContact O-N 2.79Å; W354-T357 PolarHBondContact O-N 3.04Å; W354-T357 VanDerWaalsContact O-N 3.14Å; W354-T357 PolarHBondContact O-OG1 3.09Å; W354-T357 VanDerWaalsContact O-OG1 3.08Å; W354-T358 WeakPolarHBondContact O-CG2 3.13Å; W354-T358 PolarHBondContact O-N 3.21Å
355	L	97.7	Very high	94.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-34.6	176.7	-72.8	174.9	0	0	0	112.1	L314 L326 I327 I330 I351 I352 T358	L314-L355 HydrophobicContact CD1-CD2 3.65Å; L326-L355 HydrophobicContact CB-CD1 3.85Å; L326-L355 HydrophobicContact CD1-CD2 3.91Å; I327-L355 HydrophobicContact CG1-CB 4.45Å; I327-L355 HydrophobicContact CG1-CD1 4.15Å; I330-L355 HydrophobicContact CD1-CD1 3.63Å; I351-L355 HydrophobicContact CG2-CD1 4.23Å; I351-L355 HydrophobicContact CG2-CG 4.43Å; I351-L355 WeakPolarHBondContact O-CG 3.4Å; I351-L355 PolarHBondContact O-N 2.94Å; I352-L355 PolarHBondContact O-N 3.28Å; L355-T358 PolarHBondContact O-OG1 3.47Å
356	L	95.6	Very high	94.3	Very high	25 Å²	25	35 Å²	35	13%	0.131	21%	0.213	C	C	.	.	H	α-helix	trans	-70.1	-41.9	173	-69.8	169.8	0	0	0	112.8	I352 G353 W354 T358 C359 A368 K369 L372 V395 L410	I352-L356 HydrophobicContact CG2-CD1 4.04Å; I352-L356 HydrophobicContact CG2-CG 4.4Å; I352-L356 WeakPolarHBondContact O-CG 3.21Å; I352-L356 PolarHBondContact O-N 2.99Å; G353-L356 WeakPolarHBondContact O-CB 3.42Å; G353-L356 PolarHBondContact O-N 3.5Å; W354-L356 PolarHBondContact O-N 2.79Å; L356-T358 VanDerWaalsContact C-N 3.29Å; L356-T358 PolarHBondContact O-N 3.26Å; L356-C359 WeakPolarHBondContact O-CB 3.49Å; L356-C359 PolarHBondContact O-N 3.18Å; L356-A368 HydrophobicContact CD2-CB 3.87Å; L356-K369 HydrophobicContact CD2-CG 4.4Å; L356-L372 HydrophobicContact CD1-CD2 4.13Å; L356-V395 HydrophobicContact CD1-CG1 4.39Å; L356-L410 HydrophobicContact CD1-CD1 4.23Å; L356-L410 HydrophobicContact CD1-CD2 4.31Å
357	T	93	Very high	94.3	Very high	63 Å²	63	37.3 Å²	37.3	39%	0.387	23%	0.225	S	C	.	.	H	α-helix	trans	-68.8	-26.6	178.2	61.4	0	0	0	0	113	G353 W354 C359 I406	G353-T357 WeakPolarHBondContact O-CG2 3.42Å; G353-T357 PolarHBondContact O-N 3.22Å; W354-T357 PolarHBondContact O-N 3.04Å; W354-T357 VanDerWaalsContact O-N 3.14Å; W354-T357 PolarHBondContact O-OG1 3.09Å; W354-T357 VanDerWaalsContact O-OG1 3.08Å; T357-C359 VanDerWaalsContact C-N 3.26Å; T357-C359 PolarHBondContact O-N 3.5Å; T357-I406 HydrophobicContact CG2-CD1 3.74Å
358	T	93	Very high	94.4	Very high	14 Å²	14	35.6 Å²	35.6	9%	0.086	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	1.7	174.6	67.7	0	0	0	0	115.1	Q310 R323 W354 L355 L356 T360	Q310-T358 VanDerWaalsContact OE1-CG2 3.23Å; R323-T358 PolarHBondContact NE-O 2.83Å; R323-T358 PolarHBondContact NE-OG1 2.89Å; R323-T358 PolarHBondContact NH2-O 3.46Å; W354-T358 WeakPolarHBondContact O-CG2 3.13Å; W354-T358 PolarHBondContact O-N 3.21Å; L355-T358 PolarHBondContact O-OG1 3.47Å; L356-T358 VanDerWaalsContact C-N 3.29Å; L356-T358 PolarHBondContact O-N 3.26Å; T358-T360 PolarHBondContact O-N 2.74Å
359	C	91.1	Very high	94.4	Very high	23 Å²	23	36.6 Å²	36.6	16%	0.155	22%	0.219	C	C	.	.			trans	-73.5	108.9	178.3	-76.2	0	0	0	0	111.7	L356 T357 S361 A365	L356-C359 WeakPolarHBondContact O-CB 3.49Å; L356-C359 PolarHBondContact O-N 3.18Å; T357-C359 VanDerWaalsContact C-N 3.26Å; T357-C359 PolarHBondContact O-N 3.5Å; C359-S361 VanDerWaalsContact C-N 3.32Å; C359-S361 PolarHBondContact O-N 3.32Å; C359-A365 HydrophobicContact CB-CB 3.93Å
360	T	90.8	Very high	94.5	Very high	108 Å²	108	35.1 Å²	35.1	66%	0.663	21%	0.214	S	C	*	.			trans	-86.1	3.1	-177.3	64.3	0	0	0	0	114.4	Q320 T358	Q320-T360 PolarHBondContact NE2-OG1 3.16Å; Q320-T360 VanDerWaalsContact NE2-OG1 3.09Å; Q320-T360 PolarHBondContact OE1-OG1 3.3Å; T358-T360 PolarHBondContact O-N 2.74Å
361	S	90.5	Very high	94.5	Very high	48 Å²	48	34.6 Å²	34.6	34%	0.336	21%	0.21	S	C	.	.	S	Bend	trans	-145.6	148	176.6	71.6	0	0	0	0	113	C359 V363 A364 A365	C359-S361 VanDerWaalsContact C-N 3.32Å; C359-S361 PolarHBondContact O-N 3.32Å; S361-V363 PolarHBondContact O-N 2.72Å; S361-A364 PolarHBondContact O-N 2.96Å; S361-A364 VanDerWaalsContact O-N 3.12Å; S361-A364 VanDerWaalsContact OG-CB 3.32Å; S361-A364 WeakPolarHBondContact OG-CB 3.37Å; S361-A364 PolarHBondContact OG-N 3.33Å; S361-A365 PolarHBondContact O-N 2.81Å
362	N	88.6	Confident	94.5	Very high	142 Å²	142	34.6 Å²	34.6	76%	0.759	21%	0.21	S	C	*	.	H	α-helix	trans	-60.5	-29.5	178.3	-70.5	-19.8	0	0	0	113.1	S366	N362-S366 VanDerWaalsContact O-CB 3.28Å; N362-S366 WeakPolarHBondContact O-CB 3.36Å; N362-S366 PolarHBondContact O-N 3.15Å; N362-S366 PolarHBondContact O-OG 3.16Å
363	V	90.3	Very high	94.6	Very high	102 Å²	102	34.7 Å²	34.7	62%	0.618	21%	0.21	S	C	*	.	H	α-helix	trans	-68.9	-47.5	174.9	179.7	0	0	0	0	110.3	S361 S366 N367	S361-V363 PolarHBondContact O-N 2.72Å; V363-S366 PolarHBondContact O-N 3.27Å; V363-N367 WeakPolarHBondContact O-CB 3.44Å; V363-N367 VanDerWaalsContact O-CG 3.26Å; V363-N367 PolarHBondContact O-N 3.4Å
364	A	90.3	Very high	94.6	Very high	7 Å²	7	34.3 Å²	34.3	6%	0.058	21%	0.205	C	C	.	.	H	α-helix	trans	-62.6	-45.6	176.7	0	0	0	0	0	111.7	Q320 S361 S366 N367 A368	Q320-A364 HydrophobicContact CB-CB 3.82Å; Q320-A364 HydrophobicContact CG-CB 4.49Å; S361-A364 PolarHBondContact O-N 2.96Å; S361-A364 VanDerWaalsContact O-N 3.12Å; S361-A364 VanDerWaalsContact OG-CB 3.32Å; S361-A364 WeakPolarHBondContact OG-CB 3.37Å; S361-A364 PolarHBondContact OG-N 3.33Å; A364-S366 PolarHBondContact O-N 2.54Å; A364-N367 PolarHBondContact O-N 3.41Å; A364-A368 VanDerWaalsContact O-CB 3.23Å; A364-A368 WeakPolarHBondContact O-CB 3.37Å; A364-A368 PolarHBondContact O-N 2.77Å
365	A	91.9	Very high	94.7	Very high	22 Å²	22	34 Å²	34	18%	0.182	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-42.9	176.1	0	0	0	0	0	112.5	C359 S361 A368 K369	C359-A365 HydrophobicContact CB-CB 3.93Å; S361-A365 PolarHBondContact O-N 2.81Å; A365-A368 PolarHBondContact O-N 3.06Å; A365-K369 VanDerWaalsContact O-CG 3.27Å; A365-K369 WeakPolarHBondContact O-CG 3.44Å; A365-K369 PolarHBondContact O-N 2.79Å
366	S	93.9	Very high	94.7	Very high	58 Å²	58	34.1 Å²	34.1	41%	0.406	21%	0.205	S	C	.	.	H	α-helix	trans	-65.8	-42.5	177.7	-58.7	0	0	0	0	112	N362 V363 A364 A368 K369 L370	N362-S366 VanDerWaalsContact O-CB 3.28Å; N362-S366 WeakPolarHBondContact O-CB 3.36Å; N362-S366 PolarHBondContact O-N 3.15Å; N362-S366 PolarHBondContact O-OG 3.16Å; V363-S366 PolarHBondContact O-N 3.27Å; A364-S366 PolarHBondContact O-N 2.54Å; S366-A368 VanDerWaalsContact C-N 3.35Å; S366-K369 PolarHBondContact O-N 3Å; S366-L370 WeakPolarHBondContact O-CB 3.27Å; S366-L370 PolarHBondContact O-N 3.02Å
367	N	94.4	Very high	94.9	Very high	51 Å²	51	33 Å²	33	27%	0.273	20%	0.199	S	C	.	.	H	α-helix	trans	-68.5	-34.5	177	-68.3	-12.2	0	0	0	111.9	C324 V363 A364 L370 A371	C324-N367 VanDerWaalsContact SG-C 3.59Å; C324-N367 VanDerWaalsContact SG-CB 3.58Å; V363-N367 WeakPolarHBondContact O-CB 3.44Å; V363-N367 VanDerWaalsContact O-CG 3.26Å; V363-N367 PolarHBondContact O-N 3.4Å; A364-N367 PolarHBondContact O-N 3.41Å; N367-L370 PolarHBondContact O-N 2.85Å; N367-A371 VanDerWaalsContact O-CB 3.32Å; N367-A371 WeakPolarHBondContact O-CB 3.2Å; N367-A371 PolarHBondContact O-N 3.23Å
368	A	97.9	Very high	95.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.3	-45.8	174.9	0	0	0	0	0	112	I327 L356 A364 A365 S366 L370 A371 L372	I327-A368 HydrophobicContact CD1-CB 3.62Å; L356-A368 HydrophobicContact CD2-CB 3.87Å; A364-A368 VanDerWaalsContact O-CB 3.23Å; A364-A368 WeakPolarHBondContact O-CB 3.37Å; A364-A368 PolarHBondContact O-N 2.77Å; A365-A368 PolarHBondContact O-N 3.06Å; S366-A368 VanDerWaalsContact C-N 3.35Å; A368-L370 PolarHBondContact O-N 3.27Å; A368-A371 PolarHBondContact O-N 3.03Å; A368-L372 WeakPolarHBondContact O-CB 3.46Å; A368-L372 PolarHBondContact O-N 2.86Å
369	K	98.3	Very high	95.4	Very high	30 Å²	30	30.2 Å²	30.2	13%	0.13	18%	0.18	C	C	.	.	H	α-helix	trans	-59.3	-44.9	172.2	-68.1	174.8	-173.2	-170.1	0	111.7	L356 A365 S366 A371 L372 F373 T409 L410 F413	L356-K369 HydrophobicContact CD2-CG 4.4Å; A365-K369 VanDerWaalsContact O-CG 3.27Å; A365-K369 WeakPolarHBondContact O-CG 3.44Å; A365-K369 PolarHBondContact O-N 2.79Å; S366-K369 PolarHBondContact O-N 3Å; K369-A371 PolarHBondContact O-N 3.01Å; K369-L372 WeakPolarHBondContact O-CB 3.24Å; K369-L372 PolarHBondContact O-N 3.12Å; K369-F373 WeakPolarHBondContact O-CD2 3.26Å; K369-F373 PolarHBondContact O-N 3.41Å; K369-T409 PolarHBondContact NZ-O 3.06Å; K369-T409 PolarHBondContact NZ-OG1 2.7Å; K369-L410 HydrophobicContact CG-CD2 3.92Å; K369-F413 HydrophobicContact CB-CD1 4.02Å; K369-F413 HydrophobicContact CB-CD2 3.87Å; K369-F413 HydrophobicContact CB-CE1 4.09Å; K369-F413 HydrophobicContact CB-CE2 3.93Å; K369-F413 HydrophobicContact CB-CG 3.92Å; K369-F413 HydrophobicContact CB-CZ 4.05Å; K369-F413 HydrophobicContact CD-CB 4.07Å; K369-F413 HydrophobicContact CD-CD2 3.83Å; K369-F413 HydrophobicContact CD-CG 3.99Å
370	L	98.4	Very high	95.6	Very high	15 Å²	15	31.1 Å²	31.1	8%	0.079	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-40.3	177.3	-173.8	51.3	0	0	0	112	S366 N367 A368 L372 F373 Y374 L377 F413 I417 F421	S366-L370 WeakPolarHBondContact O-CB 3.27Å; S366-L370 PolarHBondContact O-N 3.02Å; N367-L370 PolarHBondContact O-N 2.85Å; A368-L370 PolarHBondContact O-N 3.27Å; L370-L372 VanDerWaalsContact C-N 3.31Å; L370-L372 PolarHBondContact O-N 3.21Å; L370-F373 PolarHBondContact O-N 3.29Å; L370-Y374 HydrophobicContact CD1-CD2 3.93Å; L370-Y374 HydrophobicContact CD1-CE2 4.09Å; L370-Y374 HydrophobicContact CD2-CE2 4.36Å; L370-Y374 HydrophobicContact CG-CD2 3.87Å; L370-Y374 HydrophobicContact CG-CE2 3.98Å; L370-Y374 WeakPolarHBondContact O-CA 3.43Å; L370-Y374 WeakPolarHBondContact O-CB 3.47Å; L370-Y374 WeakPolarHBondContact O-CD2 3.36Å; L370-Y374 PolarHBondContact O-N 3.48Å; L370-L377 HydrophobicContact CD1-CD1 4.04Å; L370-F413 HydrophobicContact CB-CZ 3.79Å; L370-F413 HydrophobicContact CD1-CZ 4.13Å; L370-F413 HydrophobicContact CG-CZ 4.5Å; L370-I417 HydrophobicContact CD1-CD1 4.08Å; L370-I417 HydrophobicContact CD1-CG1 4.15Å; L370-F421 HydrophobicContact CD1-CD2 4.25Å; L370-F421 HydrophobicContact CD1-CE2 4.35Å
371	A	98.5	Very high	95.7	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-62.7	-37.2	174.6	0	0	0	0	0	112.6	C324 I327 R328 N367 A368 K369	C324-A371 HydrophobicContact CB-CB 4.24Å; I327-A371 HydrophobicContact CB-CB 4.45Å; I327-A371 HydrophobicContact CG2-CB 3.99Å; R328-A371 WeakPolarHBondContact CD-O 3.34Å; R328-A371 HydrophobicContact CG-CB 4.14Å; R328-A371 PolarHBondContact NH1-O 2.88Å; N367-A371 VanDerWaalsContact O-CB 3.32Å; N367-A371 WeakPolarHBondContact O-CB 3.2Å; N367-A371 PolarHBondContact O-N 3.23Å; A368-A371 PolarHBondContact O-N 3.03Å; K369-A371 PolarHBondContact O-N 3.01Å
372	L	98.8	Very high	95.8	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-67.4	-44.2	176.3	178.6	56.9	0	0	0	111.9	I327 I352 L356 A368 K369 L370 P391 A392 L410	I327-L372 HydrophobicContact CG2-CB 3.89Å; I327-L372 HydrophobicContact CG2-CD1 4.44Å; I352-L372 HydrophobicContact CG2-CD1 3.83Å; I352-L372 HydrophobicContact CG2-CD2 3.71Å; I352-L372 HydrophobicContact CG2-CG 4.37Å; L356-L372 HydrophobicContact CD1-CD2 4.13Å; A368-L372 WeakPolarHBondContact O-CB 3.46Å; A368-L372 PolarHBondContact O-N 2.86Å; K369-L372 WeakPolarHBondContact O-CB 3.24Å; K369-L372 PolarHBondContact O-N 3.12Å; L370-L372 VanDerWaalsContact C-N 3.31Å; L370-L372 PolarHBondContact O-N 3.21Å; L372-P391 HydrophobicContact CD1-CB 4.41Å; L372-A392 HydrophobicContact CD1-CB 3.85Å; L372-A392 HydrophobicContact CD2-CB 4.14Å; L372-A392 HydrophobicContact CG-CB 3.73Å; L372-L410 HydrophobicContact CD2-CD2 4.02Å
373	F	98.7	Very high	95.9	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.009	18%	0.176	C	C	.	.	H	α-helix	trans	-84.7	0.3	178	-75.3	-72.6	0	0	0	114.5	K369 L370 D375 W376 L377 A392 M396 L410 F413 M414	K369-F373 WeakPolarHBondContact O-CD2 3.26Å; K369-F373 PolarHBondContact O-N 3.41Å; L370-F373 PolarHBondContact O-N 3.29Å; F373-D375 VanDerWaalsContact C-N 3.3Å; F373-D375 PolarHBondContact O-N 3.02Å; F373-W376 HydrophobicContact CD1-CB 4.34Å; F373-W376 AromaticContact CD1-CD1 3.89Å; F373-W376 AromaticContact CD1-CD2 3.72Å; F373-W376 HydrophobicContact CD1-CD2 3.72Å; F373-W376 AromaticContact CD1-CE2 3.93Å; F373-W376 HydrophobicContact CD1-CE3 4.21Å; F373-W376 AromaticContact CD1-CG 3.76Å; F373-W376 HydrophobicContact CD1-CG 3.76Å; F373-W376 AromaticContact CD1-NE1 3.98Å; F373-W376 HydrophobicContact CE1-CD2 4.06Å; F373-W376 HydrophobicContact CE1-CE3 4.25Å; F373-W376 HydrophobicContact CE1-CH2 4.47Å; F373-W376 HydrophobicContact CE1-CZ2 4.29Å; F373-W376 HydrophobicContact CE1-CZ3 4.43Å; F373-W376 VanDerWaalsContact O-CB 3.27Å; F373-W376 WeakPolarHBondContact O-CB 3.23Å; F373-W376 PolarHBondContact O-N 3.4Å; F373-L377 PolarHBondContact O-N 3.35Å; F373-A392 HydrophobicContact CD1-CB 4.37Å; F373-A392 HydrophobicContact CE1-CB 4.03Å; F373-A392 HydrophobicContact CZ-CB 4.33Å; F373-M396 HydrophobicContact CE1-CE 4.04Å; F373-M396 HydrophobicContact CZ-CE 3.75Å; F373-M396 HydrophobicContact CZ-SD 4.25Å; F373-L410 HydrophobicContact CE2-CB 4.29Å; F373-L410 HydrophobicContact CE2-CD2 3.81Å; F373-L410 HydrophobicContact CZ-CB 4.4Å; F373-F413 HydrophobicContact CB-CE1 4.29Å; F373-F413 AromaticContact CD2-CD1 3.51Å; F373-F413 HydrophobicContact CD2-CD1 3.51Å; F373-F413 AromaticContact CD2-CE1 3.82Å; F373-F413 HydrophobicContact CD2-CE1 3.82Å; F373-F413 AromaticContact CE2-CD1 3.92Å; F373-F413 HydrophobicContact CE2-CD1 3.92Å; F373-F413 HydrophobicContact CG-CD1 4.38Å; F373-F413 HydrophobicContact CG-CE1 4.41Å; F373-M414 HydrophobicContact CE1-CB 4.08Å; F373-M414 HydrophobicContact CE1-CG 4.07Å; F373-M414 HydrophobicContact CE1-SD 4.11Å; F373-M414 HydrophobicContact CE2-CB 4.49Å; F373-M414 HydrophobicContact CZ-CB 3.94Å; F373-M414 HydrophobicContact CZ-CG 4.43Å
374	Y	98.4	Very high	96	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.008	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-31.3	-168.2	-140.7	-92.5	0	0	0	114.8	R229 R233 Q236 L370 L377 F421	R229-Y374 HydrophobicContact CB-CE1 4.31Å; R229-Y374 HydrophobicContact CG-CD1 4.36Å; R229-Y374 WeakPolarHBondContact O-CE1 3.29Å; R233-Y374 WeakPolarHBondContact CA-OH 3.49Å; R233-Y374 HydrophobicContact CB-CD1 4.38Å; R233-Y374 HydrophobicContact CB-CD2 4.25Å; R233-Y374 HydrophobicContact CB-CE1 3.88Å; R233-Y374 HydrophobicContact CB-CE2 3.73Å; R233-Y374 HydrophobicContact CG-CD2 4Å; R233-Y374 HydrophobicContact CG-CE2 3.75Å; R233-Y374 PolarHBondContact N-OH 2.95Å; R233-Y374 VanDerWaalsContact N-OH 3.11Å; Q236-Y374 PolarHBondContact OE1-OH 3.28Å; L370-Y374 HydrophobicContact CD1-CD2 3.93Å; L370-Y374 HydrophobicContact CD1-CE2 4.09Å; L370-Y374 HydrophobicContact CD2-CE2 4.36Å; L370-Y374 HydrophobicContact CG-CD2 3.87Å; L370-Y374 HydrophobicContact CG-CE2 3.98Å; L370-Y374 WeakPolarHBondContact O-CA 3.43Å; L370-Y374 WeakPolarHBondContact O-CB 3.47Å; L370-Y374 WeakPolarHBondContact O-CD2 3.36Å; L370-Y374 PolarHBondContact O-N 3.48Å; Y374-L377 HydrophobicContact CD2-CD1 4.29Å; Y374-L377 HydrophobicContact CE2-CD1 4.39Å; Y374-F421 HydrophobicContact CE2-CE2 4.03Å; Y374-F421 HydrophobicContact CE2-CZ 4.44Å
375	D	98.3	Very high	96.3	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.011	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-16	175.4	-68.9	-46.9	0	0	0	113.2	R229 R328 F373 F379 N388 I389	R229-D375 WeakPolarHBondContact CD-OD1 3.01Å; R229-D375 IonicContact CZ-OD1 2.68Å; R229-D375 IonicContact NE-OD1 3.83Å; R229-D375 IonicContact NH1-OD1 3.27Å; R229-D375 PolarHBondContact NH1-OD1 3.09Å; R328-D375 IonicContact CZ-OD1 2.69Å; R328-D375 IonicContact CZ-OD2 2.61Å; R328-D375 VanDerWaalsContact CZ-OD2 3.3Å; R328-D375 IonicContact NH1-OD1 3.69Å; R328-D375 IonicContact NH1-OD2 2.69Å; R328-D375 PolarHBondContact NH1-OD2 3.2Å; R328-D375 VanDerWaalsContact NH2-CG 3.31Å; R328-D375 IonicContact NH2-OD1 3.61Å; R328-D375 PolarHBondContact NH2-OD1 3.28Å; R328-D375 IonicContact NH2-OD2 2.72Å; R328-D375 PolarHBondContact NH2-OD2 2.9Å; F373-D375 VanDerWaalsContact C-N 3.3Å; F373-D375 PolarHBondContact O-N 3.02Å; D375-F379 WeakPolarHBondContact O-CB 3.26Å; D375-N388 HydrophobicContact CB-CB 3.97Å; D375-N388 PolarHBondContact OD2-ND2 2.93Å; D375-I389 HydrophobicContact CB-CG2 4.37Å
376	W	98.6	Very high	96.5	Very high	1 Å²	1	30.3 Å²	30.3	0%	0.004	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-38.6	175	-67.3	58.6	0	0	0	111.5	F373 F378 F379 I389 A392 I393 M414 G432 V433 S436 L437 I440	F373-W376 HydrophobicContact CD1-CB 4.34Å; F373-W376 AromaticContact CD1-CD1 3.89Å; F373-W376 AromaticContact CD1-CD2 3.72Å; F373-W376 HydrophobicContact CD1-CD2 3.72Å; F373-W376 AromaticContact CD1-CE2 3.93Å; F373-W376 HydrophobicContact CD1-CE3 4.21Å; F373-W376 AromaticContact CD1-CG 3.76Å; F373-W376 HydrophobicContact CD1-CG 3.76Å; F373-W376 AromaticContact CD1-NE1 3.98Å; F373-W376 HydrophobicContact CE1-CD2 4.06Å; F373-W376 HydrophobicContact CE1-CE3 4.25Å; F373-W376 HydrophobicContact CE1-CH2 4.47Å; F373-W376 HydrophobicContact CE1-CZ2 4.29Å; F373-W376 HydrophobicContact CE1-CZ3 4.43Å; F373-W376 VanDerWaalsContact O-CB 3.27Å; F373-W376 WeakPolarHBondContact O-CB 3.23Å; F373-W376 PolarHBondContact O-N 3.4Å; W376-F378 PolarHBondContact O-N 3.08Å; W376-F379 PolarHBondContact O-N 3.39Å; W376-I389 HydrophobicContact CD2-CB 4.35Å; W376-I389 HydrophobicContact CD2-CG2 4.41Å; W376-I389 HydrophobicContact CG-CB 4.37Å; W376-I389 HydrophobicContact CG-CG2 3.96Å; W376-I389 HydrophobicContact CZ2-CB 4.24Å; W376-I389 WeakPolarHBondContact CZ2-O 3.38Å; W376-I389 PolarHBondContact NE1-O 3.42Å; W376-A392 HydrophobicContact CZ2-CB 3.78Å; W376-I393 HydrophobicContact CH2-CB 4.19Å; W376-I393 HydrophobicContact CH2-CD1 4.38Å; W376-I393 HydrophobicContact CZ2-CB 4.25Å; W376-M414 HydrophobicContact CE3-SD 4.33Å; W376-M414 HydrophobicContact CZ3-SD 3.86Å; W376-G432 CarbonylContact O-C 2.94Å; W376-G432 WeakPolarHBondContact O-CA 3.35Å; W376-V433 HydrophobicContact CB-CG2 4.49Å; W376-V433 HydrophobicContact CE3-CG1 4.21Å; W376-V433 PolarHBondContact O-N 3.02Å; W376-S436 WeakPolarHBondContact CA-OG 3.4Å; W376-S436 VanDerWaalsContact CE3-CB 3.4Å; W376-L437 HydrophobicContact CH2-CD2 3.98Å; W376-L437 HydrophobicContact CZ3-CD2 3.63Å; W376-L437 HydrophobicContact CZ3-CG 3.89Å; W376-I440 HydrophobicContact CH2-CD1 3.39Å; W376-I440 HydrophobicContact CZ2-CD1 3.67Å; W376-I440 HydrophobicContact CZ3-CD1 4.19Å
377	L	98.4	Very high	96.7	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-32.1	-168.7	-61	174.3	0	0	0	114	L370 F373 Y374 I417 F421 V429	L370-L377 HydrophobicContact CD1-CD1 4.04Å; F373-L377 PolarHBondContact O-N 3.35Å; Y374-L377 HydrophobicContact CD2-CD1 4.29Å; Y374-L377 HydrophobicContact CE2-CD1 4.39Å; L377-I417 HydrophobicContact CD2-CG1 3.98Å; L377-I417 HydrophobicContact CD2-CG2 4.05Å; L377-F421 HydrophobicContact CD1-CD1 4.32Å; L377-F421 HydrophobicContact CD1-CD2 3.66Å; L377-F421 HydrophobicContact CD1-CE1 4.24Å; L377-F421 HydrophobicContact CD1-CE2 3.56Å; L377-F421 HydrophobicContact CD1-CG 4.05Å; L377-F421 HydrophobicContact CD1-CZ 3.87Å; L377-V429 HydrophobicContact CB-CG1 4.44Å; L377-V429 HydrophobicContact CD2-CG1 3.75Å; L377-V429 WeakPolarHBondContact O-CA 3.48Å
378	F	98.1	Very high	96.8	Very high	17 Å²	17	27.3 Å²	27.3	8%	0.075	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.1	35.4	179.1	-68.5	-92	0	0	0	111.2	L266 L269 T270 W376 N380 F421 L425 Q428 V429	L266-F378 HydrophobicContact CD1-CD1 3.94Å; L266-F378 HydrophobicContact CD1-CE1 3.66Å; L269-F378 HydrophobicContact CB-CD1 4.29Å; L269-F378 HydrophobicContact CB-CD2 3.75Å; L269-F378 HydrophobicContact CB-CE1 4.38Å; L269-F378 HydrophobicContact CB-CE2 3.88Å; L269-F378 HydrophobicContact CB-CG 3.98Å; L269-F378 HydrophobicContact CB-CZ 4.2Å; L269-F378 HydrophobicContact CD1-CD2 4.49Å; L269-F378 HydrophobicContact CD1-CE1 4.48Å; L269-F378 HydrophobicContact CD1-CE2 3.76Å; L269-F378 HydrophobicContact CD1-CZ 3.75Å; L269-F378 HydrophobicContact CD2-CD2 4.21Å; L269-F378 HydrophobicContact CD2-CE2 4Å; L269-F378 HydrophobicContact CG-CD2 4.36Å; L269-F378 HydrophobicContact CG-CE2 4.09Å; L269-F378 HydrophobicContact CG-CZ 4.45Å; T270-F378 HydrophobicContact CG2-CB 4.45Å; T270-F378 HydrophobicContact CG2-CD1 4.2Å; W376-F378 PolarHBondContact O-N 3.08Å; F378-N380 PolarHBondContact O-N 3.36Å; F378-F421 HydrophobicContact CE2-CD1 4.14Å; F378-F421 AromaticContact CE2-CE1 3.81Å; F378-F421 HydrophobicContact CE2-CE1 3.81Å; F378-L425 HydrophobicContact CE1-CB 4.48Å; F378-L425 HydrophobicContact CE1-CD1 4.22Å; F378-L425 HydrophobicContact CZ-CB 4.27Å; F378-L425 HydrophobicContact CZ-CD1 4.08Å; F378-Q428 HydrophobicContact CD1-CB 4.25Å; F378-Q428 HydrophobicContact CE1-CB 3.73Å; F378-V429 HydrophobicContact CE1-CG2 4.36Å; F378-V429 HydrophobicContact CE2-CG2 3.8Å; F378-V429 HydrophobicContact CZ-CG2 3.57Å
379	F	98.4	Very high	96.8	Very high	3 Å²	3	27.3 Å²	27.3	1%	0.013	14%	0.139	C	C	.	.			trans	-61.7	126.4	-175.6	-171.5	-95.3	0	0	0	112.5	D375 W376 P381 D384 I389 N435 S436 F439	D375-F379 WeakPolarHBondContact O-CB 3.26Å; W376-F379 PolarHBondContact O-N 3.39Å; F379-P381 HydrophobicContact CE1-CB 4.05Å; F379-D384 HydrophobicContact CD2-CB 3.5Å; F379-D384 HydrophobicContact CE2-CB 3.39Å; F379-D384 HydrophobicContact CG-CB 4.33Å; F379-D384 HydrophobicContact CZ-CB 4.13Å; F379-I389 HydrophobicContact CD2-CD1 4.13Å; F379-I389 HydrophobicContact CD2-CG2 3.61Å; F379-I389 HydrophobicContact CE1-CD1 4.16Å; F379-I389 HydrophobicContact CE2-CD1 3.7Å; F379-I389 HydrophobicContact CE2-CG1 4.06Å; F379-I389 HydrophobicContact CE2-CG2 3.81Å; F379-I389 HydrophobicContact CZ-CD1 3.74Å; F379-I389 HydrophobicContact CZ-CG1 4.45Å; F379-N435 HydrophobicContact CD1-CB 4.03Å; F379-N435 PolarHBondContact O-ND2 3.31Å; F379-S436 WeakPolarHBondContact CB-OG 3.23Å; F379-S436 WeakPolarHBondContact CG-OG 3.45Å; F379-F439 HydrophobicContact CE1-CB 3.91Å; F379-F439 AromaticContact CE1-CD1 3.76Å; F379-F439 HydrophobicContact CE1-CD1 3.76Å; F379-F439 HydrophobicContact CE1-CE1 4.43Å; F379-F439 AromaticContact CE1-CG 3.95Å; F379-F439 HydrophobicContact CE1-CG 3.95Å; F379-F439 HydrophobicContact CZ-CB 4.45Å; F379-F439 AromaticContact CZ-CD1 3.52Å; F379-F439 HydrophobicContact CZ-CD1 3.52Å; F379-F439 AromaticContact CZ-CE1 3.94Å; F379-F439 HydrophobicContact CZ-CE1 3.94Å; F379-F439 HydrophobicContact CZ-CG 4.19Å
380	N	95.7	Very high	96.8	Very high	41 Å²	41	26.8 Å²	26.8	22%	0.219	14%	0.137	C	C	.	.			trans	-121.3	119.2	169	175.9	-22.8	0	0	0	109.4	F378 E382 K383 D384	F378-N380 PolarHBondContact O-N 3.36Å; N380-E382 PolarHBondContact ND2-OE2 3.49Å; N380-E382 PolarHBondContact O-N 3.1Å; N380-E382 VanDerWaalsContact O-N 3.13Å; N380-E382 WeakPolarHBondContact OD1-CB 3.45Å; N380-E382 VanDerWaalsContact OD1-CG 3.31Å; N380-E382 WeakPolarHBondContact OD1-CG 3.21Å; N380-E382 PolarHBondContact OD1-N 3.29Å; N380-E382 PolarHBondContact OD1-OE2 2.91Å; N380-K383 HydrophobicContact CB-CB 4.43Å; N380-K383 PolarHBondContact O-N 3.16Å; N380-D384 PolarHBondContact N-OD2 2.91Å; N380-D384 VanDerWaalsContact N-OD2 3.16Å; N380-D384 PolarHBondContact O-N 3.03Å
381	P	93.5	Very high	96.8	Very high	56 Å²	56	26.1 Å²	26.1	36%	0.364	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.7	-177.4	27.2	-35.6	0	0	0	114.8	F379 K383 F439	F379-P381 HydrophobicContact CE1-CB 4.05Å; P381-K383 VanDerWaalsContact C-N 3.32Å; P381-F439 HydrophobicContact CB-CD2 3.58Å; P381-F439 HydrophobicContact CB-CE2 3.57Å; P381-F439 HydrophobicContact CB-CG 4.12Å; P381-F439 HydrophobicContact CB-CZ 4.09Å
382	E	93.1	Very high	96.8	Very high	160 Å²	160	26.1 Å²	26.1	75%	0.748	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.6	172.5	-51.7	171.5	138.9	0	0	113.1	N380	N380-E382 PolarHBondContact ND2-OE2 3.49Å; N380-E382 PolarHBondContact O-N 3.1Å; N380-E382 VanDerWaalsContact O-N 3.13Å; N380-E382 WeakPolarHBondContact OD1-CB 3.45Å; N380-E382 VanDerWaalsContact OD1-CG 3.31Å; N380-E382 WeakPolarHBondContact OD1-CG 3.21Å; N380-E382 PolarHBondContact OD1-N 3.29Å; N380-E382 PolarHBondContact OD1-OE2 2.91Å
383	K	89.8	Confident	96.8	Very high	113 Å²	113	26.1 Å²	26.1	49%	0.491	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.8	-35.6	-164.3	-64.4	176.9	-172	173.1	0	114.2	R272 N380 P381	R272-K383 WeakPolarHBondContact CD-O 3.38Å; R272-K383 PolarHBondContact NH1-O 2.71Å; N380-K383 HydrophobicContact CB-CB 4.43Å; N380-K383 PolarHBondContact O-N 3.16Å; P381-K383 VanDerWaalsContact C-N 3.32Å
384	D	93.4	Very high	96.7	Very high	13 Å²	13	27.3 Å²	27.3	7%	0.07	14%	0.14	C	C	.	.	S	Bend	trans	-98.8	152.9	179.6	-67.9	-59.8	0	0	0	110.3	R229 F379 N380	R229-D384 IonicContact CZ-OD1 2.69Å; R229-D384 IonicContact CZ-OD2 3.85Å; R229-D384 IonicContact NH1-OD1 3.96Å; R229-D384 PolarHBondContact NH1-OD1 2.84Å; R229-D384 IonicContact NH1-OD2 2.84Å; R229-D384 VanDerWaalsContact NH2-CG 3.34Å; R229-D384 IonicContact NH2-OD1 2.66Å; R229-D384 PolarHBondContact NH2-OD1 3.05Å; R229-D384 IonicContact NH2-OD2 2.85Å; R229-D384 PolarHBondContact NH2-OD2 3.3Å; F379-D384 HydrophobicContact CD2-CB 3.5Å; F379-D384 HydrophobicContact CE2-CB 3.39Å; F379-D384 HydrophobicContact CG-CB 4.33Å; F379-D384 HydrophobicContact CZ-CB 4.13Å; N380-D384 PolarHBondContact N-OD2 2.91Å; N380-D384 VanDerWaalsContact N-OD2 3.16Å; N380-D384 PolarHBondContact O-N 3.03Å
385	S	94.8	Very high	96.7	Very high	44 Å²	44	27.2 Å²	27.2	31%	0.308	14%	0.139	S	C	.	.			trans	-97.7	144.4	-177.5	-176.5	0	0	0	0	111.3	M387 N388	S385-M387 PolarHBondContact O-N 3.38Å; S385-M387 WeakPolarHBondContact OG-CG 3.5Å; S385-M387 PolarHBondContact OG-N 3.27Å; S385-N388 WeakPolarHBondContact O-CB 3.36Å; S385-N388 PolarHBondContact O-N 3.21Å
386	I	97.3	Very high	96.7	Very high	27 Å²	27	27.1 Å²	27.1	14%	0.138	14%	0.139	C	C	.	.	H	α-helix	trans	-50.7	-37	167.2	-174.3	63.3	0	0	0	111.1	N388 I389 E390 F439 I440 K443 V445	I386-N388 PolarHBondContact O-N 2.94Å; I386-N388 VanDerWaalsContact O-N 3.09Å; I386-I389 HydrophobicContact CD1-CD1 4.07Å; I386-I389 HydrophobicContact CD1-CG1 4.03Å; I386-I389 VanDerWaalsContact O-CG1 3.29Å; I386-I389 WeakPolarHBondContact O-CG1 3.15Å; I386-I389 PolarHBondContact O-N 2.59Å; I386-E390 PolarHBondContact O-N 3.01Å; I386-F439 HydrophobicContact CB-CD1 4.07Å; I386-F439 HydrophobicContact CB-CE1 3.85Å; I386-F439 HydrophobicContact CD1-CD1 4.01Å; I386-I440 HydrophobicContact CD1-CG1 3.83Å; I386-K443 HydrophobicContact CB-CG 4.39Å; I386-K443 HydrophobicContact CD1-CB 4.19Å; I386-K443 HydrophobicContact CD1-CG 4.42Å; I386-K443 HydrophobicContact CG1-CB 4.07Å; I386-K443 HydrophobicContact CG1-CG 4.27Å; I386-V445 HydrophobicContact CD1-CG2 3.86Å; I386-V445 HydrophobicContact CG1-CG2 3.67Å
387	M	96.9	Very high	96.6	Very high	24 Å²	24	31 Å²	31	12%	0.118	16%	0.157	C	C	.	.	H	α-helix	trans	-61.8	-20.8	-179.9	-55.6	-54.5	-75.4	0	0	113.7	C331 H335 L341 R348 S385	C331-M387 VanDerWaalsContact O-O 3.12Å; H335-M387 HydrophobicContact CB-CB 4.3Å; H335-M387 HydrophobicContact CB-CE 4.37Å; H335-M387 HydrophobicContact CB-CG 4.29Å; H335-M387 VanDerWaalsContact CD2-CB 3.41Å; H335-M387 WeakPolarHBondContact CD2-CB 3.44Å; H335-M387 WeakPolarHBondContact NE2-CB 3.16Å; L341-M387 HydrophobicContact CD1-CE 3.86Å; L341-M387 HydrophobicContact CD2-CE 4.32Å; R348-M387 VanDerWaalsContact CZ-O 3.3Å; R348-M387 PolarHBondContact NH1-O 2.94Å; R348-M387 PolarHBondContact NH2-O 2.63Å; S385-M387 PolarHBondContact O-N 3.38Å; S385-M387 WeakPolarHBondContact OG-CG 3.5Å; S385-M387 PolarHBondContact OG-N 3.27Å
388	N	96.9	Very high	96.5	Very high	21 Å²	21	34.7 Å²	34.7	11%	0.112	17%	0.173	C	C	.	.	H	α-helix	trans	-81.3	-26.4	175.1	-77	58.3	0	0	0	113	C331 H335 D375 S385 I386	C331-N388 WeakPolarHBondContact O-CA 3.38Å; H335-N388 PolarHBondContact CE1-OD1 2.69Å; H335-N388 PolarHBondContact NE2-OD1 2.97Å; D375-N388 HydrophobicContact CB-CB 3.97Å; D375-N388 PolarHBondContact OD2-ND2 2.93Å; S385-N388 WeakPolarHBondContact O-CB 3.36Å; S385-N388 PolarHBondContact O-N 3.21Å; I386-N388 PolarHBondContact O-N 2.94Å; I386-N388 VanDerWaalsContact O-N 3.09Å
389	I	98.3	Very high	96.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-106.6	-30.9	-172.9	60.6	167.7	0	0	0	113.2	D375 W376 F379 I386 P391 A392 I440	D375-I389 HydrophobicContact CB-CG2 4.37Å; W376-I389 HydrophobicContact CD2-CB 4.35Å; W376-I389 HydrophobicContact CD2-CG2 4.41Å; W376-I389 HydrophobicContact CG-CB 4.37Å; W376-I389 HydrophobicContact CG-CG2 3.96Å; W376-I389 HydrophobicContact CZ2-CB 4.24Å; W376-I389 WeakPolarHBondContact CZ2-O 3.38Å; W376-I389 PolarHBondContact NE1-O 3.42Å; F379-I389 HydrophobicContact CD2-CD1 4.13Å; F379-I389 HydrophobicContact CD2-CG2 3.61Å; F379-I389 HydrophobicContact CE1-CD1 4.16Å; F379-I389 HydrophobicContact CE2-CD1 3.7Å; F379-I389 HydrophobicContact CE2-CG1 4.06Å; F379-I389 HydrophobicContact CE2-CG2 3.81Å; F379-I389 HydrophobicContact CZ-CD1 3.74Å; F379-I389 HydrophobicContact CZ-CG1 4.45Å; I386-I389 HydrophobicContact CD1-CD1 4.07Å; I386-I389 HydrophobicContact CD1-CG1 4.03Å; I386-I389 VanDerWaalsContact O-CG1 3.29Å; I386-I389 WeakPolarHBondContact O-CG1 3.15Å; I386-I389 PolarHBondContact O-N 2.59Å; I389-P391 VanDerWaalsContact C-N 3.34Å; I389-P391 WeakPolarHBondContact O-CD 3.43Å; I389-A392 PolarHBondContact O-N 3.34Å; I389-I440 HydrophobicContact CD1-CD1 4.05Å; I389-I440 HydrophobicContact CD1-CG1 3.98Å; I389-I440 HydrophobicContact CG1-CD1 4.43Å; I389-I440 HydrophobicContact CG1-CG1 4.42Å
390	E	98.1	Very high	96	Very high	20 Å²	20	34.8 Å²	34.8	9%	0.093	18%	0.175	C	C	.	.	H	α-helix	trans	-52.8	-34.8	-179.7	71.8	171.5	-144.4	0	0	115.6	R348 I386 A392 I393 L394 V445	R348-E390 IonicContact CZ-OE1 2.64Å; R348-E390 IonicContact NE-OE1 3.48Å; R348-E390 VanDerWaalsContact NH2-CG 3.25Å; R348-E390 IonicContact NH2-OE1 2.65Å; R348-E390 PolarHBondContact NH2-OE1 2.83Å; I386-E390 PolarHBondContact O-N 3.01Å; E390-A392 PolarHBondContact O-N 3.44Å; E390-A392 VanDerWaalsContact O-N 3.15Å; E390-I393 WeakPolarHBondContact O-CG2 3.41Å; E390-I393 PolarHBondContact O-N 3.45Å; E390-L394 HydrophobicContact CB-CD1 4.27Å; E390-L394 HydrophobicContact CG-CD1 4.48Å; E390-L394 WeakPolarHBondContact O-CB 3.01Å; E390-L394 WeakPolarHBondContact O-CG 3.27Å; E390-L394 PolarHBondContact O-N 3.03Å; E390-V445 HydrophobicContact CB-CG1 3.8Å; E390-V445 HydrophobicContact CB-CG2 4.44Å
391	P	98.6	Very high	95.6	Very high	1 Å²	1	41 Å²	41	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-66	-26.6	-174.7	-22	36.4	0	0	0	112.1	I352 L372 I389 V395	I352-P391 HydrophobicContact CG1-CB 4.1Å; L372-P391 HydrophobicContact CD1-CB 4.41Å; I389-P391 VanDerWaalsContact C-N 3.34Å; I389-P391 WeakPolarHBondContact O-CD 3.43Å; P391-V395 WeakPolarHBondContact O-CB 3.39Å; P391-V395 WeakPolarHBondContact O-CG2 3.34Å; P391-V395 PolarHBondContact O-N 3.34Å; P391-V395 VanDerWaalsContact O-N 3.11Å
392	A	98.5	Very high	95.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-73.2	-45.2	177.7	0	0	0	0	0	112	L372 F373 W376 I389 E390 M396	L372-A392 HydrophobicContact CD1-CB 3.85Å; L372-A392 HydrophobicContact CD2-CB 4.14Å; L372-A392 HydrophobicContact CG-CB 3.73Å; F373-A392 HydrophobicContact CD1-CB 4.37Å; F373-A392 HydrophobicContact CE1-CB 4.03Å; F373-A392 HydrophobicContact CZ-CB 4.33Å; W376-A392 HydrophobicContact CZ2-CB 3.78Å; I389-A392 PolarHBondContact O-N 3.34Å; E390-A392 PolarHBondContact O-N 3.44Å; E390-A392 VanDerWaalsContact O-N 3.15Å; A392-M396 WeakPolarHBondContact O-CE 3.08Å; A392-M396 WeakPolarHBondContact O-CG 3.36Å; A392-M396 PolarHBondContact O-N 3.48Å; A392-M396 VanDerWaalsContact O-N 3.13Å
393	I	98.4	Very high	94.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-71.1	-37.3	179.7	-162.7	72.9	0	0	0	111.6	W376 E390 M396 H397 L437 I440 V445 L446 L449 L452	W376-I393 HydrophobicContact CH2-CB 4.19Å; W376-I393 HydrophobicContact CH2-CD1 4.38Å; W376-I393 HydrophobicContact CZ2-CB 4.25Å; E390-I393 WeakPolarHBondContact O-CG2 3.41Å; E390-I393 PolarHBondContact O-N 3.45Å; I393-M396 HydrophobicContact CD1-CE 4.01Å; I393-M396 WeakPolarHBondContact O-CB 3.35Å; I393-M396 PolarHBondContact O-N 2.71Å; I393-H397 WeakPolarHBondContact O-CB 3.49Å; I393-H397 PolarHBondContact O-N 2.67Å; I393-L437 HydrophobicContact CD1-CD2 4.33Å; I393-I440 HydrophobicContact CB-CD1 3.92Å; I393-I440 HydrophobicContact CG1-CD1 4.35Å; I393-I440 HydrophobicContact CG1-CG2 4.21Å; I393-I440 HydrophobicContact CG2-CD1 3.77Å; I393-I440 HydrophobicContact CG2-CG1 4.16Å; I393-I440 HydrophobicContact CG2-CG2 4.09Å; I393-V445 HydrophobicContact CG2-CG1 3.74Å; I393-L446 HydrophobicContact CD1-CD1 4.18Å; I393-L446 HydrophobicContact CG1-CD1 3.53Å; I393-L446 HydrophobicContact CG1-CG 4.21Å; I393-L449 HydrophobicContact CD1-CD2 3.92Å; I393-L449 HydrophobicContact CG1-CD2 4.43Å; I393-L452 HydrophobicContact CD1-CD2 3.53Å; I393-L452 HydrophobicContact CG1-CD2 4.28Å
394	L	98	Very high	95	Very high	28 Å²	28	34.9 Å²	34.9	15%	0.147	18%	0.179	C	C	.	.	H	α-helix	trans	-70.7	-35.9	177.8	-66.1	175.3	0	0	0	112.2	W349 E390 M396 H397 H398 V445	W349-L394 HydrophobicContact CB-CB 3.7Å; W349-L394 HydrophobicContact CG-CB 3.78Å; E390-L394 HydrophobicContact CB-CD1 4.27Å; E390-L394 HydrophobicContact CG-CD1 4.48Å; E390-L394 WeakPolarHBondContact O-CB 3.01Å; E390-L394 WeakPolarHBondContact O-CG 3.27Å; E390-L394 PolarHBondContact O-N 3.03Å; L394-M396 VanDerWaalsContact C-N 3.34Å; L394-M396 PolarHBondContact O-N 3.17Å; L394-H397 PolarHBondContact O-N 3.33Å; L394-H398 PolarHBondContact O-CD2 2.84Å; L394-H398 PolarHBondContact O-N 2.84Å; L394-V445 HydrophobicContact CD1-CG1 4.27Å; L394-V445 HydrophobicContact CD2-CG1 4.03Å; L394-V445 HydrophobicContact CG-CG1 4.03Å
395	V	98.3	Very high	94.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.6	-47.6	167.7	167.2	0	0	0	0	110.3	W349 I352 L356 P391 H397 S399 I406 L410	W349-V395 HydrophobicContact CB-CG2 3.88Å; W349-V395 WeakPolarHBondContact O-CG2 3.39Å; I352-V395 HydrophobicContact CB-CG2 3.9Å; I352-V395 HydrophobicContact CG2-CG2 3.85Å; L356-V395 HydrophobicContact CD1-CG1 4.39Å; P391-V395 WeakPolarHBondContact O-CB 3.39Å; P391-V395 WeakPolarHBondContact O-CG2 3.34Å; P391-V395 PolarHBondContact O-N 3.34Å; P391-V395 VanDerWaalsContact O-N 3.11Å; V395-H397 VanDerWaalsContact C-N 3.34Å; V395-H397 PolarHBondContact O-N 3.24Å; V395-S399 WeakPolarHBondContact O-CB 3.48Å; V395-S399 PolarHBondContact O-N 2.71Å; V395-S399 PolarHBondContact O-OG 3.24Å; V395-I406 HydrophobicContact CG1-CG2 3.77Å; V395-L410 HydrophobicContact CB-CD1 4.33Å; V395-L410 HydrophobicContact CG1-CD1 3.49Å; V395-L410 VanDerWaalsContact CG1-CD1 3.49Å
396	M	97.9	Very high	94.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62	-40.4	179.7	-75.1	-172.1	-74.3	0	0	112.2	F373 A392 I393 L394 T407 L410 L411 L452	F373-M396 HydrophobicContact CE1-CE 4.04Å; F373-M396 HydrophobicContact CZ-CE 3.75Å; F373-M396 HydrophobicContact CZ-SD 4.25Å; A392-M396 WeakPolarHBondContact O-CE 3.08Å; A392-M396 WeakPolarHBondContact O-CG 3.36Å; A392-M396 PolarHBondContact O-N 3.48Å; A392-M396 VanDerWaalsContact O-N 3.13Å; I393-M396 HydrophobicContact CD1-CE 4.01Å; I393-M396 WeakPolarHBondContact O-CB 3.35Å; I393-M396 PolarHBondContact O-N 2.71Å; L394-M396 VanDerWaalsContact C-N 3.34Å; L394-M396 PolarHBondContact O-N 3.17Å; M396-T407 HydrophobicContact CB-CG2 3.93Å; M396-T407 HydrophobicContact CG-CG2 4.33Å; M396-T407 WeakPolarHBondContact O-CB 3.38Å; M396-T407 WeakPolarHBondContact O-CG2 3.33Å; M396-T407 PolarHBondContact O-OG1 3.19Å; M396-L410 HydrophobicContact CG-CB 3.59Å; M396-L410 HydrophobicContact CG-CD1 3.74Å; M396-L410 HydrophobicContact CG-CG 4.33Å; M396-L410 HydrophobicContact SD-CB 3.55Å; M396-L410 VanDerWaalsContact SD-CB 3.55Å; M396-L411 HydrophobicContact CE-CD2 4.47Å; M396-L411 HydrophobicContact SD-CD2 3.55Å; M396-L411 VanDerWaalsContact SD-CD2 3.55Å; M396-L411 HydrophobicContact SD-CG 3.67Å; M396-L452 HydrophobicContact CB-CD1 4.43Å; M396-L452 HydrophobicContact CB-CD2 4.25Å
397	H	97.3	Very high	94.7	Very high	83 Å²	83	35.6 Å²	35.6	38%	0.384	19%	0.19	S	C	.	.	H	α-helix	trans	-66.6	-62.8	177.4	-176	79.1	0	0	0	112.3	I393 L394 V395 S399 M400 L446	I393-H397 WeakPolarHBondContact O-CB 3.49Å; I393-H397 PolarHBondContact O-N 2.67Å; L394-H397 PolarHBondContact O-N 3.33Å; V395-H397 VanDerWaalsContact C-N 3.34Å; V395-H397 PolarHBondContact O-N 3.24Å; H397-S399 VanDerWaalsContact C-N 3.26Å; H397-S399 PolarHBondContact O-N 3.25Å; H397-M400 WeakPolarHBondContact O-CB 3.47Å; H397-M400 PolarHBondContact O-N 2.99Å; H397-M400 VanDerWaalsContact O-N 3.08Å; H397-L446 HydrophobicContact CB-CD1 4.21Å; H397-L446 HydrophobicContact CB-CD2 4.1Å
398	H	94.4	Very high	94.7	Very high	77 Å²	77	35.2 Å²	35.2	36%	0.356	19%	0.19	S	C	.	.	H	α-helix	trans	-68.8	-21.9	-173.6	-63.1	-70.2	0	0	0	113.4	W349 L394 P402	W349-H398 AromaticContact CD1-CD2 3.95Å; W349-H398 HydrophobicContact CD2-CB 4.31Å; W349-H398 AromaticContact CD2-CD2 3.65Å; W349-H398 AromaticContact CE2-CD2 3.21Å; W349-H398 AromaticContact CE2-CG 3.77Å; W349-H398 AromaticContact CE2-NE2 3.77Å; W349-H398 HydrophobicContact CE3-CB 3.95Å; W349-H398 HydrophobicContact CH2-CB 3.45Å; W349-H398 VanDerWaalsContact CH2-CB 3.45Å; W349-H398 AromaticContact CH2-CG 3.73Å; W349-H398 HydrophobicContact CZ2-CB 3.8Å; W349-H398 AromaticContact CZ2-CD2 3.46Å; W349-H398 VanDerWaalsContact CZ2-CD2 3.46Å; W349-H398 WeakPolarHBondContact CZ2-CD2 3.38Å; W349-H398 AromaticContact CZ2-CG 3.52Å; W349-H398 AromaticContact CZ2-NE2 3.98Å; W349-H398 HydrophobicContact CZ3-CB 3.52Å; W349-H398 AromaticContact NE1-CD2 3.37Å; W349-H398 PolarHBondContact NE1-CD2 3.21Å; W349-H398 AromaticContact NE1-NE2 3.53Å; L394-H398 PolarHBondContact O-CD2 2.84Å; L394-H398 PolarHBondContact O-N 2.84Å; H398-P402 WeakPolarHBondContact O-CD 3.42Å
399	S	93.1	Very high	94.6	Very high	9 Å²	9	37 Å²	37	6%	0.063	20%	0.203	C	C	.	.	H	α-helix	trans	-76.6	-17.2	174	-53.7	0	0	0	0	113.8	V395 H397 K401 P402 H403 T407	V395-S399 WeakPolarHBondContact O-CB 3.48Å; V395-S399 PolarHBondContact O-N 2.71Å; V395-S399 PolarHBondContact O-OG 3.24Å; H397-S399 VanDerWaalsContact C-N 3.26Å; H397-S399 PolarHBondContact O-N 3.25Å; S399-K401 VanDerWaalsContact C-N 3.28Å; S399-K401 PolarHBondContact O-N 3.33Å; S399-P402 WeakPolarHBondContact O-CD 3.38Å; S399-H403 CarbonylContact O-C 3.6Å; S399-H403 WeakPolarHBondContact O-CA 3.46Å; S399-H403 PolarHBondContact O-N 2.98Å; S399-T407 WeakPolarHBondContact CB-OG1 3.33Å
400	M	93.2	Very high	94.6	Very high	13 Å²	13	37.1 Å²	37.1	6%	0.064	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-33.8	-174.8	-175.1	64.1	81	0	0	113.2	H397 P404 T407 L452 N455 K457 L458	H397-M400 WeakPolarHBondContact O-CB 3.47Å; H397-M400 PolarHBondContact O-N 2.99Å; H397-M400 VanDerWaalsContact O-N 3.08Å; M400-P404 HydrophobicContact SD-CB 4.43Å; M400-T407 HydrophobicContact CE-CG2 3.51Å; M400-T407 PolarHBondContact N-OG1 2.9Å; M400-T407 HydrophobicContact SD-CG2 4.41Å; M400-L452 HydrophobicContact CE-CD1 3.85Å; M400-N455 HydrophobicContact CE-CB 3.58Å; M400-N455 HydrophobicContact SD-CB 4.06Å; M400-K457 WeakPolarHBondContact O-CD 3.38Å; M400-K457 HydrophobicContact SD-CB 4Å; M400-L458 HydrophobicContact CE-CD1 3.89Å; M400-L458 HydrophobicContact CE-CD2 3.93Å; M400-L458 HydrophobicContact CE-CG 3.77Å; M400-L458 HydrophobicContact SD-CD2 4.27Å; M400-L458 HydrophobicContact SD-CG 4.3Å
401	K	87.2	Confident	94.6	Very high	173 Å²	173	36.1 Å²	36.1	75%	0.752	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-56.9	178.3	-172.3	172.7	179.8	178.3	0	112.6	S399 K457	S399-K401 VanDerWaalsContact C-N 3.28Å; S399-K401 PolarHBondContact O-N 3.33Å; K401-K457 PolarHBondContact O-NZ 2.65Å
402	P	84.1	Confident	94.5	Very high	78 Å²	78	38.1 Å²	38.1	51%	0.506	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-33.4	-175.9	33.2	-36.9	0	0	0	115.2	H398 S399	H398-P402 WeakPolarHBondContact O-CD 3.42Å; S399-P402 WeakPolarHBondContact O-CD 3.38Å
403	H	88.8	Confident	94.5	Very high	77 Å²	77	39.7 Å²	39.7	36%	0.356	22%	0.216	S	C	.	.			trans	-140.8	60.3	-168.2	-55.9	-41.5	0	0	0	111.7	S399 A405 I406 F512	S399-H403 CarbonylContact O-C 3.6Å; S399-H403 WeakPolarHBondContact O-CA 3.46Å; S399-H403 PolarHBondContact O-N 2.98Å; H403-A405 PolarHBondContact O-N 3.5Å; H403-I406 HydrophobicContact CB-CD1 3.69Å; H403-I406 HydrophobicContact CB-CG1 4Å; H403-I406 WeakPolarHBondContact O-CB 3.34Å; H403-I406 PolarHBondContact O-N 2.82Å; H403-F512 AromaticContact NE2-CE2 3.63Å
404	P	90.5	Very high	94.5	Very high	45 Å²	45	39.7 Å²	39.7	29%	0.292	22%	0.216	S	C	.	.	H	α-helix	trans	-57.3	-25.7	-171.9	21.9	-33.9	0	0	0	114.1	M400 I406 T407 A408 K457	M400-P404 HydrophobicContact SD-CB 4.43Å; P404-I406 VanDerWaalsContact C-N 3.27Å; P404-I406 PolarHBondContact O-N 2.94Å; P404-T407 WeakPolarHBondContact O-CB 3.46Å; P404-T407 PolarHBondContact O-N 2.87Å; P404-T407 VanDerWaalsContact O-N 3.15Å; P404-A408 WeakPolarHBondContact O-CB 3.49Å; P404-A408 PolarHBondContact O-N 2.83Å; P404-K457 HydrophobicContact CB-CB 4.4Å
405	A	91.5	Very high	94.4	Very high	74 Å²	74	38.5 Å²	38.5	61%	0.612	21%	0.21	S	C	*	.	H	α-helix	trans	-59	-33	173.2	0	0	0	0	0	113.7	H403 T409	H403-A405 PolarHBondContact O-N 3.5Å; A405-T409 VanDerWaalsContact O-CB 3.25Å; A405-T409 WeakPolarHBondContact O-CB 3.36Å; A405-T409 VanDerWaalsContact O-CG2 3.26Å; A405-T409 WeakPolarHBondContact O-CG2 3.34Å; A405-T409 PolarHBondContact O-N 3.22Å
406	I	92.8	Very high	94.4	Very high	25 Å²	25	44.3 Å²	44.3	13%	0.128	23%	0.232	C	C	.	.	H	α-helix	trans	-65.9	-45.9	174.9	-60.6	179.1	0	0	0	109.5	T357 V395 H403 P404 L410	T357-I406 HydrophobicContact CG2-CD1 3.74Å; V395-I406 HydrophobicContact CG1-CG2 3.77Å; H403-I406 HydrophobicContact CB-CD1 3.69Å; H403-I406 HydrophobicContact CB-CG1 4Å; H403-I406 WeakPolarHBondContact O-CB 3.34Å; H403-I406 PolarHBondContact O-N 2.82Å; P404-I406 VanDerWaalsContact C-N 3.27Å; P404-I406 PolarHBondContact O-N 2.94Å; I406-L410 HydrophobicContact CG2-CD1 3.97Å; I406-L410 WeakPolarHBondContact O-CB 3.5Å; I406-L410 WeakPolarHBondContact O-CD1 3.36Å; I406-L410 VanDerWaalsContact O-CG 3.28Å; I406-L410 WeakPolarHBondContact O-CG 3.43Å; I406-L410 PolarHBondContact O-N 2.81Å
407	T	96.5	Very high	94.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-50.1	177.4	-53.1	0	0	0	0	111.6	M396 S399 M400 P404 T409 L410 L411 L452	M396-T407 HydrophobicContact CB-CG2 3.93Å; M396-T407 HydrophobicContact CG-CG2 4.33Å; M396-T407 WeakPolarHBondContact O-CB 3.38Å; M396-T407 WeakPolarHBondContact O-CG2 3.33Å; M396-T407 PolarHBondContact O-OG1 3.19Å; S399-T407 WeakPolarHBondContact CB-OG1 3.33Å; M400-T407 HydrophobicContact CE-CG2 3.51Å; M400-T407 PolarHBondContact N-OG1 2.9Å; M400-T407 HydrophobicContact SD-CG2 4.41Å; P404-T407 WeakPolarHBondContact O-CB 3.46Å; P404-T407 PolarHBondContact O-N 2.87Å; P404-T407 VanDerWaalsContact O-N 3.15Å; T407-T409 VanDerWaalsContact C-N 3.33Å; T407-T409 PolarHBondContact O-N 3.22Å; T407-L410 PolarHBondContact O-N 3.41Å; T407-L411 HydrophobicContact CG2-CD1 3.75Å; T407-L411 HydrophobicContact CG2-CG 4.31Å; T407-L411 WeakPolarHBondContact O-CG 3.48Å; T407-L411 PolarHBondContact O-N 2.82Å; T407-L452 HydrophobicContact CG2-CD1 3.94Å
408	A	96.3	Very high	94.3	Very high	15 Å²	15	41.4 Å²	41.4	12%	0.124	22%	0.219	C	C	.	.	H	α-helix	trans	-57	-45.7	179.2	0	0	0	0	0	111.7	P404 L410 L411 D412 L458 L462	P404-A408 WeakPolarHBondContact O-CB 3.49Å; P404-A408 PolarHBondContact O-N 2.83Å; A408-L410 VanDerWaalsContact C-N 3.28Å; A408-L410 PolarHBondContact O-N 3.14Å; A408-L411 PolarHBondContact O-N 3.47Å; A408-D412 VanDerWaalsContact O-CB 3.27Å; A408-D412 WeakPolarHBondContact O-CB 3.42Å; A408-D412 PolarHBondContact O-N 3.04Å; A408-L458 HydrophobicContact CB-CD2 3.8Å; A408-L462 HydrophobicContact CB-CD2 3.85Å; A408-L462 WeakPolarHBondContact O-CD2 3.49Å
409	T	95.9	Very high	94.4	Very high	60 Å²	60	38.8 Å²	38.8	37%	0.368	21%	0.209	S	C	.	.	H	α-helix	trans	-76.7	-10.8	-177.1	-150.2	0	0	0	0	114.4	K369 A405 T407 F413	K369-T409 PolarHBondContact NZ-O 3.06Å; K369-T409 PolarHBondContact NZ-OG1 2.7Å; A405-T409 VanDerWaalsContact O-CB 3.25Å; A405-T409 WeakPolarHBondContact O-CB 3.36Å; A405-T409 VanDerWaalsContact O-CG2 3.26Å; A405-T409 WeakPolarHBondContact O-CG2 3.34Å; A405-T409 PolarHBondContact O-N 3.22Å; T407-T409 VanDerWaalsContact C-N 3.33Å; T407-T409 PolarHBondContact O-N 3.22Å; T409-F413 WeakPolarHBondContact O-CB 3.38Å
410	L	98.1	Very high	94.5	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-91.8	-40.3	170.2	-73.3	169.8	0	0	0	111.7	L356 K369 L372 F373 V395 M396 I406 T407 A408 F413 M414	L356-L410 HydrophobicContact CD1-CD1 4.23Å; L356-L410 HydrophobicContact CD1-CD2 4.31Å; K369-L410 HydrophobicContact CG-CD2 3.92Å; L372-L410 HydrophobicContact CD2-CD2 4.02Å; F373-L410 HydrophobicContact CE2-CB 4.29Å; F373-L410 HydrophobicContact CE2-CD2 3.81Å; F373-L410 HydrophobicContact CZ-CB 4.4Å; V395-L410 HydrophobicContact CB-CD1 4.33Å; V395-L410 HydrophobicContact CG1-CD1 3.49Å; V395-L410 VanDerWaalsContact CG1-CD1 3.49Å; M396-L410 HydrophobicContact CG-CB 3.59Å; M396-L410 HydrophobicContact CG-CD1 3.74Å; M396-L410 HydrophobicContact CG-CG 4.33Å; M396-L410 HydrophobicContact SD-CB 3.55Å; M396-L410 VanDerWaalsContact SD-CB 3.55Å; I406-L410 HydrophobicContact CG2-CD1 3.97Å; I406-L410 WeakPolarHBondContact O-CB 3.5Å; I406-L410 WeakPolarHBondContact O-CD1 3.36Å; I406-L410 VanDerWaalsContact O-CG 3.28Å; I406-L410 WeakPolarHBondContact O-CG 3.43Å; I406-L410 PolarHBondContact O-N 2.81Å; T407-L410 PolarHBondContact O-N 3.41Å; A408-L410 VanDerWaalsContact C-N 3.28Å; A408-L410 PolarHBondContact O-N 3.14Å; L410-F413 PolarHBondContact O-N 3.05Å; L410-M414 WeakPolarHBondContact O-CB 3.41Å; L410-M414 PolarHBondContact O-N 3.39Å
411	L	98	Very high	94.7	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-45.2	173.3	-69.9	170.3	0	0	0	111.5	M396 T407 A408 F413 M414 C415 F453 L458 L462 L466	M396-L411 HydrophobicContact CE-CD2 4.47Å; M396-L411 HydrophobicContact SD-CD2 3.55Å; M396-L411 VanDerWaalsContact SD-CD2 3.55Å; M396-L411 HydrophobicContact SD-CG 3.67Å; T407-L411 HydrophobicContact CG2-CD1 3.75Å; T407-L411 HydrophobicContact CG2-CG 4.31Å; T407-L411 WeakPolarHBondContact O-CG 3.48Å; T407-L411 PolarHBondContact O-N 2.82Å; A408-L411 PolarHBondContact O-N 3.47Å; L411-F413 VanDerWaalsContact C-N 3.32Å; L411-F413 PolarHBondContact O-N 3.03Å; L411-M414 HydrophobicContact CD2-CE 3.96Å; L411-M414 WeakPolarHBondContact O-CB 3.37Å; L411-M414 PolarHBondContact O-N 3.47Å; L411-C415 PolarHBondContact O-N 2.97Å; L411-F453 HydrophobicContact CD2-CD1 3.93Å; L411-F453 HydrophobicContact CD2-CE1 3.67Å; L411-L458 HydrophobicContact CD1-CD1 3.53Å; L411-L458 HydrophobicContact CD1-CD2 4.33Å; L411-L462 HydrophobicContact CB-CD1 4.27Å; L411-L462 HydrophobicContact CB-CD2 4.27Å; L411-L466 HydrophobicContact CB-CD1 4.26Å; L411-L466 HydrophobicContact CB-CD2 4.43Å; L411-L466 HydrophobicContact CD1-CD1 4.03Å; L411-L466 HydrophobicContact CD2-CD1 4.5Å; L411-L466 HydrophobicContact CD2-CD2 4.11Å; L411-L466 HydrophobicContact CG-CD1 4.5Å
412	D	96.6	Very high	95.2	Very high	43 Å²	43	40.3 Å²	40.3	23%	0.23	22%	0.216	C	C	.	.	H	α-helix	trans	-57.6	-45	173.9	177.8	88	0	0	0	111.4	A408 C415 R416 L462	A408-D412 VanDerWaalsContact O-CB 3.27Å; A408-D412 WeakPolarHBondContact O-CB 3.42Å; A408-D412 PolarHBondContact O-N 3.04Å; D412-C415 PolarHBondContact O-N 3.24Å; D412-R416 WeakPolarHBondContact O-CB 3.24Å; D412-R416 WeakPolarHBondContact O-CG 3.17Å; D412-R416 PolarHBondContact O-N 3.13Å; D412-R416 IonicContact OD1-CZ 2.83Å; D412-R416 IonicContact OD1-NE 4Å; D412-R416 PolarHBondContact OD1-NE 3.16Å; D412-R416 IonicContact OD1-NH2 3.8Å; D412-R416 PolarHBondContact OD1-NH2 3.48Å; D412-R416 WeakPolarHBondContact OD2-CD 3.15Å; D412-R416 IonicContact OD2-CZ 3.52Å; D412-R416 IonicContact OD2-NE 2.61Å; D412-R416 PolarHBondContact OD2-NE 2.97Å; D412-R416 IonicContact OD2-NH2 3.78Å; D412-L462 HydrophobicContact CB-CD1 3.98Å
413	F	98	Very high	95.8	Very high	32 Å²	32	40.6 Å²	40.6	14%	0.14	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-44.3	175.9	-177.1	-85.5	0	0	0	111.8	K369 L370 F373 T409 L410 L411 C415 R416 I417	K369-F413 HydrophobicContact CB-CD1 4.02Å; K369-F413 HydrophobicContact CB-CD2 3.87Å; K369-F413 HydrophobicContact CB-CE1 4.09Å; K369-F413 HydrophobicContact CB-CE2 3.93Å; K369-F413 HydrophobicContact CB-CG 3.92Å; K369-F413 HydrophobicContact CB-CZ 4.05Å; K369-F413 HydrophobicContact CD-CB 4.07Å; K369-F413 HydrophobicContact CD-CD2 3.83Å; K369-F413 HydrophobicContact CD-CG 3.99Å; L370-F413 HydrophobicContact CB-CZ 3.79Å; L370-F413 HydrophobicContact CD1-CZ 4.13Å; L370-F413 HydrophobicContact CG-CZ 4.5Å; F373-F413 HydrophobicContact CB-CE1 4.29Å; F373-F413 AromaticContact CD2-CD1 3.51Å; F373-F413 HydrophobicContact CD2-CD1 3.51Å; F373-F413 AromaticContact CD2-CE1 3.82Å; F373-F413 HydrophobicContact CD2-CE1 3.82Å; F373-F413 AromaticContact CE2-CD1 3.92Å; F373-F413 HydrophobicContact CE2-CD1 3.92Å; F373-F413 HydrophobicContact CG-CD1 4.38Å; F373-F413 HydrophobicContact CG-CE1 4.41Å; T409-F413 WeakPolarHBondContact O-CB 3.38Å; L410-F413 PolarHBondContact O-N 3.05Å; L411-F413 VanDerWaalsContact C-N 3.32Å; L411-F413 PolarHBondContact O-N 3.03Å; F413-C415 VanDerWaalsContact C-N 3.35Å; F413-C415 PolarHBondContact O-N 3.23Å; F413-R416 PolarHBondContact O-N 3.41Å; F413-I417 HydrophobicContact CD1-CB 4.36Å; F413-I417 HydrophobicContact CD1-CG2 4.39Å; F413-I417 HydrophobicContact CE1-CB 3.98Å; F413-I417 HydrophobicContact CE1-CG1 4.02Å; F413-I417 HydrophobicContact CE1-CG2 4.19Å; F413-I417 HydrophobicContact CZ-CB 4.27Å; F413-I417 HydrophobicContact CZ-CD1 4.05Å; F413-I417 HydrophobicContact CZ-CG1 4.05Å; F413-I417 VanDerWaalsContact O-CB 3.29Å; F413-I417 WeakPolarHBondContact O-CB 3.45Å; F413-I417 VanDerWaalsContact O-CG2 3.31Å; F413-I417 WeakPolarHBondContact O-CG2 3.12Å; F413-I417 PolarHBondContact O-N 3.37Å
414	M	98.2	Very high	96.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-40.3	177.8	-174.6	-177.6	70.4	0	0	112.1	F373 W376 L410 L411 I418 V433 L437 F453 L466 F470	F373-M414 HydrophobicContact CE1-CB 4.08Å; F373-M414 HydrophobicContact CE1-CG 4.07Å; F373-M414 HydrophobicContact CE1-SD 4.11Å; F373-M414 HydrophobicContact CE2-CB 4.49Å; F373-M414 HydrophobicContact CZ-CB 3.94Å; F373-M414 HydrophobicContact CZ-CG 4.43Å; W376-M414 HydrophobicContact CE3-SD 4.33Å; W376-M414 HydrophobicContact CZ3-SD 3.86Å; L410-M414 WeakPolarHBondContact O-CB 3.41Å; L410-M414 PolarHBondContact O-N 3.39Å; L411-M414 HydrophobicContact CD2-CE 3.96Å; L411-M414 WeakPolarHBondContact O-CB 3.37Å; L411-M414 PolarHBondContact O-N 3.47Å; M414-I418 VanDerWaalsContact O-CD1 3.3Å; M414-I418 WeakPolarHBondContact O-CD1 3.21Å; M414-I418 WeakPolarHBondContact O-CG1 3.36Å; M414-V433 HydrophobicContact CG-CG1 3.83Å; M414-V433 HydrophobicContact SD-CG1 3.93Å; M414-L437 HydrophobicContact CE-CD1 4.35Å; M414-L437 HydrophobicContact SD-CD1 4.46Å; M414-F453 HydrophobicContact CE-CE1 4.19Å; M414-F453 HydrophobicContact CE-CZ 3.83Å; M414-L466 HydrophobicContact CE-CD2 4.19Å; M414-F470 HydrophobicContact CE-CE2 4.22Å
415	C	96.6	Very high	96.5	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.02	22%	0.22	C	C	.	.	H	α-helix	trans	-69.2	-43.1	175	-72.1	0	0	0	0	112.4	L411 D412 F413 P419 M465 L466	L411-C415 PolarHBondContact O-N 2.97Å; D412-C415 PolarHBondContact O-N 3.24Å; F413-C415 VanDerWaalsContact C-N 3.35Å; F413-C415 PolarHBondContact O-N 3.23Å; C415-P419 WeakPolarHBondContact O-CD 3.44Å; C415-M465 HydrophobicContact CB-CG 4.01Å; C415-M465 HydrophobicContact CB-SD 3.48Å; C415-M465 WeakPolarHBondContact CB-SD 3.13Å; C415-L466 VanDerWaalsContact SG-CD2 3.58Å
416	R	96.5	Very high	96.8	Very high	122 Å²	122	39.7 Å²	39.7	46%	0.46	21%	0.206	S	C	.	.	H	α-helix	trans	-75.2	-31	-177.5	-68.8	-177.5	-160.3	-83.4	-6.1	114.2	D412 F413 I418 P419 H420	D412-R416 WeakPolarHBondContact O-CB 3.24Å; D412-R416 WeakPolarHBondContact O-CG 3.17Å; D412-R416 PolarHBondContact O-N 3.13Å; D412-R416 IonicContact OD1-CZ 2.83Å; D412-R416 IonicContact OD1-NE 4Å; D412-R416 PolarHBondContact OD1-NE 3.16Å; D412-R416 IonicContact OD1-NH2 3.8Å; D412-R416 PolarHBondContact OD1-NH2 3.48Å; D412-R416 WeakPolarHBondContact OD2-CD 3.15Å; D412-R416 IonicContact OD2-CZ 3.52Å; D412-R416 IonicContact OD2-NE 2.61Å; D412-R416 PolarHBondContact OD2-NE 2.97Å; D412-R416 IonicContact OD2-NH2 3.78Å; F413-R416 PolarHBondContact O-N 3.41Å; R416-I418 VanDerWaalsContact C-N 3.25Å; R416-I418 PolarHBondContact O-N 3.32Å; R416-P419 WeakPolarHBondContact O-CD 3.22Å; R416-H420 WeakPolarHBondContact O-CB 3.46Å; R416-H420 PolarHBondContact O-CD2 3.47Å
417	I	97.1	Very high	97	Very high	22 Å²	22	43.7 Å²	43.7	11%	0.113	23%	0.231	C	C	.	.	H	α-helix	trans	-69.9	-24	-176.3	-163.1	56.2	0	0	0	112.5	L370 L377 F413 H420 F421	L370-I417 HydrophobicContact CD1-CD1 4.08Å; L370-I417 HydrophobicContact CD1-CG1 4.15Å; L377-I417 HydrophobicContact CD2-CG1 3.98Å; L377-I417 HydrophobicContact CD2-CG2 4.05Å; F413-I417 HydrophobicContact CD1-CB 4.36Å; F413-I417 HydrophobicContact CD1-CG2 4.39Å; F413-I417 HydrophobicContact CE1-CB 3.98Å; F413-I417 HydrophobicContact CE1-CG1 4.02Å; F413-I417 HydrophobicContact CE1-CG2 4.19Å; F413-I417 HydrophobicContact CZ-CB 4.27Å; F413-I417 HydrophobicContact CZ-CD1 4.05Å; F413-I417 HydrophobicContact CZ-CG1 4.05Å; F413-I417 VanDerWaalsContact O-CB 3.29Å; F413-I417 WeakPolarHBondContact O-CB 3.45Å; F413-I417 VanDerWaalsContact O-CG2 3.31Å; F413-I417 WeakPolarHBondContact O-CG2 3.12Å; F413-I417 PolarHBondContact O-N 3.37Å; I417-H420 PolarHBondContact O-N 3.09Å; I417-F421 HydrophobicContact CD1-CB 3.95Å; I417-F421 HydrophobicContact CD1-CD2 4.21Å; I417-F421 HydrophobicContact CG1-CB 4.1Å; I417-F421 WeakPolarHBondContact O-CB 3.12Å; I417-F421 PolarHBondContact O-N 3.27Å
418	I	97.2	Very high	97.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-59.5	179.8	-67.3	160.9	0	0	0	112.7	M414 R416 H420 E426 V429 R430 V433 F470	M414-I418 VanDerWaalsContact O-CD1 3.3Å; M414-I418 WeakPolarHBondContact O-CD1 3.21Å; M414-I418 WeakPolarHBondContact O-CG1 3.36Å; R416-I418 VanDerWaalsContact C-N 3.25Å; R416-I418 PolarHBondContact O-N 3.32Å; I418-H420 VanDerWaalsContact C-N 3.31Å; I418-H420 PolarHBondContact O-N 3.25Å; I418-E426 HydrophobicContact CG2-CG 4.06Å; I418-V429 HydrophobicContact CB-CG1 4.46Å; I418-V429 HydrophobicContact CG1-CG1 4.27Å; I418-R430 HydrophobicContact CG2-CB 3.75Å; I418-R430 HydrophobicContact CG2-CG 4.46Å; I418-V433 HydrophobicContact CD1-CB 4.27Å; I418-V433 HydrophobicContact CD1-CG1 4.27Å; I418-V433 HydrophobicContact CD1-CG2 4.3Å; I418-V433 HydrophobicContact CG1-CG2 4.06Å; I418-F470 HydrophobicContact CD1-CE2 4.04Å; I418-F470 HydrophobicContact CD1-CZ 3.62Å
419	P	96.3	Very high	97.1	Very high	22 Å²	22	46.7 Å²	46.7	14%	0.143	24%	0.243	C	C	.	.	H	α-helix	trans	-72.9	-19.5	176	28.4	-36.3	0	0	0	114	C415 R416 P423 E426	C415-P419 WeakPolarHBondContact O-CD 3.44Å; R416-P419 WeakPolarHBondContact O-CD 3.22Å; P419-P423 WeakPolarHBondContact O-CG 3.34Å; P419-E426 HydrophobicContact CB-CG 4.49Å
420	H	95.9	Very high	97.2	Very high	136 Å²	136	47.5 Å²	47.5	63%	0.63	24%	0.239	S	C	*	.	H	α-helix	trans	-108.2	-14.6	-167.2	-62.8	-36.4	0	0	0	115.9	R416 I417 I418	R416-H420 WeakPolarHBondContact O-CB 3.46Å; R416-H420 PolarHBondContact O-CD2 3.47Å; I417-H420 PolarHBondContact O-N 3.09Å; I418-H420 VanDerWaalsContact C-N 3.31Å; I418-H420 PolarHBondContact O-N 3.25Å
421	F	96.6	Very high	97.2	Very high	37 Å²	37	51.9 Å²	51.9	16%	0.162	26%	0.26	C	S	.	.	S	Bend	trans	-62	-52.8	178.3	178.8	-102.4	0	0	0	111.9	L269 L370 Y374 L377 F378 I417 V429	L269-F421 HydrophobicContact CD1-CE1 4.15Å; L269-F421 HydrophobicContact CD2-CE1 3.82Å; L269-F421 HydrophobicContact CD2-CZ 3.82Å; L370-F421 HydrophobicContact CD1-CD2 4.25Å; L370-F421 HydrophobicContact CD1-CE2 4.35Å; Y374-F421 HydrophobicContact CE2-CE2 4.03Å; Y374-F421 HydrophobicContact CE2-CZ 4.44Å; L377-F421 HydrophobicContact CD1-CD1 4.32Å; L377-F421 HydrophobicContact CD1-CD2 3.66Å; L377-F421 HydrophobicContact CD1-CE1 4.24Å; L377-F421 HydrophobicContact CD1-CE2 3.56Å; L377-F421 HydrophobicContact CD1-CG 4.05Å; L377-F421 HydrophobicContact CD1-CZ 3.87Å; F378-F421 HydrophobicContact CE2-CD1 4.14Å; F378-F421 AromaticContact CE2-CE1 3.81Å; F378-F421 HydrophobicContact CE2-CE1 3.81Å; I417-F421 HydrophobicContact CD1-CB 3.95Å; I417-F421 HydrophobicContact CD1-CD2 4.21Å; I417-F421 HydrophobicContact CG1-CB 4.1Å; I417-F421 WeakPolarHBondContact O-CB 3.12Å; I417-F421 PolarHBondContact O-N 3.27Å; F421-V429 HydrophobicContact CD1-CG2 4.15Å
422	F	96.9	Very high	97.2	Very high	54 Å²	54	52 Å²	52	24%	0.237	26%	0.261	C	S	.	.			trans	-159.1	98.3	171	-176.4	-114.2	0	0	0	108.7	L252 I265 P424 L425	L252-F422 HydrophobicContact CD1-CE2 4.24Å; L252-F422 HydrophobicContact CD2-CE2 3.77Å; L252-F422 HydrophobicContact CD2-CZ 3.75Å; I265-F422 HydrophobicContact CG2-CE1 4.26Å; F422-P424 VanDerWaalsContact C-CD 3.41Å; F422-P424 VanDerWaalsContact C-N 3.34Å; F422-P424 HydrophobicContact CD1-CB 4.23Å; F422-P424 HydrophobicContact CD1-CG 4.33Å; F422-P424 HydrophobicContact CE1-CB 3.7Å; F422-P424 HydrophobicContact CE1-CG 3.82Å; F422-P424 HydrophobicContact CE2-CG 4.19Å; F422-P424 HydrophobicContact CZ-CB 4.08Å; F422-P424 HydrophobicContact CZ-CG 3.73Å; F422-P424 VanDerWaalsContact O-N 3.14Å; F422-L425 HydrophobicContact CD1-CB 3.97Å; F422-L425 HydrophobicContact CD1-CD1 3.74Å; F422-L425 HydrophobicContact CD1-CG 3.68Å; F422-L425 HydrophobicContact CE1-CD1 4.12Å; F422-L425 HydrophobicContact CE1-CG 4.01Å; F422-L425 PolarHBondContact O-N 2.7Å
423	P	96.9	Very high	97.3	Very high	83 Å²	83	50 Å²	50	54%	0.539	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-52.1	-37	-170.4	-26.3	31	0	0	0	116.1	P419 L425 E426	P419-P423 WeakPolarHBondContact O-CG 3.34Å; P423-L425 PolarHBondContact O-N 3.25Å; P423-E426 PolarHBondContact O-N 2.84Å; P423-E426 VanDerWaalsContact O-N 3.08Å
424	P	96.9	Very high	97.3	Very high	97 Å²	97	50.9 Å²	50.9	63%	0.63	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-64.5	-6.6	175.4	-22	34.4	0	0	0	115.4	F422	F422-P424 VanDerWaalsContact C-CD 3.41Å; F422-P424 VanDerWaalsContact C-N 3.34Å; F422-P424 HydrophobicContact CD1-CB 4.23Å; F422-P424 HydrophobicContact CD1-CG 4.33Å; F422-P424 HydrophobicContact CE1-CB 3.7Å; F422-P424 HydrophobicContact CE1-CG 3.82Å; F422-P424 HydrophobicContact CE2-CG 4.19Å; F422-P424 HydrophobicContact CZ-CB 4.08Å; F422-P424 HydrophobicContact CZ-CG 3.73Å; F422-P424 VanDerWaalsContact O-N 3.14Å
425	L	97.4	Very high	97.3	Very high	16 Å²	16	52.9 Å²	52.9	8%	0.084	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-123.6	19.4	173.2	-63.7	175.3	0	0	0	112.8	I265 L266 L269 F378 F422 P423 T427 Q428 V429	I265-L425 HydrophobicContact CG2-CD1 4.3Å; L266-L425 HydrophobicContact CB-CD1 4.26Å; L266-L425 HydrophobicContact CD1-CD1 4.07Å; L266-L425 HydrophobicContact CD1-CD2 4.32Å; L266-L425 HydrophobicContact CD2-CD2 4.46Å; L269-L425 HydrophobicContact CD1-CD1 4.15Å; F378-L425 HydrophobicContact CE1-CB 4.48Å; F378-L425 HydrophobicContact CE1-CD1 4.22Å; F378-L425 HydrophobicContact CZ-CB 4.27Å; F378-L425 HydrophobicContact CZ-CD1 4.08Å; F422-L425 HydrophobicContact CD1-CB 3.97Å; F422-L425 HydrophobicContact CD1-CD1 3.74Å; F422-L425 HydrophobicContact CD1-CG 3.68Å; F422-L425 HydrophobicContact CE1-CD1 4.12Å; F422-L425 HydrophobicContact CE1-CG 4.01Å; F422-L425 PolarHBondContact O-N 2.7Å; P423-L425 PolarHBondContact O-N 3.25Å; L425-T427 PolarHBondContact O-N 3.3Å; L425-Q428 VanDerWaalsContact CA-OE1 3.29Å; L425-Q428 HydrophobicContact CB-CB 4.43Å; L425-Q428 HydrophobicContact CD2-CG 4.29Å; L425-Q428 PolarHBondContact O-N 3.4Å; L425-Q428 PolarHBondContact O-OE1 2.85Å; L425-V429 WeakPolarHBondContact O-CG2 3.41Å; L425-V429 PolarHBondContact O-N 3.39Å
426	E	97.5	Very high	97.4	Very high	65 Å²	65	52.7 Å²	52.7	30%	0.304	26%	0.263	S	S	.	.	H	α-helix	trans	-50.9	-43.1	179.8	175.2	173.1	-175.4	0	0	111.8	I418 P419 P423 Q428 V429 R430 R469	I418-E426 HydrophobicContact CG2-CG 4.06Å; P419-E426 HydrophobicContact CB-CG 4.49Å; P423-E426 PolarHBondContact O-N 2.84Å; P423-E426 VanDerWaalsContact O-N 3.08Å; E426-Q428 VanDerWaalsContact C-N 3.34Å; E426-Q428 PolarHBondContact O-N 3.16Å; E426-V429 PolarHBondContact O-N 2.91Å; E426-R430 WeakPolarHBondContact O-CB 3.49Å; E426-R430 PolarHBondContact O-N 2.87Å; E426-R469 IonicContact OE1-NH1 2.73Å; E426-R469 PolarHBondContact OE1-NH1 3.46Å
427	T	97.3	Very high	97.5	Very high	108 Å²	108	46.9 Å²	46.9	66%	0.663	24%	0.242	S	C	*	.	H	α-helix	trans	-59.8	-42.9	178.7	-48.5	0	0	0	0	112.2	L425 Q431	L425-T427 PolarHBondContact O-N 3.3Å; T427-Q431 WeakPolarHBondContact O-CB 3.5Å; T427-Q431 PolarHBondContact O-N 3.26Å
428	Q	98.1	Very high	97.5	Very high	78 Å²	78	47.8 Å²	47.8	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-69.7	-37.3	177.4	-66.7	83	-14.2	0	0	111.4	F378 L425 E426 Q431 G432	F378-Q428 HydrophobicContact CD1-CB 4.25Å; F378-Q428 HydrophobicContact CE1-CB 3.73Å; L425-Q428 VanDerWaalsContact CA-OE1 3.29Å; L425-Q428 HydrophobicContact CB-CB 4.43Å; L425-Q428 HydrophobicContact CD2-CG 4.29Å; L425-Q428 PolarHBondContact O-N 3.4Å; L425-Q428 PolarHBondContact O-OE1 2.85Å; E426-Q428 VanDerWaalsContact C-N 3.34Å; E426-Q428 PolarHBondContact O-N 3.16Å; Q428-Q431 PolarHBondContact O-N 3.15Å; Q428-G432 PolarHBondContact O-N 3.11Å
429	V	98.3	Very high	97.5	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.7	-42.9	176.6	-178.1	0	0	0	0	111.4	L377 F378 I418 F421 L425 E426 Q431 G432 V433	L377-V429 HydrophobicContact CB-CG1 4.44Å; L377-V429 HydrophobicContact CD2-CG1 3.75Å; L377-V429 WeakPolarHBondContact O-CA 3.48Å; F378-V429 HydrophobicContact CE1-CG2 4.36Å; F378-V429 HydrophobicContact CE2-CG2 3.8Å; F378-V429 HydrophobicContact CZ-CG2 3.57Å; I418-V429 HydrophobicContact CB-CG1 4.46Å; I418-V429 HydrophobicContact CG1-CG1 4.27Å; F421-V429 HydrophobicContact CD1-CG2 4.15Å; L425-V429 WeakPolarHBondContact O-CG2 3.41Å; L425-V429 PolarHBondContact O-N 3.39Å; E426-V429 PolarHBondContact O-N 2.91Å; V429-Q431 VanDerWaalsContact C-N 3.31Å; V429-Q431 PolarHBondContact O-N 3.35Å; V429-G432 PolarHBondContact O-N 2.89Å; V429-V433 WeakPolarHBondContact O-CG2 3.34Å; V429-V433 PolarHBondContact O-N 3.49Å
430	R	97.6	Very high	97.6	Very high	77 Å²	77	47.9 Å²	47.9	29%	0.291	25%	0.245	S	C	.	.	H	α-helix	trans	-56.3	-46.2	171.3	-178	180	172.6	73.1	9.5	110.7	I418 E426 V433 F434 R469	I418-R430 HydrophobicContact CG2-CB 3.75Å; I418-R430 HydrophobicContact CG2-CG 4.46Å; E426-R430 WeakPolarHBondContact O-CB 3.49Å; E426-R430 PolarHBondContact O-N 2.87Å; R430-V433 PolarHBondContact O-N 2.97Å; R430-F434 VanDerWaalsContact O-CB 3.26Å; R430-F434 WeakPolarHBondContact O-CB 3.43Å; R430-F434 PolarHBondContact O-N 3.14Å; R430-R469 PolarHBondContact NH1-O 3.36Å; R430-R469 PolarHBondContact NH2-O 3.04Å
431	Q	97.8	Very high	97.6	Very high	94 Å²	94	43.9 Å²	43.9	44%	0.439	23%	0.227	S	C	.	.	H	α-helix	trans	-65.2	-40.2	178.2	-167.4	66.1	52.9	0	0	112.2	T427 Q428 V429 F434 N435	T427-Q431 WeakPolarHBondContact O-CB 3.5Å; T427-Q431 PolarHBondContact O-N 3.26Å; Q428-Q431 PolarHBondContact O-N 3.15Å; V429-Q431 VanDerWaalsContact C-N 3.31Å; V429-Q431 PolarHBondContact O-N 3.35Å; Q431-F434 PolarHBondContact O-N 3.29Å; Q431-N435 PolarHBondContact NE2-OD1 3.13Å; Q431-N435 VanDerWaalsContact O-CB 3.31Å; Q431-N435 WeakPolarHBondContact O-CB 3.25Å; Q431-N435 PolarHBondContact O-N 3.22Å; Q431-N435 PolarHBondContact O-ND2 3.28Å; Q431-N435 PolarHBondContact O-OD1 3.06Å
432	G	98.2	Very high	97.5	Very high	2 Å²	2	48.2 Å²	48.2	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-47.9	175.7	0	0	0	0	0	112.6	W376 Q428 V429 N435 S436	W376-G432 CarbonylContact O-C 2.94Å; W376-G432 WeakPolarHBondContact O-CA 3.35Å; Q428-G432 PolarHBondContact O-N 3.11Å; V429-G432 PolarHBondContact O-N 2.89Å; G432-N435 PolarHBondContact O-N 2.91Å; G432-S436 WeakPolarHBondContact O-CB 3.3Å; G432-S436 PolarHBondContact O-N 3.15Å; G432-S436 PolarHBondContact O-OG 2.87Å
433	V	98.5	Very high	97.3	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-65.6	-41.1	176.9	178.6	0	0	0	0	111.3	W376 M414 I418 V429 R430 S436 L437 F470	W376-V433 HydrophobicContact CB-CG2 4.49Å; W376-V433 HydrophobicContact CE3-CG1 4.21Å; W376-V433 PolarHBondContact O-N 3.02Å; M414-V433 HydrophobicContact CG-CG1 3.83Å; M414-V433 HydrophobicContact SD-CG1 3.93Å; I418-V433 HydrophobicContact CD1-CB 4.27Å; I418-V433 HydrophobicContact CD1-CG1 4.27Å; I418-V433 HydrophobicContact CD1-CG2 4.3Å; I418-V433 HydrophobicContact CG1-CG2 4.06Å; V429-V433 WeakPolarHBondContact O-CG2 3.34Å; V429-V433 PolarHBondContact O-N 3.49Å; R430-V433 PolarHBondContact O-N 2.97Å; V433-S436 WeakPolarHBondContact O-CB 3.27Å; V433-S436 PolarHBondContact O-N 3.4Å; V433-L437 HydrophobicContact CG1-CD1 4.09Å; V433-L437 WeakPolarHBondContact O-CG 3.42Å; V433-L437 PolarHBondContact O-N 3.21Å; V433-F470 HydrophobicContact CB-CZ 4.27Å; V433-F470 HydrophobicContact CG1-CE1 4.3Å; V433-F470 HydrophobicContact CG1-CE2 4.3Å; V433-F470 HydrophobicContact CG1-CZ 3.57Å
434	F	98.1	Very high	97	Very high	51 Å²	51	57.5 Å²	57.5	22%	0.224	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-43.2	175.3	-178.6	-97.8	0	0	0	112.7	R430 Q431 S436 L437 N438 F470 E472 F473	R430-F434 VanDerWaalsContact O-CB 3.26Å; R430-F434 WeakPolarHBondContact O-CB 3.43Å; R430-F434 PolarHBondContact O-N 3.14Å; Q431-F434 PolarHBondContact O-N 3.29Å; F434-S436 VanDerWaalsContact C-N 3.31Å; F434-S436 PolarHBondContact O-N 3.47Å; F434-L437 PolarHBondContact O-N 2.92Å; F434-N438 VanDerWaalsContact CD1-ND2 3.28Å; F434-N438 WeakPolarHBondContact CD1-ND2 3.35Å; F434-N438 WeakPolarHBondContact CE1-ND2 3.14Å; F434-N438 VanDerWaalsContact CZ-ND2 3.33Å; F434-N438 WeakPolarHBondContact CZ-ND2 3.17Å; F434-N438 PolarHBondContact O-N 2.86Å; F434-N438 PolarHBondContact O-ND2 3.25Å; F434-F470 HydrophobicContact CB-CE1 4.42Å; F434-F470 HydrophobicContact CD2-CD1 4.43Å; F434-E472 HydrophobicContact CE2-CB 4.47Å; F434-E472 HydrophobicContact CE2-CG 4.18Å; F434-F473 AromaticContact CD2-CE2 3.64Å; F434-F473 HydrophobicContact CD2-CE2 3.64Å; F434-F473 AromaticContact CD2-CZ 3.55Å; F434-F473 HydrophobicContact CD2-CZ 3.55Å; F434-F473 HydrophobicContact CE2-CE1 4.23Å; F434-F473 AromaticContact CE2-CE2 3.98Å; F434-F473 HydrophobicContact CE2-CE2 3.98Å; F434-F473 AromaticContact CE2-CZ 3.51Å; F434-F473 HydrophobicContact CE2-CZ 3.51Å; F434-F473 HydrophobicContact CG-CZ 4.35Å; F434-F473 HydrophobicContact CZ-CZ 4.3Å
435	N	98.3	Very high	96.9	Very high	42 Å²	42	54.3 Å²	54.3	23%	0.225	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-42.4	173.3	-68.5	-7.8	0	0	0	111	F379 Q431 G432 N438 F439	F379-N435 HydrophobicContact CD1-CB 4.03Å; F379-N435 PolarHBondContact O-ND2 3.31Å; Q431-N435 PolarHBondContact NE2-OD1 3.13Å; Q431-N435 VanDerWaalsContact O-CB 3.31Å; Q431-N435 WeakPolarHBondContact O-CB 3.25Å; Q431-N435 PolarHBondContact O-N 3.22Å; Q431-N435 PolarHBondContact O-ND2 3.28Å; Q431-N435 PolarHBondContact O-OD1 3.06Å; G432-N435 PolarHBondContact O-N 2.91Å; N435-N438 PolarHBondContact O-N 3.16Å; N435-F439 VanDerWaalsContact O-CB 3.3Å; N435-F439 WeakPolarHBondContact O-CB 3.28Å; N435-F439 PolarHBondContact O-N 3.43Å
436	S	98.5	Very high	96.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.1	-47.6	178.4	-55.8	0	0	0	0	111.2	W376 F379 G432 V433 F434 F439 I440	W376-S436 WeakPolarHBondContact CA-OG 3.4Å; W376-S436 VanDerWaalsContact CE3-CB 3.4Å; F379-S436 WeakPolarHBondContact CB-OG 3.23Å; F379-S436 WeakPolarHBondContact CG-OG 3.45Å; G432-S436 WeakPolarHBondContact O-CB 3.3Å; G432-S436 PolarHBondContact O-N 3.15Å; G432-S436 PolarHBondContact O-OG 2.87Å; V433-S436 WeakPolarHBondContact O-CB 3.27Å; V433-S436 PolarHBondContact O-N 3.4Å; F434-S436 VanDerWaalsContact C-N 3.31Å; F434-S436 PolarHBondContact O-N 3.47Å; S436-F439 PolarHBondContact O-N 2.81Å; S436-I440 WeakPolarHBondContact O-CB 3.47Å; S436-I440 WeakPolarHBondContact O-CD1 3.3Å; S436-I440 VanDerWaalsContact O-CG1 3.27Å; S436-I440 WeakPolarHBondContact O-CG1 3.49Å; S436-I440 PolarHBondContact O-N 3.15Å
437	L	98.3	Very high	96	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.6	-40.7	-179.6	-70.9	171.4	0	0	0	112.8	W376 I393 M414 V433 F434 M441 L449 F453 F470 F473	W376-L437 HydrophobicContact CH2-CD2 3.98Å; W376-L437 HydrophobicContact CZ3-CD2 3.63Å; W376-L437 HydrophobicContact CZ3-CG 3.89Å; I393-L437 HydrophobicContact CD1-CD2 4.33Å; M414-L437 HydrophobicContact CE-CD1 4.35Å; M414-L437 HydrophobicContact SD-CD1 4.46Å; V433-L437 HydrophobicContact CG1-CD1 4.09Å; V433-L437 WeakPolarHBondContact O-CG 3.42Å; V433-L437 PolarHBondContact O-N 3.21Å; F434-L437 PolarHBondContact O-N 2.92Å; L437-M441 PolarHBondContact O-N 3.02Å; L437-L449 HydrophobicContact CB-CD1 3.84Å; L437-L449 HydrophobicContact CD2-CD1 3.9Å; L437-L449 HydrophobicContact CD2-CD2 4.18Å; L437-L449 HydrophobicContact CG-CD1 4.36Å; L437-F453 HydrophobicContact CD1-CE2 4.25Å; L437-F453 HydrophobicContact CD1-CZ 3.91Å; L437-F453 HydrophobicContact CD2-CZ 3.88Å; L437-F470 HydrophobicContact CD1-CD1 4.21Å; L437-F470 HydrophobicContact CD1-CD2 4.41Å; L437-F470 HydrophobicContact CD1-CE1 4.1Å; L437-F470 HydrophobicContact CD1-CE2 4.3Å; L437-F470 HydrophobicContact CD1-CG 4.36Å; L437-F470 HydrophobicContact CD1-CZ 4.14Å; L437-F473 HydrophobicContact CB-CD2 3.95Å; L437-F473 HydrophobicContact CB-CE2 3.42Å; L437-F473 VanDerWaalsContact CB-CE2 3.42Å; L437-F473 HydrophobicContact CB-CZ 3.87Å; L437-F473 HydrophobicContact CD1-CD2 3.69Å; L437-F473 HydrophobicContact CD1-CE2 3.64Å; L437-F473 HydrophobicContact CG-CD2 4.41Å; L437-F473 HydrophobicContact CG-CE2 4.16Å
438	N	97.3	Very high	95.7	Very high	41 Å²	41	54.5 Å²	54.5	22%	0.219	26%	0.256	C	S	.	.	H	α-helix	trans	-62.7	-49	171.7	-75.6	-60	0	0	0	111.6	F434 N435 I440 M441 E442 F473	F434-N438 VanDerWaalsContact CD1-ND2 3.28Å; F434-N438 WeakPolarHBondContact CD1-ND2 3.35Å; F434-N438 WeakPolarHBondContact CE1-ND2 3.14Å; F434-N438 VanDerWaalsContact CZ-ND2 3.33Å; F434-N438 WeakPolarHBondContact CZ-ND2 3.17Å; F434-N438 PolarHBondContact O-N 2.86Å; F434-N438 PolarHBondContact O-ND2 3.25Å; N435-N438 PolarHBondContact O-N 3.16Å; N438-I440 PolarHBondContact O-N 3.04Å; N438-M441 WeakPolarHBondContact O-CA 3.47Å; N438-M441 PolarHBondContact O-N 3.22Å; N438-E442 WeakPolarHBondContact O-CG 3.37Å; N438-E442 PolarHBondContact O-N 2.93Å; N438-F473 WeakPolarHBondContact OD1-CE1 3.19Å
439	F	97.8	Very high	95.4	Very high	24 Å²	24	50.9 Å²	50.9	11%	0.105	24%	0.239	C	C	.	.	H	α-helix	trans	-64	-30	-177.4	-160	-118.1	0	0	0	112.6	F379 P381 I386 N435 S436 E442 K443	F379-F439 HydrophobicContact CE1-CB 3.91Å; F379-F439 AromaticContact CE1-CD1 3.76Å; F379-F439 HydrophobicContact CE1-CD1 3.76Å; F379-F439 HydrophobicContact CE1-CE1 4.43Å; F379-F439 AromaticContact CE1-CG 3.95Å; F379-F439 HydrophobicContact CE1-CG 3.95Å; F379-F439 HydrophobicContact CZ-CB 4.45Å; F379-F439 AromaticContact CZ-CD1 3.52Å; F379-F439 HydrophobicContact CZ-CD1 3.52Å; F379-F439 AromaticContact CZ-CE1 3.94Å; F379-F439 HydrophobicContact CZ-CE1 3.94Å; F379-F439 HydrophobicContact CZ-CG 4.19Å; P381-F439 HydrophobicContact CB-CD2 3.58Å; P381-F439 HydrophobicContact CB-CE2 3.57Å; P381-F439 HydrophobicContact CB-CG 4.12Å; P381-F439 HydrophobicContact CB-CZ 4.09Å; I386-F439 HydrophobicContact CB-CD1 4.07Å; I386-F439 HydrophobicContact CB-CE1 3.85Å; I386-F439 HydrophobicContact CD1-CD1 4.01Å; N435-F439 VanDerWaalsContact O-CB 3.3Å; N435-F439 WeakPolarHBondContact O-CB 3.28Å; N435-F439 PolarHBondContact O-N 3.43Å; S436-F439 PolarHBondContact O-N 2.81Å; F439-E442 WeakPolarHBondContact CD2-OE2 3.47Å; F439-K443 HydrophobicContact CD1-CG 4.21Å; F439-K443 HydrophobicContact CD2-CG 4.46Å; F439-K443 HydrophobicContact CE1-CG 4.12Å; F439-K443 HydrophobicContact CE2-CG 4.36Å; F439-K443 HydrophobicContact CG-CG 4.41Å; F439-K443 HydrophobicContact CZ-CG 4.2Å; F439-K443 VanDerWaalsContact O-CB 3.27Å; F439-K443 WeakPolarHBondContact O-CB 3.32Å; F439-K443 VanDerWaalsContact O-CG 3.29Å; F439-K443 WeakPolarHBondContact O-CG 3.27Å; F439-K443 PolarHBondContact O-N 3.08Å
440	I	97.9	Very high	95.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-40.2	170.2	-80.2	161.2	0	0	0	112.1	W376 I386 I389 I393 S436 N438 R444 V445 L446	W376-I440 HydrophobicContact CH2-CD1 3.39Å; W376-I440 HydrophobicContact CZ2-CD1 3.67Å; W376-I440 HydrophobicContact CZ3-CD1 4.19Å; I386-I440 HydrophobicContact CD1-CG1 3.83Å; I389-I440 HydrophobicContact CD1-CD1 4.05Å; I389-I440 HydrophobicContact CD1-CG1 3.98Å; I389-I440 HydrophobicContact CG1-CD1 4.43Å; I389-I440 HydrophobicContact CG1-CG1 4.42Å; I393-I440 HydrophobicContact CB-CD1 3.92Å; I393-I440 HydrophobicContact CG1-CD1 4.35Å; I393-I440 HydrophobicContact CG1-CG2 4.21Å; I393-I440 HydrophobicContact CG2-CD1 3.77Å; I393-I440 HydrophobicContact CG2-CG1 4.16Å; I393-I440 HydrophobicContact CG2-CG2 4.09Å; S436-I440 WeakPolarHBondContact O-CB 3.47Å; S436-I440 WeakPolarHBondContact O-CD1 3.3Å; S436-I440 VanDerWaalsContact O-CG1 3.27Å; S436-I440 WeakPolarHBondContact O-CG1 3.49Å; S436-I440 PolarHBondContact O-N 3.15Å; N438-I440 PolarHBondContact O-N 3.04Å; I440-R444 PolarHBondContact O-N 3.29Å; I440-V445 HydrophobicContact CG2-CB 4.2Å; I440-V445 HydrophobicContact CG2-CG1 4.42Å; I440-V445 PolarHBondContact O-N 3.25Å; I440-L446 HydrophobicContact CG2-CB 4.3Å; I440-L446 PolarHBondContact O-N 3.5Å
441	M	95.6	Very high	94.9	Very high	51 Å²	51	52.1 Å²	52.1	25%	0.251	26%	0.259	S	S	.	.	H	α-helix	trans	-76.1	-43.2	175.8	-63.5	-172.7	-62.7	0	0	112.1	L437 N438 K443 R444 L446 L449 F473	L437-M441 PolarHBondContact O-N 3.02Å; N438-M441 WeakPolarHBondContact O-CA 3.47Å; N438-M441 PolarHBondContact O-N 3.22Å; M441-K443 VanDerWaalsContact C-N 3.26Å; M441-K443 PolarHBondContact O-N 3.41Å; M441-R444 WeakPolarHBondContact O-CA 3.23Å; M441-R444 PolarHBondContact O-N 2.91Å; M441-L446 WeakPolarHBondContact CA-O 3.37Å; M441-L449 HydrophobicContact CE-CD1 4.05Å; M441-L449 HydrophobicContact CG-CD1 4.05Å; M441-L449 HydrophobicContact CG-CG 3.98Å; M441-L449 HydrophobicContact SD-CB 4.37Å; M441-L449 HydrophobicContact SD-CD1 3.73Å; M441-L449 HydrophobicContact SD-CG 3.78Å; M441-F473 HydrophobicContact CE-CD1 3.59Å; M441-F473 HydrophobicContact CE-CE1 3.46Å; M441-F473 VanDerWaalsContact CE-CE1 3.46Å; M441-F473 HydrophobicContact CE-CZ 4.45Å
442	E	94.9	Very high	94.7	Very high	129 Å²	129	47.9 Å²	47.9	60%	0.603	24%	0.239	S	C	*	.	H	α-helix	trans	-58	-37.7	175.1	-70.2	171.2	-159.4	0	0	112.3	N438 F439 R444	N438-E442 WeakPolarHBondContact O-CG 3.37Å; N438-E442 PolarHBondContact O-N 2.93Å; F439-E442 WeakPolarHBondContact CD2-OE2 3.47Å; E442-R444 VanDerWaalsContact C-N 3.33Å
443	K	91.6	Very high	94.5	Very high	119 Å²	119	47.8 Å²	47.8	52%	0.517	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	6.7	174.8	-60.7	-55.2	-178.1	-172.1	0	113.9	I386 F439 M441 V445	I386-K443 HydrophobicContact CB-CG 4.39Å; I386-K443 HydrophobicContact CD1-CB 4.19Å; I386-K443 HydrophobicContact CD1-CG 4.42Å; I386-K443 HydrophobicContact CG1-CB 4.07Å; I386-K443 HydrophobicContact CG1-CG 4.27Å; F439-K443 HydrophobicContact CD1-CG 4.21Å; F439-K443 HydrophobicContact CD2-CG 4.46Å; F439-K443 HydrophobicContact CE1-CG 4.12Å; F439-K443 HydrophobicContact CE2-CG 4.36Å; F439-K443 HydrophobicContact CG-CG 4.41Å; F439-K443 HydrophobicContact CZ-CG 4.2Å; F439-K443 VanDerWaalsContact O-CB 3.27Å; F439-K443 WeakPolarHBondContact O-CB 3.32Å; F439-K443 VanDerWaalsContact O-CG 3.29Å; F439-K443 WeakPolarHBondContact O-CG 3.27Å; F439-K443 PolarHBondContact O-N 3.08Å; M441-K443 VanDerWaalsContact C-N 3.26Å; M441-K443 PolarHBondContact O-N 3.41Å; K443-V445 HydrophobicContact CB-CG2 4.39Å; K443-V445 PolarHBondContact O-N 3.16Å; K443-V445 VanDerWaalsContact O-N 3.07Å
444	R	92.1	Very high	94.2	Very high	212 Å²	212	50.1 Å²	50.1	80%	0.8	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	22.4	178.4	-58.6	-176.1	176.4	-173.3	-1.1	115.2	I440 M441 E442 L446	I440-R444 PolarHBondContact O-N 3.29Å; M441-R444 WeakPolarHBondContact O-CA 3.23Å; M441-R444 PolarHBondContact O-N 2.91Å; E442-R444 VanDerWaalsContact C-N 3.33Å; R444-L446 PolarHBondContact O-N 2.96Å
445	V	93.2	Very high	94	Very high	30 Å²	30	49.4 Å²	49.4	18%	0.182	25%	0.249	C	C	.	.	S	Bend	trans	-63	-32.2	172.9	171.2	0	0	0	0	110.8	I386 E390 I393 L394 I440 K443	I386-V445 HydrophobicContact CD1-CG2 3.86Å; I386-V445 HydrophobicContact CG1-CG2 3.67Å; E390-V445 HydrophobicContact CB-CG1 3.8Å; E390-V445 HydrophobicContact CB-CG2 4.44Å; I393-V445 HydrophobicContact CG2-CG1 3.74Å; L394-V445 HydrophobicContact CD1-CG1 4.27Å; L394-V445 HydrophobicContact CD2-CG1 4.03Å; L394-V445 HydrophobicContact CG-CG1 4.03Å; I440-V445 HydrophobicContact CG2-CB 4.2Å; I440-V445 HydrophobicContact CG2-CG1 4.42Å; I440-V445 PolarHBondContact O-N 3.25Å; K443-V445 HydrophobicContact CB-CG2 4.39Å; K443-V445 PolarHBondContact O-N 3.16Å; K443-V445 VanDerWaalsContact O-N 3.07Å
446	L	91.6	Very high	93.7	Very high	18 Å²	18	52.7 Å²	52.7	9%	0.094	27%	0.273	C	S	.	.	S	Bend	trans	-138.5	127.9	150.6	-70.4	-177.9	0	0	0	107.5	I393 H397 I440 M441 R444 H448 L449 L452	I393-L446 HydrophobicContact CD1-CD1 4.18Å; I393-L446 HydrophobicContact CG1-CD1 3.53Å; I393-L446 HydrophobicContact CG1-CG 4.21Å; H397-L446 HydrophobicContact CB-CD1 4.21Å; H397-L446 HydrophobicContact CB-CD2 4.1Å; I440-L446 HydrophobicContact CG2-CB 4.3Å; I440-L446 PolarHBondContact O-N 3.5Å; M441-L446 WeakPolarHBondContact CA-O 3.37Å; R444-L446 PolarHBondContact O-N 2.96Å; L446-H448 VanDerWaalsContact C-N 3.3Å; L446-H448 PolarHBondContact O-N 3.41Å; L446-L449 HydrophobicContact CD1-CD2 4.29Å; L446-L452 HydrophobicContact CD1-CD2 4.03Å
447	A	85.6	Confident	93.4	Very high	62 Å²	62	58.1 Å²	58.1	51%	0.512	30%	0.296	S	S	.	.	S	Bend	trans	-62.5	-36.9	179.5	0	0	0	0	0	112.8
448	H	89.9	Confident	93.1	Very high	113 Å²	113	58.3 Å²	58.3	52%	0.523	30%	0.297	S	S	.	.			trans	-139.9	138.9	-179.2	-57.1	-46.3	0	0	0	111.4	L446 P451	L446-H448 VanDerWaalsContact C-N 3.3Å; L446-H448 PolarHBondContact O-N 3.41Å; H448-P451 HydrophobicContact CB-CG 4.48Å
449	L	92.9	Very high	92.9	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.01	32%	0.316	C	S	.	.	S	Bend	trans	-91.9	-24.9	179.5	-68.4	169.9	0	0	0	113.8	I393 L437 M441 L446 L452 F453 F473	I393-L449 HydrophobicContact CD1-CD2 3.92Å; I393-L449 HydrophobicContact CG1-CD2 4.43Å; L437-L449 HydrophobicContact CB-CD1 3.84Å; L437-L449 HydrophobicContact CD2-CD1 3.9Å; L437-L449 HydrophobicContact CD2-CD2 4.18Å; L437-L449 HydrophobicContact CG-CD1 4.36Å; M441-L449 HydrophobicContact CE-CD1 4.05Å; M441-L449 HydrophobicContact CG-CD1 4.05Å; M441-L449 HydrophobicContact CG-CG 3.98Å; M441-L449 HydrophobicContact SD-CB 4.37Å; M441-L449 HydrophobicContact SD-CD1 3.73Å; M441-L449 HydrophobicContact SD-CG 3.78Å; L446-L449 HydrophobicContact CD1-CD2 4.29Å; L449-L452 WeakPolarHBondContact O-CA 3.33Å; L449-L452 WeakPolarHBondContact O-CB 3.32Å; L449-L452 PolarHBondContact O-N 2.99Å; L449-F453 HydrophobicContact CD2-CE1 4.49Å; L449-F453 PolarHBondContact O-N 3.18Å; L449-F473 HydrophobicContact CB-CB 4.05Å; L449-F473 HydrophobicContact CD1-CB 3.96Å; L449-F473 HydrophobicContact CD1-CD1 4.02Å; L449-F473 HydrophobicContact CD1-CD2 4.04Å; L449-F473 HydrophobicContact CD1-CG 3.74Å
450	A	91.7	Very high	92.7	Very high	18 Å²	18	71 Å²	71	15%	0.149	35%	0.35	C	S	.	.	H	α-helix	trans	-56.4	-40.9	-177.8	0	0	0	0	0	114.3	L452 F453 D454 F473	A450-L452 PolarHBondContact O-N 3.39Å; A450-L452 VanDerWaalsContact O-N 3.17Å; A450-F453 PolarHBondContact O-N 3.06Å; A450-D454 PolarHBondContact O-N 3.13Å; A450-F473 WeakPolarHBondContact CA-O 3.46Å; A450-F473 PolarHBondContact N-O 3.24Å
451	P	92.6	Very high	92.5	Very high	86 Å²	86	79 Å²	79	56%	0.558	39%	0.388	S	S	*	.	H	α-helix	trans	-64	-18.7	175.6	-22.5	34.9	0	0	0	114.6	H448 N455	H448-P451 HydrophobicContact CB-CG 4.48Å; P451-N455 WeakPolarHBondContact O-CB 3.42Å; P451-N455 PolarHBondContact O-ND2 3.47Å
452	L	93.8	Very high	92.5	Very high	5 Å²	5	77.1 Å²	77.1	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-90.3	-44.5	173.6	-177.6	66.6	0	0	0	111.3	I393 M396 M400 T407 L446 L449 A450 L458	I393-L452 HydrophobicContact CD1-CD2 3.53Å; I393-L452 HydrophobicContact CG1-CD2 4.28Å; M396-L452 HydrophobicContact CB-CD1 4.43Å; M396-L452 HydrophobicContact CB-CD2 4.25Å; M400-L452 HydrophobicContact CE-CD1 3.85Å; T407-L452 HydrophobicContact CG2-CD1 3.94Å; L446-L452 HydrophobicContact CD1-CD2 4.03Å; L449-L452 WeakPolarHBondContact O-CA 3.33Å; L449-L452 WeakPolarHBondContact O-CB 3.32Å; L449-L452 PolarHBondContact O-N 2.99Å; A450-L452 PolarHBondContact O-N 3.39Å; A450-L452 VanDerWaalsContact O-N 3.17Å; L452-L458 WeakPolarHBondContact O-CD1 3.49Å
453	F	95.3	Very high	92.5	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-79.3	-32.5	-172.1	-76.6	11.2	0	0	0	114	L411 M414 L437 L449 A450 R463 L466 F470 F473	L411-F453 HydrophobicContact CD2-CD1 3.93Å; L411-F453 HydrophobicContact CD2-CE1 3.67Å; M414-F453 HydrophobicContact CE-CE1 4.19Å; M414-F453 HydrophobicContact CE-CZ 3.83Å; L437-F453 HydrophobicContact CD1-CE2 4.25Å; L437-F453 HydrophobicContact CD1-CZ 3.91Å; L437-F453 HydrophobicContact CD2-CZ 3.88Å; L449-F453 HydrophobicContact CD2-CE1 4.49Å; L449-F453 PolarHBondContact O-N 3.18Å; A450-F453 PolarHBondContact O-N 3.06Å; F453-R463 WeakPolarHBondContact O-CG 3.39Å; F453-L466 HydrophobicContact CB-CD1 4.4Å; F453-L466 HydrophobicContact CD1-CD2 4.31Å; F453-L466 HydrophobicContact CD2-CD2 4.24Å; F453-L466 HydrophobicContact CE1-CD2 4.42Å; F453-L466 HydrophobicContact CE2-CD2 4.33Å; F453-L466 HydrophobicContact CG-CD2 4.23Å; F453-L466 HydrophobicContact CZ-CD2 4.43Å; F453-L466 WeakPolarHBondContact O-CD1 3.48Å; F453-F470 HydrophobicContact CE2-CB 4.21Å; F453-F470 HydrophobicContact CE2-CD2 4.42Å; F453-F473 HydrophobicContact CD2-CB 3.9Å; F453-F473 HydrophobicContact CE2-CB 3.75Å; F453-F473 HydrophobicContact CE2-CD2 4.16Å; F453-F473 HydrophobicContact CE2-CG 4.44Å
454	D	92	Very high	92.6	Very high	49 Å²	49	71.7 Å²	71.7	26%	0.262	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	21.6	177.1	-154.3	-1.8	0	0	0	113	A450 R463 R467	A450-D454 PolarHBondContact O-N 3.13Å; D454-R463 VanDerWaalsContact C-CD 3.43Å; D454-R463 PolarHBondContact O-NH1 3.31Å; D454-R463 WeakPolarHBondContact OD1-CD 3.35Å; D454-R463 IonicContact OD1-CZ 3.58Å; D454-R463 IonicContact OD1-NE 3.26Å; D454-R463 IonicContact OD1-NH1 3.74Å; D454-R463 PolarHBondContact OD1-NH1 3.36Å; D454-R467 IonicContact OD1-NH2 3.25Å; D454-R467 IonicContact OD2-CZ 2.78Å; D454-R467 IonicContact OD2-NH2 3.73Å; D454-R467 PolarHBondContact OD2-NH2 3.14Å
455	N	92.4	Very high	92.7	Very high	37 Å²	37	63.8 Å²	63.8	20%	0.198	33%	0.333	C	S	.	.			trans	-60.5	130.3	-175.7	-162.4	-77.4	0	0	0	111.7	M400 P451 K457 L458 R463	M400-N455 HydrophobicContact CE-CB 3.58Å; M400-N455 HydrophobicContact SD-CB 4.06Å; P451-N455 WeakPolarHBondContact O-CB 3.42Å; P451-N455 PolarHBondContact O-ND2 3.47Å; N455-K457 PolarHBondContact O-N 3.29Å; N455-K457 WeakPolarHBondContact OD1-CB 3.24Å; N455-K457 PolarHBondContact OD1-N 3.4Å; N455-L458 HydrophobicContact CB-CD1 4.41Å; N455-L458 HydrophobicContact CB-CG 4.35Å; N455-L458 WeakPolarHBondContact O-CB 3.5Å; N455-L458 PolarHBondContact O-N 3.23Å; N455-R463 VanDerWaalsContact O-CD 3.28Å; N455-R463 WeakPolarHBondContact O-CD 3.26Å; N455-R463 PolarHBondContact O-NE 3.08Å
456	P	92	Very high	92.8	Very high	110 Å²	110	62.3 Å²	62.3	71%	0.714	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.3	-178.4	-29.4	36.5	0	0	0	115.4	L458	P456-L458 PolarHBondContact O-N 3.01Å
457	K	92.4	Very high	92.9	Very high	115 Å²	115	67.5 Å²	67.5	50%	0.5	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-9	175.3	-70.4	-173.8	167.6	-171.8	0	114.8	M400 K401 P404 N455	M400-K457 WeakPolarHBondContact O-CD 3.38Å; M400-K457 HydrophobicContact SD-CB 4Å; K401-K457 PolarHBondContact O-NZ 2.65Å; P404-K457 HydrophobicContact CB-CB 4.4Å; N455-K457 PolarHBondContact O-N 3.29Å; N455-K457 WeakPolarHBondContact OD1-CB 3.24Å; N455-K457 PolarHBondContact OD1-N 3.4Å
458	L	93.5	Very high	93.2	Very high	4 Å²	4	70.5 Å²	70.5	2%	0.021	35%	0.346	C	S	.	.	S	Bend	trans	-93.7	143.6	175.9	-64.3	178.3	0	0	0	111.7	M400 A408 L411 L452 N455 P456 L462 R463 L466	M400-L458 HydrophobicContact CE-CD1 3.89Å; M400-L458 HydrophobicContact CE-CD2 3.93Å; M400-L458 HydrophobicContact CE-CG 3.77Å; M400-L458 HydrophobicContact SD-CD2 4.27Å; M400-L458 HydrophobicContact SD-CG 4.3Å; A408-L458 HydrophobicContact CB-CD2 3.8Å; L411-L458 HydrophobicContact CD1-CD1 3.53Å; L411-L458 HydrophobicContact CD1-CD2 4.33Å; L452-L458 WeakPolarHBondContact O-CD1 3.49Å; N455-L458 HydrophobicContact CB-CD1 4.41Å; N455-L458 HydrophobicContact CB-CG 4.35Å; N455-L458 WeakPolarHBondContact O-CB 3.5Å; N455-L458 PolarHBondContact O-N 3.23Å; P456-L458 PolarHBondContact O-N 3.01Å; L458-L462 HydrophobicContact CD2-CD2 4.21Å; L458-R463 HydrophobicContact CB-CG 3.66Å; L458-R463 HydrophobicContact CD1-CG 4.31Å; L458-R463 PolarHBondContact O-NE 2.85Å; L458-R463 PolarHBondContact O-NH2 2.88Å; L458-L466 HydrophobicContact CD1-CD1 4.43Å
459	D	92.1	Very high	93.3	Very high	113 Å²	113	67.9 Å²	67.9	60%	0.604	33%	0.332	S	S	*	.			trans	-54.6	138.3	175.6	-60.6	-66.1	0	0	0	112.1	E461 L462 R463	D459-E461 PolarHBondContact O-N 2.9Å; D459-L462 HydrophobicContact CB-CB 4.37Å; D459-L462 PolarHBondContact O-N 3.48Å; D459-L462 VanDerWaalsContact O-N 3.08Å; D459-R463 PolarHBondContact O-N 2.93Å
460	R	92.9	Very high	93.3	Very high	219 Å²	219	67.8 Å²	67.8	83%	0.826	33%	0.331	S	S	*	.	H	α-helix	trans	-57	-35.4	-177.7	-175.8	178.6	176.6	177.2	0.5	112.6	S464	R460-S464 WeakPolarHBondContact O-CB 3.22Å; R460-S464 PolarHBondContact O-N 2.9Å
461	E	94.5	Very high	93.3	Very high	168 Å²	168	69.8 Å²	69.8	79%	0.785	34%	0.343	S	S	*	.	H	α-helix	trans	-67.5	-43.5	177.2	-62.8	-171.9	176.9	0	0	112.1	D459 S464 M465	D459-E461 PolarHBondContact O-N 2.9Å; E461-S464 WeakPolarHBondContact O-CB 3.41Å; E461-S464 PolarHBondContact O-N 3.4Å; E461-M465 PolarHBondContact O-N 2.88Å
462	L	94.6	Very high	93.2	Very high	11 Å²	11	70.5 Å²	70.5	6%	0.058	34%	0.339	C	S	.	.	H	α-helix	trans	-64.5	-42.3	176.9	176.1	57.4	0	0	0	111.3	A408 L411 D412 L458 D459 S464 M465 L466	A408-L462 HydrophobicContact CB-CD2 3.85Å; A408-L462 WeakPolarHBondContact O-CD2 3.49Å; L411-L462 HydrophobicContact CB-CD1 4.27Å; L411-L462 HydrophobicContact CB-CD2 4.27Å; D412-L462 HydrophobicContact CB-CD1 3.98Å; L458-L462 HydrophobicContact CD2-CD2 4.21Å; D459-L462 HydrophobicContact CB-CB 4.37Å; D459-L462 PolarHBondContact O-N 3.48Å; D459-L462 VanDerWaalsContact O-N 3.08Å; L462-S464 VanDerWaalsContact C-N 3.33Å; L462-S464 PolarHBondContact O-N 3.32Å; L462-M465 WeakPolarHBondContact O-CB 3.18Å; L462-M465 PolarHBondContact O-N 3.46Å; L462-L466 HydrophobicContact CD1-CD1 4.29Å; L462-L466 HydrophobicContact CD1-CG 4.44Å; L462-L466 HydrophobicContact CG-CD1 4.14Å; L462-L466 WeakPolarHBondContact O-CG 3.38Å; L462-L466 PolarHBondContact O-N 3.35Å
463	R	95.1	Very high	93.1	Very high	58 Å²	58	70.8 Å²	70.8	22%	0.219	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-36.6	174.7	-64.9	-164.9	-84.8	143	-13.4	112.6	F453 D454 N455 L458 D459 L466 R467	F453-R463 WeakPolarHBondContact O-CG 3.39Å; D454-R463 VanDerWaalsContact C-CD 3.43Å; D454-R463 PolarHBondContact O-NH1 3.31Å; D454-R463 WeakPolarHBondContact OD1-CD 3.35Å; D454-R463 IonicContact OD1-CZ 3.58Å; D454-R463 IonicContact OD1-NE 3.26Å; D454-R463 IonicContact OD1-NH1 3.74Å; D454-R463 PolarHBondContact OD1-NH1 3.36Å; N455-R463 VanDerWaalsContact O-CD 3.28Å; N455-R463 WeakPolarHBondContact O-CD 3.26Å; N455-R463 PolarHBondContact O-NE 3.08Å; L458-R463 HydrophobicContact CB-CG 3.66Å; L458-R463 HydrophobicContact CD1-CG 4.31Å; L458-R463 PolarHBondContact O-NE 2.85Å; L458-R463 PolarHBondContact O-NH2 2.88Å; D459-R463 PolarHBondContact O-N 2.93Å; R463-L466 PolarHBondContact O-N 3.33Å; R463-R467 WeakPolarHBondContact O-CB 3.2Å; R463-R467 PolarHBondContact O-N 3.08Å
464	S	94	Very high	92.7	Very high	76 Å²	76	71.2 Å²	71.2	53%	0.531	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-40.6	171.7	-164	0	0	0	0	112.1	R460 E461 L462 R467 E468	R460-S464 WeakPolarHBondContact O-CB 3.22Å; R460-S464 PolarHBondContact O-N 2.9Å; E461-S464 WeakPolarHBondContact O-CB 3.41Å; E461-S464 PolarHBondContact O-N 3.4Å; L462-S464 VanDerWaalsContact C-N 3.33Å; L462-S464 PolarHBondContact O-N 3.32Å; S464-R467 PolarHBondContact O-N 3.33Å; S464-E468 WeakPolarHBondContact O-CB 3.32Å; S464-E468 PolarHBondContact O-N 3.28Å
465	M	95	Very high	91.9	Very high	45 Å²	45	72.5 Å²	72.5	22%	0.222	36%	0.355	C	S	.	.	H	α-helix	trans	-66.6	-40.1	176.7	-167.9	-171.8	-53	0	0	112	C415 E461 L462 E468 R469	C415-M465 HydrophobicContact CB-CG 4.01Å; C415-M465 HydrophobicContact CB-SD 3.48Å; C415-M465 WeakPolarHBondContact CB-SD 3.13Å; E461-M465 PolarHBondContact O-N 2.88Å; L462-M465 WeakPolarHBondContact O-CB 3.18Å; L462-M465 PolarHBondContact O-N 3.46Å; M465-E468 PolarHBondContact O-N 3.26Å; M465-R469 WeakPolarHBondContact O-CB 3.35Å; M465-R469 VanDerWaalsContact O-CG 3.24Å; M465-R469 WeakPolarHBondContact O-CG 3.25Å; M465-R469 PolarHBondContact O-N 3.01Å
466	L	94.8	Very high	90.2	Very high	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-62.2	-44	173.1	-74.9	160.1	0	0	0	111.1	L411 M414 C415 F453 L458 L462 R463 R469 F470	L411-L466 HydrophobicContact CB-CD1 4.26Å; L411-L466 HydrophobicContact CB-CD2 4.43Å; L411-L466 HydrophobicContact CD1-CD1 4.03Å; L411-L466 HydrophobicContact CD2-CD1 4.5Å; L411-L466 HydrophobicContact CD2-CD2 4.11Å; L411-L466 HydrophobicContact CG-CD1 4.5Å; M414-L466 HydrophobicContact CE-CD2 4.19Å; C415-L466 VanDerWaalsContact SG-CD2 3.58Å; F453-L466 HydrophobicContact CB-CD1 4.4Å; F453-L466 HydrophobicContact CD1-CD2 4.31Å; F453-L466 HydrophobicContact CD2-CD2 4.24Å; F453-L466 HydrophobicContact CE1-CD2 4.42Å; F453-L466 HydrophobicContact CE2-CD2 4.33Å; F453-L466 HydrophobicContact CG-CD2 4.23Å; F453-L466 HydrophobicContact CZ-CD2 4.43Å; F453-L466 WeakPolarHBondContact O-CD1 3.48Å; L458-L466 HydrophobicContact CD1-CD1 4.43Å; L462-L466 HydrophobicContact CD1-CD1 4.29Å; L462-L466 HydrophobicContact CD1-CG 4.44Å; L462-L466 HydrophobicContact CG-CD1 4.14Å; L462-L466 WeakPolarHBondContact O-CG 3.38Å; L462-L466 PolarHBondContact O-N 3.35Å; R463-L466 PolarHBondContact O-N 3.33Å; L466-R469 PolarHBondContact O-N 3.08Å; L466-F470 WeakPolarHBondContact O-CA 3.41Å; L466-F470 PolarHBondContact O-N 3.18Å
467	R	93.4	Very high	88	Confident	127 Å²	127	75 Å²	75	48%	0.479	37%	0.374	S	S	.	.	H	α-helix	trans	-70.4	-32	178.5	-161.7	-177.4	-65.8	154.3	-3.2	113.6	D454 R463 S464 P471 C474	D454-R467 IonicContact OD1-NH2 3.25Å; D454-R467 IonicContact OD2-CZ 2.78Å; D454-R467 IonicContact OD2-NH2 3.73Å; D454-R467 PolarHBondContact OD2-NH2 3.14Å; R463-R467 WeakPolarHBondContact O-CB 3.2Å; R463-R467 PolarHBondContact O-N 3.08Å; S464-R467 PolarHBondContact O-N 3.33Å; R467-P471 WeakPolarHBondContact O-CA 3.38Å; R467-P471 WeakPolarHBondContact O-CD 3.21Å; R467-C474 HydrophobicContact CB-CB 4.23Å; R467-C474 HydrophobicContact CG-CB 3.93Å
468	E	92.6	Very high	85.1	Confident	124 Å²	124	74.3 Å²	74.3	58%	0.579	38%	0.383	S	S	*	.	H	α-helix	trans	-65	-45.7	169.2	-178.4	-157.1	117.8	0	0	111.1	S464 M465	S464-E468 WeakPolarHBondContact O-CB 3.32Å; S464-E468 PolarHBondContact O-N 3.28Å; M465-E468 PolarHBondContact O-N 3.26Å
469	R	91.6	Very high	82.4	Confident	59 Å²	59	79.1 Å²	79.1	22%	0.223	42%	0.415	C	S	.	.	H	α-helix	trans	-82.2	-32.4	-172.3	-67.4	-75.2	153.5	162.5	-6	112.8	E426 R430 M465 L466	E426-R469 IonicContact OE1-NH1 2.73Å; E426-R469 PolarHBondContact OE1-NH1 3.46Å; R430-R469 PolarHBondContact NH1-O 3.36Å; R430-R469 PolarHBondContact NH2-O 3.04Å; M465-R469 WeakPolarHBondContact O-CB 3.35Å; M465-R469 VanDerWaalsContact O-CG 3.24Å; M465-R469 WeakPolarHBondContact O-CG 3.25Å; M465-R469 PolarHBondContact O-N 3.01Å; L466-R469 PolarHBondContact O-N 3.08Å
470	F	93.9	Very high	79.6	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	43%	0.427	C	S	.	.			trans	-141	61.9	-174.4	-60.5	-68.4	0	0	0	112	M414 I418 V433 F434 L437 F453 L466 E472 F473 C474	M414-F470 HydrophobicContact CE-CE2 4.22Å; I418-F470 HydrophobicContact CD1-CE2 4.04Å; I418-F470 HydrophobicContact CD1-CZ 3.62Å; V433-F470 HydrophobicContact CB-CZ 4.27Å; V433-F470 HydrophobicContact CG1-CE1 4.3Å; V433-F470 HydrophobicContact CG1-CE2 4.3Å; V433-F470 HydrophobicContact CG1-CZ 3.57Å; F434-F470 HydrophobicContact CB-CE1 4.42Å; F434-F470 HydrophobicContact CD2-CD1 4.43Å; L437-F470 HydrophobicContact CD1-CD1 4.21Å; L437-F470 HydrophobicContact CD1-CD2 4.41Å; L437-F470 HydrophobicContact CD1-CE1 4.1Å; L437-F470 HydrophobicContact CD1-CE2 4.3Å; L437-F470 HydrophobicContact CD1-CG 4.36Å; L437-F470 HydrophobicContact CD1-CZ 4.14Å; F453-F470 HydrophobicContact CE2-CB 4.21Å; F453-F470 HydrophobicContact CE2-CD2 4.42Å; L466-F470 WeakPolarHBondContact O-CA 3.41Å; L466-F470 PolarHBondContact O-N 3.18Å; F470-E472 VanDerWaalsContact C-OE2 3.25Å; F470-E472 WeakPolarHBondContact CA-OE2 3.24Å; F470-E472 PolarHBondContact O-N 3.14Å; F470-F473 HydrophobicContact CB-CB 4.38Å; F470-F473 HydrophobicContact CB-CD2 3.78Å; F470-F473 HydrophobicContact CB-CG 4.47Å; F470-F473 AromaticContact CD1-CD2 3.97Å; F470-F473 HydrophobicContact CD1-CD2 3.97Å; F470-F473 AromaticContact CD1-CE2 3.95Å; F470-F473 HydrophobicContact CD1-CE2 3.95Å; F470-F473 HydrophobicContact CG-CD2 4.07Å; F470-F473 HydrophobicContact CG-CE2 4.5Å; F470-F473 PolarHBondContact O-N 3.19Å; F470-F473 VanDerWaalsContact O-N 3.12Å; F470-C474 PolarHBondContact O-N 3.41Å; F470-C474 PolarHBondContact O-SG 3.2Å
471	P	91.5	Very high	76.6	Confident	60 Å²	60	75.5 Å²	75.5	39%	0.39	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-57.5	-29.8	179	25.1	-35.2	0	0	0	112.9	R467 F473 C474 S475	R467-P471 WeakPolarHBondContact O-CA 3.38Å; R467-P471 WeakPolarHBondContact O-CD 3.21Å; P471-F473 PolarHBondContact O-N 2.75Å; P471-C474 PolarHBondContact O-N 3.13Å; P471-S475 PolarHBondContact O-OG 3.2Å
472	E	90.1	Very high	73.6	Confident	101 Å²	101	76.2 Å²	76.2	47%	0.472	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-63.1	-29.1	179.6	-47.1	86.5	167.1	0	0	112.5	F434 F470	F434-E472 HydrophobicContact CE2-CB 4.47Å; F434-E472 HydrophobicContact CE2-CG 4.18Å; F470-E472 VanDerWaalsContact C-OE2 3.25Å; F470-E472 WeakPolarHBondContact CA-OE2 3.24Å; F470-E472 PolarHBondContact O-N 3.14Å
473	F	91.9	Very high	70.6	Confident	10 Å²	10	82.3 Å²	82.3	4%	0.044	46%	0.464	C	S	.	.	G	3₁₀ helix	trans	-103.9	-4.8	-176.1	-54.6	-36.2	0	0	0	113.6	F434 L437 N438 M441 L449 A450 F453 F470 P471	F434-F473 AromaticContact CD2-CE2 3.64Å; F434-F473 HydrophobicContact CD2-CE2 3.64Å; F434-F473 AromaticContact CD2-CZ 3.55Å; F434-F473 HydrophobicContact CD2-CZ 3.55Å; F434-F473 HydrophobicContact CE2-CE1 4.23Å; F434-F473 AromaticContact CE2-CE2 3.98Å; F434-F473 HydrophobicContact CE2-CE2 3.98Å; F434-F473 AromaticContact CE2-CZ 3.51Å; F434-F473 HydrophobicContact CE2-CZ 3.51Å; F434-F473 HydrophobicContact CG-CZ 4.35Å; F434-F473 HydrophobicContact CZ-CZ 4.3Å; L437-F473 HydrophobicContact CB-CD2 3.95Å; L437-F473 HydrophobicContact CB-CE2 3.42Å; L437-F473 VanDerWaalsContact CB-CE2 3.42Å; L437-F473 HydrophobicContact CB-CZ 3.87Å; L437-F473 HydrophobicContact CD1-CD2 3.69Å; L437-F473 HydrophobicContact CD1-CE2 3.64Å; L437-F473 HydrophobicContact CG-CD2 4.41Å; L437-F473 HydrophobicContact CG-CE2 4.16Å; N438-F473 WeakPolarHBondContact OD1-CE1 3.19Å; M441-F473 HydrophobicContact CE-CD1 3.59Å; M441-F473 HydrophobicContact CE-CE1 3.46Å; M441-F473 VanDerWaalsContact CE-CE1 3.46Å; M441-F473 HydrophobicContact CE-CZ 4.45Å; L449-F473 HydrophobicContact CB-CB 4.05Å; L449-F473 HydrophobicContact CD1-CB 3.96Å; L449-F473 HydrophobicContact CD1-CD1 4.02Å; L449-F473 HydrophobicContact CD1-CD2 4.04Å; L449-F473 HydrophobicContact CD1-CG 3.74Å; A450-F473 WeakPolarHBondContact CA-O 3.46Å; A450-F473 PolarHBondContact N-O 3.24Å; F453-F473 HydrophobicContact CD2-CB 3.9Å; F453-F473 HydrophobicContact CE2-CB 3.75Å; F453-F473 HydrophobicContact CE2-CD2 4.16Å; F453-F473 HydrophobicContact CE2-CG 4.44Å; F470-F473 HydrophobicContact CB-CB 4.38Å; F470-F473 HydrophobicContact CB-CD2 3.78Å; F470-F473 HydrophobicContact CB-CG 4.47Å; F470-F473 AromaticContact CD1-CD2 3.97Å; F470-F473 HydrophobicContact CD1-CD2 3.97Å; F470-F473 AromaticContact CD1-CE2 3.95Å; F470-F473 HydrophobicContact CD1-CE2 3.95Å; F470-F473 HydrophobicContact CG-CD2 4.07Å; F470-F473 HydrophobicContact CG-CE2 4.5Å; F470-F473 PolarHBondContact O-N 3.19Å; F470-F473 VanDerWaalsContact O-N 3.12Å; P471-F473 PolarHBondContact O-N 2.75Å
474	C	85.6	Confident	67.4	Low	9 Å²	9	89.4 Å²	89.4	6%	0.061	50%	0.497	C	S	.	.	S	Bend	trans	-99.4	2	-178.7	-63.7	0	0	0	0	113.7	R467 F470 P471	R467-C474 HydrophobicContact CB-CB 4.23Å; R467-C474 HydrophobicContact CG-CB 3.93Å; F470-C474 PolarHBondContact O-N 3.41Å; F470-C474 PolarHBondContact O-SG 3.2Å; P471-C474 PolarHBondContact O-N 3.13Å
475	S	77.1	Confident	64.2	Low	77 Å²	77	93.4 Å²	93.4	54%	0.538	51%	0.509	S	S	.	.	S	Bend	trans	-106	138.9	179.5	-54.3	0	0	0	0	110	P471	P471-S475 PolarHBondContact O-OG 3.2Å
476	P	56.7	Low	60.9	Low	103 Å²	103	99.2 Å²	99.2	67%	0.669	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-64.2	150.5	165.3	30.1	-34.1	0	0	0	109.6	S478	P476-S478 PolarHBondContact O-N 2.71Å
477	P	43.9	Very low	57.6	Low	97 Å²	97	109 Å²	109	63%	0.63	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-66.1	118.8	179	27	-33.4	0	0	0	110.6
478	S	33.4	Very low	54.4	Low	100 Å²	100	107.2 Å²	107.2	70%	0.699	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-59.3	140.2	167.7	-53.9	0	0	0	0	110	P476	P476-S478 PolarHBondContact O-N 2.71Å
479	P	35.6	Very low	51.1	Low	104 Å²	104	107.3 Å²	107.3	68%	0.675	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-59.2	147.5	168.1	27.1	-34.2	0	0	0	109.8	T481	P479-T481 PolarHBondContact O-N 3.34Å; P479-T481 PolarHBondContact O-OG1 3.21Å
480	P	33.3	Very low	47.9	Very low	134 Å²	134	110 Å²	110	87%	0.87	63%	0.63	S	S	*	*			trans	-63.2	106.4	-175.5	25.6	-34.1	0	0	0	110.7	E482	P480-E482 PolarHBondContact O-N 2.93Å
481	T	31.2	Very low	44.6	Very low	122 Å²	122	117 Å²	117	75%	0.748	67%	0.665	S	S	*	*			trans	-85	114.8	-169.6	-25.6	0	0	0	0	111.9	P479	P479-T481 PolarHBondContact O-N 3.34Å; P479-T481 PolarHBondContact O-OG1 3.21Å
482	E	30.2	Very low	41.3	Very low	184 Å²	184	121.8 Å²	121.8	86%	0.86	68%	0.682	S	S	*	*			trans	-64.6	149	162.8	-71.5	-157.7	140.9	0	0	111.3	P480 K484	P480-E482 PolarHBondContact O-N 2.93Å; E482-K484 PolarHBondContact O-N 3.16Å
483	V	31.7	Very low	38.2	Very low	138 Å²	138	125.1 Å²	125.1	84%	0.836	70%	0.7	S	S	*	*			trans	-76.7	122.7	-172	-176.6	0	0	0	0	112.1
484	K	28.1	Very low	34.9	Very low	208 Å²	208	131.2 Å²	131.2	90%	0.904	73%	0.733	S	S	*	*			trans	-154.9	162.4	154.2	-107.5	146.5	-168.2	167.9	0	112.4	E482	E482-K484 PolarHBondContact O-N 3.16Å
485	M	27.3	Very low	32.3	Very low	159 Å²	159	136.8 Å²	136.8	78%	0.783	76%	0.762	S	S	*	*			trans	-93.4	151	-164.6	-69.8	161.2	52.2	0	0	114.1
486	E	26	Very low	29.8	Very low	168 Å²	168	141.8 Å²	141.8	79%	0.785	78%	0.776	S	S	*	*			trans	29.8	119.3	139.4	-56.2	178.2	136.5	0	0	120
487	E	25	Very low	28.3	Very low	204 Å²	204	141.7 Å²	141.7	95%	0.953	77%	0.773	S	S	*	*				-160	-172.8	108.2	-113.4	-177.3	178.8	0	0	111.6
488	A	25.8	Very low	27.4	Very low	90 Å²	90	144.6 Å²	144.6	74%	0.744	78%	0.783	S	S	*	*			trans	-135	147.9	-141.5	0	0	0	0	0	118.9
489	V	23.8	Very low	27.1	Very low	127 Å²	127	146.6 Å²	146.6	77%	0.77	79%	0.786	S	S	*	*			trans	67.6	115	147.8	175.1	0	0	0	0	121.3
490	S	24.5	Very low	26.6	Very low	115 Å²	115	151.5 Å²	151.5	80%	0.804	80%	0.797	S	S	*	*				-172.1	127	127.3	15.9	0	0	0	0	107.2
491	M	23.7	Very low	26.3	Very low	148 Å²	148	153.9 Å²	153.9	73%	0.729	80%	0.796	S	S	*	*				76.5	122.2	55.2	-84	-165.1	70.6	0	0	115.8
492	E	22.6	Very low	26	Very low	159 Å²	159	157.8 Å²	157.8	74%	0.743	81%	0.806	S	S	*	*			trans	70.7	146.1	163.9	-64.9	176.6	-169	0	0	117
493	M	25.4	Very low	25.7	Very low	172 Å²	172	152.4 Å²	152.4	85%	0.847	80%	0.8	S	S	*	*			cis	-149.4	176.5	-5.1	-134	171	61.5	0	0	112.7
494	D	22.1	Very low	25.2	Very low	137 Å²	137	152.2 Å²	152.2	73%	0.733	80%	0.803	S	S	*	*			trans	-86	172.4	-169.4	-146.4	-26.6	0	0	0	114.9
495	N	30.1	Very low	25	Very low	126 Å²	126	152.7 Å²	152.7	67%	0.674	80%	0.801	S	S	*	*			trans	-47.1	149.5	-179.2	-73.5	-89.2	0	0	0	117
496	H	24.8	Very low	24.8	Very low	183 Å²	183	152.4 Å²	152.4	85%	0.847	80%	0.803	S	S	*	*			trans	-144.8	114.8	133.6	-100.3	-86.1	0	0	0	108.2
497	V	25.3	Very low	25	Very low	100 Å²	100	150 Å²	150	61%	0.606	79%	0.791	S	S	*	*				93.8	108.5	58.3	161.2	0	0	0	0	112.4
498	L	26	Very low	25	Very low	158 Å²	158	147.4 Å²	147.4	83%	0.827	79%	0.789	S	S	*	*				-172.5	141.3	115.8	-101.5	175.7	0	0	0	112.1
499	D	25.9	Very low	25.2	Very low	142 Å²	142	149.8 Å²	149.8	76%	0.759	79%	0.785	S	S	*	*			trans	-70.9	161.6	171.2	-49.2	-88.1	0	0	0	112.6
500	K	25.3	Very low	25.4	Very low	208 Å²	208	148.6 Å²	148.6	90%	0.904	79%	0.788	S	S	*	*				-153.6	128.3	127.5	-121.3	178.5	-179	-168.1	0	113.9
501	E	27.7	Very low	25.7	Very low	183 Å²	183	146.5 Å²	146.5	86%	0.855	78%	0.778	S	S	*	*			trans	-80.1	135.1	170.4	-55.5	169.2	113.8	0	0	110.4
502	E	23.9	Very low	26	Very low	204 Å²	204	145.1 Å²	145.1	95%	0.953	77%	0.768	S	S	*	*			trans	-176.2	138	144.9	-106.2	169.2	-147.7	0	0	108
503	G	24.3	Very low	26.3	Very low	72 Å²	72	141 Å²	141	74%	0.742	76%	0.757	S	S	*	*			cis	159.7	30.4	-1.8	0	0	0	0	0	116.6
504	C	21.3	Very low	26.8	Very low	133 Å²	133	140.6 Å²	140.6	90%	0.899	76%	0.758	S	S	*	*			trans	-150.3	143.8	172.1	-106.4	0	0	0	0	114.6
505	Y	24.8	Very low	27.8	Very low	218 Å²	218	139.4 Å²	139.4	86%	0.855	75%	0.752	S	S	*	*			trans	-93.9	152.8	168.3	-72.6	-120.8	0	0	0	109.1
506	D	23.4	Very low	28	Very low	154 Å²	154	142.3 Å²	142.3	82%	0.824	76%	0.761	S	S	*	*				-154.2	165	119.5	-142.7	-26.4	0	0	0	111.1
507	H	28.7	Very low	28.3	Very low	116 Å²	116	141.6 Å²	141.6	54%	0.537	76%	0.758	S	S	.	*			trans	-93.7	152.9	-162.8	-57.6	-101.9	0	0	0	115.1	E509	H507-E509 HydrophobicContact CB-CG 4.45Å; H507-E509 IonicContact CE1-OE1 2.71Å; H507-E509 PolarHBondContact CE1-OE1 3.49Å; H507-E509 VanDerWaalsContact CE1-OE1 3.22Å; H507-E509 IonicContact ND1-OE1 3.94Å; H507-E509 PolarHBondContact ND1-OE1 3.01Å
508	T	26.6	Very low	28.4	Very low	150 Å²	150	144.4 Å²	144.4	92%	0.92	77%	0.765	S	S	*	*				-138.5	115.7	122.8	50.6	0	0	0	0	109.8
509	E	28.6	Very low	28.4	Very low	141 Å²	141	142 Å²	142	66%	0.659	76%	0.756	S	S	*	*			trans	-107.8	157.4	-177.6	-67.7	-179.3	-174.6	0	0	113	H507	H507-E509 HydrophobicContact CB-CG 4.45Å; H507-E509 IonicContact CE1-OE1 2.71Å; H507-E509 PolarHBondContact CE1-OE1 3.49Å; H507-E509 VanDerWaalsContact CE1-OE1 3.22Å; H507-E509 IonicContact ND1-OE1 3.94Å; H507-E509 PolarHBondContact ND1-OE1 3.01Å
510	A	27.9	Very low	28.3	Very low	101 Å²	101	141.4 Å²	141.4	84%	0.835	75%	0.754	S	S	*	*			trans	-115.3	78.9	161.3	0	0	0	0	0	109.1
511	A	31.9	Very low	28.3	Very low	71 Å²	71	137 Å²	137	59%	0.587	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-75.1	155	-175.6	0	0	0	0	0	113.5
512	F	29.1	Very low	28.2	Very low	119 Å²	119	137.2 Å²	137.2	52%	0.522	74%	0.738	S	S	.	*	P	Polyproline II helix	trans	-72.8	137.8	160.7	-67.2	-91.2	0	0	0	108.7	H403	H403-F512 AromaticContact NE2-CE2 3.63Å
513	S	30	Very low	28.7	Very low	73 Å²	73	131.2 Å²	131.2	51%	0.51	73%	0.731	S	S	.	*	P	Polyproline II helix	trans	-89.9	125.6	-167.7	-149.4	0	0	0	0	112.6
514	D	35.1	Very low	28.8	Very low	163 Å²	163	137.8 Å²	137.8	87%	0.872	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-93.4	158.1	140.2	-107.5	-31.3	0	0	0	108
515	D	42.8	Very low	29.1	Very low	112 Å²	112	141.6 Å²	141.6	60%	0.599	74%	0.74	S	S	*	*			trans	-107.9	144.5	-179.4	-75.1	-44.4	0	0	0	110.2	R311	R311-D515 IonicContact NH2-OD2 3.56Å; R311-D515 PolarHBondContact NH2-OD2 3.23Å; R311-D515 VanDerWaalsContact NH2-OD2 3.15Å
516	E	34.1	Very low	29.1	Very low	187 Å²	187	141.1 Å²	141.1	87%	0.874	74%	0.737	S	S	*	*			trans	-168.9	133.1	133.7	-80.3	-128.8	143.4	0	0	113.8
517	E	32.3	Very low	29.2	Very low	168 Å²	168	143 Å²	143	79%	0.785	74%	0.741	S	S	*	*			trans	33.7	136.6	157.2	-56.7	-148.6	139.3	0	0	129.2
518	E	26.9	Very low	28.8	Very low	159 Å²	159	145 Å²	145	74%	0.743	75%	0.748	S	S	*	*			trans	78.4	108.1	137.5	-69.5	-107	115.5	0	0	125.7
519	V	26.4	Very low	28.8	Very low	107 Å²	107	146.4 Å²	146.4	65%	0.648	74%	0.736	S	S	*	*				58.1	112.5	124.7	-179.4	0	0	0	0	119.2
520	N	23.9	Very low	28.5	Very low	131 Å²	131	148.3 Å²	148.3	70%	0.701	74%	0.743	S	S	*	*				-178.6	157.1	68.2	-150.9	-22.2	0	0	0	115.7
521	N	24.8	Very low	28.3	Very low	114 Å²	114	148.7 Å²	148.7	61%	0.61	73%	0.727	S	S	*	*			trans	70.1	128.1	149.1	-95.7	-51.4	0	0	0	124.1
522	K	26.1	Very low	28	Very low	189 Å²	189	149.4 Å²	149.4	82%	0.822	73%	0.726	S	S	*	*			trans	74.2	56.6	141.4	-68.8	170.8	-173.7	178	0	121.6
523	G	34.7	Very low	27.8	Very low	78 Å²	78	151.8 Å²	151.8	80%	0.804	74%	0.742	S	S	*	*				40.7	108.7	113.7	0	0	0	0	0	121.6
524	K	25	Very low	27.7	Very low	209 Å²	209	154.2 Å²	154.2	91%	0.909	74%	0.744	S	S	*	*			trans	-141.8	131.6	134.9	-102	176.2	178.6	177.6	0	107.5	R526	K524-R526 PolarHBondContact O-N 2.89Å
525	K	28.2	Very low	27.3	Very low	213 Å²	213	155.1 Å²	155.1	93%	0.926	74%	0.743	S	S	*	*			trans	-72.4	123.6	168.9	-75.3	-173.1	173.9	-172.1	0	108.3
526	R	25.3	Very low	26.5	Very low	209 Å²	209	154.3 Å²	154.3	79%	0.789	75%	0.751	S	S	*	*			trans	-105.4	133.2	153.1	-82.3	-178.2	165.6	173.3	-7.2	106.8	K524 F528	K524-R526 PolarHBondContact O-N 2.89Å; R526-F528 HydrophobicContact CB-CD2 4.29Å; R526-F528 HydrophobicContact CB-CE2 3.89Å
527	E	24.8	Very low	26.6	Very low	194 Å²	194	149.8 Å²	149.8	91%	0.907	74%	0.736	S	S	*	*			trans	-82.2	129	167	-65.9	-179.8	139.9	0	0	107.3
528	F	21.4	Very low	26.8	Very low	157 Å²	157	149.2 Å²	149.2	69%	0.689	74%	0.737	S	S	*	*			trans	-109.9	100	173.4	-77.3	-88.8	0	0	0	107.8	R526 F530	R526-F528 HydrophobicContact CB-CD2 4.29Å; R526-F528 HydrophobicContact CB-CE2 3.89Å; F528-F530 HydrophobicContact CB-CD2 4.36Å; F528-F530 HydrophobicContact CB-CE2 4.27Å
529	R	25	Very low	27.6	Very low	179 Å²	179	146.4 Å²	146.4	68%	0.675	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-76.6	129.5	154.2	-69	-174.9	-177.6	176.6	-0.1	106.5	E633	R529-E633 IonicContact CZ-OE1 2.79Å; R529-E633 IonicContact CZ-OE2 2.75Å; R529-E633 IonicContact NH1-OE1 2.72Å; R529-E633 PolarHBondContact NH1-OE1 3.41Å; R529-E633 IonicContact NH1-OE2 2.75Å; R529-E633 PolarHBondContact NH1-OE2 3.15Å
530	F	23.8	Very low	28.7	Very low	182 Å²	182	149.4 Å²	149.4	80%	0.798	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-101.6	120.5	171.7	-96.2	-92.6	0	0	0	108.1	F528	F528-F530 HydrophobicContact CB-CD2 4.36Å; F528-F530 HydrophobicContact CB-CE2 4.27Å
531	H	22.9	Very low	30.3	Very low	109 Å²	109	148.4 Å²	148.4	51%	0.505	73%	0.731	S	S	.	*	P	Polyproline II helix	trans	-83.5	149.4	167.8	-55.7	91	0	0	0	108.9	E632	H531-E632 IonicContact CD2-OE1 3.82Å; H531-E632 IonicContact CD2-OE2 3.97Å; H531-E632 PolarHBondContact CD2-OE2 3.22Å; H531-E632 IonicContact CG-OE2 2.78Å
532	P	24.8	Very low	32.2	Very low	85 Å²	85	143.5 Å²	143.5	55%	0.552	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-59.5	144	174.8	-23.8	35.4	0	0	0	112.9	K534 E632	P532-K534 PolarHBondContact O-N 2.91Å; P532-K534 VanDerWaalsContact O-N 3.16Å; P532-E632 WeakPolarHBondContact CD-OE2 3.41Å
533	I	25.9	Very low	34.6	Very low	169 Å²	169	138.9 Å²	138.9	87%	0.867	69%	0.691	S	S	*	*			trans	-79.4	100.5	174	-57.4	175.5	0	0	0	108.1
534	K	27.4	Very low	37	Very low	125 Å²	125	135.1 Å²	135.1	54%	0.543	65%	0.653	S	S	.	*			trans	-59.6	142	170.7	-64.2	-167.5	179.5	-169	0	110.2	P532 A536 E628	P532-K534 PolarHBondContact O-N 2.91Å; P532-K534 VanDerWaalsContact O-N 3.16Å; K534-A536 PolarHBondContact O-N 3.07Å; K534-E628 PolarHBondContact NZ-O 3.37Å
535	E	27	Very low	39.7	Very low	182 Å²	182	129.3 Å²	129.3	85%	0.85	63%	0.634	S	S	*	*			trans	-66	130.8	178.7	-68.2	-163.7	121.4	0	0	111.1	V537	E535-V537 PolarHBondContact O-N 3.47Å
536	A	26.7	Very low	42.4	Very low	95 Å²	95	122.7 Å²	122.7	79%	0.785	61%	0.613	S	S	*	*			trans	-75	93.4	174.8	0	0	0	0	0	109.7	K534 I538	K534-A536 PolarHBondContact O-N 3.07Å; A536-I538 PolarHBondContact O-N 2.92Å
537	V	35.1	Very low	45.4	Very low	91 Å²	91	116.2 Å²	116.2	55%	0.552	59%	0.589	S	S	*	*			trans	-60	130	169.1	-179.9	0	0	0	0	108.7	E535 E539	E535-V537 PolarHBondContact O-N 3.47Å; V537-E539 PolarHBondContact O-N 2.67Å
538	I	37.6	Very low	48.3	Very low	157 Å²	157	107.9 Å²	107.9	81%	0.805	55%	0.55	S	S	*	*			trans	-81	111.9	170.4	-60.5	174.8	0	0	0	106.8	A536 E540	A536-I538 PolarHBondContact O-N 2.92Å; I538-E540 PolarHBondContact O-N 3.48Å
539	E	43.4	Very low	51.2	Low	99 Å²	99	106.6 Å²	106.6	46%	0.463	55%	0.551	S	S	.	*			trans	-71	115.7	177	-73.1	-170.5	-157.9	0	0	111.2	V537 R566	V537-E539 PolarHBondContact O-N 2.67Å; E539-R566 VanDerWaalsContact CD-NH2 3.3Å; E539-R566 IonicContact OE1-NH2 3.5Å; E539-R566 IonicContact OE2-CZ 3.21Å; E539-R566 IonicContact OE2-NE 3.52Å; E539-R566 PolarHBondContact OE2-NE 3.38Å; E539-R566 IonicContact OE2-NH2 3.33Å; E539-R566 PolarHBondContact OE2-NH2 3.3Å
540	E	49.1	Very low	54.1	Low	171 Å²	171	103.4 Å²	103.4	80%	0.799	54%	0.543	S	S	*	.			trans	-74.6	140.2	156.8	-65.8	-177	142.8	0	0	109	I538 A542	I538-E540 PolarHBondContact O-N 3.48Å; E540-A542 PolarHBondContact O-N 3.06Å
541	P	58.4	Low	57.1	Low	109 Å²	109	95.3 Å²	95.3	71%	0.708	51%	0.508	S	S	*	.			trans	-69.9	118.7	-177	27.7	-34.1	0	0	0	111.3	D543	P541-D543 PolarHBondContact O-N 3.19Å
542	A	64.3	Low	60.2	Low	11 Å²	11	93 Å²	93	9%	0.091	50%	0.5	C	S	.	.			trans	-51.3	107.1	177.5	0	0	0	0	0	112.8	E540 I544 Q563 E619	E540-A542 PolarHBondContact O-N 3.06Å; A542-I544 PolarHBondContact O-N 3.28Å; A542-Q563 PolarHBondContact O-NE2 3.09Å; A542-E619 HydrophobicContact CB-CG 4.08Å
543	D	76.8	Confident	63.1	Low	92 Å²	92	95.6 Å²	95.6	49%	0.492	51%	0.509	S	S	.	.			trans	-90.5	101.6	177.8	-174.6	15.9	0	0	0	111.3	P541 T545 W547	P541-D543 PolarHBondContact O-N 3.19Å; D543-T545 WeakPolarHBondContact OD1-CB 3.17Å; D543-T545 PolarHBondContact OD1-N 3.05Å; D543-T545 PolarHBondContact OD1-OG1 3.12Å; D543-W547 WeakPolarHBondContact O-CZ3 3.41Å
544	I	83.9	Confident	66.1	Low	0 Å²	0	91.2 Å²	91.2	0%	0	49%	0.491	C	S	.	.			trans	-97.8	3.6	175	57.3	170.3	0	0	0	113.5	A542 P546 W547 L548 V559 Q563 C616 E619 L620	A542-I544 PolarHBondContact O-N 3.28Å; I544-P546 VanDerWaalsContact C-N 3.31Å; I544-W547 HydrophobicContact CB-CE3 4.27Å; I544-W547 HydrophobicContact CG2-CE3 4.43Å; I544-W547 HydrophobicContact CG2-CZ3 4.47Å; I544-W547 PolarHBondContact O-N 3.23Å; I544-W547 VanDerWaalsContact O-N 3.12Å; I544-L548 HydrophobicContact CD1-CD1 4.13Å; I544-L548 HydrophobicContact CD1-CD2 3.94Å; I544-L548 HydrophobicContact CD1-CG 4.11Å; I544-L548 HydrophobicContact CG1-CD1 3.97Å; I544-L548 HydrophobicContact CG1-CD2 4.46Å; I544-L548 HydrophobicContact CG1-CG 4.08Å; I544-L548 PolarHBondContact O-N 3.13Å; I544-V559 HydrophobicContact CD1-CG1 3.7Å; I544-Q563 HydrophobicContact CD1-CB 4.35Å; I544-Q563 HydrophobicContact CD1-CG 4.42Å; I544-C616 HydrophobicContact CG2-CB 4.43Å; I544-E619 HydrophobicContact CG2-CB 4.21Å; I544-E619 HydrophobicContact CG2-CG 4.46Å; I544-L620 HydrophobicContact CD1-CD1 4.27Å; I544-L620 HydrophobicContact CD1-CD2 4.3Å; I544-L620 HydrophobicContact CD1-CG 4.39Å; I544-L620 HydrophobicContact CG2-CD2 4.48Å; I544-L620 HydrophobicContact CG2-CG 4.08Å
545	T	82.4	Confident	69	Low	86 Å²	86	85.4 Å²	85.4	53%	0.528	47%	0.465	S	S	.	.	H	α-helix	trans	-52.5	-38.4	-176.7	-47	0	0	0	0	113.8	D543 W547	D543-T545 WeakPolarHBondContact OD1-CB 3.17Å; D543-T545 PolarHBondContact OD1-N 3.05Å; D543-T545 PolarHBondContact OD1-OG1 3.12Å; T545-W547 PolarHBondContact O-N 3.47Å; T545-W547 VanDerWaalsContact O-N 3.14Å
546	P	85.2	Confident	71.8	Confident	74 Å²	74	78.6 Å²	78.6	48%	0.481	43%	0.433	S	S	.	.	H	α-helix	trans	-60	-24	179.4	-26.8	36.7	0	0	0	115.7	I544 Q550	I544-P546 VanDerWaalsContact C-N 3.31Å; P546-Q550 PolarHBondContact O-NE2 3.14Å
547	W	87.4	Confident	74.8	Confident	74 Å²	74	80.1 Å²	80.1	28%	0.28	42%	0.424	S	S	.	.	H	α-helix	trans	-109.3	-19.3	-174.4	-52.1	-72.8	0	0	0	113.5	D543 I544 T545 D549 Q550 A612 E619	D543-W547 WeakPolarHBondContact O-CZ3 3.41Å; I544-W547 HydrophobicContact CB-CE3 4.27Å; I544-W547 HydrophobicContact CG2-CE3 4.43Å; I544-W547 HydrophobicContact CG2-CZ3 4.47Å; I544-W547 PolarHBondContact O-N 3.23Å; I544-W547 VanDerWaalsContact O-N 3.12Å; T545-W547 PolarHBondContact O-N 3.47Å; T545-W547 VanDerWaalsContact O-N 3.14Å; W547-D549 PolarHBondContact O-N 3.18Å; W547-D549 VanDerWaalsContact O-N 3.12Å; W547-Q550 WeakPolarHBondContact O-CB 2.92Å; W547-Q550 PolarHBondContact O-N 2.96Å; W547-A612 HydrophobicContact CB-CB 4.4Å; W547-E619 HydrophobicContact CZ3-CB 4.38Å
548	L	85	Confident	77.4	Confident	18 Å²	18	77.7 Å²	77.7	9%	0.094	41%	0.406	C	S	.	.	H	α-helix	trans	-59.7	-24.2	-179	-79.2	176.9	0	0	0	114.1	I544 Q550 L551 K556 V559 Q560	I544-L548 HydrophobicContact CD1-CD1 4.13Å; I544-L548 HydrophobicContact CD1-CD2 3.94Å; I544-L548 HydrophobicContact CD1-CG 4.11Å; I544-L548 HydrophobicContact CG1-CD1 3.97Å; I544-L548 HydrophobicContact CG1-CD2 4.46Å; I544-L548 HydrophobicContact CG1-CG 4.08Å; I544-L548 PolarHBondContact O-N 3.13Å; L548-Q550 VanDerWaalsContact C-N 3.33Å; L548-L551 HydrophobicContact CD2-CD1 4.34Å; L548-K556 HydrophobicContact CD2-CG 4.28Å; L548-K556 VanDerWaalsContact O-CD 3.31Å; L548-K556 WeakPolarHBondContact O-CD 3.38Å; L548-K556 WeakPolarHBondContact O-CE 3.3Å; L548-K556 PolarHBondContact O-NZ 3.47Å; L548-V559 HydrophobicContact CD2-CG1 3.98Å; L548-Q560 HydrophobicContact CD1-CG 4.31Å; L548-Q560 HydrophobicContact CD2-CG 4.11Å
549	D	83.8	Confident	79.7	Confident	131 Å²	131	70.2 Å²	70.2	70%	0.701	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	2.2	177.9	-69.2	-20.5	0	0	0	113.9	W547 K556	W547-D549 PolarHBondContact O-N 3.18Å; W547-D549 VanDerWaalsContact O-N 3.12Å; D549-K556 IonicContact OD1-NZ 3.58Å; D549-K556 PolarHBondContact OD1-NZ 3.35Å
550	Q	85.6	Confident	81.8	Confident	111 Å²	111	68.3 Å²	68.3	52%	0.519	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	2.5	173.3	-62.8	162.9	56.8	0	0	112.2	P546 W547 L548 A612	P546-Q550 PolarHBondContact O-NE2 3.14Å; W547-Q550 WeakPolarHBondContact O-CB 2.92Å; W547-Q550 PolarHBondContact O-N 2.96Å; L548-Q550 VanDerWaalsContact C-N 3.33Å; Q550-A612 HydrophobicContact CB-CB 3.55Å
551	L	87.4	Confident	83.5	Confident	12 Å²	12	63.4 Å²	63.4	6%	0.063	34%	0.336	C	S	.	.	S	Bend	trans	-100.7	146.5	173.3	-59	179.7	0	0	0	110.1	L548 M555 K556 V559 Q609 A612 L613	L548-L551 HydrophobicContact CD2-CD1 4.34Å; L551-M555 HydrophobicContact CD1-CG 4.34Å; L551-M555 HydrophobicContact CD2-CG 4.26Å; L551-K556 HydrophobicContact CB-CB 4.08Å; L551-V559 HydrophobicContact CD1-CB 4.16Å; L551-V559 HydrophobicContact CD1-CG1 4.33Å; L551-V559 HydrophobicContact CD1-CG2 3.9Å; L551-Q609 HydrophobicContact CD2-CG 3.87Å; L551-A612 HydrophobicContact CD2-CB 3.92Å; L551-L613 HydrophobicContact CD2-CB 3.94Å
552	D	87.5	Confident	84.7	Confident	61 Å²	61	58.4 Å²	58.4	33%	0.326	30%	0.303	S	S	.	.			trans	-63.1	161.5	168	93.9	-69.3	0	0	0	111.3	T554 M555 K556 Q609	D552-T554 VanDerWaalsContact CG-OG1 3.32Å; D552-T554 PolarHBondContact O-N 2.97Å; D552-T554 VanDerWaalsContact O-N 3.16Å; D552-T554 PolarHBondContact OD1-OG1 2.96Å; D552-T554 WeakPolarHBondContact OD2-CA 3.46Å; D552-T554 VanDerWaalsContact OD2-CB 3.29Å; D552-T554 WeakPolarHBondContact OD2-CB 3.45Å; D552-T554 WeakPolarHBondContact OD2-CG2 3.25Å; D552-T554 PolarHBondContact OD2-N 3.06Å; D552-T554 PolarHBondContact OD2-OG1 3.38Å; D552-M555 PolarHBondContact O-N 3.46Å; D552-M555 WeakPolarHBondContact OD1-CB 3.42Å; D552-M555 PolarHBondContact OD1-N 2.92Å; D552-K556 WeakPolarHBondContact O-CB 3.36Å; D552-K556 PolarHBondContact O-N 2.91Å; D552-Q609 PolarHBondContact OD1-NE2 3.4Å
553	D	85.4	Confident	85.4	Confident	139 Å²	139	59.5 Å²	59.5	74%	0.743	31%	0.306	S	S	*	.	H	α-helix	trans	-57.8	-31.9	-177.1	-75.7	-39.4	0	0	0	113.4	E557	D553-E557 PolarHBondContact O-N 2.9Å; D553-E557 VanDerWaalsContact O-N 3.09Å
554	T	88.1	Confident	85.4	Confident	78 Å²	78	59.8 Å²	59.8	48%	0.479	30%	0.303	S	S	.	.	H	α-helix	trans	-75.3	-51.3	-178.6	71.6	0	0	0	0	112.2	D552 K556 E557 K558	D552-T554 VanDerWaalsContact CG-OG1 3.32Å; D552-T554 PolarHBondContact O-N 2.97Å; D552-T554 VanDerWaalsContact O-N 3.16Å; D552-T554 PolarHBondContact OD1-OG1 2.96Å; D552-T554 WeakPolarHBondContact OD2-CA 3.46Å; D552-T554 VanDerWaalsContact OD2-CB 3.29Å; D552-T554 WeakPolarHBondContact OD2-CB 3.45Å; D552-T554 WeakPolarHBondContact OD2-CG2 3.25Å; D552-T554 PolarHBondContact OD2-N 3.06Å; D552-T554 PolarHBondContact OD2-OG1 3.38Å; T554-K556 VanDerWaalsContact C-N 3.29Å; T554-K556 PolarHBondContact O-N 3.32Å; T554-E557 PolarHBondContact O-N 2.92Å; T554-K558 PolarHBondContact O-N 3.15Å
555	M	87.9	Confident	84.6	Confident	2 Å²	2	61 Å²	61	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-36.6	175.8	-172.2	61.1	70	0	0	111.1	L551 D552 E557 K558 V559 V596 L599 I600 F605 L613	L551-M555 HydrophobicContact CD1-CG 4.34Å; L551-M555 HydrophobicContact CD2-CG 4.26Å; D552-M555 PolarHBondContact O-N 3.46Å; D552-M555 WeakPolarHBondContact OD1-CB 3.42Å; D552-M555 PolarHBondContact OD1-N 2.92Å; M555-E557 VanDerWaalsContact C-N 3.34Å; M555-E557 PolarHBondContact O-N 2.98Å; M555-K558 PolarHBondContact O-N 3.15Å; M555-V559 HydrophobicContact CG-CG2 4.24Å; M555-V559 WeakPolarHBondContact O-CB 3.3Å; M555-V559 WeakPolarHBondContact O-CG2 3.25Å; M555-V559 PolarHBondContact O-N 2.85Å; M555-V559 HydrophobicContact SD-CG2 4.33Å; M555-V596 HydrophobicContact CE-CG1 4.34Å; M555-V596 HydrophobicContact SD-CB 4.36Å; M555-V596 HydrophobicContact SD-CG1 3.87Å; M555-V596 HydrophobicContact SD-CG2 3.98Å; M555-L599 HydrophobicContact CE-CB 3.64Å; M555-L599 HydrophobicContact CE-CD1 4.15Å; M555-I600 HydrophobicContact CE-CG1 4.28Å; M555-F605 HydrophobicContact CE-CE2 4.05Å; M555-L613 HydrophobicContact CE-CD2 3.82Å; M555-L613 HydrophobicContact CG-CD1 3.87Å; M555-L613 HydrophobicContact CG-CD2 4.12Å; M555-L613 HydrophobicContact SD-CD1 3.78Å; M555-L613 HydrophobicContact SD-CD2 3.74Å; M555-L613 HydrophobicContact SD-CG 4.43Å
556	K	87.8	Confident	83.7	Confident	40 Å²	40	59.3 Å²	59.3	17%	0.174	29%	0.294	C	S	.	.	H	α-helix	trans	-60.4	-40.1	174.7	-173	177	-166.5	141.9	0	112.2	L548 D549 L551 D552 T554 Q560	L548-K556 HydrophobicContact CD2-CG 4.28Å; L548-K556 VanDerWaalsContact O-CD 3.31Å; L548-K556 WeakPolarHBondContact O-CD 3.38Å; L548-K556 WeakPolarHBondContact O-CE 3.3Å; L548-K556 PolarHBondContact O-NZ 3.47Å; D549-K556 IonicContact OD1-NZ 3.58Å; D549-K556 PolarHBondContact OD1-NZ 3.35Å; L551-K556 HydrophobicContact CB-CB 4.08Å; D552-K556 WeakPolarHBondContact O-CB 3.36Å; D552-K556 PolarHBondContact O-N 2.91Å; T554-K556 VanDerWaalsContact C-N 3.29Å; T554-K556 PolarHBondContact O-N 3.32Å; K556-Q560 WeakPolarHBondContact O-CB 3.49Å; K556-Q560 VanDerWaalsContact O-CG 3.25Å; K556-Q560 WeakPolarHBondContact O-CG 3.48Å; K556-Q560 PolarHBondContact O-N 3.23Å
557	E	89.4	Confident	82.2	Confident	126 Å²	126	61.3 Å²	61.3	59%	0.589	30%	0.295	S	S	*	.	H	α-helix	trans	-63.4	-46.9	173.6	-177.6	164.6	-142.4	0	0	111.5	D553 T554 M555 Q560 Q561	D553-E557 PolarHBondContact O-N 2.9Å; D553-E557 VanDerWaalsContact O-N 3.09Å; T554-E557 PolarHBondContact O-N 2.92Å; M555-E557 VanDerWaalsContact C-N 3.34Å; M555-E557 PolarHBondContact O-N 2.98Å; E557-Q560 CarbonylContact O-C 3.49Å; E557-Q560 PolarHBondContact O-N 2.82Å; E557-Q561 WeakPolarHBondContact O-CB 3.48Å; E557-Q561 PolarHBondContact O-N 3.41Å
558	K	88.8	Confident	80.2	Confident	40 Å²	40	66 Å²	66	17%	0.174	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-45.8	179.9	-61.4	-60.1	-176.1	178.4	0	113.1	T554 M555 Q560 Q561 I562 V592 E595 V596 L599	T554-K558 PolarHBondContact O-N 3.15Å; M555-K558 PolarHBondContact O-N 3.15Å; K558-Q560 VanDerWaalsContact C-N 3.31Å; K558-Q560 PolarHBondContact O-N 2.93Å; K558-Q561 WeakPolarHBondContact O-CA 3.45Å; K558-Q561 WeakPolarHBondContact O-CB 3.1Å; K558-Q561 PolarHBondContact O-N 2.77Å; K558-I562 PolarHBondContact O-N 2.82Å; K558-V592 HydrophobicContact CB-CG1 4.39Å; K558-V592 HydrophobicContact CD-CG1 4.33Å; K558-E595 HydrophobicContact CD-CB 4.49Å; K558-E595 WeakPolarHBondContact CE-OE2 3.3Å; K558-E595 IonicContact NZ-OE1 2.87Å; K558-E595 PolarHBondContact NZ-OE1 2.68Å; K558-E595 IonicContact NZ-OE2 3.79Å; K558-E595 PolarHBondContact NZ-OE2 2.96Å; K558-V596 HydrophobicContact CB-CG2 3.69Å; K558-V596 HydrophobicContact CG-CG2 4.48Å; K558-L599 HydrophobicContact CG-CD1 4.1Å
559	V	86.9	Confident	78.2	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61.3	-40.4	175.3	171	0	0	0	0	111.1	I544 L548 L551 M555 Q561 I562 Q563 L613 C616 L620	I544-V559 HydrophobicContact CD1-CG1 3.7Å; L548-V559 HydrophobicContact CD2-CG1 3.98Å; L551-V559 HydrophobicContact CD1-CB 4.16Å; L551-V559 HydrophobicContact CD1-CG1 4.33Å; L551-V559 HydrophobicContact CD1-CG2 3.9Å; M555-V559 HydrophobicContact CG-CG2 4.24Å; M555-V559 WeakPolarHBondContact O-CB 3.3Å; M555-V559 WeakPolarHBondContact O-CG2 3.25Å; M555-V559 PolarHBondContact O-N 2.85Å; M555-V559 HydrophobicContact SD-CG2 4.33Å; V559-Q561 VanDerWaalsContact C-N 3.35Å; V559-I562 PolarHBondContact O-N 3.03Å; V559-Q563 PolarHBondContact O-N 3.06Å; V559-Q563 VanDerWaalsContact O-N 3.12Å; V559-L613 HydrophobicContact CG2-CD1 3.45Å; V559-L613 VanDerWaalsContact CG2-CD1 3.45Å; V559-C616 HydrophobicContact CG1-CB 3.84Å; V559-L620 HydrophobicContact CG1-CD1 3.91Å
560	Q	85.9	Confident	76	Confident	60 Å²	60	64.7 Å²	64.7	28%	0.28	32%	0.321	S	S	.	.	H	α-helix	trans	-68.6	-30.5	171.7	-73.9	-175.8	20.2	0	0	113.2	L548 K556 E557 K558 Q563 K564	L548-Q560 HydrophobicContact CD1-CG 4.31Å; L548-Q560 HydrophobicContact CD2-CG 4.11Å; K556-Q560 WeakPolarHBondContact O-CB 3.49Å; K556-Q560 VanDerWaalsContact O-CG 3.25Å; K556-Q560 WeakPolarHBondContact O-CG 3.48Å; K556-Q560 PolarHBondContact O-N 3.23Å; E557-Q560 CarbonylContact O-C 3.49Å; E557-Q560 PolarHBondContact O-N 2.82Å; K558-Q560 VanDerWaalsContact C-N 3.31Å; K558-Q560 PolarHBondContact O-N 2.93Å; Q560-Q563 PolarHBondContact O-N 2.87Å; Q560-K564 WeakPolarHBondContact O-CB 3.11Å; Q560-K564 VanDerWaalsContact O-CD 3.28Å; Q560-K564 WeakPolarHBondContact O-CD 3.39Å; Q560-K564 WeakPolarHBondContact O-CG 3.29Å; Q560-K564 PolarHBondContact O-N 2.73Å
561	Q	84.9	Confident	73.7	Confident	68 Å²	68	65.4 Å²	65.4	32%	0.318	33%	0.328	S	S	.	.	H	α-helix	trans	-65.1	-43.5	175.2	-171.5	176.2	-12.8	0	0	110.4	E557 K558 V559 Q563 K564 T565 V592	E557-Q561 WeakPolarHBondContact O-CB 3.48Å; E557-Q561 PolarHBondContact O-N 3.41Å; K558-Q561 WeakPolarHBondContact O-CA 3.45Å; K558-Q561 WeakPolarHBondContact O-CB 3.1Å; K558-Q561 PolarHBondContact O-N 2.77Å; V559-Q561 VanDerWaalsContact C-N 3.35Å; Q561-Q563 PolarHBondContact O-N 2.98Å; Q561-K564 PolarHBondContact O-N 3.08Å; Q561-T565 PolarHBondContact O-N 2.92Å; Q561-T565 PolarHBondContact O-OG1 3.25Å; Q561-T565 VanDerWaalsContact O-OG1 3.09Å; Q561-V592 HydrophobicContact CB-CG1 4.09Å; Q561-V592 HydrophobicContact CG-CG1 4.15Å; Q561-V592 HydrophobicContact CG-CG2 3.95Å; Q561-V592 VanDerWaalsContact NE2-CG2 3.27Å
562	I	83.3	Confident	71.3	Confident	4 Å²	4	73.5 Å²	73.5	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-57.6	-48.5	170.8	-61.2	171.5	0	0	0	110.7	K558 V559 K564 T565 R566 V592 M593 V596 L620 F621	K558-I562 PolarHBondContact O-N 2.82Å; V559-I562 PolarHBondContact O-N 3.03Å; I562-K564 VanDerWaalsContact C-N 3.31Å; I562-K564 PolarHBondContact O-N 2.92Å; I562-T565 PolarHBondContact O-N 3.36Å; I562-R566 PolarHBondContact O-N 3.39Å; I562-R566 VanDerWaalsContact O-N 3.1Å; I562-V592 HydrophobicContact CD1-CG1 4.3Å; I562-V592 HydrophobicContact CG1-CB 4.24Å; I562-V592 HydrophobicContact CG1-CG1 3.67Å; I562-M593 HydrophobicContact CD1-SD 4.18Å; I562-V596 HydrophobicContact CD1-CG2 4.31Å; I562-L620 HydrophobicContact CB-CD1 4.39Å; I562-L620 HydrophobicContact CG2-CD1 4.13Å; I562-F621 HydrophobicContact CG2-CE1 4.07Å; I562-F621 HydrophobicContact CG2-CZ 4.27Å
563	Q	80.9	Confident	68.8	Low	34 Å²	34	75.2 Å²	75.2	16%	0.159	38%	0.382	C	S	.	.	H	α-helix	trans	-63.5	-33.4	178.2	-156.4	-156.7	49.8	0	0	113	A542 I544 V559 Q560 Q561 K567 L620	A542-Q563 PolarHBondContact O-NE2 3.09Å; I544-Q563 HydrophobicContact CD1-CB 4.35Å; I544-Q563 HydrophobicContact CD1-CG 4.42Å; V559-Q563 PolarHBondContact O-N 3.06Å; V559-Q563 VanDerWaalsContact O-N 3.12Å; Q560-Q563 PolarHBondContact O-N 2.87Å; Q561-Q563 PolarHBondContact O-N 2.98Å; Q563-K567 PolarHBondContact O-N 3.1Å; Q563-K567 VanDerWaalsContact OE1-NZ 3.15Å; Q563-L620 HydrophobicContact CB-CD2 3.84Å; Q563-L620 HydrophobicContact CG-CD2 3.8Å
564	K	76.5	Confident	66.4	Low	97 Å²	97	76.8 Å²	76.8	42%	0.422	39%	0.391	S	S	.	.	H	α-helix	trans	-68.9	-47	176.3	-73.7	157.4	-166	158.4	0	110.8	Q560 Q561 I562 R566 K567 Y568	Q560-K564 WeakPolarHBondContact O-CB 3.11Å; Q560-K564 VanDerWaalsContact O-CD 3.28Å; Q560-K564 WeakPolarHBondContact O-CD 3.39Å; Q560-K564 WeakPolarHBondContact O-CG 3.29Å; Q560-K564 PolarHBondContact O-N 2.73Å; Q561-K564 PolarHBondContact O-N 3.08Å; I562-K564 VanDerWaalsContact C-N 3.31Å; I562-K564 PolarHBondContact O-N 2.92Å; K564-R566 VanDerWaalsContact C-N 3.32Å; K564-R566 PolarHBondContact O-N 3.19Å; K564-K567 PolarHBondContact O-N 3.26Å; K564-Y568 WeakPolarHBondContact O-CD2 3.47Å; K564-Y568 PolarHBondContact O-N 3.33Å
565	T	67.1	Low	63.7	Low	27 Å²	27	81.3 Å²	81.3	17%	0.166	41%	0.407	C	S	.	.	H	α-helix	trans	-60.5	-40.7	178.1	-51.3	0	0	0	0	111.5	Q561 I562 K567 Y568 T588 Q589	Q561-T565 PolarHBondContact O-N 2.92Å; Q561-T565 PolarHBondContact O-OG1 3.25Å; Q561-T565 VanDerWaalsContact O-OG1 3.09Å; I562-T565 PolarHBondContact O-N 3.36Å; T565-K567 VanDerWaalsContact C-N 3.29Å; T565-K567 PolarHBondContact O-N 2.82Å; T565-Y568 PolarHBondContact O-N 2.76Å; T565-T588 HydrophobicContact CG2-CG2 4.31Å; T565-Q589 HydrophobicContact CG2-CG 3.82Å
566	R	62.8	Low	61.4	Low	49 Å²	49	88.7 Å²	88.7	19%	0.185	45%	0.451	C	S	.	.	H	α-helix	trans	-58.3	-35.7	172.9	-176.3	173.8	173.2	167.4	-0.8	113.2	E539 I562 K564 L620 D623	E539-R566 VanDerWaalsContact CD-NH2 3.3Å; E539-R566 IonicContact OE1-NH2 3.5Å; E539-R566 IonicContact OE2-CZ 3.21Å; E539-R566 IonicContact OE2-NE 3.52Å; E539-R566 PolarHBondContact OE2-NE 3.38Å; E539-R566 IonicContact OE2-NH2 3.33Å; E539-R566 PolarHBondContact OE2-NH2 3.3Å; I562-R566 PolarHBondContact O-N 3.39Å; I562-R566 VanDerWaalsContact O-N 3.1Å; K564-R566 VanDerWaalsContact C-N 3.32Å; K564-R566 PolarHBondContact O-N 3.19Å; R566-L620 PolarHBondContact NH1-O 3.18Å; R566-D623 IonicContact CZ-OD2 3.21Å; R566-D623 IonicContact NH1-OD2 2.77Å; R566-D623 PolarHBondContact NH1-OD2 3.27Å; R566-D623 VanDerWaalsContact NH1-OD2 3.14Å; R566-D623 IonicContact NH2-OD2 2.82Å; R566-D623 PolarHBondContact NH2-OD2 3.26Å
567	K	53.3	Low	58.6	Low	116 Å²	116	90.6 Å²	90.6	50%	0.504	47%	0.47	S	S	.	.	H	α-helix	trans	-75.8	-21.6	-176.4	-80.2	174	177.1	164.6	0	115	Q563 K564 T565	Q563-K567 PolarHBondContact O-N 3.1Å; Q563-K567 VanDerWaalsContact OE1-NZ 3.15Å; K564-K567 PolarHBondContact O-N 3.26Å; T565-K567 VanDerWaalsContact C-N 3.29Å; T565-K567 PolarHBondContact O-N 2.82Å
568	Y	45.6	Very low	56	Low	173 Å²	173	93 Å²	93	68%	0.678	49%	0.487	S	S	*	.	H	α-helix	trans	-85.7	-33	-178.5	-79.9	-76.8	0	0	0	113.7	K564 T565 C570 L571	K564-Y568 WeakPolarHBondContact O-CD2 3.47Å; K564-Y568 PolarHBondContact O-N 3.33Å; T565-Y568 PolarHBondContact O-N 2.76Å; Y568-C570 VanDerWaalsContact C-N 3.32Å; Y568-C570 PolarHBondContact O-N 3.1Å; Y568-L571 PolarHBondContact O-N 3.39Å
569	G	42.3	Very low	53.5	Low	35 Å²	35	96.8 Å²	96.8	36%	0.361	51%	0.513	S	S	.	.	H	α-helix	trans	-60.4	-36.8	179.7	0	0	0	0	0	113.9	L571	G569-L571 PolarHBondContact O-N 2.87Å; G569-L571 VanDerWaalsContact O-N 3.12Å
570	C	39.7	Very low	50.8	Low	86 Å²	86	101 Å²	101	58%	0.581	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-0.5	-178	-57.9	0	0	0	0	115.3	Y568	Y568-C570 VanDerWaalsContact C-N 3.32Å; Y568-C570 PolarHBondContact O-N 3.1Å
571	L	36	Very low	48.6	Very low	127 Å²	127	103.2 Å²	103.2	67%	0.665	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	1.6	-174.5	-80.6	165.3	0	0	0	114.9	Y568 G569	Y568-L571 PolarHBondContact O-N 3.39Å; G569-L571 PolarHBondContact O-N 2.87Å; G569-L571 VanDerWaalsContact O-N 3.12Å
572	H	37	Very low	46.4	Very low	181 Å²	181	103.9 Å²	103.9	84%	0.838	57%	0.571	S	S	*	*	S	Bend	trans	-133.8	6.7	-172.6	-92.1	22	0	0	0	116.3	D574	H572-D574 PolarHBondContact O-N 2.76Å
573	S	34.9	Very low	44.5	Very low	98 Å²	98	110.1 Å²	110.1	69%	0.685	60%	0.604	S	S	*	*			trans	-92	25.2	-173.8	64.6	0	0	0	0	116	Q575	S573-Q575 PolarHBondContact O-N 3.08Å
574	D	34.4	Very low	42.9	Very low	171 Å²	171	111.2 Å²	111.2	91%	0.914	62%	0.615	S	S	*	*			trans	-78.7	12.5	-179.3	-90.3	-20.8	0	0	0	114.5	H572	H572-D574 PolarHBondContact O-N 2.76Å
575	Q	32.8	Very low	42.3	Very low	174 Å²	174	108.9 Å²	108.9	81%	0.813	61%	0.607	S	S	*	*	S	Bend	trans	-124.3	120.9	174.6	-66.6	-166.9	3.9	0	0	111.8	S573 S577	S573-Q575 PolarHBondContact O-N 3.08Å; Q575-S577 PolarHBondContact O-N 3.27Å
576	V	38.5	Very low	42.5	Very low	156 Å²	156	110.6 Å²	110.6	95%	0.945	62%	0.618	S	S	*	*			trans	-73.8	108.9	177.2	-179.6	0	0	0	0	109.9
577	S	29.3	Very low	43.3	Very low	81 Å²	81	114.2 Å²	114.2	57%	0.566	64%	0.637	S	S	*	*			trans	-140.5	138.3	165.7	64.8	0	0	0	0	109.6	Q575 V579	Q575-S577 PolarHBondContact O-N 3.27Å; S577-V579 PolarHBondContact O-N 3.07Å
578	D	34.6	Very low	44.7	Very low	177 Å²	177	111.1 Å²	111.1	95%	0.947	63%	0.628	S	S	*	*	S	Bend	trans	-71.3	69.5	178.6	-67.2	-51.6	0	0	0	111.4
579	V	36.3	Very low	46.5	Very low	119 Å²	119	104.2 Å²	104.2	72%	0.721	60%	0.601	S	S	*	*	S	Bend	trans	-141.1	140.7	176.2	-170.7	0	0	0	0	108.2	S577	S577-V579 PolarHBondContact O-N 3.07Å
580	C	31.1	Very low	48.6	Very low	88 Å²	88	103.8 Å²	103.8	60%	0.595	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-54.5	155.2	174.1	-56.4	0	0	0	0	111.7
581	P	39.4	Very low	51	Low	106 Å²	106	105.7 Å²	105.7	69%	0.688	59%	0.593	S	S	*	*	S	Bend	trans	-52	145	164.5	25.6	-35	0	0	0	109.7	L583	P581-L583 PolarHBondContact O-N 3.29Å
582	P	38.6	Very low	53.5	Low	82 Å²	82	99.7 Å²	99.7	53%	0.532	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-61.4	127.2	-171	26	-34.9	0	0	0	110.6	S584 D585	P582-S584 PolarHBondContact O-N 2.67Å; P582-D585 PolarHBondContact O-N 3.18Å; P582-D585 VanDerWaalsContact O-N 3.17Å
583	L	43.5	Very low	56.2	Low	136 Å²	136	91.1 Å²	91.1	71%	0.712	52%	0.522	S	S	*	.	H	α-helix	trans	-55	-24.3	-175.2	-73.6	113.5	0	0	0	113.6	P581 D585 T586 E587	P581-L583 PolarHBondContact O-N 3.29Å; L583-D585 PolarHBondContact O-N 3.43Å; L583-T586 PolarHBondContact O-N 2.9Å; L583-E587 VanDerWaalsContact O-CB 3.26Å; L583-E587 WeakPolarHBondContact O-CB 3.26Å; L583-E587 PolarHBondContact O-N 3.38Å
584	S	48.2	Very low	58.9	Low	57 Å²	57	88.8 Å²	88.8	40%	0.399	50%	0.5	S	S	.	.	H	α-helix	trans	-49.2	-39.9	176	50.5	0	0	0	0	113.9	P582 T588	P582-S584 PolarHBondContact O-N 2.67Å; S584-T588 VanDerWaalsContact O-CB 3.31Å; S584-T588 WeakPolarHBondContact O-CB 3.5Å; S584-T588 PolarHBondContact O-N 3.12Å; S584-T588 PolarHBondContact O-OG1 2.87Å
585	D	63.3	Low	61.7	Low	48 Å²	48	84.3 Å²	84.3	26%	0.257	47%	0.474	S	S	.	.	H	α-helix	trans	-80.8	-33.7	-168.1	-69.6	29.9	0	0	0	110.9	P582 L583 Q589	P582-D585 PolarHBondContact O-N 3.18Å; P582-D585 VanDerWaalsContact O-N 3.17Å; L583-D585 PolarHBondContact O-N 3.43Å; D585-Q589 WeakPolarHBondContact O-CG 3.42Å; D585-Q589 PolarHBondContact O-N 2.97Å; D585-Q589 PolarHBondContact O-NE2 3.27Å
586	T	71.6	Confident	64.4	Low	62 Å²	62	76 Å²	76	38%	0.38	44%	0.435	S	S	.	.	H	α-helix	trans	-77.2	-38.6	171.5	-49.4	0	0	0	0	111.4	L583 Q589 C590 P646	L583-T586 PolarHBondContact O-N 2.9Å; T586-Q589 PolarHBondContact O-N 3.09Å; T586-C590 WeakPolarHBondContact O-CB 3.49Å; T586-C590 PolarHBondContact O-N 3.38Å; T586-C590 PolarHBondContact O-SG 2.91Å; T586-C590 VanDerWaalsContact O-SG 3.42Å; T586-P646 HydrophobicContact CG2-CG 4.35Å
587	E	79.4	Confident	66.9	Low	126 Å²	126	68.6 Å²	68.6	59%	0.589	39%	0.39	S	S	*	.	H	α-helix	trans	-60.4	-47.5	175	-171.1	166.6	-143.3	0	0	110.8	L583 Q589 C590 E591	L583-E587 VanDerWaalsContact O-CB 3.26Å; L583-E587 WeakPolarHBondContact O-CB 3.26Å; L583-E587 PolarHBondContact O-N 3.38Å; E587-Q589 VanDerWaalsContact C-N 3.33Å; E587-Q589 PolarHBondContact O-N 3.42Å; E587-C590 WeakPolarHBondContact O-CA 3.15Å; E587-C590 WeakPolarHBondContact O-CB 3.37Å; E587-C590 PolarHBondContact O-N 3.2Å; E587-C590 VanDerWaalsContact O-N 3.09Å; E587-E591 PolarHBondContact O-N 3.09Å
588	T	82.4	Confident	69.8	Low	51 Å²	51	68.8 Å²	68.8	31%	0.313	39%	0.385	S	S	.	.	H	α-helix	trans	-61.5	-38	174.5	-53.1	0	0	0	0	112.2	T565 S584 C590 E591 V592	T565-T588 HydrophobicContact CG2-CG2 4.31Å; S584-T588 VanDerWaalsContact O-CB 3.31Å; S584-T588 WeakPolarHBondContact O-CB 3.5Å; S584-T588 PolarHBondContact O-N 3.12Å; S584-T588 PolarHBondContact O-OG1 2.87Å; T588-C590 VanDerWaalsContact C-N 3.35Å; T588-E591 PolarHBondContact O-N 2.89Å; T588-V592 WeakPolarHBondContact O-CG2 3.5Å; T588-V592 PolarHBondContact O-N 3.32Å; T588-V592 VanDerWaalsContact O-N 3.17Å
589	Q	82.7	Confident	72.4	Confident	27 Å²	27	62.1 Å²	62.1	13%	0.126	35%	0.349	C	S	.	.	H	α-helix	trans	-68.3	-34.5	174.8	-74.8	171	42.6	0	0	112.1	T565 D585 T586 E587 M593 P646	T565-Q589 HydrophobicContact CG2-CG 3.82Å; D585-Q589 WeakPolarHBondContact O-CG 3.42Å; D585-Q589 PolarHBondContact O-N 2.97Å; D585-Q589 PolarHBondContact O-NE2 3.27Å; T586-Q589 PolarHBondContact O-N 3.09Å; E587-Q589 VanDerWaalsContact C-N 3.33Å; E587-Q589 PolarHBondContact O-N 3.42Å; Q589-M593 WeakPolarHBondContact O-CB 3.5Å; Q589-M593 PolarHBondContact O-N 3.39Å; Q589-P646 HydrophobicContact CB-CB 4.38Å; Q589-P646 HydrophobicContact CB-CG 3.65Å
590	C	87.8	Confident	74.9	Confident	27 Å²	27	56.5 Å²	56.5	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-68.1	-40.3	173.4	-77.2	0	0	0	0	112.1	T586 E587 T588 M593 Q594 L649	T586-C590 WeakPolarHBondContact O-CB 3.49Å; T586-C590 PolarHBondContact O-N 3.38Å; T586-C590 PolarHBondContact O-SG 2.91Å; T586-C590 VanDerWaalsContact O-SG 3.42Å; E587-C590 WeakPolarHBondContact O-CA 3.15Å; E587-C590 WeakPolarHBondContact O-CB 3.37Å; E587-C590 PolarHBondContact O-N 3.2Å; E587-C590 VanDerWaalsContact O-N 3.09Å; T588-C590 VanDerWaalsContact C-N 3.35Å; C590-M593 PolarHBondContact O-N 3.07Å; C590-Q594 PolarHBondContact O-N 2.95Å; C590-L649 HydrophobicContact CB-CD1 3.91Å; C590-L649 WeakPolarHBondContact O-CD1 3.48Å
591	E	88.8	Confident	77.5	Confident	125 Å²	125	54.8 Å²	54.8	58%	0.584	30%	0.299	S	S	*	.	H	α-helix	trans	-58.5	-53.3	173.9	-70.7	-177.3	152	0	0	111.2	E587 T588 M593 Q594 E595	E587-E591 PolarHBondContact O-N 3.09Å; T588-E591 PolarHBondContact O-N 2.89Å; E591-M593 VanDerWaalsContact C-N 3.31Å; E591-M593 PolarHBondContact O-N 3.09Å; E591-Q594 PolarHBondContact O-N 3.2Å; E591-Q594 VanDerWaalsContact O-N 3.16Å; E591-E595 PolarHBondContact O-N 3.03Å
592	V	89.6	Confident	79.5	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.012	29%	0.294	C	S	.	.	H	α-helix	trans	-65.9	-33.8	-179.7	-178.7	0	0	0	0	111.9	K558 Q561 I562 T588 E595 V596	K558-V592 HydrophobicContact CB-CG1 4.39Å; K558-V592 HydrophobicContact CD-CG1 4.33Å; Q561-V592 HydrophobicContact CB-CG1 4.09Å; Q561-V592 HydrophobicContact CG-CG1 4.15Å; Q561-V592 HydrophobicContact CG-CG2 3.95Å; Q561-V592 VanDerWaalsContact NE2-CG2 3.27Å; I562-V592 HydrophobicContact CD1-CG1 4.3Å; I562-V592 HydrophobicContact CG1-CB 4.24Å; I562-V592 HydrophobicContact CG1-CG1 3.67Å; T588-V592 WeakPolarHBondContact O-CG2 3.5Å; T588-V592 PolarHBondContact O-N 3.32Å; T588-V592 VanDerWaalsContact O-N 3.17Å; V592-E595 PolarHBondContact O-N 3.19Å; V592-V596 WeakPolarHBondContact O-CG2 3.22Å; V592-V596 PolarHBondContact O-N 2.91Å
593	M	92.3	Very high	80.7	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-73.6	-27.8	176	-174.4	63.3	-156.7	0	0	112.5	I562 Q589 C590 E591 V596 V597 L617 F621 P646 L649 I650	I562-M593 HydrophobicContact CD1-SD 4.18Å; Q589-M593 WeakPolarHBondContact O-CB 3.5Å; Q589-M593 PolarHBondContact O-N 3.39Å; C590-M593 PolarHBondContact O-N 3.07Å; E591-M593 VanDerWaalsContact C-N 3.31Å; E591-M593 PolarHBondContact O-N 3.09Å; M593-V596 HydrophobicContact CE-CG1 4.25Å; M593-V596 PolarHBondContact O-N 3.23Å; M593-V596 HydrophobicContact SD-CB 4.24Å; M593-V596 HydrophobicContact SD-CG1 4.17Å; M593-V597 HydrophobicContact CE-CG2 4.16Å; M593-V597 WeakPolarHBondContact O-CG2 3.41Å; M593-V597 PolarHBondContact O-N 2.95Å; M593-L617 HydrophobicContact CE-CD1 3.91Å; M593-L617 HydrophobicContact SD-CD2 4.12Å; M593-F621 HydrophobicContact CE-CE2 4.42Å; M593-F621 HydrophobicContact CG-CE2 4.46Å; M593-F621 HydrophobicContact CG-CZ 4.32Å; M593-F621 HydrophobicContact SD-CE2 3.79Å; M593-F621 HydrophobicContact SD-CZ 3.96Å; M593-P646 HydrophobicContact CB-CB 4.12Å; M593-P646 HydrophobicContact CG-CB 4.24Å; M593-P646 WeakPolarHBondContact CG-O 3.42Å; M593-L649 HydrophobicContact CB-CD1 4.08Å; M593-L649 HydrophobicContact CG-CD1 4.27Å; M593-I650 HydrophobicContact CE-CD1 3.79Å; M593-I650 HydrophobicContact CE-CG1 3.75Å
594	Q	92.8	Very high	82.1	Confident	49 Å²	49	59.4 Å²	59.4	23%	0.229	31%	0.31	C	S	.	.	H	α-helix	trans	-68.2	-43.4	167.8	-175.1	66.3	48.8	0	0	110.6	C590 E591 V596 V597 D598 L649 N653	C590-Q594 PolarHBondContact O-N 2.95Å; E591-Q594 PolarHBondContact O-N 3.2Å; E591-Q594 VanDerWaalsContact O-N 3.16Å; Q594-V596 PolarHBondContact O-N 3.37Å; Q594-V597 PolarHBondContact O-N 2.91Å; Q594-D598 PolarHBondContact NE2-OD1 3.17Å; Q594-D598 VanDerWaalsContact O-CG 3.23Å; Q594-D598 PolarHBondContact O-N 3.01Å; Q594-L649 HydrophobicContact CB-CD1 4.35Å; Q594-N653 PolarHBondContact NE2-ND2 3.29Å; Q594-N653 PolarHBondContact NE2-OD1 2.98Å; Q594-N653 VanDerWaalsContact NE2-OD1 3.08Å; Q594-N653 PolarHBondContact OE1-ND2 3.49Å
595	E	92.1	Very high	83.7	Confident	78 Å²	78	58.5 Å²	58.5	36%	0.364	30%	0.299	S	S	.	.	H	α-helix	trans	-58.1	-35	173.5	-64.4	179.7	121.8	0	0	112	K558 E591 V592 L599	K558-E595 HydrophobicContact CD-CB 4.49Å; K558-E595 WeakPolarHBondContact CE-OE2 3.3Å; K558-E595 IonicContact NZ-OE1 2.87Å; K558-E595 PolarHBondContact NZ-OE1 2.68Å; K558-E595 IonicContact NZ-OE2 3.79Å; K558-E595 PolarHBondContact NZ-OE2 2.96Å; E591-E595 PolarHBondContact O-N 3.03Å; V592-E595 PolarHBondContact O-N 3.19Å; E595-L599 VanDerWaalsContact O-CG 3.29Å; E595-L599 WeakPolarHBondContact O-CG 3.39Å; E595-L599 PolarHBondContact O-N 3.25Å; E595-L599 VanDerWaalsContact O-N 3.08Å
596	V	91	Very high	84.5	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66.6	-41.7	172.6	166.5	0	0	0	0	112	M555 K558 I562 V592 M593 Q594 L599 I600 L613	M555-V596 HydrophobicContact CE-CG1 4.34Å; M555-V596 HydrophobicContact SD-CB 4.36Å; M555-V596 HydrophobicContact SD-CG1 3.87Å; M555-V596 HydrophobicContact SD-CG2 3.98Å; K558-V596 HydrophobicContact CB-CG2 3.69Å; K558-V596 HydrophobicContact CG-CG2 4.48Å; I562-V596 HydrophobicContact CD1-CG2 4.31Å; V592-V596 WeakPolarHBondContact O-CG2 3.22Å; V592-V596 PolarHBondContact O-N 2.91Å; M593-V596 HydrophobicContact CE-CG1 4.25Å; M593-V596 PolarHBondContact O-N 3.23Å; M593-V596 HydrophobicContact SD-CB 4.24Å; M593-V596 HydrophobicContact SD-CG1 4.17Å; Q594-V596 PolarHBondContact O-N 3.37Å; V596-L599 PolarHBondContact O-N 2.93Å; V596-I600 HydrophobicContact CG1-CD1 3.88Å; V596-I600 WeakPolarHBondContact O-CD1 3.46Å; V596-I600 VanDerWaalsContact O-CG1 3.26Å; V596-I600 WeakPolarHBondContact O-CG1 3.39Å; V596-I600 PolarHBondContact O-N 3.22Å; V596-L613 HydrophobicContact CG1-CD2 4.36Å
597	V	91.1	Very high	84.7	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-41.9	175.1	171.4	0	0	0	0	111.4	M593 Q594 L599 I600 M601 I650 N653 L667	M593-V597 HydrophobicContact CE-CG2 4.16Å; M593-V597 WeakPolarHBondContact O-CG2 3.41Å; M593-V597 PolarHBondContact O-N 2.95Å; Q594-V597 PolarHBondContact O-N 2.91Å; V597-L599 VanDerWaalsContact C-N 3.3Å; V597-L599 PolarHBondContact O-N 2.71Å; V597-I600 PolarHBondContact O-N 3.27Å; V597-M601 HydrophobicContact CG1-SD 3.95Å; V597-M601 WeakPolarHBondContact O-CG 3.44Å; V597-M601 PolarHBondContact O-N 3.39Å; V597-M601 VanDerWaalsContact O-N 3.13Å; V597-I650 HydrophobicContact CG2-CG1 4.19Å; V597-N653 HydrophobicContact CG1-CB 3.94Å; V597-L667 HydrophobicContact CG1-CD1 4.08Å; V597-L667 HydrophobicContact CG1-CD2 3.91Å
598	D	90.3	Very high	84.5	Confident	84 Å²	84	63.7 Å²	63.7	45%	0.449	33%	0.327	S	S	.	.	H	α-helix	trans	-61.9	-39	177.9	-63.9	-13	0	0	0	111.1	Q594 M601	Q594-D598 PolarHBondContact NE2-OD1 3.17Å; Q594-D598 VanDerWaalsContact O-CG 3.23Å; Q594-D598 PolarHBondContact O-N 3.01Å; D598-M601 PolarHBondContact O-N 2.89Å
599	L	89.3	Confident	84.7	Confident	38 Å²	38	62.5 Å²	62.5	20%	0.199	32%	0.318	C	S	.	.	H	α-helix	trans	-69.3	-35.6	174	-74.3	169.1	0	0	0	113.8	M555 K558 E595 V596 V597 M601 E602	M555-L599 HydrophobicContact CE-CB 3.64Å; M555-L599 HydrophobicContact CE-CD1 4.15Å; K558-L599 HydrophobicContact CG-CD1 4.1Å; E595-L599 VanDerWaalsContact O-CG 3.29Å; E595-L599 WeakPolarHBondContact O-CG 3.39Å; E595-L599 PolarHBondContact O-N 3.25Å; E595-L599 VanDerWaalsContact O-N 3.08Å; V596-L599 PolarHBondContact O-N 2.93Å; V597-L599 VanDerWaalsContact C-N 3.3Å; V597-L599 PolarHBondContact O-N 2.71Å; L599-M601 PolarHBondContact O-N 3.4Å; L599-E602 PolarHBondContact O-N 3.47Å
600	I	88.4	Confident	85.1	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-26.5	173.1	-69.2	156.3	0	0	0	110.9	M555 V596 V597 F605 L613 V666 L667 M670	M555-I600 HydrophobicContact CE-CG1 4.28Å; V596-I600 HydrophobicContact CG1-CD1 3.88Å; V596-I600 WeakPolarHBondContact O-CD1 3.46Å; V596-I600 VanDerWaalsContact O-CG1 3.26Å; V596-I600 WeakPolarHBondContact O-CG1 3.39Å; V596-I600 PolarHBondContact O-N 3.22Å; V597-I600 PolarHBondContact O-N 3.27Å; I600-F605 HydrophobicContact CG1-CE1 4.36Å; I600-F605 HydrophobicContact CG1-CE2 4.36Å; I600-F605 HydrophobicContact CG1-CZ 4.07Å; I600-L613 HydrophobicContact CD1-CD2 3.82Å; I600-L613 HydrophobicContact CG1-CD2 3.85Å; I600-V666 HydrophobicContact CG2-CG1 4.17Å; I600-V666 VanDerWaalsContact O-CG1 3.25Å; I600-V666 WeakPolarHBondContact O-CG1 3.31Å; I600-L667 HydrophobicContact CG2-CD1 4.1Å; I600-M670 HydrophobicContact CD1-CE 4.45Å; I600-M670 HydrophobicContact CD1-CG 4.09Å; I600-M670 HydrophobicContact CG2-CB 4.17Å; I600-M670 HydrophobicContact CG2-CG 4.26Å
601	M	84.7	Confident	85.2	Confident	52 Å²	52	62.6 Å²	62.6	26%	0.256	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	6.3	-177.5	-73.2	176.1	44.6	0	0	114.6	V597 D598 L599 M657 L667	V597-M601 HydrophobicContact CG1-SD 3.95Å; V597-M601 WeakPolarHBondContact O-CG 3.44Å; V597-M601 PolarHBondContact O-N 3.39Å; V597-M601 VanDerWaalsContact O-N 3.13Å; D598-M601 PolarHBondContact O-N 2.89Å; L599-M601 PolarHBondContact O-N 3.4Å; M601-M657 HydrophobicContact CE-CE 3.44Å; M601-M657 VanDerWaalsContact CE-CE 3.44Å; M601-M657 HydrophobicContact CE-SD 3.81Å; M601-M657 HydrophobicContact SD-CE 3.98Å; M601-M657 HydrophobicContact SD-SD 3.82Å; M601-L667 HydrophobicContact SD-CD2 4.13Å
602	E	82.6	Confident	85.2	Confident	125 Å²	125	56.7 Å²	56.7	58%	0.584	29%	0.293	S	S	*	.	S	Bend	trans	-73.3	137.8	169.5	-61.9	-165.5	168.1	0	0	110.8	L599 D604 F605	L599-E602 PolarHBondContact O-N 3.47Å; E602-D604 PolarHBondContact O-N 3.18Å; E602-F605 PolarHBondContact O-N 2.87Å
603	D	63.8	Low	85.3	Confident	129 Å²	129	56.6 Å²	56.6	69%	0.69	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-5.8	-166.1	-72.5	-57	0	0	0	116	S662	D603-S662 WeakPolarHBondContact OD1-CB 3.42Å; D603-S662 PolarHBondContact OD1-OG 2.73Å
604	D	72.5	Confident	85.3	Confident	167 Å²	167	56.6 Å²	56.6	89%	0.893	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	19.9	-176.6	-77.1	-48	0	0	0	113.7	E602	E602-D604 PolarHBondContact O-N 3.18Å
605	F	82.1	Confident	85.3	Confident	38 Å²	38	55 Å²	55	17%	0.167	29%	0.287	C	S	.	.			trans	-63.9	132	-175.6	-169.3	-104.7	0	0	0	114.5	M555 I600 E602 Q609 M610 L613 V666	M555-F605 HydrophobicContact CE-CE2 4.05Å; I600-F605 HydrophobicContact CG1-CE1 4.36Å; I600-F605 HydrophobicContact CG1-CE2 4.36Å; I600-F605 HydrophobicContact CG1-CZ 4.07Å; E602-F605 PolarHBondContact O-N 2.87Å; F605-Q609 HydrophobicContact CE2-CG 4.2Å; F605-Q609 HydrophobicContact CZ-CG 4.08Å; F605-M610 HydrophobicContact CD1-CE 4.09Å; F605-M610 HydrophobicContact CE1-CB 3.85Å; F605-M610 HydrophobicContact CE1-CE 4.3Å; F605-M610 HydrophobicContact CE1-CG 4.2Å; F605-L613 HydrophobicContact CZ-CD2 3.94Å; F605-V666 HydrophobicContact CB-CG1 4.29Å; F605-V666 HydrophobicContact CD1-CG1 4.32Å
606	D	79.7	Confident	85.2	Confident	79 Å²	79	51.3 Å²	51.3	42%	0.422	27%	0.269	S	S	.	.			trans	-84.7	131.2	-170.9	-169	-14.4	0	0	0	114.2	E608 Q609 M610	D606-E608 PolarHBondContact O-N 3.03Å; D606-E608 PolarHBondContact OD1-N 3.06Å; D606-Q609 HydrophobicContact CB-CB 4.09Å; D606-Q609 WeakPolarHBondContact O-CB 3.28Å; D606-Q609 PolarHBondContact O-N 2.96Å; D606-M610 PolarHBondContact O-N 3.02Å
607	T	75.2	Confident	85.2	Confident	108 Å²	108	51.3 Å²	51.3	66%	0.663	27%	0.27	S	S	*	.	H	α-helix	trans	-54.3	-36.6	169.1	39.5	0	0	0	0	115.7	M610 S611	T607-M610 PolarHBondContact O-N 3.46Å; T607-S611 PolarHBondContact O-N 3.2Å
608	E	75.6	Confident	85.2	Confident	159 Å²	159	51.8 Å²	51.8	74%	0.743	27%	0.274	S	S	*	.	H	α-helix	trans	-69.4	-40.3	176.5	-69.6	-164.9	-178.8	0	0	110.4	D606	D606-E608 PolarHBondContact O-N 3.03Å; D606-E608 PolarHBondContact OD1-N 3.06Å
609	Q	87.1	Confident	85	Confident	26 Å²	26	50.1 Å²	50.1	12%	0.121	26%	0.263	C	S	.	.	H	α-helix	trans	-66	-36.2	174.8	-176.5	165.2	5.1	0	0	112.3	L551 D552 F605 D606 S611 A612 L613	L551-Q609 HydrophobicContact CD2-CG 3.87Å; D552-Q609 PolarHBondContact OD1-NE2 3.4Å; F605-Q609 HydrophobicContact CE2-CG 4.2Å; F605-Q609 HydrophobicContact CZ-CG 4.08Å; D606-Q609 HydrophobicContact CB-CB 4.09Å; D606-Q609 WeakPolarHBondContact O-CB 3.28Å; D606-Q609 PolarHBondContact O-N 2.96Å; Q609-S611 PolarHBondContact O-N 2.95Å; Q609-A612 PolarHBondContact O-N 2.83Å; Q609-L613 WeakPolarHBondContact O-CB 3.41Å; Q609-L613 PolarHBondContact O-N 3.08Å
610	M	89.4	Confident	84.9	Confident	17 Å²	17	48.6 Å²	48.6	8%	0.084	26%	0.255	C	S	.	.	H	α-helix	trans	-57.7	-46.8	178.5	-169.6	-176.1	-77.4	0	0	112.3	F605 D606 T607 A612 L613 A614 V666 D669 M670 E673	F605-M610 HydrophobicContact CD1-CE 4.09Å; F605-M610 HydrophobicContact CE1-CB 3.85Å; F605-M610 HydrophobicContact CE1-CE 4.3Å; F605-M610 HydrophobicContact CE1-CG 4.2Å; D606-M610 PolarHBondContact O-N 3.02Å; T607-M610 PolarHBondContact O-N 3.46Å; M610-A612 PolarHBondContact O-N 3.26Å; M610-L613 PolarHBondContact O-N 2.78Å; M610-A614 WeakPolarHBondContact O-CB 3.46Å; M610-A614 PolarHBondContact O-N 2.73Å; M610-V666 HydrophobicContact CE-CG1 4.13Å; M610-D669 HydrophobicContact CE-CB 4.19Å; M610-D669 HydrophobicContact SD-CB 4.23Å; M610-M670 HydrophobicContact CE-CB 4.27Å; M610-M670 HydrophobicContact CG-CB 4.22Å; M610-M670 HydrophobicContact CG-SD 3.54Å; M610-M670 VanDerWaalsContact CG-SD 3.54Å; M610-M670 HydrophobicContact SD-CB 4.26Å; M610-E673 HydrophobicContact CG-CB 4.43Å; M610-E673 HydrophobicContact CG-CG 4.42Å; M610-E673 HydrophobicContact SD-CB 4.38Å
611	S	90.1	Very high	84.8	Confident	39 Å²	39	48.8 Å²	48.8	27%	0.273	26%	0.256	S	S	.	.	H	α-helix	trans	-68.8	-35.4	-178.9	-160.1	0	0	0	0	113	T607 Q609 S615 E673 K677	T607-S611 PolarHBondContact O-N 3.2Å; Q609-S611 PolarHBondContact O-N 2.95Å; S611-S615 PolarHBondContact O-N 2.83Å; S611-S615 VanDerWaalsContact O-N 3.15Å; S611-S615 PolarHBondContact O-OG 3.22Å; S611-E673 WeakPolarHBondContact CB-OE1 3.49Å; S611-E673 PolarHBondContact OG-OE1 2.84Å; S611-K677 PolarHBondContact OG-NZ 3.01Å
612	A	90.4	Very high	84.8	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-44.1	172.7	0	0	0	0	0	111.6	W547 Q550 L551 Q609 M610 S615 C616	W547-A612 HydrophobicContact CB-CB 4.4Å; Q550-A612 HydrophobicContact CB-CB 3.55Å; L551-A612 HydrophobicContact CD2-CB 3.92Å; Q609-A612 PolarHBondContact O-N 2.83Å; M610-A612 PolarHBondContact O-N 3.26Å; A612-S615 PolarHBondContact O-N 3.18Å; A612-C616 PolarHBondContact O-N 3.12Å; A612-C616 PolarHBondContact O-SG 3.19Å; A612-C616 VanDerWaalsContact O-SG 3.4Å
613	L	91.6	Very high	84.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.5	-44.5	177.7	-176.1	57.9	0	0	0	111.6	L551 M555 V559 V596 I600 F605 Q609 M610 S615 C616 L617 M670	L551-L613 HydrophobicContact CD2-CB 3.94Å; M555-L613 HydrophobicContact CE-CD2 3.82Å; M555-L613 HydrophobicContact CG-CD1 3.87Å; M555-L613 HydrophobicContact CG-CD2 4.12Å; M555-L613 HydrophobicContact SD-CD1 3.78Å; M555-L613 HydrophobicContact SD-CD2 3.74Å; M555-L613 HydrophobicContact SD-CG 4.43Å; V559-L613 HydrophobicContact CG2-CD1 3.45Å; V559-L613 VanDerWaalsContact CG2-CD1 3.45Å; V596-L613 HydrophobicContact CG1-CD2 4.36Å; I600-L613 HydrophobicContact CD1-CD2 3.82Å; I600-L613 HydrophobicContact CG1-CD2 3.85Å; F605-L613 HydrophobicContact CZ-CD2 3.94Å; Q609-L613 WeakPolarHBondContact O-CB 3.41Å; Q609-L613 PolarHBondContact O-N 3.08Å; M610-L613 PolarHBondContact O-N 2.78Å; L613-S615 VanDerWaalsContact C-N 3.26Å; L613-S615 PolarHBondContact O-N 3.23Å; L613-C616 WeakPolarHBondContact O-CB 3.45Å; L613-C616 PolarHBondContact O-N 3.24Å; L613-C616 VanDerWaalsContact O-N 3.15Å; L613-L617 HydrophobicContact CD1-CD1 4.4Å; L613-L617 HydrophobicContact CD1-CD2 4.49Å; L613-L617 HydrophobicContact CD1-CG 4.18Å; L613-L617 HydrophobicContact CG-CD1 4.24Å; L613-L617 HydrophobicContact CG-CG 4.4Å; L613-L617 WeakPolarHBondContact O-CG 3.42Å; L613-L617 PolarHBondContact O-N 3.48Å; L613-M670 HydrophobicContact CB-CE 4.17Å; L613-M670 HydrophobicContact CD2-CE 3.99Å; L613-M670 HydrophobicContact CG-CE 3.75Å
614	A	91.9	Very high	85.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56.7	-41.5	174.8	0	0	0	0	0	111.7	M610 L617 A618 M670 E673 L674 K677	M610-A614 WeakPolarHBondContact O-CB 3.46Å; M610-A614 PolarHBondContact O-N 2.73Å; A614-L617 PolarHBondContact O-N 2.91Å; A614-A618 VanDerWaalsContact O-CB 3.29Å; A614-A618 WeakPolarHBondContact O-CB 3.41Å; A614-A618 PolarHBondContact O-N 3.23Å; A614-M670 HydrophobicContact CB-CE 4.18Å; A614-M670 HydrophobicContact CB-SD 4.45Å; A614-E673 HydrophobicContact CB-CB 4.42Å; A614-E673 HydrophobicContact CB-CG 3.86Å; A614-L674 HydrophobicContact CB-CB 4.32Å; A614-L674 HydrophobicContact CB-CD1 4.48Å; A614-L674 VanDerWaalsContact O-CD1 3.3Å; A614-L674 WeakPolarHBondContact O-CD1 3.04Å; A614-K677 HydrophobicContact CB-CG 4.07Å
615	S	92	Very high	86	Confident	15 Å²	15	33.4 Å²	33.4	11%	0.105	17%	0.174	C	C	.	.	H	α-helix	trans	-66.9	-42	176	-52.9	0	0	0	0	112.3	S611 A612 L613 E619 K677	S611-S615 PolarHBondContact O-N 2.83Å; S611-S615 VanDerWaalsContact O-N 3.15Å; S611-S615 PolarHBondContact O-OG 3.22Å; A612-S615 PolarHBondContact O-N 3.18Å; L613-S615 VanDerWaalsContact C-N 3.26Å; L613-S615 PolarHBondContact O-N 3.23Å; S615-E619 PolarHBondContact O-N 3.16Å; S615-K677 VanDerWaalsContact OG-CE 3.25Å; S615-K677 WeakPolarHBondContact OG-CE 3.25Å
616	C	90.7	Very high	85.4	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-47.8	173.2	-70.6	0	0	0	0	112.5	I544 V559 A612 L613 E619 L620	I544-C616 HydrophobicContact CG2-CB 4.43Å; V559-C616 HydrophobicContact CG1-CB 3.84Å; A612-C616 PolarHBondContact O-N 3.12Å; A612-C616 PolarHBondContact O-SG 3.19Å; A612-C616 VanDerWaalsContact O-SG 3.4Å; L613-C616 WeakPolarHBondContact O-CB 3.45Å; L613-C616 PolarHBondContact O-N 3.24Å; L613-C616 VanDerWaalsContact O-N 3.15Å; C616-E619 PolarHBondContact O-N 3.03Å; C616-L620 VanDerWaalsContact O-CB 3.31Å; C616-L620 WeakPolarHBondContact O-CB 3.37Å; C616-L620 VanDerWaalsContact O-CG 3.27Å; C616-L620 WeakPolarHBondContact O-CG 3.29Å; C616-L620 PolarHBondContact O-N 3.46Å
617	L	90.9	Very high	84.8	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-69.1	-37.1	-177.6	-64.3	-178.1	0	0	0	112.2	M593 L613 A614 E619 L620 F621 M670 L674	M593-L617 HydrophobicContact CE-CD1 3.91Å; M593-L617 HydrophobicContact SD-CD2 4.12Å; L613-L617 HydrophobicContact CD1-CD1 4.4Å; L613-L617 HydrophobicContact CD1-CD2 4.49Å; L613-L617 HydrophobicContact CD1-CG 4.18Å; L613-L617 HydrophobicContact CG-CD1 4.24Å; L613-L617 HydrophobicContact CG-CG 4.4Å; L613-L617 WeakPolarHBondContact O-CG 3.42Å; L613-L617 PolarHBondContact O-N 3.48Å; A614-L617 PolarHBondContact O-N 2.91Å; L617-E619 VanDerWaalsContact C-N 3.33Å; L617-E619 PolarHBondContact O-N 2.91Å; L617-L620 PolarHBondContact O-N 3.22Å; L617-F621 HydrophobicContact CB-CD2 4.33Å; L617-F621 HydrophobicContact CD2-CD2 4.44Å; L617-F621 HydrophobicContact CD2-CE2 3.89Å; L617-F621 WeakPolarHBondContact O-CB 3.46Å; L617-F621 PolarHBondContact O-N 3.2Å; L617-M670 HydrophobicContact CD1-CE 3.68Å; L617-L674 HydrophobicContact CB-CD1 4.34Å
618	A	89.9	Confident	84.5	Confident	10 Å²	10	35.5 Å²	35.5	8%	0.083	19%	0.185	C	C	.	.	H	α-helix	trans	-59.6	-40.7	176.2	0	0	0	0	0	112.8	A614 K622 L674 K677 Q678	A614-A618 VanDerWaalsContact O-CB 3.29Å; A614-A618 WeakPolarHBondContact O-CB 3.41Å; A614-A618 PolarHBondContact O-N 3.23Å; A618-K622 PolarHBondContact O-N 3.25Å; A618-L674 HydrophobicContact CB-CD1 3.96Å; A618-K677 HydrophobicContact CB-CB 3.9Å; A618-Q678 HydrophobicContact CB-CB 4.07Å
619	E	88.1	Confident	84.7	Confident	49 Å²	49	28.5 Å²	28.5	23%	0.229	15%	0.153	C	C	.	.	H	α-helix	trans	-82.8	-36.2	178.9	-169.9	59.5	-152.9	0	0	112.2	A542 I544 W547 S615 C616 L617 K622	A542-E619 HydrophobicContact CB-CG 4.08Å; I544-E619 HydrophobicContact CG2-CB 4.21Å; I544-E619 HydrophobicContact CG2-CG 4.46Å; W547-E619 HydrophobicContact CZ3-CB 4.38Å; S615-E619 PolarHBondContact O-N 3.16Å; C616-E619 PolarHBondContact O-N 3.03Å; L617-E619 VanDerWaalsContact C-N 3.33Å; L617-E619 PolarHBondContact O-N 2.91Å; E619-K622 WeakPolarHBondContact O-CB 3.48Å; E619-K622 WeakPolarHBondContact OE1-CD 3.47Å; E619-K622 IonicContact OE1-NZ 3.2Å; E619-K622 PolarHBondContact OE1-NZ 2.7Å; E619-K622 IonicContact OE2-NZ 2.63Å; E619-K622 PolarHBondContact OE2-NZ 3.17Å
620	L	86.6	Confident	84.8	Confident	5 Å²	5	27.5 Å²	27.5	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-64.3	-39.4	175.1	-78.9	172.8	0	0	0	113.1	I544 V559 I562 Q563 R566 C616 L617	I544-L620 HydrophobicContact CD1-CD1 4.27Å; I544-L620 HydrophobicContact CD1-CD2 4.3Å; I544-L620 HydrophobicContact CD1-CG 4.39Å; I544-L620 HydrophobicContact CG2-CD2 4.48Å; I544-L620 HydrophobicContact CG2-CG 4.08Å; V559-L620 HydrophobicContact CG1-CD1 3.91Å; I562-L620 HydrophobicContact CB-CD1 4.39Å; I562-L620 HydrophobicContact CG2-CD1 4.13Å; Q563-L620 HydrophobicContact CB-CD2 3.84Å; Q563-L620 HydrophobicContact CG-CD2 3.8Å; R566-L620 PolarHBondContact NH1-O 3.18Å; C616-L620 VanDerWaalsContact O-CB 3.31Å; C616-L620 WeakPolarHBondContact O-CB 3.37Å; C616-L620 VanDerWaalsContact O-CG 3.27Å; C616-L620 WeakPolarHBondContact O-CG 3.29Å; C616-L620 PolarHBondContact O-N 3.46Å; L617-L620 PolarHBondContact O-N 3.22Å
621	F	86.9	Confident	84.6	Confident	5 Å²	5	27.8 Å²	27.8	2%	0.022	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	13.9	-177.7	-61	-39.1	0	0	0	113.7	I562 M593 L617 D623 H624 F625 P646 V647	I562-F621 HydrophobicContact CG2-CE1 4.07Å; I562-F621 HydrophobicContact CG2-CZ 4.27Å; M593-F621 HydrophobicContact CE-CE2 4.42Å; M593-F621 HydrophobicContact CG-CE2 4.46Å; M593-F621 HydrophobicContact CG-CZ 4.32Å; M593-F621 HydrophobicContact SD-CE2 3.79Å; M593-F621 HydrophobicContact SD-CZ 3.96Å; L617-F621 HydrophobicContact CB-CD2 4.33Å; L617-F621 HydrophobicContact CD2-CD2 4.44Å; L617-F621 HydrophobicContact CD2-CE2 3.89Å; L617-F621 WeakPolarHBondContact O-CB 3.46Å; L617-F621 PolarHBondContact O-N 3.2Å; F621-D623 PolarHBondContact O-N 3.16Å; F621-H624 HydrophobicContact CB-CB 4.42Å; F621-H624 AromaticContact CD1-CE1 3.23Å; F621-H624 WeakPolarHBondContact CD1-CE1 3.09Å; F621-H624 AromaticContact CD1-ND1 3.44Å; F621-H624 WeakPolarHBondContact CD1-ND1 3.35Å; F621-H624 AromaticContact CE1-CE1 3.74Å; F621-H624 AromaticContact CG-CE1 3.87Å; F621-H624 AromaticContact CG-ND1 3.57Å; F621-H624 VanDerWaalsContact O-CB 3.29Å; F621-H624 WeakPolarHBondContact O-CB 3.2Å; F621-H624 PolarHBondContact O-N 2.75Å; F621-F625 HydrophobicContact CB-CE2 4.14Å; F621-F625 WeakPolarHBondContact O-CD2 3.43Å; F621-F625 WeakPolarHBondContact O-CE2 3.25Å; F621-P646 HydrophobicContact CE1-CB 3.97Å; F621-P646 HydrophobicContact CZ-CB 3.83Å; F621-V647 HydrophobicContact CB-CB 4.43Å; F621-V647 HydrophobicContact CD2-CB 3.73Å; F621-V647 HydrophobicContact CD2-CG2 3.93Å; F621-V647 HydrophobicContact CE2-CB 4.16Å; F621-V647 HydrophobicContact CG-CB 4.17Å
622	K	83.6	Confident	84.1	Confident	67 Å²	67	29.9 Å²	29.9	29%	0.291	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-43.8	-38.2	178.1	-167.3	174	-162.3	151.1	0	114.1	A618 E619	A618-K622 PolarHBondContact O-N 3.25Å; E619-K622 WeakPolarHBondContact O-CB 3.48Å; E619-K622 WeakPolarHBondContact OE1-CD 3.47Å; E619-K622 IonicContact OE1-NZ 3.2Å; E619-K622 PolarHBondContact OE1-NZ 2.7Å; E619-K622 IonicContact OE2-NZ 2.63Å; E619-K622 PolarHBondContact OE2-NZ 3.17Å
623	D	78.6	Confident	83.7	Confident	39 Å²	39	34.6 Å²	34.6	21%	0.209	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-83.3	-16.4	-177.9	-54.1	-74.3	0	0	0	114.1	R566 F621 F625 R626	R566-D623 IonicContact CZ-OD2 3.21Å; R566-D623 IonicContact NH1-OD2 2.77Å; R566-D623 PolarHBondContact NH1-OD2 3.27Å; R566-D623 VanDerWaalsContact NH1-OD2 3.14Å; R566-D623 IonicContact NH2-OD2 2.82Å; R566-D623 PolarHBondContact NH2-OD2 3.26Å; F621-D623 PolarHBondContact O-N 3.16Å; D623-F625 PolarHBondContact O-N 3.23Å; D623-R626 PolarHBondContact O-N 3.18Å; D623-R626 WeakPolarHBondContact OD1-CD 3.31Å; D623-R626 IonicContact OD1-CZ 2.76Å; D623-R626 IonicContact OD1-NE 3.18Å; D623-R626 IonicContact OD1-NH1 3.38Å; D623-R626 PolarHBondContact OD1-NH1 3.39Å
624	H	82.6	Confident	83.5	Confident	39 Å²	39	38.6 Å²	38.6	18%	0.181	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-66	-23.8	169.2	-65.4	166.8	0	0	0	112.6	F621 K645 V647	F621-H624 HydrophobicContact CB-CB 4.42Å; F621-H624 AromaticContact CD1-CE1 3.23Å; F621-H624 WeakPolarHBondContact CD1-CE1 3.09Å; F621-H624 AromaticContact CD1-ND1 3.44Å; F621-H624 WeakPolarHBondContact CD1-ND1 3.35Å; F621-H624 AromaticContact CE1-CE1 3.74Å; F621-H624 AromaticContact CG-CE1 3.87Å; F621-H624 AromaticContact CG-ND1 3.57Å; F621-H624 VanDerWaalsContact O-CB 3.29Å; F621-H624 WeakPolarHBondContact O-CB 3.2Å; F621-H624 PolarHBondContact O-N 2.75Å; H624-K645 HydrophobicContact CB-CD 4.12Å; H624-K645 PolarHBondContact O-NZ 2.86Å; H624-V647 HydrophobicContact CB-CG1 4.14Å
625	F	82.3	Confident	83.4	Confident	5 Å²	5	41.7 Å²	41.7	2%	0.022	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-100.7	17.7	-179.7	-46.1	-78.8	0	0	0	113.5	F621 D623 V647 Q678 K680 I681 H684	F621-F625 HydrophobicContact CB-CE2 4.14Å; F621-F625 WeakPolarHBondContact O-CD2 3.43Å; F621-F625 WeakPolarHBondContact O-CE2 3.25Å; D623-F625 PolarHBondContact O-N 3.23Å; F625-V647 HydrophobicContact CZ-CG2 4Å; F625-Q678 HydrophobicContact CD1-CG 4.39Å; F625-Q678 HydrophobicContact CD2-CG 3.84Å; F625-Q678 HydrophobicContact CE1-CG 4.25Å; F625-Q678 HydrophobicContact CE2-CG 3.69Å; F625-Q678 HydrophobicContact CG-CG 4.19Å; F625-Q678 HydrophobicContact CZ-CG 3.9Å; F625-K680 HydrophobicContact CB-CB 4.23Å; F625-K680 HydrophobicContact CB-CD 3.86Å; F625-K680 HydrophobicContact CD1-CB 4.27Å; F625-K680 HydrophobicContact CG-CB 4.48Å; F625-K680 PolarHBondContact O-NZ 2.74Å; F625-I681 HydrophobicContact CE1-CB 3.98Å; F625-I681 HydrophobicContact CE1-CD1 4.35Å; F625-I681 HydrophobicContact CE1-CG1 3.97Å; F625-I681 HydrophobicContact CZ-CB 4.42Å; F625-I681 HydrophobicContact CZ-CD1 4.22Å; F625-I681 HydrophobicContact CZ-CG1 4.34Å; F625-H684 AromaticContact CD1-CE1 3.87Å; F625-H684 AromaticContact CD1-ND1 3.99Å; F625-H684 AromaticContact CD1-NE2 3.88Å
626	R	70.6	Confident	83	Confident	121 Å²	121	47.3 Å²	47.3	46%	0.457	24%	0.243	S	C	.	.	S	Bend	trans	-117.1	138.4	-179.2	-76.2	176	165.2	173.3	-10	111.7	D623	D623-R626 PolarHBondContact O-N 3.18Å; D623-R626 WeakPolarHBondContact OD1-CD 3.31Å; D623-R626 IonicContact OD1-CZ 2.76Å; D623-R626 IonicContact OD1-NE 3.18Å; D623-R626 IonicContact OD1-NH1 3.38Å; D623-R626 PolarHBondContact OD1-NH1 3.39Å
627	G	66.9	Low	82.8	Confident	60 Å²	60	54.9 Å²	54.9	62%	0.619	28%	0.278	S	S	*	.	S	Bend	trans	76.1	178.1	177.5	0	0	0	0	0	114.4	V629	G627-V629 PolarHBondContact O-N 3.47Å
628	E	68.5	Low	82.7	Confident	87 Å²	87	55.8 Å²	55.8	41%	0.407	29%	0.285	S	S	.	.			trans	-56.2	120.7	179.5	-68.8	178.8	-130	0	0	111.8	K534 R731	K534-E628 PolarHBondContact NZ-O 3.37Å; E628-R731 IonicContact OE2-NH1 3.17Å
629	V	80.6	Confident	82.6	Confident	12 Å²	12	56.1 Å²	56.1	7%	0.073	29%	0.285	C	S	.	.			trans	-88.4	-33	-177.6	-177.2	0	0	0	0	111.1	G627 Y687 D729 L732	G627-V629 PolarHBondContact O-N 3.47Å; V629-Y687 HydrophobicContact CG1-CD1 3.7Å; V629-Y687 HydrophobicContact CG1-CE1 3.72Å; V629-Y687 HydrophobicContact CG1-CG 4.44Å; V629-D729 PolarHBondContact N-OD2 2.67Å; V629-L732 HydrophobicContact CB-CD2 4.27Å
630	L	87.7	Confident	82.7	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	28%	0.284	C	S	.	.	S	Bend	trans	-80.8	125.4	-177.9	-171.6	71.1	0	0	0	111.1	I634 L639 Y687 R731 Y735	L630-I634 HydrophobicContact CD1-CD1 4.45Å; L630-I634 HydrophobicContact CD2-CD1 3.8Å; L630-I634 HydrophobicContact CD2-CG1 4.38Å; L630-I634 HydrophobicContact CG-CD1 4.26Å; L630-I634 HydrophobicContact CG-CG1 4.32Å; L630-L639 HydrophobicContact CD1-CD2 4.03Å; L630-Y687 HydrophobicContact CD1-CE2 3.66Å; L630-R731 HydrophobicContact CD2-CG 4.11Å; L630-R731 PolarHBondContact O-NH1 2.97Å; L630-Y735 HydrophobicContact CD1-CD1 3.57Å; L630-Y735 HydrophobicContact CD1-CD2 4.27Å; L630-Y735 HydrophobicContact CD1-CE1 3.82Å; L630-Y735 HydrophobicContact CD1-CE2 4.49Å; L630-Y735 HydrophobicContact CD1-CG 3.81Å; L630-Y735 HydrophobicContact CD2-CD1 4.49Å; L630-Y735 HydrophobicContact CD2-CD2 4.47Å; L630-Y735 HydrophobicContact CD2-CG 4.01Å
631	P	86.8	Confident	82.7	Confident	24 Å²	24	61.9 Å²	61.9	16%	0.156	31%	0.312	C	S	.	.			trans	-52.5	143.8	176	-27.6	33.9	0	0	0	113.4	E633 S638 Y687 R731	P631-E633 PolarHBondContact O-N 2.88Å; P631-S638 VanDerWaalsContact CG-O 3.27Å; P631-S638 WeakPolarHBondContact CG-O 3.35Å; P631-Y687 WeakPolarHBondContact CD-OH 3.37Å; P631-R731 PolarHBondContact O-NH1 3.14Å; P631-R731 PolarHBondContact O-NH2 2.89Å
632	E	78.7	Confident	82.7	Confident	83 Å²	83	62.7 Å²	62.7	39%	0.388	32%	0.318	S	S	.	.	S	Bend	trans	-58.6	-48.2	177.8	-74.1	-178.9	-124.9	0	0	111.9	H531 P532 R731	H531-E632 IonicContact CD2-OE1 3.82Å; H531-E632 IonicContact CD2-OE2 3.97Å; H531-E632 PolarHBondContact CD2-OE2 3.22Å; H531-E632 IonicContact CG-OE2 2.78Å; P532-E632 WeakPolarHBondContact CD-OE2 3.41Å; E632-R731 PolarHBondContact O-NH2 2.8Å
633	E	82.7	Confident	83	Confident	99 Å²	99	59.9 Å²	59.9	46%	0.463	31%	0.307	S	S	.	.	S	Bend	trans	-97.6	108.3	169.7	-69.1	-175.7	-130.5	0	0	109.6	R529 P631 T635 S638	R529-E633 IonicContact CZ-OE1 2.79Å; R529-E633 IonicContact CZ-OE2 2.75Å; R529-E633 IonicContact NH1-OE1 2.72Å; R529-E633 PolarHBondContact NH1-OE1 3.41Å; R529-E633 IonicContact NH1-OE2 2.75Å; R529-E633 PolarHBondContact NH1-OE2 3.15Å; P631-E633 PolarHBondContact O-N 2.88Å; E633-T635 PolarHBondContact O-N 3.26Å; E633-S638 PolarHBondContact O-OG 2.67Å
634	I	87.3	Confident	83.3	Confident	84 Å²	84	61.6 Å²	61.6	43%	0.431	32%	0.322	S	S	.	.			trans	-76.9	105.5	-178.8	-55.4	175.2	0	0	0	109	L630 L639 Y735	L630-I634 HydrophobicContact CD1-CD1 4.45Å; L630-I634 HydrophobicContact CD2-CD1 3.8Å; L630-I634 HydrophobicContact CD2-CG1 4.38Å; L630-I634 HydrophobicContact CG-CD1 4.26Å; L630-I634 HydrophobicContact CG-CG1 4.32Å; I634-L639 HydrophobicContact CG2-CD1 3.94Å; I634-L639 HydrophobicContact CG2-CD2 4.23Å; I634-L639 HydrophobicContact CG2-CG 4.18Å; I634-Y735 HydrophobicContact CD1-CD2 4.22Å; I634-Y735 HydrophobicContact CG2-CE2 4.14Å
635	T	88.8	Confident	83.5	Confident	65 Å²	65	62.4 Å²	62.4	40%	0.399	33%	0.325	S	S	.	.			trans	-134.5	161.7	177.4	74.2	0	0	0	0	110.5	E633 E637 S638 L639	E633-T635 PolarHBondContact O-N 3.26Å; T635-E637 PolarHBondContact O-N 3.21Å; T635-E637 VanDerWaalsContact O-N 3.15Å; T635-E637 PolarHBondContact OG1-N 3.43Å; T635-S638 PolarHBondContact N-OG 3.34Å; T635-S638 PolarHBondContact O-N 3.28Å; T635-S638 PolarHBondContact O-OG 2.93Å; T635-S638 WeakPolarHBondContact OG1-CB 3.43Å; T635-S638 PolarHBondContact OG1-N 3.2Å; T635-S638 PolarHBondContact OG1-OG 2.64Å; T635-L639 VanDerWaalsContact O-CB 3.3Å; T635-L639 WeakPolarHBondContact O-CB 3.25Å; T635-L639 WeakPolarHBondContact O-CG 3.33Å; T635-L639 PolarHBondContact O-N 3.04Å
636	E	84.3	Confident	83.8	Confident	133 Å²	133	62.2 Å²	62.2	62%	0.621	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-10.5	179.3	-149.9	-162	121.4	0	0	114	K693	E636-K693 HydrophobicContact CG-CD 4.42Å; E636-K693 WeakPolarHBondContact O-CE 3.42Å; E636-K693 PolarHBondContact O-NZ 3.08Å; E636-K693 VanDerWaalsContact OE1-CD 3.3Å; E636-K693 WeakPolarHBondContact OE1-CD 3.4Å; E636-K693 WeakPolarHBondContact OE1-CE 3.44Å; E636-K693 IonicContact OE1-NZ 3.22Å; E636-K693 PolarHBondContact OE1-NZ 3.38Å
637	E	85.6	Confident	84.7	Confident	159 Å²	159	56.6 Å²	56.6	74%	0.743	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-50.3	175.6	-64.5	180	166.4	0	0	110.3	T635 L639 E640 E641	T635-E637 PolarHBondContact O-N 3.21Å; T635-E637 VanDerWaalsContact O-N 3.15Å; T635-E637 PolarHBondContact OG1-N 3.43Å; E637-L639 VanDerWaalsContact C-N 3.31Å; E637-L639 PolarHBondContact O-N 3.13Å; E637-E640 PolarHBondContact O-N 3.37Å; E637-E641 PolarHBondContact O-N 3.23Å
638	S	89.1	Confident	85.8	Confident	20 Å²	20	54.3 Å²	54.3	14%	0.14	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-30.8	178	59	0	0	0	0	113.6	P631 E633 T635 S642	P631-S638 VanDerWaalsContact CG-O 3.27Å; P631-S638 WeakPolarHBondContact CG-O 3.35Å; E633-S638 PolarHBondContact O-OG 2.67Å; T635-S638 PolarHBondContact N-OG 3.34Å; T635-S638 PolarHBondContact O-N 3.28Å; T635-S638 PolarHBondContact O-OG 2.93Å; T635-S638 WeakPolarHBondContact OG1-CB 3.43Å; T635-S638 PolarHBondContact OG1-N 3.2Å; T635-S638 PolarHBondContact OG1-OG 2.64Å; S638-S642 PolarHBondContact O-N 3.37Å
639	L	89.4	Confident	86.9	Confident	17 Å²	17	50.9 Å²	50.9	9%	0.089	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-47.4	172.2	-76.2	171.1	0	0	0	111.5	L630 I634 T635 E637 S642 V643 Y687 A691 Y735	L630-L639 HydrophobicContact CD1-CD2 4.03Å; I634-L639 HydrophobicContact CG2-CD1 3.94Å; I634-L639 HydrophobicContact CG2-CD2 4.23Å; I634-L639 HydrophobicContact CG2-CG 4.18Å; T635-L639 VanDerWaalsContact O-CB 3.3Å; T635-L639 WeakPolarHBondContact O-CB 3.25Å; T635-L639 WeakPolarHBondContact O-CG 3.33Å; T635-L639 PolarHBondContact O-N 3.04Å; E637-L639 VanDerWaalsContact C-N 3.31Å; E637-L639 PolarHBondContact O-N 3.13Å; L639-S642 PolarHBondContact O-N 3.11Å; L639-S642 PolarHBondContact O-OG 2.66Å; L639-V643 WeakPolarHBondContact O-CG2 2.99Å; L639-V643 PolarHBondContact O-N 3.2Å; L639-Y687 HydrophobicContact CD2-CE2 4.3Å; L639-Y687 WeakPolarHBondContact CD2-OH 3.32Å; L639-A691 HydrophobicContact CB-CB 4.34Å; L639-A691 HydrophobicContact CD2-CB 4.11Å; L639-Y735 WeakPolarHBondContact CD1-OH 3.35Å; L639-Y735 HydrophobicContact CD2-CE1 4.35Å
640	E	88.6	Confident	87.4	Confident	42 Å²	42	50.3 Å²	50.3	20%	0.196	26%	0.259	C	S	.	.	H	α-helix	trans	-66.7	-37.1	178.5	-69.6	-82	-145.8	0	0	112.3	E637 S642 V643 S644 S692 K693	E637-E640 PolarHBondContact O-N 3.37Å; E640-S642 VanDerWaalsContact C-N 3.34Å; E640-S642 PolarHBondContact O-N 3.04Å; E640-V643 VanDerWaalsContact O-CG2 3.29Å; E640-V643 WeakPolarHBondContact O-CG2 3.41Å; E640-V643 PolarHBondContact O-N 3.23Å; E640-S644 PolarHBondContact O-N 3.02Å; E640-S644 VanDerWaalsContact O-N 3.17Å; E640-S644 PolarHBondContact O-OG 3.41Å; E640-S692 VanDerWaalsContact OE2-CA 3.27Å; E640-S692 WeakPolarHBondContact OE2-CA 3.22Å; E640-S692 WeakPolarHBondContact OE2-CB 3.43Å; E640-S692 PolarHBondContact OE2-OG 3.28Å; E640-K693 VanDerWaalsContact CG-CE 3.4Å; E640-K693 WeakPolarHBondContact OE1-CB 2.78Å; E640-K693 WeakPolarHBondContact OE1-CE 3.32Å; E640-K693 VanDerWaalsContact OE1-CG 3.23Å; E640-K693 WeakPolarHBondContact OE1-CG 3.46Å; E640-K693 PolarHBondContact OE1-N 2.84Å
641	E	86.6	Confident	87.8	Confident	134 Å²	134	50.1 Å²	50.1	63%	0.626	26%	0.258	S	S	*	.	H	α-helix	trans	-58.7	-45.8	172.2	-173.1	175.8	-161.1	0	0	111	E637 V643 S644	E637-E641 PolarHBondContact O-N 3.23Å; E641-V643 VanDerWaalsContact C-N 3.25Å; E641-V643 PolarHBondContact O-N 2.79Å; E641-S644 WeakPolarHBondContact O-CB 3.46Å; E641-S644 PolarHBondContact O-N 2.9Å; E641-S644 VanDerWaalsContact O-N 3.09Å
642	S	87.7	Confident	88	Confident	21 Å²	21	55.7 Å²	55.7	15%	0.147	28%	0.275	C	S	.	.	H	α-helix	trans	-64.5	-24.8	-179	75.5	0	0	0	0	114.9	S638 L639 E640 Y687	S638-S642 PolarHBondContact O-N 3.37Å; L639-S642 PolarHBondContact O-N 3.11Å; L639-S642 PolarHBondContact O-OG 2.66Å; E640-S642 VanDerWaalsContact C-N 3.34Å; E640-S642 PolarHBondContact O-N 3.04Å; S642-Y687 PolarHBondContact OG-OH 3.49Å
643	V	89.3	Confident	88.6	Confident	8 Å²	8	52.8 Å²	52.8	5%	0.048	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	3.2	177	-62	0	0	0	0	113.6	L639 E640 E641 K645 C648 Y687 Y688 A691	L639-V643 WeakPolarHBondContact O-CG2 2.99Å; L639-V643 PolarHBondContact O-N 3.2Å; E640-V643 VanDerWaalsContact O-CG2 3.29Å; E640-V643 WeakPolarHBondContact O-CG2 3.41Å; E640-V643 PolarHBondContact O-N 3.23Å; E641-V643 VanDerWaalsContact C-N 3.25Å; E641-V643 PolarHBondContact O-N 2.79Å; V643-K645 PolarHBondContact O-N 2.86Å; V643-C648 WeakPolarHBondContact O-CB 3.12Å; V643-Y687 HydrophobicContact CG1-CD1 3.96Å; V643-Y687 HydrophobicContact CG1-CE1 3.62Å; V643-Y688 HydrophobicContact CB-CD2 3.73Å; V643-Y688 HydrophobicContact CB-CE2 3.93Å; V643-Y688 HydrophobicContact CG1-CD2 4.08Å; V643-Y688 HydrophobicContact CG2-CD2 4.4Å; V643-Y688 HydrophobicContact CG2-CE2 4.23Å; V643-A691 HydrophobicContact CG1-CB 3.89Å
644	S	85.6	Confident	89	Confident	76 Å²	76	48.2 Å²	48.2	53%	0.531	24%	0.242	S	C	.	.			trans	-84.9	27.7	176.9	-65	0	0	0	0	113.3	E640 E641	E640-S644 PolarHBondContact O-N 3.02Å; E640-S644 VanDerWaalsContact O-N 3.17Å; E640-S644 PolarHBondContact O-OG 3.41Å; E641-S644 WeakPolarHBondContact O-CB 3.46Å; E641-S644 PolarHBondContact O-N 2.9Å; E641-S644 VanDerWaalsContact O-N 3.09Å
645	K	87.5	Confident	89.2	Confident	55 Å²	55	44.5 Å²	44.5	24%	0.239	22%	0.222	C	C	.	.	S	Bend	trans	-81.1	148.7	176.4	-60.2	178.2	-177.5	173.2	0	110.9	H624 V643 V647 C648	H624-K645 HydrophobicContact CB-CD 4.12Å; H624-K645 PolarHBondContact O-NZ 2.86Å; V643-K645 PolarHBondContact O-N 2.86Å; K645-V647 VanDerWaalsContact C-N 3.31Å; K645-V647 HydrophobicContact CB-CG1 4.38Å; K645-V647 PolarHBondContact O-N 2.84Å; K645-C648 WeakPolarHBondContact O-CB 3.37Å; K645-C648 PolarHBondContact O-N 3.19Å
646	P	87.7	Confident	89.1	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-43.4	179.3	-29	32.9	0	0	0	114.6	T586 Q589 M593 F621 C648 L649	T586-P646 HydrophobicContact CG2-CG 4.35Å; Q589-P646 HydrophobicContact CB-CB 4.38Å; Q589-P646 HydrophobicContact CB-CG 3.65Å; M593-P646 HydrophobicContact CB-CB 4.12Å; M593-P646 HydrophobicContact CG-CB 4.24Å; M593-P646 WeakPolarHBondContact CG-O 3.42Å; F621-P646 HydrophobicContact CE1-CB 3.97Å; F621-P646 HydrophobicContact CZ-CB 3.83Å; P646-C648 PolarHBondContact O-N 3.4Å; P646-L649 VanDerWaalsContact O-CB 3.32Å; P646-L649 WeakPolarHBondContact O-CB 3.43Å; P646-L649 WeakPolarHBondContact O-CG 3.35Å; P646-L649 PolarHBondContact O-N 3.04Å
647	V	88.6	Confident	89.1	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.024	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.4	179.1	69.2	0	0	0	0	113.2	F621 H624 F625 K645 L649 I650 I681	F621-V647 HydrophobicContact CB-CB 4.43Å; F621-V647 HydrophobicContact CD2-CB 3.73Å; F621-V647 HydrophobicContact CD2-CG2 3.93Å; F621-V647 HydrophobicContact CE2-CB 4.16Å; F621-V647 HydrophobicContact CG-CB 4.17Å; H624-V647 HydrophobicContact CB-CG1 4.14Å; F625-V647 HydrophobicContact CZ-CG2 4Å; K645-V647 VanDerWaalsContact C-N 3.31Å; K645-V647 HydrophobicContact CB-CG1 4.38Å; K645-V647 PolarHBondContact O-N 2.84Å; V647-L649 PolarHBondContact O-N 2.79Å; V647-I650 PolarHBondContact O-N 3.15Å; V647-I681 HydrophobicContact CG2-CD1 4.24Å
648	C	90.9	Very high	88.7	Confident	12 Å²	12	40.4 Å²	40.4	8%	0.081	21%	0.205	C	C	.	.	H	α-helix	trans	-75	-5.7	177.9	-60.1	0	0	0	0	113.2	V643 K645 P646 I650 F651 R652 Y688	V643-C648 WeakPolarHBondContact O-CB 3.12Å; K645-C648 WeakPolarHBondContact O-CB 3.37Å; K645-C648 PolarHBondContact O-N 3.19Å; P646-C648 PolarHBondContact O-N 3.4Å; C648-I650 VanDerWaalsContact C-N 3.29Å; C648-I650 PolarHBondContact O-N 3Å; C648-F651 HydrophobicContact CB-CD2 3.95Å; C648-F651 WeakPolarHBondContact O-CB 3.31Å; C648-F651 PolarHBondContact O-N 2.9Å; C648-R652 WeakPolarHBondContact O-CB 3.11Å; C648-R652 PolarHBondContact O-N 2.82Å; C648-Y688 HydrophobicContact CB-CD2 3.89Å; C648-Y688 HydrophobicContact CB-CE2 3.92Å
649	L	91.1	Very high	88.1	Confident	14 Å²	14	46.4 Å²	46.4	7%	0.073	23%	0.231	C	C	.	.	H	α-helix	trans	-67.8	-28.8	171.9	-66.6	174.9	0	0	0	112.6	C590 M593 Q594 P646 V647 R652 N653	C590-L649 HydrophobicContact CB-CD1 3.91Å; C590-L649 WeakPolarHBondContact O-CD1 3.48Å; M593-L649 HydrophobicContact CB-CD1 4.08Å; M593-L649 HydrophobicContact CG-CD1 4.27Å; Q594-L649 HydrophobicContact CB-CD1 4.35Å; P646-L649 VanDerWaalsContact O-CB 3.32Å; P646-L649 WeakPolarHBondContact O-CB 3.43Å; P646-L649 WeakPolarHBondContact O-CG 3.35Å; P646-L649 PolarHBondContact O-N 3.04Å; V647-L649 PolarHBondContact O-N 2.79Å; L649-R652 PolarHBondContact O-N 2.67Å; L649-N653 PolarHBondContact O-N 3.01Å; L649-N653 PolarHBondContact O-ND2 3.19Å
650	I	92.4	Very high	87.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.1	-51.4	170.3	-61.9	168.8	0	0	0	109	M593 V597 V647 C648 R652 N653 L654 L667 L671 L674	M593-I650 HydrophobicContact CE-CD1 3.79Å; M593-I650 HydrophobicContact CE-CG1 3.75Å; V597-I650 HydrophobicContact CG2-CG1 4.19Å; V647-I650 PolarHBondContact O-N 3.15Å; C648-I650 VanDerWaalsContact C-N 3.29Å; C648-I650 PolarHBondContact O-N 3Å; I650-R652 PolarHBondContact O-N 3.42Å; I650-N653 PolarHBondContact O-N 2.95Å; I650-L654 HydrophobicContact CG2-CD1 4.17Å; I650-L654 WeakPolarHBondContact O-CG 3.2Å; I650-L654 PolarHBondContact O-N 2.82Å; I650-L667 HydrophobicContact CG2-CD1 4.07Å; I650-L667 HydrophobicContact CG2-CG 4.31Å; I650-L671 HydrophobicContact CG2-CB 4.14Å; I650-L671 HydrophobicContact CG2-CD1 4.25Å; I650-L671 HydrophobicContact CG2-CD2 4.34Å; I650-L671 HydrophobicContact CG2-CG 4.47Å; I650-L674 HydrophobicContact CD1-CD2 3.88Å
651	F	94.4	Very high	86.8	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.009	28%	0.278	C	S	.	.	H	α-helix	trans	-60.1	-45	176.6	-48.3	-32.6	0	0	0	111.8	C648 N653 V655 L671 I681 H684 L685 Y688	C648-F651 HydrophobicContact CB-CD2 3.95Å; C648-F651 WeakPolarHBondContact O-CB 3.31Å; C648-F651 PolarHBondContact O-N 2.9Å; F651-N653 PolarHBondContact O-N 3.32Å; F651-V655 WeakPolarHBondContact O-CB 3.43Å; F651-V655 WeakPolarHBondContact O-CG2 3.44Å; F651-V655 PolarHBondContact O-N 2.75Å; F651-L671 HydrophobicContact CD1-CD1 4.45Å; F651-L671 HydrophobicContact CD1-CD2 4.07Å; F651-L671 HydrophobicContact CE1-CD1 3.87Å; F651-L671 HydrophobicContact CE1-CD2 4.12Å; F651-I681 HydrophobicContact CE1-CD1 4.23Å; F651-I681 HydrophobicContact CE1-CG1 3.87Å; F651-I681 HydrophobicContact CZ-CD1 4.26Å; F651-I681 HydrophobicContact CZ-CG1 3.63Å; F651-H684 HydrophobicContact CE2-CB 4.36Å; F651-H684 HydrophobicContact CZ-CB 4.28Å; F651-L685 HydrophobicContact CB-CD1 4.2Å; F651-L685 HydrophobicContact CD1-CB 4.29Å; F651-L685 HydrophobicContact CD1-CD1 3.7Å; F651-L685 HydrophobicContact CE1-CB 3.87Å; F651-L685 HydrophobicContact CE1-CD1 4.17Å; F651-L685 HydrophobicContact CG-CD1 3.97Å; F651-L685 HydrophobicContact CZ-CB 4.06Å; F651-Y688 HydrophobicContact CB-CD1 3.52Å; F651-Y688 HydrophobicContact CB-CD2 4.12Å; F651-Y688 HydrophobicContact CB-CE1 3.8Å; F651-Y688 HydrophobicContact CB-CE2 4.39Å; F651-Y688 HydrophobicContact CB-CG 3.71Å; F651-Y688 HydrophobicContact CD2-CD1 4.29Å; F651-Y688 AromaticContact CD2-CD2 3.77Å; F651-Y688 HydrophobicContact CD2-CD2 3.77Å; F651-Y688 AromaticContact CD2-CG 3.6Å; F651-Y688 HydrophobicContact CD2-CG 3.6Å; F651-Y688 HydrophobicContact CG-CD1 4.32Å; F651-Y688 HydrophobicContact CG-CD2 4.47Å; F651-Y688 HydrophobicContact CG-CG 4.08Å
652	R	92.1	Very high	86.4	Confident	140 Å²	140	51.4 Å²	51.4	53%	0.528	27%	0.268	S	S	.	.	H	α-helix	trans	-59.3	-48.4	-178.7	-174.2	-179.8	175	173	-3	111.8	C648 L649 I650 V655 T656 Y688	C648-R652 WeakPolarHBondContact O-CB 3.11Å; C648-R652 PolarHBondContact O-N 2.82Å; L649-R652 PolarHBondContact O-N 2.67Å; I650-R652 PolarHBondContact O-N 3.42Å; R652-V655 PolarHBondContact O-N 2.89Å; R652-T656 WeakPolarHBondContact O-CG2 3.09Å; R652-T656 PolarHBondContact O-N 2.96Å; R652-T656 PolarHBondContact O-OG1 3.39Å; R652-T656 VanDerWaalsContact O-OG1 3.08Å; R652-Y688 WeakPolarHBondContact CA-OH 3.26Å; R652-Y688 WeakPolarHBondContact CB-OH 3.25Å
653	N	91.3	Very high	86.2	Confident	22 Å²	22	50.5 Å²	50.5	12%	0.118	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-52	-178.8	-76.7	-80.7	0	0	0	110.2	Q594 V597 L649 I650 F651 V655 T656 M657 L667	Q594-N653 PolarHBondContact NE2-ND2 3.29Å; Q594-N653 PolarHBondContact NE2-OD1 2.98Å; Q594-N653 VanDerWaalsContact NE2-OD1 3.08Å; Q594-N653 PolarHBondContact OE1-ND2 3.49Å; V597-N653 HydrophobicContact CG1-CB 3.94Å; L649-N653 PolarHBondContact O-N 3.01Å; L649-N653 PolarHBondContact O-ND2 3.19Å; I650-N653 PolarHBondContact O-N 2.95Å; F651-N653 PolarHBondContact O-N 3.32Å; N653-V655 VanDerWaalsContact C-N 3.28Å; N653-V655 PolarHBondContact O-N 2.96Å; N653-T656 PolarHBondContact O-N 2.97Å; N653-T656 PolarHBondContact O-OG1 2.9Å; N653-M657 VanDerWaalsContact O-CG 3.25Å; N653-M657 WeakPolarHBondContact O-CG 3.35Å; N653-M657 PolarHBondContact O-N 3.46Å; N653-L667 HydrophobicContact CB-CD2 3.8Å
654	L	91.1	Very high	86.1	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-49.8	-46.9	173.2	-72.6	171.2	0	0	0	112.5	I650 T656 M657 F664 L667 L668 L671 L701	I650-L654 HydrophobicContact CG2-CD1 4.17Å; I650-L654 WeakPolarHBondContact O-CG 3.2Å; I650-L654 PolarHBondContact O-N 2.82Å; L654-T656 VanDerWaalsContact C-N 3.29Å; L654-T656 PolarHBondContact O-N 3.48Å; L654-M657 PolarHBondContact O-N 3.34Å; L654-F664 HydrophobicContact CD2-CD2 3.94Å; L654-F664 HydrophobicContact CD2-CE2 4.08Å; L654-L667 HydrophobicContact CD1-CG 4.44Å; L654-L667 HydrophobicContact CD2-CB 3.86Å; L654-L667 HydrophobicContact CD2-CD2 3.99Å; L654-L667 HydrophobicContact CD2-CG 3.87Å; L654-L667 HydrophobicContact CG-CB 4.43Å; L654-L667 HydrophobicContact CG-CD2 3.8Å; L654-L667 HydrophobicContact CG-CG 3.87Å; L654-L668 HydrophobicContact CD1-CD1 4.3Å; L654-L668 HydrophobicContact CD2-CB 4.23Å; L654-L668 HydrophobicContact CD2-CD1 4.46Å; L654-L671 HydrophobicContact CD1-CB 4.48Å; L654-L671 HydrophobicContact CD1-CD2 3.67Å; L654-L701 HydrophobicContact CB-CD2 4.05Å
655	V	90.6	Very high	86.2	Confident	5 Å²	5	50 Å²	50	3%	0.03	26%	0.257	C	S	.	.	H	α-helix	trans	-65.1	-27.4	178.5	159.6	0	0	0	0	113.4	F651 R652 N653 Y688 L689 A694 A695 K698 L701	F651-V655 WeakPolarHBondContact O-CB 3.43Å; F651-V655 WeakPolarHBondContact O-CG2 3.44Å; F651-V655 PolarHBondContact O-N 2.75Å; R652-V655 PolarHBondContact O-N 2.89Å; N653-V655 VanDerWaalsContact C-N 3.28Å; N653-V655 PolarHBondContact O-N 2.96Å; V655-Y688 HydrophobicContact CB-CE1 4.48Å; V655-Y688 HydrophobicContact CG2-CD1 4.4Å; V655-Y688 HydrophobicContact CG2-CE1 4.1Å; V655-L689 HydrophobicContact CG2-CD2 3.8Å; V655-A694 HydrophobicContact CG1-CB 4.34Å; V655-A694 WeakPolarHBondContact CG1-O 3.47Å; V655-A695 HydrophobicContact CG1-CB 3.88Å; V655-A695 HydrophobicContact CG2-CB 4.11Å; V655-K698 HydrophobicContact CG1-CD 3.94Å; V655-K698 PolarHBondContact O-NZ 3.43Å; V655-L701 HydrophobicContact CB-CD2 4.48Å; V655-L701 HydrophobicContact CG2-CD2 3.52Å
656	T	86.4	Confident	86.3	Confident	84 Å²	84	49.1 Å²	49.1	52%	0.515	26%	0.256	S	S	.	.	H	α-helix	trans	-93.6	-17.1	179.4	54.6	0	0	0	0	114.7	R652 N653 L654	R652-T656 WeakPolarHBondContact O-CG2 3.09Å; R652-T656 PolarHBondContact O-N 2.96Å; R652-T656 PolarHBondContact O-OG1 3.39Å; R652-T656 VanDerWaalsContact O-OG1 3.08Å; N653-T656 PolarHBondContact O-N 2.97Å; N653-T656 PolarHBondContact O-OG1 2.9Å; L654-T656 VanDerWaalsContact C-N 3.29Å; L654-T656 PolarHBondContact O-N 3.48Å
657	M	85.1	Confident	86.5	Confident	36 Å²	36	49.1 Å²	49.1	18%	0.177	26%	0.256	C	S	.	.	S	Bend	trans	-77.4	172.5	179.6	-72.6	169.5	78.8	0	0	112.4	M601 N653 L654 N661 G663 F664 L667	M601-M657 HydrophobicContact CE-CE 3.44Å; M601-M657 VanDerWaalsContact CE-CE 3.44Å; M601-M657 HydrophobicContact CE-SD 3.81Å; M601-M657 HydrophobicContact SD-CE 3.98Å; M601-M657 HydrophobicContact SD-SD 3.82Å; N653-M657 VanDerWaalsContact O-CG 3.25Å; N653-M657 WeakPolarHBondContact O-CG 3.35Å; N653-M657 PolarHBondContact O-N 3.46Å; L654-M657 PolarHBondContact O-N 3.34Å; M657-N661 HydrophobicContact CE-CB 4.28Å; M657-G663 VanDerWaalsContact CE-C 3.46Å; M657-F664 HydrophobicContact CB-CD2 4.13Å; M657-F664 HydrophobicContact CE-CB 4.11Å; M657-F664 VanDerWaalsContact CE-N 3.35Å; M657-L667 HydrophobicContact SD-CD2 4.33Å
658	Q	78.2	Confident	86.6	Confident	152 Å²	152	49.6 Å²	49.6	71%	0.71	26%	0.259	S	S	*	.			trans	-104.6	142.5	168.2	-67.2	-177.9	-29.4	0	0	108.5	D660 N661	Q658-D660 PolarHBondContact O-N 2.84Å; Q658-N661 VanDerWaalsContact O-CB 3.26Å; Q658-N661 WeakPolarHBondContact O-CB 3.49Å; Q658-N661 PolarHBondContact O-N 2.86Å; Q658-N661 VanDerWaalsContact O-N 3.15Å
659	E	75	Confident	86.6	Confident	146 Å²	146	52.8 Å²	52.8	68%	0.682	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.9	-176.3	-65.2	167.3	-159	0	0	112.9	N661 F664	E659-N661 PolarHBondContact O-N 3.45Å; E659-F664 HydrophobicContact CB-CD1 4.4Å; E659-F664 HydrophobicContact CB-CE1 4.2Å; E659-F664 HydrophobicContact CG-CE1 3.93Å; E659-F664 HydrophobicContact CG-CE2 4.38Å; E659-F664 HydrophobicContact CG-CZ 3.84Å
660	D	71.7	Confident	86.7	Confident	166 Å²	166	52.1 Å²	52.1	89%	0.888	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	2.3	177.3	-64.5	-50.3	0	0	0	114.8	Q658	Q658-D660 PolarHBondContact O-N 2.84Å
661	N	79.4	Confident	86.8	Confident	70 Å²	70	52.1 Å²	52.1	37%	0.374	27%	0.271	S	S	.	.	S	Bend	trans	-91.9	134.2	-176.5	-173.4	-23.1	0	0	0	111.6	M657 Q658 E659 G663 F664	M657-N661 HydrophobicContact CE-CB 4.28Å; Q658-N661 VanDerWaalsContact O-CB 3.26Å; Q658-N661 WeakPolarHBondContact O-CB 3.49Å; Q658-N661 PolarHBondContact O-N 2.86Å; Q658-N661 VanDerWaalsContact O-N 3.15Å; E659-N661 PolarHBondContact O-N 3.45Å; N661-G663 VanDerWaalsContact C-N 3.28Å; N661-G663 PolarHBondContact O-N 3.23Å; N661-G663 PolarHBondContact OD1-N 3.45Å; N661-G663 VanDerWaalsContact OD1-N 3.11Å; N661-F664 HydrophobicContact CB-CB 4.31Å; N661-F664 VanDerWaalsContact O-CB 3.28Å; N661-F664 WeakPolarHBondContact O-CB 3.23Å; N661-F664 PolarHBondContact O-N 3.21Å
662	S	78.2	Confident	86.8	Confident	61 Å²	61	52.2 Å²	52.2	43%	0.427	27%	0.272	S	S	.	.	H	α-helix	trans	-54.3	-42.9	178.1	47.4	0	0	0	0	112.6	D603 F664 S665 V666	D603-S662 WeakPolarHBondContact OD1-CB 3.42Å; D603-S662 PolarHBondContact OD1-OG 2.73Å; S662-F664 PolarHBondContact O-N 3.06Å; S662-S665 PolarHBondContact O-N 3Å; S662-S665 PolarHBondContact O-OG 3.48Å; S662-V666 PolarHBondContact O-N 3.36Å
663	G	82.8	Confident	86.9	Confident	2 Å²	2	47 Å²	47	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-18.4	177.3	0	0	0	0	0	114.5	M657 N661 L667	M657-G663 VanDerWaalsContact CE-C 3.46Å; N661-G663 VanDerWaalsContact C-N 3.28Å; N661-G663 PolarHBondContact O-N 3.23Å; N661-G663 PolarHBondContact OD1-N 3.45Å; N661-G663 VanDerWaalsContact OD1-N 3.11Å; G663-L667 VanDerWaalsContact O-CB 3.23Å; G663-L667 WeakPolarHBondContact O-CB 3.27Å; G663-L667 PolarHBondContact O-N 2.9Å
664	F	87.7	Confident	87	Confident	16 Å²	16	46 Å²	46	7%	0.07	25%	0.249	C	C	.	.	H	α-helix	trans	-69.2	-46.6	177.8	177.8	-94.6	0	0	0	110.6	L654 M657 E659 N661 S662 L668 L701	L654-F664 HydrophobicContact CD2-CD2 3.94Å; L654-F664 HydrophobicContact CD2-CE2 4.08Å; M657-F664 HydrophobicContact CB-CD2 4.13Å; M657-F664 HydrophobicContact CE-CB 4.11Å; M657-F664 VanDerWaalsContact CE-N 3.35Å; E659-F664 HydrophobicContact CB-CD1 4.4Å; E659-F664 HydrophobicContact CB-CE1 4.2Å; E659-F664 HydrophobicContact CG-CE1 3.93Å; E659-F664 HydrophobicContact CG-CE2 4.38Å; E659-F664 HydrophobicContact CG-CZ 3.84Å; N661-F664 HydrophobicContact CB-CB 4.31Å; N661-F664 VanDerWaalsContact O-CB 3.28Å; N661-F664 WeakPolarHBondContact O-CB 3.23Å; N661-F664 PolarHBondContact O-N 3.21Å; S662-F664 PolarHBondContact O-N 3.06Å; F664-L668 HydrophobicContact CE1-CD2 4.25Å; F664-L668 VanDerWaalsContact O-CB 3.26Å; F664-L668 WeakPolarHBondContact O-CB 3.32Å; F664-L668 PolarHBondContact O-N 2.7Å; F664-L701 HydrophobicContact CE2-CD1 3.79Å; F664-L701 HydrophobicContact CZ-CD1 3.54Å
665	S	87.6	Confident	87.2	Confident	58 Å²	58	46.6 Å²	46.6	41%	0.406	25%	0.251	S	S	.	.	H	α-helix	trans	-60.5	-48.3	173.7	28.1	0	0	0	0	112.3	S662 L667 L668 D669	S662-S665 PolarHBondContact O-N 3Å; S662-S665 PolarHBondContact O-OG 3.48Å; S665-L667 VanDerWaalsContact C-N 3.34Å; S665-L667 PolarHBondContact O-N 2.97Å; S665-L668 WeakPolarHBondContact O-CB 3.37Å; S665-L668 PolarHBondContact O-N 3.4Å; S665-L668 VanDerWaalsContact O-N 3.09Å; S665-D669 PolarHBondContact O-N 3.34Å
666	V	90.3	Very high	87.3	Confident	37 Å²	37	51.5 Å²	51.5	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-63.2	-40.1	-177.2	-177.7	0	0	0	0	111.9	I600 F605 M610 S662 L668 M670	I600-V666 HydrophobicContact CG2-CG1 4.17Å; I600-V666 VanDerWaalsContact O-CG1 3.25Å; I600-V666 WeakPolarHBondContact O-CG1 3.31Å; F605-V666 HydrophobicContact CB-CG1 4.29Å; F605-V666 HydrophobicContact CD1-CG1 4.32Å; M610-V666 HydrophobicContact CE-CG1 4.13Å; S662-V666 PolarHBondContact O-N 3.36Å; V666-L668 VanDerWaalsContact C-N 3.33Å; V666-M670 WeakPolarHBondContact O-CB 3.42Å; V666-M670 PolarHBondContact O-N 2.95Å
667	L	91.1	Very high	87.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-72.5	-26.4	176.9	-171.2	61.3	0	0	0	112.7	V597 I600 M601 I650 N653 L654 M657 G663 S665 L671	V597-L667 HydrophobicContact CG1-CD1 4.08Å; V597-L667 HydrophobicContact CG1-CD2 3.91Å; I600-L667 HydrophobicContact CG2-CD1 4.1Å; M601-L667 HydrophobicContact SD-CD2 4.13Å; I650-L667 HydrophobicContact CG2-CD1 4.07Å; I650-L667 HydrophobicContact CG2-CG 4.31Å; N653-L667 HydrophobicContact CB-CD2 3.8Å; L654-L667 HydrophobicContact CD1-CG 4.44Å; L654-L667 HydrophobicContact CD2-CB 3.86Å; L654-L667 HydrophobicContact CD2-CD2 3.99Å; L654-L667 HydrophobicContact CD2-CG 3.87Å; L654-L667 HydrophobicContact CG-CB 4.43Å; L654-L667 HydrophobicContact CG-CD2 3.8Å; L654-L667 HydrophobicContact CG-CG 3.87Å; M657-L667 HydrophobicContact SD-CD2 4.33Å; G663-L667 VanDerWaalsContact O-CB 3.23Å; G663-L667 WeakPolarHBondContact O-CB 3.27Å; G663-L667 PolarHBondContact O-N 2.9Å; S665-L667 VanDerWaalsContact C-N 3.34Å; S665-L667 PolarHBondContact O-N 2.97Å; L667-L671 PolarHBondContact O-N 3.44Å; L667-L671 VanDerWaalsContact O-N 3.15Å
668	L	91.7	Very high	88	Confident	15 Å²	15	50.9 Å²	50.9	8%	0.079	26%	0.263	C	S	.	.	H	α-helix	trans	-75.6	-42.5	174.6	-167.9	68.6	0	0	0	111.5	L654 F664 S665 V666 L671 A672 F705 A708	L654-L668 HydrophobicContact CD1-CD1 4.3Å; L654-L668 HydrophobicContact CD2-CB 4.23Å; L654-L668 HydrophobicContact CD2-CD1 4.46Å; F664-L668 HydrophobicContact CE1-CD2 4.25Å; F664-L668 VanDerWaalsContact O-CB 3.26Å; F664-L668 WeakPolarHBondContact O-CB 3.32Å; F664-L668 PolarHBondContact O-N 2.7Å; S665-L668 WeakPolarHBondContact O-CB 3.37Å; S665-L668 PolarHBondContact O-N 3.4Å; S665-L668 VanDerWaalsContact O-N 3.09Å; V666-L668 VanDerWaalsContact C-N 3.33Å; L668-L671 WeakPolarHBondContact O-CB 3.21Å; L668-L671 PolarHBondContact O-N 3.3Å; L668-L671 VanDerWaalsContact O-N 3.15Å; L668-A672 PolarHBondContact O-N 2.95Å; L668-F705 HydrophobicContact CD1-CB 4.08Å; L668-A708 HydrophobicContact CD2-CB 4.08Å; L668-A708 HydrophobicContact CG-CB 3.97Å
669	D	91.4	Very high	88.6	Confident	79 Å²	79	47 Å²	47	42%	0.422	25%	0.251	S	S	.	.	H	α-helix	trans	-61.9	-43.4	173.2	-68.7	-27.9	0	0	0	110.8	M610 S665 L671 A672 E673	M610-D669 HydrophobicContact CE-CB 4.19Å; M610-D669 HydrophobicContact SD-CB 4.23Å; S665-D669 PolarHBondContact O-N 3.34Å; D669-L671 VanDerWaalsContact C-N 3.29Å; D669-L671 PolarHBondContact O-N 3.18Å; D669-A672 WeakPolarHBondContact O-CB 3.28Å; D669-A672 PolarHBondContact O-N 3.23Å; D669-A672 VanDerWaalsContact O-N 3.16Å; D669-E673 WeakPolarHBondContact O-CB 3.44Å; D669-E673 PolarHBondContact O-N 3.32Å
670	M	92.9	Very high	89.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.8	-37.4	172.8	175.9	59.4	-167	0	0	112.4	I600 M610 L613 A614 L617 V666 L674	I600-M670 HydrophobicContact CD1-CE 4.45Å; I600-M670 HydrophobicContact CD1-CG 4.09Å; I600-M670 HydrophobicContact CG2-CB 4.17Å; I600-M670 HydrophobicContact CG2-CG 4.26Å; M610-M670 HydrophobicContact CE-CB 4.27Å; M610-M670 HydrophobicContact CG-CB 4.22Å; M610-M670 HydrophobicContact CG-SD 3.54Å; M610-M670 VanDerWaalsContact CG-SD 3.54Å; M610-M670 HydrophobicContact SD-CB 4.26Å; L613-M670 HydrophobicContact CB-CE 4.17Å; L613-M670 HydrophobicContact CD2-CE 3.99Å; L613-M670 HydrophobicContact CG-CE 3.75Å; A614-M670 HydrophobicContact CB-CE 4.18Å; A614-M670 HydrophobicContact CB-SD 4.45Å; L617-M670 HydrophobicContact CD1-CE 3.68Å; V666-M670 WeakPolarHBondContact O-CB 3.42Å; V666-M670 PolarHBondContact O-N 2.95Å; M670-L674 WeakPolarHBondContact O-CB 3.14Å; M670-L674 PolarHBondContact O-N 3.48Å
671	L	94.4	Very high	90.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-71.4	-36.3	175.1	-179.9	56.9	0	0	0	112.2	I650 F651 L654 L667 L668 D669 L674 Y675 I681 L685 F705	I650-L671 HydrophobicContact CG2-CB 4.14Å; I650-L671 HydrophobicContact CG2-CD1 4.25Å; I650-L671 HydrophobicContact CG2-CD2 4.34Å; I650-L671 HydrophobicContact CG2-CG 4.47Å; F651-L671 HydrophobicContact CD1-CD1 4.45Å; F651-L671 HydrophobicContact CD1-CD2 4.07Å; F651-L671 HydrophobicContact CE1-CD1 3.87Å; F651-L671 HydrophobicContact CE1-CD2 4.12Å; L654-L671 HydrophobicContact CD1-CB 4.48Å; L654-L671 HydrophobicContact CD1-CD2 3.67Å; L667-L671 PolarHBondContact O-N 3.44Å; L667-L671 VanDerWaalsContact O-N 3.15Å; L668-L671 WeakPolarHBondContact O-CB 3.21Å; L668-L671 PolarHBondContact O-N 3.3Å; L668-L671 VanDerWaalsContact O-N 3.15Å; D669-L671 VanDerWaalsContact C-N 3.29Å; D669-L671 PolarHBondContact O-N 3.18Å; L671-L674 PolarHBondContact O-N 3.42Å; L671-Y675 PolarHBondContact O-N 3.32Å; L671-I681 HydrophobicContact CD1-CD1 3.57Å; L671-I681 HydrophobicContact CD1-CG1 4.01Å; L671-I681 HydrophobicContact CD1-CG2 4.38Å; L671-L685 HydrophobicContact CD2-CD2 4.2Å; L671-F705 HydrophobicContact CD2-CD2 3.96Å; L671-F705 HydrophobicContact CD2-CE2 4.34Å; L671-F705 HydrophobicContact CG-CD2 3.85Å; L671-F705 HydrophobicContact CG-CE2 3.84Å
672	A	94.3	Very high	91.3	Very high	3 Å²	3	31.1 Å²	31.1	3%	0.025	17%	0.168	C	C	.	.	H	α-helix	trans	-66.5	-38.9	173.8	0	0	0	0	0	112.7	L668 D669 Y675 Q676 A708	L668-A672 PolarHBondContact O-N 2.95Å; D669-A672 WeakPolarHBondContact O-CB 3.28Å; D669-A672 PolarHBondContact O-N 3.23Å; D669-A672 VanDerWaalsContact O-N 3.16Å; A672-Y675 PolarHBondContact O-N 3.29Å; A672-Q676 PolarHBondContact O-N 3.08Å; A672-A708 HydrophobicContact CB-CB 4.15Å; A672-A708 WeakPolarHBondContact CB-O 3.22Å
673	E	93.9	Very high	92.1	Very high	30 Å²	30	28.4 Å²	28.4	14%	0.14	15%	0.149	C	C	.	.	H	α-helix	trans	-68.7	-36.7	173.5	-175.3	57.9	-157.4	0	0	111.7	M610 S611 A614 D669 Q676 K677	M610-E673 HydrophobicContact CG-CB 4.43Å; M610-E673 HydrophobicContact CG-CG 4.42Å; M610-E673 HydrophobicContact SD-CB 4.38Å; S611-E673 WeakPolarHBondContact CB-OE1 3.49Å; S611-E673 PolarHBondContact OG-OE1 2.84Å; A614-E673 HydrophobicContact CB-CB 4.42Å; A614-E673 HydrophobicContact CB-CG 3.86Å; D669-E673 WeakPolarHBondContact O-CB 3.44Å; D669-E673 PolarHBondContact O-N 3.32Å; E673-Q676 WeakPolarHBondContact O-CB 3.3Å; E673-Q676 PolarHBondContact O-N 2.75Å; E673-Q676 PolarHBondContact OE2-NE2 2.83Å; E673-K677 PolarHBondContact O-N 3.43Å; E673-K677 VanDerWaalsContact OE1-CE 3.31Å; E673-K677 WeakPolarHBondContact OE1-CE 3.29Å; E673-K677 IonicContact OE1-NZ 2.68Å; E673-K677 PolarHBondContact OE1-NZ 3.47Å
674	L	93.4	Very high	92.7	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-66.1	-36.2	171.8	-176.3	54.9	0	0	0	112.5	A614 L617 A618 I650 M670 L671 Q676 K677 Q678 I681	A614-L674 HydrophobicContact CB-CB 4.32Å; A614-L674 HydrophobicContact CB-CD1 4.48Å; A614-L674 VanDerWaalsContact O-CD1 3.3Å; A614-L674 WeakPolarHBondContact O-CD1 3.04Å; L617-L674 HydrophobicContact CB-CD1 4.34Å; A618-L674 HydrophobicContact CB-CD1 3.96Å; I650-L674 HydrophobicContact CD1-CD2 3.88Å; M670-L674 WeakPolarHBondContact O-CB 3.14Å; M670-L674 PolarHBondContact O-N 3.48Å; L671-L674 PolarHBondContact O-N 3.42Å; L674-Q676 VanDerWaalsContact C-N 3.34Å; L674-Q676 PolarHBondContact O-N 3.39Å; L674-K677 PolarHBondContact O-N 2.85Å; L674-K677 VanDerWaalsContact O-N 3.13Å; L674-Q678 PolarHBondContact O-N 3.38Å; L674-I681 HydrophobicContact CD2-CD1 3.39Å; L674-I681 HydrophobicContact CG-CD1 3.71Å
675	Y	95.3	Very high	93	Very high	17 Å²	17	28.2 Å²	28.2	7%	0.067	15%	0.148	C	C	.	.	H	α-helix	trans	-62.8	-36.7	172.3	174.4	-108.9	0	0	0	112.6	L671 A672 K677 Q678 P679 I681 F705 T709 L711	L671-Y675 PolarHBondContact O-N 3.32Å; A672-Y675 PolarHBondContact O-N 3.29Å; Y675-K677 VanDerWaalsContact C-N 3.26Å; Y675-K677 PolarHBondContact O-N 2.93Å; Y675-Q678 CarbonylContact O-C 3.56Å; Y675-Q678 VanDerWaalsContact O-C 3.3Å; Y675-Q678 PolarHBondContact O-N 3.38Å; Y675-P679 HydrophobicContact CD2-CB 4.49Å; Y675-P679 WeakPolarHBondContact CD2-O 3.31Å; Y675-P679 HydrophobicContact CE2-CB 4.19Å; Y675-P679 VanDerWaalsContact CE2-O 3.26Å; Y675-P679 WeakPolarHBondContact CE2-O 3.2Å; Y675-P679 WeakPolarHBondContact O-CA 3.43Å; Y675-I681 HydrophobicContact CD2-CG2 4.02Å; Y675-I681 HydrophobicContact CG-CG2 4.42Å; Y675-F705 HydrophobicContact CD1-CZ 4.25Å; Y675-F705 AromaticContact CD2-CZ 3.87Å; Y675-F705 HydrophobicContact CD2-CZ 3.87Å; Y675-F705 HydrophobicContact CE2-CZ 4.48Å; Y675-F705 HydrophobicContact CG-CE2 4.37Å; Y675-F705 AromaticContact CG-CZ 3.74Å; Y675-F705 HydrophobicContact CG-CZ 3.74Å; Y675-T709 HydrophobicContact CD1-CG2 3.61Å; Y675-T709 HydrophobicContact CE1-CG2 3.88Å; Y675-T709 HydrophobicContact CG-CG2 4.41Å; Y675-L711 HydrophobicContact CE1-CD1 4.37Å
676	Q	92.9	Very high	93.4	Very high	107 Å²	107	25.4 Å²	25.4	50%	0.5	13%	0.128	S	C	.	.	H	α-helix	trans	-62.5	-30.3	172.4	-69.3	178.7	61.2	0	0	113.2	A672 E673 L674	A672-Q676 PolarHBondContact O-N 3.08Å; E673-Q676 WeakPolarHBondContact O-CB 3.3Å; E673-Q676 PolarHBondContact O-N 2.75Å; E673-Q676 PolarHBondContact OE2-NE2 2.83Å; L674-Q676 VanDerWaalsContact C-N 3.34Å; L674-Q676 PolarHBondContact O-N 3.39Å
677	K	92.8	Very high	93.7	Very high	77 Å²	77	23.9 Å²	23.9	34%	0.335	12%	0.119	S	C	.	.	H	α-helix	trans	-86.9	-32	176.6	-49	-37.1	-165.1	-150.8	0	112.6	S611 A614 S615 A618 E673 L674 Y675	S611-K677 PolarHBondContact OG-NZ 3.01Å; A614-K677 HydrophobicContact CB-CG 4.07Å; S615-K677 VanDerWaalsContact OG-CE 3.25Å; S615-K677 WeakPolarHBondContact OG-CE 3.25Å; A618-K677 HydrophobicContact CB-CB 3.9Å; E673-K677 PolarHBondContact O-N 3.43Å; E673-K677 VanDerWaalsContact OE1-CE 3.31Å; E673-K677 WeakPolarHBondContact OE1-CE 3.29Å; E673-K677 IonicContact OE1-NZ 2.68Å; E673-K677 PolarHBondContact OE1-NZ 3.47Å; L674-K677 PolarHBondContact O-N 2.85Å; L674-K677 VanDerWaalsContact O-N 3.13Å; Y675-K677 VanDerWaalsContact C-N 3.26Å; Y675-K677 PolarHBondContact O-N 2.93Å
678	Q	93	Very high	93.9	Very high	30 Å²	30	24.3 Å²	24.3	14%	0.14	12%	0.12	C	C	.	.			trans	-141.6	87.4	-174.2	179.4	52	-90.3	0	0	110.4	A618 F625 L674 Y675 K680 I681	A618-Q678 HydrophobicContact CB-CB 4.07Å; F625-Q678 HydrophobicContact CD1-CG 4.39Å; F625-Q678 HydrophobicContact CD2-CG 3.84Å; F625-Q678 HydrophobicContact CE1-CG 4.25Å; F625-Q678 HydrophobicContact CE2-CG 3.69Å; F625-Q678 HydrophobicContact CG-CG 4.19Å; F625-Q678 HydrophobicContact CZ-CG 3.9Å; L674-Q678 PolarHBondContact O-N 3.38Å; Y675-Q678 CarbonylContact O-C 3.56Å; Y675-Q678 VanDerWaalsContact O-C 3.3Å; Y675-Q678 PolarHBondContact O-N 3.38Å; Q678-K680 PolarHBondContact O-N 2.84Å; Q678-K680 VanDerWaalsContact O-N 3.12Å; Q678-I681 VanDerWaalsContact O-CG2 3.25Å; Q678-I681 WeakPolarHBondContact O-CG2 3.39Å; Q678-I681 PolarHBondContact O-N 2.92Å; Q678-I681 VanDerWaalsContact O-N 3.16Å
679	P	91.8	Very high	94	Very high	71 Å²	71	23.9 Å²	23.9	46%	0.461	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.7	-173.6	24.6	-34.4	0	0	0	113.2	Y675 I681 G682	Y675-P679 HydrophobicContact CD2-CB 4.49Å; Y675-P679 WeakPolarHBondContact CD2-O 3.31Å; Y675-P679 HydrophobicContact CE2-CB 4.19Å; Y675-P679 VanDerWaalsContact CE2-O 3.26Å; Y675-P679 WeakPolarHBondContact CE2-O 3.2Å; Y675-P679 WeakPolarHBondContact O-CA 3.43Å; P679-I681 PolarHBondContact O-N 3.03Å; P679-G682 PolarHBondContact O-N 3.5Å
680	K	93.4	Very high	94.1	Very high	47 Å²	47	22.4 Å²	22.4	20%	0.204	11%	0.108	C	C	.	.	H	α-helix	trans	-57.9	-19.4	177.2	-64.9	169.8	166.1	-90.2	0	113.5	F625 Q678 G682 Y683 H684 D728	F625-K680 HydrophobicContact CB-CB 4.23Å; F625-K680 HydrophobicContact CB-CD 3.86Å; F625-K680 HydrophobicContact CD1-CB 4.27Å; F625-K680 HydrophobicContact CG-CB 4.48Å; F625-K680 PolarHBondContact O-NZ 2.74Å; Q678-K680 PolarHBondContact O-N 2.84Å; Q678-K680 VanDerWaalsContact O-N 3.12Å; K680-G682 VanDerWaalsContact C-N 3.29Å; K680-G682 PolarHBondContact O-N 2.59Å; K680-Y683 HydrophobicContact CB-CE1 3.73Å; K680-Y683 HydrophobicContact CG-CE1 3.92Å; K680-Y683 WeakPolarHBondContact O-CD1 3.43Å; K680-H684 PolarHBondContact O-N 2.98Å; K680-H684 PolarHBondContact O-ND1 3.36Å; K680-D728 IonicContact NZ-OD1 3.54Å; K680-D728 PolarHBondContact NZ-OD1 3.15Å; K680-D728 IonicContact NZ-OD2 2.8Å; K680-D728 PolarHBondContact NZ-OD2 3.34Å
681	I	93.8	Very high	94.1	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-66.9	-26.5	-176.7	-159.5	165.4	0	0	0	113.5	F625 V647 F651 L671 L674 Y675 Q678 P679 H684 L685	F625-I681 HydrophobicContact CE1-CB 3.98Å; F625-I681 HydrophobicContact CE1-CD1 4.35Å; F625-I681 HydrophobicContact CE1-CG1 3.97Å; F625-I681 HydrophobicContact CZ-CB 4.42Å; F625-I681 HydrophobicContact CZ-CD1 4.22Å; F625-I681 HydrophobicContact CZ-CG1 4.34Å; V647-I681 HydrophobicContact CG2-CD1 4.24Å; F651-I681 HydrophobicContact CE1-CD1 4.23Å; F651-I681 HydrophobicContact CE1-CG1 3.87Å; F651-I681 HydrophobicContact CZ-CD1 4.26Å; F651-I681 HydrophobicContact CZ-CG1 3.63Å; L671-I681 HydrophobicContact CD1-CD1 3.57Å; L671-I681 HydrophobicContact CD1-CG1 4.01Å; L671-I681 HydrophobicContact CD1-CG2 4.38Å; L674-I681 HydrophobicContact CD2-CD1 3.39Å; L674-I681 HydrophobicContact CG-CD1 3.71Å; Y675-I681 HydrophobicContact CD2-CG2 4.02Å; Y675-I681 HydrophobicContact CG-CG2 4.42Å; Q678-I681 VanDerWaalsContact O-CG2 3.25Å; Q678-I681 WeakPolarHBondContact O-CG2 3.39Å; Q678-I681 PolarHBondContact O-N 2.92Å; Q678-I681 VanDerWaalsContact O-N 3.16Å; P679-I681 PolarHBondContact O-N 3.03Å; I681-H684 CarbonylContact O-C 3.52Å; I681-H684 WeakPolarHBondContact O-CB 3.34Å; I681-H684 PolarHBondContact O-N 3.43Å; I681-L685 PolarHBondContact O-N 2.87Å
682	G	95	Very high	94	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-69.5	-47.7	-178.5	0	0	0	0	0	112.6	P679 K680 H684 L685 L686 D721	P679-G682 PolarHBondContact O-N 3.5Å; K680-G682 VanDerWaalsContact C-N 3.29Å; K680-G682 PolarHBondContact O-N 2.59Å; G682-H684 VanDerWaalsContact C-N 3.26Å; G682-H684 PolarHBondContact O-N 3.08Å; G682-L685 WeakPolarHBondContact O-CB 3.41Å; G682-L685 PolarHBondContact O-N 2.8Å; G682-L685 VanDerWaalsContact O-N 3.07Å; G682-L686 PolarHBondContact O-N 2.78Å; G682-D721 VanDerWaalsContact C-CG 3.4Å; G682-D721 VanDerWaalsContact C-OD1 3.22Å; G682-D721 WeakPolarHBondContact CA-OD1 3.34Å; G682-D721 VanDerWaalsContact CA-OD2 3.26Å; G682-D721 WeakPolarHBondContact CA-OD2 3.19Å
683	Y	94.9	Very high	93.7	Very high	4 Å²	4	28 Å²	28	2%	0.016	13%	0.134	C	C	.	.	H	α-helix	trans	-69.2	-23.3	172	80.7	-103.4	0	0	0	113.1	K680 L686 Y687 D721 A724 C725 D728 L732	K680-Y683 HydrophobicContact CB-CE1 3.73Å; K680-Y683 HydrophobicContact CG-CE1 3.92Å; K680-Y683 WeakPolarHBondContact O-CD1 3.43Å; Y683-L686 PolarHBondContact O-N 3.17Å; Y683-Y687 PolarHBondContact O-N 3.23Å; Y683-D721 VanDerWaalsContact N-CG 3.25Å; Y683-D721 PolarHBondContact N-OD1 3.15Å; Y683-A724 HydrophobicContact CD1-CB 3.84Å; Y683-A724 HydrophobicContact CE1-CB 3.9Å; Y683-C725 HydrophobicContact CD1-CB 4.25Å; Y683-C725 HydrophobicContact CD2-CB 3.89Å; Y683-C725 HydrophobicContact CE2-CB 4.42Å; Y683-C725 HydrophobicContact CG-CB 3.81Å; Y683-D728 PolarHBondContact OH-OD2 3.2Å; Y683-D728 VanDerWaalsContact OH-OD2 3.07Å; Y683-L732 HydrophobicContact CD2-CD2 3.84Å; Y683-L732 HydrophobicContact CE2-CD2 3.82Å
684	H	94.5	Very high	93.3	Very high	13 Å²	13	28.4 Å²	28.4	6%	0.06	14%	0.143	C	C	.	.	H	α-helix	trans	-70.4	-32.5	168.4	-77.6	69.1	0	0	0	112.5	F625 F651 K680 I681 G682 Y687 Y688	F625-H684 AromaticContact CD1-CE1 3.87Å; F625-H684 AromaticContact CD1-ND1 3.99Å; F625-H684 AromaticContact CD1-NE2 3.88Å; F651-H684 HydrophobicContact CE2-CB 4.36Å; F651-H684 HydrophobicContact CZ-CB 4.28Å; K680-H684 PolarHBondContact O-N 2.98Å; K680-H684 PolarHBondContact O-ND1 3.36Å; I681-H684 CarbonylContact O-C 3.52Å; I681-H684 WeakPolarHBondContact O-CB 3.34Å; I681-H684 PolarHBondContact O-N 3.43Å; G682-H684 VanDerWaalsContact C-N 3.26Å; G682-H684 PolarHBondContact O-N 3.08Å; H684-Y687 PolarHBondContact O-N 3.48Å; H684-Y688 WeakPolarHBondContact O-CB 3.33Å; H684-Y688 PolarHBondContact O-N 2.89Å
685	L	95.5	Very high	93.1	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-65.6	-45.2	169.5	173.6	63.2	0	0	0	110.4	F651 L671 I681 G682 Y687 Y688 L689 Y702 F705	F651-L685 HydrophobicContact CB-CD1 4.2Å; F651-L685 HydrophobicContact CD1-CB 4.29Å; F651-L685 HydrophobicContact CD1-CD1 3.7Å; F651-L685 HydrophobicContact CE1-CB 3.87Å; F651-L685 HydrophobicContact CE1-CD1 4.17Å; F651-L685 HydrophobicContact CG-CD1 3.97Å; F651-L685 HydrophobicContact CZ-CB 4.06Å; L671-L685 HydrophobicContact CD2-CD2 4.2Å; I681-L685 PolarHBondContact O-N 2.87Å; G682-L685 WeakPolarHBondContact O-CB 3.41Å; G682-L685 PolarHBondContact O-N 2.8Å; G682-L685 VanDerWaalsContact O-N 3.07Å; L685-Y687 VanDerWaalsContact C-N 3.26Å; L685-Y687 PolarHBondContact O-N 2.96Å; L685-Y688 WeakPolarHBondContact O-CB 3.34Å; L685-Y688 PolarHBondContact O-N 3.16Å; L685-Y688 VanDerWaalsContact O-N 3.12Å; L685-L689 HydrophobicContact CD1-CD1 3.93Å; L685-L689 HydrophobicContact CD1-CD2 4.38Å; L685-L689 HydrophobicContact CD1-CG 3.9Å; L685-L689 HydrophobicContact CG-CD1 3.85Å; L685-L689 HydrophobicContact CG-CG 4.27Å; L685-L689 WeakPolarHBondContact O-CB 3.35Å; L685-L689 VanDerWaalsContact O-CG 3.25Å; L685-L689 WeakPolarHBondContact O-CG 3.1Å; L685-L689 PolarHBondContact O-N 3.31Å; L685-Y702 HydrophobicContact CD2-CD2 4.04Å; L685-Y702 HydrophobicContact CG-CD2 4.39Å; L685-F705 HydrophobicContact CD2-CB 3.85Å; L685-F705 HydrophobicContact CD2-CD1 3.81Å; L685-F705 HydrophobicContact CD2-CD2 4.36Å; L685-F705 HydrophobicContact CD2-CE1 4.48Å; L685-F705 HydrophobicContact CD2-CG 3.73Å
686	L	96.3	Very high	92.6	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.1	-38.9	173.2	-68.2	174.8	0	0	0	112.3	G682 Y683 K690 M699 Y702 L718 D721 M722 L736 I740 F744	G682-L686 PolarHBondContact O-N 2.78Å; Y683-L686 PolarHBondContact O-N 3.17Å; L686-K690 PolarHBondContact O-N 3.08Å; L686-M699 HydrophobicContact CD2-SD 3.92Å; L686-Y702 HydrophobicContact CD1-CD2 4.44Å; L686-Y702 HydrophobicContact CD1-CE2 3.99Å; L686-Y702 HydrophobicContact CD2-CD1 3.79Å; L686-Y702 HydrophobicContact CD2-CD2 3.41Å; L686-Y702 VanDerWaalsContact CD2-CD2 3.41Å; L686-Y702 HydrophobicContact CD2-CE1 4.16Å; L686-Y702 HydrophobicContact CD2-CE2 3.82Å; L686-Y702 HydrophobicContact CD2-CG 3.41Å; L686-Y702 VanDerWaalsContact CD2-CG 3.41Å; L686-Y702 HydrophobicContact CG-CD2 3.66Å; L686-Y702 HydrophobicContact CG-CE2 3.65Å; L686-Y702 HydrophobicContact CG-CG 4.19Å; L686-L718 HydrophobicContact CD1-CD1 3.83Å; L686-D721 HydrophobicContact CD1-CB 4.38Å; L686-M722 HydrophobicContact CD1-SD 4.32Å; L686-L736 HydrophobicContact CB-CD1 4.5Å; L686-L736 HydrophobicContact CB-CD2 4.25Å; L686-I740 HydrophobicContact CB-CD1 4.38Å; L686-I740 HydrophobicContact CD1-CD1 3.96Å; L686-I740 HydrophobicContact CD2-CD1 3.77Å; L686-I740 HydrophobicContact CG-CD1 4.26Å; L686-F744 HydrophobicContact CD2-CE2 4.25Å
687	Y	95.4	Very high	92.3	Very high	5 Å²	5	32.1 Å²	32.1	2%	0.02	18%	0.183	C	C	.	.	H	α-helix	trans	-65.4	-47.8	172.5	-179.6	-116.9	0	0	0	112.4	V629 L630 P631 L639 S642 V643 Y683 H684 L685 L689 K690 A691 L732 Y735	V629-Y687 HydrophobicContact CG1-CD1 3.7Å; V629-Y687 HydrophobicContact CG1-CE1 3.72Å; V629-Y687 HydrophobicContact CG1-CG 4.44Å; L630-Y687 HydrophobicContact CD1-CE2 3.66Å; P631-Y687 WeakPolarHBondContact CD-OH 3.37Å; L639-Y687 HydrophobicContact CD2-CE2 4.3Å; L639-Y687 WeakPolarHBondContact CD2-OH 3.32Å; S642-Y687 PolarHBondContact OG-OH 3.49Å; V643-Y687 HydrophobicContact CG1-CD1 3.96Å; V643-Y687 HydrophobicContact CG1-CE1 3.62Å; Y683-Y687 PolarHBondContact O-N 3.23Å; H684-Y687 PolarHBondContact O-N 3.48Å; L685-Y687 VanDerWaalsContact C-N 3.26Å; L685-Y687 PolarHBondContact O-N 2.96Å; Y687-L689 VanDerWaalsContact C-N 3.33Å; Y687-L689 PolarHBondContact O-N 3.43Å; Y687-K690 PolarHBondContact O-N 2.91Å; Y687-K690 VanDerWaalsContact O-N 3.1Å; Y687-A691 HydrophobicContact CD2-CB 4.21Å; Y687-A691 HydrophobicContact CE1-CB 4.2Å; Y687-A691 HydrophobicContact CE2-CB 3.81Å; Y687-A691 VanDerWaalsContact O-CB 3.26Å; Y687-A691 WeakPolarHBondContact O-CB 2.95Å; Y687-A691 PolarHBondContact O-N 2.89Å; Y687-L732 HydrophobicContact CD2-CD1 3.31Å; Y687-L732 HydrophobicContact CE2-CD1 3.89Å; Y687-L732 HydrophobicContact CG-CD1 3.88Å; Y687-Y735 HydrophobicContact CD2-CD1 4.27Å; Y687-Y735 HydrophobicContact CD2-CE1 4.14Å; Y687-Y735 HydrophobicContact CE2-CD1 4.11Å; Y687-Y735 AromaticContact CE2-CE1 3.8Å; Y687-Y735 HydrophobicContact CE2-CE1 3.8Å
688	Y	95.1	Very high	92.1	Very high	8 Å²	8	32.6 Å²	32.6	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-56.9	-46.5	177.7	-173.1	-90.1	0	0	0	112.1	V643 C648 F651 R652 V655 H684 L685 K690 A691 S692 A695	V643-Y688 HydrophobicContact CB-CD2 3.73Å; V643-Y688 HydrophobicContact CB-CE2 3.93Å; V643-Y688 HydrophobicContact CG1-CD2 4.08Å; V643-Y688 HydrophobicContact CG2-CD2 4.4Å; V643-Y688 HydrophobicContact CG2-CE2 4.23Å; C648-Y688 HydrophobicContact CB-CD2 3.89Å; C648-Y688 HydrophobicContact CB-CE2 3.92Å; F651-Y688 HydrophobicContact CB-CD1 3.52Å; F651-Y688 HydrophobicContact CB-CD2 4.12Å; F651-Y688 HydrophobicContact CB-CE1 3.8Å; F651-Y688 HydrophobicContact CB-CE2 4.39Å; F651-Y688 HydrophobicContact CB-CG 3.71Å; F651-Y688 HydrophobicContact CD2-CD1 4.29Å; F651-Y688 AromaticContact CD2-CD2 3.77Å; F651-Y688 HydrophobicContact CD2-CD2 3.77Å; F651-Y688 AromaticContact CD2-CG 3.6Å; F651-Y688 HydrophobicContact CD2-CG 3.6Å; F651-Y688 HydrophobicContact CG-CD1 4.32Å; F651-Y688 HydrophobicContact CG-CD2 4.47Å; F651-Y688 HydrophobicContact CG-CG 4.08Å; R652-Y688 WeakPolarHBondContact CA-OH 3.26Å; R652-Y688 WeakPolarHBondContact CB-OH 3.25Å; V655-Y688 HydrophobicContact CB-CE1 4.48Å; V655-Y688 HydrophobicContact CG2-CD1 4.4Å; V655-Y688 HydrophobicContact CG2-CE1 4.1Å; H684-Y688 WeakPolarHBondContact O-CB 3.33Å; H684-Y688 PolarHBondContact O-N 2.89Å; L685-Y688 WeakPolarHBondContact O-CB 3.34Å; L685-Y688 PolarHBondContact O-N 3.16Å; L685-Y688 VanDerWaalsContact O-N 3.12Å; Y688-K690 PolarHBondContact O-N 3.01Å; Y688-A691 PolarHBondContact O-N 3.02Å; Y688-S692 PolarHBondContact O-N 3.28Å; Y688-A695 HydrophobicContact CD1-CB 4.24Å; Y688-A695 HydrophobicContact CE1-CB 4.15Å
689	L	95.1	Very high	92	Very high	6 Å²	6	31.6 Å²	31.6	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-23.6	179	-68.9	172.8	0	0	0	113.4	V655 L685 Y687 A695 M699 L701	V655-L689 HydrophobicContact CG2-CD2 3.8Å; L685-L689 HydrophobicContact CD1-CD1 3.93Å; L685-L689 HydrophobicContact CD1-CD2 4.38Å; L685-L689 HydrophobicContact CD1-CG 3.9Å; L685-L689 HydrophobicContact CG-CD1 3.85Å; L685-L689 HydrophobicContact CG-CG 4.27Å; L685-L689 WeakPolarHBondContact O-CB 3.35Å; L685-L689 VanDerWaalsContact O-CG 3.25Å; L685-L689 WeakPolarHBondContact O-CG 3.1Å; L685-L689 PolarHBondContact O-N 3.31Å; Y687-L689 VanDerWaalsContact C-N 3.33Å; Y687-L689 PolarHBondContact O-N 3.43Å; L689-A695 HydrophobicContact CD2-CB 4.01Å; L689-M699 HydrophobicContact CB-CE 3.64Å; L689-M699 HydrophobicContact CB-SD 3.58Å; L689-M699 VanDerWaalsContact CB-SD 3.58Å; L689-M699 HydrophobicContact CD1-SD 3.93Å; L689-M699 HydrophobicContact CG-SD 4.41Å; L689-L701 HydrophobicContact CD2-CB 4.3Å; L689-L701 HydrophobicContact CD2-CD2 4.25Å
690	K	93.1	Very high	91.9	Very high	49 Å²	49	32.6 Å²	32.6	21%	0.213	18%	0.18	C	C	.	.	H	α-helix	trans	-91.3	-37.1	174.8	-175	-179.8	175.2	111.2	0	113.2	L686 Y687 Y688 M699 Y735 L736 S739	L686-K690 PolarHBondContact O-N 3.08Å; Y687-K690 PolarHBondContact O-N 2.91Å; Y687-K690 VanDerWaalsContact O-N 3.1Å; Y688-K690 PolarHBondContact O-N 3.01Å; K690-M699 HydrophobicContact CB-CE 4.09Å; K690-Y735 HydrophobicContact CD-CD1 3.78Å; K690-Y735 HydrophobicContact CD-CE1 3.45Å; K690-Y735 VanDerWaalsContact CD-CE1 3.45Å; K690-Y735 VanDerWaalsContact CE-CE1 3.41Å; K690-Y735 WeakPolarHBondContact CE-O 3.36Å; K690-Y735 HydrophobicContact CG-CE1 3.97Å; K690-Y735 PolarHBondContact NZ-O 2.78Å; K690-L736 HydrophobicContact CB-CD2 4.4Å; K690-L736 HydrophobicContact CD-CD2 4.05Å; K690-S739 PolarHBondContact NZ-OG 2.9Å
691	A	92.1	Very high	91.9	Very high	9 Å²	9	31.1 Å²	31.1	7%	0.074	17%	0.174	C	C	.	.	H	α-helix	trans	-92.1	-30.7	-167.6	0	0	0	0	0	114.2	L639 V643 Y687 Y688	L639-A691 HydrophobicContact CB-CB 4.34Å; L639-A691 HydrophobicContact CD2-CB 4.11Å; V643-A691 HydrophobicContact CG1-CB 3.89Å; Y687-A691 HydrophobicContact CD2-CB 4.21Å; Y687-A691 HydrophobicContact CE1-CB 4.2Å; Y687-A691 HydrophobicContact CE2-CB 3.81Å; Y687-A691 VanDerWaalsContact O-CB 3.26Å; Y687-A691 WeakPolarHBondContact O-CB 2.95Å; Y687-A691 PolarHBondContact O-N 2.89Å; Y688-A691 PolarHBondContact O-N 3.02Å
692	S	92.1	Very high	92	Very high	10 Å²	10	31 Å²	31	7%	0.07	17%	0.174	C	C	.	.			trans	-90.5	136.5	-177	-167.4	0	0	0	0	113.8	E640 Y688 A694 A695 N696	E640-S692 VanDerWaalsContact OE2-CA 3.27Å; E640-S692 WeakPolarHBondContact OE2-CA 3.22Å; E640-S692 WeakPolarHBondContact OE2-CB 3.43Å; E640-S692 PolarHBondContact OE2-OG 3.28Å; Y688-S692 PolarHBondContact O-N 3.28Å; S692-A694 PolarHBondContact O-N 2.95Å; S692-A694 PolarHBondContact OG-N 3.16Å; S692-A695 PolarHBondContact O-N 2.88Å; S692-A695 VanDerWaalsContact O-N 3.1Å; S692-N696 PolarHBondContact O-N 3.38Å
693	K	87.9	Confident	92	Very high	101 Å²	101	34.1 Å²	34.1	44%	0.439	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-64.3	-27.9	175	-67.6	167.8	-114.8	-151.7	0	112.3	E636 E640 A695 N696	E636-K693 HydrophobicContact CG-CD 4.42Å; E636-K693 WeakPolarHBondContact O-CE 3.42Å; E636-K693 PolarHBondContact O-NZ 3.08Å; E636-K693 VanDerWaalsContact OE1-CD 3.3Å; E636-K693 WeakPolarHBondContact OE1-CD 3.4Å; E636-K693 WeakPolarHBondContact OE1-CE 3.44Å; E636-K693 IonicContact OE1-NZ 3.22Å; E636-K693 PolarHBondContact OE1-NZ 3.38Å; E640-K693 VanDerWaalsContact CG-CE 3.4Å; E640-K693 WeakPolarHBondContact OE1-CB 2.78Å; E640-K693 WeakPolarHBondContact OE1-CE 3.32Å; E640-K693 VanDerWaalsContact OE1-CG 3.23Å; E640-K693 WeakPolarHBondContact OE1-CG 3.46Å; E640-K693 PolarHBondContact OE1-N 2.84Å; K693-A695 PolarHBondContact O-N 3.05Å; K693-N696 WeakPolarHBondContact O-CB 3.09Å; K693-N696 PolarHBondContact O-N 3.45Å
694	A	86.8	Confident	91.9	Very high	38 Å²	38	35.5 Å²	35.5	31%	0.314	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-64.5	-28.4	175.9	0	0	0	0	0	112.7	V655 S692 K698	V655-A694 HydrophobicContact CG1-CB 4.34Å; V655-A694 WeakPolarHBondContact CG1-O 3.47Å; S692-A694 PolarHBondContact O-N 2.95Å; S692-A694 PolarHBondContact OG-N 3.16Å; A694-K698 PolarHBondContact O-NZ 2.73Å
695	A	87.9	Confident	91.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-98.8	-2.6	-178.3	0	0	0	0	0	114.5	V655 Y688 L689 S692 K693 G697 K698	V655-A695 HydrophobicContact CG1-CB 3.88Å; V655-A695 HydrophobicContact CG2-CB 4.11Å; Y688-A695 HydrophobicContact CD1-CB 4.24Å; Y688-A695 HydrophobicContact CE1-CB 4.15Å; L689-A695 HydrophobicContact CD2-CB 4.01Å; S692-A695 PolarHBondContact O-N 2.88Å; S692-A695 VanDerWaalsContact O-N 3.1Å; K693-A695 PolarHBondContact O-N 3.05Å; A695-G697 PolarHBondContact O-N 3.35Å; A695-G697 VanDerWaalsContact O-N 3.16Å; A695-K698 WeakPolarHBondContact O-CB 3.39Å; A695-K698 PolarHBondContact O-N 2.88Å
696	N	86.4	Confident	91.9	Very high	138 Å²	138	34.9 Å²	34.9	74%	0.738	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	120.6	-176.8	-174.5	11.4	0	0	0	111.6	S692 K693	S692-N696 PolarHBondContact O-N 3.38Å; K693-N696 WeakPolarHBondContact O-CB 3.09Å; K693-N696 PolarHBondContact O-N 3.45Å
697	G	84.6	Confident	91.8	Very high	67 Å²	67	40.3 Å²	40.3	69%	0.691	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.5	12.7	-176.9	0	0	0	0	0	115.9	A695	A695-G697 PolarHBondContact O-N 3.35Å; A695-G697 VanDerWaalsContact O-N 3.16Å
698	K	89.4	Confident	91.6	Very high	86 Å²	86	41.6 Å²	41.6	37%	0.374	23%	0.233	S	C	.	.			trans	-114.9	25.2	-178.2	-60.8	172.5	179.4	167	0	114.1	V655 A694 A695 M700 L701	V655-K698 HydrophobicContact CG1-CD 3.94Å; V655-K698 PolarHBondContact O-NZ 3.43Å; A694-K698 PolarHBondContact O-NZ 2.73Å; A695-K698 WeakPolarHBondContact O-CB 3.39Å; A695-K698 PolarHBondContact O-N 2.88Å; K698-M700 PolarHBondContact O-N 3.29Å; K698-M700 VanDerWaalsContact O-N 3.09Å; K698-L701 WeakPolarHBondContact O-CB 3.08Å; K698-L701 PolarHBondContact O-N 3.5Å
699	M	91.4	Very high	91.4	Very high	9 Å²	9	41.5 Å²	41.5	4%	0.044	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-28.9	-178.5	-167.3	62.8	62.9	0	0	112.9	L686 L689 K690 L701 Y702 E743 F744	L686-M699 HydrophobicContact CD2-SD 3.92Å; L689-M699 HydrophobicContact CB-CE 3.64Å; L689-M699 HydrophobicContact CB-SD 3.58Å; L689-M699 VanDerWaalsContact CB-SD 3.58Å; L689-M699 HydrophobicContact CD1-SD 3.93Å; L689-M699 HydrophobicContact CG-SD 4.41Å; K690-M699 HydrophobicContact CB-CE 4.09Å; M699-L701 PolarHBondContact O-N 3.17Å; M699-L701 VanDerWaalsContact O-N 3.08Å; M699-Y702 WeakPolarHBondContact O-CB 3.37Å; M699-Y702 PolarHBondContact O-N 2.94Å; M699-E743 HydrophobicContact CB-CB 4.02Å; M699-E743 HydrophobicContact CB-CG 3.74Å; M699-E743 HydrophobicContact CG-CB 3.81Å; M699-E743 HydrophobicContact CG-CG 3.8Å; M699-F744 HydrophobicContact CG-CE2 3.77Å; M699-F744 HydrophobicContact CG-CZ 3.78Å; M699-F744 HydrophobicContact SD-CE2 4.46Å
700	M	90	Very high	91.1	Very high	93 Å²	93	45.5 Å²	45.5	46%	0.458	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-20.5	175.7	-60.4	-52.6	-57.1	0	0	114.7	K698 Y702 E703 F744	K698-M700 PolarHBondContact O-N 3.29Å; K698-M700 VanDerWaalsContact O-N 3.09Å; M700-Y702 PolarHBondContact O-N 3.03Å; M700-Y702 VanDerWaalsContact O-N 3.16Å; M700-E703 HydrophobicContact CE-CB 4.46Å; M700-E703 WeakPolarHBondContact CE-OE2 3.1Å; M700-E703 WeakPolarHBondContact O-CB 3.35Å; M700-E703 PolarHBondContact O-N 3.29Å; M700-F744 HydrophobicContact SD-CE1 4.28Å
701	L	93.3	Very high	90.9	Very high	15 Å²	15	46.3 Å²	46.3	8%	0.079	27%	0.273	C	S	.	.	H	α-helix	trans	-57.5	-27.8	172.4	179.8	62.1	0	0	0	112.4	L654 V655 F664 L689 K698 M699 E703 S704 F705	L654-L701 HydrophobicContact CB-CD2 4.05Å; V655-L701 HydrophobicContact CB-CD2 4.48Å; V655-L701 HydrophobicContact CG2-CD2 3.52Å; F664-L701 HydrophobicContact CE2-CD1 3.79Å; F664-L701 HydrophobicContact CZ-CD1 3.54Å; L689-L701 HydrophobicContact CD2-CB 4.3Å; L689-L701 HydrophobicContact CD2-CD2 4.25Å; K698-L701 WeakPolarHBondContact O-CB 3.08Å; K698-L701 PolarHBondContact O-N 3.5Å; M699-L701 PolarHBondContact O-N 3.17Å; M699-L701 VanDerWaalsContact O-N 3.08Å; L701-E703 VanDerWaalsContact C-N 3.27Å; L701-E703 PolarHBondContact O-N 3.47Å; L701-S704 PolarHBondContact O-N 3.41Å; L701-F705 PolarHBondContact O-N 2.86Å
702	Y	95.9	Very high	90.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.1	-27.3	174	-177.6	-94	0	0	0	112.8	L685 L686 M699 M700 F705 A706 L714 C717 L718 D721 F744	L685-Y702 HydrophobicContact CD2-CD2 4.04Å; L685-Y702 HydrophobicContact CG-CD2 4.39Å; L686-Y702 HydrophobicContact CD1-CD2 4.44Å; L686-Y702 HydrophobicContact CD1-CE2 3.99Å; L686-Y702 HydrophobicContact CD2-CD1 3.79Å; L686-Y702 HydrophobicContact CD2-CD2 3.41Å; L686-Y702 VanDerWaalsContact CD2-CD2 3.41Å; L686-Y702 HydrophobicContact CD2-CE1 4.16Å; L686-Y702 HydrophobicContact CD2-CE2 3.82Å; L686-Y702 HydrophobicContact CD2-CG 3.41Å; L686-Y702 VanDerWaalsContact CD2-CG 3.41Å; L686-Y702 HydrophobicContact CG-CD2 3.66Å; L686-Y702 HydrophobicContact CG-CE2 3.65Å; L686-Y702 HydrophobicContact CG-CG 4.19Å; M699-Y702 WeakPolarHBondContact O-CB 3.37Å; M699-Y702 PolarHBondContact O-N 2.94Å; M700-Y702 PolarHBondContact O-N 3.03Å; M700-Y702 VanDerWaalsContact O-N 3.16Å; Y702-F705 AromaticContact CD2-CD1 3.78Å; Y702-F705 HydrophobicContact CD2-CD1 3.78Å; Y702-F705 HydrophobicContact CD2-CE1 4.32Å; Y702-F705 AromaticContact CE2-CD1 3.74Å; Y702-F705 HydrophobicContact CE2-CD1 3.74Å; Y702-F705 AromaticContact CE2-CE1 3.85Å; Y702-F705 HydrophobicContact CE2-CE1 3.85Å; Y702-A706 WeakPolarHBondContact O-CB 3.17Å; Y702-A706 PolarHBondContact O-N 2.87Å; Y702-L714 HydrophobicContact CD1-CD1 3.69Å; Y702-L714 HydrophobicContact CE1-CD1 3.75Å; Y702-C717 VanDerWaalsContact OH-C 3.3Å; Y702-C717 PolarHBondContact OH-O 2.98Å; Y702-C717 PolarHBondContact OH-SG 3.16Å; Y702-L718 HydrophobicContact CE1-CB 4.11Å; Y702-L718 HydrophobicContact CE1-CD1 3.87Å; Y702-L718 WeakPolarHBondContact OH-CA 3.33Å; Y702-L718 PolarHBondContact OH-N 3.19Å; Y702-D721 WeakPolarHBondContact CE2-OD2 3.36Å; Y702-D721 PolarHBondContact OH-OD2 3.33Å; Y702-F744 HydrophobicContact CD1-CE2 4.12Å; Y702-F744 HydrophobicContact CD1-CZ 4.01Å; Y702-F744 HydrophobicContact CG-CZ 4.5Å
703	E	94.3	Very high	90.6	Very high	65 Å²	65	50.5 Å²	50.5	30%	0.304	31%	0.305	S	S	.	.	H	α-helix	trans	-68.3	-44.9	172.4	-174.9	178.5	172.8	0	0	111	M700 L701 F705 A706 Q707 L714	M700-E703 HydrophobicContact CE-CB 4.46Å; M700-E703 WeakPolarHBondContact CE-OE2 3.1Å; M700-E703 WeakPolarHBondContact O-CB 3.35Å; M700-E703 PolarHBondContact O-N 3.29Å; L701-E703 VanDerWaalsContact C-N 3.27Å; L701-E703 PolarHBondContact O-N 3.47Å; E703-F705 VanDerWaalsContact C-N 3.32Å; E703-F705 PolarHBondContact O-N 3.07Å; E703-A706 PolarHBondContact O-N 2.94Å; E703-Q707 VanDerWaalsContact O-CG 3.32Å; E703-Q707 WeakPolarHBondContact O-CG 3.28Å; E703-Q707 PolarHBondContact O-N 3.19Å; E703-Q707 PolarHBondContact OE1-NE2 3.31Å; E703-Q707 VanDerWaalsContact OE1-NE2 3.07Å; E703-L714 HydrophobicContact CB-CD1 4.44Å; E703-L714 HydrophobicContact CB-CD2 4.38Å; E703-L714 HydrophobicContact CG-CB 4.47Å; E703-L714 HydrophobicContact CG-CD2 4.11Å
704	S	92.6	Very high	90.9	Very high	32 Å²	32	46.9 Å²	46.9	22%	0.224	29%	0.29	C	S	.	.	H	α-helix	trans	-58.2	-44.6	174	-45.2	0	0	0	0	111.4	L701 Q707 A708	L701-S704 PolarHBondContact O-N 3.41Å; S704-Q707 PolarHBondContact O-N 3.45Å; S704-A708 PolarHBondContact O-N 3.04Å; S704-A708 VanDerWaalsContact O-N 3.08Å
705	F	95.2	Very high	91.2	Very high	1 Å²	1	47.4 Å²	47.4	0%	0.004	29%	0.286	C	S	.	.	H	α-helix	trans	-59.5	-50.8	174.1	163.3	-106.2	0	0	0	111.9	L668 L671 Y675 L685 L701 Y702 E703 Q707 A708 T709	L668-F705 HydrophobicContact CD1-CB 4.08Å; L671-F705 HydrophobicContact CD2-CD2 3.96Å; L671-F705 HydrophobicContact CD2-CE2 4.34Å; L671-F705 HydrophobicContact CG-CD2 3.85Å; L671-F705 HydrophobicContact CG-CE2 3.84Å; Y675-F705 HydrophobicContact CD1-CZ 4.25Å; Y675-F705 AromaticContact CD2-CZ 3.87Å; Y675-F705 HydrophobicContact CD2-CZ 3.87Å; Y675-F705 HydrophobicContact CE2-CZ 4.48Å; Y675-F705 HydrophobicContact CG-CE2 4.37Å; Y675-F705 AromaticContact CG-CZ 3.74Å; Y675-F705 HydrophobicContact CG-CZ 3.74Å; L685-F705 HydrophobicContact CD2-CB 3.85Å; L685-F705 HydrophobicContact CD2-CD1 3.81Å; L685-F705 HydrophobicContact CD2-CD2 4.36Å; L685-F705 HydrophobicContact CD2-CE1 4.48Å; L685-F705 HydrophobicContact CD2-CG 3.73Å; L701-F705 PolarHBondContact O-N 2.86Å; Y702-F705 AromaticContact CD2-CD1 3.78Å; Y702-F705 HydrophobicContact CD2-CD1 3.78Å; Y702-F705 HydrophobicContact CD2-CE1 4.32Å; Y702-F705 AromaticContact CE2-CD1 3.74Å; Y702-F705 HydrophobicContact CE2-CD1 3.74Å; Y702-F705 AromaticContact CE2-CE1 3.85Å; Y702-F705 HydrophobicContact CE2-CE1 3.85Å; E703-F705 VanDerWaalsContact C-N 3.32Å; E703-F705 PolarHBondContact O-N 3.07Å; F705-Q707 VanDerWaalsContact C-N 3.29Å; F705-Q707 PolarHBondContact O-N 3.36Å; F705-A708 WeakPolarHBondContact O-CB 3.33Å; F705-A708 PolarHBondContact O-N 3.31Å; F705-T709 HydrophobicContact CD2-CG2 4.37Å; F705-T709 HydrophobicContact CE1-CG2 4.19Å; F705-T709 HydrophobicContact CE2-CG2 3.94Å; F705-T709 HydrophobicContact CZ-CG2 3.85Å; F705-T709 WeakPolarHBondContact O-CG2 3.23Å; F705-T709 PolarHBondContact O-N 2.83Å
706	A	95.1	Very high	91.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-39.7	-179.8	0	0	0	0	0	112.5	Y702 E703 A708 T709 L714 C717	Y702-A706 WeakPolarHBondContact O-CB 3.17Å; Y702-A706 PolarHBondContact O-N 2.87Å; E703-A706 PolarHBondContact O-N 2.94Å; A706-A708 VanDerWaalsContact C-N 3.34Å; A706-T709 PolarHBondContact O-N 2.99Å; A706-T709 PolarHBondContact O-OG1 3.21Å; A706-L714 HydrophobicContact CB-CB 4.47Å; A706-L714 HydrophobicContact CB-CD1 4.24Å; A706-C717 HydrophobicContact CB-CB 3.71Å
707	Q	93.1	Very high	91.9	Very high	114 Å²	114	43.6 Å²	43.6	53%	0.533	27%	0.268	S	S	.	.	H	α-helix	trans	-66	-31	174.4	-70	178.6	20.2	0	0	113.2	E703 S704 F705	E703-Q707 VanDerWaalsContact O-CG 3.32Å; E703-Q707 WeakPolarHBondContact O-CG 3.28Å; E703-Q707 PolarHBondContact O-N 3.19Å; E703-Q707 PolarHBondContact OE1-NE2 3.31Å; E703-Q707 VanDerWaalsContact OE1-NE2 3.07Å; S704-Q707 PolarHBondContact O-N 3.45Å; F705-Q707 VanDerWaalsContact C-N 3.29Å; F705-Q707 PolarHBondContact O-N 3.36Å
708	A	91.3	Very high	92.5	Very high	32 Å²	32	40.4 Å²	40.4	26%	0.264	24%	0.235	S	C	.	.	H	α-helix	trans	-78.9	-22	174.9	0	0	0	0	0	113.4	L668 A672 S704 F705 A706	L668-A708 HydrophobicContact CD2-CB 4.08Å; L668-A708 HydrophobicContact CG-CB 3.97Å; A672-A708 HydrophobicContact CB-CB 4.15Å; A672-A708 WeakPolarHBondContact CB-O 3.22Å; S704-A708 PolarHBondContact O-N 3.04Å; S704-A708 VanDerWaalsContact O-N 3.08Å; F705-A708 WeakPolarHBondContact O-CB 3.33Å; F705-A708 PolarHBondContact O-N 3.31Å; A706-A708 VanDerWaalsContact C-N 3.34Å
709	T	92.7	Very high	92.8	Very high	7 Å²	7	36.9 Å²	36.9	4%	0.043	22%	0.22	C	C	.	.	S	Bend	trans	-65.9	157.6	173.5	75	0	0	0	0	112.2	Y675 F705 A706 L711 G712	Y675-T709 HydrophobicContact CD1-CG2 3.61Å; Y675-T709 HydrophobicContact CE1-CG2 3.88Å; Y675-T709 HydrophobicContact CG-CG2 4.41Å; F705-T709 HydrophobicContact CD2-CG2 4.37Å; F705-T709 HydrophobicContact CE1-CG2 4.19Å; F705-T709 HydrophobicContact CE2-CG2 3.94Å; F705-T709 HydrophobicContact CZ-CG2 3.85Å; F705-T709 WeakPolarHBondContact O-CG2 3.23Å; F705-T709 PolarHBondContact O-N 2.83Å; A706-T709 PolarHBondContact O-N 2.99Å; A706-T709 PolarHBondContact O-OG1 3.21Å; T709-L711 PolarHBondContact O-N 3.18Å; T709-L711 WeakPolarHBondContact OG1-CB 3.44Å; T709-L711 PolarHBondContact OG1-N 2.88Å; T709-G712 PolarHBondContact O-N 3.37Å
710	A	87.8	Confident	92.9	Very high	89 Å²	89	41.1 Å²	41.1	74%	0.736	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-4.4	173.1	0	0	0	0	0	115
711	L	88.3	Confident	93.2	Very high	67 Å²	67	36.8 Å²	36.8	35%	0.351	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-37.7	169.5	-57.1	173.3	0	0	0	111.2	Y675 T709 D713 T716 C717 M720	Y675-L711 HydrophobicContact CE1-CD1 4.37Å; T709-L711 PolarHBondContact O-N 3.18Å; T709-L711 WeakPolarHBondContact OG1-CB 3.44Å; T709-L711 PolarHBondContact OG1-N 2.88Å; L711-D713 PolarHBondContact O-N 2.72Å; L711-T716 HydrophobicContact CD1-CG2 4.39Å; L711-T716 HydrophobicContact CD2-CG2 4.28Å; L711-C717 HydrophobicContact CD1-CB 3.85Å; L711-M720 HydrophobicContact CD1-SD 3.86Å; L711-M720 HydrophobicContact CD2-SD 4.12Å
712	G	87.4	Confident	93.3	Very high	48 Å²	48	36 Å²	36	50%	0.495	22%	0.216	S	C	.	.			trans	68.9	6.4	-179.8	0	0	0	0	0	115.6	T709	T709-G712 PolarHBondContact O-N 3.37Å
713	D	91.4	Very high	93.3	Very high	59 Å²	59	39.7 Å²	39.7	32%	0.316	23%	0.232	S	C	.	.			trans	-140.3	139.7	-178.7	95.4	82.9	0	0	0	113.3	L711 H715 T716 C717	L711-D713 PolarHBondContact O-N 2.72Å; D713-H715 VanDerWaalsContact C-N 3.34Å; D713-H715 PolarHBondContact O-N 3.48Å; D713-H715 WeakPolarHBondContact OD1-CA 3.45Å; D713-H715 VanDerWaalsContact OD1-CB 3.29Å; D713-H715 WeakPolarHBondContact OD1-CB 3.31Å; D713-H715 PolarHBondContact OD1-N 3.29Å; D713-T716 PolarHBondContact OD1-N 3.39Å; D713-T716 PolarHBondContact OD1-OG1 3.28Å; D713-T716 WeakPolarHBondContact OD2-CB 3.29Å; D713-T716 PolarHBondContact OD2-OG1 2.76Å; D713-C717 WeakPolarHBondContact O-CB 3.44Å; D713-C717 PolarHBondContact O-N 3.23Å
714	L	94.2	Very high	93.2	Very high	24 Å²	24	37.8 Å²	37.8	13%	0.126	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-34.2	-178.9	173.5	62.4	0	0	0	112.9	Y702 E703 A706 L718 F744 E747	Y702-L714 HydrophobicContact CD1-CD1 3.69Å; Y702-L714 HydrophobicContact CE1-CD1 3.75Å; E703-L714 HydrophobicContact CB-CD1 4.44Å; E703-L714 HydrophobicContact CB-CD2 4.38Å; E703-L714 HydrophobicContact CG-CB 4.47Å; E703-L714 HydrophobicContact CG-CD2 4.11Å; A706-L714 HydrophobicContact CB-CB 4.47Å; A706-L714 HydrophobicContact CB-CD1 4.24Å; L714-L718 WeakPolarHBondContact O-CB 3.4Å; L714-L718 PolarHBondContact O-N 2.89Å; L714-F744 HydrophobicContact CD1-CD1 4.44Å; L714-F744 HydrophobicContact CD1-CE1 4.31Å; L714-F744 HydrophobicContact CD2-CD1 3.89Å; L714-F744 HydrophobicContact CD2-CE1 4.23Å; L714-E747 HydrophobicContact CD2-CG 4.26Å; L714-E747 HydrophobicContact CG-CG 4.49Å
715	H	93.8	Very high	93.2	Very high	50 Å²	50	36.3 Å²	36.3	23%	0.231	22%	0.216	C	C	.	.	H	α-helix	trans	-70	-53.8	-172	-167.4	97.9	0	0	0	111	D713 C717 L718 M719 E747	D713-H715 VanDerWaalsContact C-N 3.34Å; D713-H715 PolarHBondContact O-N 3.48Å; D713-H715 WeakPolarHBondContact OD1-CA 3.45Å; D713-H715 VanDerWaalsContact OD1-CB 3.29Å; D713-H715 WeakPolarHBondContact OD1-CB 3.31Å; D713-H715 PolarHBondContact OD1-N 3.29Å; H715-C717 VanDerWaalsContact C-N 3.34Å; H715-C717 PolarHBondContact O-N 3.39Å; H715-L718 PolarHBondContact O-N 2.85Å; H715-M719 WeakPolarHBondContact O-CG 3.45Å; H715-M719 PolarHBondContact O-N 3.27Å; H715-E747 IonicContact CE1-OE2 2.73Å; H715-E747 IonicContact CG-OE2 3.07Å; H715-E747 IonicContact ND1-OE2 3.36Å; H715-E747 PolarHBondContact ND1-OE2 2.72Å
716	T	92.9	Very high	93.1	Very high	57 Å²	57	37.1 Å²	37.1	35%	0.35	22%	0.22	S	C	.	.	H	α-helix	trans	-63.5	-42.2	179.7	-49.9	0	0	0	0	110.7	L711 D713 M719 M720	L711-T716 HydrophobicContact CD1-CG2 4.39Å; L711-T716 HydrophobicContact CD2-CG2 4.28Å; D713-T716 PolarHBondContact OD1-N 3.39Å; D713-T716 PolarHBondContact OD1-OG1 3.28Å; D713-T716 WeakPolarHBondContact OD2-CB 3.29Å; D713-T716 PolarHBondContact OD2-OG1 2.76Å; T716-M719 PolarHBondContact O-N 3.3Å; T716-M720 HydrophobicContact CG2-CG 4.46Å; T716-M720 HydrophobicContact CG2-SD 4.06Å; T716-M720 WeakPolarHBondContact O-CB 3.38Å; T716-M720 VanDerWaalsContact O-CG 3.31Å; T716-M720 WeakPolarHBondContact O-CG 3.47Å; T716-M720 PolarHBondContact O-N 3.4Å
717	C	95.8	Very high	92.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61	-49.9	177.1	-161.5	0	0	0	0	111.3	Y702 A706 L711 D713 H715 M719 M720 D721	Y702-C717 VanDerWaalsContact OH-C 3.3Å; Y702-C717 PolarHBondContact OH-O 2.98Å; Y702-C717 PolarHBondContact OH-SG 3.16Å; A706-C717 HydrophobicContact CB-CB 3.71Å; L711-C717 HydrophobicContact CD1-CB 3.85Å; D713-C717 WeakPolarHBondContact O-CB 3.44Å; D713-C717 PolarHBondContact O-N 3.23Å; H715-C717 VanDerWaalsContact C-N 3.34Å; H715-C717 PolarHBondContact O-N 3.39Å; C717-M719 PolarHBondContact O-N 3.24Å; C717-M720 PolarHBondContact O-N 2.87Å; C717-D721 WeakPolarHBondContact O-CB 3.46Å; C717-D721 PolarHBondContact O-N 2.94Å
718	L	95.9	Very high	92.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.3	-39.3	179.7	-174.7	62.8	0	0	0	112.4	L686 Y702 L714 H715 M722 I740 F744 T748	L686-L718 HydrophobicContact CD1-CD1 3.83Å; Y702-L718 HydrophobicContact CE1-CB 4.11Å; Y702-L718 HydrophobicContact CE1-CD1 3.87Å; Y702-L718 WeakPolarHBondContact OH-CA 3.33Å; Y702-L718 PolarHBondContact OH-N 3.19Å; L714-L718 WeakPolarHBondContact O-CB 3.4Å; L714-L718 PolarHBondContact O-N 2.89Å; H715-L718 PolarHBondContact O-N 2.85Å; L718-M722 HydrophobicContact CD1-CG 4.05Å; L718-M722 HydrophobicContact CG-CG 4.4Å; L718-M722 VanDerWaalsContact O-CB 3.28Å; L718-M722 WeakPolarHBondContact O-CB 3.38Å; L718-M722 WeakPolarHBondContact O-CG 3.28Å; L718-M722 PolarHBondContact O-N 3.45Å; L718-I740 HydrophobicContact CD1-CD1 4.41Å; L718-I740 HydrophobicContact CD1-CG2 3.94Å; L718-I740 HydrophobicContact CD2-CG2 4.06Å; L718-I740 HydrophobicContact CG-CG2 4.35Å; L718-F744 HydrophobicContact CD1-CD2 4.33Å; L718-F744 HydrophobicContact CD2-CB 3.93Å; L718-F744 HydrophobicContact CD2-CD2 3.93Å; L718-F744 HydrophobicContact CD2-CG 4.12Å; L718-T748 HydrophobicContact CD2-CG2 4.17Å
719	M	95.8	Very high	92.3	Very high	13 Å²	13	41.2 Å²	41.2	6%	0.064	24%	0.237	C	C	.	.	H	α-helix	trans	-69.1	-39	176.9	-68.7	-51.1	100.5	0	0	111.5	H715 T716 C717 K723 E753 L754 M757	H715-M719 WeakPolarHBondContact O-CG 3.45Å; H715-M719 PolarHBondContact O-N 3.27Å; T716-M719 PolarHBondContact O-N 3.3Å; C717-M719 PolarHBondContact O-N 3.24Å; M719-K723 WeakPolarHBondContact O-CB 3.19Å; M719-K723 PolarHBondContact O-N 3.07Å; M719-E753 HydrophobicContact SD-CG 4.23Å; M719-L754 HydrophobicContact CE-CB 4.12Å; M719-L754 HydrophobicContact CE-CD2 4.38Å; M719-L754 HydrophobicContact SD-CB 3.98Å; M719-M757 HydrophobicContact SD-CE 4.48Å
720	M	95.1	Very high	92.2	Very high	97 Å²	97	42.8 Å²	42.8	48%	0.478	25%	0.246	S	C	.	.	H	α-helix	trans	-65.7	-46.1	175.4	-75.4	-179.7	68.4	0	0	112.5	L711 T716 C717 K723 A724	L711-M720 HydrophobicContact CD1-SD 3.86Å; L711-M720 HydrophobicContact CD2-SD 4.12Å; T716-M720 HydrophobicContact CG2-CG 4.46Å; T716-M720 HydrophobicContact CG2-SD 4.06Å; T716-M720 WeakPolarHBondContact O-CB 3.38Å; T716-M720 VanDerWaalsContact O-CG 3.31Å; T716-M720 WeakPolarHBondContact O-CG 3.47Å; T716-M720 PolarHBondContact O-N 3.4Å; C717-M720 PolarHBondContact O-N 2.87Å; M720-K723 WeakPolarHBondContact O-CB 3.42Å; M720-K723 PolarHBondContact O-N 2.9Å; M720-A724 PolarHBondContact O-N 3.49Å
721	D	96	Very high	92.3	Very high	2 Å²	2	42 Å²	42	1%	0.011	22%	0.224	C	C	.	.	H	α-helix	trans	-65.1	-45	178.7	-92.3	-42.4	0	0	0	112.4	G682 Y683 L686 Y702 C717 K723 A724 C725	G682-D721 VanDerWaalsContact C-CG 3.4Å; G682-D721 VanDerWaalsContact C-OD1 3.22Å; G682-D721 WeakPolarHBondContact CA-OD1 3.34Å; G682-D721 VanDerWaalsContact CA-OD2 3.26Å; G682-D721 WeakPolarHBondContact CA-OD2 3.19Å; Y683-D721 VanDerWaalsContact N-CG 3.25Å; Y683-D721 PolarHBondContact N-OD1 3.15Å; L686-D721 HydrophobicContact CD1-CB 4.38Å; Y702-D721 WeakPolarHBondContact CE2-OD2 3.36Å; Y702-D721 PolarHBondContact OH-OD2 3.33Å; C717-D721 WeakPolarHBondContact O-CB 3.46Å; C717-D721 PolarHBondContact O-N 2.94Å; D721-K723 VanDerWaalsContact C-N 3.25Å; D721-K723 PolarHBondContact O-N 2.85Å; D721-A724 PolarHBondContact O-N 3.36Å; D721-C725 WeakPolarHBondContact O-CB 3.37Å; D721-C725 PolarHBondContact O-N 2.98Å
722	M	95.8	Very high	92.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.2	-31.7	175.7	-67.3	-65.4	-76	0	0	111.3	L686 L718 C725 Q726 L733 L736 I740 L754 M757	L686-M722 HydrophobicContact CD1-SD 4.32Å; L718-M722 HydrophobicContact CD1-CG 4.05Å; L718-M722 HydrophobicContact CG-CG 4.4Å; L718-M722 VanDerWaalsContact O-CB 3.28Å; L718-M722 WeakPolarHBondContact O-CB 3.38Å; L718-M722 WeakPolarHBondContact O-CG 3.28Å; L718-M722 PolarHBondContact O-N 3.45Å; M722-C725 PolarHBondContact O-N 3.12Å; M722-Q726 VanDerWaalsContact O-CB 3.31Å; M722-Q726 WeakPolarHBondContact O-CB 3.22Å; M722-Q726 PolarHBondContact O-N 3.47Å; M722-L733 HydrophobicContact CE-CD1 3.64Å; M722-L733 HydrophobicContact SD-CD1 4.41Å; M722-L736 HydrophobicContact SD-CD1 4.47Å; M722-I740 HydrophobicContact CE-CB 4.31Å; M722-I740 HydrophobicContact CE-CG1 3.97Å; M722-I740 HydrophobicContact CE-CG2 4.22Å; M722-I740 HydrophobicContact SD-CD1 4.49Å; M722-I740 HydrophobicContact SD-CG1 3.95Å; M722-I740 HydrophobicContact SD-CG2 4.39Å; M722-L754 HydrophobicContact CB-CD1 3.79Å; M722-L754 HydrophobicContact CE-CD1 3.88Å; M722-L754 HydrophobicContact CG-CD1 4.07Å; M722-M757 HydrophobicContact CB-CE 4.48Å; M722-M757 HydrophobicContact CB-SD 3.76Å
723	K	93.9	Very high	92.9	Very high	77 Å²	77	36.5 Å²	36.5	34%	0.335	18%	0.184	S	C	.	.	H	α-helix	trans	-69.1	-40.8	174.3	-170.8	71.9	-175.1	71.5	0	112.3	M719 M720 D721 Q726 E727 M757	M719-K723 WeakPolarHBondContact O-CB 3.19Å; M719-K723 PolarHBondContact O-N 3.07Å; M720-K723 WeakPolarHBondContact O-CB 3.42Å; M720-K723 PolarHBondContact O-N 2.9Å; D721-K723 VanDerWaalsContact C-N 3.25Å; D721-K723 PolarHBondContact O-N 2.85Å; K723-Q726 VanDerWaalsContact CE-OE1 3.32Å; K723-Q726 WeakPolarHBondContact O-CB 3.04Å; K723-Q726 PolarHBondContact O-N 3.08Å; K723-E727 IonicContact NZ-OE1 2.7Å; K723-E727 PolarHBondContact NZ-OE1 3.47Å; K723-E727 PolarHBondContact O-N 3.3Å; K723-E727 VanDerWaalsContact O-N 3.08Å; K723-M757 HydrophobicContact CB-CE 3.93Å; K723-M757 HydrophobicContact CB-SD 4.16Å; K723-M757 HydrophobicContact CD-CE 4.08Å; K723-M757 HydrophobicContact CD-CG 4.14Å; K723-M757 HydrophobicContact CD-SD 4.29Å; K723-M757 PolarHBondContact N-SD 3.05Å; K723-M757 VanDerWaalsContact N-SD 3.39Å
724	A	92.8	Very high	93.1	Very high	25 Å²	25	34.2 Å²	34.2	21%	0.207	17%	0.173	C	C	.	.	H	α-helix	trans	-63	-46.3	172.6	0	0	0	0	0	110.9	Y683 M720 D721 Q726 E727 D728	Y683-A724 HydrophobicContact CD1-CB 3.84Å; Y683-A724 HydrophobicContact CE1-CB 3.9Å; M720-A724 PolarHBondContact O-N 3.49Å; D721-A724 PolarHBondContact O-N 3.36Å; A724-Q726 VanDerWaalsContact C-N 3.27Å; A724-Q726 PolarHBondContact O-N 3.31Å; A724-E727 PolarHBondContact O-N 2.73Å; A724-E727 VanDerWaalsContact O-N 3.12Å; A724-D728 WeakPolarHBondContact O-CB 3.49Å; A724-D728 PolarHBondContact O-N 3.37Å
725	C	93.8	Very high	93.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.1	-36.7	174	-170.8	0	0	0	0	112.8	Y683 D721 M722 D728 D729 L733	Y683-C725 HydrophobicContact CD1-CB 4.25Å; Y683-C725 HydrophobicContact CD2-CB 3.89Å; Y683-C725 HydrophobicContact CE2-CB 4.42Å; Y683-C725 HydrophobicContact CG-CB 3.81Å; D721-C725 WeakPolarHBondContact O-CB 3.37Å; D721-C725 PolarHBondContact O-N 2.98Å; M722-C725 PolarHBondContact O-N 3.12Å; C725-D728 PolarHBondContact O-N 3.1Å; C725-D729 CarbonylContact O-C 3.27Å; C725-D729 VanDerWaalsContact O-C 3.26Å; C725-D729 PolarHBondContact O-N 3.41Å; C725-D729 VanDerWaalsContact O-O 3.13Å; C725-L733 HydrophobicContact CB-CD1 4.36Å
726	Q	91.9	Very high	93.2	Very high	19 Å²	19	33 Å²	33	9%	0.089	16%	0.164	C	C	.	.	H	α-helix	trans	-66.9	-35.1	176.3	-173.3	-132.3	27.7	0	0	112.6	M722 K723 A724 L733 M757 V761	M722-Q726 VanDerWaalsContact O-CB 3.31Å; M722-Q726 WeakPolarHBondContact O-CB 3.22Å; M722-Q726 PolarHBondContact O-N 3.47Å; K723-Q726 VanDerWaalsContact CE-OE1 3.32Å; K723-Q726 WeakPolarHBondContact O-CB 3.04Å; K723-Q726 PolarHBondContact O-N 3.08Å; A724-Q726 VanDerWaalsContact C-N 3.27Å; A724-Q726 PolarHBondContact O-N 3.31Å; Q726-L733 HydrophobicContact CB-CD1 4.25Å; Q726-L733 HydrophobicContact CB-CD2 3.92Å; Q726-L733 HydrophobicContact CG-CD2 3.85Å; Q726-M757 HydrophobicContact CB-CG 3.95Å; Q726-M757 HydrophobicContact CB-SD 4.32Å; Q726-M757 HydrophobicContact CG-CG 3.83Å; Q726-M757 PolarHBondContact NE2-O 3.46Å; Q726-V761 HydrophobicContact CG-CB 4.37Å; Q726-V761 HydrophobicContact CG-CG1 3.92Å; Q726-V761 HydrophobicContact CG-CG2 3.57Å
727	E	87.6	Confident	93.4	Very high	142 Å²	142	30.2 Å²	30.2	66%	0.664	15%	0.148	S	C	*	.	H	α-helix	trans	-79.4	-27.2	177	-71.4	-179.5	-164.8	0	0	113.2	K723 A724	K723-E727 IonicContact NZ-OE1 2.7Å; K723-E727 PolarHBondContact NZ-OE1 3.47Å; K723-E727 PolarHBondContact O-N 3.3Å; K723-E727 VanDerWaalsContact O-N 3.08Å; A724-E727 PolarHBondContact O-N 2.73Å; A724-E727 VanDerWaalsContact O-N 3.12Å
728	D	87	Confident	93.4	Very high	78 Å²	78	30.7 Å²	30.7	42%	0.417	15%	0.151	S	C	.	.	H	α-helix	trans	-97.8	-46.1	-175	-75.8	-51.6	0	0	0	115.2	K680 Y683 A724 C725	K680-D728 IonicContact NZ-OD1 3.54Å; K680-D728 PolarHBondContact NZ-OD1 3.15Å; K680-D728 IonicContact NZ-OD2 2.8Å; K680-D728 PolarHBondContact NZ-OD2 3.34Å; Y683-D728 PolarHBondContact OH-OD2 3.2Å; Y683-D728 VanDerWaalsContact OH-OD2 3.07Å; A724-D728 WeakPolarHBondContact O-CB 3.49Å; A724-D728 PolarHBondContact O-N 3.37Å; C725-D728 PolarHBondContact O-N 3.1Å
729	D	88.6	Confident	93.3	Very high	12 Å²	12	32 Å²	32	6%	0.064	16%	0.16	C	C	.	.			trans	-151.1	90.3	-173	-172.2	-18.2	0	0	0	111	V629 C725 R731 L732 L733	V629-D729 PolarHBondContact N-OD2 2.67Å; C725-D729 CarbonylContact O-C 3.27Å; C725-D729 VanDerWaalsContact O-C 3.26Å; C725-D729 PolarHBondContact O-N 3.41Å; C725-D729 VanDerWaalsContact O-O 3.13Å; D729-R731 PolarHBondContact O-N 3.3Å; D729-R731 WeakPolarHBondContact OD1-CA 3.33Å; D729-R731 WeakPolarHBondContact OD1-CB 3.46Å; D729-R731 PolarHBondContact OD1-N 3.33Å; D729-L732 HydrophobicContact CB-CB 3.81Å; D729-L732 WeakPolarHBondContact O-CB 3.12Å; D729-L732 PolarHBondContact O-N 2.59Å; D729-L732 PolarHBondContact OD1-N 3.12Å; D729-L733 PolarHBondContact O-N 2.92Å
730	V	90.4	Very high	93.3	Very high	39 Å²	39	31.4 Å²	31.4	24%	0.236	16%	0.157	C	C	.	.	H	α-helix	trans	-62.3	-25.6	177.9	-174.9	0	0	0	0	112.1	L733 C734 V761	V730-L733 WeakPolarHBondContact O-CB 3.35Å; V730-L733 PolarHBondContact O-N 3.42Å; V730-C734 PolarHBondContact O-N 3.01Å; V730-C734 PolarHBondContact O-SG 3.08Å; V730-V761 HydrophobicContact CG1-CB 4.13Å; V730-V761 HydrophobicContact CG1-CG2 3.72Å; V730-V761 HydrophobicContact CG2-CB 4.02Å; V730-V761 HydrophobicContact CG2-CG2 4.04Å
731	R	90.8	Very high	93.3	Very high	72 Å²	72	27 Å²	27	27%	0.272	14%	0.135	S	C	.	.	H	α-helix	trans	-75.5	-40.4	178.8	-172.5	-179.8	166.2	-108.5	-13.5	110.3	E628 L630 P631 E632 D729 C734 Y735	E628-R731 IonicContact OE2-NH1 3.17Å; L630-R731 HydrophobicContact CD2-CG 4.11Å; L630-R731 PolarHBondContact O-NH1 2.97Å; P631-R731 PolarHBondContact O-NH1 3.14Å; P631-R731 PolarHBondContact O-NH2 2.89Å; E632-R731 PolarHBondContact O-NH2 2.8Å; D729-R731 PolarHBondContact O-N 3.3Å; D729-R731 WeakPolarHBondContact OD1-CA 3.33Å; D729-R731 WeakPolarHBondContact OD1-CB 3.46Å; D729-R731 PolarHBondContact OD1-N 3.33Å; R731-C734 PolarHBondContact O-N 2.66Å; R731-Y735 PolarHBondContact O-N 3.32Å
732	L	93.4	Very high	93.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.7	-42.6	167.4	178.3	62.1	0	0	0	111.8	V629 Y683 Y687 D729 C734 Y735 L736	V629-L732 HydrophobicContact CB-CD2 4.27Å; Y683-L732 HydrophobicContact CD2-CD2 3.84Å; Y683-L732 HydrophobicContact CE2-CD2 3.82Å; Y687-L732 HydrophobicContact CD2-CD1 3.31Å; Y687-L732 HydrophobicContact CE2-CD1 3.89Å; Y687-L732 HydrophobicContact CG-CD1 3.88Å; D729-L732 HydrophobicContact CB-CB 3.81Å; D729-L732 WeakPolarHBondContact O-CB 3.12Å; D729-L732 PolarHBondContact O-N 2.59Å; D729-L732 PolarHBondContact OD1-N 3.12Å; L732-C734 VanDerWaalsContact C-N 3.33Å; L732-C734 PolarHBondContact O-N 3.23Å; L732-Y735 HydrophobicContact CD1-CD1 4.34Å; L732-Y735 PolarHBondContact O-N 2.95Å; L732-Y735 VanDerWaalsContact O-N 3.14Å; L732-L736 HydrophobicContact CD1-CD1 4.13Å; L732-L736 HydrophobicContact CD1-CG 3.97Å; L732-L736 HydrophobicContact CG-CD1 3.93Å; L732-L736 HydrophobicContact CG-CG 4.22Å; L732-L736 WeakPolarHBondContact O-CB 3.46Å; L732-L736 WeakPolarHBondContact O-CG 3.39Å; L732-L736 PolarHBondContact O-N 3.38Å
733	L	95	Very high	93.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-55.6	-47.4	175.6	-176.4	77.9	0	0	0	111.4	M722 C725 Q726 D729 V730 L736 T737 I758 V761	M722-L733 HydrophobicContact CE-CD1 3.64Å; M722-L733 HydrophobicContact SD-CD1 4.41Å; C725-L733 HydrophobicContact CB-CD1 4.36Å; Q726-L733 HydrophobicContact CB-CD1 4.25Å; Q726-L733 HydrophobicContact CB-CD2 3.92Å; Q726-L733 HydrophobicContact CG-CD2 3.85Å; D729-L733 PolarHBondContact O-N 2.92Å; V730-L733 WeakPolarHBondContact O-CB 3.35Å; V730-L733 PolarHBondContact O-N 3.42Å; L733-L736 PolarHBondContact O-N 3.45Å; L733-T737 WeakPolarHBondContact O-CB 3.44Å; L733-T737 PolarHBondContact O-N 3.5Å; L733-T737 PolarHBondContact O-OG1 2.98Å; L733-I758 HydrophobicContact CD2-CG1 4.21Å; L733-I758 HydrophobicContact CG-CG1 4.47Å; L733-V761 HydrophobicContact CD2-CG2 3.94Å
734	C	93.9	Very high	93.2	Very high	12 Å²	12	30.8 Å²	30.8	8%	0.081	16%	0.162	C	C	.	.	H	α-helix	trans	-63.4	-41.3	176.7	-66.8	0	0	0	0	112.1	V730 R731 L732 P738	V730-C734 PolarHBondContact O-N 3.01Å; V730-C734 PolarHBondContact O-SG 3.08Å; R731-C734 PolarHBondContact O-N 2.66Å; L732-C734 VanDerWaalsContact C-N 3.33Å; L732-C734 PolarHBondContact O-N 3.23Å; C734-P738 VanDerWaalsContact O-CD 3.23Å; C734-P738 WeakPolarHBondContact O-CD 3.48Å
735	Y	94.8	Very high	93.2	Very high	47 Å²	47	32.1 Å²	32.1	18%	0.184	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-43.3	176.1	178.8	-108.7	0	0	0	112.3	L630 I634 L639 Y687 K690 R731 L732	L630-Y735 HydrophobicContact CD1-CD1 3.57Å; L630-Y735 HydrophobicContact CD1-CD2 4.27Å; L630-Y735 HydrophobicContact CD1-CE1 3.82Å; L630-Y735 HydrophobicContact CD1-CE2 4.49Å; L630-Y735 HydrophobicContact CD1-CG 3.81Å; L630-Y735 HydrophobicContact CD2-CD1 4.49Å; L630-Y735 HydrophobicContact CD2-CD2 4.47Å; L630-Y735 HydrophobicContact CD2-CG 4.01Å; I634-Y735 HydrophobicContact CD1-CD2 4.22Å; I634-Y735 HydrophobicContact CG2-CE2 4.14Å; L639-Y735 WeakPolarHBondContact CD1-OH 3.35Å; L639-Y735 HydrophobicContact CD2-CE1 4.35Å; Y687-Y735 HydrophobicContact CD2-CD1 4.27Å; Y687-Y735 HydrophobicContact CD2-CE1 4.14Å; Y687-Y735 HydrophobicContact CE2-CD1 4.11Å; Y687-Y735 AromaticContact CE2-CE1 3.8Å; Y687-Y735 HydrophobicContact CE2-CE1 3.8Å; K690-Y735 HydrophobicContact CD-CD1 3.78Å; K690-Y735 HydrophobicContact CD-CE1 3.45Å; K690-Y735 VanDerWaalsContact CD-CE1 3.45Å; K690-Y735 VanDerWaalsContact CE-CE1 3.41Å; K690-Y735 WeakPolarHBondContact CE-O 3.36Å; K690-Y735 HydrophobicContact CG-CE1 3.97Å; K690-Y735 PolarHBondContact NZ-O 2.78Å; R731-Y735 PolarHBondContact O-N 3.32Å; L732-Y735 HydrophobicContact CD1-CD1 4.34Å; L732-Y735 PolarHBondContact O-N 2.95Å; L732-Y735 VanDerWaalsContact O-N 3.14Å
736	L	95.7	Very high	93	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.7	-45.2	178.3	-74.4	175.1	0	0	0	112.1	L686 K690 M722 L732 L733 P738 S739 I740	L686-L736 HydrophobicContact CB-CD1 4.5Å; L686-L736 HydrophobicContact CB-CD2 4.25Å; K690-L736 HydrophobicContact CB-CD2 4.4Å; K690-L736 HydrophobicContact CD-CD2 4.05Å; M722-L736 HydrophobicContact SD-CD1 4.47Å; L732-L736 HydrophobicContact CD1-CD1 4.13Å; L732-L736 HydrophobicContact CD1-CG 3.97Å; L732-L736 HydrophobicContact CG-CD1 3.93Å; L732-L736 HydrophobicContact CG-CG 4.22Å; L732-L736 WeakPolarHBondContact O-CB 3.46Å; L732-L736 WeakPolarHBondContact O-CG 3.39Å; L732-L736 PolarHBondContact O-N 3.38Å; L733-L736 PolarHBondContact O-N 3.45Å; L736-P738 VanDerWaalsContact O-N 3.11Å; L736-S739 PolarHBondContact O-N 2.84Å; L736-I740 HydrophobicContact CB-CG1 4.12Å; L736-I740 PolarHBondContact O-N 2.67Å
737	T	96.5	Very high	93	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-38.9	-53.1	-170.9	-72.7	0	0	0	0	115.1	L733 S739 I740 Y741 I758 L770 L779 M781	L733-T737 WeakPolarHBondContact O-CB 3.44Å; L733-T737 PolarHBondContact O-N 3.5Å; L733-T737 PolarHBondContact O-OG1 2.98Å; T737-S739 VanDerWaalsContact C-N 3.31Å; T737-S739 PolarHBondContact O-N 3.22Å; T737-I740 PolarHBondContact O-N 3.11Å; T737-Y741 HydrophobicContact CG2-CD2 3.86Å; T737-Y741 HydrophobicContact CG2-CE2 4.06Å; T737-Y741 WeakPolarHBondContact O-CD2 3.49Å; T737-Y741 PolarHBondContact O-N 2.96Å; T737-Y741 VanDerWaalsContact O-N 3.08Å; T737-I758 HydrophobicContact CG2-CD1 3.72Å; T737-I758 WeakPolarHBondContact OG1-CD1 3.38Å; T737-L770 HydrophobicContact CG2-CD2 3.79Å; T737-L779 HydrophobicContact CG2-CD1 4.08Å; T737-L779 HydrophobicContact CG2-CD2 4.11Å; T737-M781 HydrophobicContact CG2-CE 4.26Å
738	P	95.7	Very high	93.3	Very high	10 Å²	10	30.1 Å²	30.1	7%	0.065	16%	0.161	C	C	.	.	H	α-helix	trans	-50.8	-41	174.8	-31.2	37.1	0	0	0	115.8	C734 L736 S742 H773 L779	C734-P738 VanDerWaalsContact O-CD 3.23Å; C734-P738 WeakPolarHBondContact O-CD 3.48Å; L736-P738 VanDerWaalsContact O-N 3.11Å; P738-S742 WeakPolarHBondContact O-CB 3.39Å; P738-S742 PolarHBondContact O-N 3.01Å; P738-H773 HydrophobicContact CG-CB 4.44Å; P738-L779 HydrophobicContact CB-CB 4.5Å
739	S	94.6	Very high	93.4	Very high	28 Å²	28	26.7 Å²	26.7	20%	0.196	14%	0.143	C	C	.	.	H	α-helix	trans	-77.3	-41.1	179.7	-65.1	0	0	0	0	111.5	K690 L736 T737 Y741 S742 E743	K690-S739 PolarHBondContact NZ-OG 2.9Å; L736-S739 PolarHBondContact O-N 2.84Å; T737-S739 VanDerWaalsContact C-N 3.31Å; T737-S739 PolarHBondContact O-N 3.22Å; S739-Y741 VanDerWaalsContact C-N 3.33Å; S739-Y741 PolarHBondContact O-N 3.25Å; S739-S742 WeakPolarHBondContact O-CB 3.42Å; S739-S742 PolarHBondContact O-N 3.17Å; S739-E743 WeakPolarHBondContact O-CG 3.25Å; S739-E743 PolarHBondContact O-N 3.15Å
740	I	96.3	Very high	93.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.4	-40.5	-178.8	-57.9	-56.8	0	0	0	111.4	L686 L718 M722 L736 T737 F744 T748 L754	L686-I740 HydrophobicContact CB-CD1 4.38Å; L686-I740 HydrophobicContact CD1-CD1 3.96Å; L686-I740 HydrophobicContact CD2-CD1 3.77Å; L686-I740 HydrophobicContact CG-CD1 4.26Å; L718-I740 HydrophobicContact CD1-CD1 4.41Å; L718-I740 HydrophobicContact CD1-CG2 3.94Å; L718-I740 HydrophobicContact CD2-CG2 4.06Å; L718-I740 HydrophobicContact CG-CG2 4.35Å; M722-I740 HydrophobicContact CE-CB 4.31Å; M722-I740 HydrophobicContact CE-CG1 3.97Å; M722-I740 HydrophobicContact CE-CG2 4.22Å; M722-I740 HydrophobicContact SD-CD1 4.49Å; M722-I740 HydrophobicContact SD-CG1 3.95Å; M722-I740 HydrophobicContact SD-CG2 4.39Å; L736-I740 HydrophobicContact CB-CG1 4.12Å; L736-I740 PolarHBondContact O-N 2.67Å; T737-I740 PolarHBondContact O-N 3.11Å; I740-F744 HydrophobicContact CD1-CE2 4.49Å; I740-F744 HydrophobicContact CG2-CD2 4.48Å; I740-F744 WeakPolarHBondContact O-CB 3.29Å; I740-F744 PolarHBondContact O-N 3.23Å; I740-F744 VanDerWaalsContact O-N 3.1Å; I740-T748 HydrophobicContact CG2-CG2 3.9Å; I740-L754 HydrophobicContact CG2-CD2 4.04Å
741	Y	95.7	Very high	93	Very high	5 Å²	5	32.2 Å²	32.2	2%	0.02	16%	0.164	C	C	.	.	H	α-helix	trans	-73.5	-22.5	173.3	-85.8	-82.8	0	0	0	114.5	T737 S739 T748 L749 L754 L755 I758 L779 V780 M781	T737-Y741 HydrophobicContact CG2-CD2 3.86Å; T737-Y741 HydrophobicContact CG2-CE2 4.06Å; T737-Y741 WeakPolarHBondContact O-CD2 3.49Å; T737-Y741 PolarHBondContact O-N 2.96Å; T737-Y741 VanDerWaalsContact O-N 3.08Å; S739-Y741 VanDerWaalsContact C-N 3.33Å; S739-Y741 PolarHBondContact O-N 3.25Å; Y741-T748 HydrophobicContact CD1-CG2 4.49Å; Y741-T748 WeakPolarHBondContact CD1-OG1 3.46Å; Y741-T748 WeakPolarHBondContact CE1-O 3.5Å; Y741-L749 HydrophobicContact CD1-CD2 3.66Å; Y741-L749 HydrophobicContact CD1-CG 4.09Å; Y741-L749 HydrophobicContact CE1-CD2 3.78Å; Y741-L749 HydrophobicContact CE1-CG 4.4Å; Y741-L754 HydrophobicContact CD2-CD2 4.23Å; Y741-L754 HydrophobicContact CE2-CD2 3.62Å; Y741-L754 HydrophobicContact CE2-CG 4.01Å; Y741-L755 PolarHBondContact OH-N 3.09Å; Y741-I758 HydrophobicContact CE2-CD1 3.8Å; Y741-L779 HydrophobicContact CD2-CD1 3.86Å; Y741-L779 HydrophobicContact CG-CD1 3.87Å; Y741-V780 WeakPolarHBondContact CB-O 3.39Å; Y741-V780 WeakPolarHBondContact CD1-O 3.34Å; Y741-M781 HydrophobicContact CD1-CG 4.46Å; Y741-M781 HydrophobicContact CD2-CE 4.45Å; Y741-M781 HydrophobicContact CD2-CG 4.41Å; Y741-M781 HydrophobicContact CE1-CB 4.18Å; Y741-M781 HydrophobicContact CE1-CG 4.31Å; Y741-M781 HydrophobicContact CE2-CE 3.64Å; Y741-M781 HydrophobicContact CE2-CG 4.25Å
742	S	93.9	Very high	93	Very high	72 Å²	72	28.8 Å²	28.8	50%	0.503	15%	0.151	S	C	.	.	H	α-helix	trans	-78.5	-48.8	176.9	177.4	0	0	0	0	111.9	P738 S739 P745	P738-S742 WeakPolarHBondContact O-CB 3.39Å; P738-S742 PolarHBondContact O-N 3.01Å; S739-S742 WeakPolarHBondContact O-CB 3.42Å; S739-S742 PolarHBondContact O-N 3.17Å; S742-P745 WeakPolarHBondContact O-CD 3.34Å
743	E	95	Very high	93	Very high	77 Å²	77	33.2 Å²	33.2	36%	0.36	17%	0.171	S	C	.	.	H	α-helix	trans	-88.5	-30.9	-170.4	-52.8	-57.1	107.3	0	0	112.2	M699 S739 P745	M699-E743 HydrophobicContact CB-CB 4.02Å; M699-E743 HydrophobicContact CB-CG 3.74Å; M699-E743 HydrophobicContact CG-CB 3.81Å; M699-E743 HydrophobicContact CG-CG 3.8Å; S739-E743 WeakPolarHBondContact O-CG 3.25Å; S739-E743 PolarHBondContact O-N 3.15Å; E743-P745 WeakPolarHBondContact O-CD 3.48Å
744	F	94.8	Very high	93	Very high	8 Å²	8	33.3 Å²	33.3	4%	0.035	17%	0.172	C	C	.	.	S	Bend	trans	-115.3	51.7	176.9	-50.6	-59.4	0	0	0	112.7	L686 M699 M700 Y702 L714 L718 I740 D746 E747 T748	L686-F744 HydrophobicContact CD2-CE2 4.25Å; M699-F744 HydrophobicContact CG-CE2 3.77Å; M699-F744 HydrophobicContact CG-CZ 3.78Å; M699-F744 HydrophobicContact SD-CE2 4.46Å; M700-F744 HydrophobicContact SD-CE1 4.28Å; Y702-F744 HydrophobicContact CD1-CE2 4.12Å; Y702-F744 HydrophobicContact CD1-CZ 4.01Å; Y702-F744 HydrophobicContact CG-CZ 4.5Å; L714-F744 HydrophobicContact CD1-CD1 4.44Å; L714-F744 HydrophobicContact CD1-CE1 4.31Å; L714-F744 HydrophobicContact CD2-CD1 3.89Å; L714-F744 HydrophobicContact CD2-CE1 4.23Å; L718-F744 HydrophobicContact CD1-CD2 4.33Å; L718-F744 HydrophobicContact CD2-CB 3.93Å; L718-F744 HydrophobicContact CD2-CD2 3.93Å; L718-F744 HydrophobicContact CD2-CG 4.12Å; I740-F744 HydrophobicContact CD1-CE2 4.49Å; I740-F744 HydrophobicContact CG2-CD2 4.48Å; I740-F744 WeakPolarHBondContact O-CB 3.29Å; I740-F744 PolarHBondContact O-N 3.23Å; I740-F744 VanDerWaalsContact O-N 3.1Å; F744-D746 PolarHBondContact O-N 3.22Å; F744-E747 PolarHBondContact O-N 3.13Å; F744-T748 HydrophobicContact CB-CG2 4.35Å; F744-T748 WeakPolarHBondContact O-CB 3.49Å; F744-T748 VanDerWaalsContact O-CG2 3.3Å; F744-T748 WeakPolarHBondContact O-CG2 3.38Å; F744-T748 PolarHBondContact O-N 3.15Å; F744-T748 PolarHBondContact O-OG1 2.98Å
745	P	92.9	Very high	93.1	Very high	53 Å²	53	32.8 Å²	32.8	34%	0.344	17%	0.168	S	C	.	.	H	α-helix	trans	-68	-21.4	-171.1	30.8	-37	0	0	0	112.8	S742 E743 T748 L749 R783	S742-P745 WeakPolarHBondContact O-CD 3.34Å; E743-P745 WeakPolarHBondContact O-CD 3.48Å; P745-T748 WeakPolarHBondContact CA-OG1 3.39Å; P745-L749 HydrophobicContact CB-CD1 3.77Å; P745-L749 WeakPolarHBondContact O-CB 3.26Å; P745-L749 VanDerWaalsContact O-CD1 3.3Å; P745-L749 WeakPolarHBondContact O-CD1 3.28Å; P745-L749 VanDerWaalsContact O-CG 3.25Å; P745-L749 WeakPolarHBondContact O-CG 3.5Å; P745-L749 PolarHBondContact O-N 3.13Å; P745-R783 PolarHBondContact O-NH1 3.07Å
746	D	89.4	Confident	93.2	Very high	71 Å²	71	32.9 Å²	32.9	38%	0.38	17%	0.172	S	C	.	.	H	α-helix	trans	-88.3	-20.5	-178.9	-119.2	-14	0	0	0	113.3	F744 R750 R783	F744-D746 PolarHBondContact O-N 3.22Å; D746-R750 VanDerWaalsContact CB-NH2 3.33Å; D746-R750 VanDerWaalsContact CG-CZ 3.46Å; D746-R750 WeakPolarHBondContact O-CD 3.28Å; D746-R750 WeakPolarHBondContact O-CG 3.25Å; D746-R750 PolarHBondContact O-NE 3Å; D746-R750 PolarHBondContact O-NH1 2.87Å; D746-R750 IonicContact OD1-CZ 3.68Å; D746-R750 IonicContact OD1-NE 3.71Å; D746-R750 PolarHBondContact OD1-NE 3.36Å; D746-R750 VanDerWaalsContact OD1-NE 3.08Å; D746-R750 IonicContact OD1-NH2 4Å; D746-R750 PolarHBondContact OD1-NH2 3.19Å; D746-R750 IonicContact OD2-CZ 2.77Å; D746-R750 IonicContact OD2-NH2 3.06Å; D746-R750 PolarHBondContact OD2-NH2 3.18Å; D746-R783 IonicContact OD1-CZ 2.68Å; D746-R783 IonicContact OD1-NH1 3.95Å; D746-R783 PolarHBondContact OD1-NH1 2.83Å; D746-R783 IonicContact OD1-NH2 2.63Å; D746-R783 PolarHBondContact OD1-NH2 3.13Å
747	E	91.8	Very high	93.1	Very high	46 Å²	46	33.5 Å²	33.5	22%	0.215	18%	0.175	C	C	.	.	H	α-helix	trans	-89	-38.5	171	-57	-42.8	126.7	0	0	111.4	L714 H715 F744 R750	L714-E747 HydrophobicContact CD2-CG 4.26Å; L714-E747 HydrophobicContact CG-CG 4.49Å; H715-E747 IonicContact CE1-OE2 2.73Å; H715-E747 IonicContact CG-OE2 3.07Å; H715-E747 IonicContact ND1-OE2 3.36Å; H715-E747 PolarHBondContact ND1-OE2 2.72Å; F744-E747 PolarHBondContact O-N 3.13Å; E747-R750 IonicContact OE1-CZ 3.81Å; E747-R750 IonicContact OE1-NH1 3.63Å; E747-R750 PolarHBondContact OE1-NH1 3.23Å; E747-R750 IonicContact OE1-NH2 2.78Å; E747-R750 IonicContact OE2-NH1 2.79Å
748	T	92.4	Very high	93.1	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-79.6	-25.2	-176.4	58.3	0	0	0	0	115.2	L718 I740 Y741 F744 P745 L754	L718-T748 HydrophobicContact CD2-CG2 4.17Å; I740-T748 HydrophobicContact CG2-CG2 3.9Å; Y741-T748 HydrophobicContact CD1-CG2 4.49Å; Y741-T748 WeakPolarHBondContact CD1-OG1 3.46Å; Y741-T748 WeakPolarHBondContact CE1-O 3.5Å; F744-T748 HydrophobicContact CB-CG2 4.35Å; F744-T748 WeakPolarHBondContact O-CB 3.49Å; F744-T748 VanDerWaalsContact O-CG2 3.3Å; F744-T748 WeakPolarHBondContact O-CG2 3.38Å; F744-T748 PolarHBondContact O-N 3.15Å; F744-T748 PolarHBondContact O-OG1 2.98Å; P745-T748 WeakPolarHBondContact CA-OG1 3.39Å; T748-L754 HydrophobicContact CG2-CD2 3.6Å
749	L	90.8	Very high	93.1	Very high	5 Å²	5	33 Å²	33	3%	0.026	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-2.3	-174.5	-58.7	164.6	0	0	0	114.6	Y741 P745 V780 M781 R783 S786	Y741-L749 HydrophobicContact CD1-CD2 3.66Å; Y741-L749 HydrophobicContact CD1-CG 4.09Å; Y741-L749 HydrophobicContact CE1-CD2 3.78Å; Y741-L749 HydrophobicContact CE1-CG 4.4Å; P745-L749 HydrophobicContact CB-CD1 3.77Å; P745-L749 WeakPolarHBondContact O-CB 3.26Å; P745-L749 VanDerWaalsContact O-CD1 3.3Å; P745-L749 WeakPolarHBondContact O-CD1 3.28Å; P745-L749 VanDerWaalsContact O-CG 3.25Å; P745-L749 WeakPolarHBondContact O-CG 3.5Å; P745-L749 PolarHBondContact O-N 3.13Å; L749-V780 WeakPolarHBondContact CD2-O 3.41Å; L749-M781 VanDerWaalsContact CD2-O 3.29Å; L749-M781 WeakPolarHBondContact CD2-O 3.4Å; L749-R783 HydrophobicContact CB-CG 3.85Å; L749-R783 HydrophobicContact CD1-CG 3.58Å; L749-R783 HydrophobicContact CD2-CG 4.35Å; L749-R783 HydrophobicContact CG-CG 4.13Å; L749-S786 WeakPolarHBondContact O-CB 3.45Å; L749-S786 PolarHBondContact O-OG 2.82Å
750	R	83.6	Confident	92.9	Very high	134 Å²	134	33.7 Å²	33.7	51%	0.506	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-31	176.9	-71.5	178.8	-163.2	146.7	-3.4	113	D746 E747	D746-R750 VanDerWaalsContact CB-NH2 3.33Å; D746-R750 VanDerWaalsContact CG-CZ 3.46Å; D746-R750 WeakPolarHBondContact O-CD 3.28Å; D746-R750 WeakPolarHBondContact O-CG 3.25Å; D746-R750 PolarHBondContact O-NE 3Å; D746-R750 PolarHBondContact O-NH1 2.87Å; D746-R750 IonicContact OD1-CZ 3.68Å; D746-R750 IonicContact OD1-NE 3.71Å; D746-R750 PolarHBondContact OD1-NE 3.36Å; D746-R750 VanDerWaalsContact OD1-NE 3.08Å; D746-R750 IonicContact OD1-NH2 4Å; D746-R750 PolarHBondContact OD1-NH2 3.19Å; D746-R750 IonicContact OD2-CZ 2.77Å; D746-R750 IonicContact OD2-NH2 3.06Å; D746-R750 PolarHBondContact OD2-NH2 3.18Å; E747-R750 IonicContact OE1-CZ 3.81Å; E747-R750 IonicContact OE1-NH1 3.63Å; E747-R750 PolarHBondContact OE1-NH1 3.23Å; E747-R750 IonicContact OE1-NH2 2.78Å; E747-R750 IonicContact OE2-NH1 2.79Å
751	S	86.5	Confident	92.6	Very high	34 Å²	34	36.1 Å²	36.1	24%	0.238	19%	0.194	C	C	.	.			trans	-113.8	155.7	-178.6	-174.7	0	0	0	0	111.7	E753	S751-E753 VanDerWaalsContact C-N 3.25Å; S751-E753 WeakPolarHBondContact OG-CB 3.34Å; S751-E753 PolarHBondContact OG-N 3.34Å
752	G	90.3	Very high	92.3	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-81.7	0.5	167.9	0	0	0	0	0	114.1	L755 N756 W797	G752-L755 PolarHBondContact O-N 3.24Å; G752-N756 WeakPolarHBondContact O-CB 3.44Å; G752-N756 PolarHBondContact O-N 2.95Å; G752-W797 WeakPolarHBondContact O-CH2 3.49Å
753	E	93.6	Very high	91.8	Very high	92 Å²	92	35 Å²	35	43%	0.43	18%	0.183	S	C	.	.	H	α-helix	trans	-65.3	-57.2	-169.2	-175.8	165.4	178	0	0	114.3	M719 S751 L755 N756 M757	M719-E753 HydrophobicContact SD-CG 4.23Å; S751-E753 VanDerWaalsContact C-N 3.25Å; S751-E753 WeakPolarHBondContact OG-CB 3.34Å; S751-E753 PolarHBondContact OG-N 3.34Å; E753-L755 PolarHBondContact O-N 3.45Å; E753-N756 PolarHBondContact O-N 2.95Å; E753-N756 VanDerWaalsContact O-N 3.16Å; E753-M757 WeakPolarHBondContact O-CB 3.41Å; E753-M757 PolarHBondContact O-N 2.97Å
754	L	94.9	Very high	91.2	Very high	2 Å²	2	35 Å²	35	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-33.2	175	-178	60.1	0	0	0	111.9	M719 M722 I740 Y741 T748 M757 I758	M719-L754 HydrophobicContact CE-CB 4.12Å; M719-L754 HydrophobicContact CE-CD2 4.38Å; M719-L754 HydrophobicContact SD-CB 3.98Å; M722-L754 HydrophobicContact CB-CD1 3.79Å; M722-L754 HydrophobicContact CE-CD1 3.88Å; M722-L754 HydrophobicContact CG-CD1 4.07Å; I740-L754 HydrophobicContact CG2-CD2 4.04Å; Y741-L754 HydrophobicContact CD2-CD2 4.23Å; Y741-L754 HydrophobicContact CE2-CD2 3.62Å; Y741-L754 HydrophobicContact CE2-CG 4.01Å; T748-L754 HydrophobicContact CG2-CD2 3.6Å; L754-M757 HydrophobicContact CD1-CE 4.46Å; L754-M757 HydrophobicContact CD1-SD 3.93Å; L754-I758 HydrophobicContact CD1-CD1 4.22Å; L754-I758 HydrophobicContact CD1-CG1 4.46Å; L754-I758 HydrophobicContact CG-CD1 3.99Å; L754-I758 WeakPolarHBondContact O-CD1 3.29Å; L754-I758 VanDerWaalsContact O-CG1 3.28Å; L754-I758 WeakPolarHBondContact O-CG1 3.43Å; L754-I758 PolarHBondContact O-N 3.4Å
755	L	96.3	Very high	90.8	Very high	1 Å²	1	39 Å²	39	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-65.4	-46.3	175.3	176.6	66.4	0	0	0	111.3	Y741 G752 E753 I758 V759 M781 F782 I790 W797 T805 L808	Y741-L755 PolarHBondContact OH-N 3.09Å; G752-L755 PolarHBondContact O-N 3.24Å; E753-L755 PolarHBondContact O-N 3.45Å; L755-I758 PolarHBondContact O-N 3.49Å; L755-V759 HydrophobicContact CD1-CG1 4.04Å; L755-V759 WeakPolarHBondContact O-CG2 3.46Å; L755-V759 PolarHBondContact O-N 3.17Å; L755-M781 HydrophobicContact CD1-CE 3.61Å; L755-M781 HydrophobicContact CD1-SD 4.26Å; L755-F782 HydrophobicContact CD1-CZ 4.35Å; L755-F782 HydrophobicContact CD2-CE1 3.49Å; L755-F782 VanDerWaalsContact CD2-CE1 3.49Å; L755-F782 HydrophobicContact CD2-CZ 3.54Å; L755-I790 HydrophobicContact CD2-CG2 3.56Å; L755-W797 HydrophobicContact CB-CH2 4.41Å; L755-W797 HydrophobicContact CD2-CH2 4.13Å; L755-W797 HydrophobicContact CD2-CZ3 4.21Å; L755-W797 HydrophobicContact CG-CH2 4.17Å; L755-W797 HydrophobicContact CG-CZ3 4.14Å; L755-T805 HydrophobicContact CD2-CG2 4.17Å; L755-L808 HydrophobicContact CD1-CD1 4.06Å
756	N	96.2	Very high	90.7	Very high	50 Å²	50	37.8 Å²	37.8	27%	0.267	20%	0.201	S	C	.	.	H	α-helix	trans	-58.9	-48.8	175.4	-180	-121.2	0	0	0	110.8	G752 E753 I758 V759 A760 W797	G752-N756 WeakPolarHBondContact O-CB 3.44Å; G752-N756 PolarHBondContact O-N 2.95Å; E753-N756 PolarHBondContact O-N 2.95Å; E753-N756 VanDerWaalsContact O-N 3.16Å; N756-I758 PolarHBondContact O-N 2.76Å; N756-V759 PolarHBondContact O-N 3.32Å; N756-A760 WeakPolarHBondContact O-CB 3.41Å; N756-A760 PolarHBondContact O-N 2.95Å; N756-W797 HydrophobicContact CB-CD2 4.26Å; N756-W797 HydrophobicContact CB-CE3 4.37Å; N756-W797 HydrophobicContact CB-CH2 3.73Å; N756-W797 HydrophobicContact CB-CZ2 3.59Å; N756-W797 HydrophobicContact CB-CZ3 4.11Å
757	M	94.3	Very high	90.9	Very high	12 Å²	12	35.2 Å²	35.2	6%	0.059	19%	0.187	C	C	.	.	H	α-helix	trans	-53.2	-41.2	176.3	-171.2	-168.6	-58.9	0	0	112	M719 M722 K723 Q726 E753 L754	M719-M757 HydrophobicContact SD-CE 4.48Å; M722-M757 HydrophobicContact CB-CE 4.48Å; M722-M757 HydrophobicContact CB-SD 3.76Å; K723-M757 HydrophobicContact CB-CE 3.93Å; K723-M757 HydrophobicContact CB-SD 4.16Å; K723-M757 HydrophobicContact CD-CE 4.08Å; K723-M757 HydrophobicContact CD-CG 4.14Å; K723-M757 HydrophobicContact CD-SD 4.29Å; K723-M757 PolarHBondContact N-SD 3.05Å; K723-M757 VanDerWaalsContact N-SD 3.39Å; Q726-M757 HydrophobicContact CB-CG 3.95Å; Q726-M757 HydrophobicContact CB-SD 4.32Å; Q726-M757 HydrophobicContact CG-CG 3.83Å; Q726-M757 PolarHBondContact NE2-O 3.46Å; E753-M757 WeakPolarHBondContact O-CB 3.41Å; E753-M757 PolarHBondContact O-N 2.97Å; L754-M757 HydrophobicContact CD1-CE 4.46Å; L754-M757 HydrophobicContact CD1-SD 3.93Å
758	I	95.7	Very high	91	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-70.8	-53.8	174.7	-67.6	161.6	0	0	0	111.1	L733 T737 Y741 L754 L755 N756 A760 V761 I762 L770 M781	L733-I758 HydrophobicContact CD2-CG1 4.21Å; L733-I758 HydrophobicContact CG-CG1 4.47Å; T737-I758 HydrophobicContact CG2-CD1 3.72Å; T737-I758 WeakPolarHBondContact OG1-CD1 3.38Å; Y741-I758 HydrophobicContact CE2-CD1 3.8Å; L754-I758 HydrophobicContact CD1-CD1 4.22Å; L754-I758 HydrophobicContact CD1-CG1 4.46Å; L754-I758 HydrophobicContact CG-CD1 3.99Å; L754-I758 WeakPolarHBondContact O-CD1 3.29Å; L754-I758 VanDerWaalsContact O-CG1 3.28Å; L754-I758 WeakPolarHBondContact O-CG1 3.43Å; L754-I758 PolarHBondContact O-N 3.4Å; L755-I758 PolarHBondContact O-N 3.49Å; N756-I758 PolarHBondContact O-N 2.76Å; I758-A760 PolarHBondContact O-N 2.71Å; I758-A760 VanDerWaalsContact O-N 3.16Å; I758-V761 PolarHBondContact O-N 3.47Å; I758-I762 HydrophobicContact CG2-CD1 4.21Å; I758-I762 HydrophobicContact CG2-CG2 3.79Å; I758-I762 WeakPolarHBondContact O-CG2 3.33Å; I758-I762 PolarHBondContact O-N 2.66Å; I758-L770 HydrophobicContact CG2-CD1 3.81Å; I758-M781 HydrophobicContact CD1-CE 3.71Å; I758-M781 HydrophobicContact CG2-CE 4.42Å
759	V	95.6	Very high	91	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.2	-16.4	-173.8	-58.9	0	0	0	0	114.7	L755 N756 I762 W797 E801 L808	L755-V759 HydrophobicContact CD1-CG1 4.04Å; L755-V759 WeakPolarHBondContact O-CG2 3.46Å; L755-V759 PolarHBondContact O-N 3.17Å; N756-V759 PolarHBondContact O-N 3.32Å; V759-I762 HydrophobicContact CG1-CD1 4.33Å; V759-W797 HydrophobicContact CG2-CE3 3.87Å; V759-W797 HydrophobicContact CG2-CZ3 3.88Å; V759-E801 HydrophobicContact CB-CB 4.45Å; V759-E801 HydrophobicContact CG2-CB 3.74Å; V759-E801 HydrophobicContact CG2-CG 4.17Å; V759-L808 HydrophobicContact CG1-CD1 3.86Å
760	A	91.7	Very high	91.2	Very high	43 Å²	43	42 Å²	42	36%	0.355	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-18.4	175.6	0	0	0	0	0	114.6	N756 I758 E801	N756-A760 WeakPolarHBondContact O-CB 3.41Å; N756-A760 PolarHBondContact O-N 2.95Å; I758-A760 PolarHBondContact O-N 2.71Å; I758-A760 VanDerWaalsContact O-N 3.16Å; A760-E801 WeakPolarHBondContact CA-OE1 3.28Å; A760-E801 WeakPolarHBondContact CB-OE1 3.24Å
761	V	89.1	Confident	91.9	Very high	51 Å²	51	37.2 Å²	37.2	31%	0.309	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.3	-19.1	-175.4	-65.4	0	0	0	0	115.6	Q726 V730 L733 I758	Q726-V761 HydrophobicContact CG-CB 4.37Å; Q726-V761 HydrophobicContact CG-CG1 3.92Å; Q726-V761 HydrophobicContact CG-CG2 3.57Å; V730-V761 HydrophobicContact CG1-CB 4.13Å; V730-V761 HydrophobicContact CG1-CG2 3.72Å; V730-V761 HydrophobicContact CG2-CB 4.02Å; V730-V761 HydrophobicContact CG2-CG2 4.04Å; L733-V761 HydrophobicContact CD2-CG2 3.94Å; I758-V761 PolarHBondContact O-N 3.47Å
762	I	89.1	Confident	92.2	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	21%	0.209	C	C	.	.			trans	-65.9	144	-179.8	59.4	-179.8	0	0	0	112.5	I758 V759 Q766 L767 L770 F800	I758-I762 HydrophobicContact CG2-CD1 4.21Å; I758-I762 HydrophobicContact CG2-CG2 3.79Å; I758-I762 WeakPolarHBondContact O-CG2 3.33Å; I758-I762 PolarHBondContact O-N 2.66Å; V759-I762 HydrophobicContact CG1-CD1 4.33Å; I762-Q766 VanDerWaalsContact CA-OE1 3.31Å; I762-Q766 HydrophobicContact CB-CB 3.97Å; I762-Q766 HydrophobicContact CG2-CB 4.13Å; I762-L767 HydrophobicContact CD1-CB 4.09Å; I762-L767 HydrophobicContact CD1-CD1 4.01Å; I762-L770 HydrophobicContact CD1-CD1 4.13Å; I762-L770 HydrophobicContact CG2-CD1 4.17Å; I762-F800 HydrophobicContact CG1-CE1 4.34Å; I762-F800 WeakPolarHBondContact O-CE1 3.36Å; I762-F800 WeakPolarHBondContact O-CZ 3.47Å
763	D	83.9	Confident	92.5	Very high	50 Å²	50	41.6 Å²	41.6	27%	0.267	22%	0.224	S	C	.	.			trans	-86.9	178	168.4	88	-7.2	0	0	0	112.5	M765 Q766 L767	D763-M765 PolarHBondContact O-N 2.98Å; D763-M765 WeakPolarHBondContact OD1-CA 3.37Å; D763-M765 VanDerWaalsContact OD1-CB 3.3Å; D763-M765 WeakPolarHBondContact OD1-CB 3.43Å; D763-M765 PolarHBondContact OD1-N 2.88Å; D763-Q766 PolarHBondContact O-N 3.16Å; D763-Q766 WeakPolarHBondContact OD1-CG 3.45Å; D763-Q766 PolarHBondContact OD1-N 2.96Å; D763-L767 VanDerWaalsContact O-CB 3.31Å; D763-L767 WeakPolarHBondContact O-CB 3.33Å; D763-L767 PolarHBondContact O-N 3.42Å
764	S	81.5	Confident	92.7	Very high	77 Å²	77	37.8 Å²	37.8	54%	0.538	21%	0.207	S	C	.	.	H	α-helix	trans	-66.2	-18.8	178.6	66.8	0	0	0	0	115.3	Q768	S764-Q768 WeakPolarHBondContact O-CB 3.33Å; S764-Q768 PolarHBondContact O-N 2.97Å
765	M	86.3	Confident	92.6	Very high	94 Å²	94	44.3 Å²	44.3	46%	0.463	24%	0.24	S	C	.	.	H	α-helix	trans	-84.2	-47.1	176.6	-171.6	-176.6	78.3	0	0	110.2	D763 L767 Q768 E769	D763-M765 PolarHBondContact O-N 2.98Å; D763-M765 WeakPolarHBondContact OD1-CA 3.37Å; D763-M765 VanDerWaalsContact OD1-CB 3.3Å; D763-M765 WeakPolarHBondContact OD1-CB 3.43Å; D763-M765 PolarHBondContact OD1-N 2.88Å; M765-L767 VanDerWaalsContact C-N 3.33Å; M765-L767 PolarHBondContact O-N 2.97Å; M765-Q768 CarbonylContact O-C 3.51Å; M765-Q768 WeakPolarHBondContact O-CA 3.27Å; M765-Q768 WeakPolarHBondContact O-CB 3.4Å; M765-Q768 PolarHBondContact O-N 3.11Å; M765-E769 WeakPolarHBondContact O-CG 3.23Å; M765-E769 PolarHBondContact O-N 3.05Å
766	Q	91.6	Very high	92.4	Very high	26 Å²	26	50.9 Å²	50.9	12%	0.121	27%	0.272	C	S	.	.	H	α-helix	trans	-60.5	-40.7	173.2	-70.3	168	-26	0	0	111.5	I762 D763 Q768 E769 L770	I762-Q766 VanDerWaalsContact CA-OE1 3.31Å; I762-Q766 HydrophobicContact CB-CB 3.97Å; I762-Q766 HydrophobicContact CG2-CB 4.13Å; D763-Q766 PolarHBondContact O-N 3.16Å; D763-Q766 WeakPolarHBondContact OD1-CG 3.45Å; D763-Q766 PolarHBondContact OD1-N 2.96Å; Q766-Q768 VanDerWaalsContact C-N 3.33Å; Q766-Q768 PolarHBondContact O-N 3.21Å; Q766-E769 PolarHBondContact O-N 3.06Å; Q766-L770 WeakPolarHBondContact O-CB 3.35Å; Q766-L770 WeakPolarHBondContact O-CG 3.45Å; Q766-L770 PolarHBondContact O-N 3.08Å
767	L	94.8	Very high	92.2	Very high	18 Å²	18	51.3 Å²	51.3	9%	0.094	29%	0.288	C	S	.	.	H	α-helix	trans	-57.3	-45.6	169.8	177.4	64	0	0	0	111.7	I762 D763 M765 L770 M771 Q807 L808	I762-L767 HydrophobicContact CD1-CB 4.09Å; I762-L767 HydrophobicContact CD1-CD1 4.01Å; D763-L767 VanDerWaalsContact O-CB 3.31Å; D763-L767 WeakPolarHBondContact O-CB 3.33Å; D763-L767 PolarHBondContact O-N 3.42Å; M765-L767 VanDerWaalsContact C-N 3.33Å; M765-L767 PolarHBondContact O-N 2.97Å; L767-L770 PolarHBondContact O-N 3.11Å; L767-M771 HydrophobicContact CD1-CG 4.45Å; L767-M771 HydrophobicContact CD1-SD 4.43Å; L767-M771 HydrophobicContact CG-SD 4.17Å; L767-M771 WeakPolarHBondContact O-CB 3.5Å; L767-M771 WeakPolarHBondContact O-CG 3.45Å; L767-M771 PolarHBondContact O-N 2.84Å; L767-Q807 HydrophobicContact CD1-CB 4.46Å; L767-Q807 HydrophobicContact CD2-CB 4.45Å; L767-Q807 HydrophobicContact CD2-CG 4.47Å; L767-L808 HydrophobicContact CD1-CD1 4.17Å; L767-L808 HydrophobicContact CD1-CD2 4.04Å; L767-L808 HydrophobicContact CD1-CG 3.75Å
768	Q	92.5	Very high	92.2	Very high	103 Å²	103	54.8 Å²	54.8	48%	0.481	31%	0.307	S	S	.	.	H	α-helix	trans	-66.7	-35.1	178.2	177.3	60	86.2	0	0	112.1	S764 M765 Q766 C772	S764-Q768 WeakPolarHBondContact O-CB 3.33Å; S764-Q768 PolarHBondContact O-N 2.97Å; M765-Q768 CarbonylContact O-C 3.51Å; M765-Q768 WeakPolarHBondContact O-CA 3.27Å; M765-Q768 WeakPolarHBondContact O-CB 3.4Å; M765-Q768 PolarHBondContact O-N 3.11Å; Q766-Q768 VanDerWaalsContact C-N 3.33Å; Q766-Q768 PolarHBondContact O-N 3.21Å; Q768-C772 PolarHBondContact NE2-SG 3.14Å; Q768-C772 VanDerWaalsContact NE2-SG 3.44Å; Q768-C772 WeakPolarHBondContact O-CB 3.23Å; Q768-C772 PolarHBondContact O-N 3.31Å; Q768-C772 PolarHBondContact O-SG 3.15Å
769	E	92	Very high	92.2	Very high	92 Å²	92	55 Å²	55	43%	0.43	31%	0.308	S	S	.	.	H	α-helix	trans	-67.5	-48.1	173.8	-73.1	172.1	-172.4	0	0	111.6	M765 Q766 M771 C772 H773	M765-E769 WeakPolarHBondContact O-CG 3.23Å; M765-E769 PolarHBondContact O-N 3.05Å; Q766-E769 PolarHBondContact O-N 3.06Å; E769-M771 VanDerWaalsContact C-N 3.33Å; E769-M771 PolarHBondContact O-N 3.08Å; E769-C772 CarbonylContact O-C 3.58Å; E769-C772 WeakPolarHBondContact O-CA 3.28Å; E769-C772 WeakPolarHBondContact O-CB 3.26Å; E769-C772 PolarHBondContact O-N 3.36Å; E769-H773 PolarHBondContact O-CD2 2.88Å; E769-H773 VanDerWaalsContact O-CD2 3.24Å; E769-H773 PolarHBondContact O-N 3.39Å
770	L	96.4	Very high	92.2	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-60.6	-40.7	174.8	-68.9	173.2	0	0	0	111.7	T737 I758 I762 Q766 L767 C772 H773 V774 L779 L808	T737-L770 HydrophobicContact CG2-CD2 3.79Å; I758-L770 HydrophobicContact CG2-CD1 3.81Å; I762-L770 HydrophobicContact CD1-CD1 4.13Å; I762-L770 HydrophobicContact CG2-CD1 4.17Å; Q766-L770 WeakPolarHBondContact O-CB 3.35Å; Q766-L770 WeakPolarHBondContact O-CG 3.45Å; Q766-L770 PolarHBondContact O-N 3.08Å; L767-L770 PolarHBondContact O-N 3.11Å; L770-C772 VanDerWaalsContact C-N 3.34Å; L770-C772 PolarHBondContact O-N 2.93Å; L770-H773 PolarHBondContact O-N 2.71Å; L770-V774 WeakPolarHBondContact O-CG2 3.41Å; L770-V774 PolarHBondContact O-N 2.99Å; L770-L779 HydrophobicContact CB-CD2 4.31Å; L770-L779 HydrophobicContact CD2-CD2 3.73Å; L770-L808 HydrophobicContact CB-CD2 3.84Å
771	M	96.8	Very high	92.4	Very high	33 Å²	33	56.4 Å²	56.4	16%	0.163	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-39.6	171.2	-73.6	174.7	73	0	0	112.4	L767 E769 V774 M775 Q807 L808 A811	L767-M771 HydrophobicContact CD1-CG 4.45Å; L767-M771 HydrophobicContact CD1-SD 4.43Å; L767-M771 HydrophobicContact CG-SD 4.17Å; L767-M771 WeakPolarHBondContact O-CB 3.5Å; L767-M771 WeakPolarHBondContact O-CG 3.45Å; L767-M771 PolarHBondContact O-N 2.84Å; E769-M771 VanDerWaalsContact C-N 3.33Å; E769-M771 PolarHBondContact O-N 3.08Å; M771-V774 PolarHBondContact O-N 3.39Å; M771-M775 WeakPolarHBondContact O-CB 3.41Å; M771-M775 VanDerWaalsContact O-CG 3.32Å; M771-M775 WeakPolarHBondContact O-CG 3.31Å; M771-M775 PolarHBondContact O-N 3.2Å; M771-Q807 HydrophobicContact CE-CB 4.1Å; M771-Q807 HydrophobicContact SD-CB 3.74Å; M771-L808 HydrophobicContact CG-CD2 4.11Å; M771-A811 HydrophobicContact CB-CB 4.22Å; M771-A811 HydrophobicContact CE-CB 4.46Å; M771-A811 HydrophobicContact CG-CB 4.15Å
772	C	93.8	Very high	92.7	Very high	56 Å²	56	54.1 Å²	54.1	38%	0.378	30%	0.298	S	S	.	.	H	α-helix	trans	-64	-44.2	173.2	-76	0	0	0	0	111.6	Q768 E769 L770 V774 M775 M776	Q768-C772 PolarHBondContact NE2-SG 3.14Å; Q768-C772 VanDerWaalsContact NE2-SG 3.44Å; Q768-C772 WeakPolarHBondContact O-CB 3.23Å; Q768-C772 PolarHBondContact O-N 3.31Å; Q768-C772 PolarHBondContact O-SG 3.15Å; E769-C772 CarbonylContact O-C 3.58Å; E769-C772 WeakPolarHBondContact O-CA 3.28Å; E769-C772 WeakPolarHBondContact O-CB 3.26Å; E769-C772 PolarHBondContact O-N 3.36Å; L770-C772 VanDerWaalsContact C-N 3.34Å; L770-C772 PolarHBondContact O-N 2.93Å; C772-V774 VanDerWaalsContact C-N 3.32Å; C772-V774 PolarHBondContact O-N 2.8Å; C772-M775 PolarHBondContact O-N 3.05Å; C772-M776 WeakPolarHBondContact O-CB 3.32Å; C772-M776 VanDerWaalsContact O-CG 3.25Å; C772-M776 WeakPolarHBondContact O-CG 3.44Å; C772-M776 PolarHBondContact O-N 3.47Å
773	H	96.2	Very high	92.7	Very high	69 Å²	69	57 Å²	57	32%	0.319	31%	0.309	S	S	.	.	H	α-helix	trans	-58.4	-43.3	174.5	-81.3	-82.1	0	0	0	111.8	P738 E769 L770 M776 G777 N778 L779	P738-H773 HydrophobicContact CG-CB 4.44Å; E769-H773 PolarHBondContact O-CD2 2.88Å; E769-H773 VanDerWaalsContact O-CD2 3.24Å; E769-H773 PolarHBondContact O-N 3.39Å; L770-H773 PolarHBondContact O-N 2.71Å; H773-M776 PolarHBondContact O-N 3.03Å; H773-G777 PolarHBondContact O-N 3.44Å; H773-N778 HydrophobicContact CB-CB 4.28Å; H773-N778 WeakPolarHBondContact O-CA 3.42Å; H773-N778 PolarHBondContact O-N 3.11Å; H773-L779 HydrophobicContact CB-CB 3.8Å; H773-L779 HydrophobicContact CB-CD2 4.29Å; H773-L779 PolarHBondContact O-N 3.27Å
774	V	97.2	Very high	93	Very high	12 Å²	12	61.4 Å²	61.4	7%	0.073	33%	0.325	C	S	.	.	H	α-helix	trans	-60.9	-49.6	173.6	171.3	0	0	0	0	111.6	L770 M771 C772 M776 G777 L779 A811 H812	L770-V774 WeakPolarHBondContact O-CG2 3.41Å; L770-V774 PolarHBondContact O-N 2.99Å; M771-V774 PolarHBondContact O-N 3.39Å; C772-V774 VanDerWaalsContact C-N 3.32Å; C772-V774 PolarHBondContact O-N 2.8Å; V774-M776 VanDerWaalsContact C-N 3.26Å; V774-M776 PolarHBondContact O-N 2.79Å; V774-G777 PolarHBondContact O-N 2.73Å; V774-L779 WeakPolarHBondContact CA-O 3.43Å; V774-L779 HydrophobicContact CG2-CB 4.12Å; V774-L779 HydrophobicContact CG2-CD2 3.99Å; V774-L779 HydrophobicContact CG2-CG 3.87Å; V774-A811 HydrophobicContact CB-CB 4.03Å; V774-A811 VanDerWaalsContact CG1-C 3.49Å; V774-A811 HydrophobicContact CG1-CB 3.68Å; V774-A811 WeakPolarHBondContact CG1-O 3.43Å; V774-H812 HydrophobicContact CG1-CB 4.42Å; V774-H812 WeakPolarHBondContact CG1-ND1 3.45Å; V774-H812 VanDerWaalsContact CG2-CE1 3.48Å; V774-H812 WeakPolarHBondContact CG2-CE1 3.44Å
775	M	93.2	Very high	93.3	Very high	140 Å²	140	62.6 Å²	62.6	69%	0.69	33%	0.326	S	S	*	.	H	α-helix	trans	-67.6	-23.9	-178.4	-72.1	-178.1	65.5	0	0	113.6	M771 C772 G777 A811	M771-M775 WeakPolarHBondContact O-CB 3.41Å; M771-M775 VanDerWaalsContact O-CG 3.32Å; M771-M775 WeakPolarHBondContact O-CG 3.31Å; M771-M775 PolarHBondContact O-N 3.2Å; C772-M775 PolarHBondContact O-N 3.05Å; M775-G777 VanDerWaalsContact C-N 3.35Å; M775-A811 HydrophobicContact CG-CB 4.16Å
776	M	93.3	Very high	93.5	Very high	139 Å²	139	58.5 Å²	58.5	69%	0.685	31%	0.306	S	S	*	.	H	α-helix	trans	-82.3	-10.5	171.9	-70.1	175.9	71.2	0	0	113.3	C772 H773 V774 N778	C772-M776 WeakPolarHBondContact O-CB 3.32Å; C772-M776 VanDerWaalsContact O-CG 3.25Å; C772-M776 WeakPolarHBondContact O-CG 3.44Å; C772-M776 PolarHBondContact O-N 3.47Å; H773-M776 PolarHBondContact O-N 3.03Å; V774-M776 VanDerWaalsContact C-N 3.26Å; V774-M776 PolarHBondContact O-N 2.79Å; M776-N778 VanDerWaalsContact C-N 3.34Å
777	G	92.2	Very high	93.6	Very high	59 Å²	59	57.2 Å²	57.2	61%	0.608	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	10.6	-174	0	0	0	0	0	114.6	H773 V774 M775	H773-G777 PolarHBondContact O-N 3.44Å; V774-G777 PolarHBondContact O-N 2.73Å; M775-G777 VanDerWaalsContact C-N 3.35Å
778	N	92.5	Very high	93.6	Very high	85 Å²	85	58.2 Å²	58.2	46%	0.455	31%	0.306	S	S	.	.	S	Bend	trans	-86.6	-7.2	-179.2	-64.5	-22.1	0	0	0	113.4	H773 M776	H773-N778 HydrophobicContact CB-CB 4.28Å; H773-N778 WeakPolarHBondContact O-CA 3.42Å; H773-N778 PolarHBondContact O-N 3.11Å; M776-N778 VanDerWaalsContact C-N 3.34Å
779	L	96.8	Very high	93.7	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.021	31%	0.31	C	S	.	.			trans	-148.3	136.7	-179.7	170.5	59.5	0	0	0	109.4	T737 P738 Y741 L770 H773 V774 M781	T737-L779 HydrophobicContact CG2-CD1 4.08Å; T737-L779 HydrophobicContact CG2-CD2 4.11Å; P738-L779 HydrophobicContact CB-CB 4.5Å; Y741-L779 HydrophobicContact CD2-CD1 3.86Å; Y741-L779 HydrophobicContact CG-CD1 3.87Å; L770-L779 HydrophobicContact CB-CD2 4.31Å; L770-L779 HydrophobicContact CD2-CD2 3.73Å; H773-L779 HydrophobicContact CB-CB 3.8Å; H773-L779 HydrophobicContact CB-CD2 4.29Å; H773-L779 PolarHBondContact O-N 3.27Å; V774-L779 WeakPolarHBondContact CA-O 3.43Å; V774-L779 HydrophobicContact CG2-CB 4.12Å; V774-L779 HydrophobicContact CG2-CD2 3.99Å; V774-L779 HydrophobicContact CG2-CG 3.87Å; L779-M781 HydrophobicContact CD1-CG 3.68Å; L779-M781 HydrophobicContact CD2-CG 4.05Å; L779-M781 HydrophobicContact CD2-SD 3.95Å; L779-M781 HydrophobicContact CG-CG 3.82Å; L779-M781 HydrophobicContact CG-SD 4.39Å
780	V	96.1	Very high	93.9	Very high	70 Å²	70	54.2 Å²	54.2	42%	0.424	29%	0.29	S	S	.	.			trans	-130.8	119.4	169.7	178.4	0	0	0	0	107.5	Y741 L749	Y741-V780 WeakPolarHBondContact CB-O 3.39Å; Y741-V780 WeakPolarHBondContact CD1-O 3.34Å; L749-V780 WeakPolarHBondContact CD2-O 3.41Å
781	M	95.4	Very high	93.9	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.01	29%	0.29	C	S	.	.			trans	-109.8	-7.7	179.4	-57.1	-178.3	91.3	0	0	113.1	T737 Y741 L749 L755 I758 L779 L808 H812	T737-M781 HydrophobicContact CG2-CE 4.26Å; Y741-M781 HydrophobicContact CD1-CG 4.46Å; Y741-M781 HydrophobicContact CD2-CE 4.45Å; Y741-M781 HydrophobicContact CD2-CG 4.41Å; Y741-M781 HydrophobicContact CE1-CB 4.18Å; Y741-M781 HydrophobicContact CE1-CG 4.31Å; Y741-M781 HydrophobicContact CE2-CE 3.64Å; Y741-M781 HydrophobicContact CE2-CG 4.25Å; L749-M781 VanDerWaalsContact CD2-O 3.29Å; L749-M781 WeakPolarHBondContact CD2-O 3.4Å; L755-M781 HydrophobicContact CD1-CE 3.61Å; L755-M781 HydrophobicContact CD1-SD 4.26Å; I758-M781 HydrophobicContact CD1-CE 3.71Å; I758-M781 HydrophobicContact CG2-CE 4.42Å; L779-M781 HydrophobicContact CD1-CG 3.68Å; L779-M781 HydrophobicContact CD2-CG 4.05Å; L779-M781 HydrophobicContact CD2-SD 3.95Å; L779-M781 HydrophobicContact CG-CG 3.82Å; L779-M781 HydrophobicContact CG-SD 4.39Å; M781-L808 HydrophobicContact CE-CD1 4.46Å; M781-L808 HydrophobicContact SD-CD1 3.95Å; M781-L808 HydrophobicContact SD-CD2 4.07Å; M781-L808 HydrophobicContact SD-CG 4.43Å; M781-H812 PolarHBondContact N-NE2 3.05Å
782	F	95.1	Very high	93.8	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.018	29%	0.293	C	S	.	.			trans	-137.3	130.9	-179.1	-59.2	-80	0	0	0	111.7	L755 V787 I790 T805 L808 F809 H812 I814	L755-F782 HydrophobicContact CD1-CZ 4.35Å; L755-F782 HydrophobicContact CD2-CE1 3.49Å; L755-F782 VanDerWaalsContact CD2-CE1 3.49Å; L755-F782 HydrophobicContact CD2-CZ 3.54Å; F782-V787 HydrophobicContact CB-CB 4.12Å; F782-V787 HydrophobicContact CB-CG2 3.93Å; F782-V787 HydrophobicContact CD1-CB 4.3Å; F782-V787 HydrophobicContact CD1-CG2 3.75Å; F782-V787 HydrophobicContact CG-CG2 4.04Å; F782-I790 HydrophobicContact CD1-CG2 4.4Å; F782-I790 HydrophobicContact CE1-CG2 3.92Å; F782-T805 HydrophobicContact CZ-CG2 4.27Å; F782-L808 HydrophobicContact CE2-CB 4.01Å; F782-F809 HydrophobicContact CD2-CB 4.33Å; F782-F809 HydrophobicContact CE2-CB 3.91Å; F782-F809 HydrophobicContact CZ-CB 4.1Å; F782-H812 AromaticContact CD2-CE1 3.57Å; F782-H812 AromaticContact CD2-ND1 3.66Å; F782-H812 AromaticContact CD2-NE2 3.95Å; F782-H812 PolarHBondContact N-NE2 3.35Å; F782-I814 HydrophobicContact CB-CD1 3.62Å
783	R	90	Very high	93.9	Very high	62 Å²	62	55.9 Å²	55.9	23%	0.234	29%	0.293	C	S	.	.			trans	-107.7	156.8	167.5	-54.3	-170	-46.1	-147.3	13.1	110.9	P745 D746 L749 D785 S786 V787	P745-R783 PolarHBondContact O-NH1 3.07Å; D746-R783 IonicContact OD1-CZ 2.68Å; D746-R783 IonicContact OD1-NH1 3.95Å; D746-R783 PolarHBondContact OD1-NH1 2.83Å; D746-R783 IonicContact OD1-NH2 2.63Å; D746-R783 PolarHBondContact OD1-NH2 3.13Å; L749-R783 HydrophobicContact CB-CG 3.85Å; L749-R783 HydrophobicContact CD1-CG 3.58Å; L749-R783 HydrophobicContact CD2-CG 4.35Å; L749-R783 HydrophobicContact CG-CG 4.13Å; R783-D785 WeakPolarHBondContact CB-OD1 3.29Å; R783-D785 IonicContact CZ-OD2 2.67Å; R783-D785 IonicContact NE-OD1 3.43Å; R783-D785 PolarHBondContact NE-OD1 3.05Å; R783-D785 IonicContact NE-OD2 3.76Å; R783-D785 PolarHBondContact NE-OD2 3.03Å; R783-D785 IonicContact NH2-OD2 3.37Å; R783-D785 PolarHBondContact NH2-OD2 3.21Å; R783-D785 PolarHBondContact O-N 2.94Å; R783-S786 PolarHBondContact O-N 3.22Å; R783-V787 WeakPolarHBondContact O-CB 3.37Å; R783-V787 VanDerWaalsContact O-CG1 3.24Å; R783-V787 WeakPolarHBondContact O-CG1 3.13Å; R783-V787 PolarHBondContact O-N 3.25Å
784	K	89.6	Confident	93.9	Very high	142 Å²	142	52.6 Å²	52.6	62%	0.617	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.2	-175	-66.7	177.5	-178.3	171.5	0	114.1	T818	K784-T818 HydrophobicContact CB-CG2 4.36Å
785	D	87.3	Confident	93.9	Very high	102 Å²	102	52.7 Å²	52.7	55%	0.545	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-39.7	175.7	52.6	-51.2	0	0	0	113.1	R783	R783-D785 WeakPolarHBondContact CB-OD1 3.29Å; R783-D785 IonicContact CZ-OD2 2.67Å; R783-D785 IonicContact NE-OD1 3.43Å; R783-D785 PolarHBondContact NE-OD1 3.05Å; R783-D785 IonicContact NE-OD2 3.76Å; R783-D785 PolarHBondContact NE-OD2 3.03Å; R783-D785 IonicContact NH2-OD2 3.37Å; R783-D785 PolarHBondContact NH2-OD2 3.21Å; R783-D785 PolarHBondContact O-N 2.94Å
786	S	90.6	Very high	93.9	Very high	8 Å²	8	54.9 Å²	54.9	6%	0.056	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-28.4	-174	58.3	0	0	0	0	114.8	L749 R783 L788 N789 I790	L749-S786 WeakPolarHBondContact O-CB 3.45Å; L749-S786 PolarHBondContact O-OG 2.82Å; R783-S786 PolarHBondContact O-N 3.22Å; S786-L788 VanDerWaalsContact C-N 3.29Å; S786-L788 PolarHBondContact O-N 3.41Å; S786-L788 VanDerWaalsContact O-N 3.09Å; S786-N789 WeakPolarHBondContact O-CB 3.25Å; S786-N789 PolarHBondContact O-N 3.15Å; S786-I790 PolarHBondContact O-N 3.26Å
787	V	94.9	Very high	94	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-52	-38.7	-169.7	62.1	0	0	0	0	114.9	F782 R783 L791 F809 I814 T818 I819	F782-V787 HydrophobicContact CB-CB 4.12Å; F782-V787 HydrophobicContact CB-CG2 3.93Å; F782-V787 HydrophobicContact CD1-CB 4.3Å; F782-V787 HydrophobicContact CD1-CG2 3.75Å; F782-V787 HydrophobicContact CG-CG2 4.04Å; R783-V787 WeakPolarHBondContact O-CB 3.37Å; R783-V787 VanDerWaalsContact O-CG1 3.24Å; R783-V787 WeakPolarHBondContact O-CG1 3.13Å; R783-V787 PolarHBondContact O-N 3.25Å; V787-L791 HydrophobicContact CG2-CD1 3.98Å; V787-L791 HydrophobicContact CG2-CG 4.32Å; V787-L791 WeakPolarHBondContact O-CB 3.26Å; V787-L791 VanDerWaalsContact O-CG 3.3Å; V787-L791 WeakPolarHBondContact O-CG 3.15Å; V787-L791 PolarHBondContact O-N 3.43Å; V787-F809 HydrophobicContact CG2-CD2 3.62Å; V787-F809 HydrophobicContact CG2-CE2 3.74Å; V787-I814 HydrophobicContact CB-CD1 4.49Å; V787-I814 HydrophobicContact CG1-CG2 4.5Å; V787-I814 HydrophobicContact CG2-CD1 4.28Å; V787-T818 HydrophobicContact CG1-CG2 4.03Å; V787-I819 HydrophobicContact CB-CG2 4.41Å; V787-I819 HydrophobicContact CG1-CG2 3.79Å; V787-I819 HydrophobicContact CG2-CG2 3.84Å
788	L	94.7	Very high	94	Very high	39 Å²	39	53.4 Å²	53.4	20%	0.204	26%	0.261	C	S	.	.	H	α-helix	trans	-66	-39.8	178	174.9	60.3	0	0	0	111.8	S786 I792 P821 I822	S786-L788 VanDerWaalsContact C-N 3.29Å; S786-L788 PolarHBondContact O-N 3.41Å; S786-L788 VanDerWaalsContact O-N 3.09Å; L788-I792 HydrophobicContact CD1-CD1 3.9Å; L788-I792 HydrophobicContact CD1-CG1 4.37Å; L788-I792 HydrophobicContact CG-CD1 3.99Å; L788-I792 WeakPolarHBondContact O-CD1 3.48Å; L788-I792 WeakPolarHBondContact O-CG1 3.49Å; L788-I792 PolarHBondContact O-N 3.08Å; L788-P821 HydrophobicContact CD1-CB 4.44Å; L788-P821 HydrophobicContact CD2-CB 4.05Å; L788-P821 HydrophobicContact CD2-CG 4.12Å; L788-I822 HydrophobicContact CD1-CB 3.96Å
789	N	93.9	Very high	93.9	Very high	106 Å²	106	53 Å²	53	57%	0.567	26%	0.262	S	S	*	.	H	α-helix	trans	-71.2	-41.8	179.4	-61.9	-26.2	0	0	0	110.9	S786 I792 Q793	S786-N789 WeakPolarHBondContact O-CB 3.25Å; S786-N789 PolarHBondContact O-N 3.15Å; N789-I792 PolarHBondContact O-N 3.45Å; N789-Q793 PolarHBondContact O-N 2.96Å
790	I	95.4	Very high	93.5	Very high	4 Å²	4	55.5 Å²	55.5	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-45.3	176.4	-63.3	171.3	0	0	0	110.5	L755 F782 S786 I792 Q793 S794	L755-I790 HydrophobicContact CD2-CG2 3.56Å; F782-I790 HydrophobicContact CD1-CG2 4.4Å; F782-I790 HydrophobicContact CE1-CG2 3.92Å; S786-I790 PolarHBondContact O-N 3.26Å; I790-I792 VanDerWaalsContact C-N 3.3Å; I790-I792 PolarHBondContact O-N 2.68Å; I790-Q793 WeakPolarHBondContact O-CB 3.41Å; I790-Q793 PolarHBondContact O-N 2.91Å; I790-S794 PolarHBondContact O-N 3.26Å
791	L	96.6	Very high	93.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.1	-31.1	175.6	-69.5	174.5	0	0	0	112.6	V787 S794 T805 W806 F809 I819 I822	V787-L791 HydrophobicContact CG2-CD1 3.98Å; V787-L791 HydrophobicContact CG2-CG 4.32Å; V787-L791 WeakPolarHBondContact O-CB 3.26Å; V787-L791 VanDerWaalsContact O-CG 3.3Å; V787-L791 WeakPolarHBondContact O-CG 3.15Å; V787-L791 PolarHBondContact O-N 3.43Å; L791-S794 WeakPolarHBondContact CA-OG 3.31Å; L791-S794 PolarHBondContact O-N 3.03Å; L791-S794 PolarHBondContact O-OG 3.43Å; L791-T805 HydrophobicContact CD2-CG2 3.73Å; L791-W806 HydrophobicContact CD1-CH2 4.03Å; L791-W806 HydrophobicContact CD1-CZ2 4.49Å; L791-W806 HydrophobicContact CD1-CZ3 4.26Å; L791-W806 HydrophobicContact CD2-CZ2 4.37Å; L791-F809 HydrophobicContact CD1-CD1 4.44Å; L791-F809 HydrophobicContact CD1-CD2 4.13Å; L791-F809 HydrophobicContact CD1-CE2 4.36Å; L791-F809 HydrophobicContact CD1-CG 4.19Å; L791-F809 HydrophobicContact CD2-CB 4.46Å; L791-I819 HydrophobicContact CD1-CB 4Å; L791-I819 HydrophobicContact CD1-CG1 4.26Å; L791-I819 HydrophobicContact CD1-CG2 3.75Å; L791-I822 HydrophobicContact CB-CD1 3.62Å
792	I	95.4	Very high	93.5	Very high	43 Å²	43	53.8 Å²	53.8	22%	0.221	26%	0.26	C	S	.	.	H	α-helix	trans	-68.7	-41.1	172	-72.3	162.7	0	0	0	111.3	L788 N789 I790 S794 L795 I822	L788-I792 HydrophobicContact CD1-CD1 3.9Å; L788-I792 HydrophobicContact CD1-CG1 4.37Å; L788-I792 HydrophobicContact CG-CD1 3.99Å; L788-I792 WeakPolarHBondContact O-CD1 3.48Å; L788-I792 WeakPolarHBondContact O-CG1 3.49Å; L788-I792 PolarHBondContact O-N 3.08Å; N789-I792 PolarHBondContact O-N 3.45Å; I790-I792 VanDerWaalsContact C-N 3.3Å; I790-I792 PolarHBondContact O-N 2.68Å; I792-S794 VanDerWaalsContact C-N 3.28Å; I792-S794 PolarHBondContact O-N 3.46Å; I792-L795 WeakPolarHBondContact O-CB 3.38Å; I792-L795 WeakPolarHBondContact O-CG 3.38Å; I792-L795 PolarHBondContact O-N 3.37Å; I792-I822 HydrophobicContact CG1-CD1 4.14Å; I792-I822 HydrophobicContact CG1-CG1 3.95Å
793	Q	95.3	Very high	93.6	Very high	84 Å²	84	58 Å²	58	39%	0.393	28%	0.276	S	S	.	.	H	α-helix	trans	-60.5	-39.3	173.7	-175.3	-179.7	0.8	0	0	111.2	N789 I790 L795 E796 W797	N789-Q793 PolarHBondContact O-N 2.96Å; I790-Q793 WeakPolarHBondContact O-CB 3.41Å; I790-Q793 PolarHBondContact O-N 2.91Å; Q793-L795 PolarHBondContact O-N 3.02Å; Q793-L795 VanDerWaalsContact O-N 3.1Å; Q793-E796 PolarHBondContact O-N 3.05Å; Q793-W797 HydrophobicContact CG-CZ2 4.11Å; Q793-W797 PolarHBondContact O-NE1 2.87Å
794	S	97.1	Very high	93.8	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-65.5	-10.5	179.1	74.1	0	0	0	0	115.6	I790 L791 I792 E796 W797 Q802	I790-S794 PolarHBondContact O-N 3.26Å; L791-S794 WeakPolarHBondContact CA-OG 3.31Å; L791-S794 PolarHBondContact O-N 3.03Å; L791-S794 PolarHBondContact O-OG 3.43Å; I792-S794 VanDerWaalsContact C-N 3.28Å; I792-S794 PolarHBondContact O-N 3.46Å; S794-E796 PolarHBondContact O-N 2.89Å; S794-W797 VanDerWaalsContact CA-CD2 3.47Å; S794-W797 WeakPolarHBondContact O-CB 3.37Å; S794-W797 PolarHBondContact O-N 2.83Å; S794-W797 VanDerWaalsContact O-N 3.16Å; S794-Q802 VanDerWaalsContact O-CD 3.32Å; S794-Q802 WeakPolarHBondContact O-CG 3.35Å
795	L	95.9	Very high	94.2	Very high	13 Å²	13	48.3 Å²	48.3	7%	0.068	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-69.8	-13.8	178.2	-56.7	-178.6	0	0	0	113.3	I792 Q793 I822 H825 L826 H831 A834	I792-L795 WeakPolarHBondContact O-CB 3.38Å; I792-L795 WeakPolarHBondContact O-CG 3.38Å; I792-L795 PolarHBondContact O-N 3.37Å; Q793-L795 PolarHBondContact O-N 3.02Å; Q793-L795 VanDerWaalsContact O-N 3.1Å; L795-I822 HydrophobicContact CD1-CD1 4.44Å; L795-I822 HydrophobicContact CD1-CG1 4.31Å; L795-I822 HydrophobicContact CD2-CD1 4.33Å; L795-H825 HydrophobicContact CD1-CB 3.96Å; L795-L826 HydrophobicContact CD1-CD2 3.95Å; L795-L826 HydrophobicContact CD2-CD2 3.5Å; L795-L826 HydrophobicContact CG-CD2 4.38Å; L795-H831 HydrophobicContact CD2-CB 4.48Å; L795-A834 HydrophobicContact CD2-CB 3.78Å
796	E	93.5	Very high	94.7	Very high	186 Å²	186	43.5 Å²	43.5	87%	0.869	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-99.4	0.9	176.3	-58	-174.6	167.1	0	0	112.7	Q793 S794	Q793-E796 PolarHBondContact O-N 3.05Å; S794-E796 PolarHBondContact O-N 2.89Å
797	W	96.1	Very high	95	Very high	29 Å²	29	46.2 Å²	46.2	11%	0.11	22%	0.222	C	C	.	.	S	Bend	trans	-87.5	163.3	-178.7	-62.2	-0.8	0	0	0	112.2	G752 L755 N756 V759 Q793 S794 E801 Q802 T805	G752-W797 WeakPolarHBondContact O-CH2 3.49Å; L755-W797 HydrophobicContact CB-CH2 4.41Å; L755-W797 HydrophobicContact CD2-CH2 4.13Å; L755-W797 HydrophobicContact CD2-CZ3 4.21Å; L755-W797 HydrophobicContact CG-CH2 4.17Å; L755-W797 HydrophobicContact CG-CZ3 4.14Å; N756-W797 HydrophobicContact CB-CD2 4.26Å; N756-W797 HydrophobicContact CB-CE3 4.37Å; N756-W797 HydrophobicContact CB-CH2 3.73Å; N756-W797 HydrophobicContact CB-CZ2 3.59Å; N756-W797 HydrophobicContact CB-CZ3 4.11Å; V759-W797 HydrophobicContact CG2-CE3 3.87Å; V759-W797 HydrophobicContact CG2-CZ3 3.88Å; Q793-W797 HydrophobicContact CG-CZ2 4.11Å; Q793-W797 PolarHBondContact O-NE1 2.87Å; S794-W797 VanDerWaalsContact CA-CD2 3.47Å; S794-W797 WeakPolarHBondContact O-CB 3.37Å; S794-W797 PolarHBondContact O-N 2.83Å; S794-W797 VanDerWaalsContact O-N 3.16Å; W797-E801 HydrophobicContact CB-CB 3.9Å; W797-E801 VanDerWaalsContact CB-OE2 3.28Å; W797-E801 WeakPolarHBondContact CB-OE2 3.13Å; W797-E801 HydrophobicContact CE3-CB 4.41Å; W797-Q802 HydrophobicContact CB-CG 4.26Å; W797-Q802 PolarHBondContact O-NE2 3.29Å; W797-T805 HydrophobicContact CZ3-CG2 4.32Å; W797-T805 VanDerWaalsContact CZ3-OG1 3.31Å; W797-T805 WeakPolarHBondContact CZ3-OG1 3.37Å
798	E	91.4	Very high	95.1	Very high	139 Å²	139	46.2 Å²	46.2	65%	0.65	22%	0.222	S	C	*	.			trans	-64.6	161	-179.5	-65	-154.3	165.7	0	0	113.1	F800 E801 Q802	E798-F800 VanDerWaalsContact C-N 3.31Å; E798-F800 PolarHBondContact O-N 2.95Å; E798-E801 HydrophobicContact CB-CB 4.49Å; E798-E801 HydrophobicContact CB-CG 4.07Å; E798-E801 PolarHBondContact N-OE2 3.32Å; E798-E801 WeakPolarHBondContact O-CB 3.29Å; E798-E801 PolarHBondContact O-N 3.38Å; E798-E801 VanDerWaalsContact O-N 3.14Å; E798-Q802 PolarHBondContact O-N 2.56Å
799	T	90.6	Very high	95.2	Very high	76 Å²	76	44.5 Å²	44.5	47%	0.466	21%	0.213	S	C	.	.	H	α-helix	trans	-53.2	-43.1	-176.7	-66.7	0	0	0	0	113.3	Y803 E833	T799-Y803 HydrophobicContact CG2-CD2 3.91Å; T799-Y803 HydrophobicContact CG2-CE2 3.72Å; T799-Y803 WeakPolarHBondContact O-CD2 3.47Å; T799-Y803 PolarHBondContact O-N 2.89Å; T799-Y803 VanDerWaalsContact O-N 3.13Å; T799-E833 WeakPolarHBondContact CB-OE1 3.21Å; T799-E833 HydrophobicContact CG2-CG 3.88Å; T799-E833 WeakPolarHBondContact CG2-OE1 3.36Å; T799-E833 PolarHBondContact OG1-OE1 3.46Å
800	F	88.9	Confident	95.2	Very high	57 Å²	57	41.9 Å²	41.9	25%	0.25	20%	0.199	C	C	.	.	H	α-helix	trans	-72	-44.9	177.7	-179	-94.4	0	0	0	111.8	I762 E798 Q802 Y803 S804	I762-F800 HydrophobicContact CG1-CE1 4.34Å; I762-F800 WeakPolarHBondContact O-CE1 3.36Å; I762-F800 WeakPolarHBondContact O-CZ 3.47Å; E798-F800 VanDerWaalsContact C-N 3.31Å; E798-F800 PolarHBondContact O-N 2.95Å; F800-Q802 PolarHBondContact O-N 2.78Å; F800-Y803 PolarHBondContact O-N 3.21Å; F800-S804 WeakPolarHBondContact CE1-OG 3.33Å; F800-S804 VanDerWaalsContact CZ-OG 3.24Å; F800-S804 WeakPolarHBondContact CZ-OG 3.27Å; F800-S804 WeakPolarHBondContact O-CB 3.36Å; F800-S804 PolarHBondContact O-N 3.24Å; F800-S804 PolarHBondContact O-OG 2.93Å
801	E	95.6	Very high	95.2	Very high	29 Å²	29	42.4 Å²	42.4	14%	0.136	20%	0.203	C	C	.	.	H	α-helix	trans	-53.8	-43.4	176.5	-61.5	178.5	154.8	0	0	111.2	V759 A760 W797 E798 T805	V759-E801 HydrophobicContact CB-CB 4.45Å; V759-E801 HydrophobicContact CG2-CB 3.74Å; V759-E801 HydrophobicContact CG2-CG 4.17Å; A760-E801 WeakPolarHBondContact CA-OE1 3.28Å; A760-E801 WeakPolarHBondContact CB-OE1 3.24Å; W797-E801 HydrophobicContact CB-CB 3.9Å; W797-E801 VanDerWaalsContact CB-OE2 3.28Å; W797-E801 WeakPolarHBondContact CB-OE2 3.13Å; W797-E801 HydrophobicContact CE3-CB 4.41Å; E798-E801 HydrophobicContact CB-CB 4.49Å; E798-E801 HydrophobicContact CB-CG 4.07Å; E798-E801 PolarHBondContact N-OE2 3.32Å; E798-E801 WeakPolarHBondContact O-CB 3.29Å; E798-E801 PolarHBondContact O-N 3.38Å; E798-E801 VanDerWaalsContact O-N 3.14Å; E801-T805 WeakPolarHBondContact O-CB 3.47Å; E801-T805 PolarHBondContact O-N 3.43Å; E801-T805 PolarHBondContact O-OG1 3.38Å
802	Q	96.7	Very high	95.2	Very high	6 Å²	6	43.3 Å²	43.3	3%	0.028	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-51.4	172.6	-76.6	-168.4	57.9	0	0	112.5	S794 W797 E798 F800 S804 T805 W806 E833	S794-Q802 VanDerWaalsContact O-CD 3.32Å; S794-Q802 WeakPolarHBondContact O-CG 3.35Å; W797-Q802 HydrophobicContact CB-CG 4.26Å; W797-Q802 PolarHBondContact O-NE2 3.29Å; E798-Q802 PolarHBondContact O-N 2.56Å; F800-Q802 PolarHBondContact O-N 2.78Å; Q802-S804 VanDerWaalsContact C-N 3.33Å; Q802-S804 PolarHBondContact O-N 3.41Å; Q802-T805 WeakPolarHBondContact O-CB 3.42Å; Q802-T805 PolarHBondContact O-N 2.94Å; Q802-W806 PolarHBondContact O-N 3.48Å; Q802-E833 HydrophobicContact CB-CB 3.95Å; Q802-E833 HydrophobicContact CB-CG 4.25Å
803	Y	95.3	Very high	94.9	Very high	92 Å²	92	47.4 Å²	47.4	36%	0.361	24%	0.24	S	C	.	.	H	α-helix	trans	-60.4	-42	-179.9	-82.2	-59	0	0	0	112.6	T799 F800 W806 Q807 E833	T799-Y803 HydrophobicContact CG2-CD2 3.91Å; T799-Y803 HydrophobicContact CG2-CE2 3.72Å; T799-Y803 WeakPolarHBondContact O-CD2 3.47Å; T799-Y803 PolarHBondContact O-N 2.89Å; T799-Y803 VanDerWaalsContact O-N 3.13Å; F800-Y803 PolarHBondContact O-N 3.21Å; Y803-W806 PolarHBondContact O-N 3.34Å; Y803-Q807 WeakPolarHBondContact O-CG 3.44Å; Y803-Q807 PolarHBondContact O-N 2.93Å; Y803-Q807 PolarHBondContact O-NE2 3.48Å; Y803-E833 HydrophobicContact CD2-CG 4.07Å; Y803-E833 HydrophobicContact CE1-CB 4.31Å; Y803-E833 HydrophobicContact CE2-CB 4.25Å; Y803-E833 HydrophobicContact CE2-CG 3.63Å
804	S	95.9	Very high	94.9	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.007	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-46.6	175.9	-68.2	0	0	0	0	111.6	F800 Q802 W806 Q807 L808	F800-S804 WeakPolarHBondContact CE1-OG 3.33Å; F800-S804 VanDerWaalsContact CZ-OG 3.24Å; F800-S804 WeakPolarHBondContact CZ-OG 3.27Å; F800-S804 WeakPolarHBondContact O-CB 3.36Å; F800-S804 PolarHBondContact O-N 3.24Å; F800-S804 PolarHBondContact O-OG 2.93Å; Q802-S804 VanDerWaalsContact C-N 3.33Å; Q802-S804 PolarHBondContact O-N 3.41Å; S804-W806 VanDerWaalsContact C-N 3.34Å; S804-W806 PolarHBondContact O-N 3.38Å; S804-Q807 PolarHBondContact O-N 3.09Å; S804-Q807 VanDerWaalsContact O-N 3.16Å; S804-L808 WeakPolarHBondContact O-CB 3.45Å; S804-L808 WeakPolarHBondContact O-CG 3.35Å; S804-L808 PolarHBondContact O-N 3.1Å
805	T	97.4	Very high	94.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-56.1	-46	172.8	-64.4	0	0	0	0	111.9	L755 F782 L791 W797 E801 Q802 F809	L755-T805 HydrophobicContact CD2-CG2 4.17Å; F782-T805 HydrophobicContact CZ-CG2 4.27Å; L791-T805 HydrophobicContact CD2-CG2 3.73Å; W797-T805 HydrophobicContact CZ3-CG2 4.32Å; W797-T805 VanDerWaalsContact CZ3-OG1 3.31Å; W797-T805 WeakPolarHBondContact CZ3-OG1 3.37Å; E801-T805 WeakPolarHBondContact O-CB 3.47Å; E801-T805 PolarHBondContact O-N 3.43Å; E801-T805 PolarHBondContact O-OG1 3.38Å; Q802-T805 WeakPolarHBondContact O-CB 3.42Å; Q802-T805 PolarHBondContact O-N 2.94Å; T805-F809 WeakPolarHBondContact O-CB 3.48Å; T805-F809 PolarHBondContact O-N 3.47Å
806	W	97	Very high	94.4	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-67.4	-37	176.4	-80.8	101	0	0	0	112.6	L791 Q802 Y803 S804 F809 L810 I819 I822 A834 C837 L838	L791-W806 HydrophobicContact CD1-CH2 4.03Å; L791-W806 HydrophobicContact CD1-CZ2 4.49Å; L791-W806 HydrophobicContact CD1-CZ3 4.26Å; L791-W806 HydrophobicContact CD2-CZ2 4.37Å; Q802-W806 PolarHBondContact O-N 3.48Å; Y803-W806 PolarHBondContact O-N 3.34Å; S804-W806 VanDerWaalsContact C-N 3.34Å; S804-W806 PolarHBondContact O-N 3.38Å; W806-F809 AromaticContact CE3-CD1 3.84Å; W806-F809 HydrophobicContact CE3-CD1 3.84Å; W806-F809 HydrophobicContact CE3-CE1 4.39Å; W806-F809 AromaticContact CZ3-CD1 3.88Å; W806-F809 HydrophobicContact CZ3-CD1 3.88Å; W806-F809 HydrophobicContact CZ3-CE1 4.03Å; W806-L810 WeakPolarHBondContact O-CB 3.28Å; W806-L810 VanDerWaalsContact O-CD1 3.29Å; W806-L810 WeakPolarHBondContact O-CD1 3.27Å; W806-L810 WeakPolarHBondContact O-CG 3.32Å; W806-L810 PolarHBondContact O-N 2.95Å; W806-I819 HydrophobicContact CH2-CD1 4.24Å; W806-I819 HydrophobicContact CZ3-CD1 4.32Å; W806-I822 HydrophobicContact CH2-CG2 4.49Å; W806-I822 HydrophobicContact CZ2-CD1 4.19Å; W806-A834 HydrophobicContact CZ2-CB 3.92Å; W806-C837 HydrophobicContact CB-CB 4.17Å; W806-C837 HydrophobicContact CD2-CB 3.98Å; W806-C837 HydrophobicContact CE3-CB 4.22Å; W806-C837 HydrophobicContact CG-CB 3.93Å; W806-L838 HydrophobicContact CH2-CD1 3.89Å; W806-L838 HydrophobicContact CH2-CD2 3.64Å; W806-L838 HydrophobicContact CH2-CG 3.65Å; W806-L838 HydrophobicContact CZ2-CD1 4.23Å; W806-L838 HydrophobicContact CZ2-CG 4.23Å; W806-L838 HydrophobicContact CZ3-CD2 3.75Å; W806-L838 HydrophobicContact CZ3-CG 4Å
807	Q	96.8	Very high	94.2	Very high	65 Å²	65	43.5 Å²	43.5	30%	0.304	23%	0.228	S	C	.	.	H	α-helix	trans	-68	-42.8	176	-67.3	-27	-82.8	0	0	111.9	L767 M771 Y803 S804 L810 A811	L767-Q807 HydrophobicContact CD1-CB 4.46Å; L767-Q807 HydrophobicContact CD2-CB 4.45Å; L767-Q807 HydrophobicContact CD2-CG 4.47Å; M771-Q807 HydrophobicContact CE-CB 4.1Å; M771-Q807 HydrophobicContact SD-CB 3.74Å; Y803-Q807 WeakPolarHBondContact O-CG 3.44Å; Y803-Q807 PolarHBondContact O-N 2.93Å; Y803-Q807 PolarHBondContact O-NE2 3.48Å; S804-Q807 PolarHBondContact O-N 3.09Å; S804-Q807 VanDerWaalsContact O-N 3.16Å; Q807-L810 CarbonylContact O-C 3.56Å; Q807-L810 PolarHBondContact O-N 3.2Å; Q807-L810 VanDerWaalsContact O-N 3.17Å; Q807-A811 PolarHBondContact O-N 2.96Å
808	L	97.3	Very high	94.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-45.1	174.9	-69.9	167.2	0	0	0	110.9	L755 V759 L767 L770 M771 M781 F782 S804 L810 A811 H812	L755-L808 HydrophobicContact CD1-CD1 4.06Å; V759-L808 HydrophobicContact CG1-CD1 3.86Å; L767-L808 HydrophobicContact CD1-CD1 4.17Å; L767-L808 HydrophobicContact CD1-CD2 4.04Å; L767-L808 HydrophobicContact CD1-CG 3.75Å; L770-L808 HydrophobicContact CB-CD2 3.84Å; M771-L808 HydrophobicContact CG-CD2 4.11Å; M781-L808 HydrophobicContact CE-CD1 4.46Å; M781-L808 HydrophobicContact SD-CD1 3.95Å; M781-L808 HydrophobicContact SD-CD2 4.07Å; M781-L808 HydrophobicContact SD-CG 4.43Å; F782-L808 HydrophobicContact CE2-CB 4.01Å; S804-L808 WeakPolarHBondContact O-CB 3.45Å; S804-L808 WeakPolarHBondContact O-CG 3.35Å; S804-L808 PolarHBondContact O-N 3.1Å; L808-L810 VanDerWaalsContact C-N 3.29Å; L808-L810 PolarHBondContact O-N 3.36Å; L808-A811 PolarHBondContact O-N 3.34Å; L808-H812 PolarHBondContact O-N 3.16Å; L808-H812 PolarHBondContact O-ND1 2.93Å
809	F	96.7	Very high	94.3	Very high	3 Å²	3	37.6 Å²	37.6	1%	0.013	21%	0.205	C	C	.	.	H	α-helix	trans	-57.7	-41.5	173.4	167	-104.1	0	0	0	111.9	F782 V787 L791 T805 W806 A811 H812 I814 L816 I819	F782-F809 HydrophobicContact CD2-CB 4.33Å; F782-F809 HydrophobicContact CE2-CB 3.91Å; F782-F809 HydrophobicContact CZ-CB 4.1Å; V787-F809 HydrophobicContact CG2-CD2 3.62Å; V787-F809 HydrophobicContact CG2-CE2 3.74Å; L791-F809 HydrophobicContact CD1-CD1 4.44Å; L791-F809 HydrophobicContact CD1-CD2 4.13Å; L791-F809 HydrophobicContact CD1-CE2 4.36Å; L791-F809 HydrophobicContact CD1-CG 4.19Å; L791-F809 HydrophobicContact CD2-CB 4.46Å; T805-F809 WeakPolarHBondContact O-CB 3.48Å; T805-F809 PolarHBondContact O-N 3.47Å; W806-F809 AromaticContact CE3-CD1 3.84Å; W806-F809 HydrophobicContact CE3-CD1 3.84Å; W806-F809 HydrophobicContact CE3-CE1 4.39Å; W806-F809 AromaticContact CZ3-CD1 3.88Å; W806-F809 HydrophobicContact CZ3-CD1 3.88Å; W806-F809 HydrophobicContact CZ3-CE1 4.03Å; F809-A811 VanDerWaalsContact C-N 3.34Å; F809-A811 PolarHBondContact O-N 2.99Å; F809-H812 WeakPolarHBondContact O-CB 3.46Å; F809-H812 PolarHBondContact O-N 3.12Å; F809-H812 VanDerWaalsContact O-N 3.12Å; F809-I814 HydrophobicContact CD2-CD1 4.46Å; F809-I814 HydrophobicContact CE2-CB 3.85Å; F809-I814 HydrophobicContact CE2-CD1 4.27Å; F809-I814 HydrophobicContact CE2-CG2 3.83Å; F809-I814 HydrophobicContact CZ-CB 4.43Å; F809-I814 HydrophobicContact CZ-CG2 4.35Å; F809-L816 HydrophobicContact CE1-CD1 4.19Å; F809-I819 HydrophobicContact CE1-CG1 3.95Å; F809-I819 HydrophobicContact CE2-CG1 4.24Å; F809-I819 HydrophobicContact CE2-CG2 3.91Å; F809-I819 HydrophobicContact CZ-CB 4.45Å; F809-I819 HydrophobicContact CZ-CG1 3.51Å; F809-I819 HydrophobicContact CZ-CG2 4.04Å
810	L	94.9	Very high	94.4	Very high	51 Å²	51	34 Å²	34	27%	0.267	18%	0.183	S	C	.	.	H	α-helix	trans	-77.5	-15	-178.6	-68.8	166.3	0	0	0	114.6	W806 Q807 L808 H812 Q841	W806-L810 WeakPolarHBondContact O-CB 3.28Å; W806-L810 VanDerWaalsContact O-CD1 3.29Å; W806-L810 WeakPolarHBondContact O-CD1 3.27Å; W806-L810 WeakPolarHBondContact O-CG 3.32Å; W806-L810 PolarHBondContact O-N 2.95Å; Q807-L810 CarbonylContact O-C 3.56Å; Q807-L810 PolarHBondContact O-N 3.2Å; Q807-L810 VanDerWaalsContact O-N 3.17Å; L808-L810 VanDerWaalsContact C-N 3.29Å; L808-L810 PolarHBondContact O-N 3.36Å; L810-H812 VanDerWaalsContact C-N 3.32Å; L810-Q841 HydrophobicContact CD1-CG 3.98Å; L810-Q841 VanDerWaalsContact CD1-NE2 3.25Å; L810-Q841 HydrophobicContact CD2-CG 3.67Å; L810-Q841 HydrophobicContact CG-CG 4.49Å
811	A	95.7	Very high	94.7	Very high	14 Å²	14	33.2 Å²	33.2	12%	0.116	18%	0.183	C	C	.	.	H	α-helix	trans	-74	-25	165.8	0	0	0	0	0	111.9	M771 V774 M775 Q807 L808 F809	M771-A811 HydrophobicContact CB-CB 4.22Å; M771-A811 HydrophobicContact CE-CB 4.46Å; M771-A811 HydrophobicContact CG-CB 4.15Å; V774-A811 HydrophobicContact CB-CB 4.03Å; V774-A811 VanDerWaalsContact CG1-C 3.49Å; V774-A811 HydrophobicContact CG1-CB 3.68Å; V774-A811 WeakPolarHBondContact CG1-O 3.43Å; M775-A811 HydrophobicContact CG-CB 4.16Å; Q807-A811 PolarHBondContact O-N 2.96Å; L808-A811 PolarHBondContact O-N 3.34Å; F809-A811 VanDerWaalsContact C-N 3.34Å; F809-A811 PolarHBondContact O-N 2.99Å
812	H	95.5	Very high	94.7	Very high	20 Å²	20	31.8 Å²	31.8	9%	0.093	18%	0.177	C	C	.	.	S	Bend	trans	-78.7	143.9	175.8	-67.9	67.1	0	0	0	111.6	V774 M781 F782 L808 F809 L810 I814	V774-H812 HydrophobicContact CG1-CB 4.42Å; V774-H812 WeakPolarHBondContact CG1-ND1 3.45Å; V774-H812 VanDerWaalsContact CG2-CE1 3.48Å; V774-H812 WeakPolarHBondContact CG2-CE1 3.44Å; M781-H812 PolarHBondContact N-NE2 3.05Å; F782-H812 AromaticContact CD2-CE1 3.57Å; F782-H812 AromaticContact CD2-ND1 3.66Å; F782-H812 AromaticContact CD2-NE2 3.95Å; F782-H812 PolarHBondContact N-NE2 3.35Å; L808-H812 PolarHBondContact O-N 3.16Å; L808-H812 PolarHBondContact O-ND1 2.93Å; F809-H812 WeakPolarHBondContact O-CB 3.46Å; F809-H812 PolarHBondContact O-N 3.12Å; F809-H812 VanDerWaalsContact O-N 3.12Å; L810-H812 VanDerWaalsContact C-N 3.32Å; H812-I814 HydrophobicContact CB-CD1 4.06Å; H812-I814 HydrophobicContact CB-CG1 4.04Å; H812-I814 PolarHBondContact O-N 3.46Å
813	S	90.5	Very high	94.5	Very high	128 Å²	128	31.6 Å²	31.6	90%	0.895	18%	0.176	S	C	*	.			trans	-79.2	48.7	173.7	-66.9	0	0	0	0	113
814	I	93.6	Very high	94.3	Very high	23 Å²	23	30.5 Å²	30.5	12%	0.118	17%	0.174	C	C	.	.			trans	-94.1	121.7	176.4	-63.5	172	0	0	0	109.2	F782 V787 F809 H812 L816 T818	F782-I814 HydrophobicContact CB-CD1 3.62Å; V787-I814 HydrophobicContact CB-CD1 4.49Å; V787-I814 HydrophobicContact CG1-CG2 4.5Å; V787-I814 HydrophobicContact CG2-CD1 4.28Å; F809-I814 HydrophobicContact CD2-CD1 4.46Å; F809-I814 HydrophobicContact CE2-CB 3.85Å; F809-I814 HydrophobicContact CE2-CD1 4.27Å; F809-I814 HydrophobicContact CE2-CG2 3.83Å; F809-I814 HydrophobicContact CZ-CB 4.43Å; F809-I814 HydrophobicContact CZ-CG2 4.35Å; H812-I814 HydrophobicContact CB-CD1 4.06Å; H812-I814 HydrophobicContact CB-CG1 4.04Å; H812-I814 PolarHBondContact O-N 3.46Å; I814-L816 PolarHBondContact O-N 2.82Å; I814-T818 HydrophobicContact CG2-CG2 4.25Å
815	P	92	Very high	94.1	Very high	71 Å²	71	34.1 Å²	34.1	46%	0.461	19%	0.19	S	C	.	.			trans	-60.1	135.4	178.3	-24.2	34.6	0	0	0	112.2	E817 T818	P815-E817 PolarHBondContact O-N 3.4Å; P815-E817 VanDerWaalsContact O-N 3.07Å; P815-T818 VanDerWaalsContact O-CB 3.26Å; P815-T818 WeakPolarHBondContact O-CB 3.27Å; P815-T818 PolarHBondContact O-N 3.24Å; P815-T818 PolarHBondContact O-OG1 2.65Å
816	L	91.7	Very high	93.9	Very high	9 Å²	9	34.4 Å²	34.4	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-59.1	-27.1	-177.3	-158.4	72.6	0	0	0	113	F809 I814 T818 I819 I820 L838 Q841 L842 E845 M851	F809-L816 HydrophobicContact CE1-CD1 4.19Å; I814-L816 PolarHBondContact O-N 2.82Å; L816-T818 PolarHBondContact O-N 2.64Å; L816-I819 HydrophobicContact CD1-CD1 3.74Å; L816-I819 HydrophobicContact CD1-CG1 4.27Å; L816-I819 HydrophobicContact CG-CD1 4.09Å; L816-I819 PolarHBondContact O-N 3.14Å; L816-I819 VanDerWaalsContact O-N 3.12Å; L816-I820 PolarHBondContact O-N 3.48Å; L816-L838 HydrophobicContact CD1-CD2 4.19Å; L816-Q841 HydrophobicContact CD1-CB 4.38Å; L816-Q841 HydrophobicContact CD2-CB 4.2Å; L816-L842 HydrophobicContact CD2-CD2 3.64Å; L816-L842 HydrophobicContact CD2-CG 3.83Å; L816-E845 HydrophobicContact CB-CG 4.32Å; L816-E845 HydrophobicContact CD2-CG 3.82Å; L816-M851 HydrophobicContact CB-CE 4.42Å
817	E	89.8	Confident	93.6	Very high	98 Å²	98	39.3 Å²	39.3	46%	0.458	21%	0.214	S	C	.	.	H	α-helix	trans	-63.2	-19.2	173.8	-169.1	162.6	-122.9	0	0	113.7	P815 S848 M851	P815-E817 PolarHBondContact O-N 3.4Å; P815-E817 VanDerWaalsContact O-N 3.07Å; E817-S848 WeakPolarHBondContact OE1-CB 3.5Å; E817-S848 PolarHBondContact OE1-OG 3Å; E817-M851 HydrophobicContact CB-CE 4.05Å
818	T	93.1	Very high	93.3	Very high	44 Å²	44	41 Å²	41	27%	0.27	22%	0.218	S	C	.	.	H	α-helix	trans	-68.9	-36.7	171.7	-53.4	0	0	0	0	112	K784 V787 I814 P815 L816	K784-T818 HydrophobicContact CB-CG2 4.36Å; V787-T818 HydrophobicContact CG1-CG2 4.03Å; I814-T818 HydrophobicContact CG2-CG2 4.25Å; P815-T818 VanDerWaalsContact O-CB 3.26Å; P815-T818 WeakPolarHBondContact O-CB 3.27Å; P815-T818 PolarHBondContact O-N 3.24Å; P815-T818 PolarHBondContact O-OG1 2.65Å; L816-T818 PolarHBondContact O-N 2.64Å
819	I	95	Very high	92.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-104	-6.8	-174.4	63.5	67.1	0	0	0	113.7	V787 L791 W806 F809 L816 P821 I822 L838	V787-I819 HydrophobicContact CB-CG2 4.41Å; V787-I819 HydrophobicContact CG1-CG2 3.79Å; V787-I819 HydrophobicContact CG2-CG2 3.84Å; L791-I819 HydrophobicContact CD1-CB 4Å; L791-I819 HydrophobicContact CD1-CG1 4.26Å; L791-I819 HydrophobicContact CD1-CG2 3.75Å; W806-I819 HydrophobicContact CH2-CD1 4.24Å; W806-I819 HydrophobicContact CZ3-CD1 4.32Å; F809-I819 HydrophobicContact CE1-CG1 3.95Å; F809-I819 HydrophobicContact CE2-CG1 4.24Å; F809-I819 HydrophobicContact CE2-CG2 3.91Å; F809-I819 HydrophobicContact CZ-CB 4.45Å; F809-I819 HydrophobicContact CZ-CG1 3.51Å; F809-I819 HydrophobicContact CZ-CG2 4.04Å; L816-I819 HydrophobicContact CD1-CD1 3.74Å; L816-I819 HydrophobicContact CD1-CG1 4.27Å; L816-I819 HydrophobicContact CG-CD1 4.09Å; L816-I819 PolarHBondContact O-N 3.14Å; L816-I819 VanDerWaalsContact O-N 3.12Å; I819-P821 VanDerWaalsContact C-N 3.29Å; I819-P821 WeakPolarHBondContact O-CD 3.27Å; I819-P821 VanDerWaalsContact O-N 3.08Å; I819-I822 HydrophobicContact CD1-CG2 4.4Å; I819-I822 WeakPolarHBondContact O-CB 3.5Å; I819-I822 WeakPolarHBondContact O-CG2 3.41Å; I819-I822 PolarHBondContact O-N 2.61Å; I819-L838 HydrophobicContact CD1-CD2 3.61Å
820	I	93.9	Very high	92.6	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-56.8	-24.2	-173.8	-159.2	60.2	0	0	0	116.4	L816 I822 L823 L842 M851 M854	L816-I820 PolarHBondContact O-N 3.48Å; I820-I822 PolarHBondContact O-N 2.69Å; I820-I822 VanDerWaalsContact O-N 3.13Å; I820-L823 HydrophobicContact CD1-CD1 3.48Å; I820-L823 VanDerWaalsContact CD1-CD1 3.48Å; I820-L823 HydrophobicContact CD1-CG 3.95Å; I820-L823 HydrophobicContact CG1-CD1 4.02Å; I820-L823 PolarHBondContact O-N 2.72Å; I820-L842 HydrophobicContact CD1-CD1 4.17Å; I820-L842 HydrophobicContact CD1-CD2 3.77Å; I820-L842 HydrophobicContact CD1-CG 4.43Å; I820-M851 HydrophobicContact CG1-CG 4.23Å; I820-M854 HydrophobicContact CG1-CB 4.07Å; I820-M854 HydrophobicContact CG1-CG 4.4Å; I820-M854 HydrophobicContact CG2-CG 4.21Å
821	P	94	Very high	92.7	Very high	40 Å²	40	51.6 Å²	51.6	26%	0.26	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-59.6	-19.2	171.2	-25.4	36.9	0	0	0	114.7	L788 I819 L823 Q824	L788-P821 HydrophobicContact CD1-CB 4.44Å; L788-P821 HydrophobicContact CD2-CB 4.05Å; L788-P821 HydrophobicContact CD2-CG 4.12Å; I819-P821 VanDerWaalsContact C-N 3.29Å; I819-P821 WeakPolarHBondContact O-CD 3.27Å; I819-P821 VanDerWaalsContact O-N 3.08Å; P821-L823 PolarHBondContact O-N 3.36Å; P821-Q824 WeakPolarHBondContact O-CB 3.29Å; P821-Q824 WeakPolarHBondContact O-CG 3.39Å; P821-Q824 PolarHBondContact O-N 3.5Å
822	I	95.2	Very high	92.5	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-57.2	-23.7	176	-161.2	165.1	0	0	0	113	L788 L791 I792 L795 W806 I819 I820 Q824 H825 L826 L838	L788-I822 HydrophobicContact CD1-CB 3.96Å; L791-I822 HydrophobicContact CB-CD1 3.62Å; I792-I822 HydrophobicContact CG1-CD1 4.14Å; I792-I822 HydrophobicContact CG1-CG1 3.95Å; L795-I822 HydrophobicContact CD1-CD1 4.44Å; L795-I822 HydrophobicContact CD1-CG1 4.31Å; L795-I822 HydrophobicContact CD2-CD1 4.33Å; W806-I822 HydrophobicContact CH2-CG2 4.49Å; W806-I822 HydrophobicContact CZ2-CD1 4.19Å; I819-I822 HydrophobicContact CD1-CG2 4.4Å; I819-I822 WeakPolarHBondContact O-CB 3.5Å; I819-I822 WeakPolarHBondContact O-CG2 3.41Å; I819-I822 PolarHBondContact O-N 2.61Å; I820-I822 PolarHBondContact O-N 2.69Å; I820-I822 VanDerWaalsContact O-N 3.13Å; I822-Q824 PolarHBondContact O-N 2.68Å; I822-H825 PolarHBondContact O-N 3.31Å; I822-L826 HydrophobicContact CG1-CD1 4.44Å; I822-L826 HydrophobicContact CG1-CG 4.36Å; I822-L826 HydrophobicContact CG2-CD1 4.18Å; I822-L826 WeakPolarHBondContact O-CG 3.5Å; I822-L826 PolarHBondContact O-N 3.46Å; I822-L838 HydrophobicContact CG2-CD1 3.66Å
823	L	93.7	Very high	92.6	Very high	2 Å²	2	54 Å²	54	1%	0.01	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-56.4	-21.1	172.7	-69.1	-178.8	0	0	0	113.7	I820 P821 L826 L838 M854 V855 R858 F866	I820-L823 HydrophobicContact CD1-CD1 3.48Å; I820-L823 VanDerWaalsContact CD1-CD1 3.48Å; I820-L823 HydrophobicContact CD1-CG 3.95Å; I820-L823 HydrophobicContact CG1-CD1 4.02Å; I820-L823 PolarHBondContact O-N 2.72Å; P821-L823 PolarHBondContact O-N 3.36Å; L823-L826 HydrophobicContact CD2-CD1 4.22Å; L823-L838 HydrophobicContact CD2-CD1 3.95Å; L823-M854 HydrophobicContact CB-CB 4.39Å; L823-M854 HydrophobicContact CD1-CB 3.97Å; L823-V855 HydrophobicContact CD1-CG2 3.73Å; L823-R858 PolarHBondContact O-NH1 3.07Å; L823-F866 HydrophobicContact CD1-CE1 4.41Å; L823-F866 HydrophobicContact CD2-CE1 3.7Å; L823-F866 HydrophobicContact CD2-CE2 4.43Å; L823-F866 HydrophobicContact CD2-CZ 3.51Å
824	Q	89.9	Confident	92.8	Very high	68 Å²	68	47.9 Å²	47.9	32%	0.318	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-78.8	-20.4	174.7	-55.3	-168.1	-65.1	0	0	113.4	P821 I822 M854 L910	P821-Q824 WeakPolarHBondContact O-CB 3.29Å; P821-Q824 WeakPolarHBondContact O-CG 3.39Å; P821-Q824 PolarHBondContact O-N 3.5Å; I822-Q824 PolarHBondContact O-N 2.68Å; Q824-M854 HydrophobicContact CG-SD 3.77Å; Q824-L910 HydrophobicContact CB-CD2 4.04Å
825	H	92.8	Very high	92.9	Very high	77 Å²	77	47.4 Å²	47.4	36%	0.356	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-21.8	177.9	-66	-112	0	0	0	112.3	L795 I822 K827 H831	L795-H825 HydrophobicContact CD1-CB 3.96Å; I822-H825 PolarHBondContact O-N 3.31Å; H825-K827 PolarHBondContact O-N 2.91Å; H825-H831 PolarHBondContact O-CE1 3.16Å; H825-H831 PolarHBondContact O-ND1 3.31Å
826	L	93.9	Very high	93	Very high	7 Å²	7	45.9 Å²	45.9	4%	0.037	22%	0.224	C	C	.	.			trans	-78.1	113	-173.8	-70.5	170.7	0	0	0	113.9	L795 I822 L823 H831 A834 L835 L838 R858	L795-L826 HydrophobicContact CD1-CD2 3.95Å; L795-L826 HydrophobicContact CD2-CD2 3.5Å; L795-L826 HydrophobicContact CG-CD2 4.38Å; I822-L826 HydrophobicContact CG1-CD1 4.44Å; I822-L826 HydrophobicContact CG1-CG 4.36Å; I822-L826 HydrophobicContact CG2-CD1 4.18Å; I822-L826 WeakPolarHBondContact O-CG 3.5Å; I822-L826 PolarHBondContact O-N 3.46Å; L823-L826 HydrophobicContact CD2-CD1 4.22Å; L826-H831 HydrophobicContact CD2-CB 3.51Å; L826-A834 HydrophobicContact CD1-CB 4.41Å; L826-A834 HydrophobicContact CD2-CB 3.54Å; L826-L835 HydrophobicContact CB-CD2 3.86Å; L826-L835 HydrophobicContact CB-CG 4.13Å; L826-L835 HydrophobicContact CD1-CD2 4.1Å; L826-L835 HydrophobicContact CD1-CG 4.4Å; L826-L838 HydrophobicContact CD1-CD1 3.31Å; L826-R858 PolarHBondContact O-NH1 3.02Å; L826-R858 PolarHBondContact O-NH2 3.32Å
827	K	90.6	Very high	93.2	Very high	105 Å²	105	45.9 Å²	45.9	46%	0.457	23%	0.225	S	C	.	.			trans	-96.6	136.6	176.3	-52.8	169.7	-172.7	169.3	0	110.5	H825 K829 E830 H831	H825-K827 PolarHBondContact O-N 2.91Å; K827-K829 VanDerWaalsContact C-N 3.32Å; K827-K829 PolarHBondContact O-N 2.94Å; K827-E830 HydrophobicContact CB-CB 4.23Å; K827-E830 HydrophobicContact CB-CG 4.49Å; K827-E830 HydrophobicContact CD-CB 4.29Å; K827-E830 HydrophobicContact CD-CG 4.14Å; K827-E830 WeakPolarHBondContact CD-OE1 3.32Å; K827-E830 WeakPolarHBondContact CD-OE2 3.43Å; K827-E830 IonicContact NZ-OE1 3.14Å; K827-E830 PolarHBondContact NZ-OE1 3.39Å; K827-E830 IonicContact NZ-OE2 3.35Å; K827-E830 PolarHBondContact NZ-OE2 2.91Å; K827-E830 PolarHBondContact O-N 2.84Å; K827-H831 PolarHBondContact N-ND1 3.17Å; K827-H831 PolarHBondContact O-N 3Å; K827-H831 VanDerWaalsContact O-N 3.15Å
828	Y	88.9	Confident	93.5	Very high	100 Å²	100	41.2 Å²	41.2	39%	0.392	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-39.2	-173.8	175.2	-113.1	0	0	0	115.1	E863 D864	Y828-E863 HydrophobicContact CD1-CB 4.23Å; Y828-E863 HydrophobicContact CE1-CB 3.55Å; Y828-E863 PolarHBondContact OH-O 2.75Å; Y828-D864 HydrophobicContact CD1-CB 4.34Å; Y828-D864 HydrophobicContact CD2-CB 3.77Å; Y828-D864 HydrophobicContact CE2-CB 4.43Å; Y828-D864 HydrophobicContact CG-CB 3.74Å
829	K	88.4	Confident	93.7	Very high	144 Å²	144	41.5 Å²	41.5	63%	0.626	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-9.1	-175.7	-62.2	-163.3	177.5	-169.6	0	115.2	K827 E863	K827-K829 VanDerWaalsContact C-N 3.32Å; K827-K829 PolarHBondContact O-N 2.94Å; K829-E863 WeakPolarHBondContact CE-OE2 3.38Å; K829-E863 IonicContact NZ-OE1 2.71Å; K829-E863 IonicContact NZ-OE2 2.76Å; K829-E863 PolarHBondContact NZ-OE2 3.03Å
830	E	91.2	Very high	93.7	Very high	113 Å²	113	45.5 Å²	45.5	53%	0.528	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-31.8	-173.2	-61.8	177.2	-135.1	0	0	112.2	K827 P832	K827-E830 HydrophobicContact CB-CB 4.23Å; K827-E830 HydrophobicContact CB-CG 4.49Å; K827-E830 HydrophobicContact CD-CB 4.29Å; K827-E830 HydrophobicContact CD-CG 4.14Å; K827-E830 WeakPolarHBondContact CD-OE1 3.32Å; K827-E830 WeakPolarHBondContact CD-OE2 3.43Å; K827-E830 IonicContact NZ-OE1 3.14Å; K827-E830 PolarHBondContact NZ-OE1 3.39Å; K827-E830 IonicContact NZ-OE2 3.35Å; K827-E830 PolarHBondContact NZ-OE2 2.91Å; K827-E830 PolarHBondContact O-N 2.84Å; E830-P832 WeakPolarHBondContact O-CD 3.29Å
831	H	96.4	Very high	93.7	Very high	19 Å²	19	47 Å²	47	9%	0.088	23%	0.231	C	C	.	.			trans	-123.3	56.9	-173.5	-42.6	149.5	0	0	0	113.4	L795 H825 L826 K827 E833 L835	L795-H831 HydrophobicContact CD2-CB 4.48Å; H825-H831 PolarHBondContact O-CE1 3.16Å; H825-H831 PolarHBondContact O-ND1 3.31Å; L826-H831 HydrophobicContact CD2-CB 3.51Å; K827-H831 PolarHBondContact N-ND1 3.17Å; K827-H831 PolarHBondContact O-N 3Å; K827-H831 VanDerWaalsContact O-N 3.15Å; H831-E833 PolarHBondContact O-N 2.87Å; H831-L835 WeakPolarHBondContact O-CB 3.31Å; H831-L835 WeakPolarHBondContact O-CG 3.47Å; H831-L835 PolarHBondContact O-N 2.8Å
832	P	93.3	Very high	93.8	Very high	66 Å²	66	45.1 Å²	45.1	43%	0.429	22%	0.218	S	C	.	.	H	α-helix	trans	-66.5	-32	-175.2	26.7	-33.1	0	0	0	114.2	E830 S836	E830-P832 WeakPolarHBondContact O-CD 3.29Å; P832-S836 WeakPolarHBondContact O-CB 3.45Å; P832-S836 PolarHBondContact O-N 2.91Å; P832-S836 PolarHBondContact O-OG 3.41Å
833	E	96	Very high	93.8	Very high	19 Å²	19	50.3 Å²	50.3	9%	0.089	24%	0.238	C	C	.	.	H	α-helix	trans	-60.7	-59.6	179.4	-64.7	77	-170.9	0	0	110.4	T799 Q802 Y803 H831 L835 S836 C837	T799-E833 WeakPolarHBondContact CB-OE1 3.21Å; T799-E833 HydrophobicContact CG2-CG 3.88Å; T799-E833 WeakPolarHBondContact CG2-OE1 3.36Å; T799-E833 PolarHBondContact OG1-OE1 3.46Å; Q802-E833 HydrophobicContact CB-CB 3.95Å; Q802-E833 HydrophobicContact CB-CG 4.25Å; Y803-E833 HydrophobicContact CD2-CG 4.07Å; Y803-E833 HydrophobicContact CE1-CB 4.31Å; Y803-E833 HydrophobicContact CE2-CB 4.25Å; Y803-E833 HydrophobicContact CE2-CG 3.63Å; H831-E833 PolarHBondContact O-N 2.87Å; E833-L835 VanDerWaalsContact C-N 3.34Å; E833-L835 PolarHBondContact O-N 2.73Å; E833-S836 PolarHBondContact O-N 3.07Å; E833-S836 VanDerWaalsContact O-N 3.15Å; E833-S836 PolarHBondContact O-OG 3.42Å; E833-C837 PolarHBondContact O-N 2.95Å; E833-C837 PolarHBondContact O-SG 2.88Å
834	A	95.8	Very high	93.8	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.2	-38.5	178.5	0	0	0	0	0	112.8	L795 W806 L826 L838	L795-A834 HydrophobicContact CD2-CB 3.78Å; W806-A834 HydrophobicContact CZ2-CB 3.92Å; L826-A834 HydrophobicContact CD1-CB 4.41Å; L826-A834 HydrophobicContact CD2-CB 3.54Å; A834-L838 WeakPolarHBondContact O-CB 3.42Å; A834-L838 WeakPolarHBondContact O-CG 3.16Å; A834-L838 PolarHBondContact O-N 3.46Å
835	L	95.9	Very high	94	Very high	12 Å²	12	58.7 Å²	58.7	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-64	-42.1	173.9	-77.4	169	0	0	0	112.1	L826 H831 E833 L839 F866	L826-L835 HydrophobicContact CB-CD2 3.86Å; L826-L835 HydrophobicContact CB-CG 4.13Å; L826-L835 HydrophobicContact CD1-CD2 4.1Å; L826-L835 HydrophobicContact CD1-CG 4.4Å; H831-L835 WeakPolarHBondContact O-CB 3.31Å; H831-L835 WeakPolarHBondContact O-CG 3.47Å; H831-L835 PolarHBondContact O-N 2.8Å; E833-L835 VanDerWaalsContact C-N 3.34Å; E833-L835 PolarHBondContact O-N 2.73Å; L835-L839 VanDerWaalsContact O-CB 3.31Å; L835-L839 WeakPolarHBondContact O-CB 3.23Å; L835-L839 PolarHBondContact O-N 2.93Å; L835-F866 HydrophobicContact CB-CD2 4.38Å; L835-F866 HydrophobicContact CD2-CD2 3.69Å; L835-F866 HydrophobicContact CD2-CE2 3.9Å; L835-F866 HydrophobicContact CD2-CG 4.17Å; L835-F866 WeakPolarHBondContact O-CE2 3.45Å
836	S	94.6	Very high	94	Very high	39 Å²	39	60.8 Å²	60.8	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-65.7	-43	177.9	78.4	0	0	0	0	111.8	P832 E833 L839 L840	P832-S836 WeakPolarHBondContact O-CB 3.45Å; P832-S836 PolarHBondContact O-N 2.91Å; P832-S836 PolarHBondContact O-OG 3.41Å; E833-S836 PolarHBondContact O-N 3.07Å; E833-S836 VanDerWaalsContact O-N 3.15Å; E833-S836 PolarHBondContact O-OG 3.42Å; S836-L839 PolarHBondContact O-N 3.06Å; S836-L840 VanDerWaalsContact O-CG 3.31Å; S836-L840 WeakPolarHBondContact O-CG 3.37Å; S836-L840 PolarHBondContact O-N 2.82Å; S836-L840 VanDerWaalsContact O-N 3.13Å
837	C	95.1	Very high	94.1	Very high	9 Å²	9	60.6 Å²	60.6	6%	0.061	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-52.1	177.8	-68	0	0	0	0	111	W806 E833 L839 L840 Q841	W806-C837 HydrophobicContact CB-CB 4.17Å; W806-C837 HydrophobicContact CD2-CB 3.98Å; W806-C837 HydrophobicContact CE3-CB 4.22Å; W806-C837 HydrophobicContact CG-CB 3.93Å; E833-C837 PolarHBondContact O-N 2.95Å; E833-C837 PolarHBondContact O-SG 2.88Å; C837-L839 PolarHBondContact O-N 3.19Å; C837-L840 PolarHBondContact O-N 3.37Å; C837-Q841 WeakPolarHBondContact O-CG 3.33Å; C837-Q841 PolarHBondContact O-N 2.7Å; C837-Q841 VanDerWaalsContact O-N 3.16Å
838	L	96.2	Very high	94.4	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-40.1	179.1	-76	168.7	0	0	0	113	W806 L816 I819 I822 L823 L826 A834 L840 Q841 L842 F866	W806-L838 HydrophobicContact CH2-CD1 3.89Å; W806-L838 HydrophobicContact CH2-CD2 3.64Å; W806-L838 HydrophobicContact CH2-CG 3.65Å; W806-L838 HydrophobicContact CZ2-CD1 4.23Å; W806-L838 HydrophobicContact CZ2-CG 4.23Å; W806-L838 HydrophobicContact CZ3-CD2 3.75Å; W806-L838 HydrophobicContact CZ3-CG 4Å; L816-L838 HydrophobicContact CD1-CD2 4.19Å; I819-L838 HydrophobicContact CD1-CD2 3.61Å; I822-L838 HydrophobicContact CG2-CD1 3.66Å; L823-L838 HydrophobicContact CD2-CD1 3.95Å; L826-L838 HydrophobicContact CD1-CD1 3.31Å; A834-L838 WeakPolarHBondContact O-CB 3.42Å; A834-L838 WeakPolarHBondContact O-CG 3.16Å; A834-L838 PolarHBondContact O-N 3.46Å; L838-L840 VanDerWaalsContact C-N 3.31Å; L838-L840 PolarHBondContact O-N 3.07Å; L838-Q841 PolarHBondContact O-N 2.84Å; L838-L842 WeakPolarHBondContact O-CB 3.47Å; L838-L842 WeakPolarHBondContact O-CG 3.29Å; L838-L842 PolarHBondContact O-N 3.36Å; L838-F866 HydrophobicContact CB-CE2 4.29Å; L838-F866 HydrophobicContact CB-CZ 4.34Å
839	L	96.2	Very high	94.6	Very high	50 Å²	50	54.8 Å²	54.8	26%	0.262	26%	0.257	S	S	.	.	H	α-helix	trans	-61.9	-40.7	177.7	-176.3	58.9	0	0	0	111.5	L835 S836 C837 Q841 R843 F866 I870	L835-L839 VanDerWaalsContact O-CB 3.31Å; L835-L839 WeakPolarHBondContact O-CB 3.23Å; L835-L839 PolarHBondContact O-N 2.93Å; S836-L839 PolarHBondContact O-N 3.06Å; C837-L839 PolarHBondContact O-N 3.19Å; L839-Q841 VanDerWaalsContact C-N 3.35Å; L839-Q841 PolarHBondContact O-N 2.85Å; L839-R843 VanDerWaalsContact O-CB 3.27Å; L839-R843 WeakPolarHBondContact O-CB 3.25Å; L839-R843 PolarHBondContact O-N 2.85Å; L839-F866 HydrophobicContact CB-CD2 4.01Å; L839-F866 HydrophobicContact CB-CE2 3.75Å; L839-F866 HydrophobicContact CD1-CD2 4.35Å; L839-F866 HydrophobicContact CD1-CE2 4.41Å; L839-I870 HydrophobicContact CD1-CB 3.88Å
840	L	94.8	Very high	94.8	Very high	84 Å²	84	51 Å²	51	44%	0.44	24%	0.242	S	C	.	.	H	α-helix	trans	-70.1	-28.6	179.8	-70.8	171.3	0	0	0	113.5	S836 C837 L838	S836-L840 VanDerWaalsContact O-CG 3.31Å; S836-L840 WeakPolarHBondContact O-CG 3.37Å; S836-L840 PolarHBondContact O-N 2.82Å; S836-L840 VanDerWaalsContact O-N 3.13Å; C837-L840 PolarHBondContact O-N 3.37Å; L838-L840 VanDerWaalsContact C-N 3.31Å; L838-L840 PolarHBondContact O-N 3.07Å
841	Q	94.7	Very high	95	Very high	34 Å²	34	46 Å²	46	16%	0.159	22%	0.219	C	C	.	.	H	α-helix	trans	-89.9	-41.6	179.3	-57.2	-62.2	-8.3	0	0	113.1	L810 L816 C837 L838 L839 R843 R844 E845	L810-Q841 HydrophobicContact CD1-CG 3.98Å; L810-Q841 VanDerWaalsContact CD1-NE2 3.25Å; L810-Q841 HydrophobicContact CD2-CG 3.67Å; L810-Q841 HydrophobicContact CG-CG 4.49Å; L816-Q841 HydrophobicContact CD1-CB 4.38Å; L816-Q841 HydrophobicContact CD2-CB 4.2Å; C837-Q841 WeakPolarHBondContact O-CG 3.33Å; C837-Q841 PolarHBondContact O-N 2.7Å; C837-Q841 VanDerWaalsContact O-N 3.16Å; L838-Q841 PolarHBondContact O-N 2.84Å; L839-Q841 VanDerWaalsContact C-N 3.35Å; L839-Q841 PolarHBondContact O-N 2.85Å; Q841-R843 PolarHBondContact O-N 2.94Å; Q841-R843 VanDerWaalsContact O-N 3.13Å; Q841-R844 WeakPolarHBondContact O-CA 3.5Å; Q841-R844 WeakPolarHBondContact O-CB 3.42Å; Q841-R844 PolarHBondContact O-N 3.41Å; Q841-E845 PolarHBondContact O-N 3.45Å
842	L	95.4	Very high	95	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56.8	-30.6	171.6	-74.1	165.9	0	0	0	112	L816 I820 L838 R844 E845 M851 V855 F866 I870 W874	L816-L842 HydrophobicContact CD2-CD2 3.64Å; L816-L842 HydrophobicContact CD2-CG 3.83Å; I820-L842 HydrophobicContact CD1-CD1 4.17Å; I820-L842 HydrophobicContact CD1-CD2 3.77Å; I820-L842 HydrophobicContact CD1-CG 4.43Å; L838-L842 WeakPolarHBondContact O-CB 3.47Å; L838-L842 WeakPolarHBondContact O-CG 3.29Å; L838-L842 PolarHBondContact O-N 3.36Å; L842-R844 PolarHBondContact O-N 3.09Å; L842-E845 PolarHBondContact O-N 3.09Å; L842-M851 HydrophobicContact CD2-SD 4.14Å; L842-V855 HydrophobicContact CD1-CG2 4.41Å; L842-F866 HydrophobicContact CD1-CE1 4.37Å; L842-F866 HydrophobicContact CD1-CZ 3.83Å; L842-I870 HydrophobicContact CB-CD1 3.58Å; L842-I870 HydrophobicContact CB-CG1 3.86Å; L842-W874 HydrophobicContact CB-CZ2 4.02Å; L842-W874 HydrophobicContact CD2-CH2 4.04Å; L842-W874 HydrophobicContact CD2-CZ2 3.87Å; L842-W874 PolarHBondContact O-NE1 3.48Å
843	R	95.3	Very high	95	Very high	108 Å²	108	44.9 Å²	44.9	41%	0.408	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21	173	-175.2	-172.7	63	154.4	-2	114	L839 Q841 I870 H873	L839-R843 VanDerWaalsContact O-CB 3.27Å; L839-R843 WeakPolarHBondContact O-CB 3.25Å; L839-R843 PolarHBondContact O-N 2.85Å; Q841-R843 PolarHBondContact O-N 2.94Å; Q841-R843 VanDerWaalsContact O-N 3.13Å; R843-I870 HydrophobicContact CB-CD1 4.46Å; R843-H873 WeakPolarHBondContact CG-NE2 3.35Å; R843-H873 PolarHBondContact O-CD2 3.31Å; R843-H873 PolarHBondContact O-NE2 3.45Å
844	R	93.5	Very high	94.9	Very high	172 Å²	172	44.3 Å²	44.3	65%	0.649	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-37.1	172.8	-66.4	172.4	165.4	173.6	-10	111.3	Q841 L842	Q841-R844 WeakPolarHBondContact O-CA 3.5Å; Q841-R844 WeakPolarHBondContact O-CB 3.42Å; Q841-R844 PolarHBondContact O-N 3.41Å; L842-R844 PolarHBondContact O-N 3.09Å
845	E	93.9	Very high	94.9	Very high	74 Å²	74	44.3 Å²	44.3	35%	0.346	21%	0.205	S	C	.	.	S	Bend	trans	-64.4	153.3	-179.5	-69.9	-58.3	159.2	0	0	114.6	L816 Q841 L842 M851 W874 Y878	L816-E845 HydrophobicContact CB-CG 4.32Å; L816-E845 HydrophobicContact CD2-CG 3.82Å; Q841-E845 PolarHBondContact O-N 3.45Å; L842-E845 PolarHBondContact O-N 3.09Å; E845-M851 HydrophobicContact CB-CE 4.31Å; E845-M851 HydrophobicContact CB-SD 4.2Å; E845-M851 HydrophobicContact CG-CE 4.11Å; E845-W874 PolarHBondContact O-NE1 3.1Å; E845-Y878 WeakPolarHBondContact O-CE2 3.34Å
846	K	94.4	Very high	94.8	Very high	122 Å²	122	43.8 Å²	43.8	53%	0.53	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-86.1	129.7	162.7	-177.6	179.3	175.1	176.3	0	108.1	S848 Y878	K846-S848 PolarHBondContact O-N 3.11Å; K846-Y878 HydrophobicContact CB-CE2 4.24Å; K846-Y878 HydrophobicContact CG-CD1 4.34Å; K846-Y878 HydrophobicContact CG-CD2 4.46Å; K846-Y878 HydrophobicContact CG-CE1 4.34Å; K846-Y878 HydrophobicContact CG-CE2 4.45Å; K846-Y878 HydrophobicContact CG-CG 4.39Å
847	P	96.3	Very high	94.7	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.019	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-62.1	126.5	-176.2	23.6	-33.4	0	0	0	111.6	V852 W874 Y878 T881 H885	P847-V852 HydrophobicContact CB-CG2 3.77Å; P847-W874 HydrophobicContact CB-CD2 3.72Å; P847-W874 HydrophobicContact CB-CE3 3.85Å; P847-W874 HydrophobicContact CB-CG 4.13Å; P847-W874 HydrophobicContact CB-CH2 4.37Å; P847-W874 HydrophobicContact CB-CZ2 4.26Å; P847-W874 HydrophobicContact CB-CZ3 4.18Å; P847-W874 HydrophobicContact CG-CB 4.18Å; P847-W874 HydrophobicContact CG-CD2 4.08Å; P847-W874 HydrophobicContact CG-CG 3.93Å; P847-Y878 HydrophobicContact CG-CD2 4.31Å; P847-T881 HydrophobicContact CG-CG2 4.38Å; P847-H885 PolarHBondContact O-CD2 2.93Å; P847-H885 VanDerWaalsContact O-CD2 3.26Å; P847-H885 PolarHBondContact O-NE2 2.85Å
848	S	95.4	Very high	94.4	Very high	24 Å²	24	42.1 Å²	42.1	17%	0.168	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-90.7	166	164.4	88.3	0	0	0	0	111.2	E817 K846 E850 M851 V852	E817-S848 WeakPolarHBondContact OE1-CB 3.5Å; E817-S848 PolarHBondContact OE1-OG 3Å; K846-S848 PolarHBondContact O-N 3.11Å; S848-E850 PolarHBondContact O-N 2.83Å; S848-E850 PolarHBondContact OG-N 3.31Å; S848-M851 PolarHBondContact O-N 3.38Å; S848-M851 WeakPolarHBondContact OG-CG 3.32Å; S848-M851 PolarHBondContact OG-N 3.06Å; S848-V852 VanDerWaalsContact O-CG2 3.3Å; S848-V852 WeakPolarHBondContact O-CG2 3.37Å; S848-V852 PolarHBondContact O-N 2.94Å
849	E	93.8	Very high	94.1	Very high	58 Å²	58	46.5 Å²	46.5	27%	0.271	22%	0.218	S	C	.	.	H	α-helix	trans	-61.8	-31.5	177	-150.7	-146.8	100.3	0	0	112.5	K853 H885 A888 Q889 K892	E849-K853 WeakPolarHBondContact O-CB 3.34Å; E849-K853 PolarHBondContact O-N 3.27Å; E849-K853 VanDerWaalsContact O-N 3.13Å; E849-H885 HydrophobicContact CG-CB 4.32Å; E849-A888 HydrophobicContact CG-CB 4.19Å; E849-Q889 PolarHBondContact O-NE2 3.39Å; E849-Q889 VanDerWaalsContact O-NE2 3.15Å; E849-Q889 PolarHBondContact OE1-NE2 2.94Å; E849-K892 IonicContact OE1-NZ 2.66Å; E849-K892 PolarHBondContact OE1-NZ 3.36Å; E849-K892 IonicContact OE2-NZ 3.65Å; E849-K892 PolarHBondContact OE2-NZ 2.83Å
850	E	92.9	Very high	93.6	Very high	65 Å²	65	46 Å²	46	30%	0.304	22%	0.218	S	C	.	.	H	α-helix	trans	-83.3	-37.5	-179.3	-171.3	57	-140.1	0	0	111.8	S848 V852 K853 M854	S848-E850 PolarHBondContact O-N 2.83Å; S848-E850 PolarHBondContact OG-N 3.31Å; E850-V852 VanDerWaalsContact C-N 3.35Å; E850-V852 PolarHBondContact O-N 3.24Å; E850-K853 WeakPolarHBondContact O-CB 3.46Å; E850-K853 PolarHBondContact O-N 2.77Å; E850-K853 IonicContact OE1-NZ 2.71Å; E850-K853 PolarHBondContact OE1-NZ 3.08Å; E850-K853 IonicContact OE2-NZ 3.01Å; E850-K853 PolarHBondContact OE2-NZ 3.44Å; E850-M854 WeakPolarHBondContact O-CG 3.32Å; E850-M854 PolarHBondContact O-N 3.29Å; E850-M854 WeakPolarHBondContact OE1-CE 3.26Å
851	M	95.4	Very high	93.3	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.039	22%	0.217	C	C	.	.	H	α-helix	trans	-58.3	-47.5	170.2	-69.1	-177.2	-174.8	0	0	111.2	L816 E817 I820 L842 E845 S848 K853 M854 V855 W874	L816-M851 HydrophobicContact CB-CE 4.42Å; E817-M851 HydrophobicContact CB-CE 4.05Å; I820-M851 HydrophobicContact CG1-CG 4.23Å; L842-M851 HydrophobicContact CD2-SD 4.14Å; E845-M851 HydrophobicContact CB-CE 4.31Å; E845-M851 HydrophobicContact CB-SD 4.2Å; E845-M851 HydrophobicContact CG-CE 4.11Å; S848-M851 PolarHBondContact O-N 3.38Å; S848-M851 WeakPolarHBondContact OG-CG 3.32Å; S848-M851 PolarHBondContact OG-N 3.06Å; M851-K853 VanDerWaalsContact C-N 3.31Å; M851-K853 PolarHBondContact O-N 3.44Å; M851-M854 PolarHBondContact O-N 3.35Å; M851-V855 WeakPolarHBondContact O-CB 3.33Å; M851-V855 WeakPolarHBondContact O-CG2 3.43Å; M851-V855 PolarHBondContact O-N 3.37Å; M851-W874 HydrophobicContact CB-CH2 4.13Å
852	V	95.2	Very high	92.7	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.7	-39.8	176.7	173.3	0	0	0	0	110.9	P847 S848 E850 L856 W874 L882 H885 I886	P847-V852 HydrophobicContact CB-CG2 3.77Å; S848-V852 VanDerWaalsContact O-CG2 3.3Å; S848-V852 WeakPolarHBondContact O-CG2 3.37Å; S848-V852 PolarHBondContact O-N 2.94Å; E850-V852 VanDerWaalsContact C-N 3.35Å; E850-V852 PolarHBondContact O-N 3.24Å; V852-L856 HydrophobicContact CG1-CD1 3.79Å; V852-L856 HydrophobicContact CG1-CG 4.44Å; V852-L856 WeakPolarHBondContact O-CB 3.49Å; V852-L856 VanDerWaalsContact O-CG 3.26Å; V852-L856 WeakPolarHBondContact O-CG 3.48Å; V852-L856 PolarHBondContact O-N 3.16Å; V852-W874 HydrophobicContact CG2-CE3 4.45Å; V852-W874 HydrophobicContact CG2-CZ3 4.15Å; V852-L882 HydrophobicContact CG1-CD1 4.31Å; V852-L882 HydrophobicContact CG2-CD1 3.65Å; V852-H885 HydrophobicContact CB-CB 4.4Å; V852-H885 HydrophobicContact CG1-CB 4.49Å; V852-H885 HydrophobicContact CG2-CB 4.18Å; V852-I886 HydrophobicContact CG1-CG1 3.73Å
853	K	94	Very high	92.3	Very high	61 Å²	61	54.5 Å²	54.5	27%	0.265	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-46.4	175.3	-178.8	165.5	143.3	-91.1	0	112.8	E849 E850 M851 L856 S857 Q889 L913	E849-K853 WeakPolarHBondContact O-CB 3.34Å; E849-K853 PolarHBondContact O-N 3.27Å; E849-K853 VanDerWaalsContact O-N 3.13Å; E850-K853 WeakPolarHBondContact O-CB 3.46Å; E850-K853 PolarHBondContact O-N 2.77Å; E850-K853 IonicContact OE1-NZ 2.71Å; E850-K853 PolarHBondContact OE1-NZ 3.08Å; E850-K853 IonicContact OE2-NZ 3.01Å; E850-K853 PolarHBondContact OE2-NZ 3.44Å; M851-K853 VanDerWaalsContact C-N 3.31Å; M851-K853 PolarHBondContact O-N 3.44Å; K853-L856 PolarHBondContact O-N 3.47Å; K853-S857 WeakPolarHBondContact O-CB 3.13Å; K853-S857 PolarHBondContact O-N 2.85Å; K853-S857 PolarHBondContact O-OG 3.42Å; K853-Q889 HydrophobicContact CB-CG 4.47Å; K853-L913 HydrophobicContact CG-CD2 4.15Å
854	M	94.3	Very high	92.1	Very high	8 Å²	8	50.1 Å²	50.1	4%	0.039	25%	0.25	C	S	.	.	H	α-helix	trans	-68.6	-40.4	178.9	-69.2	-63	95.1	0	0	112.4	I820 L823 Q824 E850 M851 L856 S857	I820-M854 HydrophobicContact CG1-CB 4.07Å; I820-M854 HydrophobicContact CG1-CG 4.4Å; I820-M854 HydrophobicContact CG2-CG 4.21Å; L823-M854 HydrophobicContact CB-CB 4.39Å; L823-M854 HydrophobicContact CD1-CB 3.97Å; Q824-M854 HydrophobicContact CG-SD 3.77Å; E850-M854 WeakPolarHBondContact O-CG 3.32Å; E850-M854 PolarHBondContact O-N 3.29Å; E850-M854 WeakPolarHBondContact OE1-CE 3.26Å; M851-M854 PolarHBondContact O-N 3.35Å; M854-L856 PolarHBondContact O-N 3.37Å; M854-S857 WeakPolarHBondContact O-CB 3.42Å; M854-S857 PolarHBondContact O-N 3.15Å; M854-S857 VanDerWaalsContact O-N 3.16Å
855	V	95.4	Very high	92.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60	-44	173.9	163.7	0	0	0	0	112.1	L823 L842 M851 S857 F866 T867 I870 L871 W874	L823-V855 HydrophobicContact CD1-CG2 3.73Å; L842-V855 HydrophobicContact CD1-CG2 4.41Å; M851-V855 WeakPolarHBondContact O-CB 3.33Å; M851-V855 WeakPolarHBondContact O-CG2 3.43Å; M851-V855 PolarHBondContact O-N 3.37Å; V855-S857 VanDerWaalsContact C-N 3.32Å; V855-F866 HydrophobicContact CG2-CE1 4.49Å; V855-T867 HydrophobicContact CG1-CG2 3.73Å; V855-T867 PolarHBondContact O-OG1 3.04Å; V855-I870 HydrophobicContact CG1-CG2 3.62Å; V855-I870 HydrophobicContact CG2-CG2 4.11Å; V855-L871 HydrophobicContact CG1-CD2 4.18Å; V855-L871 HydrophobicContact CG1-CG 4.12Å; V855-W874 HydrophobicContact CG2-CH2 4.07Å; V855-W874 HydrophobicContact CG2-CZ3 4.12Å
856	L	94.1	Very high	92.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-73.1	-21.9	176	-69	170.1	0	0	0	113.3	V852 K853 M854 R858 L871 I886 L913 Q917 I918 H921	V852-L856 HydrophobicContact CG1-CD1 3.79Å; V852-L856 HydrophobicContact CG1-CG 4.44Å; V852-L856 WeakPolarHBondContact O-CB 3.49Å; V852-L856 VanDerWaalsContact O-CG 3.26Å; V852-L856 WeakPolarHBondContact O-CG 3.48Å; V852-L856 PolarHBondContact O-N 3.16Å; K853-L856 PolarHBondContact O-N 3.47Å; M854-L856 PolarHBondContact O-N 3.37Å; L856-R858 PolarHBondContact O-N 2.99Å; L856-L871 HydrophobicContact CD2-CD1 3.95Å; L856-I886 HydrophobicContact CD1-CG1 4.43Å; L856-L913 HydrophobicContact CB-CD1 3.99Å; L856-L913 HydrophobicContact CB-CD2 4.29Å; L856-L913 WeakPolarHBondContact O-CD1 3.34Å; L856-Q917 WeakPolarHBondContact O-CG 3.45Å; L856-Q917 PolarHBondContact O-NE2 2.86Å; L856-I918 HydrophobicContact CD1-CG1 4.44Å; L856-I918 HydrophobicContact CD1-CG2 4.16Å; L856-H921 HydrophobicContact CD2-CB 3.61Å; L856-H921 PolarHBondContact O-CD2 2.9Å
857	S	91.4	Very high	92.3	Very high	10 Å²	10	37.9 Å²	37.9	7%	0.07	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-11.4	178	-61.6	0	0	0	0	113.4	K853 M854 V855 Q917	K853-S857 WeakPolarHBondContact O-CB 3.13Å; K853-S857 PolarHBondContact O-N 2.85Å; K853-S857 PolarHBondContact O-OG 3.42Å; M854-S857 WeakPolarHBondContact O-CB 3.42Å; M854-S857 PolarHBondContact O-N 3.15Å; M854-S857 VanDerWaalsContact O-N 3.16Å; V855-S857 VanDerWaalsContact C-N 3.32Å; S857-Q917 PolarHBondContact O-NE2 3.09Å
858	R	90.7	Very high	92.2	Very high	3 Å²	3	38.3 Å²	38.3	1%	0.011	21%	0.205	C	C	.	.	S	Bend	trans	-65.9	140	173	-64.1	-171	58.1	67	2	111.2	L823 L826 L856 D864 Q917 H921	L823-R858 PolarHBondContact O-NH1 3.07Å; L826-R858 PolarHBondContact O-NH1 3.02Å; L826-R858 PolarHBondContact O-NH2 3.32Å; L856-R858 PolarHBondContact O-N 2.99Å; R858-D864 IonicContact CZ-OD2 3.97Å; R858-D864 IonicContact NE-OD2 2.7Å; R858-D864 IonicContact NH2-OD2 3.74Å; R858-D864 PolarHBondContact NH2-OD2 2.86Å; R858-Q917 VanDerWaalsContact C-NE2 3.33Å; R858-Q917 PolarHBondContact O-NE2 3.26Å; R858-H921 PolarHBondContact O-NE2 3.2Å
859	P	89.1	Confident	92.2	Very high	92 Å²	92	39.8 Å²	39.8	60%	0.597	22%	0.215	S	C	*	.	P	Polyproline II helix	trans	-58.3	143.2	174.7	-24.1	34.3	0	0	0	112.5	H861	P859-H861 PolarHBondContact O-N 3.16Å
860	C	86.6	Confident	92.3	Very high	40 Å²	40	37.1 Å²	37.1	27%	0.27	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-74.4	121.2	170.2	-51.6	0	0	0	0	109.2	E920	C860-E920 HydrophobicContact CB-CG 4.05Å; C860-E920 VanDerWaalsContact CB-OE2 3.25Å; C860-E920 WeakPolarHBondContact CB-OE2 3.37Å; C860-E920 PolarHBondContact SG-OE2 2.92Å
861	H	86.5	Confident	92.5	Very high	90 Å²	90	34 Å²	34	42%	0.417	19%	0.189	S	C	.	.			trans	-140.8	132.3	175.3	-171.7	-100.2	0	0	0	109.8	P859 E863 D864	P859-H861 PolarHBondContact O-N 3.16Å; H861-E863 IonicContact CE1-OE2 2.8Å; H861-E863 PolarHBondContact CE1-OE2 3.4Å; H861-E863 PolarHBondContact ND1-N 2.98Å; H861-E863 IonicContact ND1-OE2 2.66Å; H861-E863 PolarHBondContact O-N 3.37Å; H861-E863 VanDerWaalsContact O-N 3.08Å; H861-D864 HydrophobicContact CB-CB 4.09Å; H861-D864 PolarHBondContact O-N 3.3Å
862	P	82.7	Confident	92.4	Very high	113 Å²	113	37.1 Å²	37.1	73%	0.734	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.3	-173.3	-27.7	35.9	0	0	0	115	Q865	P862-Q865 PolarHBondContact O-NE2 2.94Å
863	E	86.6	Confident	92.4	Very high	93 Å²	93	40.1 Å²	40.1	44%	0.435	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-22.3	176.3	-56.1	174	159.1	0	0	113.3	Y828 K829 H861 Q865	Y828-E863 HydrophobicContact CD1-CB 4.23Å; Y828-E863 HydrophobicContact CE1-CB 3.55Å; Y828-E863 PolarHBondContact OH-O 2.75Å; K829-E863 WeakPolarHBondContact CE-OE2 3.38Å; K829-E863 IonicContact NZ-OE1 2.71Å; K829-E863 IonicContact NZ-OE2 2.76Å; K829-E863 PolarHBondContact NZ-OE2 3.03Å; H861-E863 IonicContact CE1-OE2 2.8Å; H861-E863 PolarHBondContact CE1-OE2 3.4Å; H861-E863 PolarHBondContact ND1-N 2.98Å; H861-E863 IonicContact ND1-OE2 2.66Å; H861-E863 PolarHBondContact O-N 3.37Å; H861-E863 VanDerWaalsContact O-N 3.08Å; E863-Q865 PolarHBondContact O-N 3.37Å
864	D	91.8	Very high	92.5	Very high	17 Å²	17	37.2 Å²	37.2	9%	0.091	20%	0.201	C	C	.	.			trans	-83.3	100.6	-178.5	-171.8	-9.2	0	0	0	110.7	Y828 R858 H861 F866	Y828-D864 HydrophobicContact CD1-CB 4.34Å; Y828-D864 HydrophobicContact CD2-CB 3.77Å; Y828-D864 HydrophobicContact CE2-CB 4.43Å; Y828-D864 HydrophobicContact CG-CB 3.74Å; R858-D864 IonicContact CZ-OD2 3.97Å; R858-D864 IonicContact NE-OD2 2.7Å; R858-D864 IonicContact NH2-OD2 3.74Å; R858-D864 PolarHBondContact NH2-OD2 2.86Å; H861-D864 HydrophobicContact CB-CB 4.09Å; H861-D864 PolarHBondContact O-N 3.3Å; D864-F866 WeakPolarHBondContact OD1-CB 3.3Å; D864-F866 PolarHBondContact OD1-N 3.18Å
865	Q	93.4	Very high	92.5	Very high	98 Å²	98	36.9 Å²	36.9	46%	0.458	20%	0.199	S	C	.	.			trans	-88	-2.4	179.9	-61.3	-59	-43.8	0	0	113.8	P862 E863 T867 T868 S869	P862-Q865 PolarHBondContact O-NE2 2.94Å; E863-Q865 PolarHBondContact O-N 3.37Å; Q865-T867 PolarHBondContact O-N 3.3Å; Q865-T868 PolarHBondContact O-N 3.26Å; Q865-S869 VanDerWaalsContact O-CB 3.31Å; Q865-S869 WeakPolarHBondContact O-CB 3.41Å; Q865-S869 PolarHBondContact O-N 3.38Å; Q865-S869 PolarHBondContact O-OG 3.24Å
866	F	96.2	Very high	92.3	Very high	9 Å²	9	40.8 Å²	40.8	4%	0.039	23%	0.227	C	C	.	.	H	α-helix	trans	-54.8	-55.7	-173.2	179.8	-83.8	0	0	0	112.5	L823 L835 L838 L839 L842 V855 D864 S869 I870	L823-F866 HydrophobicContact CD1-CE1 4.41Å; L823-F866 HydrophobicContact CD2-CE1 3.7Å; L823-F866 HydrophobicContact CD2-CE2 4.43Å; L823-F866 HydrophobicContact CD2-CZ 3.51Å; L835-F866 HydrophobicContact CB-CD2 4.38Å; L835-F866 HydrophobicContact CD2-CD2 3.69Å; L835-F866 HydrophobicContact CD2-CE2 3.9Å; L835-F866 HydrophobicContact CD2-CG 4.17Å; L835-F866 WeakPolarHBondContact O-CE2 3.45Å; L838-F866 HydrophobicContact CB-CE2 4.29Å; L838-F866 HydrophobicContact CB-CZ 4.34Å; L839-F866 HydrophobicContact CB-CD2 4.01Å; L839-F866 HydrophobicContact CB-CE2 3.75Å; L839-F866 HydrophobicContact CD1-CD2 4.35Å; L839-F866 HydrophobicContact CD1-CE2 4.41Å; L842-F866 HydrophobicContact CD1-CE1 4.37Å; L842-F866 HydrophobicContact CD1-CZ 3.83Å; V855-F866 HydrophobicContact CG2-CE1 4.49Å; D864-F866 WeakPolarHBondContact OD1-CB 3.3Å; D864-F866 PolarHBondContact OD1-N 3.18Å; F866-S869 PolarHBondContact O-N 2.78Å; F866-I870 HydrophobicContact CE1-CG2 4.42Å; F866-I870 WeakPolarHBondContact O-CG2 3.43Å; F866-I870 PolarHBondContact O-N 3.23Å
867	T	95.8	Very high	92.1	Very high	3 Å²	3	46 Å²	46	2%	0.018	25%	0.25	C	C	.	.	H	α-helix	trans	-65.6	-44.6	-175	-68.2	0	0	0	0	111.4	V855 Q865 S869 I870 L871 H921	V855-T867 HydrophobicContact CG1-CG2 3.73Å; V855-T867 PolarHBondContact O-OG1 3.04Å; Q865-T867 PolarHBondContact O-N 3.3Å; T867-S869 VanDerWaalsContact C-N 3.34Å; T867-S869 PolarHBondContact O-N 2.63Å; T867-I870 WeakPolarHBondContact O-CG2 3.28Å; T867-I870 PolarHBondContact O-N 2.82Å; T867-L871 HydrophobicContact CG2-CD1 3.6Å; T867-L871 HydrophobicContact CG2-CG 4.19Å; T867-L871 VanDerWaalsContact O-CB 3.32Å; T867-L871 WeakPolarHBondContact O-CB 3.14Å; T867-L871 VanDerWaalsContact O-CG 3.24Å; T867-L871 WeakPolarHBondContact O-CG 3.38Å; T867-L871 PolarHBondContact O-N 3.33Å; T867-H921 HydrophobicContact CG2-CB 4.29Å; T867-H921 VanDerWaalsContact CG2-ND1 3.32Å; T867-H921 WeakPolarHBondContact CG2-ND1 3.26Å
868	T	94.8	Very high	92.3	Very high	13 Å²	13	48.9 Å²	48.9	8%	0.08	26%	0.259	C	S	.	.	H	α-helix	trans	-61	-41.9	176.3	-47.9	0	0	0	0	111.6	Q865 R872	Q865-T868 PolarHBondContact O-N 3.26Å; T868-R872 WeakPolarHBondContact O-CB 3.27Å; T868-R872 PolarHBondContact O-N 2.86Å
869	S	95.2	Very high	92.3	Very high	55 Å²	55	50.9 Å²	50.9	39%	0.385	27%	0.271	S	S	.	.	H	α-helix	trans	-64.6	-46.6	179	-69.1	0	0	0	0	113.1	Q865 F866 T867 H873	Q865-S869 VanDerWaalsContact O-CB 3.31Å; Q865-S869 WeakPolarHBondContact O-CB 3.41Å; Q865-S869 PolarHBondContact O-N 3.38Å; Q865-S869 PolarHBondContact O-OG 3.24Å; F866-S869 PolarHBondContact O-N 2.78Å; T867-S869 VanDerWaalsContact C-N 3.34Å; T867-S869 PolarHBondContact O-N 2.63Å; S869-H873 PolarHBondContact O-N 2.99Å; S869-H873 VanDerWaalsContact O-N 3.13Å
870	I	96.8	Very high	92.3	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-72.7	-40.9	-179	-171.1	57.4	0	0	0	112.3	L839 L842 R843 V855 F866 T867 R872 H873 W874	L839-I870 HydrophobicContact CD1-CB 3.88Å; L842-I870 HydrophobicContact CB-CD1 3.58Å; L842-I870 HydrophobicContact CB-CG1 3.86Å; R843-I870 HydrophobicContact CB-CD1 4.46Å; V855-I870 HydrophobicContact CG1-CG2 3.62Å; V855-I870 HydrophobicContact CG2-CG2 4.11Å; F866-I870 HydrophobicContact CE1-CG2 4.42Å; F866-I870 WeakPolarHBondContact O-CG2 3.43Å; F866-I870 PolarHBondContact O-N 3.23Å; T867-I870 WeakPolarHBondContact O-CG2 3.28Å; T867-I870 PolarHBondContact O-N 2.82Å; I870-R872 VanDerWaalsContact C-N 3.33Å; I870-R872 PolarHBondContact O-N 3.4Å; I870-H873 PolarHBondContact O-N 3.01Å; I870-H873 VanDerWaalsContact O-N 3.15Å; I870-W874 HydrophobicContact CD1-CD2 4.14Å; I870-W874 HydrophobicContact CD1-CZ2 3.97Å; I870-W874 HydrophobicContact CG1-CD2 3.92Å; I870-W874 HydrophobicContact CG1-CE3 3.97Å; I870-W874 HydrophobicContact CG1-CH2 3.79Å; I870-W874 HydrophobicContact CG1-CZ2 3.72Å; I870-W874 HydrophobicContact CG1-CZ3 3.91Å; I870-W874 PolarHBondContact O-N 3.15Å
871	L	96	Very high	92.7	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-61.3	-41.8	174.8	-69.8	176.6	0	0	0	111.2	V855 L856 T867 H873 W874 A875 L882 I886 H921 L925	V855-L871 HydrophobicContact CG1-CD2 4.18Å; V855-L871 HydrophobicContact CG1-CG 4.12Å; L856-L871 HydrophobicContact CD2-CD1 3.95Å; T867-L871 HydrophobicContact CG2-CD1 3.6Å; T867-L871 HydrophobicContact CG2-CG 4.19Å; T867-L871 VanDerWaalsContact O-CB 3.32Å; T867-L871 WeakPolarHBondContact O-CB 3.14Å; T867-L871 VanDerWaalsContact O-CG 3.24Å; T867-L871 WeakPolarHBondContact O-CG 3.38Å; T867-L871 PolarHBondContact O-N 3.33Å; L871-H873 VanDerWaalsContact C-N 3.31Å; L871-H873 PolarHBondContact O-N 3.34Å; L871-W874 HydrophobicContact CD2-CE3 4.34Å; L871-W874 PolarHBondContact O-N 2.89Å; L871-A875 WeakPolarHBondContact O-CB 3.31Å; L871-A875 PolarHBondContact O-N 3.3Å; L871-L882 HydrophobicContact CD2-CD1 4.07Å; L871-I886 HydrophobicContact CD2-CD1 4.41Å; L871-H921 HydrophobicContact CD1-CB 4.46Å; L871-L925 HydrophobicContact CB-CD1 4.1Å; L871-L925 HydrophobicContact CB-CD2 4.2Å
872	R	94.3	Very high	93.2	Very high	72 Å²	72	46.8 Å²	46.8	27%	0.272	25%	0.245	S	C	.	.	H	α-helix	trans	-60.1	-39	174.2	179.1	178.1	-176	129.6	4.9	112.6	T868 I870 S876 L925 S928 L929 M932	T868-R872 WeakPolarHBondContact O-CB 3.27Å; T868-R872 PolarHBondContact O-N 2.86Å; I870-R872 VanDerWaalsContact C-N 3.33Å; I870-R872 PolarHBondContact O-N 3.4Å; R872-S876 WeakPolarHBondContact O-CB 3.29Å; R872-S876 PolarHBondContact O-N 3.33Å; R872-L925 HydrophobicContact CB-CD1 4.03Å; R872-S928 VanDerWaalsContact NH1-C 3.35Å; R872-S928 PolarHBondContact NH1-O 3.22Å; R872-S928 PolarHBondContact NH1-OG 3.2Å; R872-L929 HydrophobicContact CG-CD2 3.97Å; R872-M932 PolarHBondContact NH2-SD 2.9Å
873	H	94.8	Very high	93.7	Very high	63 Å²	63	41.4 Å²	41.4	29%	0.292	21%	0.21	S	C	.	.	H	α-helix	trans	-69.5	-46	178.8	-173.7	82.8	0	0	0	112.1	R843 S869 I870 L871 S876 K877	R843-H873 WeakPolarHBondContact CG-NE2 3.35Å; R843-H873 PolarHBondContact O-CD2 3.31Å; R843-H873 PolarHBondContact O-NE2 3.45Å; S869-H873 PolarHBondContact O-N 2.99Å; S869-H873 VanDerWaalsContact O-N 3.13Å; I870-H873 PolarHBondContact O-N 3.01Å; I870-H873 VanDerWaalsContact O-N 3.15Å; L871-H873 VanDerWaalsContact C-N 3.31Å; L871-H873 PolarHBondContact O-N 3.34Å; H873-S876 WeakPolarHBondContact O-CB 3.4Å; H873-S876 PolarHBondContact O-N 3.36Å; H873-S876 VanDerWaalsContact O-N 3.11Å; H873-K877 WeakPolarHBondContact CE1-CE 3.4Å; H873-K877 PolarHBondContact CE1-NZ 3.37Å; H873-K877 WeakPolarHBondContact NE2-CE 3.48Å; H873-K877 PolarHBondContact NE2-NZ 3.12Å; H873-K877 PolarHBondContact O-N 2.86Å
874	W	96.3	Very high	94.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.6	-39.9	175.7	-69	-29.1	0	0	0	112.2	L842 E845 P847 M851 V852 V855 I870 L871 S876 K877 Y878 L882	L842-W874 HydrophobicContact CB-CZ2 4.02Å; L842-W874 HydrophobicContact CD2-CH2 4.04Å; L842-W874 HydrophobicContact CD2-CZ2 3.87Å; L842-W874 PolarHBondContact O-NE1 3.48Å; E845-W874 PolarHBondContact O-NE1 3.1Å; P847-W874 HydrophobicContact CB-CD2 3.72Å; P847-W874 HydrophobicContact CB-CE3 3.85Å; P847-W874 HydrophobicContact CB-CG 4.13Å; P847-W874 HydrophobicContact CB-CH2 4.37Å; P847-W874 HydrophobicContact CB-CZ2 4.26Å; P847-W874 HydrophobicContact CB-CZ3 4.18Å; P847-W874 HydrophobicContact CG-CB 4.18Å; P847-W874 HydrophobicContact CG-CD2 4.08Å; P847-W874 HydrophobicContact CG-CG 3.93Å; M851-W874 HydrophobicContact CB-CH2 4.13Å; V852-W874 HydrophobicContact CG2-CE3 4.45Å; V852-W874 HydrophobicContact CG2-CZ3 4.15Å; V855-W874 HydrophobicContact CG2-CH2 4.07Å; V855-W874 HydrophobicContact CG2-CZ3 4.12Å; I870-W874 HydrophobicContact CD1-CD2 4.14Å; I870-W874 HydrophobicContact CD1-CZ2 3.97Å; I870-W874 HydrophobicContact CG1-CD2 3.92Å; I870-W874 HydrophobicContact CG1-CE3 3.97Å; I870-W874 HydrophobicContact CG1-CH2 3.79Å; I870-W874 HydrophobicContact CG1-CZ2 3.72Å; I870-W874 HydrophobicContact CG1-CZ3 3.91Å; I870-W874 PolarHBondContact O-N 3.15Å; L871-W874 HydrophobicContact CD2-CE3 4.34Å; L871-W874 PolarHBondContact O-N 2.89Å; W874-S876 PolarHBondContact O-N 3.13Å; W874-K877 PolarHBondContact O-N 2.84Å; W874-K877 VanDerWaalsContact O-N 3.11Å; W874-Y878 AromaticContact CD1-CD2 3.97Å; W874-Y878 CarbonylContact O-C 3.53Å; W874-Y878 WeakPolarHBondContact O-CA 3.43Å; W874-Y878 PolarHBondContact O-N 3.47Å; W874-L882 HydrophobicContact CB-CD2 3.95Å; W874-L882 HydrophobicContact CE3-CD1 4.24Å
875	A	93.5	Very high	94.3	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.008	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-9	172.4	0	0	0	0	0	113.9	L871 L882 L929 N934 F936	L871-A875 WeakPolarHBondContact O-CB 3.31Å; L871-A875 PolarHBondContact O-N 3.3Å; A875-L882 HydrophobicContact CB-CD2 3.9Å; A875-L929 HydrophobicContact CB-CD1 4.38Å; A875-N934 PolarHBondContact O-ND2 3.36Å; A875-F936 HydrophobicContact CB-CB 4Å; A875-F936 HydrophobicContact CB-CD1 4.23Å; A875-F936 HydrophobicContact CB-CD2 3.89Å; A875-F936 HydrophobicContact CB-CE2 4.48Å; A875-F936 HydrophobicContact CB-CG 3.75Å
876	S	90.9	Very high	94.4	Very high	83 Å²	83	37.8 Å²	37.8	58%	0.58	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-2.1	176.8	-167.6	0	0	0	0	114.1	R872 H873 W874	R872-S876 WeakPolarHBondContact O-CB 3.29Å; R872-S876 PolarHBondContact O-N 3.33Å; H873-S876 WeakPolarHBondContact O-CB 3.4Å; H873-S876 PolarHBondContact O-N 3.36Å; H873-S876 VanDerWaalsContact O-N 3.11Å; W874-S876 PolarHBondContact O-N 3.13Å
877	K	91.9	Very high	94.3	Very high	110 Å²	110	39 Å²	39	48%	0.478	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.3	-30.3	-176.8	-74	-170.2	175.8	-173.8	0	114.8	H873 W874	H873-K877 WeakPolarHBondContact CE1-CE 3.4Å; H873-K877 PolarHBondContact CE1-NZ 3.37Å; H873-K877 WeakPolarHBondContact NE2-CE 3.48Å; H873-K877 PolarHBondContact NE2-NZ 3.12Å; H873-K877 PolarHBondContact O-N 2.86Å; W874-K877 PolarHBondContact O-N 2.84Å; W874-K877 VanDerWaalsContact O-N 3.11Å
878	Y	93.6	Very high	94.2	Very high	69 Å²	69	40 Å²	40	27%	0.271	21%	0.206	S	C	.	.			trans	-140.3	38.3	-167.8	-53.7	-56.2	0	0	0	110.1	E845 K846 P847 W874 D880 T881 L882	E845-Y878 WeakPolarHBondContact O-CE2 3.34Å; K846-Y878 HydrophobicContact CB-CE2 4.24Å; K846-Y878 HydrophobicContact CG-CD1 4.34Å; K846-Y878 HydrophobicContact CG-CD2 4.46Å; K846-Y878 HydrophobicContact CG-CE1 4.34Å; K846-Y878 HydrophobicContact CG-CE2 4.45Å; K846-Y878 HydrophobicContact CG-CG 4.39Å; P847-Y878 HydrophobicContact CG-CD2 4.31Å; W874-Y878 AromaticContact CD1-CD2 3.97Å; W874-Y878 CarbonylContact O-C 3.53Å; W874-Y878 WeakPolarHBondContact O-CA 3.43Å; W874-Y878 PolarHBondContact O-N 3.47Å; Y878-D880 PolarHBondContact O-N 3.48Å; Y878-T881 PolarHBondContact O-N 2.97Å; Y878-T881 VanDerWaalsContact O-N 3.09Å; Y878-L882 WeakPolarHBondContact O-CB 3.43Å; Y878-L882 PolarHBondContact O-N 3.49Å
879	D	90.9	Very high	94.1	Very high	46 Å²	46	39.5 Å²	39.5	25%	0.246	20%	0.203	C	C	.	.	H	α-helix	trans	-58.1	-44.6	-172.2	60	-37.7	0	0	0	113	T881 G883 F936 Q939	D879-T881 VanDerWaalsContact C-N 3.33Å; D879-T881 PolarHBondContact O-N 3.47Å; D879-G883 PolarHBondContact O-N 2.69Å; D879-F936 HydrophobicContact CB-CD2 3.89Å; D879-Q939 PolarHBondContact OD2-NE2 2.94Å
880	D	90.9	Very high	93.9	Very high	100 Å²	100	36.9 Å²	36.9	54%	0.535	19%	0.185	S	C	.	.	H	α-helix	trans	-54.4	-47.3	172.1	-71.2	-20.6	0	0	0	112.3	Y878 G883 E884 Q939	Y878-D880 PolarHBondContact O-N 3.48Å; D880-G883 PolarHBondContact O-N 3.24Å; D880-E884 PolarHBondContact O-N 2.66Å; D880-Q939 PolarHBondContact OD1-NE2 3.43Å; D880-Q939 PolarHBondContact OD1-OE1 3.33Å
881	T	94.4	Very high	93.5	Very high	36 Å²	36	39.5 Å²	39.5	22%	0.221	20%	0.198	C	C	.	.	H	α-helix	trans	-72.1	-45.2	-175	-59.8	0	0	0	0	111.2	P847 Y878 D879 G883 E884 H885	P847-T881 HydrophobicContact CG-CG2 4.38Å; Y878-T881 PolarHBondContact O-N 2.97Å; Y878-T881 VanDerWaalsContact O-N 3.09Å; D879-T881 VanDerWaalsContact C-N 3.33Å; D879-T881 PolarHBondContact O-N 3.47Å; T881-G883 VanDerWaalsContact C-N 3.25Å; T881-G883 PolarHBondContact O-N 3.03Å; T881-E884 PolarHBondContact O-N 2.94Å; T881-H885 PolarHBondContact O-CD2 3.03Å; T881-H885 PolarHBondContact O-N 3.09Å; T881-H885 VanDerWaalsContact O-N 3.08Å
882	L	95.8	Very high	93.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62	-37.4	175	-177.5	65.6	0	0	0	110.8	V852 L871 W874 A875 Y878 H885 I886 F936	V852-L882 HydrophobicContact CG1-CD1 4.31Å; V852-L882 HydrophobicContact CG2-CD1 3.65Å; L871-L882 HydrophobicContact CD2-CD1 4.07Å; W874-L882 HydrophobicContact CB-CD2 3.95Å; W874-L882 HydrophobicContact CE3-CD1 4.24Å; A875-L882 HydrophobicContact CB-CD2 3.9Å; Y878-L882 WeakPolarHBondContact O-CB 3.43Å; Y878-L882 PolarHBondContact O-N 3.49Å; L882-H885 PolarHBondContact O-N 3.32Å; L882-I886 HydrophobicContact CD1-CD1 3.97Å; L882-I886 HydrophobicContact CD1-CG1 4.14Å; L882-I886 HydrophobicContact CG-CD1 4.01Å; L882-I886 HydrophobicContact CG-CG1 4.4Å; L882-I886 WeakPolarHBondContact O-CB 3.3Å; L882-I886 WeakPolarHBondContact O-CG1 3.21Å; L882-I886 PolarHBondContact O-N 2.95Å; L882-F936 HydrophobicContact CB-CE2 3.92Å; L882-F936 HydrophobicContact CD2-CD2 4.38Å; L882-F936 HydrophobicContact CD2-CE2 3.7Å; L882-F936 HydrophobicContact CD2-CZ 3.85Å; L882-F936 HydrophobicContact CG-CE2 3.78Å; L882-F936 HydrophobicContact CG-CZ 3.93Å
883	G	94.1	Very high	92.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.8	-51.6	177	0	0	0	0	0	112.9	D879 D880 T881 K887	D879-G883 PolarHBondContact O-N 2.69Å; D880-G883 PolarHBondContact O-N 3.24Å; T881-G883 VanDerWaalsContact C-N 3.25Å; T881-G883 PolarHBondContact O-N 3.03Å; G883-K887 VanDerWaalsContact O-CB 3.26Å; G883-K887 WeakPolarHBondContact O-CB 3.5Å; G883-K887 PolarHBondContact O-N 3.36Å
884	E	95.4	Very high	91.9	Very high	87 Å²	87	40.2 Å²	40.2	41%	0.407	21%	0.205	S	C	.	.	H	α-helix	trans	-67.1	-36.2	176.6	-78.2	-64.8	163.9	0	0	112.9	D880 T881 K887 A888 P941	D880-E884 PolarHBondContact O-N 2.66Å; T881-E884 PolarHBondContact O-N 2.94Å; E884-K887 PolarHBondContact O-N 3.21Å; E884-K887 IonicContact OE1-NZ 3.68Å; E884-K887 PolarHBondContact OE1-NZ 3.25Å; E884-K887 VanDerWaalsContact OE2-CD 3.31Å; E884-K887 WeakPolarHBondContact OE2-CD 3.47Å; E884-K887 WeakPolarHBondContact OE2-CE 3.2Å; E884-K887 IonicContact OE2-NZ 2.63Å; E884-K887 PolarHBondContact OE2-NZ 2.93Å; E884-A888 WeakPolarHBondContact O-CB 3.38Å; E884-A888 PolarHBondContact O-N 3.39Å; E884-P941 HydrophobicContact CG-CB 4.02Å; E884-P941 HydrophobicContact CG-CG 3.86Å; E884-P941 WeakPolarHBondContact OE1-CG 3.46Å
885	H	96.1	Very high	90.6	Very high	45 Å²	45	45.4 Å²	45.4	21%	0.208	23%	0.233	C	C	.	.	H	α-helix	trans	-67.9	-39.8	176	-70.9	-30.1	0	0	0	113.1	P847 E849 V852 T881 L882 A888 Q889	P847-H885 PolarHBondContact O-CD2 2.93Å; P847-H885 VanDerWaalsContact O-CD2 3.26Å; P847-H885 PolarHBondContact O-NE2 2.85Å; E849-H885 HydrophobicContact CG-CB 4.32Å; V852-H885 HydrophobicContact CB-CB 4.4Å; V852-H885 HydrophobicContact CG1-CB 4.49Å; V852-H885 HydrophobicContact CG2-CB 4.18Å; T881-H885 PolarHBondContact O-CD2 3.03Å; T881-H885 PolarHBondContact O-N 3.09Å; T881-H885 VanDerWaalsContact O-N 3.08Å; L882-H885 PolarHBondContact O-N 3.32Å; H885-A888 WeakPolarHBondContact O-CB 3.38Å; H885-A888 PolarHBondContact O-N 3.17Å; H885-Q889 PolarHBondContact O-N 3.17Å
886	I	95.6	Very high	89.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-69.1	-40.9	174.2	-70.2	-173.3	0	0	0	111	V852 L856 L871 L882 A888 Q889 L890 L922 F936 I942	V852-I886 HydrophobicContact CG1-CG1 3.73Å; L856-I886 HydrophobicContact CD1-CG1 4.43Å; L871-I886 HydrophobicContact CD2-CD1 4.41Å; L882-I886 HydrophobicContact CD1-CD1 3.97Å; L882-I886 HydrophobicContact CD1-CG1 4.14Å; L882-I886 HydrophobicContact CG-CD1 4.01Å; L882-I886 HydrophobicContact CG-CG1 4.4Å; L882-I886 WeakPolarHBondContact O-CB 3.3Å; L882-I886 WeakPolarHBondContact O-CG1 3.21Å; L882-I886 PolarHBondContact O-N 2.95Å; I886-A888 VanDerWaalsContact C-N 3.29Å; I886-A888 PolarHBondContact O-N 2.97Å; I886-Q889 PolarHBondContact O-N 2.98Å; I886-Q889 VanDerWaalsContact O-N 3.13Å; I886-L890 HydrophobicContact CG2-CD1 3.97Å; I886-L890 HydrophobicContact CG2-CG 4.29Å; I886-L890 WeakPolarHBondContact O-CG 3.42Å; I886-L890 PolarHBondContact O-N 3.5Å; I886-L922 HydrophobicContact CD1-CD2 4.03Å; I886-L922 HydrophobicContact CG2-CD1 3.91Å; I886-L922 HydrophobicContact CG2-CD2 4.15Å; I886-L922 HydrophobicContact CG2-CG 4.45Å; I886-F936 HydrophobicContact CD1-CZ 4.17Å; I886-I942 HydrophobicContact CB-CD1 3.92Å; I886-I942 HydrophobicContact CG2-CD1 3.76Å
887	K	94.1	Very high	86.9	Confident	34 Å²	34	50.8 Å²	50.8	15%	0.148	26%	0.258	C	S	.	.	H	α-helix	trans	-54.8	-43.9	170.7	165.5	171	151.1	-170.9	0	111.9	G883 E884 L890 I891 P941 A945	G883-K887 VanDerWaalsContact O-CB 3.26Å; G883-K887 WeakPolarHBondContact O-CB 3.5Å; G883-K887 PolarHBondContact O-N 3.36Å; E884-K887 PolarHBondContact O-N 3.21Å; E884-K887 IonicContact OE1-NZ 3.68Å; E884-K887 PolarHBondContact OE1-NZ 3.25Å; E884-K887 VanDerWaalsContact OE2-CD 3.31Å; E884-K887 WeakPolarHBondContact OE2-CD 3.47Å; E884-K887 WeakPolarHBondContact OE2-CE 3.2Å; E884-K887 IonicContact OE2-NZ 2.63Å; E884-K887 PolarHBondContact OE2-NZ 2.93Å; K887-L890 PolarHBondContact O-N 3.25Å; K887-I891 HydrophobicContact CG-CD1 3.82Å; K887-I891 WeakPolarHBondContact O-CB 3.3Å; K887-I891 VanDerWaalsContact O-CG1 3.32Å; K887-I891 WeakPolarHBondContact O-CG1 3.38Å; K887-I891 PolarHBondContact O-N 2.96Å; K887-P941 HydrophobicContact CB-CB 4.47Å; K887-P941 HydrophobicContact CD-CB 3.9Å; K887-P941 VanDerWaalsContact CD-O 3.28Å; K887-P941 WeakPolarHBondContact CD-O 3.48Å; K887-A945 HydrophobicContact CB-CB 3.82Å; K887-A945 HydrophobicContact CG-CB 4.01Å
888	A	93.3	Very high	84.8	Confident	23 Å²	23	54.2 Å²	54.2	19%	0.19	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-45.6	174.7	0	0	0	0	0	112.2	E849 E884 H885 I886 K892	E849-A888 HydrophobicContact CG-CB 4.19Å; E884-A888 WeakPolarHBondContact O-CB 3.38Å; E884-A888 PolarHBondContact O-N 3.39Å; H885-A888 WeakPolarHBondContact O-CB 3.38Å; H885-A888 PolarHBondContact O-N 3.17Å; I886-A888 VanDerWaalsContact C-N 3.29Å; I886-A888 PolarHBondContact O-N 2.97Å; A888-K892 VanDerWaalsContact O-CB 3.28Å; A888-K892 WeakPolarHBondContact O-CB 3.48Å; A888-K892 WeakPolarHBondContact O-CG 3.4Å; A888-K892 PolarHBondContact O-N 2.95Å
889	Q	92.4	Very high	82.1	Confident	4 Å²	4	60 Å²	60	2%	0.019	29%	0.294	C	S	.	.	H	α-helix	trans	-66.4	-41.4	177.3	-64.5	-49.6	-26.6	0	0	113.1	E849 K853 H885 I886 K892 N893 I918	E849-Q889 PolarHBondContact O-NE2 3.39Å; E849-Q889 VanDerWaalsContact O-NE2 3.15Å; E849-Q889 PolarHBondContact OE1-NE2 2.94Å; K853-Q889 HydrophobicContact CB-CG 4.47Å; H885-Q889 PolarHBondContact O-N 3.17Å; I886-Q889 PolarHBondContact O-N 2.98Å; I886-Q889 VanDerWaalsContact O-N 3.13Å; Q889-K892 PolarHBondContact O-N 3.13Å; Q889-N893 WeakPolarHBondContact O-CB 3.45Å; Q889-N893 PolarHBondContact O-N 3.5Å; Q889-N893 PolarHBondContact O-ND2 2.99Å; Q889-I918 HydrophobicContact CB-CD1 4.17Å
890	L	90.3	Very high	79.5	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-59.7	-51.6	176.4	-75.5	172	0	0	0	110.9	I886 K887 K892 N893 N894 L915 I918 L919 L922 A945 V949	I886-L890 HydrophobicContact CG2-CD1 3.97Å; I886-L890 HydrophobicContact CG2-CG 4.29Å; I886-L890 WeakPolarHBondContact O-CG 3.42Å; I886-L890 PolarHBondContact O-N 3.5Å; K887-L890 PolarHBondContact O-N 3.25Å; L890-K892 PolarHBondContact O-N 2.83Å; L890-N893 PolarHBondContact O-N 2.85Å; L890-N894 WeakPolarHBondContact O-CB 3.48Å; L890-N894 PolarHBondContact O-N 3.02Å; L890-L915 HydrophobicContact CD2-CD1 3.93Å; L890-I918 HydrophobicContact CD2-CB 4.02Å; L890-I918 HydrophobicContact CD2-CD1 4.46Å; L890-I918 HydrophobicContact CD2-CG2 3.46Å; L890-I918 VanDerWaalsContact CD2-CG2 3.46Å; L890-I918 HydrophobicContact CG-CG2 3.98Å; L890-L919 HydrophobicContact CD2-CD2 4.33Å; L890-L922 HydrophobicContact CD1-CD1 4.09Å; L890-L922 HydrophobicContact CD2-CD1 4.47Å; L890-A945 HydrophobicContact CB-CB 4.31Å; L890-A945 HydrophobicContact CD1-CB 3.66Å; L890-V949 HydrophobicContact CB-CG2 4.04Å; L890-V949 HydrophobicContact CD2-CG2 4.25Å
891	I	88.3	Confident	76.9	Confident	56 Å²	56	73.1 Å²	73.1	29%	0.287	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-39.4	-179.6	-64.7	168.8	0	0	0	111.5	K887 N895	K887-I891 HydrophobicContact CG-CD1 3.82Å; K887-I891 WeakPolarHBondContact O-CB 3.3Å; K887-I891 VanDerWaalsContact O-CG1 3.32Å; K887-I891 WeakPolarHBondContact O-CG1 3.38Å; K887-I891 PolarHBondContact O-N 2.96Å; I891-N895 PolarHBondContact O-ND2 2.93Å
892	K	87.4	Confident	73.8	Confident	102 Å²	102	76.4 Å²	76.4	44%	0.443	37%	0.365	S	S	.	.	H	α-helix	trans	-66.6	-39.8	178.9	-74.8	173.6	-168.5	-175.4	0	112.8	E849 A888 Q889 L890	E849-K892 IonicContact OE1-NZ 2.66Å; E849-K892 PolarHBondContact OE1-NZ 3.36Å; E849-K892 IonicContact OE2-NZ 3.65Å; E849-K892 PolarHBondContact OE2-NZ 2.83Å; A888-K892 VanDerWaalsContact O-CB 3.28Å; A888-K892 WeakPolarHBondContact O-CB 3.48Å; A888-K892 WeakPolarHBondContact O-CG 3.4Å; A888-K892 PolarHBondContact O-N 2.95Å; Q889-K892 PolarHBondContact O-N 3.13Å; L890-K892 PolarHBondContact O-N 2.83Å
893	N	84.4	Confident	70.9	Confident	22 Å²	22	84.5 Å²	84.5	12%	0.118	41%	0.407	C	S	.	.	H	α-helix	trans	-87.8	-29.9	-175.6	-64.8	-59.6	0	0	0	113.1	Q889 L890 N895 Q896 I918	Q889-N893 WeakPolarHBondContact O-CB 3.45Å; Q889-N893 PolarHBondContact O-N 3.5Å; Q889-N893 PolarHBondContact O-ND2 2.99Å; L890-N893 PolarHBondContact O-N 2.85Å; N893-N895 VanDerWaalsContact C-N 3.27Å; N893-N895 PolarHBondContact O-N 3.25Å; N893-Q896 PolarHBondContact O-N 3.47Å; N893-Q896 PolarHBondContact OD1-NE2 3.4Å; N893-I918 HydrophobicContact CB-CD1 4.17Å
894	N	81.3	Confident	67.8	Low	26 Å²	26	95.3 Å²	95.3	14%	0.139	45%	0.448	C	S	.	.	H	α-helix	trans	-58.9	-34.9	171.5	-175.8	26.4	0	0	0	112.8	L890 Q896 L915 H948 V949 S952	L890-N894 WeakPolarHBondContact O-CB 3.48Å; L890-N894 PolarHBondContact O-N 3.02Å; N894-Q896 VanDerWaalsContact C-N 3.34Å; N894-Q896 PolarHBondContact O-N 3.4Å; N894-L915 HydrophobicContact CB-CD1 4.23Å; N894-L915 HydrophobicContact CB-CD2 4.38Å; N894-H948 PolarHBondContact ND2-ND1 2.93Å; N894-V949 HydrophobicContact CB-CG2 4.3Å; N894-S952 VanDerWaalsContact CG-OG 3.26Å; N894-S952 PolarHBondContact ND2-OG 3.39Å; N894-S952 PolarHBondContact OD1-OG 2.75Å
895	N	68.9	Low	64.6	Low	110 Å²	110	95.4 Å²	95.4	59%	0.588	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	2.5	-179.2	-77.3	-71.1	0	0	0	115.2	I891 N893	I891-N895 PolarHBondContact O-ND2 2.93Å; N893-N895 VanDerWaalsContact C-N 3.27Å; N893-N895 PolarHBondContact O-N 3.25Å
896	Q	61.4	Low	61.8	Low	83 Å²	83	98.7 Å²	98.7	39%	0.388	49%	0.486	S	S	.	.	S	Bend	trans	-81.7	128.3	-179	-65.2	-170.5	32.5	0	0	111.8	N893 N894 R898	N893-Q896 PolarHBondContact O-N 3.47Å; N893-Q896 PolarHBondContact OD1-NE2 3.4Å; N894-Q896 VanDerWaalsContact C-N 3.34Å; N894-Q896 PolarHBondContact O-N 3.4Å; Q896-R898 PolarHBondContact O-N 2.99Å
897	P	45.3	Very low	58.8	Low	113 Å²	113	103.5 Å²	103.5	73%	0.734	52%	0.52	S	S	*	.			trans	-68.2	118.5	-178.2	27	-33.7	0	0	0	110.6	K899	P897-K899 VanDerWaalsContact C-N 3.31Å; P897-K899 PolarHBondContact O-N 2.96Å
898	R	46.3	Very low	56	Low	182 Å²	182	107.5 Å²	107.5	69%	0.687	55%	0.553	S	S	*	*			trans	-54.8	82.8	-179.8	-68.7	-178	174.9	-172.8	-3.9	112.7	Q896 R900 D954	Q896-R898 PolarHBondContact O-N 2.99Å; R898-R900 PolarHBondContact O-N 3.18Å; R898-D954 IonicContact CZ-OD2 2.78Å; R898-D954 IonicContact NH1-OD2 3Å; R898-D954 PolarHBondContact NH1-OD2 3.08Å; R898-D954 IonicContact NH2-OD2 3.95Å; R898-D954 PolarHBondContact NH2-OD2 3.26Å
899	K	37.6	Very low	53.4	Low	190 Å²	190	114.4 Å²	114.4	83%	0.826	58%	0.578	S	S	*	*			trans	-74	106.4	171.2	-85.9	-173.6	175.8	178.6	0	109.3	P897 Q901	P897-K899 VanDerWaalsContact C-N 3.31Å; P897-K899 PolarHBondContact O-N 2.96Å; K899-Q901 PolarHBondContact O-N 3.01Å
900	R	36.3	Very low	51.4	Low	253 Å²	253	119.7 Å²	119.7	96%	0.955	61%	0.606	S	S	*	*			trans	-49	101.1	170.6	-159	179.8	-160.6	177.5	5.1	110.2	R898	R898-R900 PolarHBondContact O-N 3.18Å
901	Q	35.3	Very low	49.7	Very low	169 Å²	169	122.7 Å²	122.7	79%	0.79	63%	0.631	S	S	*	*			trans	-69.5	142.9	173	-74.1	-171	-6.3	0	0	109.5	K899	K899-Q901 PolarHBondContact O-N 3.01Å
902	S	29.4	Very low	48.9	Very low	106 Å²	106	125.9 Å²	125.9	74%	0.741	65%	0.645	S	S	*	*			trans	-99.2	134.7	177.2	-175.6	0	0	0	0	109.1	R904	S902-R904 PolarHBondContact O-N 2.88Å; S902-R904 VanDerWaalsContact O-N 3.09Å
903	L	35.5	Very low	48.8	Very low	169 Å²	169	121.7 Å²	121.7	89%	0.885	63%	0.627	S	S	*	*			trans	-71.4	102.3	173.7	-67.9	91.7	0	0	0	109.6
904	R	30.4	Very low	48.9	Very low	227 Å²	227	123.8 Å²	123.8	86%	0.857	64%	0.64	S	S	*	*			trans	-168.9	156.3	162.5	-107.4	162.1	-163.6	-151.3	1.8	110.9	S902	S902-R904 PolarHBondContact O-N 2.88Å; S902-R904 VanDerWaalsContact O-N 3.09Å
905	S	27.1	Very low	49.3	Very low	90 Å²	90	123.6 Å²	123.6	63%	0.629	64%	0.639	S	S	*	*			trans	60.7	117.8	-178.1	61.4	0	0	0	0	116
906	S	37.2	Very low	50.2	Low	113 Å²	113	121.7 Å²	121.7	79%	0.79	63%	0.627	S	S	*	*			trans	-76.8	168.1	164.9	35.5	0	0	0	0	111.7
907	S	33.6	Very low	51.6	Low	102 Å²	102	118.9 Å²	118.9	71%	0.713	61%	0.614	S	S	*	*	S	Bend	trans	72.2	153.8	-178.3	78.7	0	0	0	0	117.5	K909	S907-K909 PolarHBondContact O-N 3.46Å
908	S	33.9	Very low	53.9	Low	118 Å²	118	113.5 Å²	113.5	83%	0.825	58%	0.579	S	S	*	*			trans	53.3	39.9	162.2	66.2	0	0	0	0	120.2
909	K	38.6	Very low	56.1	Low	167 Å²	167	104.9 Å²	104.9	73%	0.726	55%	0.546	S	S	*	.			trans	-127.8	103.7	163.3	-71.8	179.2	-173.1	115.9	0	112.3	S907	S907-K909 PolarHBondContact O-N 3.46Å
910	L	51.2	Low	58.8	Low	115 Å²	115	98.3 Å²	98.3	60%	0.602	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-52	136	171.6	-71.5	160.8	0	0	0	110.8	Q824 Q912	Q824-L910 HydrophobicContact CB-CD2 4.04Å; L910-Q912 PolarHBondContact O-N 3.19Å
911	A	55.6	Low	61.6	Low	63 Å²	63	86.7 Å²	86.7	52%	0.521	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-66.8	125.4	-178.2	0	0	0	0	0	111.1
912	Q	70.3	Confident	64.4	Low	124 Å²	124	78.7 Å²	78.7	58%	0.579	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-89.7	117.2	177.8	-177.5	175	-7.2	0	0	109.5	L910 T914	L910-Q912 PolarHBondContact O-N 3.19Å; Q912-T914 WeakPolarHBondContact O-CG2 3.5Å; Q912-T914 PolarHBondContact O-N 3.48Å
913	L	84.8	Confident	67.4	Low	14 Å²	14	75 Å²	75	7%	0.073	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-46	118.6	-178.7	179.8	58	0	0	0	112.2	K853 L856 Q917 I918	K853-L913 HydrophobicContact CG-CD2 4.15Å; L856-L913 HydrophobicContact CB-CD1 3.99Å; L856-L913 HydrophobicContact CB-CD2 4.29Å; L856-L913 WeakPolarHBondContact O-CD1 3.34Å; L913-Q917 HydrophobicContact CD1-CB 4.4Å; L913-Q917 HydrophobicContact CD1-CG 4.2Å; L913-I918 HydrophobicContact CD1-CD1 4.34Å; L913-I918 HydrophobicContact CD1-CG1 3.69Å; L913-I918 HydrophobicContact CD2-CD1 4.02Å; L913-I918 HydrophobicContact CD2-CG1 4.11Å; L913-I918 HydrophobicContact CG-CD1 4.01Å; L913-I918 HydrophobicContact CG-CG1 3.93Å
914	T	87.7	Confident	70.2	Confident	65 Å²	65	70.1 Å²	70.1	40%	0.399	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-97.2	158.1	-179.3	78.3	0	0	0	0	111.7	Q912 E916 Q917 I918	Q912-T914 WeakPolarHBondContact O-CG2 3.5Å; Q912-T914 PolarHBondContact O-N 3.48Å; T914-E916 VanDerWaalsContact C-N 3.3Å; T914-E916 PolarHBondContact O-N 3.04Å; T914-Q917 PolarHBondContact O-N 3.39Å; T914-Q917 VanDerWaalsContact OG1-CB 3.29Å; T914-Q917 WeakPolarHBondContact OG1-CB 3.46Å; T914-Q917 PolarHBondContact OG1-N 3.44Å; T914-Q917 VanDerWaalsContact OG1-N 3.08Å; T914-I918 WeakPolarHBondContact O-CG1 3.48Å; T914-I918 PolarHBondContact O-N 3.22Å
915	L	88.4	Confident	73.2	Confident	22 Å²	22	59.3 Å²	59.3	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-61.4	-40.2	173.8	-177.6	64.9	0	0	0	111.8	L890 N894 I918 L919 V949	L890-L915 HydrophobicContact CD2-CD1 3.93Å; N894-L915 HydrophobicContact CB-CD1 4.23Å; N894-L915 HydrophobicContact CB-CD2 4.38Å; L915-I918 PolarHBondContact O-N 3.07Å; L915-L919 HydrophobicContact CG-CD1 4.26Å; L915-L919 WeakPolarHBondContact O-CG 3.34Å; L915-L919 PolarHBondContact O-N 3.35Å; L915-L919 VanDerWaalsContact O-N 3.09Å; L915-V949 HydrophobicContact CD1-CG1 4.04Å; L915-V949 HydrophobicContact CD1-CG2 4.09Å; L915-V949 HydrophobicContact CD2-CG1 4.12Å; L915-V949 HydrophobicContact CG-CG1 4.42Å
916	E	88.3	Confident	76.3	Confident	71 Å²	71	57.4 Å²	57.4	33%	0.332	32%	0.323	S	S	.	.	H	α-helix	trans	-61.5	-42.7	178.2	-173.3	171.5	-150.7	0	0	111.9	T914 I918 L919 E920 R960 F961	T914-E916 VanDerWaalsContact C-N 3.3Å; T914-E916 PolarHBondContact O-N 3.04Å; E916-I918 PolarHBondContact O-N 3.02Å; E916-L919 PolarHBondContact O-N 3.46Å; E916-E920 WeakPolarHBondContact O-CB 3.44Å; E916-E920 PolarHBondContact O-N 2.85Å; E916-R960 IonicContact OE1-CZ 3.05Å; E916-R960 IonicContact OE1-NH1 3.75Å; E916-R960 PolarHBondContact OE1-NH1 3.48Å; E916-F961 HydrophobicContact CG-CE2 4.23Å; E916-F961 HydrophobicContact CG-CZ 4.27Å
917	Q	90.9	Very high	78.7	Confident	24 Å²	24	56.3 Å²	56.3	11%	0.112	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-37.3	177.3	-175.1	178.7	13.9	0	0	112.6	L856 S857 R858 L913 T914 H921	L856-Q917 WeakPolarHBondContact O-CG 3.45Å; L856-Q917 PolarHBondContact O-NE2 2.86Å; S857-Q917 PolarHBondContact O-NE2 3.09Å; R858-Q917 VanDerWaalsContact C-NE2 3.33Å; R858-Q917 PolarHBondContact O-NE2 3.26Å; L913-Q917 HydrophobicContact CD1-CB 4.4Å; L913-Q917 HydrophobicContact CD1-CG 4.2Å; T914-Q917 PolarHBondContact O-N 3.39Å; T914-Q917 VanDerWaalsContact OG1-CB 3.29Å; T914-Q917 WeakPolarHBondContact OG1-CB 3.46Å; T914-Q917 PolarHBondContact OG1-N 3.44Å; T914-Q917 VanDerWaalsContact OG1-N 3.08Å; Q917-H921 PolarHBondContact O-CD2 2.92Å; Q917-H921 VanDerWaalsContact O-CD2 3.26Å; Q917-H921 PolarHBondContact O-N 3.38Å; Q917-H921 VanDerWaalsContact O-N 3.11Å
918	I	93.5	Very high	81.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-67.6	-43.8	174.5	-57.3	164.8	0	0	0	110.7	L856 Q889 L890 N893 L913 T914 L915 E916 E920 H921 L922	L856-I918 HydrophobicContact CD1-CG1 4.44Å; L856-I918 HydrophobicContact CD1-CG2 4.16Å; Q889-I918 HydrophobicContact CB-CD1 4.17Å; L890-I918 HydrophobicContact CD2-CB 4.02Å; L890-I918 HydrophobicContact CD2-CD1 4.46Å; L890-I918 HydrophobicContact CD2-CG2 3.46Å; L890-I918 VanDerWaalsContact CD2-CG2 3.46Å; L890-I918 HydrophobicContact CG-CG2 3.98Å; N893-I918 HydrophobicContact CB-CD1 4.17Å; L913-I918 HydrophobicContact CD1-CD1 4.34Å; L913-I918 HydrophobicContact CD1-CG1 3.69Å; L913-I918 HydrophobicContact CD2-CD1 4.02Å; L913-I918 HydrophobicContact CD2-CG1 4.11Å; L913-I918 HydrophobicContact CG-CD1 4.01Å; L913-I918 HydrophobicContact CG-CG1 3.93Å; T914-I918 WeakPolarHBondContact O-CG1 3.48Å; T914-I918 PolarHBondContact O-N 3.22Å; L915-I918 PolarHBondContact O-N 3.07Å; E916-I918 PolarHBondContact O-N 3.02Å; I918-E920 VanDerWaalsContact C-N 3.35Å; I918-H921 PolarHBondContact O-N 3.36Å; I918-L922 HydrophobicContact CG2-CD1 4Å; I918-L922 WeakPolarHBondContact O-CB 3.46Å; I918-L922 WeakPolarHBondContact O-CG 3.36Å; I918-L922 PolarHBondContact O-N 2.71Å
919	L	93.1	Very high	83.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.8	-38.3	179.1	-67.6	171.1	0	0	0	111.8	L890 L915 E916 L922 D923 L946 V949 F961 L964 F965	L890-L919 HydrophobicContact CD2-CD2 4.33Å; L915-L919 HydrophobicContact CG-CD1 4.26Å; L915-L919 WeakPolarHBondContact O-CG 3.34Å; L915-L919 PolarHBondContact O-N 3.35Å; L915-L919 VanDerWaalsContact O-N 3.09Å; E916-L919 PolarHBondContact O-N 3.46Å; L919-L922 PolarHBondContact O-N 3.18Å; L919-D923 PolarHBondContact O-N 3.05Å; L919-L946 HydrophobicContact CD2-CD2 4.26Å; L919-V949 HydrophobicContact CD1-CG1 4.37Å; L919-V949 HydrophobicContact CD2-CG1 4.44Å; L919-F961 HydrophobicContact CB-CD1 4.2Å; L919-F961 HydrophobicContact CB-CD2 3.79Å; L919-F961 HydrophobicContact CB-CE1 4.13Å; L919-F961 HydrophobicContact CB-CE2 3.71Å; L919-F961 HydrophobicContact CB-CG 4.03Å; L919-F961 HydrophobicContact CB-CZ 3.88Å; L919-F961 HydrophobicContact CD1-CD2 3.8Å; L919-F961 HydrophobicContact CD1-CE2 4.05Å; L919-F961 HydrophobicContact CG-CD2 4.4Å; L919-L964 HydrophobicContact CB-CD2 4.38Å; L919-L964 HydrophobicContact CD2-CD2 3.91Å; L919-F965 HydrophobicContact CD1-CZ 4.09Å; L919-F965 HydrophobicContact CD2-CE1 4.39Å; L919-F965 HydrophobicContact CD2-CZ 4.11Å
920	E	93.9	Very high	85.5	Confident	53 Å²	53	44 Å²	44	25%	0.248	24%	0.242	C	C	.	.	H	α-helix	trans	-68.8	-42.4	177.3	-174.3	161.8	-125.3	0	0	112.9	C860 E916 I918 L922 D923 N924 R960 F961	C860-E920 HydrophobicContact CB-CG 4.05Å; C860-E920 VanDerWaalsContact CB-OE2 3.25Å; C860-E920 WeakPolarHBondContact CB-OE2 3.37Å; C860-E920 PolarHBondContact SG-OE2 2.92Å; E916-E920 WeakPolarHBondContact O-CB 3.44Å; E916-E920 PolarHBondContact O-N 2.85Å; I918-E920 VanDerWaalsContact C-N 3.35Å; E920-L922 VanDerWaalsContact C-N 3.28Å; E920-L922 PolarHBondContact O-N 2.89Å; E920-D923 PolarHBondContact O-N 2.98Å; E920-N924 PolarHBondContact O-N 3.36Å; E920-N924 PolarHBondContact O-ND2 3Å; E920-R960 IonicContact OE1-CZ 3.98Å; E920-R960 IonicContact OE1-NH2 3.22Å; E920-R960 PolarHBondContact OE1-NH2 2.89Å; E920-R960 IonicContact OE2-NH2 3.29Å; E920-F961 HydrophobicContact CB-CE1 4.06Å; E920-F961 HydrophobicContact CB-CZ 4.11Å
921	H	95.1	Very high	85.9	Confident	8 Å²	8	45 Å²	45	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-33.1	171.7	-78.8	-52.7	0	0	0	112.5	L856 R858 T867 L871 Q917 I918 L925	L856-H921 HydrophobicContact CD2-CB 3.61Å; L856-H921 PolarHBondContact O-CD2 2.9Å; R858-H921 PolarHBondContact O-NE2 3.2Å; T867-H921 HydrophobicContact CG2-CB 4.29Å; T867-H921 VanDerWaalsContact CG2-ND1 3.32Å; T867-H921 WeakPolarHBondContact CG2-ND1 3.26Å; L871-H921 HydrophobicContact CD1-CB 4.46Å; Q917-H921 PolarHBondContact O-CD2 2.92Å; Q917-H921 VanDerWaalsContact O-CD2 3.26Å; Q917-H921 PolarHBondContact O-N 3.38Å; Q917-H921 VanDerWaalsContact O-N 3.11Å; I918-H921 PolarHBondContact O-N 3.36Å; H921-L925 WeakPolarHBondContact O-CB 3.47Å; H921-L925 PolarHBondContact O-N 3.27Å
922	L	94.6	Very high	86.1	Confident	1 Å²	1	48 Å²	48	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-70.6	-38.9	174	-79.5	169.1	0	0	0	113.1	I886 L890 I918 L919 E920 L925 R926 F936 F937 L964	I886-L922 HydrophobicContact CD1-CD2 4.03Å; I886-L922 HydrophobicContact CG2-CD1 3.91Å; I886-L922 HydrophobicContact CG2-CD2 4.15Å; I886-L922 HydrophobicContact CG2-CG 4.45Å; L890-L922 HydrophobicContact CD1-CD1 4.09Å; L890-L922 HydrophobicContact CD2-CD1 4.47Å; I918-L922 HydrophobicContact CG2-CD1 4Å; I918-L922 WeakPolarHBondContact O-CB 3.46Å; I918-L922 WeakPolarHBondContact O-CG 3.36Å; I918-L922 PolarHBondContact O-N 2.71Å; L919-L922 PolarHBondContact O-N 3.18Å; E920-L922 VanDerWaalsContact C-N 3.28Å; E920-L922 PolarHBondContact O-N 2.89Å; L922-L925 HydrophobicContact CD2-CD2 4.46Å; L922-L925 WeakPolarHBondContact O-CB 3.31Å; L922-L925 PolarHBondContact O-N 3Å; L922-R926 PolarHBondContact O-N 2.9Å; L922-F936 HydrophobicContact CD2-CE1 4.43Å; L922-F937 HydrophobicContact CD2-CE1 4.22Å; L922-F937 HydrophobicContact CD2-CZ 4.25Å; L922-F937 WeakPolarHBondContact O-CZ 3.36Å; L922-L964 HydrophobicContact CB-CD1 4.21Å; L922-L964 HydrophobicContact CB-CD2 3.88Å
923	D	92.6	Very high	85.9	Confident	30 Å²	30	52.3 Å²	52.3	16%	0.16	27%	0.269	C	S	.	.	H	α-helix	trans	-68.5	-40.3	176.6	-161.7	57.4	0	0	0	111.6	L919 E920 L925 R926 L927 F961	L919-D923 PolarHBondContact O-N 3.05Å; E920-D923 PolarHBondContact O-N 2.98Å; D923-L925 VanDerWaalsContact C-N 3.29Å; D923-L925 PolarHBondContact O-N 2.91Å; D923-R926 WeakPolarHBondContact O-CB 3.37Å; D923-R926 PolarHBondContact O-N 3.16Å; D923-R926 VanDerWaalsContact O-N 3.15Å; D923-R926 IonicContact OD1-CZ 3.71Å; D923-R926 IonicContact OD1-NE 2.88Å; D923-R926 PolarHBondContact OD1-NE 3.36Å; D923-R926 IonicContact OD1-NH2 2.97Å; D923-R926 PolarHBondContact OD1-NH2 3.28Å; D923-R926 IonicContact OD2-NH2 2.79Å; D923-R926 PolarHBondContact OD2-NH2 2.89Å; D923-L927 WeakPolarHBondContact O-CG 3.21Å; D923-L927 PolarHBondContact O-N 3.25Å; D923-F961 HydrophobicContact CB-CD1 4.36Å
924	N	93.1	Very high	85.4	Confident	65 Å²	65	53.6 Å²	53.6	35%	0.348	28%	0.276	S	S	.	.	H	α-helix	trans	-58.1	-40.3	170.1	-75.8	-55	0	0	0	112.2	E920 S928	E920-N924 PolarHBondContact O-N 3.36Å; E920-N924 PolarHBondContact O-ND2 3Å; N924-S928 VanDerWaalsContact O-CB 3.27Å; N924-S928 WeakPolarHBondContact O-CB 3.49Å; N924-S928 PolarHBondContact O-N 3.35Å
925	L	93	Very high	85.2	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.9	-42.3	173.7	-178.8	65.1	0	0	0	112.2	L871 R872 H921 L922 D923 S928 L929 F936 F937	L871-L925 HydrophobicContact CB-CD1 4.1Å; L871-L925 HydrophobicContact CB-CD2 4.2Å; R872-L925 HydrophobicContact CB-CD1 4.03Å; H921-L925 WeakPolarHBondContact O-CB 3.47Å; H921-L925 PolarHBondContact O-N 3.27Å; L922-L925 HydrophobicContact CD2-CD2 4.46Å; L922-L925 WeakPolarHBondContact O-CB 3.31Å; L922-L925 PolarHBondContact O-N 3Å; D923-L925 VanDerWaalsContact C-N 3.29Å; D923-L925 PolarHBondContact O-N 2.91Å; L925-S928 PolarHBondContact O-N 3.01Å; L925-L929 HydrophobicContact CD1-CD1 4.02Å; L925-L929 HydrophobicContact CD1-CG 4.05Å; L925-L929 HydrophobicContact CG-CD1 4Å; L925-L929 HydrophobicContact CG-CG 4.37Å; L925-L929 WeakPolarHBondContact O-CB 3.33Å; L925-L929 WeakPolarHBondContact O-CG 3.43Å; L925-L929 PolarHBondContact O-N 3.42Å; L925-F936 HydrophobicContact CD2-CD1 3.95Å; L925-F936 HydrophobicContact CD2-CE1 3.68Å; L925-F937 HydrophobicContact CB-CZ 4.38Å; L925-F937 HydrophobicContact CD2-CE2 4.34Å; L925-F937 HydrophobicContact CD2-CZ 4.24Å; L925-F937 HydrophobicContact CG-CE2 4.11Å; L925-F937 HydrophobicContact CG-CZ 4.28Å
926	R	92.3	Very high	85.3	Confident	51 Å²	51	54.6 Å²	54.6	19%	0.192	28%	0.279	C	S	.	.	H	α-helix	trans	-57.8	-51.9	175.4	179.3	-168.3	65.4	105.3	-7.5	111	L922 D923 S928 L929 S930 F937 D963 L967	L922-R926 PolarHBondContact O-N 2.9Å; D923-R926 WeakPolarHBondContact O-CB 3.37Å; D923-R926 PolarHBondContact O-N 3.16Å; D923-R926 VanDerWaalsContact O-N 3.15Å; D923-R926 IonicContact OD1-CZ 3.71Å; D923-R926 IonicContact OD1-NE 2.88Å; D923-R926 PolarHBondContact OD1-NE 3.36Å; D923-R926 IonicContact OD1-NH2 2.97Å; D923-R926 PolarHBondContact OD1-NH2 3.28Å; D923-R926 IonicContact OD2-NH2 2.79Å; D923-R926 PolarHBondContact OD2-NH2 2.89Å; R926-S928 VanDerWaalsContact C-N 3.32Å; R926-S928 PolarHBondContact O-N 3.48Å; R926-L929 PolarHBondContact O-N 2.83Å; R926-S930 PolarHBondContact O-N 2.92Å; R926-S930 VanDerWaalsContact O-N 3.09Å; R926-F937 VanDerWaalsContact CA-CE2 3.47Å; R926-F937 HydrophobicContact CB-CD2 4.44Å; R926-F937 HydrophobicContact CB-CE2 3.82Å; R926-F937 HydrophobicContact CB-CZ 3.87Å; R926-D963 IonicContact CZ-OD2 2.61Å; R926-D963 VanDerWaalsContact NH1-CB 3.3Å; R926-D963 IonicContact NH1-OD2 2.77Å; R926-D963 PolarHBondContact NH1-OD2 3Å; R926-D963 VanDerWaalsContact NH2-CB 3.26Å; R926-D963 IonicContact NH2-OD2 3.12Å; R926-D963 PolarHBondContact NH2-OD2 2.64Å; R926-L967 HydrophobicContact CG-CD1 4.25Å
927	L	89.3	Confident	85.4	Confident	89 Å²	89	52.3 Å²	52.3	47%	0.466	27%	0.268	S	S	.	.	H	α-helix	trans	-60.4	-42.1	177.9	-67.1	172.5	0	0	0	111.3	D923 S930	D923-L927 WeakPolarHBondContact O-CG 3.21Å; D923-L927 PolarHBondContact O-N 3.25Å; L927-S930 WeakPolarHBondContact O-CB 3.34Å; L927-S930 PolarHBondContact O-OG 2.95Å
928	S	87.8	Confident	85.3	Confident	29 Å²	29	55.7 Å²	55.7	20%	0.203	29%	0.291	C	S	.	.	H	α-helix	trans	-62.5	-44.7	176.1	-162.3	0	0	0	0	112.5	R872 N924 L925 R926 S930	R872-S928 VanDerWaalsContact NH1-C 3.35Å; R872-S928 PolarHBondContact NH1-O 3.22Å; R872-S928 PolarHBondContact NH1-OG 3.2Å; N924-S928 VanDerWaalsContact O-CB 3.27Å; N924-S928 WeakPolarHBondContact O-CB 3.49Å; N924-S928 PolarHBondContact O-N 3.35Å; L925-S928 PolarHBondContact O-N 3.01Å; R926-S928 VanDerWaalsContact C-N 3.32Å; R926-S928 PolarHBondContact O-N 3.48Å; S928-S930 PolarHBondContact O-N 2.78Å
929	L	85.9	Confident	85.1	Confident	11 Å²	11	57.5 Å²	57.5	6%	0.058	30%	0.299	C	S	.	.	H	α-helix	trans	-73.8	-20.6	-177.2	-73	-179.6	0	0	0	114.2	R872 A875 L925 R926 N931 M932 N934 F936 F937	R872-L929 HydrophobicContact CG-CD2 3.97Å; A875-L929 HydrophobicContact CB-CD1 4.38Å; L925-L929 HydrophobicContact CD1-CD1 4.02Å; L925-L929 HydrophobicContact CD1-CG 4.05Å; L925-L929 HydrophobicContact CG-CD1 4Å; L925-L929 HydrophobicContact CG-CG 4.37Å; L925-L929 WeakPolarHBondContact O-CB 3.33Å; L925-L929 WeakPolarHBondContact O-CG 3.43Å; L925-L929 PolarHBondContact O-N 3.42Å; R926-L929 PolarHBondContact O-N 2.83Å; L929-N931 PolarHBondContact O-N 3.16Å; L929-M932 PolarHBondContact O-N 3.09Å; L929-M932 VanDerWaalsContact O-O 3.06Å; L929-N934 HydrophobicContact CD1-CB 4.47Å; L929-N934 HydrophobicContact CD2-CB 3.97Å; L929-F936 HydrophobicContact CD1-CB 4.21Å; L929-F936 HydrophobicContact CD1-CD1 4.47Å; L929-F937 HydrophobicContact CD1-CD2 4.22Å; L929-F937 HydrophobicContact CD1-CE2 4.04Å
930	S	73.6	Confident	85	Confident	89 Å²	89	59.8 Å²	59.8	62%	0.622	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-29.2	178.2	68	0	0	0	0	114.8	R926 L927 S928 M932	R926-S930 PolarHBondContact O-N 2.92Å; R926-S930 VanDerWaalsContact O-N 3.09Å; L927-S930 WeakPolarHBondContact O-CB 3.34Å; L927-S930 PolarHBondContact O-OG 2.95Å; S928-S930 PolarHBondContact O-N 2.78Å; S930-M932 VanDerWaalsContact C-N 3.33Å; S930-M932 PolarHBondContact O-N 3.45Å
931	N	59.4	Low	84.9	Confident	137 Å²	137	58 Å²	58	73%	0.733	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	4.8	179.7	-69	-62.1	0	0	0	114.6	L929	L929-N931 PolarHBondContact O-N 3.16Å
932	M	60.5	Low	84.8	Confident	124 Å²	124	57.6 Å²	57.6	61%	0.611	30%	0.304	S	S	*	.	S	Bend	trans	-141.7	154.8	177.9	-67	-167.9	81.6	0	0	112.7	R872 L929 S930 N934	R872-M932 PolarHBondContact NH2-SD 2.9Å; L929-M932 PolarHBondContact O-N 3.09Å; L929-M932 VanDerWaalsContact O-O 3.06Å; S930-M932 VanDerWaalsContact C-N 3.33Å; S930-M932 PolarHBondContact O-N 3.45Å; M932-N934 PolarHBondContact O-N 2.9Å
933	K	65.8	Low	84.6	Confident	216 Å²	216	57.9 Å²	57.9	94%	0.939	31%	0.305	S	S	*	.			trans	-73.7	88.1	168.8	-65.8	-176.7	-179.9	-178.9	0	109.7
934	N	75.4	Confident	84.4	Confident	41 Å²	41	60.5 Å²	60.5	22%	0.219	32%	0.317	C	S	.	.			trans	-128.3	132.2	176.1	-176.9	-65.4	0	0	0	110	A875 L929 M932 F936	A875-N934 PolarHBondContact O-ND2 3.36Å; L929-N934 HydrophobicContact CD1-CB 4.47Å; L929-N934 HydrophobicContact CD2-CB 3.97Å; M932-N934 PolarHBondContact O-N 2.9Å; N934-F936 WeakPolarHBondContact OD1-CB 3.42Å; N934-F936 PolarHBondContact OD1-N 3.46Å
935	N	82.8	Confident	84.3	Confident	107 Å²	107	57.4 Å²	57.4	57%	0.572	30%	0.3	S	S	*	.			trans	-95.1	4.7	-171.4	-67.6	3.2	0	0	0	113.8	F937 T938	N935-F937 VanDerWaalsContact C-N 3.29Å; N935-F937 PolarHBondContact O-N 3.48Å; N935-F937 VanDerWaalsContact O-N 3.17Å; N935-T938 WeakPolarHBondContact O-CA 3.45Å; N935-T938 WeakPolarHBondContact O-CB 3.48Å; N935-T938 PolarHBondContact O-N 3.5Å; N935-T938 PolarHBondContact O-OG1 3.33Å
936	F	90.4	Very high	84.2	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-53.3	-41.2	-172.8	177.7	-104.8	0	0	0	113.7	A875 D879 L882 I886 L922 L925 L929 N934 T938 Q939 I942	A875-F936 HydrophobicContact CB-CB 4Å; A875-F936 HydrophobicContact CB-CD1 4.23Å; A875-F936 HydrophobicContact CB-CD2 3.89Å; A875-F936 HydrophobicContact CB-CE2 4.48Å; A875-F936 HydrophobicContact CB-CG 3.75Å; D879-F936 HydrophobicContact CB-CD2 3.89Å; L882-F936 HydrophobicContact CB-CE2 3.92Å; L882-F936 HydrophobicContact CD2-CD2 4.38Å; L882-F936 HydrophobicContact CD2-CE2 3.7Å; L882-F936 HydrophobicContact CD2-CZ 3.85Å; L882-F936 HydrophobicContact CG-CE2 3.78Å; L882-F936 HydrophobicContact CG-CZ 3.93Å; I886-F936 HydrophobicContact CD1-CZ 4.17Å; L922-F936 HydrophobicContact CD2-CE1 4.43Å; L925-F936 HydrophobicContact CD2-CD1 3.95Å; L925-F936 HydrophobicContact CD2-CE1 3.68Å; L929-F936 HydrophobicContact CD1-CB 4.21Å; L929-F936 HydrophobicContact CD1-CD1 4.47Å; N934-F936 WeakPolarHBondContact OD1-CB 3.42Å; N934-F936 PolarHBondContact OD1-N 3.46Å; F936-T938 VanDerWaalsContact C-N 3.28Å; F936-T938 PolarHBondContact O-N 2.87Å; F936-Q939 WeakPolarHBondContact O-CB 3.5Å; F936-Q939 WeakPolarHBondContact O-CG 3.09Å; F936-Q939 PolarHBondContact O-N 3.46Å; F936-I942 HydrophobicContact CE1-CD1 4.2Å; F936-I942 HydrophobicContact CE1-CG1 4.16Å; F936-I942 HydrophobicContact CE2-CD1 4.5Å; F936-I942 HydrophobicContact CE2-CG1 4.27Å; F936-I942 HydrophobicContact CZ-CD1 3.75Å; F936-I942 HydrophobicContact CZ-CG1 3.84Å
937	F	90.7	Very high	84	Confident	24 Å²	24	57.6 Å²	57.6	11%	0.105	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-75.9	-11.9	178.1	-77.4	-75.8	0	0	0	114.6	L922 L925 R926 L929 N935 Q939 I942 L943 L964 L967	L922-F937 HydrophobicContact CD2-CE1 4.22Å; L922-F937 HydrophobicContact CD2-CZ 4.25Å; L922-F937 WeakPolarHBondContact O-CZ 3.36Å; L925-F937 HydrophobicContact CB-CZ 4.38Å; L925-F937 HydrophobicContact CD2-CE2 4.34Å; L925-F937 HydrophobicContact CD2-CZ 4.24Å; L925-F937 HydrophobicContact CG-CE2 4.11Å; L925-F937 HydrophobicContact CG-CZ 4.28Å; R926-F937 VanDerWaalsContact CA-CE2 3.47Å; R926-F937 HydrophobicContact CB-CD2 4.44Å; R926-F937 HydrophobicContact CB-CE2 3.82Å; R926-F937 HydrophobicContact CB-CZ 3.87Å; L929-F937 HydrophobicContact CD1-CD2 4.22Å; L929-F937 HydrophobicContact CD1-CE2 4.04Å; N935-F937 VanDerWaalsContact C-N 3.29Å; N935-F937 PolarHBondContact O-N 3.48Å; N935-F937 VanDerWaalsContact O-N 3.17Å; F937-Q939 VanDerWaalsContact C-N 3.29Å; F937-I942 HydrophobicContact CD1-CG2 4.04Å; F937-I942 HydrophobicContact CE1-CG2 4.42Å; F937-L943 WeakPolarHBondContact O-CD2 3.34Å; F937-L964 HydrophobicContact CD1-CD1 4.38Å; F937-L964 HydrophobicContact CE1-CD1 3.72Å; F937-L964 HydrophobicContact CZ-CD1 4.38Å; F937-L967 HydrophobicContact CB-CD1 4.1Å; F937-L967 HydrophobicContact CD1-CD1 3.85Å; F937-L967 HydrophobicContact CG-CD1 4.05Å
938	T	88	Confident	84	Confident	95 Å²	95	57.3 Å²	57.3	58%	0.583	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-84.9	-3	169.6	70.4	0	0	0	0	112.9	N935 F936 T940 L943	N935-T938 WeakPolarHBondContact O-CA 3.45Å; N935-T938 WeakPolarHBondContact O-CB 3.48Å; N935-T938 PolarHBondContact O-N 3.5Å; N935-T938 PolarHBondContact O-OG1 3.33Å; F936-T938 VanDerWaalsContact C-N 3.28Å; F936-T938 PolarHBondContact O-N 2.87Å; T938-T940 PolarHBondContact O-N 2.74Å; T938-L943 WeakPolarHBondContact O-CD1 3.29Å
939	Q	88.9	Confident	84	Confident	37 Å²	37	55.9 Å²	55.9	17%	0.173	29%	0.29	C	S	.	.			trans	-69.9	124.7	-178.1	-74.8	-71.8	7.3	0	0	111.4	D879 D880 F936 F937 P941 I942 L943	D879-Q939 PolarHBondContact OD2-NE2 2.94Å; D880-Q939 PolarHBondContact OD1-NE2 3.43Å; D880-Q939 PolarHBondContact OD1-OE1 3.33Å; F936-Q939 WeakPolarHBondContact O-CB 3.5Å; F936-Q939 WeakPolarHBondContact O-CG 3.09Å; F936-Q939 PolarHBondContact O-N 3.46Å; F937-Q939 VanDerWaalsContact C-N 3.29Å; Q939-P941 VanDerWaalsContact C-N 3.29Å; Q939-P941 VanDerWaalsContact O-N 3.16Å; Q939-I942 PolarHBondContact O-N 3.4Å; Q939-L943 PolarHBondContact O-N 3.27Å; Q939-L943 VanDerWaalsContact O-N 3.16Å
940	T	90.8	Very high	84.1	Confident	49 Å²	49	57.4 Å²	57.4	30%	0.301	30%	0.296	S	S	.	.	H	α-helix	trans	-51.3	-38.5	-178	-70.2	0	0	0	0	113.9	T938 I942 L943 Q944 Y971	T938-T940 PolarHBondContact O-N 2.74Å; T940-I942 PolarHBondContact O-N 2.96Å; T940-L943 PolarHBondContact O-N 2.94Å; T940-Q944 HydrophobicContact CG2-CG 4.2Å; T940-Q944 WeakPolarHBondContact O-CB 3.01Å; T940-Q944 VanDerWaalsContact O-CG 3.26Å; T940-Q944 WeakPolarHBondContact O-CG 3.34Å; T940-Q944 PolarHBondContact O-N 3.45Å; T940-Y971 WeakPolarHBondContact CG2-OH 3.31Å; T940-Y971 PolarHBondContact OG1-OH 3.05Å; T940-Y971 VanDerWaalsContact OG1-OH 3.05Å
941	P	92	Very high	84.6	Confident	14 Å²	14	57.4 Å²	57.4	9%	0.091	30%	0.302	C	S	.	.	H	α-helix	trans	-55.9	-44.6	172.2	-29.1	37.1	0	0	0	114.4	E884 K887 Q939 A945	E884-P941 HydrophobicContact CG-CB 4.02Å; E884-P941 HydrophobicContact CG-CG 3.86Å; E884-P941 WeakPolarHBondContact OE1-CG 3.46Å; K887-P941 HydrophobicContact CB-CB 4.47Å; K887-P941 HydrophobicContact CD-CB 3.9Å; K887-P941 VanDerWaalsContact CD-O 3.28Å; K887-P941 WeakPolarHBondContact CD-O 3.48Å; Q939-P941 VanDerWaalsContact C-N 3.29Å; Q939-P941 VanDerWaalsContact O-N 3.16Å; P941-A945 WeakPolarHBondContact O-CB 3.31Å; P941-A945 PolarHBondContact O-N 2.54Å; P941-A945 VanDerWaalsContact O-N 3.12Å
942	I	93.1	Very high	85.8	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-68.8	-45.3	-179.8	-68	-62	0	0	0	110.5	I886 F936 F937 Q939 T940 Q944 A945 L946	I886-I942 HydrophobicContact CB-CD1 3.92Å; I886-I942 HydrophobicContact CG2-CD1 3.76Å; F936-I942 HydrophobicContact CE1-CD1 4.2Å; F936-I942 HydrophobicContact CE1-CG1 4.16Å; F936-I942 HydrophobicContact CE2-CD1 4.5Å; F936-I942 HydrophobicContact CE2-CG1 4.27Å; F936-I942 HydrophobicContact CZ-CD1 3.75Å; F936-I942 HydrophobicContact CZ-CG1 3.84Å; F937-I942 HydrophobicContact CD1-CG2 4.04Å; F937-I942 HydrophobicContact CE1-CG2 4.42Å; Q939-I942 PolarHBondContact O-N 3.4Å; T940-I942 PolarHBondContact O-N 2.96Å; I942-Q944 PolarHBondContact O-N 2.79Å; I942-A945 PolarHBondContact O-N 3.39Å; I942-A945 VanDerWaalsContact O-N 3.14Å; I942-L946 HydrophobicContact CG2-CD1 3.76Å; I942-L946 HydrophobicContact CG2-CG 4.33Å; I942-L946 WeakPolarHBondContact O-CG 3.25Å; I942-L946 PolarHBondContact O-N 2.57Å
943	L	91	Very high	86.8	Confident	7 Å²	7	48.6 Å²	48.6	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-45.8	-179.7	-62.2	167	0	0	0	111.7	F937 T938 Q939 T940 A945 L946 Q947 L967 A968 Y971	F937-L943 WeakPolarHBondContact O-CD2 3.34Å; T938-L943 WeakPolarHBondContact O-CD1 3.29Å; Q939-L943 PolarHBondContact O-N 3.27Å; Q939-L943 VanDerWaalsContact O-N 3.16Å; T940-L943 PolarHBondContact O-N 2.94Å; L943-A945 VanDerWaalsContact C-N 3.32Å; L943-A945 PolarHBondContact O-N 3.28Å; L943-L946 PolarHBondContact O-N 3.38Å; L943-Q947 WeakPolarHBondContact O-CG 3.36Å; L943-Q947 PolarHBondContact O-N 3.15Å; L943-L967 WeakPolarHBondContact CD2-O 3.25Å; L943-A968 HydrophobicContact CD2-CB 4.22Å; L943-Y971 HydrophobicContact CB-CD1 4.27Å; L943-Y971 HydrophobicContact CB-CG 4.22Å; L943-Y971 HydrophobicContact CD1-CD2 3.49Å; L943-Y971 VanDerWaalsContact CD1-CD2 3.49Å; L943-Y971 HydrophobicContact CD1-CE2 3.93Å; L943-Y971 HydrophobicContact CD1-CG 3.81Å
944	Q	88.3	Confident	87.6	Confident	85 Å²	85	40.7 Å²	40.7	40%	0.397	23%	0.231	S	C	.	.	H	α-helix	trans	-59.9	-39.8	173.3	-74	174.4	-4.2	0	0	112.8	T940 I942 H948	T940-Q944 HydrophobicContact CG2-CG 4.2Å; T940-Q944 WeakPolarHBondContact O-CB 3.01Å; T940-Q944 VanDerWaalsContact O-CG 3.26Å; T940-Q944 WeakPolarHBondContact O-CG 3.34Å; T940-Q944 PolarHBondContact O-N 3.45Å; I942-Q944 PolarHBondContact O-N 2.79Å; Q944-H948 WeakPolarHBondContact O-CB 3.46Å; Q944-H948 PolarHBondContact O-N 2.61Å
945	A	90.8	Very high	87.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-69.8	-41.1	-180	0	0	0	0	0	111.9	K887 L890 P941 I942 L943 H948 V949	K887-A945 HydrophobicContact CB-CB 3.82Å; K887-A945 HydrophobicContact CG-CB 4.01Å; L890-A945 HydrophobicContact CB-CB 4.31Å; L890-A945 HydrophobicContact CD1-CB 3.66Å; P941-A945 WeakPolarHBondContact O-CB 3.31Å; P941-A945 PolarHBondContact O-N 2.54Å; P941-A945 VanDerWaalsContact O-N 3.12Å; I942-A945 PolarHBondContact O-N 3.39Å; I942-A945 VanDerWaalsContact O-N 3.14Å; L943-A945 VanDerWaalsContact C-N 3.32Å; L943-A945 PolarHBondContact O-N 3.28Å; A945-H948 PolarHBondContact O-N 3.12Å; A945-V949 WeakPolarHBondContact O-CB 3.12Å; A945-V949 VanDerWaalsContact O-CG2 3.31Å; A945-V949 WeakPolarHBondContact O-CG2 3.38Å; A945-V949 PolarHBondContact O-N 2.96Å
946	L	91.6	Very high	87.9	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-46.8	176.2	-71.7	170.4	0	0	0	111.3	L919 I942 L943 H948 V949 Q950 L964 F965 A968	L919-L946 HydrophobicContact CD2-CD2 4.26Å; I942-L946 HydrophobicContact CG2-CD1 3.76Å; I942-L946 HydrophobicContact CG2-CG 4.33Å; I942-L946 WeakPolarHBondContact O-CG 3.25Å; I942-L946 PolarHBondContact O-N 2.57Å; L943-L946 PolarHBondContact O-N 3.38Å; L946-H948 PolarHBondContact O-N 3.32Å; L946-V949 PolarHBondContact O-N 3.17Å; L946-Q950 VanDerWaalsContact O-CB 3.31Å; L946-Q950 WeakPolarHBondContact O-CB 3.33Å; L946-Q950 PolarHBondContact O-N 2.63Å; L946-L964 HydrophobicContact CD2-CD2 4.19Å; L946-L964 HydrophobicContact CD2-CG 3.99Å; L946-F965 HydrophobicContact CB-CD1 4.43Å; L946-F965 HydrophobicContact CD2-CD1 4.29Å; L946-F965 HydrophobicContact CD2-CE1 4.24Å; L946-A968 HydrophobicContact CB-CB 3.73Å; L946-A968 HydrophobicContact CD1-CB 4.42Å
947	Q	88.5	Confident	87.5	Confident	55 Å²	55	43.7 Å²	43.7	26%	0.257	25%	0.251	S	S	.	.	H	α-helix	trans	-56.9	-47.7	173.6	-72.4	177.4	-12.1	0	0	112	L943 V949 Q950 A951 A968	L943-Q947 WeakPolarHBondContact O-CG 3.36Å; L943-Q947 PolarHBondContact O-N 3.15Å; Q947-V949 VanDerWaalsContact C-N 3.32Å; Q947-V949 PolarHBondContact O-N 3.45Å; Q947-Q950 PolarHBondContact O-N 3.2Å; Q947-A951 WeakPolarHBondContact O-CB 3.33Å; Q947-A951 PolarHBondContact O-N 2.8Å; Q947-A968 HydrophobicContact CG-CB 3.95Å; Q947-A968 PolarHBondContact NE2-O 3.4Å
948	H	87.9	Confident	87.3	Confident	82 Å²	82	45.1 Å²	45.1	38%	0.38	26%	0.258	S	S	.	.	H	α-helix	trans	-61.6	-39.7	177.8	-176.6	-37.9	0	0	0	111.8	N894 Q944 A945 L946 S952	N894-H948 PolarHBondContact ND2-ND1 2.93Å; Q944-H948 WeakPolarHBondContact O-CB 3.46Å; Q944-H948 PolarHBondContact O-N 2.61Å; A945-H948 PolarHBondContact O-N 3.12Å; L946-H948 PolarHBondContact O-N 3.32Å; H948-S952 PolarHBondContact O-OG 3.12Å
949	V	88.7	Confident	87.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-69.9	-47.2	177.8	168.1	0	0	0	0	110.8	L890 N894 L915 L919 A945 L946 Q947 A951 S952 C953 F965	L890-V949 HydrophobicContact CB-CG2 4.04Å; L890-V949 HydrophobicContact CD2-CG2 4.25Å; N894-V949 HydrophobicContact CB-CG2 4.3Å; L915-V949 HydrophobicContact CD1-CG1 4.04Å; L915-V949 HydrophobicContact CD1-CG2 4.09Å; L915-V949 HydrophobicContact CD2-CG1 4.12Å; L915-V949 HydrophobicContact CG-CG1 4.42Å; L919-V949 HydrophobicContact CD1-CG1 4.37Å; L919-V949 HydrophobicContact CD2-CG1 4.44Å; A945-V949 WeakPolarHBondContact O-CB 3.12Å; A945-V949 VanDerWaalsContact O-CG2 3.31Å; A945-V949 WeakPolarHBondContact O-CG2 3.38Å; A945-V949 PolarHBondContact O-N 2.96Å; L946-V949 PolarHBondContact O-N 3.17Å; Q947-V949 VanDerWaalsContact C-N 3.32Å; Q947-V949 PolarHBondContact O-N 3.45Å; V949-A951 VanDerWaalsContact C-N 3.27Å; V949-A951 PolarHBondContact O-N 2.92Å; V949-S952 CarbonylContact O-C 3.55Å; V949-S952 PolarHBondContact O-N 3.39Å; V949-S952 PolarHBondContact O-OG 3.17Å; V949-C953 HydrophobicContact CG1-CB 4.49Å; V949-C953 WeakPolarHBondContact O-CB 3.43Å; V949-C953 PolarHBondContact O-N 3.45Å; V949-F965 HydrophobicContact CB-CE1 4.37Å; V949-F965 HydrophobicContact CG1-CE1 4Å; V949-F965 HydrophobicContact CG1-CZ 4.02Å
950	Q	87.6	Confident	87.1	Confident	43 Å²	43	51.4 Å²	51.4	20%	0.201	28%	0.277	C	S	.	.	H	α-helix	trans	-56.6	-40.8	179	-164.5	-174.6	10.4	0	0	111.8	L946 Q947 S952 K958 F965 E969	L946-Q950 VanDerWaalsContact O-CB 3.31Å; L946-Q950 WeakPolarHBondContact O-CB 3.33Å; L946-Q950 PolarHBondContact O-N 2.63Å; Q947-Q950 PolarHBondContact O-N 3.2Å; Q950-S952 PolarHBondContact O-N 2.85Å; Q950-K958 WeakPolarHBondContact O-CE 3.05Å; Q950-F965 HydrophobicContact CB-CD1 3.65Å; Q950-F965 HydrophobicContact CB-CE1 3.83Å; Q950-F965 HydrophobicContact CB-CG 4.28Å; Q950-F965 HydrophobicContact CG-CB 4.3Å; Q950-F965 HydrophobicContact CG-CD1 3.9Å; Q950-F965 HydrophobicContact CG-CE1 4.37Å; Q950-F965 HydrophobicContact CG-CG 4.01Å; Q950-E969 PolarHBondContact NE2-OE1 3.18Å
951	A	85.5	Confident	87.1	Confident	89 Å²	89	49.4 Å²	49.4	74%	0.736	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.3	178.3	0	0	0	0	0	114.5	Q947 V949	Q947-A951 WeakPolarHBondContact O-CB 3.33Å; Q947-A951 PolarHBondContact O-N 2.8Å; V949-A951 VanDerWaalsContact C-N 3.27Å; V949-A951 PolarHBondContact O-N 2.92Å
952	S	83.5	Confident	87	Confident	66 Å²	66	51.8 Å²	51.8	46%	0.462	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	-2.6	-178.9	63	0	0	0	0	115.3	N894 H948 V949 Q950	N894-S952 VanDerWaalsContact CG-OG 3.26Å; N894-S952 PolarHBondContact ND2-OG 3.39Å; N894-S952 PolarHBondContact OD1-OG 2.75Å; H948-S952 PolarHBondContact O-OG 3.12Å; V949-S952 CarbonylContact O-C 3.55Å; V949-S952 PolarHBondContact O-N 3.39Å; V949-S952 PolarHBondContact O-OG 3.17Å; Q950-S952 PolarHBondContact O-N 2.85Å
953	C	82.4	Confident	86.8	Confident	9 Å²	9	55.9 Å²	55.9	6%	0.061	30%	0.303	C	S	.	.	S	Bend	trans	-77.8	157.2	175	-130.9	0	0	0	0	111.6	V949 H957 K958	V949-C953 HydrophobicContact CG1-CB 4.49Å; V949-C953 WeakPolarHBondContact O-CB 3.43Å; V949-C953 PolarHBondContact O-N 3.45Å; C953-H957 HydrophobicContact CB-CB 4.43Å; C953-H957 WeakPolarHBondContact SG-CB 3.28Å; C953-K958 WeakPolarHBondContact O-CE 3.43Å
954	D	81.9	Confident	86.8	Confident	51 Å²	51	55.5 Å²	55.5	27%	0.273	30%	0.301	S	S	.	.			trans	-81.1	161.5	171.5	62.6	59.5	0	0	0	112.4	R898 A956 H957 K958	R898-D954 IonicContact CZ-OD2 2.78Å; R898-D954 IonicContact NH1-OD2 3Å; R898-D954 PolarHBondContact NH1-OD2 3.08Å; R898-D954 IonicContact NH2-OD2 3.95Å; R898-D954 PolarHBondContact NH2-OD2 3.26Å; D954-A956 PolarHBondContact O-N 2.9Å; D954-A956 WeakPolarHBondContact OD1-CB 3.31Å; D954-A956 PolarHBondContact OD1-N 2.97Å; D954-H957 VanDerWaalsContact CG-ND1 3.32Å; D954-H957 PolarHBondContact O-N 3.47Å; D954-H957 IonicContact OD1-CE1 3.13Å; D954-H957 IonicContact OD1-CG 3.43Å; D954-H957 PolarHBondContact OD1-N 2.89Å; D954-H957 IonicContact OD1-ND1 3.21Å; D954-H957 PolarHBondContact OD1-ND1 2.96Å; D954-H957 IonicContact OD2-CE1 2.96Å; D954-H957 IonicContact OD2-ND1 2.69Å; D954-H957 PolarHBondContact OD2-ND1 2.74Å; D954-K958 PolarHBondContact O-N 3.36Å; D954-K958 VanDerWaalsContact O-N 3.12Å
955	E	82.6	Confident	87	Confident	113 Å²	113	51.6 Å²	51.6	53%	0.528	28%	0.283	S	S	.	.	H	α-helix	trans	-62.5	-24.1	-174.8	-54.6	-51	128.5	0	0	113.8	K958 M959	E955-K958 IonicContact OE1-NZ 3.78Å; E955-K958 PolarHBondContact OE1-NZ 3.36Å; E955-K958 WeakPolarHBondContact OE2-CD 3.46Å; E955-K958 IonicContact OE2-NZ 2.93Å; E955-M959 HydrophobicContact CB-CE 4.19Å; E955-M959 WeakPolarHBondContact O-CB 3.45Å; E955-M959 VanDerWaalsContact O-CE 3.25Å; E955-M959 WeakPolarHBondContact O-CE 3.48Å; E955-M959 WeakPolarHBondContact O-CG 3.33Å; E955-M959 PolarHBondContact O-N 2.98Å
956	A	81.4	Confident	86.8	Confident	67 Å²	67	53.6 Å²	53.6	55%	0.554	30%	0.299	S	S	*	.	H	α-helix	trans	-70.1	-42.4	177	0	0	0	0	0	111.3	D954 R960	D954-A956 PolarHBondContact O-N 2.9Å; D954-A956 WeakPolarHBondContact OD1-CB 3.31Å; D954-A956 PolarHBondContact OD1-N 2.97Å; A956-R960 WeakPolarHBondContact O-CB 3.26Å; A956-R960 PolarHBondContact O-N 2.76Å
957	H	82.7	Confident	86.5	Confident	30 Å²	30	56.2 Å²	56.2	14%	0.139	31%	0.313	C	S	.	.	H	α-helix	trans	-69.2	-38.1	174.4	-67	73.4	0	0	0	111.8	C953 D954 M959 R960 F961	C953-H957 HydrophobicContact CB-CB 4.43Å; C953-H957 WeakPolarHBondContact SG-CB 3.28Å; D954-H957 VanDerWaalsContact CG-ND1 3.32Å; D954-H957 PolarHBondContact O-N 3.47Å; D954-H957 IonicContact OD1-CE1 3.13Å; D954-H957 IonicContact OD1-CG 3.43Å; D954-H957 PolarHBondContact OD1-N 2.89Å; D954-H957 IonicContact OD1-ND1 3.21Å; D954-H957 PolarHBondContact OD1-ND1 2.96Å; D954-H957 IonicContact OD2-CE1 2.96Å; D954-H957 IonicContact OD2-ND1 2.69Å; D954-H957 PolarHBondContact OD2-ND1 2.74Å; H957-M959 PolarHBondContact O-N 2.79Å; H957-R960 PolarHBondContact O-N 3.3Å; H957-F961 WeakPolarHBondContact O-CD2 3.33Å; H957-F961 PolarHBondContact O-N 3.25Å
958	K	85.7	Confident	86.1	Confident	54 Å²	54	53.6 Å²	53.6	24%	0.235	30%	0.3	C	S	.	.	H	α-helix	trans	-60.9	-42.9	174.8	-68.6	173.8	-177	171.9	0	112.2	Q950 C953 D954 E955 S962	Q950-K958 WeakPolarHBondContact O-CE 3.05Å; C953-K958 WeakPolarHBondContact O-CE 3.43Å; D954-K958 PolarHBondContact O-N 3.36Å; D954-K958 VanDerWaalsContact O-N 3.12Å; E955-K958 IonicContact OE1-NZ 3.78Å; E955-K958 PolarHBondContact OE1-NZ 3.36Å; E955-K958 WeakPolarHBondContact OE2-CD 3.46Å; E955-K958 IonicContact OE2-NZ 2.93Å; K958-S962 WeakPolarHBondContact O-CA 3.31Å; K958-S962 PolarHBondContact O-N 2.82Å; K958-S962 VanDerWaalsContact O-N 3.14Å
959	M	85.6	Confident	85.4	Confident	140 Å²	140	54.5 Å²	54.5	69%	0.69	31%	0.305	S	S	*	.	H	α-helix	trans	-71.2	-32.9	175.5	-74.8	-175.9	-78.8	0	0	113	E955 H957	E955-M959 HydrophobicContact CB-CE 4.19Å; E955-M959 WeakPolarHBondContact O-CB 3.45Å; E955-M959 VanDerWaalsContact O-CE 3.25Å; E955-M959 WeakPolarHBondContact O-CE 3.48Å; E955-M959 WeakPolarHBondContact O-CG 3.33Å; E955-M959 PolarHBondContact O-N 2.98Å; H957-M959 PolarHBondContact O-N 2.79Å
960	R	88.1	Confident	84	Confident	125 Å²	125	61.7 Å²	61.7	47%	0.472	34%	0.338	S	S	.	.	H	α-helix	trans	-69.2	-35.3	176.6	-176.9	175.5	178	164.5	4.3	112.9	E916 E920 A956 H957	E916-R960 IonicContact OE1-CZ 3.05Å; E916-R960 IonicContact OE1-NH1 3.75Å; E916-R960 PolarHBondContact OE1-NH1 3.48Å; E920-R960 IonicContact OE1-CZ 3.98Å; E920-R960 IonicContact OE1-NH2 3.22Å; E920-R960 PolarHBondContact OE1-NH2 2.89Å; E920-R960 IonicContact OE2-NH2 3.29Å; A956-R960 WeakPolarHBondContact O-CB 3.26Å; A956-R960 PolarHBondContact O-N 2.76Å; H957-R960 PolarHBondContact O-N 3.3Å
961	F	91.2	Very high	82.8	Confident	6 Å²	6	61.8 Å²	61.8	3%	0.026	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	33	-173.8	-56.2	-68.4	0	0	0	112.7	E916 L919 E920 D923 H957 D963 L964 F965	E916-F961 HydrophobicContact CG-CE2 4.23Å; E916-F961 HydrophobicContact CG-CZ 4.27Å; L919-F961 HydrophobicContact CB-CD1 4.2Å; L919-F961 HydrophobicContact CB-CD2 3.79Å; L919-F961 HydrophobicContact CB-CE1 4.13Å; L919-F961 HydrophobicContact CB-CE2 3.71Å; L919-F961 HydrophobicContact CB-CG 4.03Å; L919-F961 HydrophobicContact CB-CZ 3.88Å; L919-F961 HydrophobicContact CD1-CD2 3.8Å; L919-F961 HydrophobicContact CD1-CE2 4.05Å; L919-F961 HydrophobicContact CG-CD2 4.4Å; E920-F961 HydrophobicContact CB-CE1 4.06Å; E920-F961 HydrophobicContact CB-CZ 4.11Å; D923-F961 HydrophobicContact CB-CD1 4.36Å; H957-F961 WeakPolarHBondContact O-CD2 3.33Å; H957-F961 PolarHBondContact O-N 3.25Å; F961-D963 VanDerWaalsContact C-N 3.33Å; F961-D963 PolarHBondContact O-N 3.2Å; F961-L964 HydrophobicContact CB-CB 4.34Å; F961-L964 WeakPolarHBondContact O-CB 3.24Å; F961-L964 PolarHBondContact O-N 3.4Å; F961-L964 VanDerWaalsContact O-N 3.08Å; F961-F965 HydrophobicContact CB-CD2 4.16Å; F961-F965 HydrophobicContact CB-CE2 3.9Å; F961-F965 VanDerWaalsContact O-CD2 3.22Å; F961-F965 WeakPolarHBondContact O-CD2 3.34Å; F961-F965 PolarHBondContact O-N 3.32Å; F961-F965 VanDerWaalsContact O-N 3.12Å
962	S	89.6	Confident	81.3	Confident	64 Å²	64	64.1 Å²	64.1	45%	0.448	33%	0.333	S	S	.	.	H	α-helix	trans	-53.7	-47	-175.7	51.6	0	0	0	0	112.9	K958 L964 F965 A966	K958-S962 WeakPolarHBondContact O-CA 3.31Å; K958-S962 PolarHBondContact O-N 2.82Å; K958-S962 VanDerWaalsContact O-N 3.14Å; S962-L964 VanDerWaalsContact C-N 3.27Å; S962-L964 PolarHBondContact O-N 2.95Å; S962-F965 PolarHBondContact O-N 3.02Å; S962-A966 WeakPolarHBondContact O-CB 3.4Å; S962-A966 PolarHBondContact O-N 3.18Å
963	D	89.4	Confident	79.9	Confident	86 Å²	86	67.4 Å²	67.4	46%	0.46	35%	0.346	S	S	.	.	H	α-helix	trans	-61.7	-33.4	179.7	-67.2	18.4	0	0	0	113.4	R926 F961	R926-D963 IonicContact CZ-OD2 2.61Å; R926-D963 VanDerWaalsContact NH1-CB 3.3Å; R926-D963 IonicContact NH1-OD2 2.77Å; R926-D963 PolarHBondContact NH1-OD2 3Å; R926-D963 VanDerWaalsContact NH2-CB 3.26Å; R926-D963 IonicContact NH2-OD2 3.12Å; R926-D963 PolarHBondContact NH2-OD2 2.64Å; F961-D963 VanDerWaalsContact C-N 3.33Å; F961-D963 PolarHBondContact O-N 3.2Å
964	L	90.6	Very high	78.5	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-76.2	-36.8	-179.6	-178.3	67.8	0	0	0	110.5	L919 L922 F937 L946 F961 S962 L967	L919-L964 HydrophobicContact CB-CD2 4.38Å; L919-L964 HydrophobicContact CD2-CD2 3.91Å; L922-L964 HydrophobicContact CB-CD1 4.21Å; L922-L964 HydrophobicContact CB-CD2 3.88Å; F937-L964 HydrophobicContact CD1-CD1 4.38Å; F937-L964 HydrophobicContact CE1-CD1 3.72Å; F937-L964 HydrophobicContact CZ-CD1 4.38Å; L946-L964 HydrophobicContact CD2-CD2 4.19Å; L946-L964 HydrophobicContact CD2-CG 3.99Å; F961-L964 HydrophobicContact CB-CB 4.34Å; F961-L964 WeakPolarHBondContact O-CB 3.24Å; F961-L964 PolarHBondContact O-N 3.4Å; F961-L964 VanDerWaalsContact O-N 3.08Å; S962-L964 VanDerWaalsContact C-N 3.27Å; S962-L964 PolarHBondContact O-N 2.95Å; L964-L967 HydrophobicContact CD1-CD1 4.38Å
965	F	91.3	Very high	77.1	Confident	3 Å²	3	75.1 Å²	75.1	1%	0.013	39%	0.389	C	S	.	.	H	α-helix	trans	-73.9	-35.8	175.6	-69.7	-59	0	0	0	113	L919 L946 V949 Q950 F961 S962 L967 A968	L919-F965 HydrophobicContact CD1-CZ 4.09Å; L919-F965 HydrophobicContact CD2-CE1 4.39Å; L919-F965 HydrophobicContact CD2-CZ 4.11Å; L946-F965 HydrophobicContact CB-CD1 4.43Å; L946-F965 HydrophobicContact CD2-CD1 4.29Å; L946-F965 HydrophobicContact CD2-CE1 4.24Å; V949-F965 HydrophobicContact CB-CE1 4.37Å; V949-F965 HydrophobicContact CG1-CE1 4Å; V949-F965 HydrophobicContact CG1-CZ 4.02Å; Q950-F965 HydrophobicContact CB-CD1 3.65Å; Q950-F965 HydrophobicContact CB-CE1 3.83Å; Q950-F965 HydrophobicContact CB-CG 4.28Å; Q950-F965 HydrophobicContact CG-CB 4.3Å; Q950-F965 HydrophobicContact CG-CD1 3.9Å; Q950-F965 HydrophobicContact CG-CE1 4.37Å; Q950-F965 HydrophobicContact CG-CG 4.01Å; F961-F965 HydrophobicContact CB-CD2 4.16Å; F961-F965 HydrophobicContact CB-CE2 3.9Å; F961-F965 VanDerWaalsContact O-CD2 3.22Å; F961-F965 WeakPolarHBondContact O-CD2 3.34Å; F961-F965 PolarHBondContact O-N 3.32Å; F961-F965 VanDerWaalsContact O-N 3.12Å; S962-F965 PolarHBondContact O-N 3.02Å; F965-L967 PolarHBondContact O-N 3.08Å; F965-L967 VanDerWaalsContact O-N 3.16Å; F965-A968 WeakPolarHBondContact O-CA 3.46Å; F965-A968 WeakPolarHBondContact O-CB 3.06Å; F965-A968 PolarHBondContact O-N 3.03Å
966	A	88	Confident	75.4	Confident	42 Å²	42	72.2 Å²	72.2	35%	0.347	38%	0.384	S	S	.	.	H	α-helix	trans	-54.9	-34.5	179	0	0	0	0	0	113.4	S962 A968 E969 E970	S962-A966 WeakPolarHBondContact O-CB 3.4Å; S962-A966 PolarHBondContact O-N 3.18Å; A966-A968 PolarHBondContact O-N 2.85Å; A966-A968 VanDerWaalsContact O-N 3.12Å; A966-E969 PolarHBondContact O-N 3.41Å; A966-E970 PolarHBondContact O-N 2.88Å
967	L	84.7	Confident	73	Confident	55 Å²	55	76.9 Å²	76.9	29%	0.288	39%	0.392	S	S	.	.	H	α-helix	trans	-55.2	-29.4	174	-60.2	173	0	0	0	113.1	R926 F937 L943 L964 F965	R926-L967 HydrophobicContact CG-CD1 4.25Å; F937-L967 HydrophobicContact CB-CD1 4.1Å; F937-L967 HydrophobicContact CD1-CD1 3.85Å; F937-L967 HydrophobicContact CG-CD1 4.05Å; L943-L967 WeakPolarHBondContact CD2-O 3.25Å; L964-L967 HydrophobicContact CD1-CD1 4.38Å; F965-L967 PolarHBondContact O-N 3.08Å; F965-L967 VanDerWaalsContact O-N 3.16Å
968	A	79.6	Confident	70.9	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-92.8	-11.2	-178.6	0	0	0	0	0	113.5	L943 L946 Q947 F965 A966	L943-A968 HydrophobicContact CD2-CB 4.22Å; L946-A968 HydrophobicContact CB-CB 3.73Å; L946-A968 HydrophobicContact CD1-CB 4.42Å; Q947-A968 HydrophobicContact CG-CB 3.95Å; Q947-A968 PolarHBondContact NE2-O 3.4Å; F965-A968 WeakPolarHBondContact O-CA 3.46Å; F965-A968 WeakPolarHBondContact O-CB 3.06Å; F965-A968 PolarHBondContact O-N 3.03Å; A966-A968 PolarHBondContact O-N 2.85Å; A966-A968 VanDerWaalsContact O-N 3.12Å
969	E	73.3	Confident	68.9	Low	102 Å²	102	86 Å²	86	48%	0.477	45%	0.45	S	S	.	.	H	α-helix	trans	-81.8	-39.5	173.9	-61.6	-179.3	172.5	0	0	110.6	Q950 A966 Y971 E972 D973	Q950-E969 PolarHBondContact NE2-OE1 3.18Å; A966-E969 PolarHBondContact O-N 3.41Å; E969-Y971 PolarHBondContact O-N 3.21Å; E969-Y971 VanDerWaalsContact O-N 3.14Å; E969-E972 PolarHBondContact O-N 2.68Å; E969-D973 PolarHBondContact O-N 2.99Å
970	E	60.3	Low	66.4	Low	150 Å²	150	89.2 Å²	89.2	70%	0.701	46%	0.461	S	S	*	.	H	α-helix	trans	-59.4	-24.8	173	-63.7	-170.4	163.9	0	0	113.2	A966 S974	A966-E970 PolarHBondContact O-N 2.88Å; E970-S974 PolarHBondContact O-OG 3.12Å
971	Y	61	Low	63.7	Low	46 Å²	46	88.4 Å²	88.4	18%	0.18	47%	0.474	C	S	.	.	H	α-helix	trans	-74.9	-28.1	174.3	-171.6	-106.3	0	0	0	113.4	T940 L943 E969 S974 Q975	T940-Y971 WeakPolarHBondContact CG2-OH 3.31Å; T940-Y971 PolarHBondContact OG1-OH 3.05Å; T940-Y971 VanDerWaalsContact OG1-OH 3.05Å; L943-Y971 HydrophobicContact CB-CD1 4.27Å; L943-Y971 HydrophobicContact CB-CG 4.22Å; L943-Y971 HydrophobicContact CD1-CD2 3.49Å; L943-Y971 VanDerWaalsContact CD1-CD2 3.49Å; L943-Y971 HydrophobicContact CD1-CE2 3.93Å; L943-Y971 HydrophobicContact CD1-CG 3.81Å; E969-Y971 PolarHBondContact O-N 3.21Å; E969-Y971 VanDerWaalsContact O-N 3.14Å; Y971-S974 WeakPolarHBondContact CA-OG 3.47Å; Y971-S974 PolarHBondContact O-OG 2.91Å; Y971-Q975 HydrophobicContact CE1-CG 4.49Å; Y971-Q975 VanDerWaalsContact CE1-NE2 3.3Å; Y971-Q975 VanDerWaalsContact CZ-NE2 3.28Å; Y971-Q975 PolarHBondContact O-N 3.14Å; Y971-Q975 PolarHBondContact OH-NE2 3.2Å
972	E	55.3	Low	60.8	Low	137 Å²	137	99 Å²	99	64%	0.64	51%	0.514	S	S	*	.	H	α-helix	trans	-74.7	-43.3	-179.1	-155.2	174.2	-149.7	0	0	110.6	E969 S974 Q975 A976	E969-E972 PolarHBondContact O-N 2.68Å; E972-S974 VanDerWaalsContact C-N 3.26Å; E972-S974 PolarHBondContact O-N 2.78Å; E972-Q975 PolarHBondContact O-N 2.99Å; E972-A976 WeakPolarHBondContact O-CB 3.49Å; E972-A976 PolarHBondContact O-N 3.38Å
973	D	53.1	Low	58	Low	136 Å²	136	107 Å²	107	73%	0.727	53%	0.534	S	S	*	.	H	α-helix	trans	-61.7	-32.9	175.6	-114.6	-16	0	0	0	112.7	E969 A976	E969-D973 PolarHBondContact O-N 2.99Å; D973-A976 PolarHBondContact O-N 3.48Å
974	S	53.8	Low	55.1	Low	89 Å²	89	112.6 Å²	112.6	62%	0.622	55%	0.554	S	S	*	*	H	α-helix	trans	-81.4	-15.7	-178.3	48.2	0	0	0	0	114.8	E970 Y971 E972	E970-S974 PolarHBondContact O-OG 3.12Å; Y971-S974 WeakPolarHBondContact CA-OG 3.47Å; Y971-S974 PolarHBondContact O-OG 2.91Å; E972-S974 VanDerWaalsContact C-N 3.26Å; E972-S974 PolarHBondContact O-N 2.78Å
975	Q	52.8	Low	52.1	Low	133 Å²	133	116.9 Å²	116.9	62%	0.621	59%	0.59	S	S	*	*	H	α-helix	trans	-87.3	-14.8	164.9	-66.6	-156.7	7.6	0	0	113.6	Y971 E972 K977	Y971-Q975 HydrophobicContact CE1-CG 4.49Å; Y971-Q975 VanDerWaalsContact CE1-NE2 3.3Å; Y971-Q975 VanDerWaalsContact CZ-NE2 3.28Å; Y971-Q975 PolarHBondContact O-N 3.14Å; Y971-Q975 PolarHBondContact OH-NE2 3.2Å; E972-Q975 PolarHBondContact O-N 2.99Å; Q975-K977 PolarHBondContact O-N 2.96Å
976	A	45.4	Very low	49.5	Very low	52 Å²	52	122.5 Å²	122.5	43%	0.43	63%	0.626	S	S	.	*			trans	-83.8	39.3	-159.9	0	0	0	0	0	117.6	E972 D973	E972-A976 WeakPolarHBondContact O-CB 3.49Å; E972-A976 PolarHBondContact O-N 3.38Å; D973-A976 PolarHBondContact O-N 3.48Å
977	K	32.5	Very low	46.7	Very low	164 Å²	164	124.9 Å²	124.9	71%	0.713	65%	0.647	S	S	*	*			trans	-165.9	153.4	164.9	-100.2	125.4	-145.2	154	0	111.5	Q975 L979	Q975-K977 PolarHBondContact O-N 2.96Å; K977-L979 HydrophobicContact CG-CD1 4.02Å
978	P	38.2	Very low	43.9	Very low	128 Å²	128	128.4 Å²	128.4	83%	0.831	68%	0.675	S	S	*	*			cis	-118.5	165.6	35.4	39.9	-31	0	0	0	117.1
979	L	43.8	Very low	41.4	Very low	147 Å²	147	133.6 Å²	133.6	77%	0.77	71%	0.712	S	S	*	*			trans	-79.2	138.2	-172.9	-53.9	89.5	0	0	0	113.8	K977	K977-L979 HydrophobicContact CG-CD1 4.02Å
980	K	33.3	Very low	40.1	Very low	209 Å²	209	133.4 Å²	133.4	91%	0.909	72%	0.72	S	S	*	*			trans	-140.3	102.5	156.7	-76	-167.6	178.3	174.2	0	114.6
981	S	29.6	Very low	38.6	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	73%	0.728	S	S	*	*			trans	35.6	96.9	139.9	-176.7	0	0	0	0	121.3
982	R	32	Very low	37	Very low	228 Å²	228	140.1 Å²	140.1	86%	0.86	75%	0.754	S	S	*	*				48.3	100.1	115.8	-171.1	-164.6	-166.4	-172.9	7.5	118.8
983	R	30.1	Very low	35.8	Very low	234 Å²	234	144.7 Å²	144.7	88%	0.883	77%	0.766	S	S	*	*				-177.4	134	124.9	-104.7	166.4	-179.9	179.9	0.6	115.7
984	K	29.1	Very low	35	Very low	202 Å²	202	148.3 Å²	148.3	88%	0.878	78%	0.775	S	S	*	*			trans	46	126.7	148.4	-72.6	-167	172.4	-170.1	0	122.4
985	A	26.8	Very low	33.7	Very low	90 Å²	90	147.4 Å²	147.4	74%	0.744	78%	0.78	S	S	*	*			trans	-68.9	176.3	152.3	0	0	0	0	0	111.6
986	P	37.8	Very low	32.6	Very low	121 Å²	121	148.2 Å²	148.2	79%	0.786	79%	0.794	S	S	*	*			cis	-145	168.7	21.2	43.6	-23.6	0	0	0	120.3
987	A	27.6	Very low	32	Very low	93 Å²	93	149.9 Å²	149.9	77%	0.769	81%	0.807	S	S	*	*			trans	23.8	130.5	147.8	0	0	0	0	0	122.8
988	S	26.7	Very low	32.9	Very low	128 Å²	128	147.7 Å²	147.7	90%	0.895	81%	0.81	S	S	*	*				178	171.4	116.9	44.4	0	0	0	0	113.6
989	S	26.5	Very low	33.6	Very low	110 Å²	110	146.3 Å²	146.3	77%	0.769	80%	0.801	S	S	*	*			trans	-136.3	168.2	173.4	-160.5	0	0	0	0	106.2
990	P	46.8	Very low	33.2	Very low	98 Å²	98	145 Å²	145	64%	0.636	80%	0.799	S	S	*	*			cis	-147.9	-171	14.4	44.5	-23.6	0	0	0	117.7
991	R	29	Very low	33.2	Very low	231 Å²	231	141.1 Å²	141.1	87%	0.872	79%	0.788	S	S	*	*			trans	68.4	114.7	145.6	-81.3	174.3	177.9	179.7	0	123.6
992	S	27.1	Very low	33.5	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	78%	0.78	S	S	*	*				108.4	135.3	109	77.1	0	0	0	0	125.2
993	R	29.7	Very low	33.7	Very low	233 Å²	233	137.8 Å²	137.8	88%	0.879	77%	0.774	S	S	*	*			trans	69.1	105.1	139.8	-74.7	178.4	175.9	-172.2	-0.2	125.4
994	K	35.8	Very low	34	Very low	212 Å²	212	135 Å²	135	92%	0.922	77%	0.771	S	S	*	*				72.8	127	108	-135.8	-167.5	-171.4	-162.5	0	124.4
995	G	27.8	Very low	34.3	Very low	70 Å²	70	132.4 Å²	132.4	72%	0.722	76%	0.762	S	S	*	*			trans	118	159.7	146	0	0	0	0	0	118.4
996	V	28.5	Very low	34.6	Very low	151 Å²	151	132.7 Å²	132.7	92%	0.915	76%	0.759	S	S	*	*			cis	-158.6	165.6	-20.7	169.9	0	0	0	0	108.8
997	A	33.6	Very low	34.3	Very low	87 Å²	87	131.5 Å²	131.5	72%	0.719	76%	0.759	S	S	*	*			trans	-89.9	-152.2	179.4	0	0	0	0	0	114
998	P	52	Low	34.4	Very low	118 Å²	118	132.3 Å²	132.3	77%	0.766	76%	0.759	S	S	*	*			cis	-131.7	-134.5	-11.1	42.6	-20.1	0	0	0	112.3
999	P	52.1	Low	34.5	Very low	99 Å²	99	131 Å²	131	64%	0.643	75%	0.75	S	S	*	*			cis	-140.3	166.4	-29.4	42.6	-24.1	0	0	0	119.3
1000	T	35.1	Very low	34.6	Very low	119 Å²	119	131.3 Å²	131.3	73%	0.73	75%	0.752	S	S	*	*			trans	53.3	132.3	137.4	57.8	0	0	0	0	130.1
1001	N	33.5	Very low	33.6	Very low	127 Å²	127	130.4 Å²	130.4	68%	0.679	75%	0.753	S	S	*	*				96.2	128.5	127.8	-80.7	45.6	0	0	0	126.5
1002	N	36.3	Very low	33.6	Very low	108 Å²	108	123.1 Å²	123.1	58%	0.578	74%	0.738	S	S	*	*			trans	57	152.4	136.5	-62.8	30	0	0	0	121.2
1003	E	36.4	Very low	33.7	Very low	158 Å²	158	126.5 Å²	126.5	74%	0.738	74%	0.742	S	S	*	*			cis	-158.9	-169.3	-10.5	-106.3	149.3	178.4	0	0	105.9
1004	E	35.8	Very low	33.6	Very low	174 Å²	174	122.8 Å²	122.8	81%	0.813	73%	0.734	S	S	*	*			cis	-166.1	-178	11.3	-134.3	178.4	178.8	0	0	105.3
1005	E	34.5	Very low	33.2	Very low	148 Å²	148	121.2 Å²	121.2	69%	0.692	73%	0.73	S	S	*	*			cis	-163.8	159.3	-8.7	-149.7	-75.2	97.5	0	0	108
1006	S	34.7	Very low	33.2	Very low	97 Å²	97	122.8 Å²	122.8	68%	0.678	72%	0.722	S	S	*	*			trans	65.5	147.7	166.5	78.8	0	0	0	0	119.4
1007	A	31.4	Very low	33	Very low	96 Å²	96	120.9 Å²	120.9	79%	0.793	72%	0.715	S	S	*	*			cis	-177	155.9	-16.9	0	0	0	0	0	106.1
1008	S	29.1	Very low	32.6	Very low	110 Å²	110	124 Å²	124	77%	0.769	71%	0.713	S	S	*	*			cis	-160.6	-162.6	-13.6	63.8	0	0	0	0	104.8
1009	S	28.4	Very low	32	Very low	101 Å²	101	123.5 Å²	123.5	71%	0.706	71%	0.71	S	S	*	*			cis	-179.7	155.4	-9.5	34.3	0	0	0	0	104
1010	S	29.4	Very low	30.6	Very low	115 Å²	115	128.2 Å²	128.2	80%	0.804	72%	0.72	S	S	*	*			cis	-174.9	161.9	-7.5	46.2	0	0	0	0	104.7
1011	A	26.3	Very low	30.4	Very low	80 Å²	80	126.9 Å²	126.9	66%	0.661	72%	0.721	S	S	*	*			cis	-141.3	140.5	11.4	0	0	0	0	0	107
1012	S	28.6	Very low	30.1	Very low	78 Å²	78	127.3 Å²	127.3	55%	0.545	73%	0.731	S	S	.	*				71.2	147.7	52.9	85.7	0	0	0	0	112.8	E1014	S1012-E1014 WeakPolarHBondContact CA-OE1 3.49Å
1013	E	29.5	Very low	29.7	Very low	176 Å²	176	131.3 Å²	131.3	82%	0.822	74%	0.743	S	S	*	*			cis	-128.7	-173.4	16.9	-131.4	121.3	-69.2	0	0	114.4
1014	E	27.1	Very low	29.2	Very low	155 Å²	155	134.9 Å²	134.9	72%	0.724	75%	0.75	S	S	*	*			trans	-136.1	-172.6	-152.3	-76.6	124.7	-91.5	0	0	113.7	S1012	S1012-E1014 WeakPolarHBondContact CA-OE1 3.49Å
1015	E	28	Very low	28.7	Very low	178 Å²	178	135.9 Å²	135.9	83%	0.832	75%	0.751	S	S	*	*			cis	-163.3	-166.8	19.4	-145.5	-162.1	168.7	0	0	114.6
1016	D	27.4	Very low	28.2	Very low	104 Å²	104	139.5 Å²	139.5	56%	0.556	76%	0.759	S	S	*	*			trans	-55	162.4	166.3	-150	-2.5	0	0	0	110.3	K1018	D1016-K1018 IonicContact OD1-NZ 3.94Å; D1016-K1018 PolarHBondContact OD1-NZ 3.19Å; D1016-K1018 VanDerWaalsContact OD1-NZ 3.12Å; D1016-K1018 IonicContact OD2-NZ 2.82Å; D1016-K1018 PolarHBondContact OD2-NZ 3.45Å
1017	S	24.8	Very low	27.8	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	77%	0.765	S	S	*	*				177.3	170.6	71.5	50.8	0	0	0	0	116.9
1018	K	24.5	Very low	27.5	Very low	153 Å²	153	142.9 Å²	142.9	67%	0.665	77%	0.765	S	S	*	*			trans	-77.9	-177	-176.6	-64.5	165.7	-164.4	75.1	0	112.3	D1016	D1016-K1018 IonicContact OD1-NZ 3.94Å; D1016-K1018 PolarHBondContact OD1-NZ 3.19Å; D1016-K1018 VanDerWaalsContact OD1-NZ 3.12Å; D1016-K1018 IonicContact OD2-NZ 2.82Å; D1016-K1018 PolarHBondContact OD2-NZ 3.45Å
1019	P	38.3	Very low	27.4	Very low	108 Å²	108	143.5 Å²	143.5	70%	0.701	77%	0.769	S	S	*	*			cis	-143.5	173.7	-39	36.7	-17.9	0	0	0	116.9
1020	K	24.6	Very low	27.4	Very low	197 Å²	197	144.3 Å²	144.3	86%	0.857	78%	0.775	S	S	*	*			trans	58.7	105.8	142	-76.5	171	179.3	168.8	0	122.3
1021	A	29	Very low	27.2	Very low	92 Å²	92	143 Å²	143	76%	0.76	77%	0.771	S	S	*	*				68.6	150.5	123.8	0	0	0	0	0	121.1
1022	P	28.9	Very low	27.4	Very low	135 Å²	135	146.3 Å²	146.3	88%	0.877	78%	0.783	S	S	*	*				-142.1	172.4	93.8	39.1	-25.7	0	0	0	116.2
1023	K	27.4	Very low	27.4	Very low	192 Å²	192	146 Å²	146	84%	0.835	79%	0.791	S	S	*	*			trans	-102.8	145.8	-179.1	-59.2	164.4	177.8	170.3	0	112.5
1024	R	25.3	Very low	27.3	Very low	233 Å²	233	143.2 Å²	143.2	88%	0.879	79%	0.791	S	S	*	*			trans	-174.5	130.1	137.1	-101.2	152.2	179.8	-154.8	-0.7	108.5
1025	K	24.4	Very low	27.4	Very low	195 Å²	195	142.9 Å²	142.9	85%	0.848	80%	0.795	S	S	*	*				54.5	130.6	71.6	-66.6	-177	175.8	179.1	0	111.2
1026	R	25.6	Very low	27.5	Very low	224 Å²	224	139.3 Å²	139.3	85%	0.845	79%	0.789	S	S	*	*			cis	-163.3	175.6	36.1	-152.2	178.2	-174.3	-177.1	0.4	111.2
1027	K	25.4	Very low	27.8	Very low	188 Å²	188	145.1 Å²	145.1	82%	0.817	82%	0.821	S	S	*	*			trans	-16.9	140.5	161.1	-61.5	177.5	169.4	-163.9	0	115.5
1028	G	25.9	Very low	28	Very low	76 Å²	76	146.9 Å²	146.9	78%	0.784	82%	0.823	S	S	*	*			cis	102.4	115.1	9.3	0	0	0	0	0	113
1029	S	26	Very low	28.2	Very low	124 Å²	124	146.6 Å²	146.6	87%	0.867	83%	0.831	S	S	*	*			trans	-154.4	140.3	176.8	48.3	0	0	0	0	110.1
1030	S	28.2	Very low	27.6	Very low	118 Å²	118	148.7 Å²	148.7	83%	0.825	84%	0.839	S	S	*	*			trans	-85.7	148.3	174.7	52.5	0	0	0	0	112.2
1031	A	26.9	Very low	27.8	Very low	88 Å²	88	145.9 Å²	145.9	73%	0.727	84%	0.838	S	S	*	*				171.9	162	117.7	0	0	0	0	0	112.4
1032	V	29.2	Very low	27.7	Very low	149 Å²	149	149.3 Å²	149.3	90%	0.903	84%	0.842	S	S	*	*			trans	68.9	138.5	167.4	-160.4	0	0	0	0	115.4
1033	G	29.4	Very low	27.6	Very low	70 Å²	70	150.2 Å²	150.2	72%	0.722	84%	0.84	S	S	*	*			trans	-128.9	172.3	166.8	0	0	0	0	0	109.8
1034	S	27.6	Very low	27.6	Very low	118 Å²	118	147.2 Å²	147.2	83%	0.825	84%	0.841	S	S	*	*			trans	-153.3	160.3	173.8	-170.1	0	0	0	0	108.6
1035	D	28	Very low	27.8	Very low	148 Å²	148	140.6 Å²	140.6	79%	0.791	84%	0.838	S	S	*	*			trans	-72.8	178.4	178.9	-45.2	-89.5	0	0	0	113.4
1036	S	31.4	Very low	28.1	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	84%	0.837	S	S	*	*			trans	72.1	134.1	173.2	-81.8	0	0	0	0	117.3
1037	D	33.5	Very low	28.3	Very low	227 Å²	227	128.1 Å²	128.1	100%	1.214	84%	0.836	S	S	*	*			cis	-131.6	0	-5.3	-72.8	-47	0	0	0	110.3

Retrieved 1,037 of 1,037 residues in 1183.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).