A0A087XGR7_POEFO Loading...

phospholipase A2

AlphaFold DB , UniProt , Accession A0A087XGR7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 825 aa.

						>A0A087XGR7_POEFO|A0A087XGR7
MQFLGRLLDTVSSVSTSVSTLFTNPYRVREVQLSDYGGGGKVRLKEDGRMVLYKNTQCQSWDCVLLSPETPTVALRLFQVGSEEDAMNWFPQFALKLRPFYESLTLKADTVQTIVDCIRNHPDWSSAHIAVETGMRECLKHNYVQSQINARDASGQTPLHLACERGDLACVKELLDESQARTDIRDQKGETPMHYASKQESPVIIQALCSRLCSGVNELNSNGETPLHVACRLGRVESVKALLEGGAKCDTRGSTGNPIHTAMKYSEKGCVEQILKADPFQLQAEDCVYGGTPLHWAKTAEMCRLLLDRGCEINYLSKTGESALHVLTKKGRFEAAMVLLTHGANANLKGQDGNTALHLAMKMDHMELIKGLIVFGADVEIHNDLGETPGLIAARTSKGPNRRILLDMLCSVGVQRCLPRSPSSPPPLPPPPVSNKTKPRAIGFEDIMYVGAAIGAIGKSEIDGQVMEKKKIDRLLCLDGGGIKGLVLIQMLIALEKEAGRPTRELFDWVAGTSTGGILALAIIHGKSMEYLRCLYFRMKEQVFRGSRPYESAPLEDFLKKEFGENTKMTDIRFPRVMVTSVLADRHPGELHIFRNYDPPSVRREPSYTTTATFKPLTIPQGWEDEDVLIVGYTDEPPRKRRKVTDEEQLIWRAARSSGAAPTYFRPMGRFLDGGLLANNPTLDAMAEIHQFNKSLKAEGREANIKKLGIVVSLGTGKPPQEVVTSVDVFRPSNPLELAKTFVGAKELGKMLVDCCTDSDGCAVDRARAWCEMIDTIYHRLSPQLSQEVMLDEVSDEVLVNMLWETQMYLFEKREVLQSLAKTLL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.8	Very low	36.2	Very low	240 Å²	240	137.3 Å²	137.3	100%	1.182	69%	0.693	S	S	*	*				0	44.5	0	-76.4	-113.1	-108.5	0	0	112.8
2	Q	41	Very low	35.9	Very low	178 Å²	178	131.3 Å²	131.3	83%	0.832	67%	0.674	S	S	*	*			trans	-139.1	-0.4	169.7	-83.8	-177.2	-13.7	0	0	113.3
3	F	31.3	Very low	35.7	Very low	187 Å²	187	126.3 Å²	126.3	82%	0.82	66%	0.658	S	S	*	*	S	Bend	trans	-93.9	-19.9	177.5	-130.9	-94.7	0	0	0	113.3
4	L	34.1	Very low	35.7	Very low	139 Å²	139	123.1 Å²	123.1	73%	0.728	65%	0.646	S	S	*	*	S	Bend	trans	-85.1	-20.6	177.3	-90.8	149	0	0	0	113.6
5	G	36.7	Very low	35.4	Very low	42 Å²	42	119.5 Å²	119.5	43%	0.433	64%	0.635	S	S	.	*	H	α-helix	trans	-75.6	-36.5	-180	0	0	0	0	0	114	L7 L8 D9	G5-L7 VanDerWaalsContact C-N 3.34Å; G5-L7 PolarHBondContact O-N 3.4Å; G5-L8 PolarHBondContact O-N 2.87Å; G5-D9 PolarHBondContact O-N 3.37Å
6	R	35.9	Very low	35.3	Very low	213 Å²	213	118 Å²	118	80%	0.804	63%	0.632	S	S	*	*	H	α-helix	trans	-76.9	-18	-178.8	-75.5	-173.8	176	179.7	-0.8	114.5	T10	R6-T10 PolarHBondContact O-OG1 3.41Å
7	L	34.6	Very low	35.2	Very low	108 Å²	108	115.4 Å²	115.4	57%	0.565	63%	0.625	S	S	*	*	H	α-helix	trans	-82.2	-29	174.2	-114.7	144.1	0	0	0	111.7	G5 T10 V11	G5-L7 VanDerWaalsContact C-N 3.34Å; G5-L7 PolarHBondContact O-N 3.4Å; L7-T10 PolarHBondContact O-OG1 3.38Å; L7-V11 HydrophobicContact CD2-CG2 4.44Å; L7-V11 VanDerWaalsContact O-CB 3.31Å; L7-V11 WeakPolarHBondContact O-CB 3.19Å; L7-V11 WeakPolarHBondContact O-CG2 3.44Å; L7-V11 PolarHBondContact O-N 3.15Å
8	L	35.2	Very low	35.1	Very low	122 Å²	122	112.6 Å²	112.6	64%	0.639	61%	0.612	S	S	*	*	H	α-helix	trans	-74	-32.3	175.8	-83.2	157.1	0	0	0	112.7	G5 S12	G5-L8 PolarHBondContact O-N 2.87Å; L8-S12 PolarHBondContact O-N 2.93Å; L8-S12 PolarHBondContact O-OG 3.42Å
9	D	33.8	Very low	35.1	Very low	118 Å²	118	109.8 Å²	109.8	63%	0.631	60%	0.602	S	S	*	*	H	α-helix	trans	-80.8	-23.5	177.6	-72.1	-25.8	0	0	0	114	G5 S12 S13	G5-D9 PolarHBondContact O-N 3.37Å; D9-S12 PolarHBondContact O-OG 3.47Å; D9-S12 VanDerWaalsContact O-OG 3.08Å; D9-S13 PolarHBondContact O-OG 3.11Å
10	T	36.8	Very low	35.3	Very low	80 Å²	80	108.2 Å²	108.2	49%	0.491	60%	0.596	S	S	.	*	H	α-helix	trans	-83.2	-29	169.2	31.8	0	0	0	0	112	R6 L7 S13 V14	R6-T10 PolarHBondContact O-OG1 3.41Å; L7-T10 PolarHBondContact O-OG1 3.38Å; T10-S13 PolarHBondContact O-OG 3.04Å; T10-V14 VanDerWaalsContact O-CB 3.29Å; T10-V14 WeakPolarHBondContact O-CB 3.43Å; T10-V14 WeakPolarHBondContact O-CG2 3.48Å; T10-V14 PolarHBondContact O-N 3.15Å; T10-V14 VanDerWaalsContact O-N 3.09Å
11	V	34.5	Very low	35.3	Very low	83 Å²	83	109.4 Å²	109.4	50%	0.503	60%	0.601	S	S	.	*	H	α-helix	trans	-75.2	-27.4	172.9	174.8	0	0	0	0	111.7	L7 S15	L7-V11 HydrophobicContact CD2-CG2 4.44Å; L7-V11 VanDerWaalsContact O-CB 3.31Å; L7-V11 WeakPolarHBondContact O-CB 3.19Å; L7-V11 WeakPolarHBondContact O-CG2 3.44Å; L7-V11 PolarHBondContact O-N 3.15Å; V11-S15 WeakPolarHBondContact O-CA 3.44Å; V11-S15 WeakPolarHBondContact O-CB 3.45Å; V11-S15 PolarHBondContact O-N 3.09Å
12	S	33.5	Very low	35.1	Very low	65 Å²	65	106.8 Å²	106.8	46%	0.455	58%	0.583	S	S	.	*	H	α-helix	trans	-71.4	-36.9	174.9	64.1	0	0	0	0	113.2	L8 D9 T16	L8-S12 PolarHBondContact O-N 2.93Å; L8-S12 PolarHBondContact O-OG 3.42Å; D9-S12 PolarHBondContact O-OG 3.47Å; D9-S12 VanDerWaalsContact O-OG 3.08Å; S12-T16 PolarHBondContact O-OG1 2.8Å
13	S	32.8	Very low	35.8	Very low	67 Å²	67	100.4 Å²	100.4	47%	0.469	56%	0.556	S	S	.	*	H	α-helix	trans	-79.7	-31.9	177.2	51.5	0	0	0	0	113.7	D9 T10 S17	D9-S13 PolarHBondContact O-OG 3.11Å; T10-S13 PolarHBondContact O-OG 3.04Å; S13-S17 PolarHBondContact O-OG 2.96Å
14	V	35.5	Very low	37.6	Very low	82 Å²	82	95.4 Å²	95.4	50%	0.497	54%	0.538	S	S	.	.	H	α-helix	trans	-80.7	-29.7	172.9	177.5	0	0	0	0	111.5	T10 T16 S17 V18	T10-V14 VanDerWaalsContact O-CB 3.29Å; T10-V14 WeakPolarHBondContact O-CB 3.43Å; T10-V14 WeakPolarHBondContact O-CG2 3.48Å; T10-V14 PolarHBondContact O-N 3.15Å; T10-V14 VanDerWaalsContact O-N 3.09Å; V14-T16 VanDerWaalsContact C-N 3.34Å; V14-T16 PolarHBondContact O-N 3.3Å; V14-S17 PolarHBondContact O-N 2.81Å; V14-V18 HydrophobicContact CG1-CG2 3.55Å; V14-V18 WeakPolarHBondContact O-CB 3.32Å; V14-V18 VanDerWaalsContact O-CG2 3.23Å; V14-V18 WeakPolarHBondContact O-CG2 3.45Å; V14-V18 PolarHBondContact O-N 3.48Å
15	S	32	Very low	39.5	Very low	68 Å²	68	91.7 Å²	91.7	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-61.1	-39.8	174.5	174	0	0	0	0	111.8	V11 S17 S19	V11-S15 WeakPolarHBondContact O-CA 3.44Å; V11-S15 WeakPolarHBondContact O-CB 3.45Å; V11-S15 PolarHBondContact O-N 3.09Å; S15-S17 VanDerWaalsContact C-N 3.3Å; S15-S17 PolarHBondContact O-N 3.49Å; S15-S19 WeakPolarHBondContact O-CB 3.48Å; S15-S19 PolarHBondContact O-N 2.93Å; S15-S19 PolarHBondContact O-OG 3.04Å
16	T	34	Very low	41.5	Very low	96 Å²	96	90.9 Å²	90.9	59%	0.589	51%	0.507	S	S	*	.	H	α-helix	trans	-68.2	-29	177.8	-23.2	0	0	0	0	112.9	S12 V14 S19 T20	S12-T16 PolarHBondContact O-OG1 2.8Å; V14-T16 VanDerWaalsContact C-N 3.34Å; V14-T16 PolarHBondContact O-N 3.3Å; T16-S19 PolarHBondContact O-OG 3.26Å; T16-T20 PolarHBondContact O-OG1 2.86Å
17	S	32.3	Very low	43.6	Very low	73 Å²	73	87.6 Å²	87.6	51%	0.51	49%	0.494	S	S	.	.	H	α-helix	trans	-90.7	-26.2	-179.2	-53.3	0	0	0	0	113.2	S13 V14 S15 T20	S13-S17 PolarHBondContact O-OG 2.96Å; V14-S17 PolarHBondContact O-N 2.81Å; S15-S17 VanDerWaalsContact C-N 3.3Å; S15-S17 PolarHBondContact O-N 3.49Å; S17-T20 PolarHBondContact O-OG1 3.02Å
18	V	33.9	Very low	45.9	Very low	66 Å²	66	83 Å²	83	40%	0.4	47%	0.47	S	S	.	.	H	α-helix	trans	-90.6	-27	177.8	179.3	0	0	0	0	111.7	V14 T20 L21 F22	V14-V18 HydrophobicContact CG1-CG2 3.55Å; V14-V18 WeakPolarHBondContact O-CB 3.32Å; V14-V18 VanDerWaalsContact O-CG2 3.23Å; V14-V18 WeakPolarHBondContact O-CG2 3.45Å; V14-V18 PolarHBondContact O-N 3.48Å; V18-T20 PolarHBondContact O-N 3.16Å; V18-L21 PolarHBondContact O-N 3.33Å; V18-L21 VanDerWaalsContact O-N 3.15Å; V18-F22 HydrophobicContact CG1-CD2 4.36Å; V18-F22 HydrophobicContact CG1-CE2 4.44Å
19	S	35	Very low	48	Very low	59 Å²	59	81.9 Å²	81.9	41%	0.413	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-23.8	171.6	52.9	0	0	0	0	113	S15 T16 T23	S15-S19 WeakPolarHBondContact O-CB 3.48Å; S15-S19 PolarHBondContact O-N 2.93Å; S15-S19 PolarHBondContact O-OG 3.04Å; T16-S19 PolarHBondContact O-OG 3.26Å; S19-T23 WeakPolarHBondContact O-CB 3.49Å; S19-T23 VanDerWaalsContact O-CG2 3.27Å; S19-T23 WeakPolarHBondContact O-CG2 3.38Å; S19-T23 PolarHBondContact O-OG1 3.05Å
20	T	38.7	Very low	50.2	Low	78 Å²	78	82.6 Å²	82.6	48%	0.479	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-21.6	170.6	37.7	0	0	0	0	114.4	T16 S17 V18	T16-T20 PolarHBondContact O-OG1 2.86Å; S17-T20 PolarHBondContact O-OG1 3.02Å; V18-T20 PolarHBondContact O-N 3.16Å
21	L	36.5	Very low	52.3	Low	134 Å²	134	79.5 Å²	79.5	70%	0.702	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-22.5	179.6	-81.4	161.9	0	0	0	113.1	V18	V18-L21 PolarHBondContact O-N 3.33Å; V18-L21 VanDerWaalsContact O-N 3.15Å
22	F	39.4	Very low	54.4	Low	184 Å²	184	81.1 Å²	81.1	81%	0.807	44%	0.44	S	S	*	.	S	Bend	trans	-116.4	10.2	-178	-71.7	-76.9	0	0	0	114.2	V18	V18-F22 HydrophobicContact CG1-CD2 4.36Å; V18-F22 HydrophobicContact CG1-CE2 4.44Å
23	T	55.4	Low	56.3	Low	45 Å²	45	80 Å²	80	28%	0.276	43%	0.429	S	S	.	.	S	Bend	trans	-102.8	128.5	176.3	39.4	0	0	0	0	111.2	S19 P25 R29	S19-T23 WeakPolarHBondContact O-CB 3.49Å; S19-T23 VanDerWaalsContact O-CG2 3.27Å; S19-T23 WeakPolarHBondContact O-CG2 3.38Å; S19-T23 PolarHBondContact O-OG1 3.05Å; T23-P25 WeakPolarHBondContact O-CD 3.42Å; T23-P25 VanDerWaalsContact O-N 3.13Å; T23-R29 PolarHBondContact OG1-NH2 3.27Å
24	N	68	Low	58.1	Low	81 Å²	81	80.7 Å²	80.7	43%	0.433	43%	0.434	S	S	.	.			trans	-49.9	119	177.1	177.4	-3.4	0	0	0	109.4	Y26 R27	N24-Y26 PolarHBondContact O-N 3.35Å; N24-Y26 PolarHBondContact OD1-N 3.06Å; N24-Y26 VanDerWaalsContact OD1-N 3.09Å; N24-R27 HydrophobicContact CB-CB 4.27Å; N24-R27 WeakPolarHBondContact O-CB 3.44Å; N24-R27 PolarHBondContact O-N 3.29Å
25	P	75.2	Confident	59.8	Low	62 Å²	62	80.7 Å²	80.7	40%	0.403	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-12.4	-175.6	20.1	-29	0	0	0	113.4	T23 F78 Q79	T23-P25 WeakPolarHBondContact O-CD 3.42Å; T23-P25 VanDerWaalsContact O-N 3.13Å; P25-F78 CarbonylContact O-C 3.57Å; P25-F78 VanDerWaalsContact O-CA 3.28Å; P25-F78 WeakPolarHBondContact O-CA 3.41Å; P25-Q79 WeakPolarHBondContact CB-O 3.49Å; P25-Q79 PolarHBondContact O-N 3.15Å
26	Y	78.8	Confident	61.7	Low	25 Å²	25	78 Å²	78	10%	0.098	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	20	178.8	-55.8	-88.8	0	0	0	112.7	N24 F78 V80 Q112 R119	N24-Y26 PolarHBondContact O-N 3.35Å; N24-Y26 PolarHBondContact OD1-N 3.06Å; N24-Y26 VanDerWaalsContact OD1-N 3.09Å; Y26-F78 HydrophobicContact CD1-CB 3.65Å; Y26-F78 HydrophobicContact CD1-CG 4.4Å; Y26-F78 HydrophobicContact CE1-CB 4.21Å; Y26-F78 HydrophobicContact CG-CB 4.41Å; Y26-V80 HydrophobicContact CD1-CG2 4.47Å; Y26-V80 HydrophobicContact CE1-CG2 3.76Å; Y26-Q112 PolarHBondContact O-NE2 3.19Å; Y26-Q112 VanDerWaalsContact O-NE2 3.15Å; Y26-R119 VanDerWaalsContact CB-NH1 3.34Å; Y26-R119 VanDerWaalsContact CD1-CD 3.47Å; Y26-R119 VanDerWaalsContact CD1-NE 3.34Å; Y26-R119 VanDerWaalsContact CD2-NH1 3.3Å; Y26-R119 VanDerWaalsContact CE2-CZ 3.47Å; Y26-R119 VanDerWaalsContact CG-NE 3.26Å
27	R	79.4	Confident	62.9	Low	144 Å²	144	76.9 Å²	76.9	54%	0.543	42%	0.418	S	S	.	.			trans	-78.8	121.1	174.3	-172.2	171.8	-179.8	175.5	1.1	110.2	N24 R29 Q112	N24-R27 HydrophobicContact CB-CB 4.27Å; N24-R27 WeakPolarHBondContact O-CB 3.44Å; N24-R27 PolarHBondContact O-N 3.29Å; R27-R29 PolarHBondContact O-N 3.2Å; R27-Q112 VanDerWaalsContact CA-OE1 3.29Å
28	V	82.4	Confident	64.2	Low	11 Å²	11	77.1 Å²	77.1	7%	0.067	43%	0.432	C	S	.	.			trans	-65.7	127	174.9	-175.6	0	0	0	0	109.6	L75 R76 L77 A108 V111 Q112 V115	V28-L75 HydrophobicContact CG1-CB 4.23Å; V28-L75 HydrophobicContact CG1-CD2 4.27Å; V28-R76 CarbonylContact C-O 3.6Å; V28-R76 WeakPolarHBondContact CA-O 3.46Å; V28-L77 HydrophobicContact CG2-CD2 4.45Å; V28-A108 HydrophobicContact CG1-CB 4.35Å; V28-V111 HydrophobicContact CG1-CB 4.22Å; V28-V111 HydrophobicContact CG1-CG1 4.12Å; V28-V111 HydrophobicContact CG2-CG1 4.12Å; V28-Q112 HydrophobicContact CB-CB 4.23Å; V28-Q112 HydrophobicContact CG2-CB 4.08Å; V28-V115 HydrophobicContact CG2-CB 4.3Å; V28-V115 HydrophobicContact CG2-CG2 4.1Å
29	R	80.6	Confident	65.3	Low	99 Å²	99	75.8 Å²	75.8	37%	0.374	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.3	177.6	-66	-172.2	-171.9	-178.1	8.6	111.2	T23 R27 V31 L75 R76	T23-R29 PolarHBondContact OG1-NH2 3.27Å; R27-R29 PolarHBondContact O-N 3.2Å; R29-V31 HydrophobicContact CB-CG2 4.34Å; R29-L75 CarbonylContact O-C 3.51Å; R29-L75 WeakPolarHBondContact O-CA 3.36Å; R29-R76 PolarHBondContact N-O 3.33Å; R29-R76 PolarHBondContact O-N 2.87Å
30	E	80	Confident	66.6	Low	132 Å²	132	74.4 Å²	74.4	62%	0.617	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	126.4	165.5	-71.2	173.6	-167.9	0	0	109.2	V73 L75 A108	E30-V73 HydrophobicContact CB-CG1 3.88Å; E30-V73 HydrophobicContact CG-CG1 4.18Å; E30-L75 HydrophobicContact CG-CD2 3.5Å; E30-A108 HydrophobicContact CG-CB 4.26Å
31	V	79.8	Confident	68.3	Low	15 Å²	15	72.8 Å²	72.8	9%	0.091	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	144.2	-179.9	-168.8	0	0	0	0	109	R29 D35 Y36 A74 R76	R29-V31 HydrophobicContact CB-CG2 4.34Å; V31-D35 HydrophobicContact CG1-CB 4.3Å; V31-Y36 HydrophobicContact CB-CE2 4.11Å; V31-Y36 HydrophobicContact CG1-CD2 4.41Å; V31-Y36 HydrophobicContact CG1-CE2 3.56Å; V31-A74 PolarHBondContact N-O 2.89Å; V31-A74 PolarHBondContact O-N 3.01Å; V31-R76 HydrophobicContact CG2-CB 3.79Å
32	Q	79.3	Confident	70.2	Confident	117 Å²	117	70 Å²	70	55%	0.547	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	136.2	177.5	-64.2	-172.6	10.4	0	0	110.6	S34 D35 T72	Q32-S34 WeakPolarHBondContact CB-OG 3.33Å; Q32-S34 PolarHBondContact O-N 2.73Å; Q32-D35 WeakPolarHBondContact O-CB 3.33Å; Q32-D35 PolarHBondContact O-N 3.05Å; Q32-T72 WeakPolarHBondContact CA-O 3.44Å
33	L	73.8	Confident	72.2	Confident	43 Å²	43	66.7 Å²	66.7	23%	0.225	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-64.6	-24.7	179.6	-89.1	154.5	0	0	0	112.9	D35 Y36 L66 P71 T72 A74	L33-D35 PolarHBondContact O-N 3.1Å; L33-Y36 PolarHBondContact O-N 2.8Å; L33-Y36 VanDerWaalsContact O-N 3.13Å; L33-L66 HydrophobicContact CD1-CD2 4.15Å; L33-L66 HydrophobicContact CD2-CD2 3.48Å; L33-L66 VanDerWaalsContact CD2-CD2 3.48Å; L33-L66 HydrophobicContact CG-CD2 4.36Å; L33-P71 WeakPolarHBondContact CD1-O 3Å; L33-T72 PolarHBondContact N-O 3.38Å; L33-A74 HydrophobicContact CD1-CB 4.06Å; L33-A74 HydrophobicContact CD2-CB 4.12Å; L33-A74 HydrophobicContact CG-CB 3.83Å
34	S	71.1	Confident	73.4	Confident	80 Å²	80	67.7 Å²	67.7	56%	0.559	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-57.3	-32.2	171.1	46.7	0	0	0	0	113	Q32 Y36 G37	Q32-S34 WeakPolarHBondContact CB-OG 3.33Å; Q32-S34 PolarHBondContact O-N 2.73Å; S34-Y36 PolarHBondContact O-N 3.38Å; S34-Y36 VanDerWaalsContact O-N 3.13Å; S34-G37 PolarHBondContact O-N 3.43Å; S34-G37 VanDerWaalsContact O-N 3.15Å
35	D	70.1	Confident	73.9	Confident	82 Å²	82	68.7 Å²	68.7	44%	0.439	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-70.8	-8.2	-179.5	-59.2	-17.3	0	0	0	113.1	V31 Q32 L33 K41	V31-D35 HydrophobicContact CG1-CB 4.3Å; Q32-D35 WeakPolarHBondContact O-CB 3.33Å; Q32-D35 PolarHBondContact O-N 3.05Å; L33-D35 PolarHBondContact O-N 3.1Å; D35-K41 PolarHBondContact O-NZ 2.9Å
36	Y	71.9	Confident	74.3	Confident	12 Å²	12	70.9 Å²	70.9	5%	0.047	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-112.1	-4	178.1	-68.4	-85.9	0	0	0	112.7	V31 L33 S34 K41 Y53 D62 V64 R76	V31-Y36 HydrophobicContact CB-CE2 4.11Å; V31-Y36 HydrophobicContact CG1-CD2 4.41Å; V31-Y36 HydrophobicContact CG1-CE2 3.56Å; L33-Y36 PolarHBondContact O-N 2.8Å; L33-Y36 VanDerWaalsContact O-N 3.13Å; S34-Y36 PolarHBondContact O-N 3.38Å; S34-Y36 VanDerWaalsContact O-N 3.13Å; Y36-K41 HydrophobicContact CD1-CB 4.46Å; Y36-K41 HydrophobicContact CD1-CD 3.51Å; Y36-K41 HydrophobicContact CE1-CD 3.55Å; Y36-K41 HydrophobicContact CG-CD 4.36Å; Y36-Y53 HydrophobicContact CD1-CD1 4.01Å; Y36-Y53 AromaticContact CD1-CD2 3.62Å; Y36-Y53 HydrophobicContact CD1-CD2 3.62Å; Y36-Y53 HydrophobicContact CD1-CE1 4.31Å; Y36-Y53 AromaticContact CD1-CE2 3.93Å; Y36-Y53 HydrophobicContact CD1-CE2 3.93Å; Y36-Y53 AromaticContact CD1-CG 3.66Å; Y36-Y53 HydrophobicContact CD1-CG 3.66Å; Y36-Y53 AromaticContact CE1-CD2 3.98Å; Y36-Y53 HydrophobicContact CE1-CD2 3.98Å; Y36-Y53 HydrophobicContact CE1-CG 4.14Å; Y36-Y53 HydrophobicContact CG-CD2 4.41Å; Y36-Y53 HydrophobicContact CG-CE2 4.27Å; Y36-D62 HydrophobicContact CE1-CB 4.01Å; Y36-D62 WeakPolarHBondContact CE1-OD2 3.43Å; Y36-D62 PolarHBondContact OH-OD2 2.95Å; Y36-V64 HydrophobicContact CE1-CG2 3.92Å; Y36-V64 HydrophobicContact CE2-CG2 4.08Å; Y36-R76 VanDerWaalsContact OH-CZ 3.23Å; Y36-R76 PolarHBondContact OH-NE 3.24Å; Y36-R76 PolarHBondContact OH-NH2 2.93Å
37	G	58.9	Low	74.2	Confident	72 Å²	72	73.5 Å²	73.5	74%	0.742	41%	0.408	S	S	*	.	S	Bend	trans	-91	-3	-173.8	0	0	0	0	0	117	S34	S34-G37 PolarHBondContact O-N 3.43Å; S34-G37 VanDerWaalsContact O-N 3.15Å
38	G	60.6	Low	74.2	Confident	78 Å²	78	68.9 Å²	68.9	80%	0.804	41%	0.405	S	S	*	.	S	Bend	trans	-175.4	14.4	-174.8	0	0	0	0	0	119.4
39	G	56.3	Low	73.9	Confident	39 Å²	39	72.5 Å²	72.5	40%	0.402	42%	0.418	S	S	.	.	S	Bend	trans	-126	49.9	-168.4	0	0	0	0	0	116.4	K41	G39-K41 PolarHBondContact O-N 2.81Å
40	G	61.6	Low	74	Confident	30 Å²	30	67.8 Å²	67.8	31%	0.309	40%	0.4	S	S	.	.	S	Bend	trans	75.2	18.5	175.8	0	0	0	0	0	115.4	T56	G40-T56 PolarHBondContact O-N 3.37Å; G40-T56 PolarHBondContact O-OG1 3.4Å
41	K	75.4	Confident	74.2	Confident	43 Å²	43	61.5 Å²	61.5	19%	0.187	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	116.8	172.1	-61.9	-179.3	-171.4	167.9	0	109.4	D35 Y36 G39 K54 N55 D62	D35-K41 PolarHBondContact O-NZ 2.9Å; Y36-K41 HydrophobicContact CD1-CB 4.46Å; Y36-K41 HydrophobicContact CD1-CD 3.51Å; Y36-K41 HydrophobicContact CE1-CD 3.55Å; Y36-K41 HydrophobicContact CG-CD 4.36Å; G39-K41 PolarHBondContact O-N 2.81Å; K41-K54 CarbonylContact C-O 3.51Å; K41-K54 VanDerWaalsContact CA-O 3.31Å; K41-K54 WeakPolarHBondContact CA-O 3.33Å; K41-N55 HydrophobicContact CG-CB 4.07Å; K41-D62 IonicContact NZ-OD2 3.97Å
42	V	77.1	Confident	74.4	Confident	77 Å²	77	60.8 Å²	60.8	47%	0.467	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	130.9	-178.1	-179.2	0	0	0	0	109.5	L44 Y53 K54 T56	V42-L44 PolarHBondContact O-N 2.9Å; V42-Y53 CarbonylContact O-C 3.53Å; V42-Y53 WeakPolarHBondContact O-CA 3.48Å; V42-K54 PolarHBondContact N-O 3.22Å; V42-K54 PolarHBondContact O-N 2.97Å; V42-T56 HydrophobicContact CG2-CG2 4.06Å
43	R	80.7	Confident	74.7	Confident	113 Å²	113	56.4 Å²	56.4	43%	0.426	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	121.4	174.6	-166	-179.5	-155.4	-162.8	8.1	110	E46 V51 Y53	R43-E46 IonicContact CZ-OE1 3.55Å; R43-E46 IonicContact CZ-OE2 2.69Å; R43-E46 IonicContact NH1-OE1 3.54Å; R43-E46 IonicContact NH1-OE2 3.58Å; R43-E46 PolarHBondContact NH1-OE2 3.25Å; R43-E46 IonicContact NH2-OE1 3.72Å; R43-E46 PolarHBondContact NH2-OE1 3.05Å; R43-E46 IonicContact NH2-OE2 2.69Å; R43-E46 PolarHBondContact NH2-OE2 3.01Å; R43-V51 HydrophobicContact CG-CG1 3.6Å; R43-Y53 HydrophobicContact CB-CD1 4.22Å; R43-Y53 HydrophobicContact CB-CE1 4.03Å; R43-Y53 HydrophobicContact CG-CE1 4.21Å
44	L	79.9	Confident	75.1	Confident	67 Å²	67	56.8 Å²	56.8	35%	0.351	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-48.8	-178	-70.4	-175.8	0	0	0	113.2	V42 L52 K54 M87	V42-L44 PolarHBondContact O-N 2.9Å; L44-L52 HydrophobicContact CB-CD2 4.48Å; L44-L52 HydrophobicContact CD1-CD2 4.37Å; L44-L52 PolarHBondContact N-O 3.09Å; L44-K54 HydrophobicContact CD1-CB 3.65Å; L44-K54 HydrophobicContact CD1-CD 4.34Å; L44-K54 HydrophobicContact CD1-CG 4.5Å; L44-K54 HydrophobicContact CD2-CB 4.21Å; L44-K54 HydrophobicContact CG-CB 3.82Å; L44-M87 HydrophobicContact CD1-CE 4.13Å
45	K	80	Confident	75.6	Confident	101 Å²	101	53.6 Å²	53.6	44%	0.439	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	147.9	-177.1	-71.3	-177	178.5	170.7	0	110.5	V51 L52 M87 F90	K45-V51 WeakPolarHBondContact O-CA 3.11Å; K45-L52 HydrophobicContact CB-CB 4.36Å; K45-L52 PolarHBondContact O-N 3.16Å; K45-M87 HydrophobicContact CD-SD 4.25Å; K45-M87 PolarHBondContact NZ-SD 2.71Å; K45-M87 VanDerWaalsContact NZ-SD 3.37Å; K45-F90 HydrophobicContact CB-CD1 4.39Å; K45-F90 HydrophobicContact CB-CE1 3.71Å; K45-F90 HydrophobicContact CB-CZ 3.98Å; K45-F90 HydrophobicContact CD-CD1 4.38Å; K45-F90 HydrophobicContact CD-CE1 4.32Å
46	E	82.6	Confident	75.8	Confident	109 Å²	109	53 Å²	53	51%	0.509	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	129.8	173.7	173.2	175.1	-143.3	0	0	108.3	R43 M50 V51	R43-E46 IonicContact CZ-OE1 3.55Å; R43-E46 IonicContact CZ-OE2 2.69Å; R43-E46 IonicContact NH1-OE1 3.54Å; R43-E46 IonicContact NH1-OE2 3.58Å; R43-E46 PolarHBondContact NH1-OE2 3.25Å; R43-E46 IonicContact NH2-OE1 3.72Å; R43-E46 PolarHBondContact NH2-OE1 3.05Å; R43-E46 IonicContact NH2-OE2 2.69Å; R43-E46 PolarHBondContact NH2-OE2 3.01Å; E46-M50 WeakPolarHBondContact CA-O 3.19Å; E46-V51 HydrophobicContact CG-CG2 4.4Å
47	D	76.9	Confident	75.8	Confident	79 Å²	79	59.5 Å²	59.5	42%	0.422	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	111.8	172.4	-170.5	-1.1	0	0	0	109	R49 M50 F90 A94	D47-R49 PolarHBondContact O-N 3.29Å; D47-M50 PolarHBondContact N-O 3.19Å; D47-M50 PolarHBondContact O-N 3.29Å; D47-F90 HydrophobicContact CB-CE1 4.3Å; D47-F90 HydrophobicContact CB-CZ 4.23Å; D47-A94 HydrophobicContact CB-CB 3.96Å
48	G	78.4	Confident	76.2	Confident	47 Å²	47	60.3 Å²	60.3	49%	0.485	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	-121.7	-171.5	0	0	0	0	0	112.1	M50	G48-M50 VanDerWaalsContact C-N 3.34Å
49	R	77.9	Confident	77	Confident	88 Å²	88	61.8 Å²	61.8	33%	0.332	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	5.9	178.7	-61	-172.4	-173.4	159.6	0.7	113.8	D47 L65 L66 Y101	D47-R49 PolarHBondContact O-N 3.29Å; R49-L65 HydrophobicContact CB-CD1 4.07Å; R49-L66 HydrophobicContact CB-CB 4.46Å; R49-L66 WeakPolarHBondContact O-CB 3.32Å; R49-L66 WeakPolarHBondContact O-CG 3.42Å; R49-L66 PolarHBondContact O-N 3.14Å; R49-Y101 HydrophobicContact CB-CD2 4.41Å; R49-Y101 HydrophobicContact CB-CE2 4.07Å; R49-Y101 HydrophobicContact CG-CD2 4.17Å; R49-Y101 HydrophobicContact CG-CE2 3.82Å; R49-Y101 PolarHBondContact NH1-O 3.47Å
50	M	82.1	Confident	78.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.4	-176.7	-69.5	-172.6	53.5	0	0	111.7	E46 D47 G48 C63 V64 L65 L77 F90 F93 A94 L97	E46-M50 WeakPolarHBondContact CA-O 3.19Å; D47-M50 PolarHBondContact N-O 3.19Å; D47-M50 PolarHBondContact O-N 3.29Å; G48-M50 VanDerWaalsContact C-N 3.34Å; M50-C63 WeakPolarHBondContact CE-SG 3.16Å; M50-V64 WeakPolarHBondContact CA-O 2.94Å; M50-L65 HydrophobicContact CG-CD1 3.57Å; M50-L65 HydrophobicContact SD-CD1 4.43Å; M50-L77 HydrophobicContact CE-CD1 3.35Å; M50-L77 HydrophobicContact SD-CD1 4.14Å; M50-F90 HydrophobicContact CB-CE2 4.32Å; M50-F93 HydrophobicContact CE-CB 3.59Å; M50-F93 HydrophobicContact SD-CB 4.4Å; M50-A94 VanDerWaalsContact SD-CA 3.57Å; M50-A94 HydrophobicContact SD-CB 4.37Å; M50-L97 HydrophobicContact CE-CD1 4.26Å; M50-L97 HydrophobicContact SD-CB 4.16Å; M50-L97 HydrophobicContact SD-CD1 3.88Å
51	V	84	Confident	79.4	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.7	-176.3	-171.3	0	0	0	0	110.4	R43 K45 E46 Y53 V64 L66	R43-V51 HydrophobicContact CG-CG1 3.6Å; K45-V51 WeakPolarHBondContact O-CA 3.11Å; E46-V51 HydrophobicContact CG-CG2 4.4Å; V51-Y53 HydrophobicContact CB-CD2 4.32Å; V51-Y53 HydrophobicContact CB-CE2 3.7Å; V51-Y53 HydrophobicContact CG1-CD2 3.9Å; V51-Y53 HydrophobicContact CG1-CE1 4.24Å; V51-Y53 HydrophobicContact CG1-CE2 3.35Å; V51-V64 PolarHBondContact N-O 3.47Å; V51-V64 PolarHBondContact O-N 3.1Å; V51-L66 HydrophobicContact CG2-CD1 3.91Å; V51-L66 HydrophobicContact CG2-CG 4.27Å
52	L	84.9	Confident	79.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122.7	173	-170.4	65.8	0	0	0	110	L44 K45 W61 C63 F78 A86 M87 F90	L44-L52 HydrophobicContact CB-CD2 4.48Å; L44-L52 HydrophobicContact CD1-CD2 4.37Å; L44-L52 PolarHBondContact N-O 3.09Å; K45-L52 HydrophobicContact CB-CB 4.36Å; K45-L52 PolarHBondContact O-N 3.16Å; L52-W61 HydrophobicContact CD1-CB 4.37Å; L52-C63 HydrophobicContact CD1-CB 4.23Å; L52-F78 HydrophobicContact CD1-CE2 4.33Å; L52-F78 HydrophobicContact CD1-CZ 4.25Å; L52-A86 HydrophobicContact CD1-CB 4.48Å; L52-M87 HydrophobicContact CD2-CE 4.28Å; L52-M87 HydrophobicContact CD2-SD 4.21Å; L52-F90 HydrophobicContact CB-CD2 3.71Å; L52-F90 HydrophobicContact CB-CE2 3.71Å; L52-F90 HydrophobicContact CB-CG 4.27Å; L52-F90 HydrophobicContact CB-CZ 4.27Å; L52-F90 HydrophobicContact CD1-CD2 4.23Å; L52-F90 HydrophobicContact CD2-CB 4.36Å; L52-F90 HydrophobicContact CD2-CD2 4.47Å; L52-F90 HydrophobicContact CD2-CG 4.29Å; L52-F90 HydrophobicContact CG-CD2 4.36Å
53	Y	84.7	Confident	80.1	Confident	25 Å²	25	53.8 Å²	53.8	10%	0.098	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	139.9	175	-67.9	-87.8	0	0	0	110.8	Y36 V42 R43 V51 W61 D62 V64	Y36-Y53 HydrophobicContact CD1-CD1 4.01Å; Y36-Y53 AromaticContact CD1-CD2 3.62Å; Y36-Y53 HydrophobicContact CD1-CD2 3.62Å; Y36-Y53 HydrophobicContact CD1-CE1 4.31Å; Y36-Y53 AromaticContact CD1-CE2 3.93Å; Y36-Y53 HydrophobicContact CD1-CE2 3.93Å; Y36-Y53 AromaticContact CD1-CG 3.66Å; Y36-Y53 HydrophobicContact CD1-CG 3.66Å; Y36-Y53 AromaticContact CE1-CD2 3.98Å; Y36-Y53 HydrophobicContact CE1-CD2 3.98Å; Y36-Y53 HydrophobicContact CE1-CG 4.14Å; Y36-Y53 HydrophobicContact CG-CD2 4.41Å; Y36-Y53 HydrophobicContact CG-CE2 4.27Å; V42-Y53 CarbonylContact O-C 3.53Å; V42-Y53 WeakPolarHBondContact O-CA 3.48Å; R43-Y53 HydrophobicContact CB-CD1 4.22Å; R43-Y53 HydrophobicContact CB-CE1 4.03Å; R43-Y53 HydrophobicContact CG-CE1 4.21Å; V51-Y53 HydrophobicContact CB-CD2 4.32Å; V51-Y53 HydrophobicContact CB-CE2 3.7Å; V51-Y53 HydrophobicContact CG1-CD2 3.9Å; V51-Y53 HydrophobicContact CG1-CE1 4.24Å; V51-Y53 HydrophobicContact CG1-CE2 3.35Å; Y53-W61 CarbonylContact O-C 3.49Å; Y53-W61 WeakPolarHBondContact O-CA 3.39Å; Y53-D62 PolarHBondContact N-O 3.32Å; Y53-D62 PolarHBondContact O-N 2.72Å; Y53-V64 HydrophobicContact CD2-CB 4.41Å; Y53-V64 HydrophobicContact CD2-CG2 4.08Å; Y53-V64 HydrophobicContact CE2-CB 4.31Å; Y53-V64 HydrophobicContact CE2-CG2 4.35Å
54	K	82.3	Confident	80.2	Confident	51 Å²	51	48.4 Å²	48.4	22%	0.222	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	116.7	167.8	-175.8	173.1	-173.6	166.4	0	109.5	K41 V42 L44 T56 W61 E83	K41-K54 CarbonylContact C-O 3.51Å; K41-K54 VanDerWaalsContact CA-O 3.31Å; K41-K54 WeakPolarHBondContact CA-O 3.33Å; V42-K54 PolarHBondContact N-O 3.22Å; V42-K54 PolarHBondContact O-N 2.97Å; L44-K54 HydrophobicContact CD1-CB 3.65Å; L44-K54 HydrophobicContact CD1-CD 4.34Å; L44-K54 HydrophobicContact CD1-CG 4.5Å; L44-K54 HydrophobicContact CD2-CB 4.21Å; L44-K54 HydrophobicContact CG-CB 3.82Å; K54-T56 PolarHBondContact O-N 3.34Å; K54-W61 HydrophobicContact CD-CZ2 4.21Å; K54-W61 HydrophobicContact CG-CZ2 4.49Å; K54-E83 IonicContact NZ-OE2 3.82Å
55	N	82.1	Confident	80.3	Confident	13 Å²	13	45.5 Å²	45.5	7%	0.07	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	107.8	171.5	-174	-11.9	0	0	0	109.5	K41 Q57 C58 Q59 S60	K41-N55 HydrophobicContact CG-CB 4.07Å; N55-Q57 VanDerWaalsContact C-N 3.26Å; N55-Q57 PolarHBondContact O-N 3.23Å; N55-Q57 WeakPolarHBondContact OD1-CB 3.32Å; N55-Q57 PolarHBondContact OD1-N 3.35Å; N55-C58 PolarHBondContact OD1-N 3.1Å; N55-Q59 WeakPolarHBondContact O-CA 3.21Å; N55-Q59 PolarHBondContact O-N 3.48Å; N55-S60 WeakPolarHBondContact CB-O 3.2Å; N55-S60 PolarHBondContact N-O 2.81Å; N55-S60 PolarHBondContact O-N 2.79Å
56	T	73.7	Confident	80.2	Confident	70 Å²	70	43 Å²	43	43%	0.429	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-18.9	-178.2	59.2	0	0	0	0	112.9	G40 V42 K54	G40-T56 PolarHBondContact O-N 3.37Å; G40-T56 PolarHBondContact O-OG1 3.4Å; V42-T56 HydrophobicContact CG2-CG2 4.06Å; K54-T56 PolarHBondContact O-N 3.34Å
57	Q	71.2	Confident	79.6	Confident	147 Å²	147	39 Å²	39	69%	0.687	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-37.8	-179.3	-61.6	179.8	-6.5	0	0	112.3	N55	N55-Q57 VanDerWaalsContact C-N 3.26Å; N55-Q57 PolarHBondContact O-N 3.23Å; N55-Q57 WeakPolarHBondContact OD1-CB 3.32Å; N55-Q57 PolarHBondContact OD1-N 3.35Å
58	C	68.5	Low	78.8	Confident	89 Å²	89	39 Å²	39	60%	0.601	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.2	2.9	-176.2	-58	0	0	0	0	114.2	N55 S60	N55-C58 PolarHBondContact OD1-N 3.1Å; C58-S60 VanDerWaalsContact C-N 3.26Å; C58-S60 PolarHBondContact O-N 3.28Å
59	Q	76.8	Confident	77.9	Confident	110 Å²	110	42.7 Å²	42.7	51%	0.514	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	46.3	-174	-62.8	-66.6	-30.6	0	0	112.5	N55 W61	N55-Q59 WeakPolarHBondContact O-CA 3.21Å; N55-Q59 PolarHBondContact O-N 3.48Å; Q59-W61 WeakPolarHBondContact O-CZ3 3.41Å
60	S	83.4	Confident	77.3	Confident	8 Å²	8	41.6 Å²	41.6	6%	0.056	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	150.2	177.9	74.1	0	0	0	0	111.6	N55 C58 Q79 V80	N55-S60 WeakPolarHBondContact CB-O 3.2Å; N55-S60 PolarHBondContact N-O 2.81Å; N55-S60 PolarHBondContact O-N 2.79Å; C58-S60 VanDerWaalsContact C-N 3.26Å; C58-S60 PolarHBondContact O-N 3.28Å; S60-Q79 PolarHBondContact OG-NE2 3.43Å; S60-V80 WeakPolarHBondContact CA-O 3.4Å
61	W	84.1	Confident	76.5	Confident	12 Å²	12	46.6 Å²	46.6	5%	0.045	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	120.3	175.2	-69.3	-104.4	0	0	0	109.4	L52 Y53 K54 Q59 Q79 V80 G81 E83 A86	L52-W61 HydrophobicContact CD1-CB 4.37Å; Y53-W61 CarbonylContact O-C 3.49Å; Y53-W61 WeakPolarHBondContact O-CA 3.39Å; K54-W61 HydrophobicContact CD-CZ2 4.21Å; K54-W61 HydrophobicContact CG-CZ2 4.49Å; Q59-W61 WeakPolarHBondContact O-CZ3 3.41Å; W61-Q79 WeakPolarHBondContact O-CA 3.47Å; W61-V80 PolarHBondContact N-O 3.1Å; W61-V80 PolarHBondContact O-N 2.82Å; W61-G81 WeakPolarHBondContact CZ3-O 3.34Å; W61-E83 HydrophobicContact CH2-CB 3.72Å; W61-E83 HydrophobicContact CH2-CG 4.47Å; W61-E83 HydrophobicContact CZ2-CB 3.36Å; W61-E83 HydrophobicContact CZ2-CG 3.63Å; W61-E83 WeakPolarHBondContact CZ2-OE2 3.33Å; W61-E83 HydrophobicContact CZ3-CB 4.41Å; W61-A86 HydrophobicContact CB-CB 3.46Å; W61-A86 VanDerWaalsContact CB-CB 3.46Å; W61-A86 HydrophobicContact CD2-CB 4.42Å; W61-A86 HydrophobicContact CG-CB 3.68Å
62	D	84.4	Confident	75.7	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.5	-180	-69.2	7.4	0	0	0	109	Y36 K41 Y53 V64 R76 F78 Q79	Y36-D62 HydrophobicContact CE1-CB 4.01Å; Y36-D62 WeakPolarHBondContact CE1-OD2 3.43Å; Y36-D62 PolarHBondContact OH-OD2 2.95Å; K41-D62 IonicContact NZ-OD2 3.97Å; Y53-D62 PolarHBondContact N-O 3.32Å; Y53-D62 PolarHBondContact O-N 2.72Å; D62-V64 HydrophobicContact CB-CG2 4.46Å; D62-R76 IonicContact OD2-CZ 3.17Å; D62-R76 IonicContact OD2-NE 2.77Å; D62-R76 IonicContact OD2-NH2 3.62Å; D62-F78 WeakPolarHBondContact CA-O 3.2Å; D62-Q79 WeakPolarHBondContact OD1-CG 3.31Å
63	C	82.9	Confident	75.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.3	169.8	-175.8	0	0	0	0	109.7	M50 L52 R76 L77 F78	M50-C63 WeakPolarHBondContact CE-SG 3.16Å; L52-C63 HydrophobicContact CD1-CB 4.23Å; C63-R76 CarbonylContact O-C 3.45Å; C63-R76 WeakPolarHBondContact O-CA 3.25Å; C63-L77 HydrophobicContact CB-CB 4.48Å; C63-L77 PolarHBondContact O-N 2.72Å; C63-F78 HydrophobicContact CB-CD1 3.56Å; C63-F78 HydrophobicContact CB-CD2 4.05Å; C63-F78 HydrophobicContact CB-CE1 3.21Å; C63-F78 HydrophobicContact CB-CE2 3.75Å; C63-F78 HydrophobicContact CB-CG 3.98Å; C63-F78 HydrophobicContact CB-CZ 3.34Å; C63-F78 PolarHBondContact N-O 2.91Å
64	V	83.5	Confident	75.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.6	-172.1	-179.1	0	0	0	0	110.1	Y36 M50 V51 Y53 D62 A74 L75	Y36-V64 HydrophobicContact CE1-CG2 3.92Å; Y36-V64 HydrophobicContact CE2-CG2 4.08Å; M50-V64 WeakPolarHBondContact CA-O 2.94Å; V51-V64 PolarHBondContact N-O 3.47Å; V51-V64 PolarHBondContact O-N 3.1Å; Y53-V64 HydrophobicContact CD2-CB 4.41Å; Y53-V64 HydrophobicContact CD2-CG2 4.08Å; Y53-V64 HydrophobicContact CE2-CB 4.31Å; Y53-V64 HydrophobicContact CE2-CG2 4.35Å; D62-V64 HydrophobicContact CB-CG2 4.46Å; V64-A74 HydrophobicContact CG1-CB 3.32Å; V64-L75 CarbonylContact C-O 3.56Å; V64-L75 WeakPolarHBondContact CA-O 3.3Å
65	L	81.8	Confident	75.1	Confident	5 Å²	5	50 Å²	50	3%	0.026	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	122.5	173.6	178.1	68.2	0	0	0	109.8	R49 M50 A74 L75 L77 Y101 L106	R49-L65 HydrophobicContact CB-CD1 4.07Å; M50-L65 HydrophobicContact CG-CD1 3.57Å; M50-L65 HydrophobicContact SD-CD1 4.43Å; L65-A74 WeakPolarHBondContact O-CB 3.47Å; L65-L75 HydrophobicContact CB-CB 4.35Å; L65-L75 PolarHBondContact N-O 2.95Å; L65-L75 PolarHBondContact O-N 3.31Å; L65-L77 HydrophobicContact CB-CD1 4.3Å; L65-L77 HydrophobicContact CB-CD2 4.24Å; L65-L77 HydrophobicContact CB-CG 4.28Å; L65-Y101 HydrophobicContact CD1-CD1 3.71Å; L65-Y101 HydrophobicContact CD1-CE1 4.05Å; L65-Y101 HydrophobicContact CD1-CG 4.31Å; L65-L106 HydrophobicContact CD2-CD1 3.88Å
66	L	78.9	Confident	75.2	Confident	48 Å²	48	50.9 Å²	50.9	25%	0.251	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.5	178.6	-57.5	176.6	0	0	0	110.2	L33 R49 V51 A74	L33-L66 HydrophobicContact CD1-CD2 4.15Å; L33-L66 HydrophobicContact CD2-CD2 3.48Å; L33-L66 VanDerWaalsContact CD2-CD2 3.48Å; L33-L66 HydrophobicContact CG-CD2 4.36Å; R49-L66 HydrophobicContact CB-CB 4.46Å; R49-L66 WeakPolarHBondContact O-CB 3.32Å; R49-L66 WeakPolarHBondContact O-CG 3.42Å; R49-L66 PolarHBondContact O-N 3.14Å; V51-L66 HydrophobicContact CG2-CD1 3.91Å; V51-L66 HydrophobicContact CG2-CG 4.27Å; L66-A74 HydrophobicContact CD2-CB 4.22Å
67	S	69.8	Low	75.5	Confident	27 Å²	27	47.6 Å²	47.6	19%	0.189	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-87.8	130.5	175.1	-173.2	0	0	0	0	110.8	E69	S67-E69 VanDerWaalsContact C-N 3.32Å; S67-E69 PolarHBondContact O-N 3.15Å
68	P	58.9	Low	76.1	Confident	78 Å²	78	40.6 Å²	40.6	51%	0.506	23%	0.232	S	C	.	.	S	Bend	trans	-69.8	-26.8	177	-14.8	27.6	0	0	0	114
69	E	60.5	Low	76.9	Confident	124 Å²	124	39.1 Å²	39.1	58%	0.579	22%	0.216	S	C	*	.	S	Bend	trans	-81.3	-27.3	-171.5	-69.9	160.1	-143.3	0	0	112.5	S67 T105	S67-E69 VanDerWaalsContact C-N 3.32Å; S67-E69 PolarHBondContact O-N 3.15Å; E69-T105 VanDerWaalsContact OE1-CB 3.26Å; E69-T105 WeakPolarHBondContact OE1-CB 3.39Å; E69-T105 WeakPolarHBondContact OE1-CG2 3.32Å
70	T	65.4	Low	77.3	Confident	65 Å²	65	34.3 Å²	34.3	40%	0.399	19%	0.194	S	C	.	.			trans	-130.5	86	177.7	53.1	0	0	0	0	109.6	T72 V73	T70-T72 PolarHBondContact O-N 2.87Å; T70-V73 PolarHBondContact O-N 3.14Å
71	P	65.3	Low	77.1	Confident	105 Å²	105	37 Å²	37	68%	0.682	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-4.2	-176.1	26.9	-35.4	0	0	0	114	L33	L33-P71 WeakPolarHBondContact CD1-O 3Å
72	T	67.6	Low	77.1	Confident	98 Å²	98	38.3 Å²	38.3	60%	0.601	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-17	177	53.4	0	0	0	0	113.6	Q32 L33 T70	Q32-T72 WeakPolarHBondContact CA-O 3.44Å; L33-T72 PolarHBondContact N-O 3.38Å; T70-T72 PolarHBondContact O-N 2.87Å
73	V	76.8	Confident	77	Confident	39 Å²	39	42.6 Å²	42.6	24%	0.236	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.7	-175.4	-177.1	0	0	0	0	109.8	E30 T70	E30-V73 HydrophobicContact CB-CG1 3.88Å; E30-V73 HydrophobicContact CG-CG1 4.18Å; T70-V73 PolarHBondContact O-N 3.14Å
74	A	80	Confident	77	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	153.3	177.2	0	0	0	0	0	111.1	V31 L33 V64 L65 L66	V31-A74 PolarHBondContact N-O 2.89Å; V31-A74 PolarHBondContact O-N 3.01Å; L33-A74 HydrophobicContact CD1-CB 4.06Å; L33-A74 HydrophobicContact CD2-CB 4.12Å; L33-A74 HydrophobicContact CG-CB 3.83Å; V64-A74 HydrophobicContact CG1-CB 3.32Å; L65-A74 WeakPolarHBondContact O-CB 3.47Å; L66-A74 HydrophobicContact CD2-CB 4.22Å
75	L	80.9	Confident	77	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.052	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	111.4	180	-66	174.1	0	0	0	109.4	V28 R29 E30 V64 L65 L77 A108 V111	V28-L75 HydrophobicContact CG1-CB 4.23Å; V28-L75 HydrophobicContact CG1-CD2 4.27Å; R29-L75 CarbonylContact O-C 3.51Å; R29-L75 WeakPolarHBondContact O-CA 3.36Å; E30-L75 HydrophobicContact CG-CD2 3.5Å; V64-L75 CarbonylContact C-O 3.56Å; V64-L75 WeakPolarHBondContact CA-O 3.3Å; L65-L75 HydrophobicContact CB-CB 4.35Å; L65-L75 PolarHBondContact N-O 2.95Å; L65-L75 PolarHBondContact O-N 3.31Å; L75-L77 PolarHBondContact O-N 3.05Å; L75-A108 HydrophobicContact CD2-CB 3.76Å; L75-V111 HydrophobicContact CD1-CB 4.35Å; L75-V111 HydrophobicContact CD1-CG2 3.82Å
76	R	84.3	Confident	77	Confident	33 Å²	33	53.1 Å²	53.1	13%	0.125	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	118.3	169.4	-176.6	-172.3	-60.8	171.8	4.9	108.4	V28 R29 V31 Y36 D62 C63	V28-R76 CarbonylContact C-O 3.6Å; V28-R76 WeakPolarHBondContact CA-O 3.46Å; R29-R76 PolarHBondContact N-O 3.33Å; R29-R76 PolarHBondContact O-N 2.87Å; V31-R76 HydrophobicContact CG2-CB 3.79Å; Y36-R76 VanDerWaalsContact OH-CZ 3.23Å; Y36-R76 PolarHBondContact OH-NE 3.24Å; Y36-R76 PolarHBondContact OH-NH2 2.93Å; D62-R76 IonicContact OD2-CZ 3.17Å; D62-R76 IonicContact OD2-NE 2.77Å; D62-R76 IonicContact OD2-NH2 3.62Å; C63-R76 CarbonylContact O-C 3.45Å; C63-R76 WeakPolarHBondContact O-CA 3.25Å
77	L	81.4	Confident	77.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-40.5	-178.6	-56.7	179.5	0	0	0	112.6	V28 M50 C63 L65 L75 L97 V111 V115	V28-L77 HydrophobicContact CG2-CD2 4.45Å; M50-L77 HydrophobicContact CE-CD1 3.35Å; M50-L77 HydrophobicContact SD-CD1 4.14Å; C63-L77 HydrophobicContact CB-CB 4.48Å; C63-L77 PolarHBondContact O-N 2.72Å; L65-L77 HydrophobicContact CB-CD1 4.3Å; L65-L77 HydrophobicContact CB-CD2 4.24Å; L65-L77 HydrophobicContact CB-CG 4.28Å; L75-L77 PolarHBondContact O-N 3.05Å; L77-L97 HydrophobicContact CD1-CD1 3.6Å; L77-V111 HydrophobicContact CD2-CG1 3.28Å; L77-V115 HydrophobicContact CB-CG2 4.44Å; L77-V115 HydrophobicContact CD2-CG2 4.03Å
78	F	83.4	Confident	78	Confident	1 Å²	1	56.4 Å²	56.4	0%	0.004	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	157.2	174.9	65	-104	0	0	0	111.9	P25 Y26 L52 D62 C63 V80 A86 W89 F93	P25-F78 CarbonylContact O-C 3.57Å; P25-F78 VanDerWaalsContact O-CA 3.28Å; P25-F78 WeakPolarHBondContact O-CA 3.41Å; Y26-F78 HydrophobicContact CD1-CB 3.65Å; Y26-F78 HydrophobicContact CD1-CG 4.4Å; Y26-F78 HydrophobicContact CE1-CB 4.21Å; Y26-F78 HydrophobicContact CG-CB 4.41Å; L52-F78 HydrophobicContact CD1-CE2 4.33Å; L52-F78 HydrophobicContact CD1-CZ 4.25Å; D62-F78 WeakPolarHBondContact CA-O 3.2Å; C63-F78 HydrophobicContact CB-CD1 3.56Å; C63-F78 HydrophobicContact CB-CD2 4.05Å; C63-F78 HydrophobicContact CB-CE1 3.21Å; C63-F78 HydrophobicContact CB-CE2 3.75Å; C63-F78 HydrophobicContact CB-CG 3.98Å; C63-F78 HydrophobicContact CB-CZ 3.34Å; C63-F78 PolarHBondContact N-O 2.91Å; F78-V80 HydrophobicContact CB-CG2 4.24Å; F78-V80 HydrophobicContact CD2-CB 4.21Å; F78-V80 HydrophobicContact CD2-CG2 3.6Å; F78-V80 HydrophobicContact CE2-CG2 4.27Å; F78-V80 HydrophobicContact CG-CG2 4.2Å; F78-A86 HydrophobicContact CE2-CB 4.14Å; F78-W89 HydrophobicContact CE1-CB 4.21Å; F78-W89 HydrophobicContact CZ-CB 4.4Å; F78-F93 AromaticContact CD1-CD2 3.97Å; F78-F93 HydrophobicContact CD1-CD2 3.97Å; F78-F93 AromaticContact CD1-CE2 3.72Å; F78-F93 HydrophobicContact CD1-CE2 3.72Å; F78-F93 AromaticContact CE1-CD2 3.67Å; F78-F93 HydrophobicContact CE1-CD2 3.67Å; F78-F93 AromaticContact CE1-CE2 3.82Å; F78-F93 HydrophobicContact CE1-CE2 3.82Å
79	Q	85.3	Confident	79.2	Confident	57 Å²	57	54.4 Å²	54.4	27%	0.266	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	101.9	169.6	179.3	171.2	11.4	0	0	108.2	P25 S60 W61 D62	P25-Q79 WeakPolarHBondContact CB-O 3.49Å; P25-Q79 PolarHBondContact O-N 3.15Å; S60-Q79 PolarHBondContact OG-NE2 3.43Å; W61-Q79 WeakPolarHBondContact O-CA 3.47Å; D62-Q79 WeakPolarHBondContact OD1-CG 3.31Å
80	V	85.6	Confident	80.4	Confident	9 Å²	9	48.9 Å²	48.9	6%	0.055	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	145.2	-174.2	-179.1	0	0	0	0	109.9	Y26 S60 W61 F78 D85	Y26-V80 HydrophobicContact CD1-CG2 4.47Å; Y26-V80 HydrophobicContact CE1-CG2 3.76Å; S60-V80 WeakPolarHBondContact CA-O 3.4Å; W61-V80 PolarHBondContact N-O 3.1Å; W61-V80 PolarHBondContact O-N 2.82Å; F78-V80 HydrophobicContact CB-CG2 4.24Å; F78-V80 HydrophobicContact CD2-CB 4.21Å; F78-V80 HydrophobicContact CD2-CG2 3.6Å; F78-V80 HydrophobicContact CE2-CG2 4.27Å; F78-V80 HydrophobicContact CG-CG2 4.2Å; V80-D85 HydrophobicContact CG1-CB 3.69Å
81	G	79.1	Confident	81.3	Confident	65 Å²	65	48.9 Å²	48.9	67%	0.67	28%	0.278	S	S	*	.	S	Bend	trans	-90.9	-0.3	-179.6	0	0	0	0	0	115.1	W61	W61-G81 WeakPolarHBondContact CZ3-O 3.34Å
82	S	83	Confident	82.1	Confident	40 Å²	40	46.1 Å²	46.1	28%	0.28	26%	0.256	S	S	.	.			trans	-113.3	130.2	179.8	176.7	0	0	0	0	110.7	E84 D85 A86	S82-E84 VanDerWaalsContact C-N 3.33Å; S82-E84 PolarHBondContact OG-N 3.45Å; S82-D85 WeakPolarHBondContact CB-OD2 3.25Å; S82-A86 PolarHBondContact O-N 3.36Å
83	E	83.4	Confident	82.9	Confident	90 Å²	90	41.4 Å²	41.4	42%	0.421	23%	0.227	S	C	.	.	H	α-helix	trans	-65.5	-37.8	176.4	-168.9	158.3	-177.5	0	0	111.8	K54 W61 A86 M87	K54-E83 IonicContact NZ-OE2 3.82Å; W61-E83 HydrophobicContact CH2-CB 3.72Å; W61-E83 HydrophobicContact CH2-CG 4.47Å; W61-E83 HydrophobicContact CZ2-CB 3.36Å; W61-E83 HydrophobicContact CZ2-CG 3.63Å; W61-E83 WeakPolarHBondContact CZ2-OE2 3.33Å; W61-E83 HydrophobicContact CZ3-CB 4.41Å; E83-A86 PolarHBondContact O-N 3.3Å; E83-M87 HydrophobicContact CG-CG 4.36Å; E83-M87 WeakPolarHBondContact O-CB 3.16Å; E83-M87 VanDerWaalsContact O-CG 3.27Å; E83-M87 WeakPolarHBondContact O-CG 3.24Å; E83-M87 PolarHBondContact O-N 2.84Å
84	E	82.9	Confident	83.1	Confident	161 Å²	161	39.7 Å²	39.7	75%	0.752	22%	0.217	S	C	*	.	H	α-helix	trans	-64.7	-45.8	-178.4	-64.5	-177.8	174.8	0	0	111.2	S82 M87 N88	S82-E84 VanDerWaalsContact C-N 3.33Å; S82-E84 PolarHBondContact OG-N 3.45Å; E84-M87 PolarHBondContact O-N 2.74Å; E84-N88 VanDerWaalsContact O-CB 3.32Å; E84-N88 WeakPolarHBondContact O-CB 3.26Å; E84-N88 PolarHBondContact O-N 2.95Å
85	D	83.3	Confident	83.3	Confident	65 Å²	65	44.3 Å²	44.3	35%	0.348	24%	0.241	S	C	.	.	H	α-helix	trans	-63.5	-44.5	177.2	-70.5	-31.8	0	0	0	111.3	V80 S82 M87 N88 W89	V80-D85 HydrophobicContact CG1-CB 3.69Å; S82-D85 WeakPolarHBondContact CB-OD2 3.25Å; D85-M87 VanDerWaalsContact C-N 3.33Å; D85-M87 PolarHBondContact O-N 3.24Å; D85-N88 PolarHBondContact O-N 2.67Å; D85-W89 WeakPolarHBondContact O-CB 3.28Å; D85-W89 PolarHBondContact O-N 2.97Å
86	A	81.9	Confident	83.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.6	-40.8	179.3	0	0	0	0	0	112	L52 W61 F78 S82 E83 F90	L52-A86 HydrophobicContact CD1-CB 4.48Å; W61-A86 HydrophobicContact CB-CB 3.46Å; W61-A86 VanDerWaalsContact CB-CB 3.46Å; W61-A86 HydrophobicContact CD2-CB 4.42Å; W61-A86 HydrophobicContact CG-CB 3.68Å; F78-A86 HydrophobicContact CE2-CB 4.14Å; S82-A86 PolarHBondContact O-N 3.36Å; E83-A86 PolarHBondContact O-N 3.3Å; A86-F90 WeakPolarHBondContact O-CB 3.31Å; A86-F90 PolarHBondContact O-N 3Å
87	M	84.1	Confident	83.4	Confident	54 Å²	54	43.3 Å²	43.3	27%	0.266	24%	0.237	S	C	.	.	H	α-helix	trans	-74.3	-27.5	178.2	-70.2	-66.3	179.9	0	0	113.1	L44 K45 L52 E83 E84 D85 P91	L44-M87 HydrophobicContact CD1-CE 4.13Å; K45-M87 HydrophobicContact CD-SD 4.25Å; K45-M87 PolarHBondContact NZ-SD 2.71Å; K45-M87 VanDerWaalsContact NZ-SD 3.37Å; L52-M87 HydrophobicContact CD2-CE 4.28Å; L52-M87 HydrophobicContact CD2-SD 4.21Å; E83-M87 HydrophobicContact CG-CG 4.36Å; E83-M87 WeakPolarHBondContact O-CB 3.16Å; E83-M87 VanDerWaalsContact O-CG 3.27Å; E83-M87 WeakPolarHBondContact O-CG 3.24Å; E83-M87 PolarHBondContact O-N 2.84Å; E84-M87 PolarHBondContact O-N 2.74Å; D85-M87 VanDerWaalsContact C-N 3.33Å; D85-M87 PolarHBondContact O-N 3.24Å; M87-P91 WeakPolarHBondContact O-CD 3.44Å; M87-P91 WeakPolarHBondContact O-CG 3.47Å
88	N	85.8	Confident	83.5	Confident	90 Å²	90	49.4 Å²	49.4	48%	0.481	26%	0.26	S	S	.	.	H	α-helix	trans	-75.7	-44.3	174.8	-175.1	26.9	0	0	0	112.2	E84 D85 Q92	E84-N88 VanDerWaalsContact O-CB 3.32Å; E84-N88 WeakPolarHBondContact O-CB 3.26Å; E84-N88 PolarHBondContact O-N 2.95Å; D85-N88 PolarHBondContact O-N 2.67Å; N88-Q92 PolarHBondContact O-NE2 2.95Å; N88-Q92 PolarHBondContact OD1-NE2 2.9Å
89	W	83.7	Confident	83.4	Confident	36 Å²	36	49.3 Å²	49.3	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-79.8	-34.5	-176	-75.3	116.5	0	0	0	113.8	F78 D85 Q92 F93 I118 R119 P122	F78-W89 HydrophobicContact CE1-CB 4.21Å; F78-W89 HydrophobicContact CZ-CB 4.4Å; D85-W89 WeakPolarHBondContact O-CB 3.28Å; D85-W89 PolarHBondContact O-N 2.97Å; W89-Q92 PolarHBondContact O-N 2.9Å; W89-Q92 VanDerWaalsContact O-N 3.16Å; W89-F93 HydrophobicContact CB-CD2 3.87Å; W89-F93 HydrophobicContact CB-CE2 3.72Å; W89-F93 HydrophobicContact CD2-CE2 4.28Å; W89-F93 HydrophobicContact CE3-CE2 4.09Å; W89-F93 HydrophobicContact CE3-CZ 4.33Å; W89-F93 HydrophobicContact CG-CE2 4.16Å; W89-F93 WeakPolarHBondContact O-CD2 3.41Å; W89-F93 PolarHBondContact O-N 3.42Å; W89-I118 HydrophobicContact CZ3-CG2 4.28Å; W89-R119 HydrophobicContact CH2-CG 4.35Å; W89-R119 HydrophobicContact CZ3-CG 4.4Å; W89-P122 HydrophobicContact CH2-CB 4.31Å; W89-P122 HydrophobicContact CZ3-CB 4.42Å
90	F	84.9	Confident	83.2	Confident	8 Å²	8	46.6 Å²	46.6	4%	0.035	25%	0.247	C	C	.	.	H	α-helix	trans	-55.3	-48.9	-176	175.3	-95.8	0	0	0	113.8	K45 D47 M50 L52 A86 Q92 F93 A94	K45-F90 HydrophobicContact CB-CD1 4.39Å; K45-F90 HydrophobicContact CB-CE1 3.71Å; K45-F90 HydrophobicContact CB-CZ 3.98Å; K45-F90 HydrophobicContact CD-CD1 4.38Å; K45-F90 HydrophobicContact CD-CE1 4.32Å; D47-F90 HydrophobicContact CB-CE1 4.3Å; D47-F90 HydrophobicContact CB-CZ 4.23Å; M50-F90 HydrophobicContact CB-CE2 4.32Å; L52-F90 HydrophobicContact CB-CD2 3.71Å; L52-F90 HydrophobicContact CB-CE2 3.71Å; L52-F90 HydrophobicContact CB-CG 4.27Å; L52-F90 HydrophobicContact CB-CZ 4.27Å; L52-F90 HydrophobicContact CD1-CD2 4.23Å; L52-F90 HydrophobicContact CD2-CB 4.36Å; L52-F90 HydrophobicContact CD2-CD2 4.47Å; L52-F90 HydrophobicContact CD2-CG 4.29Å; L52-F90 HydrophobicContact CG-CD2 4.36Å; A86-F90 WeakPolarHBondContact O-CB 3.31Å; A86-F90 PolarHBondContact O-N 3Å; F90-Q92 VanDerWaalsContact C-N 3.34Å; F90-Q92 PolarHBondContact O-N 2.91Å; F90-F93 PolarHBondContact O-N 3.45Å; F90-A94 WeakPolarHBondContact O-CB 3.5Å; F90-A94 PolarHBondContact O-N 2.95Å
91	P	84	Confident	82.9	Confident	65 Å²	65	47 Å²	47	42%	0.422	25%	0.248	S	C	.	.	H	α-helix	trans	-64.6	-36.3	177.8	-20.7	33.4	0	0	0	113	M87 A94 L95	M87-P91 WeakPolarHBondContact O-CD 3.44Å; M87-P91 WeakPolarHBondContact O-CG 3.47Å; P91-A94 PolarHBondContact O-N 2.99Å; P91-L95 WeakPolarHBondContact O-CB 3.37Å; P91-L95 PolarHBondContact O-N 2.83Å
92	Q	82.3	Confident	82.9	Confident	47 Å²	47	47.7 Å²	47.7	22%	0.22	23%	0.233	C	C	.	.	H	α-helix	trans	-67	-43.9	179.2	-61.9	-175.2	33.1	0	0	111.3	N88 W89 F90 K96	N88-Q92 PolarHBondContact O-NE2 2.95Å; N88-Q92 PolarHBondContact OD1-NE2 2.9Å; W89-Q92 PolarHBondContact O-N 2.9Å; W89-Q92 VanDerWaalsContact O-N 3.16Å; F90-Q92 VanDerWaalsContact C-N 3.34Å; F90-Q92 PolarHBondContact O-N 2.91Å; Q92-K96 VanDerWaalsContact O-CB 3.26Å; Q92-K96 WeakPolarHBondContact O-CB 3.39Å; Q92-K96 VanDerWaalsContact O-CG 3.26Å; Q92-K96 WeakPolarHBondContact O-CG 3.5Å; Q92-K96 PolarHBondContact O-N 2.87Å
93	F	84.3	Confident	82.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-44.5	174.9	-74.3	-61.3	0	0	0	111.7	M50 F78 W89 F90 L95 K96 L97 V115 I118 R119	M50-F93 HydrophobicContact CE-CB 3.59Å; M50-F93 HydrophobicContact SD-CB 4.4Å; F78-F93 AromaticContact CD1-CD2 3.97Å; F78-F93 HydrophobicContact CD1-CD2 3.97Å; F78-F93 AromaticContact CD1-CE2 3.72Å; F78-F93 HydrophobicContact CD1-CE2 3.72Å; F78-F93 AromaticContact CE1-CD2 3.67Å; F78-F93 HydrophobicContact CE1-CD2 3.67Å; F78-F93 AromaticContact CE1-CE2 3.82Å; F78-F93 HydrophobicContact CE1-CE2 3.82Å; W89-F93 HydrophobicContact CB-CD2 3.87Å; W89-F93 HydrophobicContact CB-CE2 3.72Å; W89-F93 HydrophobicContact CD2-CE2 4.28Å; W89-F93 HydrophobicContact CE3-CE2 4.09Å; W89-F93 HydrophobicContact CE3-CZ 4.33Å; W89-F93 HydrophobicContact CG-CE2 4.16Å; W89-F93 WeakPolarHBondContact O-CD2 3.41Å; W89-F93 PolarHBondContact O-N 3.42Å; F90-F93 PolarHBondContact O-N 3.45Å; F93-L95 VanDerWaalsContact C-N 3.34Å; F93-L95 PolarHBondContact O-N 2.8Å; F93-K96 PolarHBondContact O-N 3.02Å; F93-L97 HydrophobicContact CB-CD1 4.01Å; F93-L97 HydrophobicContact CD1-CD1 3.97Å; F93-L97 HydrophobicContact CG-CD1 4.4Å; F93-L97 WeakPolarHBondContact O-CB 3.48Å; F93-L97 PolarHBondContact O-N 2.97Å; F93-V115 HydrophobicContact CD1-CG2 4.45Å; F93-V115 HydrophobicContact CE1-CB 4.17Å; F93-V115 HydrophobicContact CE1-CG1 3.89Å; F93-V115 HydrophobicContact CE1-CG2 4.03Å; F93-V115 HydrophobicContact CZ-CG1 3.9Å; F93-I118 HydrophobicContact CD1-CB 4.26Å; F93-I118 HydrophobicContact CD1-CD1 3.66Å; F93-I118 HydrophobicContact CD1-CG2 3.87Å; F93-I118 HydrophobicContact CE1-CB 3.78Å; F93-I118 HydrophobicContact CE1-CD1 3.94Å; F93-I118 HydrophobicContact CE1-CG1 4.46Å; F93-I118 HydrophobicContact CE1-CG2 3.59Å; F93-I118 HydrophobicContact CZ-CG2 4.24Å; F93-R119 HydrophobicContact CZ-CG 3.96Å
94	A	82	Confident	82.2	Confident	3 Å²	3	46.2 Å²	46.2	3%	0.025	23%	0.229	C	C	.	.	H	α-helix	trans	-58	-44.7	179.1	0	0	0	0	0	112.6	D47 M50 F90 P91	D47-A94 HydrophobicContact CB-CB 3.96Å; M50-A94 VanDerWaalsContact SD-CA 3.57Å; M50-A94 HydrophobicContact SD-CB 4.37Å; F90-A94 WeakPolarHBondContact O-CB 3.5Å; F90-A94 PolarHBondContact O-N 2.95Å; P91-A94 PolarHBondContact O-N 2.99Å
95	L	83.9	Confident	81.8	Confident	96 Å²	96	42.9 Å²	42.9	50%	0.503	22%	0.219	S	C	.	.	H	α-helix	trans	-70.4	-46.6	178.7	-169.5	79.1	0	0	0	112.1	P91 F93 Y143	P91-L95 WeakPolarHBondContact O-CB 3.37Å; P91-L95 PolarHBondContact O-N 2.83Å; F93-L95 VanDerWaalsContact C-N 3.34Å; F93-L95 PolarHBondContact O-N 2.8Å; L95-Y143 WeakPolarHBondContact CD1-OH 3.45Å; L95-Y143 WeakPolarHBondContact CD2-OH 3.47Å; L95-Y143 VanDerWaalsContact CG-OH 3.22Å; L95-Y143 WeakPolarHBondContact CG-OH 3.39Å
96	K	83.7	Confident	81.3	Confident	22 Å²	22	40.9 Å²	40.9	10%	0.096	21%	0.208	C	C	.	.	H	α-helix	trans	-80.8	-30.7	-171	-65.9	-177.3	-174.9	-166.9	0	113.6	Q92 F93 P99 F100 I118 P122 W124 S126 I129	Q92-K96 VanDerWaalsContact O-CB 3.26Å; Q92-K96 WeakPolarHBondContact O-CB 3.39Å; Q92-K96 VanDerWaalsContact O-CG 3.26Å; Q92-K96 WeakPolarHBondContact O-CG 3.5Å; Q92-K96 PolarHBondContact O-N 2.87Å; F93-K96 PolarHBondContact O-N 3.02Å; K96-P99 WeakPolarHBondContact O-CD 3.29Å; K96-F100 VanDerWaalsContact O-CD2 3.29Å; K96-F100 WeakPolarHBondContact O-CD2 3.36Å; K96-F100 WeakPolarHBondContact O-CE2 3.46Å; K96-I118 HydrophobicContact CB-CD1 3.97Å; K96-I118 HydrophobicContact CB-CG1 4.42Å; K96-I118 HydrophobicContact CD-CG1 4.2Å; K96-I118 HydrophobicContact CD-CG2 4.28Å; K96-P122 VanDerWaalsContact NZ-C 3.34Å; K96-P122 PolarHBondContact NZ-O 2.94Å; K96-W124 WeakPolarHBondContact CE-O 3.41Å; K96-W124 PolarHBondContact NZ-O 3.14Å; K96-S126 WeakPolarHBondContact CA-OG 3.49Å; K96-S126 PolarHBondContact O-OG 2.92Å; K96-S126 VanDerWaalsContact O-OG 3.08Å; K96-I129 HydrophobicContact CB-CD1 4.28Å; K96-I129 HydrophobicContact CD-CD1 3.96Å
97	L	84	Confident	81.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-79.4	-19.3	-179.8	-77.9	165.1	0	0	0	113.7	M50 L77 F93 F100 Y101 I114 I118	M50-L97 HydrophobicContact CE-CD1 4.26Å; M50-L97 HydrophobicContact SD-CB 4.16Å; M50-L97 HydrophobicContact SD-CD1 3.88Å; L77-L97 HydrophobicContact CD1-CD1 3.6Å; F93-L97 HydrophobicContact CB-CD1 4.01Å; F93-L97 HydrophobicContact CD1-CD1 3.97Å; F93-L97 HydrophobicContact CG-CD1 4.4Å; F93-L97 WeakPolarHBondContact O-CB 3.48Å; F93-L97 PolarHBondContact O-N 2.97Å; L97-F100 WeakPolarHBondContact O-CB 3.47Å; L97-F100 PolarHBondContact O-N 3.22Å; L97-Y101 HydrophobicContact CB-CD1 4.39Å; L97-Y101 HydrophobicContact CB-CE1 4.5Å; L97-Y101 VanDerWaalsContact O-CD1 3.25Å; L97-Y101 WeakPolarHBondContact O-CD1 3.33Å; L97-Y101 PolarHBondContact O-N 2.85Å; L97-I114 HydrophobicContact CD2-CB 4.15Å; L97-I114 HydrophobicContact CD2-CD1 4.33Å; L97-I114 HydrophobicContact CD2-CG2 3.41Å; L97-I114 VanDerWaalsContact CD2-CG2 3.41Å; L97-I114 HydrophobicContact CG-CG2 4.44Å; L97-I118 HydrophobicContact CD2-CD1 4.43Å; L97-I118 HydrophobicContact CG-CD1 4.1Å
98	R	82.2	Confident	80.7	Confident	128 Å²	128	46.1 Å²	46.1	48%	0.483	23%	0.233	S	C	.	.	H	α-helix	trans	-50.8	-49.9	-175.6	-178.2	171.7	-177.8	-178.4	-0	115	F100 Y101 E102	R98-F100 PolarHBondContact O-N 3.47Å; R98-F100 VanDerWaalsContact O-N 3.15Å; R98-Y101 HydrophobicContact CB-CE1 4.16Å; R98-Y101 HydrophobicContact CG-CE2 4.35Å; R98-E102 HydrophobicContact CG-CG 4.42Å; R98-E102 WeakPolarHBondContact CG-OE1 3.33Å; R98-E102 WeakPolarHBondContact CG-OE2 3.48Å; R98-E102 IonicContact CZ-OE1 2.63Å; R98-E102 IonicContact NE-OE1 3.32Å; R98-E102 PolarHBondContact NE-OE1 2.91Å; R98-E102 IonicContact NE-OE2 2.88Å; R98-E102 IonicContact NH2-OE1 2.81Å; R98-E102 WeakPolarHBondContact O-CB 3.34Å; R98-E102 WeakPolarHBondContact O-CG 3.25Å; R98-E102 PolarHBondContact O-N 2.91Å
99	P	81.1	Confident	80.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.5	-24.2	-180	-22.1	35.2	0	0	0	114	K96 S103 H141 Y143 V144	K96-P99 WeakPolarHBondContact O-CD 3.29Å; P99-S103 VanDerWaalsContact O-CB 3.27Å; P99-S103 WeakPolarHBondContact O-CB 3.31Å; P99-S103 PolarHBondContact O-N 3.07Å; P99-S103 PolarHBondContact O-OG 3.32Å; P99-H141 HydrophobicContact CB-CB 4.25Å; P99-Y143 HydrophobicContact CG-CD1 3.54Å; P99-Y143 HydrophobicContact CG-CE1 4.33Å; P99-Y143 HydrophobicContact CG-CG 4.34Å; P99-V144 HydrophobicContact CB-CG2 3.45Å; P99-V144 VanDerWaalsContact CB-CG2 3.45Å; P99-V144 HydrophobicContact CG-CG2 3.72Å
100	F	82.5	Confident	80.2	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-81.6	-43.4	-174.4	-60.1	-75.5	0	0	0	111.9	K96 L97 R98 L104 L106 I114 S126 I129 A130 M135 C138	K96-F100 VanDerWaalsContact O-CD2 3.29Å; K96-F100 WeakPolarHBondContact O-CD2 3.36Å; K96-F100 WeakPolarHBondContact O-CE2 3.46Å; L97-F100 WeakPolarHBondContact O-CB 3.47Å; L97-F100 PolarHBondContact O-N 3.22Å; R98-F100 PolarHBondContact O-N 3.47Å; R98-F100 VanDerWaalsContact O-N 3.15Å; F100-L104 WeakPolarHBondContact O-CB 3.12Å; F100-L104 PolarHBondContact O-N 3.47Å; F100-L106 HydrophobicContact CB-CD2 4.3Å; F100-I114 HydrophobicContact CB-CD1 4.18Å; F100-I114 HydrophobicContact CD1-CD1 4.35Å; F100-I114 HydrophobicContact CD2-CG2 4.5Å; F100-I114 HydrophobicContact CE2-CG2 4.5Å; F100-I114 HydrophobicContact CG-CD1 4.14Å; F100-S126 WeakPolarHBondContact CZ-O 3.28Å; F100-I129 HydrophobicContact CE1-CG2 4.42Å; F100-I129 HydrophobicContact CE2-CB 4.35Å; F100-I129 HydrophobicContact CE2-CG2 3.88Å; F100-I129 HydrophobicContact CZ-CB 3.93Å; F100-I129 HydrophobicContact CZ-CG2 3.56Å; F100-A130 HydrophobicContact CE1-CB 3.79Å; F100-A130 HydrophobicContact CZ-CB 4Å; F100-M135 HydrophobicContact CD1-CE 3.15Å; F100-M135 HydrophobicContact CD1-SD 3.91Å; F100-M135 HydrophobicContact CE1-CE 3.3Å; F100-M135 HydrophobicContact CE1-SD 4.43Å; F100-M135 HydrophobicContact CG-CE 4.07Å; F100-M135 HydrophobicContact CZ-CE 4.29Å; F100-C138 HydrophobicContact CD1-CB 3.99Å; F100-C138 VanDerWaalsContact CD1-SG 3.5Å; F100-C138 HydrophobicContact CE1-CB 4.01Å
101	Y	79	Confident	80	Confident	16 Å²	16	48.6 Å²	48.6	6%	0.063	25%	0.251	C	S	.	.	H	α-helix	trans	-79.6	-18	177.1	64.6	-113.2	0	0	0	113.8	R49 L65 L97 R98 L106	R49-Y101 HydrophobicContact CB-CD2 4.41Å; R49-Y101 HydrophobicContact CB-CE2 4.07Å; R49-Y101 HydrophobicContact CG-CD2 4.17Å; R49-Y101 HydrophobicContact CG-CE2 3.82Å; R49-Y101 PolarHBondContact NH1-O 3.47Å; L65-Y101 HydrophobicContact CD1-CD1 3.71Å; L65-Y101 HydrophobicContact CD1-CE1 4.05Å; L65-Y101 HydrophobicContact CD1-CG 4.31Å; L97-Y101 HydrophobicContact CB-CD1 4.39Å; L97-Y101 HydrophobicContact CB-CE1 4.5Å; L97-Y101 VanDerWaalsContact O-CD1 3.25Å; L97-Y101 WeakPolarHBondContact O-CD1 3.33Å; L97-Y101 PolarHBondContact O-N 2.85Å; R98-Y101 HydrophobicContact CB-CE1 4.16Å; R98-Y101 HydrophobicContact CG-CE2 4.35Å; Y101-L106 VanDerWaalsContact CB-CD1 3.44Å
102	E	79.4	Confident	80	Confident	80 Å²	80	47.1 Å²	47.1	37%	0.374	24%	0.239	S	C	.	.	H	α-helix	trans	-80.3	-29.7	174.1	-72.7	175.7	166.2	0	0	111.5	R98 H141	R98-E102 HydrophobicContact CG-CG 4.42Å; R98-E102 WeakPolarHBondContact CG-OE1 3.33Å; R98-E102 WeakPolarHBondContact CG-OE2 3.48Å; R98-E102 IonicContact CZ-OE1 2.63Å; R98-E102 IonicContact NE-OE1 3.32Å; R98-E102 PolarHBondContact NE-OE1 2.91Å; R98-E102 IonicContact NE-OE2 2.88Å; R98-E102 IonicContact NH2-OE1 2.81Å; R98-E102 WeakPolarHBondContact O-CB 3.34Å; R98-E102 WeakPolarHBondContact O-CG 3.25Å; R98-E102 PolarHBondContact O-N 2.91Å; E102-H141 IonicContact OE2-CE1 2.94Å; E102-H141 PolarHBondContact OE2-CE1 3.46Å; E102-H141 IonicContact OE2-NE2 3.91Å; E102-H141 PolarHBondContact OE2-NE2 2.93Å; E102-H141 VanDerWaalsContact OE2-NE2 3.09Å
103	S	76.1	Confident	80.1	Confident	45 Å²	45	48.1 Å²	48.1	32%	0.315	25%	0.248	S	C	.	.	H	α-helix	trans	-101.6	-25.2	-174.9	-47.5	0	0	0	0	114.3	P99	P99-S103 VanDerWaalsContact O-CB 3.27Å; P99-S103 WeakPolarHBondContact O-CB 3.31Å; P99-S103 PolarHBondContact O-N 3.07Å; P99-S103 PolarHBondContact O-OG 3.32Å
104	L	74.6	Confident	80.1	Confident	55 Å²	55	48.1 Å²	48.1	29%	0.288	25%	0.248	S	C	.	.	S	Bend	trans	-134.2	152	-172.6	-68.3	170.5	0	0	0	112.8	F100 L106 M135 E137 C138	F100-L104 WeakPolarHBondContact O-CB 3.12Å; F100-L104 PolarHBondContact O-N 3.47Å; L104-L106 PolarHBondContact O-N 2.89Å; L104-M135 HydrophobicContact CD1-CB 4.01Å; L104-M135 HydrophobicContact CD1-CG 3.94Å; L104-M135 HydrophobicContact CD1-SD 3.59Å; L104-M135 VanDerWaalsContact CD1-SD 3.59Å; L104-E137 HydrophobicContact CD2-CB 4.12Å; L104-E137 HydrophobicContact CD2-CG 4.41Å; L104-C138 WeakPolarHBondContact CD1-SG 3.47Å
105	T	75.2	Confident	80.2	Confident	90 Å²	90	48 Å²	48	55%	0.552	25%	0.247	S	C	*	.			trans	-75.3	105.3	168.8	65.6	0	0	0	0	108.8	E69	E69-T105 VanDerWaalsContact OE1-CB 3.26Å; E69-T105 WeakPolarHBondContact OE1-CB 3.39Å; E69-T105 WeakPolarHBondContact OE1-CG2 3.32Å
106	L	72.6	Confident	80.2	Confident	23 Å²	23	45.6 Å²	45.6	12%	0.12	24%	0.235	C	C	.	.			trans	-86.1	120.1	-171.1	-71.2	-179.3	0	0	0	112.7	L65 F100 Y101 L104 V111 I114	L65-L106 HydrophobicContact CD2-CD1 3.88Å; F100-L106 HydrophobicContact CB-CD2 4.3Å; Y101-L106 VanDerWaalsContact CB-CD1 3.44Å; L104-L106 PolarHBondContact O-N 2.89Å; L106-V111 HydrophobicContact CB-CG2 3.65Å; L106-V111 HydrophobicContact CD1-CG2 3.86Å; L106-V111 HydrophobicContact CD2-CG2 4.1Å; L106-V111 HydrophobicContact CG-CG2 4.1Å; L106-I114 HydrophobicContact CD2-CD1 4.31Å
107	K	76.9	Confident	80.3	Confident	148 Å²	148	45.4 Å²	45.4	64%	0.643	24%	0.236	S	C	*	.			trans	-92.1	154.8	169.2	-64.3	-178	-179.3	178.9	0	111	D109 T110 V111	K107-D109 VanDerWaalsContact C-N 3.26Å; K107-D109 PolarHBondContact O-N 3.31Å; K107-T110 PolarHBondContact O-N 3.25Å; K107-T110 VanDerWaalsContact O-N 3.13Å; K107-V111 WeakPolarHBondContact O-CG2 3.45Å; K107-V111 PolarHBondContact O-N 2.84Å
108	A	75.6	Confident	80.4	Confident	16 Å²	16	45.4 Å²	45.4	13%	0.132	24%	0.236	C	C	.	.	H	α-helix	trans	-52.6	-41.8	-179.4	0	0	0	0	0	113.3	V28 E30 L75 V111 Q112	V28-A108 HydrophobicContact CG1-CB 4.35Å; E30-A108 HydrophobicContact CG-CB 4.26Å; L75-A108 HydrophobicContact CD2-CB 3.76Å; A108-V111 PolarHBondContact O-N 3.29Å; A108-Q112 WeakPolarHBondContact O-CB 3.32Å; A108-Q112 PolarHBondContact O-N 3.01Å
109	D	78.8	Confident	80.5	Confident	134 Å²	134	42.8 Å²	42.8	72%	0.717	23%	0.226	S	C	*	.	H	α-helix	trans	-67.1	-40.3	-179.6	-61.8	-29.7	0	0	0	112.8	K107 Q112 T113	K107-D109 VanDerWaalsContact C-N 3.26Å; K107-D109 PolarHBondContact O-N 3.31Å; D109-Q112 WeakPolarHBondContact O-CB 3.22Å; D109-Q112 PolarHBondContact O-N 2.8Å; D109-T113 PolarHBondContact O-N 3.36Å
110	T	80.5	Confident	80.7	Confident	53 Å²	53	48.1 Å²	48.1	33%	0.325	26%	0.255	S	S	.	.	H	α-helix	trans	-69.7	-35.8	177	-48	0	0	0	0	111.2	K107 Q112 T113 I114 M135	K107-T110 PolarHBondContact O-N 3.25Å; K107-T110 VanDerWaalsContact O-N 3.13Å; T110-Q112 VanDerWaalsContact C-N 3.34Å; T110-T113 PolarHBondContact O-N 3.32Å; T110-T113 PolarHBondContact O-OG1 3.19Å; T110-I114 HydrophobicContact CG2-CD1 4.49Å; T110-I114 WeakPolarHBondContact O-CD1 3.34Å; T110-I114 VanDerWaalsContact O-CG1 3.27Å; T110-I114 WeakPolarHBondContact O-CG1 3.28Å; T110-I114 PolarHBondContact O-N 3.36Å; T110-M135 HydrophobicContact CG2-SD 3.83Å
111	V	82.3	Confident	80.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-70.8	-34.4	175.4	179.5	0	0	0	0	111	V28 L75 L77 L106 K107 A108 T113 I114 V115	V28-V111 HydrophobicContact CG1-CB 4.22Å; V28-V111 HydrophobicContact CG1-CG1 4.12Å; V28-V111 HydrophobicContact CG2-CG1 4.12Å; L75-V111 HydrophobicContact CD1-CB 4.35Å; L75-V111 HydrophobicContact CD1-CG2 3.82Å; L77-V111 HydrophobicContact CD2-CG1 3.28Å; L106-V111 HydrophobicContact CB-CG2 3.65Å; L106-V111 HydrophobicContact CD1-CG2 3.86Å; L106-V111 HydrophobicContact CD2-CG2 4.1Å; L106-V111 HydrophobicContact CG-CG2 4.1Å; K107-V111 WeakPolarHBondContact O-CG2 3.45Å; K107-V111 PolarHBondContact O-N 2.84Å; A108-V111 PolarHBondContact O-N 3.29Å; V111-T113 PolarHBondContact O-N 2.99Å; V111-I114 PolarHBondContact O-N 3.42Å; V111-V115 HydrophobicContact CG1-CG2 4.06Å; V111-V115 WeakPolarHBondContact O-CB 3.33Å; V111-V115 VanDerWaalsContact O-CG2 3.23Å; V111-V115 WeakPolarHBondContact O-CG2 3.45Å; V111-V115 PolarHBondContact O-N 2.89Å
112	Q	83.3	Confident	81.1	Confident	33 Å²	33	54 Å²	54	15%	0.154	29%	0.288	C	S	.	.	H	α-helix	trans	-58.2	-48.4	173.5	-176.5	67.5	64.9	0	0	111.1	Y26 R27 V28 A108 D109 T110 I114 V115 D116	Y26-Q112 PolarHBondContact O-NE2 3.19Å; Y26-Q112 VanDerWaalsContact O-NE2 3.15Å; R27-Q112 VanDerWaalsContact CA-OE1 3.29Å; V28-Q112 HydrophobicContact CB-CB 4.23Å; V28-Q112 HydrophobicContact CG2-CB 4.08Å; A108-Q112 WeakPolarHBondContact O-CB 3.32Å; A108-Q112 PolarHBondContact O-N 3.01Å; D109-Q112 WeakPolarHBondContact O-CB 3.22Å; D109-Q112 PolarHBondContact O-N 2.8Å; T110-Q112 VanDerWaalsContact C-N 3.34Å; Q112-I114 VanDerWaalsContact C-N 3.32Å; Q112-I114 PolarHBondContact O-N 3.37Å; Q112-V115 PolarHBondContact O-N 2.8Å; Q112-D116 WeakPolarHBondContact CG-OD2 3.4Å; Q112-D116 VanDerWaalsContact NE2-CG 3.27Å; Q112-D116 PolarHBondContact NE2-OD1 3.29Å; Q112-D116 PolarHBondContact NE2-OD2 3Å; Q112-D116 WeakPolarHBondContact O-CB 3.46Å; Q112-D116 PolarHBondContact O-N 3.33Å
113	T	84.3	Confident	81.4	Confident	69 Å²	69	53.3 Å²	53.3	42%	0.423	29%	0.287	S	S	.	.	H	α-helix	trans	-62.8	-39.2	179.8	59.2	0	0	0	0	112.1	D109 T110 V111 C117	D109-T113 PolarHBondContact O-N 3.36Å; T110-T113 PolarHBondContact O-N 3.32Å; T110-T113 PolarHBondContact O-OG1 3.19Å; V111-T113 PolarHBondContact O-N 2.99Å; T113-C117 WeakPolarHBondContact O-CB 3.3Å; T113-C117 PolarHBondContact O-N 3.19Å; T113-C117 PolarHBondContact O-SG 3.07Å
114	I	83.8	Confident	82	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.7	-45.5	175.6	-60	160.4	0	0	0	111.3	L97 F100 L106 T110 V111 Q112 D116 C117 I118 I129 T133 M135	L97-I114 HydrophobicContact CD2-CB 4.15Å; L97-I114 HydrophobicContact CD2-CD1 4.33Å; L97-I114 HydrophobicContact CD2-CG2 3.41Å; L97-I114 VanDerWaalsContact CD2-CG2 3.41Å; L97-I114 HydrophobicContact CG-CG2 4.44Å; F100-I114 HydrophobicContact CB-CD1 4.18Å; F100-I114 HydrophobicContact CD1-CD1 4.35Å; F100-I114 HydrophobicContact CD2-CG2 4.5Å; F100-I114 HydrophobicContact CE2-CG2 4.5Å; F100-I114 HydrophobicContact CG-CD1 4.14Å; L106-I114 HydrophobicContact CD2-CD1 4.31Å; T110-I114 HydrophobicContact CG2-CD1 4.49Å; T110-I114 WeakPolarHBondContact O-CD1 3.34Å; T110-I114 VanDerWaalsContact O-CG1 3.27Å; T110-I114 WeakPolarHBondContact O-CG1 3.28Å; T110-I114 PolarHBondContact O-N 3.36Å; V111-I114 PolarHBondContact O-N 3.42Å; Q112-I114 VanDerWaalsContact C-N 3.32Å; Q112-I114 PolarHBondContact O-N 3.37Å; I114-D116 VanDerWaalsContact C-N 3.32Å; I114-D116 PolarHBondContact O-N 3.09Å; I114-C117 WeakPolarHBondContact O-CB 3.42Å; I114-C117 PolarHBondContact O-N 3.41Å; I114-I118 HydrophobicContact CG2-CD1 3.83Å; I114-I118 HydrophobicContact CG2-CG1 4.4Å; I114-I118 WeakPolarHBondContact O-CG1 3.35Å; I114-I118 PolarHBondContact O-N 3.35Å; I114-I129 HydrophobicContact CG2-CG2 3.78Å; I114-T133 HydrophobicContact CG1-CG2 3.99Å; I114-M135 HydrophobicContact CD1-CE 3.34Å; I114-M135 HydrophobicContact CD1-SD 4.18Å; I114-M135 HydrophobicContact CG1-CE 3.43Å; I114-M135 VanDerWaalsContact CG1-CE 3.43Å
115	V	84.3	Confident	82.7	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.4	-42.4	179.8	166.6	0	0	0	0	110.5	V28 L77 F93 V111 Q112 I118 R119	V28-V115 HydrophobicContact CG2-CB 4.3Å; V28-V115 HydrophobicContact CG2-CG2 4.1Å; L77-V115 HydrophobicContact CB-CG2 4.44Å; L77-V115 HydrophobicContact CD2-CG2 4.03Å; F93-V115 HydrophobicContact CD1-CG2 4.45Å; F93-V115 HydrophobicContact CE1-CB 4.17Å; F93-V115 HydrophobicContact CE1-CG1 3.89Å; F93-V115 HydrophobicContact CE1-CG2 4.03Å; F93-V115 HydrophobicContact CZ-CG1 3.9Å; V111-V115 HydrophobicContact CG1-CG2 4.06Å; V111-V115 WeakPolarHBondContact O-CB 3.33Å; V111-V115 VanDerWaalsContact O-CG2 3.23Å; V111-V115 WeakPolarHBondContact O-CG2 3.45Å; V111-V115 PolarHBondContact O-N 2.89Å; Q112-V115 PolarHBondContact O-N 2.8Å; V115-I118 PolarHBondContact O-N 3.04Å; V115-R119 WeakPolarHBondContact O-CG 3.47Å; V115-R119 PolarHBondContact O-N 2.9Å; V115-R119 VanDerWaalsContact O-N 3.11Å
116	D	84.7	Confident	83.3	Confident	46 Å²	46	45.7 Å²	45.7	25%	0.246	24%	0.24	C	C	.	.	H	α-helix	trans	-64.5	-40.5	175.6	-68.1	-27.1	0	0	0	111.3	Q112 I114 R119 N120	Q112-D116 WeakPolarHBondContact CG-OD2 3.4Å; Q112-D116 VanDerWaalsContact NE2-CG 3.27Å; Q112-D116 PolarHBondContact NE2-OD1 3.29Å; Q112-D116 PolarHBondContact NE2-OD2 3Å; Q112-D116 WeakPolarHBondContact O-CB 3.46Å; Q112-D116 PolarHBondContact O-N 3.33Å; I114-D116 VanDerWaalsContact C-N 3.32Å; I114-D116 PolarHBondContact O-N 3.09Å; D116-R119 PolarHBondContact O-N 3.35Å; D116-N120 WeakPolarHBondContact O-CB 3.35Å; D116-N120 PolarHBondContact O-N 2.82Å; D116-N120 PolarHBondContact O-ND2 3.3Å
117	C	84.8	Confident	84	Confident	18 Å²	18	44.6 Å²	44.6	12%	0.122	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-46	174.9	-71.1	0	0	0	0	112.5	T113 I114 R119 N120 H121	T113-C117 WeakPolarHBondContact O-CB 3.3Å; T113-C117 PolarHBondContact O-N 3.19Å; T113-C117 PolarHBondContact O-SG 3.07Å; I114-C117 WeakPolarHBondContact O-CB 3.42Å; I114-C117 PolarHBondContact O-N 3.41Å; C117-R119 PolarHBondContact O-N 3.38Å; C117-N120 PolarHBondContact O-N 3.39Å; C117-H121 PolarHBondContact O-N 3.48Å
118	I	86.3	Confident	84.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-35.8	178.7	-69.4	166.6	0	0	0	111	W89 F93 K96 L97 I114 V115 H121 P122 I129	W89-I118 HydrophobicContact CZ3-CG2 4.28Å; F93-I118 HydrophobicContact CD1-CB 4.26Å; F93-I118 HydrophobicContact CD1-CD1 3.66Å; F93-I118 HydrophobicContact CD1-CG2 3.87Å; F93-I118 HydrophobicContact CE1-CB 3.78Å; F93-I118 HydrophobicContact CE1-CD1 3.94Å; F93-I118 HydrophobicContact CE1-CG1 4.46Å; F93-I118 HydrophobicContact CE1-CG2 3.59Å; F93-I118 HydrophobicContact CZ-CG2 4.24Å; K96-I118 HydrophobicContact CB-CD1 3.97Å; K96-I118 HydrophobicContact CB-CG1 4.42Å; K96-I118 HydrophobicContact CD-CG1 4.2Å; K96-I118 HydrophobicContact CD-CG2 4.28Å; L97-I118 HydrophobicContact CD2-CD1 4.43Å; L97-I118 HydrophobicContact CG-CD1 4.1Å; I114-I118 HydrophobicContact CG2-CD1 3.83Å; I114-I118 HydrophobicContact CG2-CG1 4.4Å; I114-I118 WeakPolarHBondContact O-CG1 3.35Å; I114-I118 PolarHBondContact O-N 3.35Å; V115-I118 PolarHBondContact O-N 3.04Å; I118-H121 CarbonylContact O-C 3.51Å; I118-P122 WeakPolarHBondContact O-CA 3.43Å; I118-I129 HydrophobicContact CD1-CD1 4.27Å; I118-I129 HydrophobicContact CG1-CD1 3.51Å; I118-I129 HydrophobicContact CG1-CG1 4.48Å
119	R	85.2	Confident	85.2	Confident	73 Å²	73	36.8 Å²	36.8	28%	0.275	20%	0.197	S	C	.	.	H	α-helix	trans	-75.1	-40.8	179.2	-72.6	-177.5	67.4	-132.2	-6.4	112.9	Y26 W89 F93 V115 D116 C117 H121	Y26-R119 VanDerWaalsContact CB-NH1 3.34Å; Y26-R119 VanDerWaalsContact CD1-CD 3.47Å; Y26-R119 VanDerWaalsContact CD1-NE 3.34Å; Y26-R119 VanDerWaalsContact CD2-NH1 3.3Å; Y26-R119 VanDerWaalsContact CE2-CZ 3.47Å; Y26-R119 VanDerWaalsContact CG-NE 3.26Å; W89-R119 HydrophobicContact CH2-CG 4.35Å; W89-R119 HydrophobicContact CZ3-CG 4.4Å; F93-R119 HydrophobicContact CZ-CG 3.96Å; V115-R119 WeakPolarHBondContact O-CG 3.47Å; V115-R119 PolarHBondContact O-N 2.9Å; V115-R119 VanDerWaalsContact O-N 3.11Å; D116-R119 PolarHBondContact O-N 3.35Å; C117-R119 PolarHBondContact O-N 3.38Å; R119-H121 VanDerWaalsContact C-N 3.32Å
120	N	85.6	Confident	85.6	Confident	112 Å²	112	30.4 Å²	30.4	60%	0.599	16%	0.163	S	C	*	.	H	α-helix	trans	-70.7	-32.1	179.2	-67.4	-17.8	0	0	0	111.6	D116 C117	D116-N120 WeakPolarHBondContact O-CB 3.35Å; D116-N120 PolarHBondContact O-N 2.82Å; D116-N120 PolarHBondContact O-ND2 3.3Å; C117-N120 PolarHBondContact O-N 3.39Å
121	H	85.3	Confident	86	Confident	72 Å²	72	27.9 Å²	27.9	33%	0.333	15%	0.148	S	C	.	.			trans	-133.8	79.7	-177.5	-57.3	-71.9	0	0	0	111.6	C117 I118 R119 D123 W124	C117-H121 PolarHBondContact O-N 3.48Å; I118-H121 CarbonylContact O-C 3.51Å; R119-H121 VanDerWaalsContact C-N 3.32Å; H121-D123 PolarHBondContact O-N 3.46Å; H121-W124 HydrophobicContact CB-CB 4.06Å; H121-W124 HydrophobicContact CB-CD2 3.31Å; H121-W124 HydrophobicContact CB-CE3 3.8Å; H121-W124 HydrophobicContact CB-CG 3.41Å; H121-W124 VanDerWaalsContact CB-CG 3.41Å; H121-W124 HydrophobicContact CB-CZ2 4.19Å; H121-W124 HydrophobicContact CB-CZ3 4.39Å; H121-W124 AromaticContact CD2-CE2 3.8Å; H121-W124 AromaticContact CD2-CE3 3.96Å; H121-W124 AromaticContact CD2-CH2 3.43Å; H121-W124 VanDerWaalsContact CD2-CH2 3.43Å; H121-W124 WeakPolarHBondContact CD2-CH2 3.3Å; H121-W124 AromaticContact CD2-CZ2 3.51Å; H121-W124 AromaticContact CD2-CZ3 3.66Å; H121-W124 AromaticContact CE1-CZ2 3.98Å; H121-W124 AromaticContact CG-CD2 3.69Å; H121-W124 AromaticContact CG-CE2 3.42Å; H121-W124 VanDerWaalsContact CG-CE2 3.42Å; H121-W124 AromaticContact CG-CH2 3.96Å; H121-W124 AromaticContact CG-CZ2 3.59Å; H121-W124 AromaticContact CG-NE1 3.83Å; H121-W124 AromaticContact ND1-CE2 3.86Å; H121-W124 AromaticContact ND1-CZ2 3.88Å; H121-W124 AromaticContact ND1-NE1 3.99Å; H121-W124 AromaticContact NE2-CH2 3.83Å; H121-W124 AromaticContact NE2-CZ2 3.81Å; H121-W124 WeakPolarHBondContact O-CB 3.32Å; H121-W124 PolarHBondContact O-N 2.62Å
122	P	82.7	Confident	86.3	Confident	66 Å²	66	30.6 Å²	30.6	43%	0.429	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16	-176.8	27.8	-35	0	0	0	113.7	W89 K96 I118	W89-P122 HydrophobicContact CH2-CB 4.31Å; W89-P122 HydrophobicContact CZ3-CB 4.42Å; K96-P122 VanDerWaalsContact NZ-C 3.34Å; K96-P122 PolarHBondContact NZ-O 2.94Å; I118-P122 WeakPolarHBondContact O-CA 3.43Å
123	D	85.9	Confident	86.4	Confident	66 Å²	66	30.7 Å²	30.7	35%	0.353	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-16	177.4	58.9	-60.4	0	0	0	113.6	H121 D152 A153	H121-D123 PolarHBondContact O-N 3.46Å; D123-D152 WeakPolarHBondContact OD2-CB 3.38Å; D123-A153 HydrophobicContact CB-CB 3.95Å; D123-A153 WeakPolarHBondContact OD2-CB 3.5Å; D123-A153 PolarHBondContact OD2-N 3.11Å
124	W	88.6	Confident	86.3	Confident	16 Å²	16	28.7 Å²	28.7	6%	0.061	16%	0.156	C	C	.	.			trans	-67.8	138.4	-177.9	-79.5	12.2	0	0	0	113.1	K96 H121 H128 I129 E132 D152 L161	K96-W124 WeakPolarHBondContact CE-O 3.41Å; K96-W124 PolarHBondContact NZ-O 3.14Å; H121-W124 HydrophobicContact CB-CB 4.06Å; H121-W124 HydrophobicContact CB-CD2 3.31Å; H121-W124 HydrophobicContact CB-CE3 3.8Å; H121-W124 HydrophobicContact CB-CG 3.41Å; H121-W124 VanDerWaalsContact CB-CG 3.41Å; H121-W124 HydrophobicContact CB-CZ2 4.19Å; H121-W124 HydrophobicContact CB-CZ3 4.39Å; H121-W124 AromaticContact CD2-CE2 3.8Å; H121-W124 AromaticContact CD2-CE3 3.96Å; H121-W124 AromaticContact CD2-CH2 3.43Å; H121-W124 VanDerWaalsContact CD2-CH2 3.43Å; H121-W124 WeakPolarHBondContact CD2-CH2 3.3Å; H121-W124 AromaticContact CD2-CZ2 3.51Å; H121-W124 AromaticContact CD2-CZ3 3.66Å; H121-W124 AromaticContact CE1-CZ2 3.98Å; H121-W124 AromaticContact CG-CD2 3.69Å; H121-W124 AromaticContact CG-CE2 3.42Å; H121-W124 VanDerWaalsContact CG-CE2 3.42Å; H121-W124 AromaticContact CG-CH2 3.96Å; H121-W124 AromaticContact CG-CZ2 3.59Å; H121-W124 AromaticContact CG-NE1 3.83Å; H121-W124 AromaticContact ND1-CE2 3.86Å; H121-W124 AromaticContact ND1-CZ2 3.88Å; H121-W124 AromaticContact ND1-NE1 3.99Å; H121-W124 AromaticContact NE2-CH2 3.83Å; H121-W124 AromaticContact NE2-CZ2 3.81Å; H121-W124 WeakPolarHBondContact O-CB 3.32Å; H121-W124 PolarHBondContact O-N 2.62Å; W124-H128 HydrophobicContact CB-CB 3.91Å; W124-H128 HydrophobicContact CD2-CB 4.01Å; W124-H128 HydrophobicContact CE3-CB 4.21Å; W124-H128 HydrophobicContact CG-CB 3.9Å; W124-I129 HydrophobicContact CB-CG1 4.32Å; W124-I129 HydrophobicContact CE3-CG1 4.42Å; W124-E132 HydrophobicContact CH2-CB 4.41Å; W124-E132 HydrophobicContact CH2-CG 4.24Å; W124-E132 HydrophobicContact CZ3-CB 3.77Å; W124-E132 HydrophobicContact CZ3-CG 3.82Å; W124-D152 PolarHBondContact NE1-OD2 3.01Å; W124-L161 HydrophobicContact CH2-CD1 4.14Å; W124-L161 HydrophobicContact CZ2-CD1 3.98Å; W124-L161 HydrophobicContact CZ2-CD2 4.36Å
125	S	89.3	Confident	86.3	Confident	15 Å²	15	29.5 Å²	29.5	11%	0.105	16%	0.16	C	C	.	.			trans	-76.9	165.6	172.6	79.4	0	0	0	0	111.6	A127 H128 I129	S125-A127 PolarHBondContact O-N 3.19Å; S125-A127 VanDerWaalsContact O-N 3.14Å; S125-A127 PolarHBondContact OG-N 3.45Å; S125-H128 PolarHBondContact N-ND1 3.03Å; S125-H128 PolarHBondContact O-N 3.26Å; S125-H128 VanDerWaalsContact O-N 3.08Å; S125-H128 PolarHBondContact OG-N 2.88Å; S125-H128 PolarHBondContact OG-ND1 3.35Å; S125-I129 PolarHBondContact O-N 3.05Å; S125-I129 VanDerWaalsContact O-N 3.17Å
126	S	87.9	Confident	86.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.3	-26.1	175	-65.3	0	0	0	0	112.3	K96 F100 A130	K96-S126 WeakPolarHBondContact CA-OG 3.49Å; K96-S126 PolarHBondContact O-OG 2.92Å; K96-S126 VanDerWaalsContact O-OG 3.08Å; F100-S126 WeakPolarHBondContact CZ-O 3.28Å; S126-A130 WeakPolarHBondContact O-CB 3.2Å; S126-A130 PolarHBondContact O-N 3.42Å
127	A	88.5	Confident	86	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-70.8	-40.7	175	0	0	0	0	0	112.7	S125 I129 A130 V131 V144 Q147 I148 P158	S125-A127 PolarHBondContact O-N 3.19Å; S125-A127 VanDerWaalsContact O-N 3.14Å; S125-A127 PolarHBondContact OG-N 3.45Å; A127-I129 VanDerWaalsContact C-N 3.34Å; A127-A130 PolarHBondContact O-N 3.11Å; A127-V131 WeakPolarHBondContact O-CG2 3.2Å; A127-V131 PolarHBondContact O-N 3.36Å; A127-V131 VanDerWaalsContact O-N 3.11Å; A127-V144 HydrophobicContact CB-CG1 3.79Å; A127-Q147 HydrophobicContact CB-CB 4.39Å; A127-I148 HydrophobicContact CB-CD1 4.32Å; A127-P158 HydrophobicContact CB-CB 4.12Å; A127-P158 HydrophobicContact CB-CG 3.47Å; A127-P158 VanDerWaalsContact CB-CG 3.47Å
128	H	89.1	Confident	85.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-43.6	175.2	-66.2	87.5	0	0	0	110.8	W124 S125 A130 V131 E132 A150 Q156 T157 P158 L161	W124-H128 HydrophobicContact CB-CB 3.91Å; W124-H128 HydrophobicContact CD2-CB 4.01Å; W124-H128 HydrophobicContact CE3-CB 4.21Å; W124-H128 HydrophobicContact CG-CB 3.9Å; S125-H128 PolarHBondContact N-ND1 3.03Å; S125-H128 PolarHBondContact O-N 3.26Å; S125-H128 VanDerWaalsContact O-N 3.08Å; S125-H128 PolarHBondContact OG-N 2.88Å; S125-H128 PolarHBondContact OG-ND1 3.35Å; H128-A130 PolarHBondContact O-N 3.29Å; H128-V131 PolarHBondContact O-N 3.39Å; H128-E132 PolarHBondContact O-N 3.32Å; H128-A150 PolarHBondContact CE1-O 3.42Å; H128-A150 VanDerWaalsContact CE1-O 3.22Å; H128-Q156 PolarHBondContact NE2-O 3.25Å; H128-Q156 VanDerWaalsContact NE2-O 3.09Å; H128-T157 VanDerWaalsContact NE2-C 3.34Å; H128-T157 WeakPolarHBondContact NE2-CA 3.43Å; H128-P158 WeakPolarHBondContact NE2-CD 3.3Å; H128-L161 HydrophobicContact CB-CD1 3.88Å
129	I	87.8	Confident	85.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.8	-41.4	177.9	-64	162.5	0	0	0	111.1	K96 F100 I114 I118 W124 S125 A127 V131 E132 T133	K96-I129 HydrophobicContact CB-CD1 4.28Å; K96-I129 HydrophobicContact CD-CD1 3.96Å; F100-I129 HydrophobicContact CE1-CG2 4.42Å; F100-I129 HydrophobicContact CE2-CB 4.35Å; F100-I129 HydrophobicContact CE2-CG2 3.88Å; F100-I129 HydrophobicContact CZ-CB 3.93Å; F100-I129 HydrophobicContact CZ-CG2 3.56Å; I114-I129 HydrophobicContact CG2-CG2 3.78Å; I118-I129 HydrophobicContact CD1-CD1 4.27Å; I118-I129 HydrophobicContact CG1-CD1 3.51Å; I118-I129 HydrophobicContact CG1-CG1 4.48Å; W124-I129 HydrophobicContact CB-CG1 4.32Å; W124-I129 HydrophobicContact CE3-CG1 4.42Å; S125-I129 PolarHBondContact O-N 3.05Å; S125-I129 VanDerWaalsContact O-N 3.17Å; A127-I129 VanDerWaalsContact C-N 3.34Å; I129-V131 VanDerWaalsContact C-N 3.31Å; I129-V131 PolarHBondContact O-N 3.34Å; I129-E132 PolarHBondContact O-N 3.43Å; I129-T133 HydrophobicContact CG2-CG2 4.36Å; I129-T133 WeakPolarHBondContact O-CB 3.45Å; I129-T133 WeakPolarHBondContact O-CG2 3.26Å; I129-T133 PolarHBondContact O-N 3.33Å; I129-T133 PolarHBondContact O-OG1 3.37Å
130	A	88.4	Confident	85.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.8	-39.9	177.5	0	0	0	0	0	111.9	F100 S126 A127 H128 T133 G134 M135 C138 L139	F100-A130 HydrophobicContact CE1-CB 3.79Å; F100-A130 HydrophobicContact CZ-CB 4Å; S126-A130 WeakPolarHBondContact O-CB 3.2Å; S126-A130 PolarHBondContact O-N 3.42Å; A127-A130 PolarHBondContact O-N 3.11Å; H128-A130 PolarHBondContact O-N 3.29Å; A130-T133 PolarHBondContact O-OG1 3.04Å; A130-G134 PolarHBondContact O-N 3.39Å; A130-G134 VanDerWaalsContact O-N 3.11Å; A130-M135 PolarHBondContact O-N 2.95Å; A130-C138 HydrophobicContact CB-CB 4.32Å; A130-L139 HydrophobicContact CB-CD2 3.76Å; A130-L139 HydrophobicContact CB-CG 4.43Å
131	V	89.1	Confident	85.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.3	-44.7	175	174.3	0	0	0	0	111.6	A127 H128 I129 T133 G134 L139 P158 L161 A162 R165 L174	A127-V131 WeakPolarHBondContact O-CG2 3.2Å; A127-V131 PolarHBondContact O-N 3.36Å; A127-V131 VanDerWaalsContact O-N 3.11Å; H128-V131 PolarHBondContact O-N 3.39Å; I129-V131 VanDerWaalsContact C-N 3.31Å; I129-V131 PolarHBondContact O-N 3.34Å; V131-T133 VanDerWaalsContact C-N 3.27Å; V131-T133 PolarHBondContact O-N 2.87Å; V131-G134 PolarHBondContact O-N 3.45Å; V131-L139 HydrophobicContact CG2-CD2 4.21Å; V131-P158 HydrophobicContact CG2-CB 3.93Å; V131-L161 HydrophobicContact CG1-CB 4.16Å; V131-A162 HydrophobicContact CG1-CB 3.68Å; V131-R165 PolarHBondContact O-NH1 3.44Å; V131-L174 HydrophobicContact CG2-CD1 3.94Å
132	E	87.9	Confident	85.4	Confident	57 Å²	57	36.3 Å²	36.3	27%	0.266	19%	0.187	S	C	.	.	H	α-helix	trans	-63.5	-34.4	179.2	-176	57	-142.2	0	0	112.3	W124 H128 I129 R165	W124-E132 HydrophobicContact CH2-CB 4.41Å; W124-E132 HydrophobicContact CH2-CG 4.24Å; W124-E132 HydrophobicContact CZ3-CB 3.77Å; W124-E132 HydrophobicContact CZ3-CG 3.82Å; H128-E132 PolarHBondContact O-N 3.32Å; I129-E132 PolarHBondContact O-N 3.43Å; E132-R165 VanDerWaalsContact C-NH1 3.31Å; E132-R165 PolarHBondContact O-NH1 2.71Å; E132-R165 PolarHBondContact O-NH2 2.69Å; E132-R165 IonicContact OE1-CZ 2.74Å; E132-R165 IonicContact OE1-NE 3.2Å; E132-R165 IonicContact OE1-NH2 2.7Å; E132-R165 PolarHBondContact OE1-NH2 2.7Å; E132-R165 WeakPolarHBondContact OE2-CD 3.36Å; E132-R165 IonicContact OE2-NE 3.71Å; E132-R165 PolarHBondContact OE2-NE 3.34Å
133	T	84.6	Confident	85.4	Confident	34 Å²	34	36.4 Å²	36.4	21%	0.209	18%	0.179	C	C	.	.	H	α-helix	trans	-88.1	-7.1	179.5	54.7	0	0	0	0	113.3	I114 I129 A130 V131 M135	I114-T133 HydrophobicContact CG1-CG2 3.99Å; I129-T133 HydrophobicContact CG2-CG2 4.36Å; I129-T133 WeakPolarHBondContact O-CB 3.45Å; I129-T133 WeakPolarHBondContact O-CG2 3.26Å; I129-T133 PolarHBondContact O-N 3.33Å; I129-T133 PolarHBondContact O-OG1 3.37Å; A130-T133 PolarHBondContact O-OG1 3.04Å; V131-T133 VanDerWaalsContact C-N 3.27Å; V131-T133 PolarHBondContact O-N 2.87Å; T133-M135 HydrophobicContact CG2-CE 4.03Å; T133-M135 PolarHBondContact O-N 2.89Å; T133-M135 WeakPolarHBondContact OG1-CE 3.12Å
134	G	83.3	Confident	85.3	Confident	28 Å²	28	33.3 Å²	33.3	29%	0.289	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	19	-177.3	0	0	0	0	0	113.9	A130 V131 R136	A130-G134 PolarHBondContact O-N 3.39Å; A130-G134 VanDerWaalsContact O-N 3.11Å; V131-G134 PolarHBondContact O-N 3.45Å; G134-R136 VanDerWaalsContact C-N 3.31Å; G134-R136 PolarHBondContact O-N 2.78Å
135	M	83.2	Confident	85.1	Confident	16 Å²	16	36.2 Å²	36.2	8%	0.079	18%	0.177	C	C	.	.			trans	-85	75.3	-178.1	-70.5	-169.5	-74.2	0	0	111.3	F100 L104 T110 I114 A130 T133 E137 C138	F100-M135 HydrophobicContact CD1-CE 3.15Å; F100-M135 HydrophobicContact CD1-SD 3.91Å; F100-M135 HydrophobicContact CE1-CE 3.3Å; F100-M135 HydrophobicContact CE1-SD 4.43Å; F100-M135 HydrophobicContact CG-CE 4.07Å; F100-M135 HydrophobicContact CZ-CE 4.29Å; L104-M135 HydrophobicContact CD1-CB 4.01Å; L104-M135 HydrophobicContact CD1-CG 3.94Å; L104-M135 HydrophobicContact CD1-SD 3.59Å; L104-M135 VanDerWaalsContact CD1-SD 3.59Å; T110-M135 HydrophobicContact CG2-SD 3.83Å; I114-M135 HydrophobicContact CD1-CE 3.34Å; I114-M135 HydrophobicContact CD1-SD 4.18Å; I114-M135 HydrophobicContact CG1-CE 3.43Å; I114-M135 VanDerWaalsContact CG1-CE 3.43Å; A130-M135 PolarHBondContact O-N 2.95Å; T133-M135 HydrophobicContact CG2-CE 4.03Å; T133-M135 PolarHBondContact O-N 2.89Å; T133-M135 WeakPolarHBondContact OG1-CE 3.12Å; M135-E137 PolarHBondContact O-N 2.83Å; M135-C138 HydrophobicContact CB-CB 4.43Å; M135-C138 WeakPolarHBondContact O-CB 3.31Å; M135-C138 PolarHBondContact O-N 3.17Å; M135-C138 VanDerWaalsContact O-N 3.16Å
136	R	81.8	Confident	84.9	Confident	100 Å²	100	39.9 Å²	39.9	38%	0.377	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-51.6	-45.8	-179.6	-78.3	-174.2	-51.6	110.4	-0.1	114.9	G134 C138 L139 E173	G134-R136 VanDerWaalsContact C-N 3.31Å; G134-R136 PolarHBondContact O-N 2.78Å; R136-C138 PolarHBondContact O-N 2.86Å; R136-C138 VanDerWaalsContact O-N 3.16Å; R136-L139 VanDerWaalsContact O-CB 3.29Å; R136-L139 WeakPolarHBondContact O-CB 3.4Å; R136-L139 PolarHBondContact O-N 2.91Å; R136-E173 VanDerWaalsContact CA-OE2 3.31Å; R136-E173 WeakPolarHBondContact CA-OE2 3.3Å; R136-E173 WeakPolarHBondContact CB-OE1 3.35Å; R136-E173 WeakPolarHBondContact CB-OE2 3.34Å; R136-E173 VanDerWaalsContact CD-OE1 3.26Å; R136-E173 WeakPolarHBondContact CD-OE1 3.26Å; R136-E173 WeakPolarHBondContact CG-OE2 3.25Å; R136-E173 IonicContact CZ-OE1 3.89Å; R136-E173 IonicContact NE-OE1 3.56Å; R136-E173 IonicContact NH1-OE1 2.87Å; R136-E173 PolarHBondContact NH1-OE1 2.78Å
137	E	80.9	Confident	84.8	Confident	87 Å²	87	41.9 Å²	41.9	41%	0.407	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-61.9	-29.1	-179.6	-59.6	-55.2	146.6	0	0	113.3	L104 M135 L139 K140	L104-E137 HydrophobicContact CD2-CB 4.12Å; L104-E137 HydrophobicContact CD2-CG 4.41Å; M135-E137 PolarHBondContact O-N 2.83Å; E137-L139 PolarHBondContact O-N 2.93Å; E137-K140 PolarHBondContact O-N 3.28Å; E137-K140 IonicContact OE1-NZ 3.98Å; E137-K140 IonicContact OE2-NZ 2.87Å; E137-K140 PolarHBondContact OE2-NZ 2.91Å
138	C	83	Confident	84.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-70.9	-19.5	177.6	-66.5	0	0	0	0	113.1	F100 L104 A130 M135 R136 K140 H141 V144	F100-C138 HydrophobicContact CD1-CB 3.99Å; F100-C138 VanDerWaalsContact CD1-SG 3.5Å; F100-C138 HydrophobicContact CE1-CB 4.01Å; L104-C138 WeakPolarHBondContact CD1-SG 3.47Å; A130-C138 HydrophobicContact CB-CB 4.32Å; M135-C138 HydrophobicContact CB-CB 4.43Å; M135-C138 WeakPolarHBondContact O-CB 3.31Å; M135-C138 PolarHBondContact O-N 3.17Å; M135-C138 VanDerWaalsContact O-N 3.16Å; R136-C138 PolarHBondContact O-N 2.86Å; R136-C138 VanDerWaalsContact O-N 3.16Å; C138-K140 PolarHBondContact O-N 2.95Å; C138-H141 WeakPolarHBondContact O-CB 3.31Å; C138-H141 PolarHBondContact O-N 2.9Å; C138-V144 WeakPolarHBondContact O-CB 3.41Å; C138-V144 WeakPolarHBondContact O-CG2 3.26Å
139	L	83	Confident	84.7	Confident	2 Å²	2	45 Å²	45	1%	0.01	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-66.6	-21.6	176.8	-62.3	175.2	0	0	0	112.4	A130 V131 R136 E137 H141 V144 Q145 I148 E173 L174	A130-L139 HydrophobicContact CB-CD2 3.76Å; A130-L139 HydrophobicContact CB-CG 4.43Å; V131-L139 HydrophobicContact CG2-CD2 4.21Å; R136-L139 VanDerWaalsContact O-CB 3.29Å; R136-L139 WeakPolarHBondContact O-CB 3.4Å; R136-L139 PolarHBondContact O-N 2.91Å; E137-L139 PolarHBondContact O-N 2.93Å; L139-H141 VanDerWaalsContact C-N 3.31Å; L139-V144 HydrophobicContact CD2-CG1 4.04Å; L139-Q145 WeakPolarHBondContact O-CG 3.38Å; L139-I148 HydrophobicContact CD2-CD1 4.34Å; L139-E173 HydrophobicContact CD1-CB 4.47Å; L139-L174 HydrophobicContact CD1-CD2 3.95Å; L139-L174 HydrophobicContact CD1-CG 4.16Å; L139-L174 HydrophobicContact CD2-CD2 4.03Å
140	K	80.8	Confident	84.8	Confident	102 Å²	102	46.3 Å²	46.3	44%	0.443	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-79.3	-12.3	176.4	-61.8	173.3	-173.6	160	0	113.4	E137 C138 N142	E137-K140 PolarHBondContact O-N 3.28Å; E137-K140 IonicContact OE1-NZ 3.98Å; E137-K140 IonicContact OE2-NZ 2.87Å; E137-K140 PolarHBondContact OE2-NZ 2.91Å; C138-K140 PolarHBondContact O-N 2.95Å; K140-N142 PolarHBondContact O-N 3.4Å
141	H	84.2	Confident	84.9	Confident	44 Å²	44	53.4 Å²	53.4	20%	0.204	27%	0.266	C	S	.	.	S	Bend	trans	-69.9	132.3	-177.3	-167.3	-94.5	0	0	0	111	P99 E102 C138 L139 Y143 V144 Q145	P99-H141 HydrophobicContact CB-CB 4.25Å; E102-H141 IonicContact OE2-CE1 2.94Å; E102-H141 PolarHBondContact OE2-CE1 3.46Å; E102-H141 IonicContact OE2-NE2 3.91Å; E102-H141 PolarHBondContact OE2-NE2 2.93Å; E102-H141 VanDerWaalsContact OE2-NE2 3.09Å; C138-H141 WeakPolarHBondContact O-CB 3.31Å; C138-H141 PolarHBondContact O-N 2.9Å; L139-H141 VanDerWaalsContact C-N 3.31Å; H141-Y143 WeakPolarHBondContact ND1-CB 3.16Å; H141-Y143 PolarHBondContact ND1-N 2.74Å; H141-Y143 PolarHBondContact O-N 2.81Å; H141-V144 HydrophobicContact CB-CB 4.36Å; H141-V144 HydrophobicContact CB-CG2 4.18Å; H141-V144 WeakPolarHBondContact O-CA 3.42Å; H141-V144 PolarHBondContact O-N 3.41Å; H141-Q145 PolarHBondContact O-N 3.13Å
142	N	83.4	Confident	84.9	Confident	130 Å²	130	54.2 Å²	54.2	70%	0.695	27%	0.27	S	S	*	.	H	α-helix	trans	-50.6	-40.3	-176.4	-69.4	-21	0	0	0	113.3	K140 S146	K140-N142 PolarHBondContact O-N 3.4Å; N142-S146 PolarHBondContact O-N 3.33Å; N142-S146 VanDerWaalsContact O-N 3.09Å
143	Y	82.9	Confident	84.9	Confident	68 Å²	68	54.7 Å²	54.7	27%	0.267	28%	0.284	S	S	.	.	H	α-helix	trans	-66	-39.4	177.7	-173.7	-101.2	0	0	0	112.5	L95 P99 H141 S146 Q147	L95-Y143 WeakPolarHBondContact CD1-OH 3.45Å; L95-Y143 WeakPolarHBondContact CD2-OH 3.47Å; L95-Y143 VanDerWaalsContact CG-OH 3.22Å; L95-Y143 WeakPolarHBondContact CG-OH 3.39Å; P99-Y143 HydrophobicContact CG-CD1 3.54Å; P99-Y143 HydrophobicContact CG-CE1 4.33Å; P99-Y143 HydrophobicContact CG-CG 4.34Å; H141-Y143 WeakPolarHBondContact ND1-CB 3.16Å; H141-Y143 PolarHBondContact ND1-N 2.74Å; H141-Y143 PolarHBondContact O-N 2.81Å; Y143-S146 PolarHBondContact O-N 3.42Å; Y143-S146 PolarHBondContact O-OG 3.02Å; Y143-Q147 PolarHBondContact OH-NE2 3.41Å; Y143-Q147 VanDerWaalsContact OH-NE2 3.14Å
144	V	84.4	Confident	85	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-72	-39.7	178.5	177.3	0	0	0	0	110.7	P99 A127 C138 L139 H141 S146 Q147 I148	P99-V144 HydrophobicContact CB-CG2 3.45Å; P99-V144 VanDerWaalsContact CB-CG2 3.45Å; P99-V144 HydrophobicContact CG-CG2 3.72Å; A127-V144 HydrophobicContact CB-CG1 3.79Å; C138-V144 WeakPolarHBondContact O-CB 3.41Å; C138-V144 WeakPolarHBondContact O-CG2 3.26Å; L139-V144 HydrophobicContact CD2-CG1 4.04Å; H141-V144 HydrophobicContact CB-CB 4.36Å; H141-V144 HydrophobicContact CB-CG2 4.18Å; H141-V144 WeakPolarHBondContact O-CA 3.42Å; H141-V144 PolarHBondContact O-N 3.41Å; V144-S146 VanDerWaalsContact C-N 3.29Å; V144-S146 PolarHBondContact O-N 3.47Å; V144-Q147 CarbonylContact O-C 3.59Å; V144-Q147 WeakPolarHBondContact O-CA 3.43Å; V144-Q147 PolarHBondContact O-N 3.4Å; V144-I148 PolarHBondContact O-N 2.63Å; V144-I148 VanDerWaalsContact O-N 3.15Å
145	Q	84	Confident	85.2	Confident	78 Å²	78	53.9 Å²	53.9	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-58.8	-39.9	174.1	-70.7	-173.6	-20.4	0	0	112.1	L139 H141 Q147 I148	L139-Q145 WeakPolarHBondContact O-CG 3.38Å; H141-Q145 PolarHBondContact O-N 3.13Å; Q145-Q147 PolarHBondContact O-N 2.88Å; Q145-Q147 VanDerWaalsContact O-N 3.11Å; Q145-I148 WeakPolarHBondContact O-CB 3.34Å; Q145-I148 PolarHBondContact O-N 2.97Å
146	S	85.4	Confident	85.6	Confident	91 Å²	91	54.1 Å²	54.1	64%	0.636	28%	0.277	S	S	*	.	H	α-helix	trans	-61.6	-20.4	175.1	79.7	0	0	0	0	113.7	N142 Y143 V144	N142-S146 PolarHBondContact O-N 3.33Å; N142-S146 VanDerWaalsContact O-N 3.09Å; Y143-S146 PolarHBondContact O-N 3.42Å; Y143-S146 PolarHBondContact O-OG 3.02Å; V144-S146 VanDerWaalsContact C-N 3.29Å; V144-S146 PolarHBondContact O-N 3.47Å
147	Q	86.2	Confident	86.1	Confident	42 Å²	42	49.3 Å²	49.3	20%	0.196	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	12.1	-177.7	-63.4	-176.5	-14.9	0	0	113.3	A127 Y143 V144 Q145 N149 A150	A127-Q147 HydrophobicContact CB-CB 4.39Å; Y143-Q147 PolarHBondContact OH-NE2 3.41Å; Y143-Q147 VanDerWaalsContact OH-NE2 3.14Å; V144-Q147 CarbonylContact O-C 3.59Å; V144-Q147 WeakPolarHBondContact O-CA 3.43Å; V144-Q147 PolarHBondContact O-N 3.4Å; Q145-Q147 PolarHBondContact O-N 2.88Å; Q145-Q147 VanDerWaalsContact O-N 3.11Å; Q147-N149 PolarHBondContact O-N 2.7Å; Q147-A150 HydrophobicContact CB-CB 4.18Å; Q147-A150 WeakPolarHBondContact O-CB 3.5Å; Q147-A150 PolarHBondContact O-N 3.11Å
148	I	86.6	Confident	86.6	Confident	8 Å²	8	45.2 Å²	45.2	4%	0.041	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-24.8	-174.6	-150.7	66.1	0	0	0	113.4	A127 L139 V144 Q145 P158 L174 A180	A127-I148 HydrophobicContact CB-CD1 4.32Å; L139-I148 HydrophobicContact CD2-CD1 4.34Å; V144-I148 PolarHBondContact O-N 2.63Å; V144-I148 VanDerWaalsContact O-N 3.15Å; Q145-I148 WeakPolarHBondContact O-CB 3.34Å; Q145-I148 PolarHBondContact O-N 2.97Å; I148-P158 VanDerWaalsContact O-CD 3.29Å; I148-P158 WeakPolarHBondContact O-CD 3.27Å; I148-L174 HydrophobicContact CD1-CD2 3.25Å; I148-L174 HydrophobicContact CG1-CD2 3.84Å; I148-A180 HydrophobicContact CG1-CB 4.17Å
149	N	88.1	Confident	87	Confident	58 Å²	58	45.2 Å²	45.2	31%	0.31	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	14.6	177	-63.6	-46.4	0	0	0	112	Q147 R181 I184	Q147-N149 PolarHBondContact O-N 2.7Å; N149-R181 WeakPolarHBondContact OD1-CB 3.47Å; N149-R181 PolarHBondContact OD1-N 3.12Å; N149-I184 HydrophobicContact CB-CD1 3.76Å
150	A	88.9	Confident	87.4	Confident	28 Å²	28	45.1 Å²	45.1	23%	0.231	24%	0.24	C	C	.	.			trans	-62.1	150	175.2	0	0	0	0	0	109.9	H128 Q147 T157	H128-A150 PolarHBondContact CE1-O 3.42Å; H128-A150 VanDerWaalsContact CE1-O 3.22Å; Q147-A150 HydrophobicContact CB-CB 4.18Å; Q147-A150 WeakPolarHBondContact O-CB 3.5Å; Q147-A150 PolarHBondContact O-N 3.11Å; A150-T157 WeakPolarHBondContact O-CA 3.44Å
151	R	91.3	Very high	87.8	Confident	148 Å²	148	40.7 Å²	40.7	56%	0.558	22%	0.221	S	C	*	.			trans	-109.7	134	177.7	-75.3	177.6	153.5	167.2	-5.6	110	Q156 T157 I184 R185	R151-Q156 VanDerWaalsContact CA-O 3.28Å; R151-Q156 WeakPolarHBondContact CA-O 3.38Å; R151-T157 HydrophobicContact CG-CG2 4.29Å; R151-I184 HydrophobicContact CG-CG2 4.46Å; R151-I184 VanDerWaalsContact NE-CG2 3.31Å; R151-R185 PolarHBondContact NH2-O 3.48Å
152	D	89.5	Confident	88.1	Confident	18 Å²	18	38.6 Å²	38.6	10%	0.096	21%	0.211	C	C	.	.			trans	-77.6	-175	171.1	81.3	-14.5	0	0	0	111.7	D123 W124 S154 G155 Q156	D123-D152 WeakPolarHBondContact OD2-CB 3.38Å; W124-D152 PolarHBondContact NE1-OD2 3.01Å; D152-S154 VanDerWaalsContact CG-OG 3.3Å; D152-S154 PolarHBondContact O-N 3.16Å; D152-S154 VanDerWaalsContact OD1-C 3.29Å; D152-S154 WeakPolarHBondContact OD1-CA 3.27Å; D152-S154 PolarHBondContact OD1-N 2.91Å; D152-S154 PolarHBondContact OD1-OG 2.92Å; D152-S154 PolarHBondContact OD2-OG 3.17Å; D152-G155 PolarHBondContact O-N 3.01Å; D152-G155 PolarHBondContact OD1-N 3.35Å; D152-Q156 PolarHBondContact N-O 3.37Å; D152-Q156 WeakPolarHBondContact OD1-CB 3.38Å; D152-Q156 PolarHBondContact OD1-N 2.93Å; D152-Q156 PolarHBondContact OD2-OE1 3.06Å
153	A	87.1	Confident	88.5	Confident	67 Å²	67	32.4 Å²	32.4	55%	0.554	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-14.8	178.4	0	0	0	0	0	114	D123 Q187	D123-A153 HydrophobicContact CB-CB 3.95Å; D123-A153 WeakPolarHBondContact OD2-CB 3.5Å; D123-A153 PolarHBondContact OD2-N 3.11Å; A153-Q187 PolarHBondContact O-NE2 3.28Å
154	S	86.6	Confident	88.8	Confident	38 Å²	38	33.3 Å²	33.3	27%	0.266	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-1.7	173.7	76.4	0	0	0	0	112.9	D152 Q156 Q187	D152-S154 VanDerWaalsContact CG-OG 3.3Å; D152-S154 PolarHBondContact O-N 3.16Å; D152-S154 VanDerWaalsContact OD1-C 3.29Å; D152-S154 WeakPolarHBondContact OD1-CA 3.27Å; D152-S154 PolarHBondContact OD1-N 2.91Å; D152-S154 PolarHBondContact OD1-OG 2.92Å; D152-S154 PolarHBondContact OD2-OG 3.17Å; S154-Q156 VanDerWaalsContact C-N 3.3Å; S154-Q156 VanDerWaalsContact OG-CG 3.23Å; S154-Q156 WeakPolarHBondContact OG-CG 3.49Å; S154-Q156 PolarHBondContact OG-OE1 2.83Å; S154-Q187 VanDerWaalsContact O-CB 3.31Å; S154-Q187 WeakPolarHBondContact O-CB 3.46Å; S154-Q187 WeakPolarHBondContact O-CG 3.3Å; S154-Q187 PolarHBondContact O-N 3.38Å
155	G	88.8	Confident	88.9	Confident	7 Å²	7	38.5 Å²	38.5	7%	0.072	20%	0.204	C	C	.	.	S	Bend	trans	81.5	3.9	-176.5	0	0	0	0	0	114.3	D152 D186	D152-G155 PolarHBondContact O-N 3.01Å; D152-G155 PolarHBondContact OD1-N 3.35Å; G155-D186 WeakPolarHBondContact O-CA 3.37Å
156	Q	91.4	Very high	89.1	Confident	20 Å²	20	36.4 Å²	36.4	9%	0.093	20%	0.204	C	C	.	.			trans	-68.8	148.7	175.9	-70.9	178.6	-46.8	0	0	110.6	H128 R151 D152 S154 H160 E164 D186 Y195	H128-Q156 PolarHBondContact NE2-O 3.25Å; H128-Q156 VanDerWaalsContact NE2-O 3.09Å; R151-Q156 VanDerWaalsContact CA-O 3.28Å; R151-Q156 WeakPolarHBondContact CA-O 3.38Å; D152-Q156 PolarHBondContact N-O 3.37Å; D152-Q156 WeakPolarHBondContact OD1-CB 3.38Å; D152-Q156 PolarHBondContact OD1-N 2.93Å; D152-Q156 PolarHBondContact OD2-OE1 3.06Å; S154-Q156 VanDerWaalsContact C-N 3.3Å; S154-Q156 VanDerWaalsContact OG-CG 3.23Å; S154-Q156 WeakPolarHBondContact OG-CG 3.49Å; S154-Q156 PolarHBondContact OG-OE1 2.83Å; Q156-H160 HydrophobicContact CB-CB 4.12Å; Q156-H160 HydrophobicContact CG-CB 4.29Å; Q156-E164 PolarHBondContact NE2-OE2 3.29Å; Q156-D186 HydrophobicContact CG-CB 4.28Å; Q156-Y195 VanDerWaalsContact NE2-CE1 3.28Å; Q156-Y195 PolarHBondContact NE2-OH 3.04Å
157	T	91.9	Very high	89.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.184	C	C	.	.			trans	-105.7	165.8	171.2	71.3	0	0	0	0	110.1	H128 A150 R151 L159 H160 L161 I184	H128-T157 VanDerWaalsContact NE2-C 3.34Å; H128-T157 WeakPolarHBondContact NE2-CA 3.43Å; A150-T157 WeakPolarHBondContact O-CA 3.44Å; R151-T157 HydrophobicContact CG-CG2 4.29Å; T157-L159 PolarHBondContact O-N 2.82Å; T157-L159 VanDerWaalsContact O-N 3.09Å; T157-L159 PolarHBondContact OG1-N 2.96Å; T157-H160 PolarHBondContact N-ND1 3.36Å; T157-H160 WeakPolarHBondContact O-CA 3.5Å; T157-H160 WeakPolarHBondContact O-CB 3.45Å; T157-H160 PolarHBondContact O-N 3.27Å; T157-H160 PolarHBondContact OG1-ND1 2.89Å; T157-L161 PolarHBondContact O-N 3.08Å; T157-I184 HydrophobicContact CG2-CB 3.98Å; T157-I184 HydrophobicContact CG2-CD1 4Å; T157-I184 HydrophobicContact CG2-CG2 3.54Å
158	P	91.1	Very high	89.3	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-54	-32.3	174.2	-25	34	0	0	0	112.9	A127 H128 V131 I148 L161 A162	A127-P158 HydrophobicContact CB-CB 4.12Å; A127-P158 HydrophobicContact CB-CG 3.47Å; A127-P158 VanDerWaalsContact CB-CG 3.47Å; H128-P158 WeakPolarHBondContact NE2-CD 3.3Å; V131-P158 HydrophobicContact CG2-CB 3.93Å; I148-P158 VanDerWaalsContact O-CD 3.29Å; I148-P158 WeakPolarHBondContact O-CD 3.27Å; P158-L161 PolarHBondContact O-N 2.77Å; P158-A162 PolarHBondContact O-N 3.19Å
159	L	90.9	Very high	89.4	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-69.1	-34.2	175.5	-173.9	61.6	0	0	0	112.9	T157 A162 C163 V171 L174 L175 A180 T182 P192	T157-L159 PolarHBondContact O-N 2.82Å; T157-L159 VanDerWaalsContact O-N 3.09Å; T157-L159 PolarHBondContact OG1-N 2.96Å; L159-A162 PolarHBondContact O-N 2.88Å; L159-C163 PolarHBondContact O-N 2.9Å; L159-C163 PolarHBondContact O-SG 3.38Å; L159-V171 HydrophobicContact CD1-CG1 4.46Å; L159-L174 HydrophobicContact CB-CD1 4.41Å; L159-L174 HydrophobicContact CD1-CB 4.14Å; L159-L174 HydrophobicContact CD1-CD1 4.03Å; L159-L175 HydrophobicContact CD1-CD2 4.34Å; L159-L175 HydrophobicContact CD1-CG 4.45Å; L159-L175 HydrophobicContact CD2-CD2 4.05Å; L159-A180 HydrophobicContact CD2-CB 4.27Å; L159-T182 HydrophobicContact CD2-CG2 3.96Å; L159-P192 HydrophobicContact CD2-CB 4.12Å; L159-P192 HydrophobicContact CD2-CG 3.96Å; L159-P192 HydrophobicContact CG-CB 4Å; L159-P192 HydrophobicContact CG-CG 4.12Å
160	H	91.1	Very high	89.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.3	-47.5	172.5	-67.7	85.3	0	0	0	110.6	Q156 T157 A162 C163 E164 I184 E190 P192 Y195	Q156-H160 HydrophobicContact CB-CB 4.12Å; Q156-H160 HydrophobicContact CG-CB 4.29Å; T157-H160 PolarHBondContact N-ND1 3.36Å; T157-H160 WeakPolarHBondContact O-CA 3.5Å; T157-H160 WeakPolarHBondContact O-CB 3.45Å; T157-H160 PolarHBondContact O-N 3.27Å; T157-H160 PolarHBondContact OG1-ND1 2.89Å; H160-A162 PolarHBondContact O-N 3.4Å; H160-C163 PolarHBondContact O-N 3.27Å; H160-E164 WeakPolarHBondContact O-CB 3.41Å; H160-E164 PolarHBondContact O-N 3.42Å; H160-I184 PolarHBondContact CE1-O 3.34Å; H160-I184 PolarHBondContact NE2-O 2.83Å; H160-E190 PolarHBondContact NE2-O 3.28Å; H160-P192 VanDerWaalsContact NE2-CD 3.33Å; H160-P192 WeakPolarHBondContact NE2-CD 3.47Å; H160-Y195 HydrophobicContact CB-CD2 4.44Å; H160-Y195 AromaticContact CD2-CD2 3.61Å; H160-Y195 AromaticContact CD2-CE2 3.74Å
161	L	90.3	Very high	89.4	Confident	8 Å²	8	31.8 Å²	31.8	4%	0.042	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-42.7	176.9	-67.2	-176.1	0	0	0	111.8	W124 H128 V131 T157 P158 C163 E164 R165	W124-L161 HydrophobicContact CH2-CD1 4.14Å; W124-L161 HydrophobicContact CZ2-CD1 3.98Å; W124-L161 HydrophobicContact CZ2-CD2 4.36Å; H128-L161 HydrophobicContact CB-CD1 3.88Å; V131-L161 HydrophobicContact CG1-CB 4.16Å; T157-L161 PolarHBondContact O-N 3.08Å; P158-L161 PolarHBondContact O-N 2.77Å; L161-C163 VanDerWaalsContact C-N 3.29Å; L161-C163 PolarHBondContact O-N 3.01Å; L161-E164 PolarHBondContact O-N 3.23Å; L161-E164 VanDerWaalsContact O-N 3.16Å; L161-R165 WeakPolarHBondContact O-CG 3.18Å; L161-R165 PolarHBondContact O-N 2.99Å
162	A	90.7	Very high	89.2	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.3	-41.2	177.5	0	0	0	0	0	111.8	V131 P158 L159 H160 G166 D167 C170 V171 L174	V131-A162 HydrophobicContact CG1-CB 3.68Å; P158-A162 PolarHBondContact O-N 3.19Å; L159-A162 PolarHBondContact O-N 2.88Å; H160-A162 PolarHBondContact O-N 3.4Å; A162-G166 PolarHBondContact O-N 3.36Å; A162-D167 PolarHBondContact O-N 3Å; A162-C170 HydrophobicContact CB-CB 4.33Å; A162-V171 HydrophobicContact CB-CG2 3.69Å; A162-L174 HydrophobicContact CB-CD1 3.76Å
163	C	90.5	Very high	89.1	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69.6	-35.4	175.8	-64.1	0	0	0	0	112.6	L159 H160 L161 R165 A196 Q199 I204	L159-C163 PolarHBondContact O-N 2.9Å; L159-C163 PolarHBondContact O-SG 3.38Å; H160-C163 PolarHBondContact O-N 3.27Å; L161-C163 VanDerWaalsContact C-N 3.29Å; L161-C163 PolarHBondContact O-N 3.01Å; C163-R165 VanDerWaalsContact C-N 3.34Å; C163-A196 HydrophobicContact CB-CB 4.33Å; C163-Q199 WeakPolarHBondContact O-CG 3.3Å; C163-I204 HydrophobicContact CB-CG2 4.3Å
164	E	89.8	Confident	89.1	Confident	87 Å²	87	27.1 Å²	27.1	41%	0.407	15%	0.145	S	C	.	.	H	α-helix	trans	-66.6	-34.6	176.4	-171.8	163	-158.2	0	0	112.6	Q156 H160 L161 Y195 Q199	Q156-E164 PolarHBondContact NE2-OE2 3.29Å; H160-E164 WeakPolarHBondContact O-CB 3.41Å; H160-E164 PolarHBondContact O-N 3.42Å; L161-E164 PolarHBondContact O-N 3.23Å; L161-E164 VanDerWaalsContact O-N 3.16Å; E164-Y195 HydrophobicContact CB-CD1 3.83Å; E164-Y195 HydrophobicContact CB-CE1 4.41Å; E164-Y195 HydrophobicContact CG-CD1 4.1Å; E164-Y195 HydrophobicContact CG-CE1 4.38Å; E164-Y195 WeakPolarHBondContact OE2-CE1 3.44Å; E164-Q199 PolarHBondContact O-NE2 3.01Å
165	R	86.7	Confident	89	Confident	109 Å²	109	25.7 Å²	25.7	41%	0.411	14%	0.135	S	C	.	.	H	α-helix	trans	-82.8	-16.1	-178	-67	-177.8	85.9	-145.7	8.6	114.6	V131 E132 L161 C163	V131-R165 PolarHBondContact O-NH1 3.44Å; E132-R165 VanDerWaalsContact C-NH1 3.31Å; E132-R165 PolarHBondContact O-NH1 2.71Å; E132-R165 PolarHBondContact O-NH2 2.69Å; E132-R165 IonicContact OE1-CZ 2.74Å; E132-R165 IonicContact OE1-NE 3.2Å; E132-R165 IonicContact OE1-NH2 2.7Å; E132-R165 PolarHBondContact OE1-NH2 2.7Å; E132-R165 WeakPolarHBondContact OE2-CD 3.36Å; E132-R165 IonicContact OE2-NE 3.71Å; E132-R165 PolarHBondContact OE2-NE 3.34Å; L161-R165 WeakPolarHBondContact O-CG 3.18Å; L161-R165 PolarHBondContact O-N 2.99Å; C163-R165 VanDerWaalsContact C-N 3.34Å
166	G	87.4	Confident	88.7	Confident	35 Å²	35	28.7 Å²	28.7	36%	0.361	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	6.3	-174.1	0	0	0	0	0	114.5	A162 L168	A162-G166 PolarHBondContact O-N 3.36Å; G166-L168 PolarHBondContact O-N 2.93Å; G166-L168 VanDerWaalsContact O-N 3.13Å
167	D	88.1	Confident	88.2	Confident	43 Å²	43	34.1 Å²	34.1	23%	0.23	18%	0.175	C	C	.	.			trans	-84.7	92.2	-170.8	-170.6	-13.2	0	0	0	112.3	A162 A169 C170 V171	A162-D167 PolarHBondContact O-N 3Å; D167-A169 VanDerWaalsContact C-N 3.26Å; D167-A169 PolarHBondContact O-N 3.34Å; D167-A169 PolarHBondContact OD1-N 3.47Å; D167-C170 HydrophobicContact CB-CB 4.18Å; D167-C170 PolarHBondContact O-N 2.96Å; D167-C170 PolarHBondContact OD1-N 3.42Å; D167-C170 PolarHBondContact OD2-SG 3.3Å; D167-V171 WeakPolarHBondContact O-CG2 3.35Å; D167-V171 PolarHBondContact O-N 2.89Å
168	L	88.8	Confident	87.5	Confident	49 Å²	49	35 Å²	35	26%	0.257	18%	0.18	S	C	.	.	H	α-helix	trans	-57.7	-36.6	177.8	-178	63.2	0	0	0	113.3	G166 V171 K172 V203 A207	G166-L168 PolarHBondContact O-N 2.93Å; G166-L168 VanDerWaalsContact O-N 3.13Å; L168-V171 PolarHBondContact O-N 3.44Å; L168-K172 HydrophobicContact CD1-CD 4.36Å; L168-K172 HydrophobicContact CD1-CG 4.13Å; L168-K172 HydrophobicContact CG-CD 4.21Å; L168-K172 HydrophobicContact CG-CG 4.34Å; L168-K172 WeakPolarHBondContact O-CB 3.49Å; L168-K172 WeakPolarHBondContact O-CG 3.31Å; L168-K172 PolarHBondContact O-N 2.85Å; L168-V203 HydrophobicContact CD1-CG1 3.71Å; L168-V203 HydrophobicContact CD2-CG1 3.36Å; L168-V203 HydrophobicContact CG-CG1 4.01Å; L168-A207 HydrophobicContact CD1-CB 3.78Å
169	A	88.8	Confident	86.9	Confident	38 Å²	38	40.9 Å²	40.9	31%	0.314	21%	0.208	S	C	.	.	H	α-helix	trans	-69	-45.4	-175.1	0	0	0	0	0	110	D167 K172 E173	D167-A169 VanDerWaalsContact C-N 3.26Å; D167-A169 PolarHBondContact O-N 3.34Å; D167-A169 PolarHBondContact OD1-N 3.47Å; A169-K172 PolarHBondContact O-N 2.86Å; A169-E173 WeakPolarHBondContact O-CG 3.19Å; A169-E173 PolarHBondContact O-N 2.81Å
170	C	87.3	Confident	86.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-43	172.3	-73.3	0	0	0	0	111.8	A162 D167 K172 E173 L174	A162-C170 HydrophobicContact CB-CB 4.33Å; D167-C170 HydrophobicContact CB-CB 4.18Å; D167-C170 PolarHBondContact O-N 2.96Å; D167-C170 PolarHBondContact OD1-N 3.42Å; D167-C170 PolarHBondContact OD2-SG 3.3Å; C170-K172 PolarHBondContact O-N 2.97Å; C170-E173 PolarHBondContact O-N 3.47Å; C170-L174 WeakPolarHBondContact O-CB 3.46Å; C170-L174 WeakPolarHBondContact O-CG 3.37Å; C170-L174 PolarHBondContact O-N 2.89Å
171	V	88.6	Confident	86.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-46.3	177.9	171.3	0	0	0	0	111.4	L159 A162 D167 L168 L174 L175 I204 A207	L159-V171 HydrophobicContact CD1-CG1 4.46Å; A162-V171 HydrophobicContact CB-CG2 3.69Å; D167-V171 WeakPolarHBondContact O-CG2 3.35Å; D167-V171 PolarHBondContact O-N 2.89Å; L168-V171 PolarHBondContact O-N 3.44Å; V171-L174 PolarHBondContact O-N 3.48Å; V171-L175 HydrophobicContact CG1-CD1 3.61Å; V171-L175 HydrophobicContact CG1-CG 4.28Å; V171-L175 WeakPolarHBondContact O-CB 3.12Å; V171-L175 WeakPolarHBondContact O-CG 3.4Å; V171-L175 PolarHBondContact O-N 3.2Å; V171-I204 HydrophobicContact CG1-CG2 4.41Å; V171-I204 HydrophobicContact CG2-CG2 4.3Å; V171-A207 HydrophobicContact CG1-CB 4.44Å
172	K	88	Confident	86.2	Confident	105 Å²	105	48.4 Å²	48.4	46%	0.457	24%	0.241	S	C	.	.	H	α-helix	trans	-61.9	-45.9	178.2	-76.6	-176	178	-174.3	0	111.9	L168 A169 C170 L174 L175 D176	L168-K172 HydrophobicContact CD1-CD 4.36Å; L168-K172 HydrophobicContact CD1-CG 4.13Å; L168-K172 HydrophobicContact CG-CD 4.21Å; L168-K172 HydrophobicContact CG-CG 4.34Å; L168-K172 WeakPolarHBondContact O-CB 3.49Å; L168-K172 WeakPolarHBondContact O-CG 3.31Å; L168-K172 PolarHBondContact O-N 2.85Å; A169-K172 PolarHBondContact O-N 2.86Å; C170-K172 PolarHBondContact O-N 2.97Å; K172-L174 PolarHBondContact O-N 3.06Å; K172-L175 PolarHBondContact O-N 3.37Å; K172-D176 WeakPolarHBondContact O-CA 3.42Å; K172-D176 VanDerWaalsContact O-CB 3.22Å; K172-D176 WeakPolarHBondContact O-CB 3.42Å; K172-D176 PolarHBondContact O-N 2.97Å
173	E	87	Confident	85.9	Confident	30 Å²	30	51.5 Å²	51.5	14%	0.14	26%	0.257	C	S	.	.	H	α-helix	trans	-64.3	-41.1	178.2	-72.4	175.9	-169.3	0	0	112.6	R136 L139 A169 C170 L175 E177 S178	R136-E173 VanDerWaalsContact CA-OE2 3.31Å; R136-E173 WeakPolarHBondContact CA-OE2 3.3Å; R136-E173 WeakPolarHBondContact CB-OE1 3.35Å; R136-E173 WeakPolarHBondContact CB-OE2 3.34Å; R136-E173 VanDerWaalsContact CD-OE1 3.26Å; R136-E173 WeakPolarHBondContact CD-OE1 3.26Å; R136-E173 WeakPolarHBondContact CG-OE2 3.25Å; R136-E173 IonicContact CZ-OE1 3.89Å; R136-E173 IonicContact NE-OE1 3.56Å; R136-E173 IonicContact NH1-OE1 2.87Å; R136-E173 PolarHBondContact NH1-OE1 2.78Å; L139-E173 HydrophobicContact CD1-CB 4.47Å; A169-E173 WeakPolarHBondContact O-CG 3.19Å; A169-E173 PolarHBondContact O-N 2.81Å; C170-E173 PolarHBondContact O-N 3.47Å; E173-L175 VanDerWaalsContact C-N 3.31Å; E173-L175 PolarHBondContact O-N 2.92Å; E173-E177 WeakPolarHBondContact O-CB 3.38Å; E173-E177 PolarHBondContact O-N 2.84Å; E173-S178 PolarHBondContact O-N 3.45Å; E173-S178 VanDerWaalsContact O-N 3.11Å
174	L	86.5	Confident	85.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-38.6	176.5	-72.2	174.8	0	0	0	112.3	V131 L139 I148 L159 A162 C170 V171 K172 S178 Q179 A180	V131-L174 HydrophobicContact CG2-CD1 3.94Å; L139-L174 HydrophobicContact CD1-CD2 3.95Å; L139-L174 HydrophobicContact CD1-CG 4.16Å; L139-L174 HydrophobicContact CD2-CD2 4.03Å; I148-L174 HydrophobicContact CD1-CD2 3.25Å; I148-L174 HydrophobicContact CG1-CD2 3.84Å; L159-L174 HydrophobicContact CB-CD1 4.41Å; L159-L174 HydrophobicContact CD1-CB 4.14Å; L159-L174 HydrophobicContact CD1-CD1 4.03Å; A162-L174 HydrophobicContact CB-CD1 3.76Å; C170-L174 WeakPolarHBondContact O-CB 3.46Å; C170-L174 WeakPolarHBondContact O-CG 3.37Å; C170-L174 PolarHBondContact O-N 2.89Å; V171-L174 PolarHBondContact O-N 3.48Å; K172-L174 PolarHBondContact O-N 3.06Å; L174-S178 CarbonylContact O-C 3.59Å; L174-Q179 PolarHBondContact O-N 2.95Å; L174-A180 HydrophobicContact CB-CB 4.22Å; L174-A180 VanDerWaalsContact O-CB 3.31Å; L174-A180 WeakPolarHBondContact O-CB 3.47Å; L174-A180 PolarHBondContact O-N 3.26Å
175	L	85.5	Confident	85.9	Confident	8 Å²	8	52.4 Å²	52.4	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-80.1	-46.2	-179.9	-66.9	172.9	0	0	0	112.1	L159 V171 K172 E173 T182 L208 R211	L159-L175 HydrophobicContact CD1-CD2 4.34Å; L159-L175 HydrophobicContact CD1-CG 4.45Å; L159-L175 HydrophobicContact CD2-CD2 4.05Å; V171-L175 HydrophobicContact CG1-CD1 3.61Å; V171-L175 HydrophobicContact CG1-CG 4.28Å; V171-L175 WeakPolarHBondContact O-CB 3.12Å; V171-L175 WeakPolarHBondContact O-CG 3.4Å; V171-L175 PolarHBondContact O-N 3.2Å; K172-L175 PolarHBondContact O-N 3.37Å; E173-L175 VanDerWaalsContact C-N 3.31Å; E173-L175 PolarHBondContact O-N 2.92Å; L175-T182 HydrophobicContact CD2-CG2 3.69Å; L175-L208 HydrophobicContact CD1-CD2 3.8Å; L175-L208 HydrophobicContact CD1-CG 4.45Å; L175-L208 HydrophobicContact CD2-CD2 4.1Å; L175-R211 VanDerWaalsContact O-CZ 3.3Å; L175-R211 PolarHBondContact O-NH1 3.44Å
176	D	83.3	Confident	86.1	Confident	70 Å²	70	48 Å²	48	37%	0.374	24%	0.243	S	C	.	.	H	α-helix	trans	-80.5	-49.7	-169.9	-71.1	-38.8	0	0	0	113	K172 Q179 R211	K172-D176 WeakPolarHBondContact O-CA 3.42Å; K172-D176 VanDerWaalsContact O-CB 3.22Å; K172-D176 WeakPolarHBondContact O-CB 3.42Å; K172-D176 PolarHBondContact O-N 2.97Å; D176-Q179 PolarHBondContact O-NE2 3.49Å; D176-Q179 VanDerWaalsContact O-NE2 3.17Å; D176-R211 VanDerWaalsContact CA-NH2 3.3Å; D176-R211 IonicContact OD1-CZ 3.13Å; D176-R211 IonicContact OD1-NE 3.35Å; D176-R211 PolarHBondContact OD1-NE 2.96Å; D176-R211 IonicContact OD1-NH2 3.79Å; D176-R211 PolarHBondContact OD1-NH2 2.88Å
177	E	79.9	Confident	86.3	Confident	134 Å²	134	53 Å²	53	63%	0.626	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-43.9	-173	-58.4	-64.4	151.7	0	0	111.4	E173	E173-E177 WeakPolarHBondContact O-CB 3.38Å; E173-E177 PolarHBondContact O-N 2.84Å
178	S	76.3	Confident	86.4	Confident	17 Å²	17	57.3 Å²	57.3	12%	0.119	27%	0.273	C	S	.	.	S	Bend	trans	-94.8	-3	-172.1	-56.6	0	0	0	0	114.9	E173 L174 A180	E173-S178 PolarHBondContact O-N 3.45Å; E173-S178 VanDerWaalsContact O-N 3.11Å; L174-S178 CarbonylContact O-C 3.59Å; S178-A180 PolarHBondContact O-N 3.17Å
179	Q	80.4	Confident	86.5	Confident	124 Å²	124	55.4 Å²	55.4	58%	0.579	27%	0.266	S	S	*	.			trans	48.7	43.2	177.5	-58.7	-72.3	-39.1	0	0	113.1	L174 D176	L174-Q179 PolarHBondContact O-N 2.95Å; D176-Q179 PolarHBondContact O-NE2 3.49Å; D176-Q179 VanDerWaalsContact O-NE2 3.17Å
180	A	84.5	Confident	86.6	Confident	10 Å²	10	54.1 Å²	54.1	8%	0.083	25%	0.253	C	S	.	.			trans	-62.1	141.3	179.3	0	0	0	0	0	111.4	I148 L159 L174 S178	I148-A180 HydrophobicContact CG1-CB 4.17Å; L159-A180 HydrophobicContact CD2-CB 4.27Å; L174-A180 HydrophobicContact CB-CB 4.22Å; L174-A180 VanDerWaalsContact O-CB 3.31Å; L174-A180 WeakPolarHBondContact O-CB 3.47Å; L174-A180 PolarHBondContact O-N 3.26Å; S178-A180 PolarHBondContact O-N 3.17Å
181	R	85.8	Confident	86.8	Confident	132 Å²	132	54.1 Å²	54.1	50%	0.498	25%	0.253	S	S	.	.			trans	-76.6	129.7	-179.6	-77.9	-178	67.2	166.9	5	111.3	N149 D183 I184	N149-R181 WeakPolarHBondContact OD1-CB 3.47Å; N149-R181 PolarHBondContact OD1-N 3.12Å; R181-D183 WeakPolarHBondContact CB-OD1 3.42Å; R181-D183 IonicContact CZ-OD1 3.15Å; R181-D183 IonicContact CZ-OD2 3.68Å; R181-D183 IonicContact NE-OD1 2.87Å; R181-D183 PolarHBondContact NE-OD1 3.42Å; R181-D183 IonicContact NE-OD2 3.43Å; R181-D183 IonicContact NH2-OD1 2.9Å; R181-D183 PolarHBondContact NH2-OD1 2.95Å; R181-D183 IonicContact NH2-OD2 2.66Å; R181-D183 PolarHBondContact NH2-OD2 3.28Å; R181-I184 HydrophobicContact CB-CD1 3.71Å; R181-I184 HydrophobicContact CB-CG1 3.9Å
182	T	85.6	Confident	87	Confident	26 Å²	26	54.2 Å²	54.2	16%	0.16	25%	0.254	C	S	.	.	S	Bend	trans	-94.2	-6.2	-179.4	58.1	0	0	0	0	113.7	L159 L175 P192 L208	L159-T182 HydrophobicContact CD2-CG2 3.96Å; L175-T182 HydrophobicContact CD2-CG2 3.69Å; T182-P192 WeakPolarHBondContact O-CD 3.48Å; T182-L208 HydrophobicContact CG2-CD2 4.34Å
183	D	85.6	Confident	87.1	Confident	65 Å²	65	49.4 Å²	49.4	35%	0.348	23%	0.233	S	C	.	.			trans	-95.9	-9.7	-174.3	67.5	-38.6	0	0	0	113.9	R181	R181-D183 WeakPolarHBondContact CB-OD1 3.42Å; R181-D183 IonicContact CZ-OD1 3.15Å; R181-D183 IonicContact CZ-OD2 3.68Å; R181-D183 IonicContact NE-OD1 2.87Å; R181-D183 PolarHBondContact NE-OD1 3.42Å; R181-D183 IonicContact NE-OD2 3.43Å; R181-D183 IonicContact NH2-OD1 2.9Å; R181-D183 PolarHBondContact NH2-OD1 2.95Å; R181-D183 IonicContact NH2-OD2 2.66Å; R181-D183 PolarHBondContact NH2-OD2 3.28Å
184	I	88.4	Confident	87.4	Confident	19 Å²	19	48 Å²	48	10%	0.097	23%	0.226	C	C	.	.			trans	-68.9	134	-178.5	-58.9	176.2	0	0	0	109.5	N149 R151 T157 H160 R181	N149-I184 HydrophobicContact CB-CD1 3.76Å; R151-I184 HydrophobicContact CG-CG2 4.46Å; R151-I184 VanDerWaalsContact NE-CG2 3.31Å; T157-I184 HydrophobicContact CG2-CB 3.98Å; T157-I184 HydrophobicContact CG2-CD1 4Å; T157-I184 HydrophobicContact CG2-CG2 3.54Å; H160-I184 PolarHBondContact CE1-O 3.34Å; H160-I184 PolarHBondContact NE2-O 2.83Å; R181-I184 HydrophobicContact CB-CD1 3.71Å; R181-I184 HydrophobicContact CB-CG1 3.9Å
185	R	90.9	Very high	87.6	Confident	87 Å²	87	48.5 Å²	48.5	33%	0.328	23%	0.228	S	C	.	.			trans	-103.9	147.5	177.7	-57.4	-178.3	-167	-154.7	2.7	112.2	R151 E190 T191 E218 L219	R151-R185 PolarHBondContact NH2-O 3.48Å; R185-E190 CarbonylContact C-O 3.57Å; R185-E190 VanDerWaalsContact CA-O 3.31Å; R185-E190 WeakPolarHBondContact CA-O 3.46Å; R185-T191 HydrophobicContact CG-CG2 4.07Å; R185-E218 IonicContact CZ-OE2 3.44Å; R185-E218 IonicContact NH2-OE1 2.98Å; R185-E218 IonicContact NH2-OE2 3.5Å; R185-E218 PolarHBondContact NH2-OE2 3.18Å; R185-L219 PolarHBondContact NH1-O 3.26Å
186	D	92.1	Very high	87.8	Confident	15 Å²	15	48.1 Å²	48.1	8%	0.08	23%	0.226	C	C	.	.			trans	-78.2	-174.3	168.4	80.7	-13.1	0	0	0	112	G155 Q156 K188 G189 E190 Y195	G155-D186 WeakPolarHBondContact O-CA 3.37Å; Q156-D186 HydrophobicContact CG-CB 4.28Å; D186-K188 PolarHBondContact O-N 3.14Å; D186-K188 VanDerWaalsContact OD1-C 3.23Å; D186-K188 VanDerWaalsContact OD1-CA 3.27Å; D186-K188 WeakPolarHBondContact OD1-CA 3.29Å; D186-K188 WeakPolarHBondContact OD1-CB 3.28Å; D186-K188 PolarHBondContact OD1-N 3.09Å; D186-G189 PolarHBondContact O-N 2.8Å; D186-G189 PolarHBondContact OD1-N 2.85Å; D186-E190 PolarHBondContact N-O 3.43Å; D186-E190 WeakPolarHBondContact OD1-CB 3.38Å; D186-E190 PolarHBondContact OD1-N 3.26Å; D186-Y195 PolarHBondContact OD2-OH 2.81Å
187	Q	91.4	Very high	88.2	Confident	141 Å²	141	44.8 Å²	44.8	66%	0.659	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-23.7	175.7	-76.4	172.4	12.8	0	0	114.2	A153 S154 G189	A153-Q187 PolarHBondContact O-NE2 3.28Å; S154-Q187 VanDerWaalsContact O-CB 3.31Å; S154-Q187 WeakPolarHBondContact O-CB 3.46Å; S154-Q187 WeakPolarHBondContact O-CG 3.3Å; S154-Q187 PolarHBondContact O-N 3.38Å; Q187-G189 VanDerWaalsContact C-N 3.26Å
188	K	89.2	Confident	88.8	Confident	134 Å²	134	41 Å²	41	58%	0.583	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	4.3	174.9	-62.1	174.6	-175.4	167.1	0	112.1	D186 E190 S221	D186-K188 PolarHBondContact O-N 3.14Å; D186-K188 VanDerWaalsContact OD1-C 3.23Å; D186-K188 VanDerWaalsContact OD1-CA 3.27Å; D186-K188 WeakPolarHBondContact OD1-CA 3.29Å; D186-K188 WeakPolarHBondContact OD1-CB 3.28Å; D186-K188 PolarHBondContact OD1-N 3.09Å; K188-E190 HydrophobicContact CB-CG 4.08Å; K188-E190 PolarHBondContact O-N 2.88Å; K188-S221 WeakPolarHBondContact O-CB 3.39Å; K188-S221 PolarHBondContact O-N 3.32Å; K188-S221 PolarHBondContact O-OG 2.87Å
189	G	90.6	Very high	89.3	Confident	9 Å²	9	42.7 Å²	42.7	9%	0.093	20%	0.196	C	C	.	.			trans	73.6	8.7	-177.1	0	0	0	0	0	113.7	D186 Q187 N220	D186-G189 PolarHBondContact O-N 2.8Å; D186-G189 PolarHBondContact OD1-N 2.85Å; Q187-G189 VanDerWaalsContact C-N 3.26Å; G189-N220 WeakPolarHBondContact O-CA 3.46Å
190	E	92.1	Very high	89.4	Confident	10 Å²	10	43.2 Å²	43.2	5%	0.047	20%	0.199	C	C	.	.			trans	-77.7	136.6	-179.3	-64.3	-169.9	124.2	0	0	110.5	H160 R185 D186 K188 H194 Y195 K198 N220	H160-E190 PolarHBondContact NE2-O 3.28Å; R185-E190 CarbonylContact C-O 3.57Å; R185-E190 VanDerWaalsContact CA-O 3.31Å; R185-E190 WeakPolarHBondContact CA-O 3.46Å; D186-E190 PolarHBondContact N-O 3.43Å; D186-E190 WeakPolarHBondContact OD1-CB 3.38Å; D186-E190 PolarHBondContact OD1-N 3.26Å; K188-E190 HydrophobicContact CB-CG 4.08Å; K188-E190 PolarHBondContact O-N 2.88Å; E190-H194 HydrophobicContact CB-CB 3.93Å; E190-H194 HydrophobicContact CG-CB 4.27Å; E190-Y195 HydrophobicContact CB-CD2 4.24Å; E190-Y195 HydrophobicContact CB-CE2 3.84Å; E190-K198 WeakPolarHBondContact OE1-CE 3.24Å; E190-K198 IonicContact OE1-NZ 3.32Å; E190-K198 PolarHBondContact OE1-NZ 2.88Å; E190-K198 IonicContact OE2-NZ 3.01Å; E190-K198 PolarHBondContact OE2-NZ 3.37Å; E190-N220 HydrophobicContact CG-CB 3.99Å
191	T	91.9	Very high	89.4	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	21%	0.214	C	C	.	.			trans	-92.7	167.9	172.6	65	0	0	0	0	110.4	R185 M193 H194 Y195 E218	R185-T191 HydrophobicContact CG-CG2 4.07Å; T191-M193 PolarHBondContact O-N 2.63Å; T191-M193 VanDerWaalsContact O-N 3.09Å; T191-M193 PolarHBondContact OG1-N 2.6Å; T191-H194 PolarHBondContact N-ND1 2.96Å; T191-H194 VanDerWaalsContact N-ND1 3.14Å; T191-H194 WeakPolarHBondContact O-CB 3.38Å; T191-H194 PolarHBondContact O-N 2.89Å; T191-H194 PolarHBondContact OG1-ND1 3.32Å; T191-Y195 PolarHBondContact O-N 3.18Å; T191-E218 HydrophobicContact CG2-CB 4.25Å
192	P	91.1	Very high	89.6	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-55.4	-31.1	173.2	-25.8	35.7	0	0	0	112.7	L159 H160 T182 H194 Y195 A196	L159-P192 HydrophobicContact CD2-CB 4.12Å; L159-P192 HydrophobicContact CD2-CG 3.96Å; L159-P192 HydrophobicContact CG-CB 4Å; L159-P192 HydrophobicContact CG-CG 4.12Å; H160-P192 VanDerWaalsContact NE2-CD 3.33Å; H160-P192 WeakPolarHBondContact NE2-CD 3.47Å; T182-P192 WeakPolarHBondContact O-CD 3.48Å; P192-H194 VanDerWaalsContact C-N 3.34Å; P192-H194 PolarHBondContact O-N 3.49Å; P192-Y195 PolarHBondContact O-N 3Å; P192-A196 PolarHBondContact O-N 3.44Å
193	M	91.3	Very high	89.8	Confident	5 Å²	5	41.9 Å²	41.9	3%	0.025	21%	0.207	C	C	.	.	H	α-helix	trans	-62.7	-37.1	174.6	-161.7	82.2	-95.6	0	0	112.9	T191 A196 S197 I205 L208 V216 P226 L242	T191-M193 PolarHBondContact O-N 2.63Å; T191-M193 VanDerWaalsContact O-N 3.09Å; T191-M193 PolarHBondContact OG1-N 2.6Å; M193-A196 HydrophobicContact CE-CB 3.96Å; M193-A196 PolarHBondContact O-N 3.41Å; M193-S197 WeakPolarHBondContact O-CB 3.43Å; M193-S197 PolarHBondContact O-N 2.92Å; M193-S197 PolarHBondContact O-OG 3.41Å; M193-I205 HydrophobicContact CE-CB 3.9Å; M193-I205 HydrophobicContact CE-CG1 3.78Å; M193-I205 HydrophobicContact CE-CG2 3.71Å; M193-L208 HydrophobicContact CE-CB 3.85Å; M193-L208 HydrophobicContact CE-CD1 3.5Å; M193-L208 HydrophobicContact CE-CG 4.33Å; M193-L208 HydrophobicContact SD-CB 4.08Å; M193-L208 HydrophobicContact SD-CD1 4.23Å; M193-V216 HydrophobicContact SD-CG2 4.05Å; M193-P226 HydrophobicContact CB-CB 4.4Å; M193-P226 HydrophobicContact CB-CG 3.91Å; M193-P226 HydrophobicContact CG-CB 3.83Å; M193-P226 HydrophobicContact CG-CG 3.68Å; M193-L242 HydrophobicContact CE-CD2 4.11Å; M193-L242 HydrophobicContact CG-CD2 4.19Å; M193-L242 HydrophobicContact SD-CD2 4.31Å
194	H	92	Very high	89.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.2	-41.6	174.7	-70.2	82.2	0	0	0	111	E190 T191 P192 S197 K198 E218 E224	E190-H194 HydrophobicContact CB-CB 3.93Å; E190-H194 HydrophobicContact CG-CB 4.27Å; T191-H194 PolarHBondContact N-ND1 2.96Å; T191-H194 VanDerWaalsContact N-ND1 3.14Å; T191-H194 WeakPolarHBondContact O-CB 3.38Å; T191-H194 PolarHBondContact O-N 2.89Å; T191-H194 PolarHBondContact OG1-ND1 3.32Å; P192-H194 VanDerWaalsContact C-N 3.34Å; P192-H194 PolarHBondContact O-N 3.49Å; H194-S197 WeakPolarHBondContact O-CB 3.49Å; H194-S197 PolarHBondContact O-N 2.77Å; H194-K198 WeakPolarHBondContact O-CG 3.28Å; H194-K198 PolarHBondContact O-N 3.08Å; H194-E218 PolarHBondContact CE1-O 2.87Å; H194-E218 PolarHBondContact NE2-O 3.39Å; H194-E224 PolarHBondContact NE2-O 3.42Å
195	Y	91.1	Very high	90	Very high	10 Å²	10	38 Å²	38	4%	0.039	19%	0.186	C	C	.	.	H	α-helix	trans	-65	-43.7	176.3	-83.1	-95.7	0	0	0	112.2	Q156 H160 E164 D186 E190 T191 P192 S197 K198	Q156-Y195 VanDerWaalsContact NE2-CE1 3.28Å; Q156-Y195 PolarHBondContact NE2-OH 3.04Å; H160-Y195 HydrophobicContact CB-CD2 4.44Å; H160-Y195 AromaticContact CD2-CD2 3.61Å; H160-Y195 AromaticContact CD2-CE2 3.74Å; E164-Y195 HydrophobicContact CB-CD1 3.83Å; E164-Y195 HydrophobicContact CB-CE1 4.41Å; E164-Y195 HydrophobicContact CG-CD1 4.1Å; E164-Y195 HydrophobicContact CG-CE1 4.38Å; E164-Y195 WeakPolarHBondContact OE2-CE1 3.44Å; D186-Y195 PolarHBondContact OD2-OH 2.81Å; E190-Y195 HydrophobicContact CB-CD2 4.24Å; E190-Y195 HydrophobicContact CB-CE2 3.84Å; T191-Y195 PolarHBondContact O-N 3.18Å; P192-Y195 PolarHBondContact O-N 3Å; Y195-S197 PolarHBondContact O-N 3.17Å; Y195-K198 WeakPolarHBondContact O-CB 3.29Å; Y195-K198 PolarHBondContact O-N 3.07Å; Y195-K198 VanDerWaalsContact O-N 3.16Å
196	A	91.2	Very high	89.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-36.8	173.1	0	0	0	0	0	111.9	C163 P192 M193 K198 Q199 I204 I205 L208	C163-A196 HydrophobicContact CB-CB 4.33Å; P192-A196 PolarHBondContact O-N 3.44Å; M193-A196 HydrophobicContact CE-CB 3.96Å; M193-A196 PolarHBondContact O-N 3.41Å; A196-K198 VanDerWaalsContact C-N 3.27Å; A196-K198 PolarHBondContact O-N 3.39Å; A196-Q199 VanDerWaalsContact O-CB 3.32Å; A196-Q199 WeakPolarHBondContact O-CB 3.43Å; A196-Q199 PolarHBondContact O-N 3.38Å; A196-Q199 VanDerWaalsContact O-N 3.13Å; A196-I204 HydrophobicContact CB-CB 4.29Å; A196-I204 HydrophobicContact CB-CG2 3.59Å; A196-I205 HydrophobicContact CB-CG1 3.86Å; A196-L208 HydrophobicContact CB-CD1 3.72Å
197	S	91.4	Very high	89.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-70.8	-19.2	179.3	-57.7	0	0	0	0	114.2	M193 H194 Y195 Q199 P226	M193-S197 WeakPolarHBondContact O-CB 3.43Å; M193-S197 PolarHBondContact O-N 2.92Å; M193-S197 PolarHBondContact O-OG 3.41Å; H194-S197 WeakPolarHBondContact O-CB 3.49Å; H194-S197 PolarHBondContact O-N 2.77Å; Y195-S197 PolarHBondContact O-N 3.17Å; S197-Q199 VanDerWaalsContact C-N 3.27Å; S197-P226 WeakPolarHBondContact CB-O 3.44Å; S197-P226 VanDerWaalsContact OG-CB 3.3Å; S197-P226 WeakPolarHBondContact OG-CB 3.32Å
198	K	90.9	Very high	89.4	Confident	55 Å²	55	31.6 Å²	31.6	24%	0.239	16%	0.161	C	C	.	.	H	α-helix	trans	-74	-23.5	172.4	-65	170.9	-173.2	170.6	0	112	E190 H194 Y195 A196 V229 L233 R235	E190-K198 WeakPolarHBondContact OE1-CE 3.24Å; E190-K198 IonicContact OE1-NZ 3.32Å; E190-K198 PolarHBondContact OE1-NZ 2.88Å; E190-K198 IonicContact OE2-NZ 3.01Å; E190-K198 PolarHBondContact OE2-NZ 3.37Å; H194-K198 WeakPolarHBondContact O-CG 3.28Å; H194-K198 PolarHBondContact O-N 3.08Å; Y195-K198 WeakPolarHBondContact O-CB 3.29Å; Y195-K198 PolarHBondContact O-N 3.07Å; Y195-K198 VanDerWaalsContact O-N 3.16Å; A196-K198 VanDerWaalsContact C-N 3.27Å; A196-K198 PolarHBondContact O-N 3.39Å; K198-V229 HydrophobicContact CG-CG1 3.8Å; K198-L233 HydrophobicContact CB-CD1 4Å; K198-L233 HydrophobicContact CG-CD1 3.85Å; K198-R235 PolarHBondContact O-NE 3.25Å
199	Q	88	Confident	89.1	Confident	52 Å²	52	26.7 Å²	26.7	24%	0.243	14%	0.144	C	C	.	.	S	Bend	trans	-74.2	156.2	179.3	-57	-56.1	-35.1	0	0	111.7	C163 E164 A196 S197 S238	C163-Q199 WeakPolarHBondContact O-CG 3.3Å; E164-Q199 PolarHBondContact O-NE2 3.01Å; A196-Q199 VanDerWaalsContact O-CB 3.32Å; A196-Q199 WeakPolarHBondContact O-CB 3.43Å; A196-Q199 PolarHBondContact O-N 3.38Å; A196-Q199 VanDerWaalsContact O-N 3.13Å; S197-Q199 VanDerWaalsContact C-N 3.27Å; Q199-S238 PolarHBondContact O-OG 3.42Å
200	E	81.9	Confident	88.6	Confident	136 Å²	136	30.6 Å²	30.6	64%	0.636	17%	0.169	S	C	*	.	S	Bend	trans	-83.2	-27	173.7	-168.6	162.5	179	0	0	112.4	R235	E200-R235 IonicContact OE2-NH1 3.69Å; E200-R235 PolarHBondContact OE2-NH1 2.92Å
201	S	85.3	Confident	87.6	Confident	57 Å²	57	34.3 Å²	34.3	40%	0.399	18%	0.183	S	C	.	.			trans	-82.7	122.6	-179.7	-179	0	0	0	0	111.5	V203	S201-V203 PolarHBondContact O-N 3.47Å; S201-V203 WeakPolarHBondContact OG-CG2 3.36Å; S201-V203 PolarHBondContact OG-N 3.01Å
202	P	89.1	Confident	86	Confident	27 Å²	27	42.9 Å²	42.9	18%	0.175	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-9.9	177.7	30.8	-35.7	0	0	0	112.9	I204 I205 Q206 E237 A241	P202-I204 VanDerWaalsContact C-N 3.33Å; P202-I204 PolarHBondContact O-N 3.01Å; P202-I205 WeakPolarHBondContact O-CA 3.44Å; P202-I205 WeakPolarHBondContact O-CB 3.33Å; P202-I205 PolarHBondContact O-N 3.04Å; P202-Q206 WeakPolarHBondContact O-CG 3.33Å; P202-Q206 PolarHBondContact O-N 3.49Å; P202-E237 HydrophobicContact CB-CB 4.39Å; P202-E237 HydrophobicContact CG-CB 4.14Å; P202-A241 HydrophobicContact CB-CB 3.62Å
203	V	89.9	Confident	84.6	Confident	56 Å²	56	43.8 Å²	43.8	34%	0.339	23%	0.234	S	C	.	.	H	α-helix	trans	-65.2	-36.2	-167.9	-178.1	0	0	0	0	112.1	L168 S201 I205 A207	L168-V203 HydrophobicContact CD1-CG1 3.71Å; L168-V203 HydrophobicContact CD2-CG1 3.36Å; L168-V203 HydrophobicContact CG-CG1 4.01Å; S201-V203 PolarHBondContact O-N 3.47Å; S201-V203 WeakPolarHBondContact OG-CG2 3.36Å; S201-V203 PolarHBondContact OG-N 3.01Å; V203-I205 VanDerWaalsContact C-N 3.34Å; V203-A207 WeakPolarHBondContact O-CB 3.19Å; V203-A207 PolarHBondContact O-N 3.12Å
204	I	88.7	Confident	83.4	Confident	2 Å²	2	47 Å²	47	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-67.2	-39.7	173.7	-66.1	167.5	0	0	0	110.6	C163 V171 A196 P202 A207 L208	C163-I204 HydrophobicContact CB-CG2 4.3Å; V171-I204 HydrophobicContact CG1-CG2 4.41Å; V171-I204 HydrophobicContact CG2-CG2 4.3Å; A196-I204 HydrophobicContact CB-CB 4.29Å; A196-I204 HydrophobicContact CB-CG2 3.59Å; P202-I204 VanDerWaalsContact C-N 3.33Å; P202-I204 PolarHBondContact O-N 3.01Å; I204-A207 PolarHBondContact O-N 3.2Å; I204-L208 HydrophobicContact CG2-CD1 3.84Å; I204-L208 HydrophobicContact CG2-CG 4.34Å; I204-L208 WeakPolarHBondContact O-CG 3.31Å; I204-L208 PolarHBondContact O-N 2.84Å
205	I	89.3	Confident	82.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-45.4	-179.8	-63	171.9	0	0	0	109.9	M193 A196 P202 V203 A207 L208 C209 S238 A241 L242	M193-I205 HydrophobicContact CE-CB 3.9Å; M193-I205 HydrophobicContact CE-CG1 3.78Å; M193-I205 HydrophobicContact CE-CG2 3.71Å; A196-I205 HydrophobicContact CB-CG1 3.86Å; P202-I205 WeakPolarHBondContact O-CA 3.44Å; P202-I205 WeakPolarHBondContact O-CB 3.33Å; P202-I205 PolarHBondContact O-N 3.04Å; V203-I205 VanDerWaalsContact C-N 3.34Å; I205-A207 VanDerWaalsContact C-N 3.34Å; I205-A207 PolarHBondContact O-N 3.29Å; I205-L208 PolarHBondContact O-N 3.26Å; I205-C209 WeakPolarHBondContact O-CB 3.4Å; I205-C209 PolarHBondContact O-N 3.46Å; I205-C209 PolarHBondContact O-SG 3.08Å; I205-S238 VanDerWaalsContact CD1-CB 3.49Å; I205-A241 HydrophobicContact CB-CB 4.11Å; I205-A241 HydrophobicContact CG2-CB 3.78Å; I205-L242 HydrophobicContact CD1-CG 4.2Å; I205-L242 HydrophobicContact CG2-CD2 3.74Å; I205-L242 HydrophobicContact CG2-CG 3.94Å
206	Q	89.3	Confident	82.1	Confident	95 Å²	95	47.1 Å²	47.1	44%	0.444	26%	0.26	S	S	.	.	H	α-helix	trans	-60.9	-41.9	175.4	-69.2	173.3	-9	0	0	112.1	P202 C209 S210 A241	P202-Q206 WeakPolarHBondContact O-CG 3.33Å; P202-Q206 PolarHBondContact O-N 3.49Å; Q206-C209 PolarHBondContact O-N 2.91Å; Q206-S210 WeakPolarHBondContact O-CB 3.26Å; Q206-S210 PolarHBondContact O-N 3.46Å; Q206-A241 HydrophobicContact CG-CB 4.25Å
207	A	86.8	Confident	82	Confident	12 Å²	12	49.5 Å²	49.5	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-43.5	175.7	0	0	0	0	0	111.7	L168 V171 V203 I204 I205 S210	L168-A207 HydrophobicContact CD1-CB 3.78Å; V171-A207 HydrophobicContact CG1-CB 4.44Å; V203-A207 WeakPolarHBondContact O-CB 3.19Å; V203-A207 PolarHBondContact O-N 3.12Å; I204-A207 PolarHBondContact O-N 3.2Å; I205-A207 VanDerWaalsContact C-N 3.34Å; I205-A207 PolarHBondContact O-N 3.29Å; A207-S210 PolarHBondContact O-N 3.39Å; A207-S210 PolarHBondContact O-OG 3.42Å
208	L	85.9	Confident	81.9	Confident	1 Å²	1	53 Å²	53	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-46.4	175.6	-72	167.7	0	0	0	111.3	L175 T182 M193 A196 I204 I205 S210 R211 C213	L175-L208 HydrophobicContact CD1-CD2 3.8Å; L175-L208 HydrophobicContact CD1-CG 4.45Å; L175-L208 HydrophobicContact CD2-CD2 4.1Å; T182-L208 HydrophobicContact CG2-CD2 4.34Å; M193-L208 HydrophobicContact CE-CB 3.85Å; M193-L208 HydrophobicContact CE-CD1 3.5Å; M193-L208 HydrophobicContact CE-CG 4.33Å; M193-L208 HydrophobicContact SD-CB 4.08Å; M193-L208 HydrophobicContact SD-CD1 4.23Å; A196-L208 HydrophobicContact CB-CD1 3.72Å; I204-L208 HydrophobicContact CG2-CD1 3.84Å; I204-L208 HydrophobicContact CG2-CG 4.34Å; I204-L208 WeakPolarHBondContact O-CG 3.31Å; I204-L208 PolarHBondContact O-N 2.84Å; I205-L208 PolarHBondContact O-N 3.26Å; L208-S210 VanDerWaalsContact C-N 3.26Å; L208-S210 PolarHBondContact O-N 2.98Å; L208-R211 CarbonylContact O-C 3.39Å; L208-R211 PolarHBondContact O-N 2.84Å; L208-C213 PolarHBondContact O-SG 2.64Å
209	C	83.6	Confident	82	Confident	31 Å²	31	53.2 Å²	53.2	21%	0.209	29%	0.292	C	S	.	.	H	α-helix	trans	-65.3	-26.4	179.9	-70.1	0	0	0	0	113.4	I205 Q206 R211	I205-C209 WeakPolarHBondContact O-CB 3.4Å; I205-C209 PolarHBondContact O-N 3.46Å; I205-C209 PolarHBondContact O-SG 3.08Å; Q206-C209 PolarHBondContact O-N 2.91Å; C209-R211 PolarHBondContact O-N 3.38Å
210	S	79.5	Confident	82.1	Confident	91 Å²	91	51.2 Å²	51.2	64%	0.636	28%	0.283	S	S	*	.	H	α-helix	trans	-61.6	-25.3	177.1	76.6	0	0	0	0	113.6	Q206 A207 L208	Q206-S210 WeakPolarHBondContact O-CB 3.26Å; Q206-S210 PolarHBondContact O-N 3.46Å; A207-S210 PolarHBondContact O-N 3.39Å; A207-S210 PolarHBondContact O-OG 3.42Å; L208-S210 VanDerWaalsContact C-N 3.26Å; L208-S210 PolarHBondContact O-N 2.98Å
211	R	71	Confident	82.6	Confident	89 Å²	89	48.8 Å²	48.8	34%	0.336	28%	0.281	S	S	.	.	S	Bend	trans	-111.5	104.8	169.8	-69.1	-158.2	173.9	-153.7	-5.8	108.5	L175 D176 L208 C209 C213	L175-R211 VanDerWaalsContact O-CZ 3.3Å; L175-R211 PolarHBondContact O-NH1 3.44Å; D176-R211 VanDerWaalsContact CA-NH2 3.3Å; D176-R211 IonicContact OD1-CZ 3.13Å; D176-R211 IonicContact OD1-NE 3.35Å; D176-R211 PolarHBondContact OD1-NE 2.96Å; D176-R211 IonicContact OD1-NH2 3.79Å; D176-R211 PolarHBondContact OD1-NH2 2.88Å; L208-R211 CarbonylContact O-C 3.39Å; L208-R211 PolarHBondContact O-N 2.84Å; C209-R211 PolarHBondContact O-N 3.38Å; R211-C213 VanDerWaalsContact C-N 3.29Å; R211-C213 WeakPolarHBondContact O-CA 3.37Å; R211-C213 PolarHBondContact O-N 3.13Å; R211-C213 PolarHBondContact O-SG 2.84Å
212	L	58.3	Low	82.8	Confident	180 Å²	180	51.2 Å²	51.2	94%	0.942	29%	0.29	S	S	*	.			trans	-11.4	80.6	171.8	-78.5	151.1	0	0	0	113.7	S214	L212-S214 PolarHBondContact O-N 2.82Å
213	C	62.5	Low	82.8	Confident	21 Å²	21	50.8 Å²	50.8	14%	0.142	29%	0.29	C	S	.	.			trans	-87.4	114.7	-172.4	-98.7	0	0	0	0	108.1	L208 R211 G215 V216	L208-C213 PolarHBondContact O-SG 2.64Å; R211-C213 VanDerWaalsContact C-N 3.29Å; R211-C213 WeakPolarHBondContact O-CA 3.37Å; R211-C213 PolarHBondContact O-N 3.13Å; R211-C213 PolarHBondContact O-SG 2.84Å; C213-G215 PolarHBondContact O-N 3.18Å; C213-V216 HydrophobicContact CB-CG2 4.13Å
214	S	66.1	Low	83	Confident	73 Å²	73	48.8 Å²	48.8	51%	0.51	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-64.5	-19	177.3	51.7	0	0	0	0	113.5	L212	L212-S214 PolarHBondContact O-N 2.82Å
215	G	72.4	Confident	83.2	Confident	3 Å²	3	48.7 Å²	48.7	3%	0.031	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-85.3	-0.5	-171.6	0	0	0	0	0	117.2	C213 N217 E218 P226	C213-G215 PolarHBondContact O-N 3.18Å; G215-N217 VanDerWaalsContact C-N 3.28Å; G215-N217 PolarHBondContact O-N 3.02Å; G215-E218 PolarHBondContact O-N 3.47Å; G215-P226 WeakPolarHBondContact O-CG 3.13Å
216	V	83.9	Confident	83.4	Confident	9 Å²	9	48.7 Å²	48.7	6%	0.055	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-65.8	-30	-171.8	-177.7	0	0	0	0	112.9	M193 C213 P226 A247	M193-V216 HydrophobicContact SD-CG2 4.05Å; C213-V216 HydrophobicContact CB-CG2 4.13Å; V216-P226 WeakPolarHBondContact O-CD 3.42Å; V216-A247 HydrophobicContact CG1-CB 3.53Å
217	N	88.5	Confident	83.6	Confident	49 Å²	49	44.2 Å²	44.2	26%	0.262	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-115.4	10.8	-178.9	-59.9	-52.1	0	0	0	112.9	G215 K248	G215-N217 VanDerWaalsContact C-N 3.28Å; G215-N217 PolarHBondContact O-N 3.02Å; N217-K248 WeakPolarHBondContact OD1-CB 3.3Å; N217-K248 PolarHBondContact OD1-N 3.2Å
218	E	89.5	Confident	84	Confident	74 Å²	74	43.6 Å²	43.6	35%	0.346	25%	0.251	S	S	.	.			trans	-75.3	142.7	-179.1	-73.6	-64.8	174.6	0	0	111.5	R185 T191 H194 G215 T225 P226	R185-E218 IonicContact CZ-OE2 3.44Å; R185-E218 IonicContact NH2-OE1 2.98Å; R185-E218 IonicContact NH2-OE2 3.5Å; R185-E218 PolarHBondContact NH2-OE2 3.18Å; T191-E218 HydrophobicContact CG2-CB 4.25Å; H194-E218 PolarHBondContact CE1-O 2.87Å; H194-E218 PolarHBondContact NE2-O 3.39Å; G215-E218 PolarHBondContact O-N 3.47Å; E218-T225 WeakPolarHBondContact O-CA 3.22Å; E218-P226 WeakPolarHBondContact O-CD 3.03Å
219	L	91.6	Very high	84.3	Confident	60 Å²	60	43.6 Å²	43.6	31%	0.314	25%	0.251	S	S	.	.			trans	-93.3	133.2	179.2	-63.8	170.6	0	0	0	110.8	R185 E224 T225 T251	R185-L219 PolarHBondContact NH1-O 3.26Å; L219-E224 WeakPolarHBondContact CA-O 3.43Å; L219-T225 HydrophobicContact CD2-CG2 3.47Å; L219-T225 VanDerWaalsContact CD2-CG2 3.47Å; L219-T225 HydrophobicContact CG-CG2 4.39Å; L219-T251 HydrophobicContact CD2-CG2 4.49Å
220	N	92	Very high	84.8	Confident	9 Å²	9	42.1 Å²	42.1	5%	0.048	24%	0.241	C	C	.	.			trans	-76.8	179.6	167.6	72	9.8	0	0	0	111.9	G189 E190 N222 G223 E224	G189-N220 WeakPolarHBondContact O-CA 3.46Å; E190-N220 HydrophobicContact CG-CB 3.99Å; N220-N222 PolarHBondContact O-N 3.22Å; N220-N222 VanDerWaalsContact O-N 3.13Å; N220-N222 WeakPolarHBondContact OD1-CA 3.48Å; N220-N222 WeakPolarHBondContact OD1-CB 3.44Å; N220-N222 PolarHBondContact OD1-N 2.98Å; N220-G223 PolarHBondContact O-N 2.91Å; N220-G223 PolarHBondContact OD1-N 3.4Å; N220-E224 PolarHBondContact N-O 3.05Å; N220-E224 WeakPolarHBondContact OD1-CB 3.49Å; N220-E224 PolarHBondContact OD1-N 3.26Å; N220-E224 PolarHBondContact OD1-O 3.3Å
221	S	91.9	Very high	85.6	Confident	86 Å²	86	37.8 Å²	37.8	60%	0.601	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-17.3	179.9	-61.9	0	0	0	0	114	K188 G223	K188-S221 WeakPolarHBondContact O-CB 3.39Å; K188-S221 PolarHBondContact O-N 3.32Å; K188-S221 PolarHBondContact O-OG 2.87Å; S221-G223 VanDerWaalsContact C-N 3.31Å
222	N	88.1	Confident	86.6	Confident	108 Å²	108	36.5 Å²	36.5	58%	0.578	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	1.4	173.3	-62	-20.1	0	0	0	112.7	N220 E224 S254	N220-N222 PolarHBondContact O-N 3.22Å; N220-N222 VanDerWaalsContact O-N 3.13Å; N220-N222 WeakPolarHBondContact OD1-CA 3.48Å; N220-N222 WeakPolarHBondContact OD1-CB 3.44Å; N220-N222 PolarHBondContact OD1-N 2.98Å; N222-E224 VanDerWaalsContact C-N 3.33Å; N222-E224 HydrophobicContact CB-CG 4.13Å; N222-S254 WeakPolarHBondContact O-CB 3.39Å; N222-S254 PolarHBondContact O-OG 2.78Å
223	G	90.8	Very high	88.3	Confident	18 Å²	18	31.2 Å²	31.2	19%	0.186	18%	0.178	C	C	.	.	S	Bend	trans	66.9	33	-173.5	0	0	0	0	0	112.7	N220 S221 G253 S254	N220-G223 PolarHBondContact O-N 2.91Å; N220-G223 PolarHBondContact OD1-N 3.4Å; S221-G223 VanDerWaalsContact C-N 3.31Å; G223-G253 CarbonylContact O-C 3.43Å; G223-G253 WeakPolarHBondContact O-CA 3.3Å; G223-S254 PolarHBondContact O-N 3.15Å
224	E	92.4	Very high	89.8	Confident	14 Å²	14	31.1 Å²	31.1	7%	0.065	18%	0.181	C	C	.	.			trans	-105.6	138	175.4	-60.9	-176.9	139	0	0	109.5	H194 L219 N220 N222 H228 V229 R232	H194-E224 PolarHBondContact NE2-O 3.42Å; L219-E224 WeakPolarHBondContact CA-O 3.43Å; N220-E224 PolarHBondContact N-O 3.05Å; N220-E224 WeakPolarHBondContact OD1-CB 3.49Å; N220-E224 PolarHBondContact OD1-N 3.26Å; N220-E224 PolarHBondContact OD1-O 3.3Å; N222-E224 VanDerWaalsContact C-N 3.33Å; N222-E224 HydrophobicContact CB-CG 4.13Å; E224-H228 HydrophobicContact CB-CB 3.83Å; E224-H228 HydrophobicContact CG-CB 4.29Å; E224-V229 HydrophobicContact CB-CG2 4.08Å; E224-R232 WeakPolarHBondContact OE1-CD 3.18Å; E224-R232 IonicContact OE1-CZ 2.97Å; E224-R232 IonicContact OE1-NE 2.94Å; E224-R232 PolarHBondContact OE1-NE 3.15Å; E224-R232 IonicContact OE1-NH2 3.67Å; E224-R232 IonicContact OE2-CZ 3.09Å; E224-R232 IonicContact OE2-NE 3.67Å; E224-R232 PolarHBondContact OE2-NE 2.78Å; E224-R232 IonicContact OE2-NH2 3.77Å; E224-R232 PolarHBondContact OE2-NH2 2.87Å
225	T	93.8	Very high	91.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.171	C	C	.	.			trans	-84.6	167.7	164.3	73.5	0	0	0	0	110.3	E218 L219 L227 H228 V229 T251	E218-T225 WeakPolarHBondContact O-CA 3.22Å; L219-T225 HydrophobicContact CD2-CG2 3.47Å; L219-T225 VanDerWaalsContact CD2-CG2 3.47Å; L219-T225 HydrophobicContact CG-CG2 4.39Å; T225-L227 PolarHBondContact O-N 3.47Å; T225-L227 VanDerWaalsContact O-N 3.15Å; T225-L227 PolarHBondContact OG1-N 2.99Å; T225-H228 PolarHBondContact N-ND1 2.9Å; T225-H228 VanDerWaalsContact N-ND1 3.18Å; T225-H228 WeakPolarHBondContact O-CA 3.4Å; T225-H228 WeakPolarHBondContact O-CB 3.43Å; T225-H228 PolarHBondContact O-N 3.03Å; T225-H228 PolarHBondContact OG1-N 3.29Å; T225-H228 PolarHBondContact OG1-ND1 2.83Å; T225-V229 PolarHBondContact O-N 3.07Å; T225-T251 HydrophobicContact CG2-CG2 3.54Å
226	P	93.4	Very high	92.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-51.1	-37.8	171.5	-27.6	35	0	0	0	113	M193 S197 G215 V216 E218 V229 A230 L242	M193-P226 HydrophobicContact CB-CB 4.4Å; M193-P226 HydrophobicContact CB-CG 3.91Å; M193-P226 HydrophobicContact CG-CB 3.83Å; M193-P226 HydrophobicContact CG-CG 3.68Å; S197-P226 WeakPolarHBondContact CB-O 3.44Å; S197-P226 VanDerWaalsContact OG-CB 3.3Å; S197-P226 WeakPolarHBondContact OG-CB 3.32Å; G215-P226 WeakPolarHBondContact O-CG 3.13Å; V216-P226 WeakPolarHBondContact O-CD 3.42Å; E218-P226 WeakPolarHBondContact O-CD 3.03Å; P226-V229 PolarHBondContact O-N 2.92Å; P226-A230 PolarHBondContact O-N 2.79Å; P226-L242 HydrophobicContact CB-CD1 4.35Å; P226-L242 HydrophobicContact CB-CD2 4.15Å
227	L	94.1	Very high	92.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-41	175.6	-171.3	59.8	0	0	0	112.2	T225 V229 A230 C231 V239 L242 L243 A247 P258	T225-L227 PolarHBondContact O-N 3.47Å; T225-L227 VanDerWaalsContact O-N 3.15Å; T225-L227 PolarHBondContact OG1-N 2.99Å; L227-V229 VanDerWaalsContact C-N 3.34Å; L227-V229 PolarHBondContact O-N 3.41Å; L227-A230 PolarHBondContact O-N 3.47Å; L227-C231 WeakPolarHBondContact O-CB 3.46Å; L227-C231 PolarHBondContact O-N 2.67Å; L227-C231 PolarHBondContact O-SG 2.81Å; L227-V239 HydrophobicContact CD1-CB 4.31Å; L227-V239 HydrophobicContact CD1-CG1 3.96Å; L227-V239 HydrophobicContact CD1-CG2 4.22Å; L227-L242 HydrophobicContact CB-CD1 4.4Å; L227-L242 HydrophobicContact CD1-CB 4.21Å; L227-L242 HydrophobicContact CD1-CD1 4.21Å; L227-L243 HydrophobicContact CD1-CD2 4.39Å; L227-L243 HydrophobicContact CD1-CG 4.34Å; L227-L243 HydrophobicContact CD2-CD2 3.9Å; L227-A247 HydrophobicContact CD2-CB 4.26Å; L227-P258 HydrophobicContact CB-CG 4.39Å; L227-P258 HydrophobicContact CD2-CB 3.91Å; L227-P258 HydrophobicContact CD2-CG 3.75Å; L227-P258 HydrophobicContact CG-CB 3.84Å; L227-P258 HydrophobicContact CG-CG 4.04Å
228	H	94.1	Very high	92.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.9	-41.9	174	-67.3	81.7	0	0	0	111.7	E224 T225 C231 R232 T251 G253 G256 T261	E224-H228 HydrophobicContact CB-CB 3.83Å; E224-H228 HydrophobicContact CG-CB 4.29Å; T225-H228 PolarHBondContact N-ND1 2.9Å; T225-H228 VanDerWaalsContact N-ND1 3.18Å; T225-H228 WeakPolarHBondContact O-CA 3.4Å; T225-H228 WeakPolarHBondContact O-CB 3.43Å; T225-H228 PolarHBondContact O-N 3.03Å; T225-H228 PolarHBondContact OG1-N 3.29Å; T225-H228 PolarHBondContact OG1-ND1 2.83Å; H228-C231 PolarHBondContact O-N 2.68Å; H228-R232 WeakPolarHBondContact O-CB 3.18Å; H228-R232 PolarHBondContact O-N 2.87Å; H228-T251 PolarHBondContact CE1-O 3.48Å; H228-T251 VanDerWaalsContact CE1-O 3.26Å; H228-G253 PolarHBondContact NE2-N 3.45Å; H228-G256 PolarHBondContact NE2-O 3.5Å; H228-T261 PolarHBondContact CD2-OG1 2.9Å; H228-T261 VanDerWaalsContact CD2-OG1 3.25Å
229	V	93.6	Very high	93	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.1	-45.5	178	175.6	0	0	0	0	111	K198 E224 T225 P226 L227 C231 R232 L233	K198-V229 HydrophobicContact CG-CG1 3.8Å; E224-V229 HydrophobicContact CB-CG2 4.08Å; T225-V229 PolarHBondContact O-N 3.07Å; P226-V229 PolarHBondContact O-N 2.92Å; L227-V229 VanDerWaalsContact C-N 3.34Å; L227-V229 PolarHBondContact O-N 3.41Å; V229-C231 VanDerWaalsContact C-N 3.34Å; V229-C231 PolarHBondContact O-N 2.75Å; V229-R232 PolarHBondContact O-N 2.73Å; V229-L233 HydrophobicContact CG1-CD1 3.93Å; V229-L233 WeakPolarHBondContact O-CG 3.47Å; V229-L233 PolarHBondContact O-N 3.38Å; V229-L233 VanDerWaalsContact O-N 3.08Å
230	A	94.4	Very high	93.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.6	-42.2	176.5	0	0	0	0	0	111.7	P226 L227 L233 G234 R235 V239 L242	P226-A230 PolarHBondContact O-N 2.79Å; L227-A230 PolarHBondContact O-N 3.47Å; A230-L233 PolarHBondContact O-N 3.04Å; A230-G234 PolarHBondContact O-N 3.18Å; A230-G234 VanDerWaalsContact O-N 3.09Å; A230-R235 HydrophobicContact CB-CB 4.49Å; A230-R235 PolarHBondContact O-N 3.12Å; A230-V239 HydrophobicContact CB-CG2 3.7Å; A230-L242 HydrophobicContact CB-CD1 4.01Å
231	C	94.4	Very high	93.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65	-38.2	175.5	-68.4	0	0	0	0	113.4	L227 H228 V229 L233 T261 A262 E267	L227-C231 WeakPolarHBondContact O-CB 3.46Å; L227-C231 PolarHBondContact O-N 2.67Å; L227-C231 PolarHBondContact O-SG 2.81Å; H228-C231 PolarHBondContact O-N 2.68Å; V229-C231 VanDerWaalsContact C-N 3.34Å; V229-C231 PolarHBondContact O-N 2.75Å; C231-L233 VanDerWaalsContact C-N 3.31Å; C231-T261 HydrophobicContact CB-CG2 4.46Å; C231-A262 HydrophobicContact CB-CB 3.94Å; C231-E267 WeakPolarHBondContact O-CG 3.42Å
232	R	93.8	Very high	93.1	Very high	63 Å²	63	28.4 Å²	28.4	24%	0.238	14%	0.144	C	C	.	.	H	α-helix	trans	-67.7	-31.5	177	173.5	166.9	59.9	66.4	-1.2	112.6	E224 H228 V229 T261 Y265	E224-R232 WeakPolarHBondContact OE1-CD 3.18Å; E224-R232 IonicContact OE1-CZ 2.97Å; E224-R232 IonicContact OE1-NE 2.94Å; E224-R232 PolarHBondContact OE1-NE 3.15Å; E224-R232 IonicContact OE1-NH2 3.67Å; E224-R232 IonicContact OE2-CZ 3.09Å; E224-R232 IonicContact OE2-NE 3.67Å; E224-R232 PolarHBondContact OE2-NE 2.78Å; E224-R232 IonicContact OE2-NH2 3.77Å; E224-R232 PolarHBondContact OE2-NH2 2.87Å; H228-R232 WeakPolarHBondContact O-CB 3.18Å; H228-R232 PolarHBondContact O-N 2.87Å; V229-R232 PolarHBondContact O-N 2.73Å; R232-T261 HydrophobicContact CB-CG2 3.97Å; R232-Y265 HydrophobicContact CB-CD2 4Å; R232-Y265 HydrophobicContact CB-CE2 3.88Å; R232-Y265 WeakPolarHBondContact CD-OH 3.43Å; R232-Y265 HydrophobicContact CG-CD1 4.44Å; R232-Y265 HydrophobicContact CG-CD2 3.9Å; R232-Y265 HydrophobicContact CG-CE1 4.04Å; R232-Y265 HydrophobicContact CG-CE2 3.47Å; R232-Y265 VanDerWaalsContact CG-CE2 3.47Å; R232-Y265 HydrophobicContact CG-CG 4.38Å
233	L	93.1	Very high	93.3	Very high	69 Å²	69	24.5 Å²	24.5	36%	0.361	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	0.8	-178.8	-65.4	176.2	0	0	0	113.6	K198 V229 A230 C231 R235	K198-L233 HydrophobicContact CB-CD1 4Å; K198-L233 HydrophobicContact CG-CD1 3.85Å; V229-L233 HydrophobicContact CG1-CD1 3.93Å; V229-L233 WeakPolarHBondContact O-CG 3.47Å; V229-L233 PolarHBondContact O-N 3.38Å; V229-L233 VanDerWaalsContact O-N 3.08Å; A230-L233 PolarHBondContact O-N 3.04Å; C231-L233 VanDerWaalsContact C-N 3.31Å; L233-R235 VanDerWaalsContact C-N 3.31Å; L233-R235 HydrophobicContact CB-CG 3.94Å; L233-R235 PolarHBondContact O-N 3.31Å
234	G	93.3	Very high	93.2	Very high	19 Å²	19	29.7 Å²	29.7	20%	0.196	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	22.6	179.7	0	0	0	0	0	114.8	A230 V236 E267	A230-G234 PolarHBondContact O-N 3.18Å; A230-G234 VanDerWaalsContact O-N 3.09Å; G234-V236 PolarHBondContact O-N 3.46Å; G234-V236 VanDerWaalsContact O-N 3.09Å; G234-E267 VanDerWaalsContact CA-CD 3.42Å; G234-E267 WeakPolarHBondContact CA-OE2 3.37Å
235	R	94.4	Very high	92.9	Very high	80 Å²	80	30.4 Å²	30.4	30%	0.302	15%	0.153	S	C	.	.			trans	-84.6	83	-175.7	-56.8	-54.9	-167.6	177.3	3	111.5	K198 E200 A230 L233 E237 S238 V239	K198-R235 PolarHBondContact O-NE 3.25Å; E200-R235 IonicContact OE2-NH1 3.69Å; E200-R235 PolarHBondContact OE2-NH1 2.92Å; A230-R235 HydrophobicContact CB-CB 4.49Å; A230-R235 PolarHBondContact O-N 3.12Å; L233-R235 VanDerWaalsContact C-N 3.31Å; L233-R235 HydrophobicContact CB-CG 3.94Å; L233-R235 PolarHBondContact O-N 3.31Å; R235-E237 PolarHBondContact O-N 3.03Å; R235-S238 PolarHBondContact O-N 2.9Å; R235-V239 WeakPolarHBondContact O-CG2 3.42Å; R235-V239 PolarHBondContact O-N 2.87Å
236	V	94.4	Very high	92.6	Very high	42 Å²	42	32.8 Å²	32.8	26%	0.255	18%	0.178	S	C	.	.	H	α-helix	trans	-59.7	-45.8	-173.7	-174.8	0	0	0	0	113.1	G234 S238 V239 K240 Q273	G234-V236 PolarHBondContact O-N 3.46Å; G234-V236 VanDerWaalsContact O-N 3.09Å; V236-S238 VanDerWaalsContact C-N 3.33Å; V236-S238 PolarHBondContact O-N 3.17Å; V236-V239 WeakPolarHBondContact O-CB 3.48Å; V236-V239 PolarHBondContact O-N 3.46Å; V236-K240 PolarHBondContact O-N 2.91Å; V236-Q273 HydrophobicContact CG1-CG 3.69Å
237	E	93.6	Very high	92.4	Very high	98 Å²	98	33.3 Å²	33.3	46%	0.458	18%	0.183	S	C	.	.	H	α-helix	trans	-67	-36.4	179.7	-63.7	-53.6	131.2	0	0	111.9	P202 R235 K240 A241	P202-E237 HydrophobicContact CB-CB 4.39Å; P202-E237 HydrophobicContact CG-CB 4.14Å; R235-E237 PolarHBondContact O-N 3.03Å; E237-K240 PolarHBondContact O-N 3.48Å; E237-A241 WeakPolarHBondContact O-CB 3.41Å; E237-A241 PolarHBondContact O-N 3.19Å
238	S	92.3	Very high	92.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.5	-40.8	174.6	-57.7	0	0	0	0	111.8	Q199 I205 R235 V236 K240 A241 L242	Q199-S238 PolarHBondContact O-OG 3.42Å; I205-S238 VanDerWaalsContact CD1-CB 3.49Å; R235-S238 PolarHBondContact O-N 2.9Å; V236-S238 VanDerWaalsContact C-N 3.33Å; V236-S238 PolarHBondContact O-N 3.17Å; S238-K240 VanDerWaalsContact C-N 3.35Å; S238-K240 PolarHBondContact O-N 3.05Å; S238-A241 PolarHBondContact O-N 3.25Å; S238-L242 WeakPolarHBondContact O-CB 3.41Å; S238-L242 WeakPolarHBondContact O-CD1 3.1Å; S238-L242 WeakPolarHBondContact O-CG 3.5Å; S238-L242 PolarHBondContact O-N 2.97Å
239	V	93.8	Very high	91.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.8	-48.1	171.7	167.3	0	0	0	0	110.5	L227 A230 R235 V236 A241 L242 L243 C270 Q273 I274	L227-V239 HydrophobicContact CD1-CB 4.31Å; L227-V239 HydrophobicContact CD1-CG1 3.96Å; L227-V239 HydrophobicContact CD1-CG2 4.22Å; A230-V239 HydrophobicContact CB-CG2 3.7Å; R235-V239 WeakPolarHBondContact O-CG2 3.42Å; R235-V239 PolarHBondContact O-N 2.87Å; V236-V239 WeakPolarHBondContact O-CB 3.48Å; V236-V239 PolarHBondContact O-N 3.46Å; V239-A241 PolarHBondContact O-N 3.33Å; V239-L242 PolarHBondContact O-N 2.98Å; V239-L243 HydrophobicContact CG1-CD1 3.78Å; V239-L243 HydrophobicContact CG1-CG 4.46Å; V239-L243 VanDerWaalsContact O-CG 3.23Å; V239-L243 WeakPolarHBondContact O-CG 3.3Å; V239-L243 PolarHBondContact O-N 3.19Å; V239-C270 HydrophobicContact CG2-CB 4.24Å; V239-Q273 HydrophobicContact CG1-CB 4Å; V239-I274 HydrophobicContact CG1-CG1 4.13Å
240	K	93.2	Very high	91.5	Very high	82 Å²	82	44.3 Å²	44.3	36%	0.357	24%	0.236	S	C	.	.	H	α-helix	trans	-59.2	-49	178.6	-176.3	-175.3	171.9	-168.4	0	111.8	V236 E237 S238 L242 L243 E244	V236-K240 PolarHBondContact O-N 2.91Å; E237-K240 PolarHBondContact O-N 3.48Å; S238-K240 VanDerWaalsContact C-N 3.35Å; S238-K240 PolarHBondContact O-N 3.05Å; K240-L242 VanDerWaalsContact C-N 3.34Å; K240-L242 PolarHBondContact O-N 3.47Å; K240-L243 PolarHBondContact O-N 3.4Å; K240-E244 WeakPolarHBondContact CE-OE1 3.45Å; K240-E244 WeakPolarHBondContact O-CG 3.41Å; K240-E244 PolarHBondContact O-N 3.49Å
241	A	92.1	Very high	91.2	Very high	3 Å²	3	45.7 Å²	45.7	3%	0.025	24%	0.244	C	C	.	.	H	α-helix	trans	-64	-37.1	179.9	0	0	0	0	0	113	P202 I205 Q206 E237 S238 V239 G245	P202-A241 HydrophobicContact CB-CB 3.62Å; I205-A241 HydrophobicContact CB-CB 4.11Å; I205-A241 HydrophobicContact CG2-CB 3.78Å; Q206-A241 HydrophobicContact CG-CB 4.25Å; E237-A241 WeakPolarHBondContact O-CB 3.41Å; E237-A241 PolarHBondContact O-N 3.19Å; S238-A241 PolarHBondContact O-N 3.25Å; V239-A241 PolarHBondContact O-N 3.33Å; A241-G245 PolarHBondContact O-N 3.21Å
242	L	91.8	Very high	90.7	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-42.8	174.9	-73.3	167.1	0	0	0	111.6	M193 I205 P226 L227 A230 S238 V239 K240 G245 G246 A247	M193-L242 HydrophobicContact CE-CD2 4.11Å; M193-L242 HydrophobicContact CG-CD2 4.19Å; M193-L242 HydrophobicContact SD-CD2 4.31Å; I205-L242 HydrophobicContact CD1-CG 4.2Å; I205-L242 HydrophobicContact CG2-CD2 3.74Å; I205-L242 HydrophobicContact CG2-CG 3.94Å; P226-L242 HydrophobicContact CB-CD1 4.35Å; P226-L242 HydrophobicContact CB-CD2 4.15Å; L227-L242 HydrophobicContact CB-CD1 4.4Å; L227-L242 HydrophobicContact CD1-CB 4.21Å; L227-L242 HydrophobicContact CD1-CD1 4.21Å; A230-L242 HydrophobicContact CB-CD1 4.01Å; S238-L242 WeakPolarHBondContact O-CB 3.41Å; S238-L242 WeakPolarHBondContact O-CD1 3.1Å; S238-L242 WeakPolarHBondContact O-CG 3.5Å; S238-L242 PolarHBondContact O-N 2.97Å; V239-L242 PolarHBondContact O-N 2.98Å; K240-L242 VanDerWaalsContact C-N 3.34Å; K240-L242 PolarHBondContact O-N 3.47Å; L242-G245 CarbonylContact O-C 3.6Å; L242-G245 WeakPolarHBondContact O-CA 3.35Å; L242-G245 PolarHBondContact O-N 3.12Å; L242-G246 PolarHBondContact O-N 2.8Å; L242-A247 HydrophobicContact CB-CB 4Å; L242-A247 WeakPolarHBondContact O-CB 3.17Å; L242-A247 PolarHBondContact O-N 3.26Å
243	L	91.6	Very high	90.3	Very high	26 Å²	26	51.4 Å²	51.4	14%	0.136	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-44.3	178.1	-67.4	169.1	0	0	0	111.5	L227 V239 K240 G245 G246 C249 Q273 I274 A277	L227-L243 HydrophobicContact CD1-CD2 4.39Å; L227-L243 HydrophobicContact CD1-CG 4.34Å; L227-L243 HydrophobicContact CD2-CD2 3.9Å; V239-L243 HydrophobicContact CG1-CD1 3.78Å; V239-L243 HydrophobicContact CG1-CG 4.46Å; V239-L243 VanDerWaalsContact O-CG 3.23Å; V239-L243 WeakPolarHBondContact O-CG 3.3Å; V239-L243 PolarHBondContact O-N 3.19Å; K240-L243 PolarHBondContact O-N 3.4Å; L243-G245 PolarHBondContact O-N 3.41Å; L243-G246 PolarHBondContact O-N 3.38Å; L243-C249 WeakPolarHBondContact CD2-SG 3.45Å; L243-Q273 HydrophobicContact CD1-CB 4.47Å; L243-I274 HydrophobicContact CD1-CG1 4.36Å; L243-A277 HydrophobicContact CB-CB 4.26Å; L243-A277 HydrophobicContact CD1-CB 3.86Å; L243-A277 HydrophobicContact CD2-CB 4.28Å; L243-A277 HydrophobicContact CG-CB 4.36Å
244	E	89.9	Confident	89.8	Confident	127 Å²	127	51.4 Å²	51.4	59%	0.593	27%	0.274	S	S	*	.	H	α-helix	trans	-62	-32.2	172.5	-71.2	173.1	176.8	0	0	112	K240 G246	K240-E244 WeakPolarHBondContact CE-OE1 3.45Å; K240-E244 WeakPolarHBondContact O-CG 3.41Å; K240-E244 PolarHBondContact O-N 3.49Å; E244-G246 VanDerWaalsContact C-N 3.27Å; E244-G246 PolarHBondContact O-N 3.26Å
245	G	85.8	Confident	89.1	Confident	29 Å²	29	51.5 Å²	51.5	30%	0.299	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	7.2	176.6	0	0	0	0	0	115.8	A241 L242 L243	A241-G245 PolarHBondContact O-N 3.21Å; L242-G245 CarbonylContact O-C 3.6Å; L242-G245 WeakPolarHBondContact O-CA 3.35Å; L242-G245 PolarHBondContact O-N 3.12Å; L243-G245 PolarHBondContact O-N 3.41Å
246	G	86.8	Confident	88.8	Confident	51 Å²	51	47.7 Å²	47.7	53%	0.526	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	20.4	176.5	0	0	0	0	0	115.3	L242 L243 E244	L242-G246 PolarHBondContact O-N 2.8Å; L243-G246 PolarHBondContact O-N 3.38Å; E244-G246 VanDerWaalsContact C-N 3.27Å; E244-G246 PolarHBondContact O-N 3.26Å
247	A	89.4	Confident	88.6	Confident	11 Å²	11	46.2 Å²	46.2	9%	0.091	25%	0.248	C	C	.	.			trans	-64.5	134.4	171.5	0	0	0	0	0	111.4	V216 L227 L242	V216-A247 HydrophobicContact CG1-CB 3.53Å; L227-A247 HydrophobicContact CD2-CB 4.26Å; L242-A247 HydrophobicContact CB-CB 4Å; L242-A247 WeakPolarHBondContact O-CB 3.17Å; L242-A247 PolarHBondContact O-N 3.26Å
248	K	89.2	Confident	88.6	Confident	124 Å²	124	41.6 Å²	41.6	54%	0.539	23%	0.226	S	C	.	.			trans	-88.9	121	-179	-75.8	-175.2	179.3	-175.1	0	111.2	N217 D250 T251	N217-K248 WeakPolarHBondContact OD1-CB 3.3Å; N217-K248 PolarHBondContact OD1-N 3.2Å; K248-D250 VanDerWaalsContact C-N 3.26Å; K248-D250 WeakPolarHBondContact CB-OD1 3.49Å; K248-D250 PolarHBondContact O-N 3.46Å; K248-T251 WeakPolarHBondContact CB-OG1 3.48Å; K248-T251 PolarHBondContact O-OG1 3.26Å
249	C	88.2	Confident	88.6	Confident	10 Å²	10	41.6 Å²	41.6	7%	0.068	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.5	177.5	-60.2	0	0	0	0	114	L243 P258 D278 Q281	L243-C249 WeakPolarHBondContact CD2-SG 3.45Å; C249-P258 WeakPolarHBondContact O-CD 3.39Å; C249-D278 HydrophobicContact CB-CB 4.34Å; C249-Q281 HydrophobicContact CB-CG 3.73Å; C249-Q281 PolarHBondContact O-OE1 3.29Å
250	D	86	Confident	88.6	Confident	97 Å²	97	41.6 Å²	41.6	52%	0.519	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-0.1	-177.4	67.2	-26	0	0	0	113.6	K248 R252	K248-D250 VanDerWaalsContact C-N 3.26Å; K248-D250 WeakPolarHBondContact CB-OD1 3.49Å; K248-D250 PolarHBondContact O-N 3.46Å; D250-R252 PolarHBondContact O-N 3.15Å; D250-R252 VanDerWaalsContact O-N 3.14Å
251	T	87.1	Confident	88.6	Confident	28 Å²	28	37.7 Å²	37.7	17%	0.172	21%	0.209	C	C	.	.			trans	-66.9	115.9	177.9	-49.8	0	0	0	0	109.3	L219 T225 H228 K248 G253	L219-T251 HydrophobicContact CD2-CG2 4.49Å; T225-T251 HydrophobicContact CG2-CG2 3.54Å; H228-T251 PolarHBondContact CE1-O 3.48Å; H228-T251 VanDerWaalsContact CE1-O 3.26Å; K248-T251 WeakPolarHBondContact CB-OG1 3.48Å; K248-T251 PolarHBondContact O-OG1 3.26Å; T251-G253 PolarHBondContact O-N 2.9Å
252	R	85.7	Confident	88.6	Confident	175 Å²	175	37.6 Å²	37.6	66%	0.66	21%	0.208	S	C	*	.			trans	-79.6	113.3	-175.9	-64.9	-179.1	176.1	174.5	-0.9	110.6	D250	D250-R252 PolarHBondContact O-N 3.15Å; D250-R252 VanDerWaalsContact O-N 3.14Å
253	G	84.7	Confident	88.7	Confident	9 Å²	9	37.6 Å²	37.6	9%	0.093	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-91.7	-169.3	169.7	0	0	0	0	0	113.2	G223 H228 T251 T255 G256	G223-G253 CarbonylContact O-C 3.43Å; G223-G253 WeakPolarHBondContact O-CA 3.3Å; H228-G253 PolarHBondContact NE2-N 3.45Å; T251-G253 PolarHBondContact O-N 2.9Å; G253-T255 PolarHBondContact O-N 2.97Å; G253-G256 PolarHBondContact N-O 3.3Å; G253-G256 PolarHBondContact O-N 2.98Å
254	S	82.9	Confident	88.7	Confident	68 Å²	68	39.6 Å²	39.6	48%	0.476	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.4	178.4	56.8	0	0	0	0	114.3	N222 G223	N222-S254 WeakPolarHBondContact O-CB 3.39Å; N222-S254 PolarHBondContact O-OG 2.78Å; G223-S254 PolarHBondContact O-N 3.15Å
255	T	78	Confident	88.8	Confident	21 Å²	21	38.3 Å²	38.3	13%	0.129	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	20.3	178.4	57.6	0	0	0	0	112.9	G253 H260 T261 K264	G253-T255 PolarHBondContact O-N 2.97Å; T255-H260 VanDerWaalsContact O-CB 3.29Å; T255-H260 WeakPolarHBondContact O-CB 3.41Å; T255-T261 PolarHBondContact OG1-OG1 3.26Å; T255-K264 HydrophobicContact CG2-CD 4.31Å
256	G	87.3	Confident	89.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	88.2	-151	-172.4	0	0	0	0	0	111.8	H228 G253	H228-G256 PolarHBondContact NE2-O 3.5Å; G253-G256 PolarHBondContact N-O 3.3Å; G253-G256 PolarHBondContact O-N 2.98Å
257	N	91.4	Very high	89.5	Confident	11 Å²	11	39.4 Å²	39.4	6%	0.059	19%	0.194	C	C	.	.	S	Bend	trans	-68.8	159.8	175.8	-64	20.2	0	0	0	112.3	I259 H260 T261 Q281 A284	N257-I259 HydrophobicContact CB-CG2 4.14Å; N257-I259 PolarHBondContact O-N 3.15Å; N257-I259 VanDerWaalsContact O-N 3.09Å; N257-H260 WeakPolarHBondContact CB-ND1 3.47Å; N257-H260 PolarHBondContact N-ND1 3.03Å; N257-H260 WeakPolarHBondContact O-CB 3.42Å; N257-H260 PolarHBondContact O-N 3.28Å; N257-H260 PolarHBondContact O-ND1 3.4Å; N257-T261 PolarHBondContact O-N 3Å; N257-Q281 PolarHBondContact ND2-OE1 3.27Å; N257-A284 WeakPolarHBondContact ND2-CB 3.4Å
258	P	92.4	Very high	89.7	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-52.9	-33.5	178.2	-24.9	32.2	0	0	0	114.6	L227 C249 H260 T261 A262 I274	L227-P258 HydrophobicContact CB-CG 4.39Å; L227-P258 HydrophobicContact CD2-CB 3.91Å; L227-P258 HydrophobicContact CD2-CG 3.75Å; L227-P258 HydrophobicContact CG-CB 3.84Å; L227-P258 HydrophobicContact CG-CG 4.04Å; C249-P258 WeakPolarHBondContact O-CD 3.39Å; P258-H260 VanDerWaalsContact C-N 3.31Å; P258-H260 PolarHBondContact O-N 2.93Å; P258-T261 WeakPolarHBondContact O-CB 3.24Å; P258-T261 PolarHBondContact O-N 3.24Å; P258-A262 PolarHBondContact O-N 3.07Å; P258-I274 HydrophobicContact CB-CD1 4.43Å
259	I	93.7	Very high	90	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-39.7	175	-168.3	166.2	0	0	0	111.7	N257 T261 A262 M263 V271 I274 L275 Q281 A284 P293	N257-I259 HydrophobicContact CB-CG2 4.14Å; N257-I259 PolarHBondContact O-N 3.15Å; N257-I259 VanDerWaalsContact O-N 3.09Å; I259-T261 VanDerWaalsContact C-N 3.33Å; I259-T261 PolarHBondContact O-N 3.3Å; I259-A262 PolarHBondContact O-N 3.49Å; I259-M263 HydrophobicContact CG1-CG 4.4Å; I259-M263 VanDerWaalsContact O-CG 3.23Å; I259-M263 WeakPolarHBondContact O-CG 3.49Å; I259-M263 PolarHBondContact O-N 2.86Å; I259-V271 HydrophobicContact CD1-CG1 4.38Å; I259-V271 HydrophobicContact CG1-CG1 4.44Å; I259-I274 HydrophobicContact CB-CD1 4.43Å; I259-I274 HydrophobicContact CB-CG2 4.23Å; I259-I274 HydrophobicContact CD1-CG2 4.47Å; I259-L275 HydrophobicContact CD1-CD2 3.61Å; I259-L275 HydrophobicContact CD1-CG 4.11Å; I259-Q281 HydrophobicContact CB-CB 4.44Å; I259-Q281 HydrophobicContact CD1-CB 3.88Å; I259-Q281 HydrophobicContact CG2-CB 4.23Å; I259-A284 HydrophobicContact CG2-CB 4.44Å; I259-P293 HydrophobicContact CD1-CB 4.18Å; I259-P293 HydrophobicContact CD1-CG 3.87Å; I259-P293 HydrophobicContact CG1-CB 4.26Å; I259-P293 HydrophobicContact CG1-CG 4.16Å; I259-P293 HydrophobicContact CG2-CG 3.96Å
260	H	93.1	Very high	90.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.9	-37.1	177.6	-56.8	102.4	0	0	0	111.5	T255 N257 P258 M263 K264 A284 G291 W296	T255-H260 VanDerWaalsContact O-CB 3.29Å; T255-H260 WeakPolarHBondContact O-CB 3.41Å; N257-H260 WeakPolarHBondContact CB-ND1 3.47Å; N257-H260 PolarHBondContact N-ND1 3.03Å; N257-H260 WeakPolarHBondContact O-CB 3.42Å; N257-H260 PolarHBondContact O-N 3.28Å; N257-H260 PolarHBondContact O-ND1 3.4Å; P258-H260 VanDerWaalsContact C-N 3.31Å; P258-H260 PolarHBondContact O-N 2.93Å; H260-M263 PolarHBondContact O-N 3.37Å; H260-K264 VanDerWaalsContact O-CB 3.26Å; H260-K264 WeakPolarHBondContact O-CB 3.38Å; H260-K264 PolarHBondContact O-N 3.18Å; H260-A284 PolarHBondContact CE1-O 3.21Å; H260-A284 PolarHBondContact NE2-O 2.97Å; H260-G291 PolarHBondContact NE2-O 3.04Å; H260-W296 AromaticContact CD2-CD1 3.6Å; H260-W296 AromaticContact CD2-NE1 3.81Å
261	T	92.6	Very high	90.6	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-62.3	-48.9	171.9	-48.9	0	0	0	0	110.6	H228 C231 R232 T255 N257 P258 I259 M263 K264 Y265	H228-T261 PolarHBondContact CD2-OG1 2.9Å; H228-T261 VanDerWaalsContact CD2-OG1 3.25Å; C231-T261 HydrophobicContact CB-CG2 4.46Å; R232-T261 HydrophobicContact CB-CG2 3.97Å; T255-T261 PolarHBondContact OG1-OG1 3.26Å; N257-T261 PolarHBondContact O-N 3Å; P258-T261 WeakPolarHBondContact O-CB 3.24Å; P258-T261 PolarHBondContact O-N 3.24Å; I259-T261 VanDerWaalsContact C-N 3.33Å; I259-T261 PolarHBondContact O-N 3.3Å; T261-M263 VanDerWaalsContact C-N 3.31Å; T261-M263 PolarHBondContact O-N 2.95Å; T261-K264 WeakPolarHBondContact O-CB 3.48Å; T261-K264 PolarHBondContact O-N 3.03Å; T261-K264 VanDerWaalsContact O-N 3.12Å; T261-Y265 HydrophobicContact CG2-CD2 3.95Å; T261-Y265 HydrophobicContact CG2-CE2 3.93Å; T261-Y265 VanDerWaalsContact O-CD2 3.25Å; T261-Y265 WeakPolarHBondContact O-CD2 3.39Å; T261-Y265 PolarHBondContact O-N 2.94Å
262	A	93.8	Very high	91	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.6	-42.4	176.5	0	0	0	0	0	112	C231 P258 I259 Y265 S266 E267 C270 V271 I274	C231-A262 HydrophobicContact CB-CB 3.94Å; P258-A262 PolarHBondContact O-N 3.07Å; I259-A262 PolarHBondContact O-N 3.49Å; A262-Y265 PolarHBondContact O-N 3.35Å; A262-S266 PolarHBondContact O-N 2.99Å; A262-E267 PolarHBondContact O-N 2.88Å; A262-C270 HydrophobicContact CB-CB 4.04Å; A262-V271 HydrophobicContact CB-CG2 3.55Å; A262-I274 HydrophobicContact CB-CD1 4.41Å
263	M	93.8	Very high	91.4	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-63.7	-41	174.5	-67.1	-56.9	-60.1	0	0	112.3	I259 H260 T261 Y265 S266 V271 P293 W296 A297 M302 L306	I259-M263 HydrophobicContact CG1-CG 4.4Å; I259-M263 VanDerWaalsContact O-CG 3.23Å; I259-M263 WeakPolarHBondContact O-CG 3.49Å; I259-M263 PolarHBondContact O-N 2.86Å; H260-M263 PolarHBondContact O-N 3.37Å; T261-M263 VanDerWaalsContact C-N 3.31Å; T261-M263 PolarHBondContact O-N 2.95Å; M263-Y265 VanDerWaalsContact C-N 3.28Å; M263-Y265 PolarHBondContact O-N 3.2Å; M263-S266 PolarHBondContact O-N 3.26Å; M263-S266 VanDerWaalsContact O-N 3.14Å; M263-V271 HydrophobicContact CG-CG2 4.37Å; M263-V271 HydrophobicContact SD-CG1 4.11Å; M263-V271 HydrophobicContact SD-CG2 3.71Å; M263-P293 WeakPolarHBondContact CE-O 3.16Å; M263-P293 HydrophobicContact CG-CB 3.93Å; M263-P293 HydrophobicContact SD-CB 4.49Å; M263-W296 HydrophobicContact CB-CB 3.77Å; M263-A297 HydrophobicContact CE-CB 3.63Å; M263-M302 HydrophobicContact CE-CB 3.84Å; M263-M302 HydrophobicContact CE-CE 3.93Å; M263-M302 HydrophobicContact SD-CE 3.45Å; M263-M302 WeakPolarHBondContact SD-CE 3.32Å; M263-L306 HydrophobicContact CE-CD1 3.46Å; M263-L306 VanDerWaalsContact CE-CD1 3.46Å; M263-L306 HydrophobicContact CE-CG 4.27Å; M263-L306 HydrophobicContact SD-CD1 3.96Å; M263-L306 HydrophobicContact SD-CD2 4.41Å; M263-L306 HydrophobicContact SD-CG 4.4Å
264	K	91.7	Very high	91.8	Very high	68 Å²	68	27.2 Å²	27.2	30%	0.296	14%	0.141	S	C	.	.	H	α-helix	trans	-62.8	-35	178.8	-177.8	-178.5	178.4	-176.2	0	111.8	T255 H260 T261 W296 K298	T255-K264 HydrophobicContact CG2-CD 4.31Å; H260-K264 VanDerWaalsContact O-CB 3.26Å; H260-K264 WeakPolarHBondContact O-CB 3.38Å; H260-K264 PolarHBondContact O-N 3.18Å; T261-K264 WeakPolarHBondContact O-CB 3.48Å; T261-K264 PolarHBondContact O-N 3.03Å; T261-K264 VanDerWaalsContact O-N 3.12Å; K264-W296 HydrophobicContact CB-CE3 4.14Å; K264-W296 HydrophobicContact CB-CZ3 4.44Å; K264-W296 HydrophobicContact CD-CZ3 4.11Å; K264-W296 HydrophobicContact CG-CE3 4.37Å; K264-W296 HydrophobicContact CG-CZ3 4.26Å; K264-K298 WeakPolarHBondContact O-CE 3.39Å; K264-K298 PolarHBondContact O-NZ 3.33Å
265	Y	91.8	Very high	92.3	Very high	99 Å²	99	24.3 Å²	24.3	39%	0.388	12%	0.12	S	C	.	.	H	α-helix	trans	-94	0.6	176.4	-67.2	-80.7	0	0	0	113.5	R232 T261 A262 M263 E267	R232-Y265 HydrophobicContact CB-CD2 4Å; R232-Y265 HydrophobicContact CB-CE2 3.88Å; R232-Y265 WeakPolarHBondContact CD-OH 3.43Å; R232-Y265 HydrophobicContact CG-CD1 4.44Å; R232-Y265 HydrophobicContact CG-CD2 3.9Å; R232-Y265 HydrophobicContact CG-CE1 4.04Å; R232-Y265 HydrophobicContact CG-CE2 3.47Å; R232-Y265 VanDerWaalsContact CG-CE2 3.47Å; R232-Y265 HydrophobicContact CG-CG 4.38Å; T261-Y265 HydrophobicContact CG2-CD2 3.95Å; T261-Y265 HydrophobicContact CG2-CE2 3.93Å; T261-Y265 VanDerWaalsContact O-CD2 3.25Å; T261-Y265 WeakPolarHBondContact O-CD2 3.39Å; T261-Y265 PolarHBondContact O-N 2.94Å; A262-Y265 PolarHBondContact O-N 3.35Å; M263-Y265 VanDerWaalsContact C-N 3.28Å; M263-Y265 PolarHBondContact O-N 3.2Å; Y265-E267 VanDerWaalsContact C-N 3.3Å; Y265-E267 PolarHBondContact O-N 3.07Å
266	S	93.5	Very high	92.9	Very high	40 Å²	40	29.4 Å²	29.4	28%	0.28	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	33.1	-179.3	-54.2	0	0	0	0	114.1	A262 M263 K268	A262-S266 PolarHBondContact O-N 2.99Å; M263-S266 PolarHBondContact O-N 3.26Å; M263-S266 VanDerWaalsContact O-N 3.14Å; S266-K268 PolarHBondContact O-N 3.18Å; S266-K268 VanDerWaalsContact O-N 3.13Å
267	E	94.1	Very high	93.1	Very high	63 Å²	63	32.3 Å²	32.3	29%	0.294	16%	0.164	S	C	.	.			trans	-86	84.9	-176.4	-64.9	-60.2	159.8	0	0	111.4	C231 G234 A262 Y265 G269 C270 V271	C231-E267 WeakPolarHBondContact O-CG 3.42Å; G234-E267 VanDerWaalsContact CA-CD 3.42Å; G234-E267 WeakPolarHBondContact CA-OE2 3.37Å; A262-E267 PolarHBondContact O-N 2.88Å; Y265-E267 VanDerWaalsContact C-N 3.3Å; Y265-E267 PolarHBondContact O-N 3.07Å; E267-G269 PolarHBondContact O-N 3.44Å; E267-C270 HydrophobicContact CB-CB 3.99Å; E267-C270 PolarHBondContact O-N 3.34Å; E267-V271 PolarHBondContact O-N 3.25Å; E267-V271 VanDerWaalsContact O-N 3.15Å
268	K	93.6	Very high	93.1	Very high	92 Å²	92	33.6 Å²	33.6	40%	0.4	17%	0.171	S	C	.	.	H	α-helix	trans	-52.6	-48.9	-176.2	-178.2	-175.7	168.9	-177.5	0	113	S266 C270 V271 E272 M302 L305	S266-K268 PolarHBondContact O-N 3.18Å; S266-K268 VanDerWaalsContact O-N 3.13Å; K268-C270 VanDerWaalsContact C-N 3.31Å; K268-C270 PolarHBondContact O-N 2.9Å; K268-V271 PolarHBondContact O-N 3.26Å; K268-E272 WeakPolarHBondContact CE-OE1 3.19Å; K268-E272 IonicContact NZ-OE1 2.62Å; K268-E272 PolarHBondContact O-N 2.71Å; K268-M302 HydrophobicContact CB-SD 3.82Å; K268-M302 HydrophobicContact CG-SD 4.41Å; K268-L305 HydrophobicContact CG-CD2 4.08Å
269	G	93.9	Very high	93	Very high	21 Å²	21	37.2 Å²	37.2	22%	0.216	20%	0.195	C	C	.	.	H	α-helix	trans	-61.4	-39.9	-177.5	0	0	0	0	0	112.4	E267 E272 Q273	E267-G269 PolarHBondContact O-N 3.44Å; G269-E272 PolarHBondContact O-N 2.82Å; G269-Q273 WeakPolarHBondContact O-CG 3.43Å; G269-Q273 PolarHBondContact O-N 2.92Å; G269-Q273 VanDerWaalsContact O-N 3.12Å
270	C	93.9	Very high	92.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.2	-44.9	176.4	-63.8	0	0	0	0	111.6	V239 A262 E267 K268 E272 Q273 I274	V239-C270 HydrophobicContact CG2-CB 4.24Å; A262-C270 HydrophobicContact CB-CB 4.04Å; E267-C270 HydrophobicContact CB-CB 3.99Å; E267-C270 PolarHBondContact O-N 3.34Å; K268-C270 VanDerWaalsContact C-N 3.31Å; K268-C270 PolarHBondContact O-N 2.9Å; C270-E272 VanDerWaalsContact C-N 3.34Å; C270-E272 PolarHBondContact O-N 3.45Å; C270-Q273 PolarHBondContact O-N 3.27Å; C270-I274 VanDerWaalsContact O-CG1 3.31Å; C270-I274 WeakPolarHBondContact O-CG1 3.29Å; C270-I274 PolarHBondContact O-N 3.37Å
271	V	94.6	Very high	92.5	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-43.1	177.2	176.4	0	0	0	0	110.9	I259 A262 M263 E267 K268 Q273 I274 L275 M302 L305 L306	I259-V271 HydrophobicContact CD1-CG1 4.38Å; I259-V271 HydrophobicContact CG1-CG1 4.44Å; A262-V271 HydrophobicContact CB-CG2 3.55Å; M263-V271 HydrophobicContact CG-CG2 4.37Å; M263-V271 HydrophobicContact SD-CG1 4.11Å; M263-V271 HydrophobicContact SD-CG2 3.71Å; E267-V271 PolarHBondContact O-N 3.25Å; E267-V271 VanDerWaalsContact O-N 3.15Å; K268-V271 PolarHBondContact O-N 3.26Å; V271-Q273 VanDerWaalsContact C-N 3.33Å; V271-Q273 PolarHBondContact O-N 3.39Å; V271-I274 PolarHBondContact O-N 2.91Å; V271-L275 HydrophobicContact CG1-CD1 3.77Å; V271-L275 HydrophobicContact CG1-CG 4.16Å; V271-L275 WeakPolarHBondContact O-CB 3.27Å; V271-L275 VanDerWaalsContact O-CG 3.25Å; V271-L275 WeakPolarHBondContact O-CG 3.49Å; V271-L275 PolarHBondContact O-N 3.24Å; V271-M302 HydrophobicContact CB-CE 4.25Å; V271-M302 HydrophobicContact CG2-CE 3.59Å; V271-L305 HydrophobicContact CB-CD2 4.08Å; V271-L305 HydrophobicContact CG1-CD2 3.79Å; V271-L306 HydrophobicContact CG1-CD2 4.26Å
272	E	94.5	Very high	92.3	Very high	48 Å²	48	47 Å²	47	22%	0.224	24%	0.238	C	C	.	.	H	α-helix	trans	-59.5	-41.7	177	-77.4	-177.8	-175	0	0	112.9	K268 G269 C270 K276 L305	K268-E272 WeakPolarHBondContact CE-OE1 3.19Å; K268-E272 IonicContact NZ-OE1 2.62Å; K268-E272 PolarHBondContact O-N 2.71Å; G269-E272 PolarHBondContact O-N 2.82Å; C270-E272 VanDerWaalsContact C-N 3.34Å; C270-E272 PolarHBondContact O-N 3.45Å; E272-K276 WeakPolarHBondContact O-CB 3.47Å; E272-K276 WeakPolarHBondContact O-CG 3.32Å; E272-K276 PolarHBondContact O-N 2.95Å; E272-L305 HydrophobicContact CG-CD1 3.65Å; E272-L305 HydrophobicContact CG-CD2 3.75Å; E272-L305 HydrophobicContact CG-CG 4.36Å
273	Q	93.9	Very high	92.1	Very high	38 Å²	38	50.2 Å²	50.2	18%	0.178	25%	0.253	C	S	.	.	H	α-helix	trans	-69.5	-42	178.2	-64	-55.6	-32.6	0	0	112.1	V236 V239 L243 G269 C270 V271 L275 K276 A277	V236-Q273 HydrophobicContact CG1-CG 3.69Å; V239-Q273 HydrophobicContact CG1-CB 4Å; L243-Q273 HydrophobicContact CD1-CB 4.47Å; G269-Q273 WeakPolarHBondContact O-CG 3.43Å; G269-Q273 PolarHBondContact O-N 2.92Å; G269-Q273 VanDerWaalsContact O-N 3.12Å; C270-Q273 PolarHBondContact O-N 3.27Å; V271-Q273 VanDerWaalsContact C-N 3.33Å; V271-Q273 PolarHBondContact O-N 3.39Å; Q273-L275 VanDerWaalsContact C-N 3.34Å; Q273-L275 PolarHBondContact O-N 3.27Å; Q273-K276 PolarHBondContact O-N 2.95Å; Q273-A277 PolarHBondContact O-N 2.94Å
274	I	93.8	Very high	91.9	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.1	-46.6	176.1	-67.2	165.1	0	0	0	110.4	V239 L243 P258 I259 A262 C270 V271 K276 A277 D278 Q281	V239-I274 HydrophobicContact CG1-CG1 4.13Å; L243-I274 HydrophobicContact CD1-CG1 4.36Å; P258-I274 HydrophobicContact CB-CD1 4.43Å; I259-I274 HydrophobicContact CB-CD1 4.43Å; I259-I274 HydrophobicContact CB-CG2 4.23Å; I259-I274 HydrophobicContact CD1-CG2 4.47Å; A262-I274 HydrophobicContact CB-CD1 4.41Å; C270-I274 VanDerWaalsContact O-CG1 3.31Å; C270-I274 WeakPolarHBondContact O-CG1 3.29Å; C270-I274 PolarHBondContact O-N 3.37Å; V271-I274 PolarHBondContact O-N 2.91Å; I274-K276 VanDerWaalsContact C-N 3.29Å; I274-K276 PolarHBondContact O-N 3.44Å; I274-A277 PolarHBondContact O-N 3.3Å; I274-D278 PolarHBondContact O-N 2.99Å; I274-Q281 HydrophobicContact CG2-CB 4.11Å; I274-Q281 HydrophobicContact CG2-CG 3.9Å
275	L	92.4	Very high	91.8	Very high	7 Å²	7	50.5 Å²	50.5	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-69.1	-25.2	-179.7	-68.6	-178.5	0	0	0	113.7	I259 V271 Q273 Q281 L282 L306 R309	I259-L275 HydrophobicContact CD1-CD2 3.61Å; I259-L275 HydrophobicContact CD1-CG 4.11Å; V271-L275 HydrophobicContact CG1-CD1 3.77Å; V271-L275 HydrophobicContact CG1-CG 4.16Å; V271-L275 WeakPolarHBondContact O-CB 3.27Å; V271-L275 VanDerWaalsContact O-CG 3.25Å; V271-L275 WeakPolarHBondContact O-CG 3.49Å; V271-L275 PolarHBondContact O-N 3.24Å; Q273-L275 VanDerWaalsContact C-N 3.34Å; Q273-L275 PolarHBondContact O-N 3.27Å; L275-Q281 HydrophobicContact CD2-CB 4.32Å; L275-L282 HydrophobicContact CD1-CD2 3.75Å; L275-L282 HydrophobicContact CD2-CD2 3.64Å; L275-L282 HydrophobicContact CD2-CG 3.6Å; L275-L282 HydrophobicContact CG-CD2 4.34Å; L275-L306 HydrophobicContact CD1-CD2 4.03Å; L275-R309 HydrophobicContact CD1-CG 4.33Å
276	K	92.3	Very high	91.7	Very high	127 Å²	127	45.9 Å²	45.9	55%	0.552	24%	0.24	S	C	*	.	H	α-helix	trans	-72	-38.9	171.5	-77.5	169.9	-173.6	174.2	0	111.6	E272 Q273 I274	E272-K276 WeakPolarHBondContact O-CB 3.47Å; E272-K276 WeakPolarHBondContact O-CG 3.32Å; E272-K276 PolarHBondContact O-N 2.95Å; Q273-K276 PolarHBondContact O-N 2.95Å; I274-K276 VanDerWaalsContact C-N 3.29Å; I274-K276 PolarHBondContact O-N 3.44Å
277	A	91.4	Very high	91.1	Very high	62 Å²	62	47 Å²	47	51%	0.512	25%	0.247	S	C	.	.	H	α-helix	trans	-76.6	-42.6	179.3	0	0	0	0	0	112.3	L243 Q273 I274	L243-A277 HydrophobicContact CB-CB 4.26Å; L243-A277 HydrophobicContact CD1-CB 3.86Å; L243-A277 HydrophobicContact CD2-CB 4.28Å; L243-A277 HydrophobicContact CG-CB 4.36Å; Q273-A277 PolarHBondContact O-N 2.94Å; I274-A277 PolarHBondContact O-N 3.3Å
278	D	90.6	Very high	90.7	Very high	37 Å²	37	48.2 Å²	48.2	20%	0.198	26%	0.259	C	S	.	.			trans	-141	97.4	-178.8	-177.9	10.5	0	0	0	111.5	C249 I274 F280 Q281	C249-D278 HydrophobicContact CB-CB 4.34Å; I274-D278 PolarHBondContact O-N 2.99Å; D278-F280 PolarHBondContact O-N 3.43Å; D278-F280 VanDerWaalsContact OD1-CB 3.32Å; D278-F280 WeakPolarHBondContact OD1-CB 3.45Å; D278-F280 VanDerWaalsContact OD1-CD2 3.3Å; D278-F280 WeakPolarHBondContact OD1-CD2 3.46Å; D278-F280 PolarHBondContact OD1-N 3.19Å; D278-Q281 HydrophobicContact CB-CG 4.05Å; D278-Q281 PolarHBondContact O-N 3.26Å; D278-Q281 WeakPolarHBondContact OD2-CG 3.48Å; D278-Q281 PolarHBondContact OD2-NE2 3.34Å
279	P	89.4	Confident	90.4	Very high	78 Å²	78	49.8 Å²	49.8	51%	0.506	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-62.5	-22.7	176	-24.2	34.9	0	0	0	114.2	Q281 L282	P279-Q281 PolarHBondContact O-N 2.93Å; P279-L282 WeakPolarHBondContact O-CB 3.37Å; P279-L282 WeakPolarHBondContact O-CG 3.3Å; P279-L282 PolarHBondContact O-N 3.07Å
280	F	88.6	Confident	90.1	Very high	176 Å²	176	48.8 Å²	48.8	77%	0.772	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-67	-18.5	-179.2	-63.8	-73.9	0	0	0	112.4	D278 L282 Q283	D278-F280 PolarHBondContact O-N 3.43Å; D278-F280 VanDerWaalsContact OD1-CB 3.32Å; D278-F280 WeakPolarHBondContact OD1-CB 3.45Å; D278-F280 VanDerWaalsContact OD1-CD2 3.3Å; D278-F280 WeakPolarHBondContact OD1-CD2 3.46Å; D278-F280 PolarHBondContact OD1-N 3.19Å; F280-L282 PolarHBondContact O-N 2.96Å; F280-L282 VanDerWaalsContact O-N 3.14Å; F280-Q283 PolarHBondContact O-N 3.18Å
281	Q	89.1	Confident	89.8	Confident	9 Å²	9	48.9 Å²	48.9	4%	0.042	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-63.3	-17	175.2	-63.6	-56.5	-48.5	0	0	113.6	C249 N257 I259 I274 L275 D278 P279 Q283 A284 P293	C249-Q281 HydrophobicContact CB-CG 3.73Å; C249-Q281 PolarHBondContact O-OE1 3.29Å; N257-Q281 PolarHBondContact ND2-OE1 3.27Å; I259-Q281 HydrophobicContact CB-CB 4.44Å; I259-Q281 HydrophobicContact CD1-CB 3.88Å; I259-Q281 HydrophobicContact CG2-CB 4.23Å; I274-Q281 HydrophobicContact CG2-CB 4.11Å; I274-Q281 HydrophobicContact CG2-CG 3.9Å; L275-Q281 HydrophobicContact CD2-CB 4.32Å; D278-Q281 HydrophobicContact CB-CG 4.05Å; D278-Q281 PolarHBondContact O-N 3.26Å; D278-Q281 WeakPolarHBondContact OD2-CG 3.48Å; D278-Q281 PolarHBondContact OD2-NE2 3.34Å; P279-Q281 PolarHBondContact O-N 2.93Å; Q281-Q283 PolarHBondContact O-N 3.32Å; Q281-A284 WeakPolarHBondContact O-CB 3.23Å; Q281-A284 PolarHBondContact O-N 3.28Å; Q281-P293 VanDerWaalsContact O-CG 3.25Å; Q281-P293 WeakPolarHBondContact O-CG 3.48Å
282	L	88.8	Confident	89.8	Confident	20 Å²	20	48.9 Å²	48.9	11%	0.105	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-57.3	-31.2	174.2	-75.7	168.4	0	0	0	113.3	L275 P279 F280 P293 L306 R309	L275-L282 HydrophobicContact CD1-CD2 3.75Å; L275-L282 HydrophobicContact CD2-CD2 3.64Å; L275-L282 HydrophobicContact CD2-CG 3.6Å; L275-L282 HydrophobicContact CG-CD2 4.34Å; P279-L282 WeakPolarHBondContact O-CB 3.37Å; P279-L282 WeakPolarHBondContact O-CG 3.3Å; P279-L282 PolarHBondContact O-N 3.07Å; F280-L282 PolarHBondContact O-N 2.96Å; F280-L282 VanDerWaalsContact O-N 3.14Å; L282-P293 VanDerWaalsContact O-CD 3.25Å; L282-P293 WeakPolarHBondContact O-CD 3.19Å; L282-L306 HydrophobicContact CD2-CD2 3.84Å; L282-R309 HydrophobicContact CD1-CB 3.89Å; L282-R309 WeakPolarHBondContact CD1-O 3.38Å; L282-R309 HydrophobicContact CD2-CB 3.97Å
283	Q	88.6	Confident	89.7	Confident	68 Å²	68	46.6 Å²	46.6	32%	0.318	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-113.7	15.4	-178.2	-59.5	-64.7	2.3	0	0	112.3	F280 Q281 E285 E312	F280-Q283 PolarHBondContact O-N 3.18Å; Q281-Q283 PolarHBondContact O-N 3.32Å; Q283-E285 PolarHBondContact O-N 2.86Å; Q283-E312 VanDerWaalsContact NE2-CB 3.33Å
284	A	90.1	Very high	89.7	Confident	13 Å²	13	44.8 Å²	44.8	11%	0.107	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-62.4	130.6	175.2	0	0	0	0	0	110	N257 I259 H260 Q281 T292 P293	N257-A284 WeakPolarHBondContact ND2-CB 3.4Å; I259-A284 HydrophobicContact CG2-CB 4.44Å; H260-A284 PolarHBondContact CE1-O 3.21Å; H260-A284 PolarHBondContact NE2-O 2.97Å; Q281-A284 WeakPolarHBondContact O-CB 3.23Å; Q281-A284 PolarHBondContact O-N 3.28Å; A284-T292 WeakPolarHBondContact O-CA 3.22Å; A284-P293 WeakPolarHBondContact O-CD 3.12Å
285	E	90.1	Very high	89.7	Confident	63 Å²	63	45.4 Å²	45.4	29%	0.294	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-89.4	135.9	175.2	-66.9	-174.6	172.1	0	0	111.5	Q283 Y315 K318	Q283-E285 PolarHBondContact O-N 2.86Å; E285-Y315 PolarHBondContact OE1-OH 2.74Å; E285-K318 WeakPolarHBondContact OE2-CE 3.47Å; E285-K318 IonicContact OE2-NZ 2.93Å; E285-K318 PolarHBondContact OE2-NZ 3.29Å
286	D	88.6	Confident	89.7	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-62.4	144.3	163.5	173.1	37.7	0	0	0	111.7	V288 Y289 G290 G291 W296	D286-V288 PolarHBondContact OD1-N 3.19Å; D286-V288 PolarHBondContact OD2-N 3.06Å; D286-Y289 WeakPolarHBondContact OD2-CD2 3.49Å; D286-Y289 PolarHBondContact OD2-N 2.88Å; D286-Y289 VanDerWaalsContact OD2-N 3.12Å; D286-G290 WeakPolarHBondContact O-CA 3.39Å; D286-G290 PolarHBondContact O-N 2.89Å; D286-G291 PolarHBondContact N-O 3.2Å; D286-W296 HydrophobicContact CB-CZ2 4.45Å; D286-W296 WeakPolarHBondContact OD2-CZ2 3.21Å
287	C	81.9	Confident	89.8	Confident	63 Å²	63	41.6 Å²	41.6	43%	0.426	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-30.2	-179.4	59.5	0	0	0	0	113
288	V	84.6	Confident	89.7	Confident	89 Å²	89	42.6 Å²	42.6	54%	0.539	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-55.7	-175.5	-175.6	0	0	0	0	111	D286	D286-V288 PolarHBondContact OD1-N 3.19Å; D286-V288 PolarHBondContact OD2-N 3.06Å
289	Y	86.5	Confident	89.8	Confident	126 Å²	126	43.7 Å²	43.7	49%	0.494	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-12.2	-173.5	-54.4	-70	0	0	0	113.6	D286 G291 W296 S317 K318 T319	D286-Y289 WeakPolarHBondContact OD2-CD2 3.49Å; D286-Y289 PolarHBondContact OD2-N 2.88Å; D286-Y289 VanDerWaalsContact OD2-N 3.12Å; Y289-G291 PolarHBondContact O-N 3.48Å; Y289-W296 HydrophobicContact CD2-CZ2 4.08Å; Y289-W296 HydrophobicContact CE2-CH2 4.45Å; Y289-W296 HydrophobicContact CE2-CZ2 4.34Å; Y289-S317 WeakPolarHBondContact O-CB 3.41Å; Y289-K318 WeakPolarHBondContact O-CB 3.37Å; Y289-K318 PolarHBondContact O-N 3.01Å; Y289-T319 HydrophobicContact CD1-CG2 4.21Å
290	G	87.7	Confident	89.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.203	C	C	.	.			trans	66.2	22.4	-170.5	0	0	0	0	0	113.4	D286 S317	D286-G290 WeakPolarHBondContact O-CA 3.39Å; D286-G290 PolarHBondContact O-N 2.89Å; G290-S317 WeakPolarHBondContact O-CA 3.44Å
291	G	89.3	Confident	90.1	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.01	19%	0.189	C	C	.	.			trans	-85.3	141.1	179.4	0	0	0	0	0	111.5	H260 D286 Y289	H260-G291 PolarHBondContact NE2-O 3.04Å; D286-G291 PolarHBondContact N-O 3.2Å; Y289-G291 PolarHBondContact O-N 3.48Å
292	T	92.9	Very high	90.3	Very high	1 Å²	1	37 Å²	37	1%	0.006	19%	0.188	C	C	.	.			trans	-70	168.4	171.2	63	0	0	0	0	111.5	A284 L294 H295 Y315	A284-T292 WeakPolarHBondContact O-CA 3.22Å; T292-L294 PolarHBondContact O-N 3.34Å; T292-H295 PolarHBondContact N-ND1 2.68Å; T292-H295 VanDerWaalsContact N-ND1 3.16Å; T292-H295 WeakPolarHBondContact O-CB 3.4Å; T292-H295 PolarHBondContact O-N 2.99Å; T292-H295 PolarHBondContact OG1-CE1 3.33Å; T292-H295 PolarHBondContact OG1-ND1 3.01Å; T292-Y315 HydrophobicContact CG2-CD1 3.51Å; T292-Y315 HydrophobicContact CG2-CE1 3.86Å; T292-Y315 HydrophobicContact CG2-CG 3.88Å
293	P	93.5	Very high	90.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-51.6	-32.9	174.7	-27.3	35.7	0	0	0	113.3	I259 M263 Q281 L282 A284 H295 W296 A297 L306	I259-P293 HydrophobicContact CD1-CB 4.18Å; I259-P293 HydrophobicContact CD1-CG 3.87Å; I259-P293 HydrophobicContact CG1-CB 4.26Å; I259-P293 HydrophobicContact CG1-CG 4.16Å; I259-P293 HydrophobicContact CG2-CG 3.96Å; M263-P293 WeakPolarHBondContact CE-O 3.16Å; M263-P293 HydrophobicContact CG-CB 3.93Å; M263-P293 HydrophobicContact SD-CB 4.49Å; Q281-P293 VanDerWaalsContact O-CG 3.25Å; Q281-P293 WeakPolarHBondContact O-CG 3.48Å; L282-P293 VanDerWaalsContact O-CD 3.25Å; L282-P293 WeakPolarHBondContact O-CD 3.19Å; A284-P293 WeakPolarHBondContact O-CD 3.12Å; P293-H295 VanDerWaalsContact C-N 3.29Å; P293-H295 PolarHBondContact O-N 3.26Å; P293-W296 PolarHBondContact O-N 3.16Å; P293-A297 PolarHBondContact O-N 3.47Å; P293-L306 HydrophobicContact CB-CD1 3.98Å; P293-L306 HydrophobicContact CB-CD2 4.29Å
294	L	94.6	Very high	90.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-33.3	177.7	-166.9	64.2	0	0	0	112.9	T292 W296 A297 L306 L307 A323 L339	T292-L294 PolarHBondContact O-N 3.34Å; L294-W296 PolarHBondContact O-N 3.3Å; L294-A297 VanDerWaalsContact O-CB 3.31Å; L294-A297 WeakPolarHBondContact O-CB 3.35Å; L294-A297 PolarHBondContact O-N 2.95Å; L294-L306 HydrophobicContact CB-CD1 4.13Å; L294-L306 HydrophobicContact CD1-CB 4.14Å; L294-L306 HydrophobicContact CD1-CD1 3.95Å; L294-L307 HydrophobicContact CD2-CD2 4.39Å; L294-A323 HydrophobicContact CB-CB 4.26Å; L294-A323 HydrophobicContact CD2-CB 3.92Å; L294-A323 HydrophobicContact CG-CB 3.71Å; L294-L339 HydrophobicContact CD1-CD2 3.93Å; L294-L339 HydrophobicContact CD2-CD2 4.05Å; L294-L339 HydrophobicContact CG-CD2 4.2Å
295	H	93.8	Very high	90.9	Very high	12 Å²	12	36.5 Å²	36.5	6%	0.056	18%	0.179	C	C	.	.	H	α-helix	trans	-66.5	-26.6	175.7	-66.8	75.2	0	0	0	112.4	T292 P293 Y315 E321 S322 A323 V326	T292-H295 PolarHBondContact N-ND1 2.68Å; T292-H295 VanDerWaalsContact N-ND1 3.16Å; T292-H295 WeakPolarHBondContact O-CB 3.4Å; T292-H295 PolarHBondContact O-N 2.99Å; T292-H295 PolarHBondContact OG1-CE1 3.33Å; T292-H295 PolarHBondContact OG1-ND1 3.01Å; P293-H295 VanDerWaalsContact C-N 3.29Å; P293-H295 PolarHBondContact O-N 3.26Å; H295-Y315 AromaticContact CE1-CD1 3.96Å; H295-Y315 PolarHBondContact NE2-O 2.87Å; H295-E321 PolarHBondContact NE2-O 2.81Å; H295-S322 VanDerWaalsContact NE2-C 3.32Å; H295-S322 WeakPolarHBondContact NE2-CA 3.34Å; H295-A323 PolarHBondContact CD2-N 3.34Å; H295-A323 PolarHBondContact NE2-N 2.84Å; H295-A323 VanDerWaalsContact NE2-N 3.18Å; H295-V326 WeakPolarHBondContact O-CG1 3.5Å
296	W	91.8	Very high	91.1	Very high	54 Å²	54	33.5 Å²	33.5	21%	0.205	17%	0.165	C	C	.	.	H	α-helix	trans	-88.6	-8.5	179.5	-71.7	86.9	0	0	0	113.3	H260 M263 K264 D286 Y289 P293 L294 K298	H260-W296 AromaticContact CD2-CD1 3.6Å; H260-W296 AromaticContact CD2-NE1 3.81Å; M263-W296 HydrophobicContact CB-CB 3.77Å; K264-W296 HydrophobicContact CB-CE3 4.14Å; K264-W296 HydrophobicContact CB-CZ3 4.44Å; K264-W296 HydrophobicContact CD-CZ3 4.11Å; K264-W296 HydrophobicContact CG-CE3 4.37Å; K264-W296 HydrophobicContact CG-CZ3 4.26Å; D286-W296 HydrophobicContact CB-CZ2 4.45Å; D286-W296 WeakPolarHBondContact OD2-CZ2 3.21Å; Y289-W296 HydrophobicContact CD2-CZ2 4.08Å; Y289-W296 HydrophobicContact CE2-CH2 4.45Å; Y289-W296 HydrophobicContact CE2-CZ2 4.34Å; P293-W296 PolarHBondContact O-N 3.16Å; L294-W296 PolarHBondContact O-N 3.3Å; W296-K298 PolarHBondContact O-N 2.93Å
297	A	93.2	Very high	91.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.			trans	-60.2	134.6	-178.8	0	0	0	0	0	112	M263 P293 L294 M302 C303 L327 R332	M263-A297 HydrophobicContact CE-CB 3.63Å; P293-A297 PolarHBondContact O-N 3.47Å; L294-A297 VanDerWaalsContact O-CB 3.31Å; L294-A297 WeakPolarHBondContact O-CB 3.35Å; L294-A297 PolarHBondContact O-N 2.95Å; A297-M302 HydrophobicContact CB-CB 4.43Å; A297-C303 VanDerWaalsContact CB-SG 3.56Å; A297-L327 WeakPolarHBondContact O-CD2 3.25Å; A297-R332 PolarHBondContact O-NH1 3.27Å
298	K	90.6	Very high	91.6	Very high	84 Å²	84	36.9 Å²	36.9	37%	0.365	18%	0.179	S	C	.	.			trans	-108.4	-31.6	-179.7	-55.6	-167.7	168.5	168.5	0	114	K264 W296 R332	K264-K298 WeakPolarHBondContact O-CE 3.39Å; K264-K298 PolarHBondContact O-NZ 3.33Å; W296-K298 PolarHBondContact O-N 2.93Å; K298-R332 WeakPolarHBondContact O-CD 3.35Å
299	T	92.9	Very high	91.8	Very high	59 Å²	59	37.2 Å²	37.2	36%	0.362	17%	0.171	S	C	.	.	S	Bend	trans	-119.3	154.7	-172.7	60.6	0	0	0	0	110.2	E301 M302 C303	T299-E301 PolarHBondContact O-N 3.28Å; T299-M302 PolarHBondContact O-N 3.45Å; T299-M302 WeakPolarHBondContact OG1-CG 3.41Å; T299-M302 PolarHBondContact OG1-N 2.97Å; T299-C303 PolarHBondContact O-N 3.04Å
300	A	91.6	Very high	91.8	Very high	19 Å²	19	34 Å²	34	16%	0.157	18%	0.176	C	C	.	.	H	α-helix	trans	-55	-38.2	174.3	0	0	0	0	0	112.3	M302 C303 R304 E334 V338	A300-M302 PolarHBondContact O-N 3.46Å; A300-C303 PolarHBondContact O-N 2.95Å; A300-R304 WeakPolarHBondContact O-CG 3.4Å; A300-R304 PolarHBondContact O-N 3.38Å; A300-E334 HydrophobicContact CB-CB 4.21Å; A300-V338 HydrophobicContact CB-CG2 3.62Å
301	E	91.8	Very high	91.9	Very high	103 Å²	103	34.4 Å²	34.4	48%	0.481	18%	0.179	S	C	.	.	H	α-helix	trans	-62.1	-42.5	178	-70.6	-176.3	-174.4	0	0	113.4	T299 R304 L305	T299-E301 PolarHBondContact O-N 3.28Å; E301-R304 PolarHBondContact O-N 3.35Å; E301-L305 WeakPolarHBondContact O-CB 3.49Å; E301-L305 PolarHBondContact O-N 3.37Å
302	M	93.8	Very high	92	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-70.4	-37.6	179.3	-62.5	-64.5	-71.1	0	0	110.9	M263 K268 V271 A297 T299 A300 L306	M263-M302 HydrophobicContact CE-CB 3.84Å; M263-M302 HydrophobicContact CE-CE 3.93Å; M263-M302 HydrophobicContact SD-CE 3.45Å; M263-M302 WeakPolarHBondContact SD-CE 3.32Å; K268-M302 HydrophobicContact CB-SD 3.82Å; K268-M302 HydrophobicContact CG-SD 4.41Å; V271-M302 HydrophobicContact CB-CE 4.25Å; V271-M302 HydrophobicContact CG2-CE 3.59Å; A297-M302 HydrophobicContact CB-CB 4.43Å; T299-M302 PolarHBondContact O-N 3.45Å; T299-M302 WeakPolarHBondContact OG1-CG 3.41Å; T299-M302 PolarHBondContact OG1-N 2.97Å; A300-M302 PolarHBondContact O-N 3.46Å; M302-L306 WeakPolarHBondContact O-CG 3.49Å; M302-L306 PolarHBondContact O-N 2.93Å
303	C	94.7	Very high	92	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.4	-51.2	171.2	-67.9	0	0	0	0	110.8	A297 T299 A300 L305 L306 L307 V338 L339	A297-C303 VanDerWaalsContact CB-SG 3.56Å; T299-C303 PolarHBondContact O-N 3.04Å; A300-C303 PolarHBondContact O-N 2.95Å; C303-L305 PolarHBondContact O-N 2.95Å; C303-L306 PolarHBondContact O-N 3Å; C303-L307 HydrophobicContact CB-CD1 4.48Å; C303-L307 WeakPolarHBondContact O-CB 3.31Å; C303-L307 WeakPolarHBondContact O-CD1 3.33Å; C303-L307 WeakPolarHBondContact O-CG 3.47Å; C303-L307 PolarHBondContact O-N 2.66Å; C303-V338 HydrophobicContact CB-CB 4.15Å; C303-V338 HydrophobicContact CB-CG1 3.62Å; C303-L339 HydrophobicContact CB-CD2 4.39Å
304	R	92	Very high	92	Very high	74 Å²	74	44.4 Å²	44.4	28%	0.279	23%	0.228	S	C	.	.	H	α-helix	trans	-56.5	-47.7	179.1	-77	-173.9	-88.2	111.9	-11.2	111.9	A300 E301 L306 L307 D308 V338	A300-R304 WeakPolarHBondContact O-CG 3.4Å; A300-R304 PolarHBondContact O-N 3.38Å; E301-R304 PolarHBondContact O-N 3.35Å; R304-L306 VanDerWaalsContact C-N 3.3Å; R304-L306 PolarHBondContact O-N 3.04Å; R304-L307 PolarHBondContact O-N 2.71Å; R304-D308 WeakPolarHBondContact O-CB 3.37Å; R304-D308 PolarHBondContact O-N 3.08Å; R304-V338 HydrophobicContact CG-CG1 3.63Å; R304-V338 HydrophobicContact CG-CG2 4.11Å
305	L	92.9	Very high	91.9	Very high	15 Å²	15	47.5 Å²	47.5	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-54.8	-45.1	178.3	174.8	65.2	0	0	0	112.2	K268 V271 E272 E301 C303 R309	K268-L305 HydrophobicContact CG-CD2 4.08Å; V271-L305 HydrophobicContact CB-CD2 4.08Å; V271-L305 HydrophobicContact CG1-CD2 3.79Å; E272-L305 HydrophobicContact CG-CD1 3.65Å; E272-L305 HydrophobicContact CG-CD2 3.75Å; E272-L305 HydrophobicContact CG-CG 4.36Å; E301-L305 WeakPolarHBondContact O-CB 3.49Å; E301-L305 PolarHBondContact O-N 3.37Å; C303-L305 PolarHBondContact O-N 2.95Å; L305-R309 VanDerWaalsContact O-CG 3.23Å; L305-R309 WeakPolarHBondContact O-CG 3.49Å
306	L	93.6	Very high	91.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-71.1	-39.4	179.9	-67.8	178.6	0	0	0	112.3	M263 V271 L275 L282 P293 L294 M302 C303 R304 R309 C311	M263-L306 HydrophobicContact CE-CD1 3.46Å; M263-L306 VanDerWaalsContact CE-CD1 3.46Å; M263-L306 HydrophobicContact CE-CG 4.27Å; M263-L306 HydrophobicContact SD-CD1 3.96Å; M263-L306 HydrophobicContact SD-CD2 4.41Å; M263-L306 HydrophobicContact SD-CG 4.4Å; V271-L306 HydrophobicContact CG1-CD2 4.26Å; L275-L306 HydrophobicContact CD1-CD2 4.03Å; L282-L306 HydrophobicContact CD2-CD2 3.84Å; P293-L306 HydrophobicContact CB-CD1 3.98Å; P293-L306 HydrophobicContact CB-CD2 4.29Å; L294-L306 HydrophobicContact CB-CD1 4.13Å; L294-L306 HydrophobicContact CD1-CB 4.14Å; L294-L306 HydrophobicContact CD1-CD1 3.95Å; M302-L306 WeakPolarHBondContact O-CG 3.49Å; M302-L306 PolarHBondContact O-N 2.93Å; C303-L306 PolarHBondContact O-N 3Å; R304-L306 VanDerWaalsContact C-N 3.3Å; R304-L306 PolarHBondContact O-N 3.04Å; L306-R309 PolarHBondContact O-N 3.41Å; L306-C311 HydrophobicContact CB-CB 4.18Å; L306-C311 VanDerWaalsContact O-CB 3.22Å; L306-C311 WeakPolarHBondContact O-CB 3.48Å; L306-C311 PolarHBondContact O-N 3.16Å
307	L	92.1	Very high	91.9	Very high	16 Å²	16	48.2 Å²	48.2	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-68.3	-40	-179.9	-66.8	168.4	0	0	0	112.2	L294 C303 R304 R309 G310 I313 V338 L339 H342	L294-L307 HydrophobicContact CD2-CD2 4.39Å; C303-L307 HydrophobicContact CB-CD1 4.48Å; C303-L307 WeakPolarHBondContact O-CB 3.31Å; C303-L307 WeakPolarHBondContact O-CD1 3.33Å; C303-L307 WeakPolarHBondContact O-CG 3.47Å; C303-L307 PolarHBondContact O-N 2.66Å; R304-L307 PolarHBondContact O-N 2.71Å; L307-R309 PolarHBondContact O-N 3.39Å; L307-G310 PolarHBondContact O-N 2.85Å; L307-I313 HydrophobicContact CD2-CD1 3.62Å; L307-I313 HydrophobicContact CD2-CG1 3.47Å; L307-I313 VanDerWaalsContact CD2-CG1 3.47Å; L307-V338 HydrophobicContact CD1-CG1 3.61Å; L307-L339 HydrophobicContact CD1-CD2 4.12Å; L307-H342 HydrophobicContact CD1-CB 3.83Å; L307-H342 HydrophobicContact CD2-CB 4.42Å
308	D	89.4	Confident	91.8	Very high	119 Å²	119	54.7 Å²	54.7	64%	0.636	28%	0.277	S	S	*	.	H	α-helix	trans	-63.9	-20.4	176.2	-69.4	-18.8	0	0	0	112.1	R304	R304-D308 WeakPolarHBondContact O-CB 3.37Å; R304-D308 PolarHBondContact O-N 3.08Å
309	R	89.1	Confident	91.7	Very high	96 Å²	96	53 Å²	53	36%	0.362	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	4.7	175	-59.3	-68.7	175.7	74.6	7.9	113.4	L275 L282 L305 L306 L307	L275-R309 HydrophobicContact CD1-CG 4.33Å; L282-R309 HydrophobicContact CD1-CB 3.89Å; L282-R309 WeakPolarHBondContact CD1-O 3.38Å; L282-R309 HydrophobicContact CD2-CB 3.97Å; L305-R309 VanDerWaalsContact O-CG 3.23Å; L305-R309 WeakPolarHBondContact O-CG 3.49Å; L306-R309 PolarHBondContact O-N 3.41Å; L307-R309 PolarHBondContact O-N 3.39Å
310	G	87.4	Confident	91.6	Very high	59 Å²	59	51.2 Å²	51.2	61%	0.608	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	28.5	175.6	0	0	0	0	0	114.8	L307	L307-G310 PolarHBondContact O-N 2.85Å
311	C	89.9	Confident	91.7	Very high	8 Å²	8	51.3 Å²	51.3	5%	0.054	26%	0.264	C	S	.	.			trans	-61	141.2	173.7	-174.5	0	0	0	0	111.9	L306 I313	L306-C311 HydrophobicContact CB-CB 4.18Å; L306-C311 VanDerWaalsContact O-CB 3.22Å; L306-C311 WeakPolarHBondContact O-CB 3.48Å; L306-C311 PolarHBondContact O-N 3.16Å; C311-I313 PolarHBondContact O-N 2.93Å
312	E	90.9	Very high	91.9	Very high	112 Å²	112	46.4 Å²	46.4	52%	0.523	24%	0.242	S	C	.	.			trans	-69.1	121.8	172	-72.9	176.4	-164.2	0	0	110.6	Q283	Q283-E312 VanDerWaalsContact NE2-CB 3.33Å
313	I	92.3	Very high	92	Very high	31 Å²	31	46.3 Å²	46.3	16%	0.159	24%	0.241	C	C	.	.	S	Bend	trans	-81.1	-40.5	-172.4	-50	-174.2	0	0	0	111.7	L307 C311 Y315 H342 A344	L307-I313 HydrophobicContact CD2-CD1 3.62Å; L307-I313 HydrophobicContact CD2-CG1 3.47Å; L307-I313 VanDerWaalsContact CD2-CG1 3.47Å; C311-I313 PolarHBondContact O-N 2.93Å; I313-Y315 VanDerWaalsContact C-N 3.34Å; I313-H342 HydrophobicContact CD1-CB 3.88Å; I313-H342 WeakPolarHBondContact CD1-O 3.48Å; I313-A344 HydrophobicContact CG2-CB 3.57Å
314	N	92.9	Very high	92	Very high	70 Å²	70	46.5 Å²	46.5	37%	0.374	24%	0.242	S	C	.	.	S	Bend	trans	-96.9	20	-171.7	-63.7	-44.5	0	0	0	112.8	N345 L348	N314-N345 PolarHBondContact OD1-N 2.59Å; N314-L348 HydrophobicContact CB-CD2 4.18Å
315	Y	93	Very high	92.2	Very high	65 Å²	65	43.1 Å²	43.1	26%	0.255	23%	0.229	S	C	.	.			trans	-62.5	138.8	175	-168.8	-95.8	0	0	0	110.6	E285 T292 H295 I313 S322	E285-Y315 PolarHBondContact OE1-OH 2.74Å; T292-Y315 HydrophobicContact CG2-CD1 3.51Å; T292-Y315 HydrophobicContact CG2-CE1 3.86Å; T292-Y315 HydrophobicContact CG2-CG 3.88Å; H295-Y315 AromaticContact CE1-CD1 3.96Å; H295-Y315 PolarHBondContact NE2-O 2.87Å; I313-Y315 VanDerWaalsContact C-N 3.34Å; Y315-S322 WeakPolarHBondContact O-CA 3.5Å; Y315-S322 WeakPolarHBondContact O-CB 3.11Å
316	L	93.9	Very high	92.3	Very high	69 Å²	69	43.6 Å²	43.6	36%	0.361	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-104.9	126.6	175.2	-67.6	175	0	0	0	109.3	L348	L316-L348 HydrophobicContact CD2-CD2 3.78Å; L316-L348 HydrophobicContact CD2-CG 4.13Å; L316-L348 HydrophobicContact CG-CD2 4.36Å
317	S	92.9	Very high	92.4	Very high	11 Å²	11	43.7 Å²	43.7	8%	0.077	23%	0.233	C	C	.	.			trans	-63.5	174	173.3	74.5	0	0	0	0	112	Y289 G290 T319 G320 E321	Y289-S317 WeakPolarHBondContact O-CB 3.41Å; G290-S317 WeakPolarHBondContact O-CA 3.44Å; S317-T319 PolarHBondContact O-N 3.49Å; S317-T319 PolarHBondContact OG-N 3.19Å; S317-T319 PolarHBondContact OG-OG1 3.2Å; S317-G320 WeakPolarHBondContact O-CA 3.39Å; S317-G320 PolarHBondContact O-N 3.39Å; S317-G320 PolarHBondContact OG-N 3.12Å; S317-E321 WeakPolarHBondContact CB-O 3.32Å; S317-E321 PolarHBondContact N-O 2.7Å; S317-E321 PolarHBondContact OG-N 2.94Å; S317-E321 VanDerWaalsContact OG-N 3.09Å; S317-E321 PolarHBondContact OG-O 3.17Å
318	K	90.2	Very high	92.5	Very high	137 Å²	137	42.9 Å²	42.9	60%	0.596	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.4	172.8	-70.1	168.9	-172.6	155.6	0	113	E285 Y289	E285-K318 WeakPolarHBondContact OE2-CE 3.47Å; E285-K318 IonicContact OE2-NZ 2.93Å; E285-K318 PolarHBondContact OE2-NZ 3.29Å; Y289-K318 WeakPolarHBondContact O-CB 3.37Å; Y289-K318 PolarHBondContact O-N 3.01Å
319	T	89	Confident	92.7	Very high	48 Å²	48	41.2 Å²	41.2	29%	0.294	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-2.7	171.7	60.1	0	0	0	0	112.8	Y289 S317 E321 Q351	Y289-T319 HydrophobicContact CD1-CG2 4.21Å; S317-T319 PolarHBondContact O-N 3.49Å; S317-T319 PolarHBondContact OG-N 3.19Å; S317-T319 PolarHBondContact OG-OG1 3.2Å; T319-E321 VanDerWaalsContact C-N 3.31Å; T319-Q351 WeakPolarHBondContact O-CB 3.13Å
320	G	91	Very high	92.9	Very high	21 Å²	21	43.1 Å²	43.1	22%	0.216	23%	0.227	C	C	.	.	S	Bend	trans	74.5	17.8	-174.9	0	0	0	0	0	113.1	S317 G350 Q351	S317-G320 WeakPolarHBondContact O-CA 3.39Å; S317-G320 PolarHBondContact O-N 3.39Å; S317-G320 PolarHBondContact OG-N 3.12Å; G320-G350 CarbonylContact O-C 3.55Å; G320-G350 WeakPolarHBondContact O-CA 3.3Å; G320-Q351 PolarHBondContact O-N 3.4Å
321	E	93.4	Very high	93.3	Very high	22 Å²	22	41.9 Å²	41.9	10%	0.103	21%	0.214	C	C	.	.			trans	-96.9	137.5	176.7	-68.6	-178.3	137.7	0	0	109.4	H295 S317 T319 H325 V326 K329 Q351	H295-E321 PolarHBondContact NE2-O 2.81Å; S317-E321 WeakPolarHBondContact CB-O 3.32Å; S317-E321 PolarHBondContact N-O 2.7Å; S317-E321 PolarHBondContact OG-N 2.94Å; S317-E321 VanDerWaalsContact OG-N 3.09Å; S317-E321 PolarHBondContact OG-O 3.17Å; T319-E321 VanDerWaalsContact C-N 3.31Å; E321-H325 HydrophobicContact CB-CB 4.12Å; E321-H325 HydrophobicContact CG-CB 4.45Å; E321-V326 HydrophobicContact CB-CG2 4.21Å; E321-K329 IonicContact OE1-NZ 2.68Å; E321-K329 PolarHBondContact OE1-NZ 3.24Å; E321-K329 IonicContact OE2-NZ 3.03Å; E321-Q351 HydrophobicContact CG-CB 4.27Å
322	S	95.3	Very high	93.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-88.2	167.6	167.1	76.3	0	0	0	0	111.4	H295 Y315 L324 H325 V326	H295-S322 VanDerWaalsContact NE2-C 3.32Å; H295-S322 WeakPolarHBondContact NE2-CA 3.34Å; Y315-S322 WeakPolarHBondContact O-CA 3.5Å; Y315-S322 WeakPolarHBondContact O-CB 3.11Å; S322-L324 PolarHBondContact O-N 3.43Å; S322-L324 PolarHBondContact OG-N 2.89Å; S322-H325 PolarHBondContact N-ND1 3.35Å; S322-H325 VanDerWaalsContact N-ND1 3.16Å; S322-H325 WeakPolarHBondContact O-CB 3.38Å; S322-H325 PolarHBondContact O-N 3.3Å; S322-H325 PolarHBondContact OG-N 3.49Å; S322-H325 PolarHBondContact OG-ND1 2.89Å; S322-V326 PolarHBondContact O-N 3.4Å; S322-V326 VanDerWaalsContact O-N 3.09Å
323	A	95.3	Very high	93.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-55.2	-38.9	175.5	0	0	0	0	0	111.9	L294 H295 H325 V326 L327 L339	L294-A323 HydrophobicContact CB-CB 4.26Å; L294-A323 HydrophobicContact CD2-CB 3.92Å; L294-A323 HydrophobicContact CG-CB 3.71Å; H295-A323 PolarHBondContact CD2-N 3.34Å; H295-A323 PolarHBondContact NE2-N 2.84Å; H295-A323 VanDerWaalsContact NE2-N 3.18Å; A323-H325 PolarHBondContact O-N 3.48Å; A323-V326 PolarHBondContact O-N 3.49Å; A323-L327 WeakPolarHBondContact O-CG 3.33Å; A323-L327 PolarHBondContact O-N 3.49Å; A323-L339 HydrophobicContact CB-CD1 3.78Å
324	L	96.6	Very high	93.8	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-44	174.9	-175.3	63	0	0	0	111.7	S322 V326 L327 T328 A336 L339 L340 A344 A356 L372	S322-L324 PolarHBondContact O-N 3.43Å; S322-L324 PolarHBondContact OG-N 2.89Å; L324-V326 VanDerWaalsContact C-N 3.34Å; L324-V326 PolarHBondContact O-N 3.28Å; L324-L327 PolarHBondContact O-N 3.28Å; L324-T328 WeakPolarHBondContact O-CB 3.44Å; L324-T328 PolarHBondContact O-N 2.99Å; L324-T328 PolarHBondContact O-OG1 3.14Å; L324-A336 HydrophobicContact CD1-CB 4.01Å; L324-L339 HydrophobicContact CB-CD1 4.13Å; L324-L339 HydrophobicContact CD1-CB 4.44Å; L324-L340 HydrophobicContact CD1-CD2 4.3Å; L324-L340 HydrophobicContact CD1-CG 4.22Å; L324-L340 HydrophobicContact CD2-CD2 3.88Å; L324-A344 HydrophobicContact CD2-CB 4.29Å; L324-A356 HydrophobicContact CD2-CB 3.83Å; L324-A356 HydrophobicContact CG-CB 3.86Å; L324-L372 HydrophobicContact CD2-CD2 4.11Å
325	H	95.8	Very high	93.8	Very high	3 Å²	3	40.1 Å²	40.1	1%	0.014	20%	0.199	C	C	.	.	H	α-helix	trans	-58.4	-45.5	175.9	-67.4	96.3	0	0	0	111.9	E321 S322 A323 T328 K329 L348 N354 A356 L359	E321-H325 HydrophobicContact CB-CB 4.12Å; E321-H325 HydrophobicContact CG-CB 4.45Å; S322-H325 PolarHBondContact N-ND1 3.35Å; S322-H325 VanDerWaalsContact N-ND1 3.16Å; S322-H325 WeakPolarHBondContact O-CB 3.38Å; S322-H325 PolarHBondContact O-N 3.3Å; S322-H325 PolarHBondContact OG-N 3.49Å; S322-H325 PolarHBondContact OG-ND1 2.89Å; A323-H325 PolarHBondContact O-N 3.48Å; H325-T328 PolarHBondContact O-N 3.01Å; H325-K329 VanDerWaalsContact O-CB 3.29Å; H325-K329 WeakPolarHBondContact O-CB 3.45Å; H325-K329 PolarHBondContact O-N 3.23Å; H325-L348 PolarHBondContact CE1-O 3.23Å; H325-L348 PolarHBondContact NE2-O 3.4Å; H325-N354 PolarHBondContact NE2-O 3.13Å; H325-A356 PolarHBondContact NE2-N 3.14Å; H325-L359 HydrophobicContact CB-CD1 3.7Å
326	V	94.7	Very high	94	Very high	26 Å²	26	37 Å²	37	16%	0.158	19%	0.187	C	C	.	.	H	α-helix	trans	-64.1	-45.9	-180	179.7	0	0	0	0	111.1	H295 E321 S322 A323 L324 T328 K329 K330	H295-V326 WeakPolarHBondContact O-CG1 3.5Å; E321-V326 HydrophobicContact CB-CG2 4.21Å; S322-V326 PolarHBondContact O-N 3.4Å; S322-V326 VanDerWaalsContact O-N 3.09Å; A323-V326 PolarHBondContact O-N 3.49Å; L324-V326 VanDerWaalsContact C-N 3.34Å; L324-V326 PolarHBondContact O-N 3.28Å; V326-T328 PolarHBondContact O-N 3.22Å; V326-K329 PolarHBondContact O-N 2.83Å; V326-K330 WeakPolarHBondContact O-CB 3.48Å; V326-K330 VanDerWaalsContact O-CG 3.3Å; V326-K330 WeakPolarHBondContact O-CG 3.25Å; V326-K330 PolarHBondContact O-N 3.32Å; V326-K330 VanDerWaalsContact O-N 3.08Å
327	L	95.4	Very high	94	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-63.3	-41.7	178	-66.7	-177.5	0	0	0	111.9	A297 A323 L324 K330 G331 R332 A335 A336 L339	A297-L327 WeakPolarHBondContact O-CD2 3.25Å; A323-L327 WeakPolarHBondContact O-CG 3.33Å; A323-L327 PolarHBondContact O-N 3.49Å; L324-L327 PolarHBondContact O-N 3.28Å; L327-K330 CarbonylContact O-C 3.58Å; L327-K330 PolarHBondContact O-N 3.2Å; L327-G331 PolarHBondContact O-N 3.01Å; L327-R332 HydrophobicContact CB-CB 4.43Å; L327-R332 HydrophobicContact CD2-CB 4.12Å; L327-R332 PolarHBondContact O-N 3.26Å; L327-A335 HydrophobicContact CD1-CB 3.8Å; L327-A335 WeakPolarHBondContact CD1-O 3.4Å; L327-A335 HydrophobicContact CD2-CB 4.01Å; L327-A336 HydrophobicContact CB-CB 4.23Å; L327-L339 HydrophobicContact CD1-CD1 3.43Å; L327-L339 VanDerWaalsContact CD1-CD1 3.43Å; L327-L339 HydrophobicContact CD1-CG 3.81Å; L327-L339 HydrophobicContact CG-CD1 4.38Å
328	T	95.1	Very high	94.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.2	-45.3	177.1	-61.5	0	0	0	0	111.9	L324 H325 V326 K330 G331 A356 L359 A360 H365 L368 L372	L324-T328 WeakPolarHBondContact O-CB 3.44Å; L324-T328 PolarHBondContact O-N 2.99Å; L324-T328 PolarHBondContact O-OG1 3.14Å; H325-T328 PolarHBondContact O-N 3.01Å; V326-T328 PolarHBondContact O-N 3.22Å; T328-K330 PolarHBondContact O-N 2.82Å; T328-G331 PolarHBondContact O-N 3.23Å; T328-G331 VanDerWaalsContact O-N 3.1Å; T328-A356 WeakPolarHBondContact CG2-O 3.43Å; T328-L359 HydrophobicContact CG2-CB 4.11Å; T328-A360 HydrophobicContact CG2-CB 3.57Å; T328-H365 PolarHBondContact O-CE1 2.92Å; T328-H365 VanDerWaalsContact O-CE1 3.29Å; T328-H365 PolarHBondContact O-ND1 3.21Å; T328-L368 HydrophobicContact CG2-CD1 4.32Å; T328-L372 HydrophobicContact CG2-CD1 4.4Å
329	K	93.6	Very high	94.3	Very high	84 Å²	84	27.2 Å²	27.2	37%	0.365	14%	0.142	S	C	.	.	H	α-helix	trans	-61	-30.5	176.5	-170.2	-179.6	-168.5	169.9	0	112.5	E321 H325 V326 M363	E321-K329 IonicContact OE1-NZ 2.68Å; E321-K329 PolarHBondContact OE1-NZ 3.24Å; E321-K329 IonicContact OE2-NZ 3.03Å; H325-K329 VanDerWaalsContact O-CB 3.29Å; H325-K329 WeakPolarHBondContact O-CB 3.45Å; H325-K329 PolarHBondContact O-N 3.23Å; V326-K329 PolarHBondContact O-N 2.83Å; K329-M363 HydrophobicContact CG-CE 4.19Å
330	K	93.4	Very high	94.6	Very high	135 Å²	135	25.2 Å²	25.2	59%	0.587	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-2.1	177.7	-63.6	-62.6	-177.9	-176.2	0	114.1	V326 L327 T328 R332	V326-K330 WeakPolarHBondContact O-CB 3.48Å; V326-K330 VanDerWaalsContact O-CG 3.3Å; V326-K330 WeakPolarHBondContact O-CG 3.25Å; V326-K330 PolarHBondContact O-N 3.32Å; V326-K330 VanDerWaalsContact O-N 3.08Å; L327-K330 CarbonylContact O-C 3.58Å; L327-K330 PolarHBondContact O-N 3.2Å; T328-K330 PolarHBondContact O-N 2.82Å; K330-R332 VanDerWaalsContact C-N 3.34Å; K330-R332 HydrophobicContact CB-CG 4.13Å; K330-R332 PolarHBondContact O-N 2.93Å
331	G	94.2	Very high	94.6	Very high	33 Å²	33	24.6 Å²	24.6	34%	0.34	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	25.6	178.5	0	0	0	0	0	114.6	L327 T328 F333 H365	L327-G331 PolarHBondContact O-N 3.01Å; T328-G331 PolarHBondContact O-N 3.23Å; T328-G331 VanDerWaalsContact O-N 3.1Å; G331-F333 PolarHBondContact O-N 2.99Å; G331-F333 VanDerWaalsContact O-N 3.16Å; G331-H365 WeakPolarHBondContact CA-CE1 3.15Å; G331-H365 WeakPolarHBondContact CA-ND1 3.16Å; G331-H365 PolarHBondContact N-CE1 2.82Å; G331-H365 VanDerWaalsContact N-CE1 3.29Å
332	R	95	Very high	94.5	Very high	64 Å²	64	25.8 Å²	25.8	24%	0.242	13%	0.126	C	C	.	.			trans	-88.1	78.6	-177.3	-64.9	175	179.1	161.4	6.5	110.8	A297 K298 L327 K330 A335 A336	A297-R332 PolarHBondContact O-NH1 3.27Å; K298-R332 WeakPolarHBondContact O-CD 3.35Å; L327-R332 HydrophobicContact CB-CB 4.43Å; L327-R332 HydrophobicContact CD2-CB 4.12Å; L327-R332 PolarHBondContact O-N 3.26Å; K330-R332 VanDerWaalsContact C-N 3.34Å; K330-R332 HydrophobicContact CB-CG 4.13Å; K330-R332 PolarHBondContact O-N 2.93Å; R332-A335 HydrophobicContact CB-CB 4.16Å; R332-A335 PolarHBondContact O-N 3.36Å; R332-A336 WeakPolarHBondContact O-CB 3.24Å; R332-A336 PolarHBondContact O-N 2.89Å
333	F	94.5	Very high	94.2	Very high	26 Å²	26	28 Å²	28	11%	0.114	15%	0.149	C	C	.	.	H	α-helix	trans	-54.2	-60.5	-175.6	177.6	-104.6	0	0	0	113.2	G331 A335 A336 M337 E367 L368 D796 E797 V800	G331-F333 PolarHBondContact O-N 2.99Å; G331-F333 VanDerWaalsContact O-N 3.16Å; F333-A335 VanDerWaalsContact C-N 3.31Å; F333-A335 PolarHBondContact O-N 2.76Å; F333-A336 WeakPolarHBondContact O-CA 3.11Å; F333-A336 WeakPolarHBondContact O-CB 3.46Å; F333-A336 PolarHBondContact O-N 3.37Å; F333-M337 HydrophobicContact CD1-CG 4.27Å; F333-M337 HydrophobicContact CD2-CG 4.18Å; F333-M337 HydrophobicContact CE1-CG 3.89Å; F333-M337 HydrophobicContact CE2-CG 3.79Å; F333-M337 HydrophobicContact CE2-SD 3.8Å; F333-M337 HydrophobicContact CG-CG 4.41Å; F333-M337 HydrophobicContact CZ-CG 3.63Å; F333-M337 HydrophobicContact CZ-SD 3.93Å; F333-M337 WeakPolarHBondContact O-CG 3.42Å; F333-M337 PolarHBondContact O-N 3.2Å; F333-E367 HydrophobicContact CD2-CB 3.82Å; F333-E367 HydrophobicContact CE2-CB 3.9Å; F333-E367 WeakPolarHBondContact CE2-O 3.37Å; F333-E367 HydrophobicContact CG-CB 4.35Å; F333-E367 HydrophobicContact CZ-CB 4.49Å; F333-L368 HydrophobicContact CB-CD2 4.49Å; F333-L368 HydrophobicContact CB-CG 4.39Å; F333-L368 HydrophobicContact CD2-CD2 4.02Å; F333-L368 HydrophobicContact CD2-CG 4.08Å; F333-D796 HydrophobicContact CE1-CB 4.01Å; F333-D796 HydrophobicContact CZ-CB 4.44Å; F333-E797 HydrophobicContact CE1-CB 4.12Å; F333-V800 HydrophobicContact CZ-CG2 4.26Å
334	E	93.7	Very high	94.1	Very high	92 Å²	92	28.5 Å²	28.5	43%	0.43	15%	0.153	S	C	.	.	H	α-helix	trans	-53.7	-44.1	-178.6	-62.4	-58.9	142.2	0	0	113.2	A300 A336 M337 V338	A300-E334 HydrophobicContact CB-CB 4.21Å; E334-A336 PolarHBondContact O-N 3.06Å; E334-M337 PolarHBondContact O-N 3.24Å; E334-V338 PolarHBondContact O-N 3.45Å; E334-V338 VanDerWaalsContact O-N 3.13Å
335	A	94.8	Very high	94	Very high	2 Å²	2	32 Å²	32	2%	0.017	17%	0.171	C	C	.	.	H	α-helix	trans	-68.8	-35.6	179.4	0	0	0	0	0	112	L327 R332 F333 V338 L339	L327-A335 HydrophobicContact CD1-CB 3.8Å; L327-A335 WeakPolarHBondContact CD1-O 3.4Å; L327-A335 HydrophobicContact CD2-CB 4.01Å; R332-A335 HydrophobicContact CB-CB 4.16Å; R332-A335 PolarHBondContact O-N 3.36Å; F333-A335 VanDerWaalsContact C-N 3.31Å; F333-A335 PolarHBondContact O-N 2.76Å; A335-V338 PolarHBondContact O-N 3.39Å; A335-L339 PolarHBondContact O-N 2.95Å
336	A	95.9	Very high	93.8	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69.5	-37.3	175.6	0	0	0	0	0	111.6	L324 L327 R332 F333 E334 V338 L339 L340 L368	L324-A336 HydrophobicContact CD1-CB 4.01Å; L327-A336 HydrophobicContact CB-CB 4.23Å; R332-A336 WeakPolarHBondContact O-CB 3.24Å; R332-A336 PolarHBondContact O-N 2.89Å; F333-A336 WeakPolarHBondContact O-CA 3.11Å; F333-A336 WeakPolarHBondContact O-CB 3.46Å; F333-A336 PolarHBondContact O-N 3.37Å; E334-A336 PolarHBondContact O-N 3.06Å; A336-V338 VanDerWaalsContact C-N 3.33Å; A336-V338 PolarHBondContact O-N 3.07Å; A336-L339 WeakPolarHBondContact O-CB 3.06Å; A336-L339 PolarHBondContact O-N 3.01Å; A336-L339 VanDerWaalsContact O-N 3.1Å; A336-L340 WeakPolarHBondContact O-CG 3.42Å; A336-L340 PolarHBondContact O-N 3.27Å; A336-L368 HydrophobicContact CB-CD2 3.52Å
337	M	94.9	Very high	93.8	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-61.5	-41.1	174.4	-69.7	-54.7	-58.2	0	0	111.8	F333 E334 L339 L340 T341 F375 F537 D796 V800	F333-M337 HydrophobicContact CD1-CG 4.27Å; F333-M337 HydrophobicContact CD2-CG 4.18Å; F333-M337 HydrophobicContact CE1-CG 3.89Å; F333-M337 HydrophobicContact CE2-CG 3.79Å; F333-M337 HydrophobicContact CE2-SD 3.8Å; F333-M337 HydrophobicContact CG-CG 4.41Å; F333-M337 HydrophobicContact CZ-CG 3.63Å; F333-M337 HydrophobicContact CZ-SD 3.93Å; F333-M337 WeakPolarHBondContact O-CG 3.42Å; F333-M337 PolarHBondContact O-N 3.2Å; E334-M337 PolarHBondContact O-N 3.24Å; M337-L339 VanDerWaalsContact C-N 3.3Å; M337-L339 PolarHBondContact O-N 3.35Å; M337-L340 PolarHBondContact O-N 2.96Å; M337-L340 HydrophobicContact SD-CD1 4.11Å; M337-T341 WeakPolarHBondContact O-CB 3.39Å; M337-T341 WeakPolarHBondContact O-CG2 3.48Å; M337-T341 PolarHBondContact O-N 3.45Å; M337-T341 PolarHBondContact O-OG1 2.9Å; M337-F375 HydrophobicContact CE-CD2 4.29Å; M337-F375 HydrophobicContact CE-CE2 3.46Å; M337-F375 VanDerWaalsContact CE-CE2 3.46Å; M337-F375 HydrophobicContact CE-CZ 3.78Å; M337-F537 HydrophobicContact CE-CE1 4.17Å; M337-D796 HydrophobicContact CB-CB 4.45Å; M337-D796 VanDerWaalsContact CB-OD2 3.26Å; M337-D796 WeakPolarHBondContact CB-OD2 3.45Å; M337-D796 HydrophobicContact CG-CB 4.21Å; M337-V800 HydrophobicContact CE-CG2 3.47Å; M337-V800 VanDerWaalsContact CE-CG2 3.47Å; M337-V800 HydrophobicContact SD-CG2 4.04Å
338	V	94.6	Very high	93.8	Very high	11 Å²	11	34.8 Å²	34.8	7%	0.067	19%	0.186	C	C	.	.	H	α-helix	trans	-57.8	-42.4	171.6	171.1	0	0	0	0	111.9	A300 C303 R304 L307 E334 A335 A336 T341 H342	A300-V338 HydrophobicContact CB-CG2 3.62Å; C303-V338 HydrophobicContact CB-CB 4.15Å; C303-V338 HydrophobicContact CB-CG1 3.62Å; R304-V338 HydrophobicContact CG-CG1 3.63Å; R304-V338 HydrophobicContact CG-CG2 4.11Å; L307-V338 HydrophobicContact CD1-CG1 3.61Å; E334-V338 PolarHBondContact O-N 3.45Å; E334-V338 VanDerWaalsContact O-N 3.13Å; A335-V338 PolarHBondContact O-N 3.39Å; A336-V338 VanDerWaalsContact C-N 3.33Å; A336-V338 PolarHBondContact O-N 3.07Å; V338-T341 WeakPolarHBondContact CA-OG1 3.47Å; V338-T341 PolarHBondContact O-OG1 3.44Å; V338-T341 VanDerWaalsContact O-OG1 3.06Å; V338-H342 PolarHBondContact O-CD2 3.34Å; V338-H342 PolarHBondContact O-N 3.04Å
339	L	95	Very high	93.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.5	-47.2	177.2	-64.7	-168	0	0	0	111.5	L294 C303 L307 A323 L324 L327 A335 A336 M337 T341 H342 G343 A344	L294-L339 HydrophobicContact CD1-CD2 3.93Å; L294-L339 HydrophobicContact CD2-CD2 4.05Å; L294-L339 HydrophobicContact CG-CD2 4.2Å; C303-L339 HydrophobicContact CB-CD2 4.39Å; L307-L339 HydrophobicContact CD1-CD2 4.12Å; A323-L339 HydrophobicContact CB-CD1 3.78Å; L324-L339 HydrophobicContact CB-CD1 4.13Å; L324-L339 HydrophobicContact CD1-CB 4.44Å; L327-L339 HydrophobicContact CD1-CD1 3.43Å; L327-L339 VanDerWaalsContact CD1-CD1 3.43Å; L327-L339 HydrophobicContact CD1-CG 3.81Å; L327-L339 HydrophobicContact CG-CD1 4.38Å; A335-L339 PolarHBondContact O-N 2.95Å; A336-L339 WeakPolarHBondContact O-CB 3.06Å; A336-L339 PolarHBondContact O-N 3.01Å; A336-L339 VanDerWaalsContact O-N 3.1Å; M337-L339 VanDerWaalsContact C-N 3.3Å; M337-L339 PolarHBondContact O-N 3.35Å; L339-T341 PolarHBondContact O-N 2.96Å; L339-H342 PolarHBondContact O-N 3.19Å; L339-G343 PolarHBondContact O-N 3.25Å; L339-A344 VanDerWaalsContact C-CB 3.45Å; L339-A344 HydrophobicContact CB-CB 3.81Å; L339-A344 WeakPolarHBondContact O-CB 3.19Å; L339-A344 PolarHBondContact O-N 3.39Å
340	L	93.8	Very high	93.7	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.026	20%	0.195	C	C	.	.	H	α-helix	trans	-61.2	-43.2	-179.6	-69.6	171.1	0	0	0	111.9	L324 A336 M337 H342 G343 A346 L372 F375	L324-L340 HydrophobicContact CD1-CD2 4.3Å; L324-L340 HydrophobicContact CD1-CG 4.22Å; L324-L340 HydrophobicContact CD2-CD2 3.88Å; A336-L340 WeakPolarHBondContact O-CG 3.42Å; A336-L340 PolarHBondContact O-N 3.27Å; M337-L340 PolarHBondContact O-N 2.96Å; M337-L340 HydrophobicContact SD-CD1 4.11Å; L340-H342 PolarHBondContact O-N 3.2Å; L340-G343 PolarHBondContact O-N 3.29Å; L340-A346 HydrophobicContact CD2-CB 4.15Å; L340-L372 HydrophobicContact CD1-CD2 4.09Å; L340-L372 HydrophobicContact CD2-CD2 4.05Å; L340-F375 HydrophobicContact CB-CB 4.47Å; L340-F375 HydrophobicContact CB-CD1 3.76Å; L340-F375 HydrophobicContact CB-CE1 4.1Å; L340-F375 HydrophobicContact CB-CG 4.05Å; L340-F375 HydrophobicContact CD1-CB 4.31Å; L340-F375 HydrophobicContact CD1-CD2 4.46Å; L340-F375 HydrophobicContact CD1-CG 4.28Å; L340-F375 HydrophobicContact CD2-CB 4.21Å
341	T	92.2	Very high	93.7	Very high	8 Å²	8	33.6 Å²	33.6	5%	0.049	19%	0.186	C	C	.	.	H	α-helix	trans	-71.8	-15.9	179.5	58.2	0	0	0	0	113.5	M337 V338 L339 F375 C534 F537	M337-T341 WeakPolarHBondContact O-CB 3.39Å; M337-T341 WeakPolarHBondContact O-CG2 3.48Å; M337-T341 PolarHBondContact O-N 3.45Å; M337-T341 PolarHBondContact O-OG1 2.9Å; V338-T341 WeakPolarHBondContact CA-OG1 3.47Å; V338-T341 PolarHBondContact O-OG1 3.44Å; V338-T341 VanDerWaalsContact O-OG1 3.06Å; L339-T341 PolarHBondContact O-N 2.96Å; T341-F375 HydrophobicContact CG2-CE1 3.9Å; T341-F375 HydrophobicContact CG2-CZ 3.83Å; T341-C534 WeakPolarHBondContact O-CB 3.22Å; T341-F537 HydrophobicContact CG2-CB 3.36Å; T341-F537 HydrophobicContact CG2-CD1 4.05Å; T341-F537 HydrophobicContact CG2-CD2 4.34Å; T341-F537 HydrophobicContact CG2-CG 3.69Å
342	H	91.2	Very high	93.5	Very high	48 Å²	48	36.4 Å²	36.4	22%	0.222	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	5.7	170.8	-78.6	-111.1	0	0	0	113.5	L307 I313 V338 L339 L340	L307-H342 HydrophobicContact CD1-CB 3.83Å; L307-H342 HydrophobicContact CD2-CB 4.42Å; I313-H342 HydrophobicContact CD1-CB 3.88Å; I313-H342 WeakPolarHBondContact CD1-O 3.48Å; V338-H342 PolarHBondContact O-CD2 3.34Å; V338-H342 PolarHBondContact O-N 3.04Å; L339-H342 PolarHBondContact O-N 3.19Å; L340-H342 PolarHBondContact O-N 3.2Å
343	G	88.6	Confident	93.4	Very high	45 Å²	45	33.4 Å²	33.4	46%	0.464	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.4	25.3	174.1	0	0	0	0	0	114.8	L339 L340 N345	L339-G343 PolarHBondContact O-N 3.25Å; L340-G343 PolarHBondContact O-N 3.29Å; G343-N345 PolarHBondContact O-N 3.12Å
344	A	93.4	Very high	93.4	Very high	11 Å²	11	33 Å²	33	9%	0.091	18%	0.182	C	C	.	.			trans	-61	132.4	168.7	0	0	0	0	0	110.9	I313 L324 L339 A346	I313-A344 HydrophobicContact CG2-CB 3.57Å; L324-A344 HydrophobicContact CD2-CB 4.29Å; L339-A344 VanDerWaalsContact C-CB 3.45Å; L339-A344 HydrophobicContact CB-CB 3.81Å; L339-A344 WeakPolarHBondContact O-CB 3.19Å; L339-A344 PolarHBondContact O-N 3.39Å; A344-A346 PolarHBondContact O-N 3.12Å
345	N	93.2	Very high	93.5	Very high	76 Å²	76	28.7 Å²	28.7	41%	0.406	16%	0.161	S	C	.	.			trans	-78	108	179	-176.6	-4.2	0	0	0	110.4	N314 G343 N347 L348	N314-N345 PolarHBondContact OD1-N 2.59Å; G343-N345 PolarHBondContact O-N 3.12Å; N345-N347 PolarHBondContact O-N 3.4Å; N345-N347 WeakPolarHBondContact OD1-CA 3.47Å; N345-N347 PolarHBondContact OD1-N 3.3Å; N345-L348 HydrophobicContact CB-CB 4.25Å; N345-L348 WeakPolarHBondContact O-CB 3.27Å; N345-L348 PolarHBondContact O-N 2.96Å; N345-L348 PolarHBondContact OD1-N 3.19Å
346	A	93.4	Very high	93.5	Very high	4 Å²	4	28.6 Å²	28.6	3%	0.033	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.4	178.4	0	0	0	0	0	113.7	L340 A344 L372 A377	L340-A346 HydrophobicContact CD2-CB 4.15Å; A344-A346 PolarHBondContact O-N 3.12Å; A346-L372 HydrophobicContact CB-CD2 4.09Å; A346-A377 HydrophobicContact CB-CB 4Å
347	N	94.3	Very high	93.4	Very high	50 Å²	50	28.6 Å²	28.6	27%	0.267	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	5	-178.3	-64.1	-37.6	0	0	0	113.5	N345 K349 G376 A377 D378 I381	N345-N347 PolarHBondContact O-N 3.4Å; N345-N347 WeakPolarHBondContact OD1-CA 3.47Å; N345-N347 PolarHBondContact OD1-N 3.3Å; N347-K349 PolarHBondContact O-N 3.48Å; N347-G376 PolarHBondContact ND2-O 2.82Å; N347-A377 WeakPolarHBondContact OD1-CA 3.4Å; N347-D378 PolarHBondContact OD1-N 3.4Å; N347-I381 HydrophobicContact CB-CD1 4.39Å
348	L	95.2	Very high	93.3	Very high	35 Å²	35	28.6 Å²	28.6	18%	0.183	16%	0.161	C	C	.	.			trans	-61.2	123.5	174.7	-173.2	62.7	0	0	0	109	N314 L316 H325 N345	N314-L348 HydrophobicContact CB-CD2 4.18Å; L316-L348 HydrophobicContact CD2-CD2 3.78Å; L316-L348 HydrophobicContact CD2-CG 4.13Å; L316-L348 HydrophobicContact CG-CD2 4.36Å; H325-L348 PolarHBondContact CE1-O 3.23Å; H325-L348 PolarHBondContact NE2-O 3.4Å; N345-L348 HydrophobicContact CB-CB 4.25Å; N345-L348 WeakPolarHBondContact O-CB 3.27Å; N345-L348 PolarHBondContact O-N 2.96Å; N345-L348 PolarHBondContact OD1-N 3.19Å
349	K	94.1	Very high	93.2	Very high	95 Å²	95	28.8 Å²	28.8	41%	0.413	16%	0.161	S	C	.	.			trans	-81.6	123.1	175.9	-67.8	-167.9	-178	-165.2	0	109.3	N347 T355 I381 H382	N347-K349 PolarHBondContact O-N 3.48Å; K349-T355 HydrophobicContact CG-CG2 4.18Å; K349-I381 HydrophobicContact CG-CD1 4.31Å; K349-H382 WeakPolarHBondContact CE-O 3.33Å; K349-H382 PolarHBondContact NZ-O 2.95Å
350	G	92.6	Very high	93.1	Very high	13 Å²	13	28.8 Å²	28.8	13%	0.134	16%	0.161	C	C	.	.			trans	-101	-140.9	175.6	0	0	0	0	0	113	G320 D352 G353 N354	G320-G350 CarbonylContact O-C 3.55Å; G320-G350 WeakPolarHBondContact O-CA 3.3Å; G350-D352 PolarHBondContact O-N 3.31Å; G350-G353 PolarHBondContact O-N 3.39Å; G350-G353 VanDerWaalsContact O-N 3.07Å; G350-N354 PolarHBondContact N-O 2.92Å
351	Q	92.5	Very high	92.9	Very high	87 Å²	87	28.6 Å²	28.6	41%	0.407	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-57	132.1	178.4	-167.2	177.4	0.4	0	0	112.1	T319 G320 E321 G353 N354	T319-Q351 WeakPolarHBondContact O-CB 3.13Å; G320-Q351 PolarHBondContact O-N 3.4Å; E321-Q351 HydrophobicContact CG-CB 4.27Å; Q351-G353 PolarHBondContact O-N 3.5Å; Q351-N354 WeakPolarHBondContact O-CB 3.36Å; Q351-N354 PolarHBondContact O-N 3.37Å; Q351-N354 VanDerWaalsContact O-N 3.14Å; Q351-N354 PolarHBondContact O-ND2 3.1Å
352	D	91.4	Very high	92.8	Very high	91 Å²	91	33.4 Å²	33.4	49%	0.487	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	56.6	26.8	-175.4	-40.8	-47.9	0	0	0	113.6	G350 N354 N383 D384	G350-D352 PolarHBondContact O-N 3.31Å; D352-N354 PolarHBondContact O-N 3.48Å; D352-N383 WeakPolarHBondContact O-CB 3.3Å; D352-D384 WeakPolarHBondContact CA-OD2 3.3Å; D352-D384 WeakPolarHBondContact O-CB 3.36Å; D352-D384 PolarHBondContact O-N 3.32Å
353	G	92.5	Very high	92.7	Very high	2 Å²	2	34.6 Å²	34.6	2%	0.021	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	71.1	7.1	-178.1	0	0	0	0	0	113.8	G350 Q351 N383 D384	G350-G353 PolarHBondContact O-N 3.39Å; G350-G353 VanDerWaalsContact O-N 3.07Å; Q351-G353 PolarHBondContact O-N 3.5Å; G353-N383 WeakPolarHBondContact O-CA 3.42Å; G353-D384 WeakPolarHBondContact CA-OD1 3.39Å; G353-D384 PolarHBondContact N-OD2 2.86Å; G353-D384 VanDerWaalsContact N-OD2 3.08Å
354	N	94.1	Very high	92.7	Very high	18 Å²	18	34.6 Å²	34.6	10%	0.096	18%	0.176	C	C	.	.			trans	-72.1	131.6	179.8	-67.3	-57.8	0	0	0	110.4	H325 G350 Q351 D352 H358 L359 N383	H325-N354 PolarHBondContact NE2-O 3.13Å; G350-N354 PolarHBondContact N-O 2.92Å; Q351-N354 WeakPolarHBondContact O-CB 3.36Å; Q351-N354 PolarHBondContact O-N 3.37Å; Q351-N354 VanDerWaalsContact O-N 3.14Å; Q351-N354 PolarHBondContact O-ND2 3.1Å; D352-N354 PolarHBondContact O-N 3.48Å; N354-H358 HydrophobicContact CB-CB 3.91Å; N354-L359 HydrophobicContact CB-CD2 4.35Å; N354-N383 WeakPolarHBondContact OD1-CB 2.92Å; N354-N383 PolarHBondContact OD1-ND2 2.97Å
355	T	95.4	Very high	92.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.			trans	-83.3	171.3	168.1	65.1	0	0	0	0	111.5	K349 L357 H358 L359 I381	K349-T355 HydrophobicContact CG-CG2 4.18Å; T355-L357 PolarHBondContact O-N 3.48Å; T355-L357 PolarHBondContact OG1-N 3.35Å; T355-H358 PolarHBondContact N-ND1 3.39Å; T355-H358 VanDerWaalsContact N-ND1 3.12Å; T355-H358 WeakPolarHBondContact O-CB 2.96Å; T355-H358 PolarHBondContact O-N 2.63Å; T355-H358 VanDerWaalsContact O-N 3.11Å; T355-H358 PolarHBondContact OG1-ND1 2.9Å; T355-L359 PolarHBondContact O-N 2.79Å; T355-I381 HydrophobicContact CG2-CD1 3.89Å; T355-I381 HydrophobicContact CG2-CG1 4.38Å; T355-I381 HydrophobicContact CG2-CG2 3.68Å
356	A	95.4	Very high	92.3	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-53.7	-38.1	171.4	0	0	0	0	0	111.9	L324 H325 T328 H358 L359 A360 L372	L324-A356 HydrophobicContact CD2-CB 3.83Å; L324-A356 HydrophobicContact CG-CB 3.86Å; H325-A356 PolarHBondContact NE2-N 3.14Å; T328-A356 WeakPolarHBondContact CG2-O 3.43Å; A356-H358 PolarHBondContact O-N 3.46Å; A356-L359 PolarHBondContact O-N 3.22Å; A356-A360 PolarHBondContact O-N 2.99Å; A356-L372 HydrophobicContact CB-CD1 4.01Å; A356-L372 HydrophobicContact CB-CD2 3.86Å
357	L	93.8	Very high	92.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.1	-40.4	178.3	-172.5	62.2	0	0	0	112.6	T355 L359 A360 M361 I369 L372 I373 A377 V379 P389	T355-L357 PolarHBondContact O-N 3.48Å; T355-L357 PolarHBondContact OG1-N 3.35Å; L357-L359 VanDerWaalsContact C-N 3.3Å; L357-L359 PolarHBondContact O-N 3.26Å; L357-A360 PolarHBondContact O-N 2.91Å; L357-M361 HydrophobicContact CD1-CE 3.99Å; L357-M361 HydrophobicContact CD1-CG 4.5Å; L357-M361 WeakPolarHBondContact O-CB 3.14Å; L357-M361 VanDerWaalsContact O-CG 3.26Å; L357-M361 WeakPolarHBondContact O-CG 3.45Å; L357-M361 PolarHBondContact O-N 3.36Å; L357-I369 HydrophobicContact CD1-CG2 4.29Å; L357-L372 HydrophobicContact CD1-CB 4.17Å; L357-L372 HydrophobicContact CD1-CD1 4.44Å; L357-I373 HydrophobicContact CD1-CD1 4.43Å; L357-I373 HydrophobicContact CD1-CG1 4.02Å; L357-I373 HydrophobicContact CD2-CG1 4.27Å; L357-A377 HydrophobicContact CB-CB 4.15Å; L357-A377 HydrophobicContact CD2-CB 3.96Å; L357-A377 HydrophobicContact CG-CB 4.48Å; L357-V379 HydrophobicContact CD2-CG1 3.97Å; L357-P389 HydrophobicContact CB-CG 4.43Å; L357-P389 HydrophobicContact CD2-CB 3.99Å; L357-P389 HydrophobicContact CD2-CG 3.95Å; L357-P389 HydrophobicContact CG-CB 3.88Å; L357-P389 HydrophobicContact CG-CG 4.14Å
358	H	92.3	Very high	92.1	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-58.2	-43.9	173.5	-70.4	93	0	0	0	111.5	N354 T355 A356 K362 I381 E387 P389 I392	N354-H358 HydrophobicContact CB-CB 3.91Å; T355-H358 PolarHBondContact N-ND1 3.39Å; T355-H358 VanDerWaalsContact N-ND1 3.12Å; T355-H358 WeakPolarHBondContact O-CB 2.96Å; T355-H358 PolarHBondContact O-N 2.63Å; T355-H358 VanDerWaalsContact O-N 3.11Å; T355-H358 PolarHBondContact OG1-ND1 2.9Å; A356-H358 PolarHBondContact O-N 3.46Å; H358-K362 WeakPolarHBondContact O-CB 3.41Å; H358-K362 PolarHBondContact O-N 2.85Å; H358-I381 PolarHBondContact CE1-O 3.39Å; H358-I381 PolarHBondContact NE2-O 3.11Å; H358-E387 PolarHBondContact NE2-O 3.16Å; H358-E387 VanDerWaalsContact NE2-O 3.15Å; H358-P389 VanDerWaalsContact NE2-CD 3.31Å; H358-P389 WeakPolarHBondContact NE2-CD 3.26Å; H358-I392 HydrophobicContact CB-CD1 4.01Å
359	L	93.4	Very high	92	Very high	15 Å²	15	32.9 Å²	32.9	8%	0.079	16%	0.161	C	C	.	.	H	α-helix	trans	-67.2	-41.4	178.1	-62.7	-176.1	0	0	0	112.1	H325 T328 N354 T355 A356 L357 M361 K362 M363	H325-L359 HydrophobicContact CB-CD1 3.7Å; T328-L359 HydrophobicContact CG2-CB 4.11Å; N354-L359 HydrophobicContact CB-CD2 4.35Å; T355-L359 PolarHBondContact O-N 2.79Å; A356-L359 PolarHBondContact O-N 3.22Å; L357-L359 VanDerWaalsContact C-N 3.3Å; L357-L359 PolarHBondContact O-N 3.26Å; L359-M361 VanDerWaalsContact C-N 3.35Å; L359-M361 PolarHBondContact O-N 3.1Å; L359-K362 PolarHBondContact O-N 3.34Å; L359-M363 WeakPolarHBondContact O-CG 2.99Å; L359-M363 PolarHBondContact O-N 3.33Å
360	A	92.8	Very high	91.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.8	-43.9	178.3	0	0	0	0	0	111.4	T328 A356 L357 M363 D364 H365 L368 I369 L372	T328-A360 HydrophobicContact CG2-CB 3.57Å; A356-A360 PolarHBondContact O-N 2.99Å; L357-A360 PolarHBondContact O-N 2.91Å; A360-M363 PolarHBondContact O-N 3.49Å; A360-D364 PolarHBondContact O-N 3.28Å; A360-H365 PolarHBondContact O-N 3.49Å; A360-H365 VanDerWaalsContact O-N 3.13Å; A360-L368 HydrophobicContact CB-CB 4.4Å; A360-I369 HydrophobicContact CB-CG1 3.64Å; A360-L372 HydrophobicContact CB-CD1 3.81Å
361	M	89.9	Confident	91.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.1	-39.9	175.3	-69.6	-65.1	-178.8	0	0	112.5	L357 L359 M363 D364 I369 P389 A393 L405 L409	L357-M361 HydrophobicContact CD1-CE 3.99Å; L357-M361 HydrophobicContact CD1-CG 4.5Å; L357-M361 WeakPolarHBondContact O-CB 3.14Å; L357-M361 VanDerWaalsContact O-CG 3.26Å; L357-M361 WeakPolarHBondContact O-CG 3.45Å; L357-M361 PolarHBondContact O-N 3.36Å; L359-M361 VanDerWaalsContact C-N 3.35Å; L359-M361 PolarHBondContact O-N 3.1Å; M361-M363 VanDerWaalsContact C-N 3.29Å; M361-M363 PolarHBondContact O-N 2.93Å; M361-D364 PolarHBondContact O-N 3.43Å; M361-I369 HydrophobicContact CE-CB 4.32Å; M361-I369 HydrophobicContact CE-CD1 4.27Å; M361-I369 HydrophobicContact CE-CG1 4.12Å; M361-I369 HydrophobicContact CE-CG2 3.28Å; M361-I369 HydrophobicContact CG-CD1 4.4Å; M361-I369 HydrophobicContact CG-CG1 4.43Å; M361-I369 HydrophobicContact SD-CD1 3.56Å; M361-I369 VanDerWaalsContact SD-CD1 3.56Å; M361-I369 HydrophobicContact SD-CG1 3.93Å; M361-I369 HydrophobicContact SD-CG2 4.08Å; M361-P389 HydrophobicContact CG-CB 4.16Å; M361-A393 HydrophobicContact CB-CB 4.13Å; M361-A393 HydrophobicContact CG-CB 4.3Å; M361-A393 HydrophobicContact SD-CB 3.8Å; M361-L405 HydrophobicContact SD-CD1 4.14Å; M361-L405 HydrophobicContact SD-CD2 4.04Å; M361-L409 HydrophobicContact CE-CD1 4.12Å; M361-L409 HydrophobicContact CE-CD2 3.95Å; M361-L409 HydrophobicContact CE-CG 4.16Å
362	K	89.9	Confident	91.8	Very high	109 Å²	109	25.1 Å²	25.1	47%	0.474	12%	0.123	S	C	.	.	H	α-helix	trans	-62.4	-37	176.4	-175.4	174.1	178.4	177.1	0	112.2	H358 L359 I392 T396	H358-K362 WeakPolarHBondContact O-CB 3.41Å; H358-K362 PolarHBondContact O-N 2.85Å; L359-K362 PolarHBondContact O-N 3.34Å; K362-I392 HydrophobicContact CB-CG2 3.89Å; K362-I392 HydrophobicContact CG-CG2 4.49Å; K362-T396 HydrophobicContact CG-CG2 4.45Å
363	M	89.4	Confident	91.8	Very high	74 Å²	74	21.2 Å²	21.2	37%	0.365	10%	0.102	S	C	.	.	H	α-helix	trans	-94.1	-2.5	-178	-57.6	-57.7	169.3	0	0	114.1	K329 L359 A360 M361 H365	K329-M363 HydrophobicContact CG-CE 4.19Å; L359-M363 WeakPolarHBondContact O-CG 2.99Å; L359-M363 PolarHBondContact O-N 3.33Å; A360-M363 PolarHBondContact O-N 3.49Å; M361-M363 VanDerWaalsContact C-N 3.29Å; M361-M363 PolarHBondContact O-N 2.93Å; M363-H365 VanDerWaalsContact C-N 3.3Å; M363-H365 PolarHBondContact O-CD2 2.53Å; M363-H365 PolarHBondContact O-N 3.48Å
364	D	88.5	Confident	91.7	Very high	44 Å²	44	21.1 Å²	21.1	24%	0.235	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	31	178.9	-151	48.5	0	0	0	113.9	A360 M361 M366 S397 N401 L405	A360-D364 PolarHBondContact O-N 3.28Å; M361-D364 PolarHBondContact O-N 3.43Å; D364-M366 PolarHBondContact O-N 3.22Å; D364-M366 VanDerWaalsContact O-N 3.14Å; D364-S397 PolarHBondContact OD1-OG 3.2Å; D364-N401 VanDerWaalsContact OD2-CB 3.27Å; D364-N401 WeakPolarHBondContact OD2-CB 3.25Å; D364-N401 PolarHBondContact OD2-ND2 2.93Å; D364-L405 VanDerWaalsContact OD1-CD1 3.27Å; D364-L405 WeakPolarHBondContact OD1-CD1 3.36Å
365	H	90.1	Very high	91.5	Very high	55 Å²	55	21.3 Å²	21.3	26%	0.255	10%	0.101	S	C	.	.			trans	-83.8	85	-179.7	-63.2	161.8	0	0	0	111.7	T328 G331 A360 M363 E367 L368 I369	T328-H365 PolarHBondContact O-CE1 2.92Å; T328-H365 VanDerWaalsContact O-CE1 3.29Å; T328-H365 PolarHBondContact O-ND1 3.21Å; G331-H365 WeakPolarHBondContact CA-CE1 3.15Å; G331-H365 WeakPolarHBondContact CA-ND1 3.16Å; G331-H365 PolarHBondContact N-CE1 2.82Å; G331-H365 VanDerWaalsContact N-CE1 3.29Å; A360-H365 PolarHBondContact O-N 3.49Å; A360-H365 VanDerWaalsContact O-N 3.13Å; M363-H365 VanDerWaalsContact C-N 3.3Å; M363-H365 PolarHBondContact O-CD2 2.53Å; M363-H365 PolarHBondContact O-N 3.48Å; H365-E367 PolarHBondContact O-N 2.93Å; H365-L368 HydrophobicContact CB-CB 4Å; H365-L368 HydrophobicContact CB-CD1 3.89Å; H365-L368 HydrophobicContact CB-CG 4.42Å; H365-L368 PolarHBondContact O-N 3.09Å; H365-I369 WeakPolarHBondContact O-CD1 3.23Å; H365-I369 VanDerWaalsContact O-CG1 3.29Å; H365-I369 WeakPolarHBondContact O-CG1 3.16Å; H365-I369 PolarHBondContact O-N 3.33Å
366	M	87.6	Confident	91.1	Very high	34 Å²	34	23.2 Å²	23.2	17%	0.167	12%	0.121	C	C	.	.	H	α-helix	trans	-52.6	-48.9	-173.2	-169.3	64.2	64.7	0	0	114.6	D364 L368 I369 K370 I404 L405 M408	D364-M366 PolarHBondContact O-N 3.22Å; D364-M366 VanDerWaalsContact O-N 3.14Å; M366-L368 PolarHBondContact O-N 3.48Å; M366-I369 WeakPolarHBondContact O-CB 3.27Å; M366-I369 PolarHBondContact O-N 3.47Å; M366-I369 VanDerWaalsContact O-N 3.14Å; M366-K370 PolarHBondContact O-N 3.07Å; M366-I404 HydrophobicContact CE-CB 4.29Å; M366-I404 HydrophobicContact CE-CG2 3.76Å; M366-I404 HydrophobicContact SD-CG2 4.27Å; M366-L405 HydrophobicContact CE-CD2 3.53Å; M366-L405 HydrophobicContact CE-CG 3.94Å; M366-L405 HydrophobicContact SD-CD2 3.7Å; M366-M408 HydrophobicContact SD-CE 3.4Å; M366-M408 WeakPolarHBondContact SD-CE 3.43Å; M366-M408 HydrophobicContact SD-SD 4.2Å
367	E	90.8	Very high	90.9	Very high	47 Å²	47	23.5 Å²	23.5	22%	0.22	12%	0.123	C	C	.	.	H	α-helix	trans	-66.7	-37.9	-177.1	-58.6	-47.3	118.9	0	0	112	F333 H365 I369 K370 G371 N801	F333-E367 HydrophobicContact CD2-CB 3.82Å; F333-E367 HydrophobicContact CE2-CB 3.9Å; F333-E367 WeakPolarHBondContact CE2-O 3.37Å; F333-E367 HydrophobicContact CG-CB 4.35Å; F333-E367 HydrophobicContact CZ-CB 4.49Å; H365-E367 PolarHBondContact O-N 2.93Å; E367-I369 VanDerWaalsContact C-N 3.34Å; E367-I369 PolarHBondContact O-N 3.01Å; E367-K370 PolarHBondContact O-N 3.47Å; E367-K370 IonicContact OE1-NZ 3.41Å; E367-K370 PolarHBondContact OE1-NZ 2.79Å; E367-K370 IonicContact OE2-NZ 3.66Å; E367-K370 PolarHBondContact OE2-NZ 3.24Å; E367-G371 PolarHBondContact O-N 3.48Å; E367-N801 PolarHBondContact OE2-ND2 2.84Å
368	L	93.4	Very high	90.6	Very high	5 Å²	5	26.9 Å²	26.9	3%	0.026	14%	0.141	C	C	.	.	H	α-helix	trans	-65.8	-36.4	172.7	-81.1	169.6	0	0	0	112.1	T328 F333 A336 A360 H365 M366 G371 L372	T328-L368 HydrophobicContact CG2-CD1 4.32Å; F333-L368 HydrophobicContact CB-CD2 4.49Å; F333-L368 HydrophobicContact CB-CG 4.39Å; F333-L368 HydrophobicContact CD2-CD2 4.02Å; F333-L368 HydrophobicContact CD2-CG 4.08Å; A336-L368 HydrophobicContact CB-CD2 3.52Å; A360-L368 HydrophobicContact CB-CB 4.4Å; H365-L368 HydrophobicContact CB-CB 4Å; H365-L368 HydrophobicContact CB-CD1 3.89Å; H365-L368 HydrophobicContact CB-CG 4.42Å; H365-L368 PolarHBondContact O-N 3.09Å; M366-L368 PolarHBondContact O-N 3.48Å; L368-G371 PolarHBondContact O-N 2.61Å; L368-L372 VanDerWaalsContact O-CB 3.28Å; L368-L372 WeakPolarHBondContact O-CB 3.27Å; L368-L372 WeakPolarHBondContact O-CD1 3.25Å; L368-L372 WeakPolarHBondContact O-CG 3.06Å; L368-L372 PolarHBondContact O-N 3.4Å
369	I	91.5	Very high	90.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.9	-51.1	176.7	-70.9	160.2	0	0	0	110.2	L357 A360 M361 H365 M366 E367 G371 L372 I373 L405 M408	L357-I369 HydrophobicContact CD1-CG2 4.29Å; A360-I369 HydrophobicContact CB-CG1 3.64Å; M361-I369 HydrophobicContact CE-CB 4.32Å; M361-I369 HydrophobicContact CE-CD1 4.27Å; M361-I369 HydrophobicContact CE-CG1 4.12Å; M361-I369 HydrophobicContact CE-CG2 3.28Å; M361-I369 HydrophobicContact CG-CD1 4.4Å; M361-I369 HydrophobicContact CG-CG1 4.43Å; M361-I369 HydrophobicContact SD-CD1 3.56Å; M361-I369 VanDerWaalsContact SD-CD1 3.56Å; M361-I369 HydrophobicContact SD-CG1 3.93Å; M361-I369 HydrophobicContact SD-CG2 4.08Å; H365-I369 WeakPolarHBondContact O-CD1 3.23Å; H365-I369 VanDerWaalsContact O-CG1 3.29Å; H365-I369 WeakPolarHBondContact O-CG1 3.16Å; H365-I369 PolarHBondContact O-N 3.33Å; M366-I369 WeakPolarHBondContact O-CB 3.27Å; M366-I369 PolarHBondContact O-N 3.47Å; M366-I369 VanDerWaalsContact O-N 3.14Å; E367-I369 VanDerWaalsContact C-N 3.34Å; E367-I369 PolarHBondContact O-N 3.01Å; I369-G371 VanDerWaalsContact C-N 3.35Å; I369-G371 PolarHBondContact O-N 2.81Å; I369-L372 PolarHBondContact O-N 3.4Å; I369-I373 HydrophobicContact CG2-CD1 3.84Å; I369-I373 VanDerWaalsContact O-CG1 3.32Å; I369-I373 WeakPolarHBondContact O-CG1 3.47Å; I369-I373 PolarHBondContact O-N 3.35Å; I369-L405 HydrophobicContact CD1-CD1 4.34Å; I369-L405 HydrophobicContact CD1-CD2 3.57Å; I369-L405 HydrophobicContact CG2-CD2 4.32Å; I369-M408 HydrophobicContact CG2-SD 3.58Å; I369-M408 VanDerWaalsContact CG2-SD 3.58Å
370	K	90.4	Very high	90.1	Very high	29 Å²	29	30.3 Å²	30.3	13%	0.126	16%	0.158	C	C	.	.	H	α-helix	trans	-57.8	-48.7	175.8	-65.7	173.6	-171.9	160.2	0	110.8	M366 E367 L372 I373 V374 M408 V800 N801 W804	M366-K370 PolarHBondContact O-N 3.07Å; E367-K370 PolarHBondContact O-N 3.47Å; E367-K370 IonicContact OE1-NZ 3.41Å; E367-K370 PolarHBondContact OE1-NZ 2.79Å; E367-K370 IonicContact OE2-NZ 3.66Å; E367-K370 PolarHBondContact OE2-NZ 3.24Å; K370-L372 PolarHBondContact O-N 3.26Å; K370-I373 PolarHBondContact O-N 3.06Å; K370-V374 WeakPolarHBondContact O-CB 3.37Å; K370-V374 VanDerWaalsContact O-CG2 3.27Å; K370-V374 WeakPolarHBondContact O-CG2 3.46Å; K370-V374 PolarHBondContact O-N 2.87Å; K370-M408 HydrophobicContact CD-CE 4.38Å; K370-M408 HydrophobicContact CG-CE 3.62Å; K370-M408 HydrophobicContact CG-SD 4.39Å; K370-V800 HydrophobicContact CB-CG1 3.95Å; K370-N801 VanDerWaalsContact CD-OD1 3.24Å; K370-N801 WeakPolarHBondContact CD-OD1 3.41Å; K370-N801 WeakPolarHBondContact CE-OD1 3.4Å; K370-N801 PolarHBondContact NZ-OD1 3.42Å; K370-W804 HydrophobicContact CB-CD2 4.41Å; K370-W804 HydrophobicContact CB-CE3 4.26Å; K370-W804 HydrophobicContact CB-CG 4.49Å; K370-W804 HydrophobicContact CD-CG 4.28Å; K370-W804 HydrophobicContact CG-CD2 4.06Å; K370-W804 HydrophobicContact CG-CE3 4.27Å; K370-W804 HydrophobicContact CG-CG 4.17Å
371	G	92.4	Very high	89.9	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-57.4	-49.4	178.5	0	0	0	0	0	112.4	E367 L368 I369 I373 V374 F375	E367-G371 PolarHBondContact O-N 3.48Å; L368-G371 PolarHBondContact O-N 2.61Å; I369-G371 VanDerWaalsContact C-N 3.35Å; I369-G371 PolarHBondContact O-N 2.81Å; G371-I373 PolarHBondContact O-N 3.43Å; G371-V374 PolarHBondContact O-N 2.75Å; G371-F375 WeakPolarHBondContact O-CB 3.05Å; G371-F375 WeakPolarHBondContact O-CD2 3.43Å; G371-F375 PolarHBondContact O-N 3.48Å
372	L	93.9	Very high	89.9	Confident	1 Å²	1	36 Å²	36	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-61.6	-44.8	179.1	-73.7	166.9	0	0	0	112.1	L324 T328 L340 A346 A356 L357 A360 L368 I369 K370 F375 G376 A377	L324-L372 HydrophobicContact CD2-CD2 4.11Å; T328-L372 HydrophobicContact CG2-CD1 4.4Å; L340-L372 HydrophobicContact CD1-CD2 4.09Å; L340-L372 HydrophobicContact CD2-CD2 4.05Å; A346-L372 HydrophobicContact CB-CD2 4.09Å; A356-L372 HydrophobicContact CB-CD1 4.01Å; A356-L372 HydrophobicContact CB-CD2 3.86Å; L357-L372 HydrophobicContact CD1-CB 4.17Å; L357-L372 HydrophobicContact CD1-CD1 4.44Å; A360-L372 HydrophobicContact CB-CD1 3.81Å; L368-L372 VanDerWaalsContact O-CB 3.28Å; L368-L372 WeakPolarHBondContact O-CB 3.27Å; L368-L372 WeakPolarHBondContact O-CD1 3.25Å; L368-L372 WeakPolarHBondContact O-CG 3.06Å; L368-L372 PolarHBondContact O-N 3.4Å; I369-L372 PolarHBondContact O-N 3.4Å; K370-L372 PolarHBondContact O-N 3.26Å; L372-F375 CarbonylContact O-C 3.49Å; L372-F375 PolarHBondContact O-N 2.94Å; L372-G376 PolarHBondContact O-N 3.16Å; L372-A377 VanDerWaalsContact C-CB 3.48Å; L372-A377 HydrophobicContact CB-CB 3.94Å; L372-A377 WeakPolarHBondContact O-CB 3.48Å; L372-A377 PolarHBondContact O-N 3.13Å
373	I	90.1	Very high	90	Very high	9 Å²	9	31.2 Å²	31.2	5%	0.046	16%	0.164	C	C	.	.	H	α-helix	trans	-65.1	-45.5	179.2	-64.7	167	0	0	0	110.9	L357 I369 K370 G371 F375 G376 V379 M408 V412 W804	L357-I373 HydrophobicContact CD1-CD1 4.43Å; L357-I373 HydrophobicContact CD1-CG1 4.02Å; L357-I373 HydrophobicContact CD2-CG1 4.27Å; I369-I373 HydrophobicContact CG2-CD1 3.84Å; I369-I373 VanDerWaalsContact O-CG1 3.32Å; I369-I373 WeakPolarHBondContact O-CG1 3.47Å; I369-I373 PolarHBondContact O-N 3.35Å; K370-I373 PolarHBondContact O-N 3.06Å; G371-I373 PolarHBondContact O-N 3.43Å; I373-F375 PolarHBondContact O-N 3.21Å; I373-G376 PolarHBondContact O-N 3.15Å; I373-V379 HydrophobicContact CD1-CG1 4.36Å; I373-V379 HydrophobicContact CG1-CG1 4.24Å; I373-M408 HydrophobicContact CD1-SD 4.44Å; I373-V412 HydrophobicContact CG2-CG1 4.07Å; I373-V412 HydrophobicContact CG2-CG2 4.04Å; I373-W804 HydrophobicContact CB-CZ3 4.1Å; I373-W804 HydrophobicContact CD1-CH2 4.44Å; I373-W804 HydrophobicContact CD1-CZ3 4.01Å; I373-W804 HydrophobicContact CG2-CZ3 3.83Å
374	V	90	Very high	90.2	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-55.6	-42.1	175.3	165.7	0	0	0	0	110.1	K370 G371 G376 R533 L803 W804	K370-V374 WeakPolarHBondContact O-CB 3.37Å; K370-V374 VanDerWaalsContact O-CG2 3.27Å; K370-V374 WeakPolarHBondContact O-CG2 3.46Å; K370-V374 PolarHBondContact O-N 2.87Å; G371-V374 PolarHBondContact O-N 2.75Å; V374-G376 PolarHBondContact O-N 3.02Å; V374-R533 VanDerWaalsContact O-CZ 3.22Å; V374-R533 PolarHBondContact O-NH1 3.16Å; V374-R533 PolarHBondContact O-NH2 3.48Å; V374-L803 HydrophobicContact CB-CB 4.5Å; V374-L803 HydrophobicContact CG1-CB 3.61Å; V374-L803 HydrophobicContact CG1-CD1 3.59Å; V374-L803 HydrophobicContact CG1-CG 4.23Å; V374-L803 HydrophobicContact CG2-CB 4Å; V374-W804 HydrophobicContact CG2-CB 4.28Å; V374-W804 HydrophobicContact CG2-CE3 4.43Å
375	F	90.6	Very high	90.2	Very high	21 Å²	21	37.6 Å²	37.6	9%	0.092	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	14.7	178.6	-78.2	-103.8	0	0	0	114.6	M337 L340 T341 G371 L372 I373 F537	M337-F375 HydrophobicContact CE-CD2 4.29Å; M337-F375 HydrophobicContact CE-CE2 3.46Å; M337-F375 VanDerWaalsContact CE-CE2 3.46Å; M337-F375 HydrophobicContact CE-CZ 3.78Å; L340-F375 HydrophobicContact CB-CB 4.47Å; L340-F375 HydrophobicContact CB-CD1 3.76Å; L340-F375 HydrophobicContact CB-CE1 4.1Å; L340-F375 HydrophobicContact CB-CG 4.05Å; L340-F375 HydrophobicContact CD1-CB 4.31Å; L340-F375 HydrophobicContact CD1-CD2 4.46Å; L340-F375 HydrophobicContact CD1-CG 4.28Å; L340-F375 HydrophobicContact CD2-CB 4.21Å; T341-F375 HydrophobicContact CG2-CE1 3.9Å; T341-F375 HydrophobicContact CG2-CZ 3.83Å; G371-F375 WeakPolarHBondContact O-CB 3.05Å; G371-F375 WeakPolarHBondContact O-CD2 3.43Å; G371-F375 PolarHBondContact O-N 3.48Å; L372-F375 CarbonylContact O-C 3.49Å; L372-F375 PolarHBondContact O-N 2.94Å; I373-F375 PolarHBondContact O-N 3.21Å; F375-F537 HydrophobicContact CE2-CE2 4.11Å; F375-F537 HydrophobicContact CE2-CZ 4.25Å; F375-F537 AromaticContact CZ-CD2 3.82Å; F375-F537 HydrophobicContact CZ-CD2 3.82Å; F375-F537 AromaticContact CZ-CE2 3.7Å; F375-F537 HydrophobicContact CZ-CE2 3.7Å; F375-F537 HydrophobicContact CZ-CG 4.35Å; F375-F537 HydrophobicContact CZ-CZ 4.14Å
376	G	87.6	Confident	90.1	Very high	40 Å²	40	37.1 Å²	37.1	41%	0.412	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	21	170	0	0	0	0	0	115	N347 L372 I373 V374 D378	N347-G376 PolarHBondContact ND2-O 2.82Å; L372-G376 PolarHBondContact O-N 3.16Å; I373-G376 PolarHBondContact O-N 3.15Å; V374-G376 PolarHBondContact O-N 3.02Å; G376-D378 PolarHBondContact O-N 3.18Å
377	A	90.9	Very high	90.1	Very high	8 Å²	8	36.8 Å²	36.8	7%	0.066	21%	0.207	C	C	.	.			trans	-62.8	127.7	169.9	0	0	0	0	0	110.8	A346 N347 L357 L372	A346-A377 HydrophobicContact CB-CB 4Å; N347-A377 WeakPolarHBondContact OD1-CA 3.4Å; L357-A377 HydrophobicContact CB-CB 4.15Å; L357-A377 HydrophobicContact CD2-CB 3.96Å; L357-A377 HydrophobicContact CG-CB 4.48Å; L372-A377 VanDerWaalsContact C-CB 3.48Å; L372-A377 HydrophobicContact CB-CB 3.94Å; L372-A377 WeakPolarHBondContact O-CB 3.48Å; L372-A377 PolarHBondContact O-N 3.13Å
378	D	87.8	Confident	90.1	Very high	71 Å²	71	35.7 Å²	35.7	38%	0.38	20%	0.204	S	C	.	.			trans	-76.6	123.3	177.1	-173.3	0.1	0	0	0	109.8	N347 G376 E380 I381	N347-D378 PolarHBondContact OD1-N 3.4Å; G376-D378 PolarHBondContact O-N 3.18Å; D378-E380 VanDerWaalsContact C-N 3.34Å; D378-E380 PolarHBondContact OD1-N 3.12Å; D378-I381 HydrophobicContact CB-CB 4.11Å; D378-I381 HydrophobicContact CB-CG2 4.32Å; D378-I381 VanDerWaalsContact O-CG2 3.22Å; D378-I381 WeakPolarHBondContact O-CG2 3.38Å
379	V	86.9	Confident	89.7	Confident	11 Å²	11	35.5 Å²	35.5	7%	0.067	20%	0.202	C	C	.	.	S	Bend	trans	-82.6	-13.4	179.8	-64.4	0	0	0	0	112.6	L357 I373 P389 L409 V412 V414	L357-V379 HydrophobicContact CD2-CG1 3.97Å; I373-V379 HydrophobicContact CD1-CG1 4.36Å; I373-V379 HydrophobicContact CG1-CG1 4.24Å; V379-P389 WeakPolarHBondContact O-CD 2.84Å; V379-L409 HydrophobicContact CB-CD2 3.99Å; V379-L409 HydrophobicContact CG1-CD2 3.74Å; V379-V412 HydrophobicContact CG1-CG1 4.08Å; V379-V412 HydrophobicContact CG2-CG1 4.19Å; V379-V414 HydrophobicContact CB-CG2 3.87Å; V379-V414 HydrophobicContact CG2-CG2 3.5Å; V379-V414 VanDerWaalsContact CG2-CG2 3.5Å
380	E	86.9	Confident	89.3	Confident	77 Å²	77	35.9 Å²	35.9	36%	0.36	21%	0.207	S	C	.	.	S	Bend	trans	-105.2	2.4	179.9	-61.7	-59.3	157.3	0	0	112.9	D378 H382 V414	D378-E380 VanDerWaalsContact C-N 3.34Å; D378-E380 PolarHBondContact OD1-N 3.12Å; E380-H382 PolarHBondContact O-CE1 3.37Å; E380-H382 PolarHBondContact O-N 3.25Å; E380-H382 PolarHBondContact O-ND1 2.76Å; E380-V414 WeakPolarHBondContact OE1-CA 3.45Å; E380-V414 WeakPolarHBondContact OE1-CB 3.23Å; E380-V414 WeakPolarHBondContact OE1-CG1 3.31Å; E380-V414 WeakPolarHBondContact OE1-CG2 3.45Å
381	I	89.1	Confident	89	Confident	27 Å²	27	38.6 Å²	38.6	14%	0.138	22%	0.222	C	C	.	.			trans	-69.2	129.4	178.8	-165.6	163.4	0	0	0	110.4	N347 K349 T355 H358 D378 P389	N347-I381 HydrophobicContact CB-CD1 4.39Å; K349-I381 HydrophobicContact CG-CD1 4.31Å; T355-I381 HydrophobicContact CG2-CD1 3.89Å; T355-I381 HydrophobicContact CG2-CG1 4.38Å; T355-I381 HydrophobicContact CG2-CG2 3.68Å; H358-I381 PolarHBondContact CE1-O 3.39Å; H358-I381 PolarHBondContact NE2-O 3.11Å; D378-I381 HydrophobicContact CB-CB 4.11Å; D378-I381 HydrophobicContact CB-CG2 4.32Å; D378-I381 VanDerWaalsContact O-CG2 3.22Å; D378-I381 WeakPolarHBondContact O-CG2 3.38Å; I381-P389 HydrophobicContact CG2-CG 4.43Å; I381-P389 VanDerWaalsContact O-CD 3.29Å; I381-P389 WeakPolarHBondContact O-CD 3.42Å
382	H	90	Very high	88.6	Confident	93 Å²	93	38.8 Å²	38.8	43%	0.431	22%	0.223	S	C	.	.			trans	-93.8	137.7	-177.2	-62.8	61.3	0	0	0	110.9	K349 E380 G386 E387	K349-H382 WeakPolarHBondContact CE-O 3.33Å; K349-H382 PolarHBondContact NZ-O 2.95Å; E380-H382 PolarHBondContact O-CE1 3.37Å; E380-H382 PolarHBondContact O-N 3.25Å; E380-H382 PolarHBondContact O-ND1 2.76Å; H382-G386 PolarHBondContact CD2-O 3.16Å; H382-E387 WeakPolarHBondContact CA-O 3.44Å
383	N	92.1	Very high	88.1	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.043	22%	0.223	C	C	.	.			trans	-77.3	-178.5	168.4	73.8	3.9	0	0	0	111.7	D352 G353 N354 L385 G386 E387	D352-N383 WeakPolarHBondContact O-CB 3.3Å; G353-N383 WeakPolarHBondContact O-CA 3.42Å; N354-N383 WeakPolarHBondContact OD1-CB 2.92Å; N354-N383 PolarHBondContact OD1-ND2 2.97Å; N383-L385 PolarHBondContact O-N 2.93Å; N383-L385 VanDerWaalsContact O-N 3.16Å; N383-L385 WeakPolarHBondContact OD1-CA 3.44Å; N383-L385 WeakPolarHBondContact OD1-CB 3.41Å; N383-L385 PolarHBondContact OD1-N 3.14Å; N383-G386 PolarHBondContact O-N 3.46Å; N383-G386 PolarHBondContact OD1-N 2.88Å; N383-E387 PolarHBondContact N-O 3.18Å; N383-E387 WeakPolarHBondContact OD1-CB 3.48Å; N383-E387 PolarHBondContact OD1-N 3.05Å; N383-E387 PolarHBondContact OD1-O 3.2Å
384	D	92.6	Very high	87.6	Confident	121 Å²	121	39.4 Å²	39.4	65%	0.647	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-16.4	-177.3	-65.1	-16.6	0	0	0	112.9	D352 G353 G386	D352-D384 WeakPolarHBondContact CA-OD2 3.3Å; D352-D384 WeakPolarHBondContact O-CB 3.36Å; D352-D384 PolarHBondContact O-N 3.32Å; G353-D384 WeakPolarHBondContact CA-OD1 3.39Å; G353-D384 PolarHBondContact N-OD2 2.86Å; G353-D384 VanDerWaalsContact N-OD2 3.08Å; D384-G386 VanDerWaalsContact C-N 3.34Å
385	L	89.6	Confident	87.2	Confident	130 Å²	130	46.3 Å²	46.3	68%	0.681	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-0.5	173.8	-58	175.5	0	0	0	112.9	N383 E387	N383-L385 PolarHBondContact O-N 2.93Å; N383-L385 VanDerWaalsContact O-N 3.16Å; N383-L385 WeakPolarHBondContact OD1-CA 3.44Å; N383-L385 WeakPolarHBondContact OD1-CB 3.41Å; N383-L385 PolarHBondContact OD1-N 3.14Å; L385-E387 HydrophobicContact CB-CG 4.12Å; L385-E387 PolarHBondContact O-N 2.92Å
386	G	88.4	Confident	86.7	Confident	45 Å²	45	47.1 Å²	47.1	46%	0.464	26%	0.262	S	S	.	.	S	Bend	trans	71.8	15.4	-174.2	0	0	0	0	0	113.8	H382 N383 D384	H382-G386 PolarHBondContact CD2-O 3.16Å; N383-G386 PolarHBondContact O-N 3.46Å; N383-G386 PolarHBondContact OD1-N 2.88Å; D384-G386 VanDerWaalsContact C-N 3.34Å
387	E	88.1	Confident	86.2	Confident	28 Å²	28	45.6 Å²	45.6	13%	0.131	25%	0.245	C	C	.	.			trans	-84.5	137.5	174.4	-55.5	-176.8	128	0	0	109.9	H358 H382 N383 L385 L391 I392 R395	H358-E387 PolarHBondContact NE2-O 3.16Å; H358-E387 VanDerWaalsContact NE2-O 3.15Å; H382-E387 WeakPolarHBondContact CA-O 3.44Å; N383-E387 PolarHBondContact N-O 3.18Å; N383-E387 WeakPolarHBondContact OD1-CB 3.48Å; N383-E387 PolarHBondContact OD1-N 3.05Å; N383-E387 PolarHBondContact OD1-O 3.2Å; L385-E387 HydrophobicContact CB-CG 4.12Å; L385-E387 PolarHBondContact O-N 2.92Å; E387-L391 HydrophobicContact CB-CD2 4.1Å; E387-L391 HydrophobicContact CG-CD2 4.05Å; E387-I392 HydrophobicContact CB-CG1 4.09Å; E387-R395 IonicContact OE1-CZ 3.43Å; E387-R395 IonicContact OE1-NE 3.83Å; E387-R395 PolarHBondContact OE1-NE 3.44Å; E387-R395 IonicContact OE1-NH2 2.81Å; E387-R395 PolarHBondContact OE1-NH2 2.92Å; E387-R395 IonicContact OE2-NH2 2.67Å; E387-R395 PolarHBondContact OE2-NH2 3.36Å; E387-R395 VanDerWaalsContact OE2-NH2 3.15Å
388	T	89	Confident	85.2	Confident	24 Å²	24	53.9 Å²	53.9	15%	0.147	28%	0.28	C	S	.	.			trans	-84.9	159.3	165.7	61.5	0	0	0	0	110.3	G390 L391 I392	T388-G390 PolarHBondContact O-N 3.35Å; T388-G390 VanDerWaalsContact O-N 3.15Å; T388-L391 WeakPolarHBondContact O-CB 3.46Å; T388-L391 PolarHBondContact O-N 3.49Å; T388-L391 PolarHBondContact OG1-N 3.09Å; T388-I392 PolarHBondContact O-N 2.98Å; T388-I392 VanDerWaalsContact O-N 3.11Å
389	P	86.4	Confident	84.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-53.5	-36.8	175.1	-24.5	30.4	0	0	0	112.6	L357 H358 M361 V379 I381 I392 A393	L357-P389 HydrophobicContact CB-CG 4.43Å; L357-P389 HydrophobicContact CD2-CB 3.99Å; L357-P389 HydrophobicContact CD2-CG 3.95Å; L357-P389 HydrophobicContact CG-CB 3.88Å; L357-P389 HydrophobicContact CG-CG 4.14Å; H358-P389 VanDerWaalsContact NE2-CD 3.31Å; H358-P389 WeakPolarHBondContact NE2-CD 3.26Å; M361-P389 HydrophobicContact CG-CB 4.16Å; V379-P389 WeakPolarHBondContact O-CD 2.84Å; I381-P389 HydrophobicContact CG2-CG 4.43Å; I381-P389 VanDerWaalsContact O-CD 3.29Å; I381-P389 WeakPolarHBondContact O-CD 3.42Å; P389-I392 PolarHBondContact O-N 3.48Å; P389-A393 PolarHBondContact O-N 3.46Å
390	G	82.7	Confident	83.4	Confident	9 Å²	9	57.4 Å²	57.4	9%	0.093	32%	0.317	C	S	.	.	H	α-helix	trans	-67.2	-36.4	176.5	0	0	0	0	0	114.3	T388 I392 A393 A394	T388-G390 PolarHBondContact O-N 3.35Å; T388-G390 VanDerWaalsContact O-N 3.15Å; G390-I392 VanDerWaalsContact C-N 3.34Å; G390-A393 PolarHBondContact O-N 3.21Å; G390-A394 PolarHBondContact O-N 2.8Å
391	L	83.9	Confident	82.5	Confident	86 Å²	86	56.6 Å²	56.6	45%	0.45	32%	0.315	S	S	.	.	H	α-helix	trans	-66.2	-39.5	173.9	-175	62	0	0	0	111.3	E387 T388 A394 R395	E387-L391 HydrophobicContact CB-CD2 4.1Å; E387-L391 HydrophobicContact CG-CD2 4.05Å; T388-L391 WeakPolarHBondContact O-CB 3.46Å; T388-L391 PolarHBondContact O-N 3.49Å; T388-L391 PolarHBondContact OG1-N 3.09Å; L391-A394 WeakPolarHBondContact O-CB 3.29Å; L391-A394 PolarHBondContact O-N 3.33Å; L391-R395 WeakPolarHBondContact O-CB 3.22Å; L391-R395 PolarHBondContact O-N 2.98Å; L391-R395 VanDerWaalsContact O-N 3.09Å
392	I	84.6	Confident	81.6	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-60.4	-50.4	173.4	-63.9	-168.6	0	0	0	110.1	H358 K362 E387 T388 P389 G390 A394 R395 T396	H358-I392 HydrophobicContact CB-CD1 4.01Å; K362-I392 HydrophobicContact CB-CG2 3.89Å; K362-I392 HydrophobicContact CG-CG2 4.49Å; E387-I392 HydrophobicContact CB-CG1 4.09Å; T388-I392 PolarHBondContact O-N 2.98Å; T388-I392 VanDerWaalsContact O-N 3.11Å; P389-I392 PolarHBondContact O-N 3.48Å; G390-I392 VanDerWaalsContact C-N 3.34Å; I392-A394 VanDerWaalsContact C-N 3.27Å; I392-A394 PolarHBondContact O-N 3.43Å; I392-R395 PolarHBondContact O-N 3.21Å; I392-T396 HydrophobicContact CG2-CG2 4.08Å; I392-T396 PolarHBondContact O-N 2.84Å; I392-T396 PolarHBondContact O-OG1 2.86Å
393	A	82.2	Confident	80.6	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-54.7	-43.1	177.3	0	0	0	0	0	112.1	M361 P389 G390 R395 S397 L405	M361-A393 HydrophobicContact CB-CB 4.13Å; M361-A393 HydrophobicContact CG-CB 4.3Å; M361-A393 HydrophobicContact SD-CB 3.8Å; P389-A393 PolarHBondContact O-N 3.46Å; G390-A393 PolarHBondContact O-N 3.21Å; A393-R395 VanDerWaalsContact C-N 3.27Å; A393-R395 PolarHBondContact O-N 3.23Å; A393-S397 WeakPolarHBondContact O-CB 3.32Å; A393-S397 PolarHBondContact O-N 3.47Å; A393-L405 HydrophobicContact CB-CB 4.44Å; A393-L405 HydrophobicContact CB-CD1 4.19Å
394	A	80.9	Confident	79.6	Confident	23 Å²	23	69.9 Å²	69.9	19%	0.19	37%	0.365	C	S	.	.	H	α-helix	trans	-62.5	-32.1	176.8	0	0	0	0	0	113.4	G390 L391 I392 R402 L406	G390-A394 PolarHBondContact O-N 2.8Å; L391-A394 WeakPolarHBondContact O-CB 3.29Å; L391-A394 PolarHBondContact O-N 3.33Å; I392-A394 VanDerWaalsContact C-N 3.27Å; I392-A394 PolarHBondContact O-N 3.43Å; A394-R402 PolarHBondContact O-NE 3.27Å; A394-R402 VanDerWaalsContact O-NE 3.16Å; A394-R402 PolarHBondContact O-NH2 3.46Å; A394-R402 VanDerWaalsContact O-NH2 3.17Å; A394-L406 HydrophobicContact CB-CD2 4.09Å
395	R	81.7	Confident	78.6	Confident	147 Å²	147	64.1 Å²	64.1	56%	0.555	33%	0.334	S	S	*	.	H	α-helix	trans	-87.3	-39.3	-177.2	-176.7	170.3	62.1	73.9	-4.6	112.9	E387 L391 I392 A393	E387-R395 IonicContact OE1-CZ 3.43Å; E387-R395 IonicContact OE1-NE 3.83Å; E387-R395 PolarHBondContact OE1-NE 3.44Å; E387-R395 IonicContact OE1-NH2 2.81Å; E387-R395 PolarHBondContact OE1-NH2 2.92Å; E387-R395 IonicContact OE2-NH2 2.67Å; E387-R395 PolarHBondContact OE2-NH2 3.36Å; E387-R395 VanDerWaalsContact OE2-NH2 3.15Å; L391-R395 WeakPolarHBondContact O-CB 3.22Å; L391-R395 PolarHBondContact O-N 2.98Å; L391-R395 VanDerWaalsContact O-N 3.09Å; I392-R395 PolarHBondContact O-N 3.21Å; A393-R395 VanDerWaalsContact C-N 3.27Å; A393-R395 PolarHBondContact O-N 3.23Å
396	T	80.1	Confident	77.7	Confident	37 Å²	37	60.8 Å²	60.8	23%	0.227	32%	0.316	C	S	.	.	H	α-helix	trans	-101.5	-35.4	-169	59.2	0	0	0	0	113.9	K362 I392	K362-T396 HydrophobicContact CG-CG2 4.45Å; I392-T396 HydrophobicContact CG2-CG2 4.08Å; I392-T396 PolarHBondContact O-N 2.84Å; I392-T396 PolarHBondContact O-OG1 2.86Å
397	S	75.6	Confident	76.7	Confident	8 Å²	8	63.8 Å²	63.8	6%	0.056	32%	0.322	C	S	.	.			trans	-70.9	136.9	-177.9	-175.1	0	0	0	0	110.8	D364 A393 R402	D364-S397 PolarHBondContact OD1-OG 3.2Å; A393-S397 WeakPolarHBondContact O-CB 3.32Å; A393-S397 PolarHBondContact O-N 3.47Å; S397-R402 WeakPolarHBondContact OG-CA 3.21Å; S397-R402 PolarHBondContact OG-N 2.96Å
398	K	70.2	Confident	75.9	Confident	182 Å²	182	62.9 Å²	62.9	79%	0.791	32%	0.318	S	S	*	.			trans	-117.1	145.1	-178.6	-63.2	-177	-176.9	177.6	0	110.2
399	G	70.4	Confident	75	Confident	58 Å²	58	62 Å²	62	60%	0.598	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-148.9	172.3	0	0	0	0	0	114.7	N401	G399-N401 VanDerWaalsContact C-N 3.3Å; G399-N401 PolarHBondContact O-N 3.25Å
400	P	66.4	Low	74.1	Confident	98 Å²	98	64 Å²	64	64%	0.636	33%	0.325	S	S	*	.	H	α-helix	trans	-66.8	-29.3	-173.3	26.4	-33.2	0	0	0	113.2	R402 R403 I404	P400-R402 VanDerWaalsContact C-N 3.32Å; P400-R402 PolarHBondContact O-N 3.03Å; P400-R403 PolarHBondContact O-N 3.35Å; P400-R403 VanDerWaalsContact O-N 3.14Å; P400-I404 PolarHBondContact O-N 3.25Å
401	N	68	Low	73.1	Confident	60 Å²	60	64.9 Å²	64.9	32%	0.321	33%	0.331	S	S	.	.	H	α-helix	trans	-62.2	-37.9	-178.6	-67.8	-3.9	0	0	0	112.1	D364 G399 R403 I404 L405	D364-N401 VanDerWaalsContact OD2-CB 3.27Å; D364-N401 WeakPolarHBondContact OD2-CB 3.25Å; D364-N401 PolarHBondContact OD2-ND2 2.93Å; G399-N401 VanDerWaalsContact C-N 3.3Å; G399-N401 PolarHBondContact O-N 3.25Å; N401-R403 VanDerWaalsContact C-N 3.28Å; N401-R403 PolarHBondContact O-N 3.06Å; N401-I404 PolarHBondContact O-N 3.34Å; N401-I404 VanDerWaalsContact O-N 3.16Å; N401-L405 WeakPolarHBondContact O-CB 3.35Å; N401-L405 VanDerWaalsContact O-CG 3.3Å; N401-L405 WeakPolarHBondContact O-CG 3.47Å; N401-L405 PolarHBondContact O-N 2.91Å
402	R	70.6	Confident	72	Confident	115 Å²	115	62.4 Å²	62.4	43%	0.434	32%	0.319	S	S	.	.	H	α-helix	trans	-56.5	-42.3	175.3	-178.4	-177.9	172.9	-177.3	3.1	112.4	A394 S397 P400 L405 L406	A394-R402 PolarHBondContact O-NE 3.27Å; A394-R402 VanDerWaalsContact O-NE 3.16Å; A394-R402 PolarHBondContact O-NH2 3.46Å; A394-R402 VanDerWaalsContact O-NH2 3.17Å; S397-R402 WeakPolarHBondContact OG-CA 3.21Å; S397-R402 PolarHBondContact OG-N 2.96Å; P400-R402 VanDerWaalsContact C-N 3.32Å; P400-R402 PolarHBondContact O-N 3.03Å; R402-L405 PolarHBondContact O-N 2.94Å; R402-L406 HydrophobicContact CG-CD1 3.96Å; R402-L406 HydrophobicContact CG-CG 4.46Å; R402-L406 WeakPolarHBondContact O-CB 3.39Å; R402-L406 VanDerWaalsContact O-CG 3.26Å; R402-L406 WeakPolarHBondContact O-CG 3.33Å; R402-L406 PolarHBondContact O-N 2.98Å
403	R	70	Confident	70.8	Confident	209 Å²	209	64 Å²	64	79%	0.789	34%	0.336	S	S	*	.	H	α-helix	trans	-67.3	-43.2	-179.7	-173.1	175.4	179.1	173.9	-1.4	110.4	P400 N401 L406 D407	P400-R403 PolarHBondContact O-N 3.35Å; P400-R403 VanDerWaalsContact O-N 3.14Å; N401-R403 VanDerWaalsContact C-N 3.28Å; N401-R403 PolarHBondContact O-N 3.06Å; R403-L406 PolarHBondContact O-N 3.24Å; R403-D407 VanDerWaalsContact O-CB 3.29Å; R403-D407 WeakPolarHBondContact O-CB 3.35Å; R403-D407 PolarHBondContact O-N 3.27Å
404	I	69.5	Low	69.7	Low	83 Å²	83	65.3 Å²	65.3	43%	0.426	34%	0.344	S	S	.	.	H	α-helix	trans	-62.3	-45.2	176.6	-64	161.4	0	0	0	110.5	M366 P400 N401 D407 M408	M366-I404 HydrophobicContact CE-CB 4.29Å; M366-I404 HydrophobicContact CE-CG2 3.76Å; M366-I404 HydrophobicContact SD-CG2 4.27Å; P400-I404 PolarHBondContact O-N 3.25Å; N401-I404 PolarHBondContact O-N 3.34Å; N401-I404 VanDerWaalsContact O-N 3.16Å; I404-D407 PolarHBondContact O-N 3.36Å; I404-M408 WeakPolarHBondContact O-CB 3.37Å; I404-M408 PolarHBondContact O-N 3.04Å
405	L	72.5	Confident	68.2	Low	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-65	-41.5	179.4	-71.2	-178.8	0	0	0	113.1	M361 D364 M366 I369 A393 N401 R402 M408 L409	M361-L405 HydrophobicContact SD-CD1 4.14Å; M361-L405 HydrophobicContact SD-CD2 4.04Å; D364-L405 VanDerWaalsContact OD1-CD1 3.27Å; D364-L405 WeakPolarHBondContact OD1-CD1 3.36Å; M366-L405 HydrophobicContact CE-CD2 3.53Å; M366-L405 HydrophobicContact CE-CG 3.94Å; M366-L405 HydrophobicContact SD-CD2 3.7Å; I369-L405 HydrophobicContact CD1-CD1 4.34Å; I369-L405 HydrophobicContact CD1-CD2 3.57Å; I369-L405 HydrophobicContact CG2-CD2 4.32Å; A393-L405 HydrophobicContact CB-CB 4.44Å; A393-L405 HydrophobicContact CB-CD1 4.19Å; N401-L405 WeakPolarHBondContact O-CB 3.35Å; N401-L405 VanDerWaalsContact O-CG 3.3Å; N401-L405 WeakPolarHBondContact O-CG 3.47Å; N401-L405 PolarHBondContact O-N 2.91Å; R402-L405 PolarHBondContact O-N 2.94Å; L405-M408 HydrophobicContact CD2-SD 4.32Å; L405-M408 WeakPolarHBondContact O-CB 3.49Å; L405-M408 PolarHBondContact O-N 3.12Å; L405-L409 WeakPolarHBondContact O-CB 3.33Å; L405-L409 WeakPolarHBondContact O-CD1 3.49Å; L405-L409 VanDerWaalsContact O-CG 3.3Å; L405-L409 WeakPolarHBondContact O-CG 3.5Å; L405-L409 PolarHBondContact O-N 3.1Å
406	L	70.9	Confident	66.5	Low	60 Å²	60	74.9 Å²	74.9	31%	0.314	38%	0.383	S	S	.	.	H	α-helix	trans	-69.5	-36.9	177.6	-69.5	174.2	0	0	0	111.7	A394 R402 R403 C410	A394-L406 HydrophobicContact CB-CD2 4.09Å; R402-L406 HydrophobicContact CG-CD1 3.96Å; R402-L406 HydrophobicContact CG-CG 4.46Å; R402-L406 WeakPolarHBondContact O-CB 3.39Å; R402-L406 VanDerWaalsContact O-CG 3.26Å; R402-L406 WeakPolarHBondContact O-CG 3.33Å; R402-L406 PolarHBondContact O-N 2.98Å; R403-L406 PolarHBondContact O-N 3.24Å; L406-C410 PolarHBondContact O-N 3.49Å; L406-C410 PolarHBondContact O-SG 2.99Å
407	D	68.1	Low	64.5	Low	108 Å²	108	79 Å²	79	58%	0.578	41%	0.411	S	S	*	.	H	α-helix	trans	-65.2	-46	173.5	-160.9	52.9	0	0	0	110.8	R403 I404 L409 C410 S411	R403-D407 VanDerWaalsContact O-CB 3.29Å; R403-D407 WeakPolarHBondContact O-CB 3.35Å; R403-D407 PolarHBondContact O-N 3.27Å; I404-D407 PolarHBondContact O-N 3.36Å; D407-L409 VanDerWaalsContact C-N 3.32Å; D407-L409 PolarHBondContact O-N 3.43Å; D407-C410 WeakPolarHBondContact O-CB 3.4Å; D407-C410 PolarHBondContact O-N 3.41Å; D407-C410 VanDerWaalsContact O-N 3.12Å; D407-S411 PolarHBondContact O-N 3.5Å; D407-S411 PolarHBondContact O-OG 3.32Å; D407-S411 VanDerWaalsContact O-OG 3.07Å
408	M	70	Confident	62.6	Low	10 Å²	10	84.8 Å²	84.8	5%	0.049	44%	0.441	C	S	.	.	H	α-helix	trans	-51.9	-47.3	173.8	-177.2	179.9	-80.4	0	0	112.2	M366 I369 K370 I373 I404 L405 S411 V412 W804	M366-M408 HydrophobicContact SD-CE 3.4Å; M366-M408 WeakPolarHBondContact SD-CE 3.43Å; M366-M408 HydrophobicContact SD-SD 4.2Å; I369-M408 HydrophobicContact CG2-SD 3.58Å; I369-M408 VanDerWaalsContact CG2-SD 3.58Å; K370-M408 HydrophobicContact CD-CE 4.38Å; K370-M408 HydrophobicContact CG-CE 3.62Å; K370-M408 HydrophobicContact CG-SD 4.39Å; I373-M408 HydrophobicContact CD1-SD 4.44Å; I404-M408 WeakPolarHBondContact O-CB 3.37Å; I404-M408 PolarHBondContact O-N 3.04Å; L405-M408 HydrophobicContact CD2-SD 4.32Å; L405-M408 WeakPolarHBondContact O-CB 3.49Å; L405-M408 PolarHBondContact O-N 3.12Å; M408-S411 PolarHBondContact O-N 3.39Å; M408-V412 WeakPolarHBondContact O-CG2 3.31Å; M408-V412 PolarHBondContact O-N 3.23Å; M408-W804 HydrophobicContact CB-CH2 4.37Å; M408-W804 HydrophobicContact CB-CZ2 4.22Å; M408-W804 HydrophobicContact CE-CH2 4.45Å; M408-W804 HydrophobicContact CE-CZ2 4.06Å; M408-W804 HydrophobicContact CG-CH2 3.14Å; M408-W804 HydrophobicContact CG-CZ2 3.24Å; M408-W804 HydrophobicContact CG-CZ3 4.08Å; M408-W804 HydrophobicContact SD-CH2 4Å; M408-W804 HydrophobicContact SD-CZ2 4.16Å; M408-W804 HydrophobicContact SD-CZ3 4.43Å
409	L	70.8	Confident	61	Low	4 Å²	4	82 Å²	82	2%	0.021	44%	0.441	C	S	.	.	H	α-helix	trans	-70.2	-37.4	178.7	-73.3	164.3	0	0	0	112.9	M361 V379 L405 D407 S411 V412 G413 V414	M361-L409 HydrophobicContact CE-CD1 4.12Å; M361-L409 HydrophobicContact CE-CD2 3.95Å; M361-L409 HydrophobicContact CE-CG 4.16Å; V379-L409 HydrophobicContact CB-CD2 3.99Å; V379-L409 HydrophobicContact CG1-CD2 3.74Å; L405-L409 WeakPolarHBondContact O-CB 3.33Å; L405-L409 WeakPolarHBondContact O-CD1 3.49Å; L405-L409 VanDerWaalsContact O-CG 3.3Å; L405-L409 WeakPolarHBondContact O-CG 3.5Å; L405-L409 PolarHBondContact O-N 3.1Å; D407-L409 VanDerWaalsContact C-N 3.32Å; D407-L409 PolarHBondContact O-N 3.43Å; L409-S411 PolarHBondContact O-N 3.35Å; L409-V412 PolarHBondContact O-N 2.95Å; L409-V412 VanDerWaalsContact O-N 3.1Å; L409-G413 PolarHBondContact O-N 3.15Å; L409-V414 HydrophobicContact CB-CB 4.4Å; L409-V414 HydrophobicContact CB-CG2 4.03Å; L409-V414 HydrophobicContact CD2-CG2 4.2Å; L409-V414 WeakPolarHBondContact O-CB 3.47Å; L409-V414 WeakPolarHBondContact O-CG2 3.32Å; L409-V414 PolarHBondContact O-N 3.34Å
410	C	67.6	Low	59.2	Low	42 Å²	42	88.8 Å²	88.8	28%	0.284	45%	0.449	S	S	.	.	H	α-helix	trans	-59.9	-39.7	172.9	-69.1	0	0	0	0	110.9	L406 D407 V412 G413 F811	L406-C410 PolarHBondContact O-N 3.49Å; L406-C410 PolarHBondContact O-SG 2.99Å; D407-C410 WeakPolarHBondContact O-CB 3.4Å; D407-C410 PolarHBondContact O-N 3.41Å; D407-C410 VanDerWaalsContact O-N 3.12Å; C410-V412 PolarHBondContact O-N 2.93Å; C410-G413 PolarHBondContact O-N 3.38Å; C410-G413 VanDerWaalsContact O-N 3.12Å; C410-F811 VanDerWaalsContact O-CZ 3.24Å; C410-F811 WeakPolarHBondContact O-CZ 3.15Å
411	S	62.1	Low	57.6	Low	29 Å²	29	87.2 Å²	87.2	20%	0.203	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-5.6	177.8	-54.5	0	0	0	0	114.4	D407 M408 L409 M808 F811	D407-S411 PolarHBondContact O-N 3.5Å; D407-S411 PolarHBondContact O-OG 3.32Å; D407-S411 VanDerWaalsContact O-OG 3.07Å; M408-S411 PolarHBondContact O-N 3.39Å; L409-S411 PolarHBondContact O-N 3.35Å; S411-M808 WeakPolarHBondContact CB-SD 3.23Å; S411-M808 WeakPolarHBondContact O-CE 3.32Å; S411-F811 WeakPolarHBondContact O-CB 3.36Å; S411-F811 VanDerWaalsContact O-CD1 3.3Å; S411-F811 WeakPolarHBondContact O-CD1 3.41Å; S411-F811 VanDerWaalsContact O-CD2 3.3Å; S411-F811 WeakPolarHBondContact O-CD2 3.36Å; S411-F811 WeakPolarHBondContact O-CG 3.43Å
412	V	60.4	Low	56.7	Low	33 Å²	33	91.2 Å²	91.2	20%	0.2	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-1.5	172.1	-177.7	0	0	0	0	111.2	I373 V379 M408 L409 C410 W804 M808	I373-V412 HydrophobicContact CG2-CG1 4.07Å; I373-V412 HydrophobicContact CG2-CG2 4.04Å; V379-V412 HydrophobicContact CG1-CG1 4.08Å; V379-V412 HydrophobicContact CG2-CG1 4.19Å; M408-V412 WeakPolarHBondContact O-CG2 3.31Å; M408-V412 PolarHBondContact O-N 3.23Å; L409-V412 PolarHBondContact O-N 2.95Å; L409-V412 VanDerWaalsContact O-N 3.1Å; C410-V412 PolarHBondContact O-N 2.93Å; V412-W804 HydrophobicContact CG2-CH2 3.56Å; V412-W804 HydrophobicContact CG2-CZ3 3.97Å; V412-M808 HydrophobicContact CG2-CE 3.91Å
413	G	58.6	Low	55.1	Low	38 Å²	38	90.7 Å²	90.7	39%	0.392	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.9	12.5	173.5	0	0	0	0	0	116	L409 C410 Q415 F811	L409-G413 PolarHBondContact O-N 3.15Å; C410-G413 PolarHBondContact O-N 3.38Å; C410-G413 VanDerWaalsContact O-N 3.12Å; G413-Q415 PolarHBondContact O-N 3.21Å; G413-F811 VanDerWaalsContact CA-CE2 3.45Å
414	V	59.1	Low	53.6	Low	27 Å²	27	83.7 Å²	83.7	16%	0.164	47%	0.466	C	S	.	.			trans	-65.9	124.3	173.8	179.3	0	0	0	0	109.9	V379 E380 L409 R416	V379-V414 HydrophobicContact CB-CG2 3.87Å; V379-V414 HydrophobicContact CG2-CG2 3.5Å; V379-V414 VanDerWaalsContact CG2-CG2 3.5Å; E380-V414 WeakPolarHBondContact OE1-CA 3.45Å; E380-V414 WeakPolarHBondContact OE1-CB 3.23Å; E380-V414 WeakPolarHBondContact OE1-CG1 3.31Å; E380-V414 WeakPolarHBondContact OE1-CG2 3.45Å; L409-V414 HydrophobicContact CB-CB 4.4Å; L409-V414 HydrophobicContact CB-CG2 4.03Å; L409-V414 HydrophobicContact CD2-CG2 4.2Å; L409-V414 WeakPolarHBondContact O-CB 3.47Å; L409-V414 WeakPolarHBondContact O-CG2 3.32Å; L409-V414 PolarHBondContact O-N 3.34Å; V414-R416 PolarHBondContact O-N 3.17Å
415	Q	49.7	Very low	52.2	Low	168 Å²	168	85 Å²	85	79%	0.785	48%	0.481	S	S	*	.			trans	-68.9	130.4	172.2	-74.6	-175.6	0.7	0	0	109.7	G413 C417	G413-Q415 PolarHBondContact O-N 3.21Å; Q415-C417 PolarHBondContact O-N 3.37Å
416	R	45.4	Very low	50.7	Low	204 Å²	204	90.6 Å²	90.6	77%	0.77	52%	0.517	S	S	*	.			trans	-55	100.6	178.1	-100.8	-176.7	178.5	168	1.8	111.2	V414 L418	V414-R416 PolarHBondContact O-N 3.17Å; R416-L418 VanDerWaalsContact C-N 3.31Å; R416-L418 PolarHBondContact O-N 3.43Å
417	C	39.4	Very low	49.2	Very low	122 Å²	122	92.2 Å²	92.2	82%	0.824	53%	0.531	S	S	*	.			trans	-84.2	79	158.7	-66.2	0	0	0	0	108.8	Q415	Q415-C417 PolarHBondContact O-N 3.37Å
418	L	35.2	Very low	48	Very low	131 Å²	131	94.8 Å²	94.8	69%	0.686	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-67.3	140.4	157.3	-75.1	166.1	0	0	0	107.9	R416 R420	R416-L418 VanDerWaalsContact C-N 3.31Å; R416-L418 PolarHBondContact O-N 3.43Å; L418-R420 PolarHBondContact O-N 3.21Å
419	P	36.1	Very low	46.3	Very low	122 Å²	122	99.4 Å²	99.4	79%	0.792	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-57.2	128.1	166.6	1.2	3.9	0	0	0	108.7	S421	P419-S421 PolarHBondContact O-N 3.49Å
420	R	33.2	Very low	44.8	Very low	201 Å²	201	104.2 Å²	104.2	76%	0.758	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-51.2	125.9	177.3	-88.5	177.6	170	162.5	-1.9	109.7	L418	L418-R420 PolarHBondContact O-N 3.21Å
421	S	32.6	Very low	43.3	Very low	65 Å²	65	107.4 Å²	107.4	46%	0.455	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-68	147.3	169.5	60.4	0	0	0	0	109.6	P419 S423 S424	P419-S421 PolarHBondContact O-N 3.49Å; S421-S423 PolarHBondContact O-N 3.3Å; S421-S424 PolarHBondContact O-N 2.9Å; S421-S424 PolarHBondContact O-OG 3.37Å
422	P	48.4	Very low	41.8	Very low	144 Å²	144	112.4 Å²	112.4	94%	0.935	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-5	179.5	-20.5	31.7	0	0	0	114.9
423	S	37.1	Very low	40.7	Very low	105 Å²	105	116.4 Å²	116.4	73%	0.734	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	4.7	-171.4	56.5	0	0	0	0	115	S421	S421-S423 PolarHBondContact O-N 3.3Å
424	S	37.8	Very low	39.3	Very low	61 Å²	61	119.7 Å²	119.7	43%	0.427	70%	0.699	S	S	.	*	S	Bend	trans	-80.1	137.5	173.6	58.1	0	0	0	0	111.6	S421	S421-S424 PolarHBondContact O-N 2.9Å; S421-S424 PolarHBondContact O-OG 3.37Å
425	P	41.7	Very low	38.2	Very low	112 Å²	112	125.8 Å²	125.8	73%	0.727	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-61.5	154.6	175.9	7.1	-3	0	0	0	111.6
426	P	40.8	Very low	37.6	Very low	116 Å²	116	126.8 Å²	126.8	75%	0.753	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-62.2	149.6	179.7	27.2	-33.3	0	0	0	110.8	L428	P426-L428 PolarHBondContact O-N 2.99Å
427	P	39.5	Very low	36.9	Very low	95 Å²	95	123.7 Å²	123.7	62%	0.617	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-61.8	138.6	-177.8	25.4	-32.3	0	0	0	110.7
428	L	42.4	Very low	36.5	Very low	161 Å²	161	127.2 Å²	127.2	84%	0.843	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-56.8	139.9	163.6	-77.9	159.5	0	0	0	108.7	P426	P426-L428 PolarHBondContact O-N 2.99Å
429	P	34.3	Very low	36.3	Very low	107 Å²	107	127.1 Å²	127.1	70%	0.695	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-60.4	145.2	179.3	25.7	-32.6	0	0	0	110
430	P	38.6	Very low	36.2	Very low	106 Å²	106	133.1 Å²	133.1	69%	0.688	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-60.5	150.5	176.2	26	-32.8	0	0	0	110.2
431	P	37.5	Very low	36.2	Very low	109 Å²	109	128 Å²	128	71%	0.708	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-56.9	146.9	170.6	25.7	-32.3	0	0	0	109.3	V433	P431-V433 PolarHBondContact O-N 3.02Å
432	P	30.8	Very low	36.8	Very low	133 Å²	133	132 Å²	132	86%	0.864	77%	0.768	S	S	*	*			trans	-59.9	113.8	-174.1	23	-31.7	0	0	0	110.3	S434	P432-S434 PolarHBondContact O-N 3.5Å
433	V	35.8	Very low	36.3	Very low	117 Å²	117	126.9 Å²	126.9	71%	0.709	74%	0.741	S	S	*	*			trans	-66.1	117.6	169.1	177.9	0	0	0	0	107.3	P431 N435	P431-V433 PolarHBondContact O-N 3.02Å; V433-N435 PolarHBondContact O-N 3.23Å
434	S	30.6	Very low	36.4	Very low	108 Å²	108	130.4 Å²	130.4	76%	0.755	74%	0.743	S	S	*	*			trans	-67.5	100.5	172.1	67.4	0	0	0	0	109.5	P432 K436	P432-S434 PolarHBondContact O-N 3.5Å; S434-K436 VanDerWaalsContact C-N 3.34Å; S434-K436 PolarHBondContact O-N 3.47Å
435	N	36.2	Very low	36.5	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	76%	0.76	S	S	*	*			trans	-69	87.1	167.6	-90	-19.6	0	0	0	110.8	V433	V433-N435 PolarHBondContact O-N 3.23Å
436	K	37.1	Very low	36.6	Very low	188 Å²	188	134.2 Å²	134.2	82%	0.817	75%	0.748	S	S	*	*			trans	-145.7	101.8	148	-67.1	-172.2	-179	177.1	0	104.1	S434	S434-K436 VanDerWaalsContact C-N 3.34Å; S434-K436 PolarHBondContact O-N 3.47Å
437	T	30	Very low	36.8	Very low	140 Å²	140	134 Å²	134	86%	0.859	74%	0.739	S	S	*	*				-165.9	141.3	69.5	29.6	0	0	0	0	110.8
438	K	31.7	Very low	36.6	Very low	195 Å²	195	136.2 Å²	136.2	85%	0.848	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-60.8	154.2	169.9	-77.1	176.9	175	-180	0	111.6	R440	K438-R440 PolarHBondContact O-N 2.84Å
439	P	30.5	Very low	36.5	Very low	129 Å²	129	137.9 Å²	137.9	84%	0.838	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-65	124	174.3	27.5	-32.4	0	0	0	109.7
440	R	33	Very low	36.9	Very low	248 Å²	248	137.1 Å²	137.1	94%	0.936	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-74.9	129.8	173.6	-99.8	-178.6	166.1	175.4	-6	109	K438	K438-R440 PolarHBondContact O-N 2.84Å
441	A	34.4	Very low	36.8	Very low	93 Å²	93	134.2 Å²	134.2	77%	0.769	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-63.1	141.4	166.3	0	0	0	0	0	109.4	G443	A441-G443 PolarHBondContact O-N 3.38Å
442	I	45.8	Very low	36.9	Very low	151 Å²	151	132.2 Å²	132.2	77%	0.774	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-56	117.3	178.7	-61.6	162.5	0	0	0	108.4	D446	I442-D446 HydrophobicContact CG2-CB 4.11Å
443	G	37.6	Very low	37.3	Very low	36 Å²	36	128.6 Å²	128.6	37%	0.371	70%	0.696	S	S	.	*			trans	-108.6	162.2	-175.5	0	0	0	0	0	111.2	A441 E445 D446	A441-G443 PolarHBondContact O-N 3.38Å; G443-E445 PolarHBondContact O-N 3.47Å; G443-D446 PolarHBondContact N-OD2 3.48Å; G443-D446 WeakPolarHBondContact O-CB 3.36Å; G443-D446 PolarHBondContact O-N 2.91Å
444	F	38.7	Very low	37.5	Very low	178 Å²	178	128.8 Å²	128.8	78%	0.781	69%	0.691	S	S	*	*	H	α-helix	trans	-55.2	-13	-174.6	-156.4	-99.7	0	0	0	115.3	I447	F444-I447 HydrophobicContact CD2-CD1 4.44Å
445	E	39.7	Very low	37.7	Very low	167 Å²	167	126.8 Å²	126.8	78%	0.78	69%	0.688	S	S	*	*	H	α-helix	trans	-77.4	-25.6	172.3	-69.5	-165.8	160.4	0	0	113.8	G443 I447 M448 Y449	G443-E445 PolarHBondContact O-N 3.47Å; E445-I447 PolarHBondContact O-N 3.49Å; E445-M448 WeakPolarHBondContact O-CB 3.43Å; E445-M448 PolarHBondContact O-N 2.99Å; E445-Y449 PolarHBondContact O-N 3.14Å
446	D	42.8	Very low	37.7	Very low	87 Å²	87	123.1 Å²	123.1	47%	0.465	68%	0.679	S	S	.	*	H	α-helix	trans	-69.6	-25.8	176.2	-63.1	-41.5	0	0	0	111.3	I442 G443 Y449 V450	I442-D446 HydrophobicContact CG2-CB 4.11Å; G443-D446 PolarHBondContact N-OD2 3.48Å; G443-D446 WeakPolarHBondContact O-CB 3.36Å; G443-D446 PolarHBondContact O-N 2.91Å; D446-Y449 PolarHBondContact O-N 2.97Å; D446-V450 PolarHBondContact O-N 3.47Å
447	I	45.4	Very low	37.8	Very low	110 Å²	110	121.4 Å²	121.4	56%	0.564	68%	0.677	S	S	*	*	H	α-helix	trans	-73.6	-29.1	175.1	-65.9	168.8	0	0	0	111.2	F444 E445 G451	F444-I447 HydrophobicContact CD2-CD1 4.44Å; E445-I447 PolarHBondContact O-N 3.49Å; I447-G451 PolarHBondContact O-N 3Å
448	M	36.7	Very low	38	Very low	143 Å²	143	117.5 Å²	117.5	70%	0.704	67%	0.665	S	S	*	*	H	α-helix	trans	-71.2	-31.9	173.2	-86.9	-71	-66.9	0	0	112.1	E445 G451 A452	E445-M448 WeakPolarHBondContact O-CB 3.43Å; E445-M448 PolarHBondContact O-N 2.99Å; M448-G451 PolarHBondContact O-N 3.31Å; M448-A452 WeakPolarHBondContact O-CB 3.28Å; M448-A452 PolarHBondContact O-N 3.34Å
449	Y	40.5	Very low	38	Very low	195 Å²	195	117.6 Å²	117.6	77%	0.765	67%	0.665	S	S	*	*	H	α-helix	trans	-73.7	-36.9	177.6	-122.6	-88.8	0	0	0	112.6	E445 D446 A452 A453	E445-Y449 PolarHBondContact O-N 3.14Å; D446-Y449 PolarHBondContact O-N 2.97Å; Y449-A452 PolarHBondContact O-N 3.07Å; Y449-A453 WeakPolarHBondContact O-CB 3.15Å; Y449-A453 PolarHBondContact O-N 2.95Å
450	V	41.6	Very low	38.1	Very low	91 Å²	91	117.4 Å²	117.4	55%	0.552	67%	0.667	S	S	*	*	H	α-helix	trans	-70.6	-35.6	171.7	179.5	0	0	0	0	111	D446 A453 I454	D446-V450 PolarHBondContact O-N 3.47Å; V450-A453 PolarHBondContact O-N 3.45Å; V450-I454 HydrophobicContact CG1-CD1 4.05Å; V450-I454 WeakPolarHBondContact O-CG1 3.32Å; V450-I454 PolarHBondContact O-N 3.48Å; V450-I454 VanDerWaalsContact O-N 3.07Å
451	G	37.3	Very low	37.9	Very low	45 Å²	45	114.3 Å²	114.3	46%	0.464	66%	0.663	S	S	.	*	H	α-helix	trans	-63.9	-38.9	172.4	0	0	0	0	0	113.6	I447 M448 G455	I447-G451 PolarHBondContact O-N 3Å; M448-G451 PolarHBondContact O-N 3.31Å; G451-G455 PolarHBondContact O-N 3.13Å; G451-G455 VanDerWaalsContact O-N 3.15Å
452	A	38.3	Very low	38.4	Very low	67 Å²	67	118.3 Å²	118.3	55%	0.554	67%	0.67	S	S	*	*	H	α-helix	trans	-70.2	-35.1	174.5	0	0	0	0	0	112.7	M448 Y449 G455 A456	M448-A452 WeakPolarHBondContact O-CB 3.28Å; M448-A452 PolarHBondContact O-N 3.34Å; Y449-A452 PolarHBondContact O-N 3.07Å; A452-G455 PolarHBondContact O-N 3.48Å; A452-A456 PolarHBondContact O-N 3.32Å
453	A	40.7	Very low	37.6	Very low	58 Å²	58	118.8 Å²	118.8	48%	0.479	67%	0.674	S	S	.	*	H	α-helix	trans	-68.4	-33.6	175.8	0	0	0	0	0	112.7	Y449 V450	Y449-A453 WeakPolarHBondContact O-CB 3.15Å; Y449-A453 PolarHBondContact O-N 2.95Å; V450-A453 PolarHBondContact O-N 3.45Å
454	I	39	Very low	37.5	Very low	120 Å²	120	119.9 Å²	119.9	62%	0.615	69%	0.686	S	S	*	*	H	α-helix	trans	-77.7	-29.7	176.5	-66.1	171.2	0	0	0	111.6	V450 A456	V450-I454 HydrophobicContact CG1-CD1 4.05Å; V450-I454 WeakPolarHBondContact O-CG1 3.32Å; V450-I454 PolarHBondContact O-N 3.48Å; V450-I454 VanDerWaalsContact O-N 3.07Å; I454-A456 VanDerWaalsContact C-N 3.26Å; I454-A456 PolarHBondContact O-N 2.79Å
455	G	35.7	Very low	37.1	Very low	66 Å²	66	120.7 Å²	120.7	68%	0.68	69%	0.692	S	S	*	*	H	α-helix	trans	-69.4	-17.6	174.3	0	0	0	0	0	115.1	G451 A452	G451-G455 PolarHBondContact O-N 3.13Å; G451-G455 VanDerWaalsContact O-N 3.15Å; A452-G455 PolarHBondContact O-N 3.48Å
456	A	35	Very low	36.8	Very low	78 Å²	78	119.5 Å²	119.5	65%	0.645	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-2.3	-178.4	0	0	0	0	0	114.5	A452 I454 G458	A452-A456 PolarHBondContact O-N 3.32Å; I454-A456 VanDerWaalsContact C-N 3.26Å; I454-A456 PolarHBondContact O-N 2.79Å; A456-G458 PolarHBondContact O-N 2.88Å; A456-G458 VanDerWaalsContact O-N 3.1Å
457	I	39	Very low	36.8	Very low	152 Å²	152	119.1 Å²	119.1	78%	0.779	69%	0.692	S	S	*	*	S	Bend	trans	-87.4	38.2	177.9	-53.4	174.4	0	0	0	110.5
458	G	35.1	Very low	36.5	Very low	58 Å²	58	122.5 Å²	122.5	60%	0.598	71%	0.705	S	S	*	*	S	Bend	trans	-145.2	39.9	-169.3	0	0	0	0	0	114	A456	A456-G458 PolarHBondContact O-N 2.88Å; A456-G458 VanDerWaalsContact O-N 3.1Å
459	K	30.3	Very low	37	Very low	197 Å²	197	124.9 Å²	124.9	86%	0.857	71%	0.712	S	S	*	*			trans	170.9	110.6	151.3	-97.9	166.1	-175.9	-173.7	0	109	E461	K459-E461 PolarHBondContact O-N 3.49Å
460	S	34.1	Very low	37.8	Very low	125 Å²	125	119.3 Å²	119.3	87%	0.874	69%	0.692	S	S	*	*			trans	-71.6	105.1	168.9	50.3	0	0	0	0	110.1
461	E	27.6	Very low	39.2	Very low	184 Å²	184	124 Å²	124	86%	0.86	70%	0.704	S	S	*	*			trans	-127.5	126.6	156	-81.3	-177.4	166.2	0	0	108.2	K459 D463	K459-E461 PolarHBondContact O-N 3.49Å; E461-D463 PolarHBondContact O-N 3Å
462	I	44.8	Very low	41.6	Very low	177 Å²	177	126.1 Å²	126.1	91%	0.908	70%	0.704	S	S	*	*			trans	-75.1	103.8	176.4	-61.2	164.4	0	0	0	106.2
463	D	30.4	Very low	44.1	Very low	160 Å²	160	123 Å²	123	86%	0.856	68%	0.678	S	S	*	*			trans	-142.8	117.7	163.4	-138.1	-1.4	0	0	0	110.6	E461	E461-D463 PolarHBondContact O-N 3Å
464	G	34.3	Very low	46.7	Very low	60 Å²	60	120.9 Å²	120.9	62%	0.619	66%	0.658	S	S	*	*			trans	-72.1	137.1	-178.4	0	0	0	0	0	110.5	V466	G464-V466 PolarHBondContact O-N 3.2Å; G464-V466 VanDerWaalsContact O-N 3.14Å
465	Q	30.3	Very low	49.5	Very low	195 Å²	195	115.2 Å²	115.2	91%	0.911	63%	0.629	S	S	*	*			trans	-55.4	121.3	170.7	-77.9	-176.4	-16.6	0	0	110.2	M467	Q465-M467 PolarHBondContact O-N 3.23Å; Q465-M467 VanDerWaalsContact O-N 3.09Å
466	V	34.5	Very low	52.5	Low	142 Å²	142	112 Å²	112	86%	0.861	60%	0.596	S	S	*	*			trans	-63.3	107.8	175.3	177	0	0	0	0	108.8	G464 E468	G464-V466 PolarHBondContact O-N 3.2Å; G464-V466 VanDerWaalsContact O-N 3.14Å; V466-E468 PolarHBondContact O-N 2.99Å
467	M	41.7	Very low	55.5	Low	79 Å²	79	108.3 Å²	108.3	39%	0.389	57%	0.566	S	S	.	*			trans	-58.7	132.2	169.6	-78.3	177.2	61.7	0	0	110.2	Q465	Q465-M467 PolarHBondContact O-N 3.23Å; Q465-M467 VanDerWaalsContact O-N 3.09Å
468	E	40.6	Very low	58.3	Low	181 Å²	181	101.1 Å²	101.1	85%	0.846	53%	0.529	S	S	*	.			trans	-48.1	141.4	171.3	-73.1	-173.9	145.8	0	0	111.3	V466 K470	V466-E468 PolarHBondContact O-N 2.99Å; E468-K470 VanDerWaalsContact C-N 3.3Å; E468-K470 PolarHBondContact O-N 2.85Å
469	K	45.8	Very low	61.2	Low	192 Å²	192	98.3 Å²	98.3	84%	0.835	50%	0.5	S	S	*	.			trans	-63.6	80.9	-174.8	-73.8	-178.5	175.9	178.6	0	112.2
470	K	57.9	Low	64.2	Low	79 Å²	79	89 Å²	89	34%	0.343	46%	0.459	S	S	.	.			trans	-64.8	132.1	166.5	-71.8	-174.2	173.9	-171.4	0	109.3	E468 I472 K706 L825	E468-K470 VanDerWaalsContact C-N 3.3Å; E468-K470 PolarHBondContact O-N 2.85Å; K470-I472 PolarHBondContact O-N 3.46Å; K470-K706 WeakPolarHBondContact O-CE 3.3Å; K470-L825 PolarHBondContact NZ-O 3.49Å
471	K	70.9	Confident	66.8	Low	188 Å²	188	83.4 Å²	83.4	82%	0.817	42%	0.422	S	S	*	.	S	Bend	trans	-74.9	-5.4	-179.1	-72.9	-175	177.8	178.9	0	114.3
472	I	87.4	Confident	69.8	Low	90 Å²	90	75.6 Å²	75.6	46%	0.462	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	134.9	-171.6	-61	176.6	0	0	0	108.9	K470 K707 G709	K470-I472 PolarHBondContact O-N 3.46Å; I472-K707 WeakPolarHBondContact CA-O 3.5Å; I472-G709 VanDerWaalsContact CG2-CA 3.45Å
473	D	91.8	Very high	72.1	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.011	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	143.3	170.4	-87.8	-11.9	0	0	0	110.8	W509 R576 K706 K707 G709	D473-W509 PolarHBondContact OD2-NE1 3.15Å; D473-R576 IonicContact OD2-NH1 3.61Å; D473-K706 HydrophobicContact CB-CB 4.24Å; D473-K706 WeakPolarHBondContact OD1-CD 3.42Å; D473-K706 IonicContact OD1-NZ 2.73Å; D473-K707 PolarHBondContact N-O 3.44Å; D473-G709 PolarHBondContact O-N 3.07Å
474	R	95.3	Very high	75.1	Confident	13 Å²	13	61 Å²	61	5%	0.049	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126	178.4	-62.2	157.9	-69.4	162.3	13	109.5	L506 F507 D508 W509 I710 L824	R474-L506 VanDerWaalsContact CD-O 3.31Å; R474-L506 WeakPolarHBondContact CD-O 3.46Å; R474-L506 PolarHBondContact NE-O 3Å; R474-L506 PolarHBondContact NH1-O 3.08Å; R474-F507 HydrophobicContact CB-CD1 4.1Å; R474-D508 IonicContact CZ-OD1 2.72Å; R474-D508 IonicContact CZ-OD2 3.57Å; R474-D508 PolarHBondContact N-OD2 3.48Å; R474-D508 IonicContact NE-OD2 2.76Å; R474-D508 PolarHBondContact NE-OD2 3.39Å; R474-D508 IonicContact NH2-OD1 3.76Å; R474-D508 PolarHBondContact NH2-OD1 2.98Å; R474-D508 IonicContact NH2-OD2 3.56Å; R474-D508 PolarHBondContact NH2-OD2 3.25Å; R474-D508 PolarHBondContact O-N 3.3Å; R474-W509 PolarHBondContact O-N 2.97Å; R474-I710 HydrophobicContact CG-CD1 4.32Å; R474-L824 HydrophobicContact CB-CD2 4.34Å; R474-L824 HydrophobicContact CG-CD2 4.23Å; R474-L824 PolarHBondContact NH1-O 3.2Å
475	L	96.9	Very high	77.9	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.1	-179.9	172.1	63.4	0	0	0	111.1	W509 A511 A685 M686 I689 L708 I710 V711 V712	L475-W509 WeakPolarHBondContact CA-O 3.31Å; L475-W509 HydrophobicContact CB-CB 4.38Å; L475-W509 HydrophobicContact CD1-CB 3.63Å; L475-A511 HydrophobicContact CD1-CB 4.41Å; L475-A685 HydrophobicContact CD1-CB 4.33Å; L475-A685 HydrophobicContact CD2-CB 4.07Å; L475-M686 HydrophobicContact CD2-CG 4.3Å; L475-I689 HydrophobicContact CB-CD1 4.4Å; L475-I689 HydrophobicContact CD1-CD1 4.04Å; L475-I689 HydrophobicContact CD2-CD1 3.86Å; L475-I689 HydrophobicContact CG-CD1 4.32Å; L475-L708 HydrophobicContact CB-CD1 3.66Å; L475-L708 HydrophobicContact CD2-CD2 4.48Å; L475-I710 PolarHBondContact N-O 3.17Å; L475-V711 HydrophobicContact CB-CG2 4.25Å; L475-V711 HydrophobicContact CD2-CG1 4.16Å; L475-V711 HydrophobicContact CD2-CG2 4.09Å; L475-V711 WeakPolarHBondContact O-CA 3.46Å; L475-V712 PolarHBondContact O-N 2.86Å
476	L	97.9	Very high	81.1	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.2	166.4	177.5	63.9	0	0	0	109.8	L478 L492 T503 F507 W509 V510 A511 I523 V712 L714	L476-L478 HydrophobicContact CD1-CD2 4Å; L476-L478 HydrophobicContact CD2-CD1 4.47Å; L476-L478 HydrophobicContact CD2-CD2 4.14Å; L476-L478 HydrophobicContact CD2-CG 4.36Å; L476-L478 HydrophobicContact CG-CD2 3.98Å; L476-L478 HydrophobicContact CG-CG 4.18Å; L476-L492 HydrophobicContact CD1-CD2 4.37Å; L476-L492 HydrophobicContact CD2-CD2 4.06Å; L476-T503 HydrophobicContact CD2-CG2 3.81Å; L476-F507 HydrophobicContact CB-CB 4.15Å; L476-F507 HydrophobicContact CB-CD1 3.67Å; L476-F507 HydrophobicContact CB-CD2 3.87Å; L476-F507 HydrophobicContact CB-CE1 3.95Å; L476-F507 HydrophobicContact CB-CE2 4.15Å; L476-F507 HydrophobicContact CB-CG 3.62Å; L476-F507 HydrophobicContact CB-CZ 4.18Å; L476-F507 HydrophobicContact CD1-CE1 4.44Å; L476-F507 HydrophobicContact CD1-CE2 4.13Å; L476-F507 HydrophobicContact CD1-CZ 4.02Å; L476-F507 HydrophobicContact CD2-CD2 3.86Å; L476-F507 HydrophobicContact CD2-CE2 3.98Å; L476-F507 HydrophobicContact CD2-CG 4.42Å; L476-F507 HydrophobicContact CG-CD2 4.34Å; L476-F507 HydrophobicContact CG-CE2 4.32Å; L476-W509 PolarHBondContact N-O 3.15Å; L476-V510 HydrophobicContact CB-CG1 4.36Å; L476-V510 HydrophobicContact CB-CG2 4.37Å; L476-V510 HydrophobicContact CD2-CG1 4.08Å; L476-V510 HydrophobicContact CD2-CG2 4.47Å; L476-V510 HydrophobicContact CG-CG1 4.32Å; L476-V510 CarbonylContact O-C 3.34Å; L476-V510 WeakPolarHBondContact O-CA 3.47Å; L476-A511 PolarHBondContact O-N 3.43Å; L476-I523 HydrophobicContact CD2-CD1 4.16Å; L476-V712 CarbonylContact C-O 3.56Å; L476-V712 WeakPolarHBondContact CA-O 3.48Å; L476-V712 HydrophobicContact CD1-CB 4.25Å; L476-V712 HydrophobicContact CD1-CG1 4.2Å; L476-L714 HydrophobicContact CD1-CD1 3.92Å; L476-L714 HydrophobicContact CD1-CG 4.03Å
477	C	98.1	Very high	84	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.3	175.1	-62.2	0	0	0	0	109.8	A511 P681 T682 V712 S713 L714	C477-A511 CarbonylContact C-O 3.58Å; C477-A511 WeakPolarHBondContact CA-O 3.37Å; C477-P681 HydrophobicContact CB-CG 4.33Å; C477-T682 VanDerWaalsContact CB-OG1 3.31Å; C477-T682 WeakPolarHBondContact CB-OG1 3.46Å; C477-V712 PolarHBondContact N-O 3.11Å; C477-S713 WeakPolarHBondContact O-CA 3.23Å; C477-L714 PolarHBondContact O-N 3.2Å
478	L	97.9	Very high	86.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	115.5	-177.8	-59.1	179	0	0	0	109.8	L476 L488 L492 V510 A511 G512 T513 L519 A520 I523 L714	L476-L478 HydrophobicContact CD1-CD2 4Å; L476-L478 HydrophobicContact CD2-CD1 4.47Å; L476-L478 HydrophobicContact CD2-CD2 4.14Å; L476-L478 HydrophobicContact CD2-CG 4.36Å; L476-L478 HydrophobicContact CG-CD2 3.98Å; L476-L478 HydrophobicContact CG-CG 4.18Å; L478-L488 HydrophobicContact CB-CD1 4.23Å; L478-L492 HydrophobicContact CD2-CD1 4.35Å; L478-V510 HydrophobicContact CD1-CG1 4.27Å; L478-A511 PolarHBondContact N-O 3.21Å; L478-G512 WeakPolarHBondContact O-CA 3.07Å; L478-T513 PolarHBondContact O-N 2.95Å; L478-T513 VanDerWaalsContact O-N 3.09Å; L478-L519 HydrophobicContact CD1-CB 4.14Å; L478-L519 HydrophobicContact CD1-CD2 4.07Å; L478-L519 HydrophobicContact CD1-CG 3.91Å; L478-A520 HydrophobicContact CD1-CB 4.24Å; L478-I523 HydrophobicContact CD1-CD1 3.92Å; L478-L714 HydrophobicContact CD2-CB 4.05Å; L478-L714 HydrophobicContact CD2-CD1 3.83Å; L478-L714 HydrophobicContact CD2-CG 4.25Å
479	D	96.8	Very high	89.3	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.14	C	C	.	.			trans	-71.6	158.8	-177.9	-65.9	-0.9	0	0	0	112.9	L488 G516 N679 N680 L714 G715 S759 R780	D479-L488 WeakPolarHBondContact O-CD1 3.24Å; D479-G516 PolarHBondContact O-N 3.23Å; D479-N679 WeakPolarHBondContact CA-O 3.27Å; D479-N680 VanDerWaalsContact OD1-CG 3.28Å; D479-L714 VanDerWaalsContact CG-O 3.31Å; D479-L714 PolarHBondContact N-O 3.04Å; D479-L714 VanDerWaalsContact N-O 3.14Å; D479-G715 WeakPolarHBondContact OD2-CA 3.49Å; D479-S759 WeakPolarHBondContact OD2-CB 3.17Å; D479-R780 IonicContact OD1-NH1 3.63Å; D479-R780 PolarHBondContact OD1-NH1 3.16Å; D479-R780 IonicContact OD2-CZ 3.85Å; D479-R780 IonicContact OD2-NH1 3.94Å; D479-R780 PolarHBondContact OD2-NH1 3.15Å; D479-R780 IonicContact OD2-NH2 2.9Å; D479-R780 PolarHBondContact OD2-NH2 2.93Å
480	G	93.6	Very high	91.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.			trans	-78.5	156	168.2	0	0	0	0	0	113	T513 N679 T716	G480-T513 WeakPolarHBondContact CA-O 3.34Å; G480-T513 PolarHBondContact N-O 3.41Å; G480-N679 WeakPolarHBondContact CA-OD1 3.49Å; G480-N679 PolarHBondContact N-O 3Å; G480-N679 PolarHBondContact N-OD1 3.38Å; G480-T716 PolarHBondContact O-OG1 3.3Å
481	G	88.8	Confident	93.4	Very high	8 Å²	8	17.1 Å²	17.1	8%	0.082	9%	0.086	C	C	.	.			trans	168.1	25.5	-179.1	0	0	0	0	0	116.9	K484 L791	G481-K484 VanDerWaalsContact O-CB 3.29Å; G481-K484 WeakPolarHBondContact O-CB 3.4Å; G481-K484 WeakPolarHBondContact O-CE 3.44Å; G481-K484 PolarHBondContact O-N 3.14Å; G481-L791 VanDerWaalsContact O-CD2 3.27Å; G481-L791 WeakPolarHBondContact O-CD2 3.43Å
482	G	90.4	Very high	94.6	Very high	20 Å²	20	8.2 Å²	8.2	21%	0.206	5%	0.047	C	C	.	.	G	3₁₀ helix	trans	62.8	-135	175.6	0	0	0	0	0	113.6	K484 G485 T515	G482-K484 PolarHBondContact O-N 3.35Å; G482-G485 PolarHBondContact O-N 3.26Å; G482-T515 WeakPolarHBondContact O-CB 3.35Å; G482-T515 WeakPolarHBondContact O-CG2 3.42Å; G482-T515 PolarHBondContact O-OG1 2.84Å
483	I	91.9	Very high	94.9	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.031	C	C	.	.	G	3₁₀ helix	trans	-65.2	-20.6	179.2	-165.2	55.7	0	0	0	113.3	G485 L486 Y536 M539 K540 F544 L791 E793 L799	I483-G485 PolarHBondContact O-N 3.4Å; I483-L486 HydrophobicContact CD1-CD1 4.35Å; I483-L486 HydrophobicContact CG1-CD1 4.24Å; I483-L486 WeakPolarHBondContact O-CG 3.36Å; I483-L486 PolarHBondContact O-N 2.75Å; I483-Y536 HydrophobicContact CD1-CD1 4.16Å; I483-M539 HydrophobicContact CD1-CE 4.36Å; I483-K540 HydrophobicContact CD1-CB 3.79Å; I483-K540 HydrophobicContact CD1-CD 4.5Å; I483-K540 HydrophobicContact CG1-CB 4.26Å; I483-F544 HydrophobicContact CB-CE2 4.28Å; I483-L791 WeakPolarHBondContact CG2-O 3.48Å; I483-L791 PolarHBondContact N-O 3.29Å; I483-E793 HydrophobicContact CG2-CB 3.97Å; I483-L799 HydrophobicContact CG1-CD1 4.11Å; I483-L799 HydrophobicContact CG1-CD2 4.23Å; I483-L799 HydrophobicContact CG2-CD2 4.05Å
484	K	93.7	Very high	94.9	Very high	30 Å²	30	5.8 Å²	5.8	13%	0.13	4%	0.037	C	C	.	.	G	3₁₀ helix	trans	-64.5	-5.6	175.6	-56.2	-173.8	-69.4	-169.6	0	113.7	G481 G482 L486 V487 V789 M802	G481-K484 VanDerWaalsContact O-CB 3.29Å; G481-K484 WeakPolarHBondContact O-CB 3.4Å; G481-K484 WeakPolarHBondContact O-CE 3.44Å; G481-K484 PolarHBondContact O-N 3.14Å; G482-K484 PolarHBondContact O-N 3.35Å; K484-L486 PolarHBondContact O-N 3.07Å; K484-V487 WeakPolarHBondContact O-CB 3.38Å; K484-V487 WeakPolarHBondContact O-CG2 3.2Å; K484-V487 PolarHBondContact O-N 3.03Å; K484-V789 HydrophobicContact CD-CB 3.99Å; K484-V789 HydrophobicContact CD-CG1 4.18Å; K484-V789 WeakPolarHBondContact CD-O 3.37Å; K484-V789 HydrophobicContact CG-CB 4.32Å; K484-V789 HydrophobicContact CG-CG1 3.96Å; K484-M802 HydrophobicContact CB-SD 4.24Å; K484-M802 HydrophobicContact CG-SD 3.99Å
485	G	94.8	Very high	94.9	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-51.1	-22.9	165.2	0	0	0	0	0	113.6	G482 I483 V487 L488 I489 T515	G482-G485 PolarHBondContact O-N 3.26Å; I483-G485 PolarHBondContact O-N 3.4Å; G485-V487 PolarHBondContact O-N 2.98Å; G485-L488 WeakPolarHBondContact O-CB 3.46Å; G485-L488 PolarHBondContact O-N 2.93Å; G485-I489 WeakPolarHBondContact O-CG1 3.42Å; G485-I489 PolarHBondContact O-N 3.09Å; G485-T515 VanDerWaalsContact CA-CG2 3.45Å
486	L	95.7	Very high	94.7	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-51.7	-36.2	168.3	-75.2	171.1	0	0	0	113.5	I483 K484 I489 Q490 R533 Y536 F537 L799 M802 L803	I483-L486 HydrophobicContact CD1-CD1 4.35Å; I483-L486 HydrophobicContact CG1-CD1 4.24Å; I483-L486 WeakPolarHBondContact O-CG 3.36Å; I483-L486 PolarHBondContact O-N 2.75Å; K484-L486 PolarHBondContact O-N 3.07Å; L486-I489 PolarHBondContact O-N 2.97Å; L486-Q490 PolarHBondContact O-N 2.69Å; L486-R533 HydrophobicContact CD2-CG 4.02Å; L486-Y536 HydrophobicContact CD2-CG 4.34Å; L486-Y536 HydrophobicContact CG-CD1 4.28Å; L486-F537 HydrophobicContact CD1-CD2 4.21Å; L486-F537 HydrophobicContact CD1-CE2 3.83Å; L486-F537 HydrophobicContact CD1-CZ 4.14Å; L486-F537 HydrophobicContact CD2-CD2 3.89Å; L486-F537 HydrophobicContact CD2-CE2 3.84Å; L486-L799 HydrophobicContact CD1-CB 4.35Å; L486-L799 HydrophobicContact CD1-CD1 4.13Å; L486-L799 HydrophobicContact CD1-CD2 4.24Å; L486-L799 HydrophobicContact CD1-CG 4.49Å; L486-M802 HydrophobicContact CB-CE 3.96Å; L486-M802 HydrophobicContact CD1-CE 4.42Å; L486-L803 HydrophobicContact CB-CD2 3.97Å; L486-L803 HydrophobicContact CB-CG 4.47Å; L486-L803 WeakPolarHBondContact O-CD2 3.4Å
487	V	96.7	Very high	94.4	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.4	-43.8	175.5	177	0	0	0	0	110.9	K484 G485 I489 Q490 M491 P783 M802 T806	K484-V487 WeakPolarHBondContact O-CB 3.38Å; K484-V487 WeakPolarHBondContact O-CG2 3.2Å; K484-V487 PolarHBondContact O-N 3.03Å; G485-V487 PolarHBondContact O-N 2.98Å; V487-I489 VanDerWaalsContact C-N 3.34Å; V487-I489 PolarHBondContact O-N 3Å; V487-Q490 PolarHBondContact O-N 3.44Å; V487-M491 HydrophobicContact CG1-CE 3.91Å; V487-M491 WeakPolarHBondContact O-CG 3.14Å; V487-M491 PolarHBondContact O-N 3.21Å; V487-P783 HydrophobicContact CG1-CG 3.53Å; V487-M802 HydrophobicContact CG2-CE 3.84Å; V487-M802 HydrophobicContact CG2-CG 3.77Å; V487-M802 HydrophobicContact CG2-SD 3.62Å; V487-T806 HydrophobicContact CG1-CG2 4Å
488	L	96.8	Very high	94.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.1	-46.3	176.4	-53.2	177.5	0	0	0	110.5	L478 D479 G485 Q490 M491 L492 T515 L519 L714 G715 T716	L478-L488 HydrophobicContact CB-CD1 4.23Å; D479-L488 WeakPolarHBondContact O-CD1 3.24Å; G485-L488 WeakPolarHBondContact O-CB 3.46Å; G485-L488 PolarHBondContact O-N 2.93Å; L488-Q490 VanDerWaalsContact C-N 3.31Å; L488-Q490 PolarHBondContact O-N 3.05Å; L488-M491 HydrophobicContact CD2-CE 4.13Å; L488-M491 PolarHBondContact O-N 3.14Å; L488-L492 WeakPolarHBondContact O-CG 3.44Å; L488-L492 PolarHBondContact O-N 3.09Å; L488-T515 HydrophobicContact CD1-CG2 4.37Å; L488-L519 HydrophobicContact CB-CD2 3.68Å; L488-L519 HydrophobicContact CD1-CD2 4.27Å; L488-L714 VanDerWaalsContact CD2-C 3.47Å; L488-L714 HydrophobicContact CD2-CB 3.69Å; L488-L714 VanDerWaalsContact CD2-O 3.22Å; L488-L714 WeakPolarHBondContact CD2-O 3.39Å; L488-G715 VanDerWaalsContact CD2-C 3.48Å; L488-G715 WeakPolarHBondContact CD2-O 3.44Å; L488-T716 HydrophobicContact CD1-CG2 3.89Å; L488-T716 HydrophobicContact CD2-CG2 4.07Å; L488-T716 HydrophobicContact CG-CG2 3.88Å
489	I	96.1	Very high	93.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59.5	-44.9	178.7	-61.4	169.3	0	0	0	110.1	G485 L486 V487 M491 L492 I493 L519 M529 L532 R533 Y536	G485-I489 WeakPolarHBondContact O-CG1 3.42Å; G485-I489 PolarHBondContact O-N 3.09Å; L486-I489 PolarHBondContact O-N 2.97Å; V487-I489 VanDerWaalsContact C-N 3.34Å; V487-I489 PolarHBondContact O-N 3Å; I489-M491 PolarHBondContact O-N 3.15Å; I489-L492 PolarHBondContact O-N 3.45Å; I489-I493 HydrophobicContact CG2-CD1 3.99Å; I489-I493 HydrophobicContact CG2-CG1 4.39Å; I489-I493 VanDerWaalsContact O-CG1 3.3Å; I489-I493 WeakPolarHBondContact O-CG1 3.44Å; I489-I493 PolarHBondContact O-N 3.47Å; I489-L519 HydrophobicContact CD1-CD1 4.42Å; I489-L519 HydrophobicContact CG1-CD1 3.84Å; I489-L519 HydrophobicContact CG1-CD2 3.78Å; I489-L519 HydrophobicContact CG1-CG 4.47Å; I489-M529 HydrophobicContact CG2-CB 4.17Å; I489-M529 WeakPolarHBondContact CG2-O 3.37Å; I489-L532 HydrophobicContact CD1-CB 4.05Å; I489-R533 HydrophobicContact CG2-CB 3.87Å; I489-Y536 HydrophobicContact CD1-CD1 4.25Å; I489-Y536 HydrophobicContact CD1-CD2 3.9Å; I489-Y536 HydrophobicContact CD1-CE1 4.4Å; I489-Y536 HydrophobicContact CD1-CE2 4.07Å; I489-Y536 HydrophobicContact CD1-CG 4.01Å
490	Q	95.3	Very high	93.5	Very high	6 Å²	6	23 Å²	23	3%	0.028	14%	0.135	C	C	.	.	H	α-helix	trans	-63.5	-39.9	179.4	-167.8	64.3	29.1	0	0	112.5	L486 V487 L488 I493 A494 L803 T806 L810	L486-Q490 PolarHBondContact O-N 2.69Å; V487-Q490 PolarHBondContact O-N 3.44Å; L488-Q490 VanDerWaalsContact C-N 3.31Å; L488-Q490 PolarHBondContact O-N 3.05Å; Q490-I493 PolarHBondContact O-N 3.07Å; Q490-A494 PolarHBondContact O-N 3.3Å; Q490-A494 VanDerWaalsContact O-N 3.15Å; Q490-L803 HydrophobicContact CB-CD2 3.8Å; Q490-L803 HydrophobicContact CG-CD2 4.23Å; Q490-T806 HydrophobicContact CB-CG2 4.06Å; Q490-T806 HydrophobicContact CG-CG2 4.05Å; Q490-L810 HydrophobicContact CG-CD1 4.41Å
491	M	95.4	Very high	93.4	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-66.8	-38.3	174.4	-67.2	-167.5	-74.5	0	0	112.4	V487 L488 I489 A494 L495 L714 G715 L781 T806 L810	V487-M491 HydrophobicContact CG1-CE 3.91Å; V487-M491 WeakPolarHBondContact O-CG 3.14Å; V487-M491 PolarHBondContact O-N 3.21Å; L488-M491 HydrophobicContact CD2-CE 4.13Å; L488-M491 PolarHBondContact O-N 3.14Å; I489-M491 PolarHBondContact O-N 3.15Å; M491-A494 PolarHBondContact O-N 3.33Å; M491-L495 WeakPolarHBondContact O-CB 3.5Å; M491-L495 PolarHBondContact O-N 3.28Å; M491-L714 HydrophobicContact CB-CD1 4.48Å; M491-L714 HydrophobicContact CE-CB 4.05Å; M491-L714 HydrophobicContact CE-CD2 4.4Å; M491-G715 WeakPolarHBondContact CE-O 3.46Å; M491-L781 HydrophobicContact SD-CB 3.73Å; M491-T806 HydrophobicContact CG-CG2 3.98Å; M491-L810 HydrophobicContact CB-CD2 4.5Å; M491-L810 HydrophobicContact CG-CD1 4.28Å; M491-L810 HydrophobicContact CG-CD2 4.06Å; M491-L810 HydrophobicContact CG-CG 4.45Å
492	L	95.8	Very high	93.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.3	-41.5	174.9	-70.5	174.5	0	0	0	112	L476 L478 L488 I489 A494 L495 E496 T503 L519 I523 M529 L714	L476-L492 HydrophobicContact CD1-CD2 4.37Å; L476-L492 HydrophobicContact CD2-CD2 4.06Å; L478-L492 HydrophobicContact CD2-CD1 4.35Å; L488-L492 WeakPolarHBondContact O-CG 3.44Å; L488-L492 PolarHBondContact O-N 3.09Å; I489-L492 PolarHBondContact O-N 3.45Å; L492-A494 VanDerWaalsContact C-N 3.3Å; L492-A494 PolarHBondContact O-N 2.87Å; L492-L495 PolarHBondContact O-N 3.39Å; L492-E496 WeakPolarHBondContact O-CG 3.39Å; L492-E496 PolarHBondContact O-N 2.91Å; L492-T503 HydrophobicContact CD2-CG2 3.87Å; L492-L519 HydrophobicContact CD1-CD2 3.89Å; L492-L519 HydrophobicContact CD1-CG 4.31Å; L492-I523 HydrophobicContact CD1-CD1 3.99Å; L492-M529 HydrophobicContact CB-CE 4.36Å; L492-M529 HydrophobicContact CB-CG 4.17Å; L492-M529 HydrophobicContact CB-SD 3.97Å; L492-M529 HydrophobicContact CD1-CE 4.02Å; L492-M529 HydrophobicContact CD1-SD 3.88Å; L492-L714 HydrophobicContact CD2-CD1 3.56Å; L492-L714 HydrophobicContact CG-CD1 3.82Å
493	I	93.7	Very high	93.6	Very high	25 Å²	25	30.1 Å²	30.1	13%	0.128	16%	0.161	C	C	.	.	H	α-helix	trans	-56.2	-47.1	173.6	-70.3	168.1	0	0	0	110.4	I489 Q490 L495 E496 K497 M529 E530	I489-I493 HydrophobicContact CG2-CD1 3.99Å; I489-I493 HydrophobicContact CG2-CG1 4.39Å; I489-I493 VanDerWaalsContact O-CG1 3.3Å; I489-I493 WeakPolarHBondContact O-CG1 3.44Å; I489-I493 PolarHBondContact O-N 3.47Å; Q490-I493 PolarHBondContact O-N 3.07Å; I493-L495 VanDerWaalsContact C-N 3.35Å; I493-L495 PolarHBondContact O-N 3.41Å; I493-E496 PolarHBondContact O-N 3.41Å; I493-K497 WeakPolarHBondContact O-CB 3.38Å; I493-K497 PolarHBondContact O-N 3.4Å; I493-M529 HydrophobicContact CD1-CB 4.17Å; I493-M529 HydrophobicContact CG1-CB 3.37Å; I493-M529 HydrophobicContact CG1-CG 4.41Å; I493-E530 HydrophobicContact CD1-CG 4.3Å
494	A	92.3	Very high	93.5	Very high	16 Å²	16	34.2 Å²	34.2	13%	0.132	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-39.5	179.3	0	0	0	0	0	112	Q490 M491 L492 K497 E498 L810 L817	Q490-A494 PolarHBondContact O-N 3.3Å; Q490-A494 VanDerWaalsContact O-N 3.15Å; M491-A494 PolarHBondContact O-N 3.33Å; L492-A494 VanDerWaalsContact C-N 3.3Å; L492-A494 PolarHBondContact O-N 2.87Å; A494-K497 PolarHBondContact O-N 3.22Å; A494-E498 WeakPolarHBondContact O-CG 3.39Å; A494-E498 PolarHBondContact O-N 3.11Å; A494-E498 VanDerWaalsContact O-N 3.08Å; A494-L810 HydrophobicContact CB-CD1 3.74Å; A494-L810 HydrophobicContact CB-CD2 4.29Å; A494-L810 HydrophobicContact CB-CG 4.49Å; A494-L817 HydrophobicContact CB-CD2 3.79Å
495	L	93.9	Very high	93.4	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-65	-43.7	176	-175.8	64	0	0	0	112.2	M491 L492 I493 K497 E498 A499 L506 F507 L817 L820 A821 L824	M491-L495 WeakPolarHBondContact O-CB 3.5Å; M491-L495 PolarHBondContact O-N 3.28Å; L492-L495 PolarHBondContact O-N 3.39Å; I493-L495 VanDerWaalsContact C-N 3.35Å; I493-L495 PolarHBondContact O-N 3.41Å; L495-K497 VanDerWaalsContact C-N 3.3Å; L495-K497 PolarHBondContact O-N 2.97Å; L495-E498 PolarHBondContact O-N 3.49Å; L495-A499 VanDerWaalsContact O-CB 3.26Å; L495-A499 WeakPolarHBondContact O-CB 3.13Å; L495-A499 PolarHBondContact O-N 3.35Å; L495-L506 HydrophobicContact CD2-CD1 4.45Å; L495-L506 HydrophobicContact CG-CD1 4.28Å; L495-F507 HydrophobicContact CD2-CE2 3.95Å; L495-F507 HydrophobicContact CD2-CZ 3.93Å; L495-L817 HydrophobicContact CB-CD1 4.15Å; L495-L817 HydrophobicContact CD1-CD1 3.82Å; L495-L820 HydrophobicContact CD1-CD2 4.06Å; L495-L820 HydrophobicContact CD1-CG 4.13Å; L495-A821 HydrophobicContact CD1-CB 4.37Å; L495-L824 HydrophobicContact CD1-CD1 4.09Å; L495-L824 HydrophobicContact CD2-CD1 4.08Å; L495-L824 HydrophobicContact CG-CD1 4.48Å
496	E	93.6	Very high	93.2	Very high	39 Å²	39	36.9 Å²	36.9	18%	0.182	19%	0.189	C	C	.	.	H	α-helix	trans	-60.7	-40.9	175.3	-73.9	-175.7	162.2	0	0	111.4	L492 I493 A499 G500 T503 M529	L492-E496 WeakPolarHBondContact O-CG 3.39Å; L492-E496 PolarHBondContact O-N 2.91Å; I493-E496 PolarHBondContact O-N 3.41Å; E496-A499 PolarHBondContact O-N 3.11Å; E496-G500 WeakPolarHBondContact O-CA 3.4Å; E496-G500 PolarHBondContact O-N 2.99Å; E496-T503 VanDerWaalsContact CD-OG1 3.26Å; E496-T503 VanDerWaalsContact CG-OG1 3.24Å; E496-T503 WeakPolarHBondContact CG-OG1 3.43Å; E496-T503 VanDerWaalsContact OE1-CB 3.28Å; E496-T503 WeakPolarHBondContact OE1-CB 3.49Å; E496-T503 PolarHBondContact OE1-N 3.33Å; E496-T503 PolarHBondContact OE1-OG1 3.21Å; E496-M529 VanDerWaalsContact OE2-CG 3.29Å; E496-M529 WeakPolarHBondContact OE2-CG 3.49Å
497	K	90.8	Very high	93.2	Very high	172 Å²	172	36.9 Å²	36.9	75%	0.748	19%	0.189	S	C	*	.	H	α-helix	trans	-63.1	-44.6	177.9	-170.9	-179.3	179.7	-179.2	0	112.3	I493 A494 L495	I493-K497 WeakPolarHBondContact O-CB 3.38Å; I493-K497 PolarHBondContact O-N 3.4Å; A494-K497 PolarHBondContact O-N 3.22Å; L495-K497 VanDerWaalsContact C-N 3.3Å; L495-K497 PolarHBondContact O-N 2.97Å
498	E	91.6	Very high	93.1	Very high	84 Å²	84	37.2 Å²	37.2	39%	0.393	19%	0.191	S	C	.	.	H	α-helix	trans	-73.5	-33.7	178.3	-66	-60	133.2	0	0	112.6	A494 L495 L817 Q818 A821	A494-E498 WeakPolarHBondContact O-CG 3.39Å; A494-E498 PolarHBondContact O-N 3.11Å; A494-E498 VanDerWaalsContact O-N 3.08Å; L495-E498 PolarHBondContact O-N 3.49Å; E498-L817 HydrophobicContact CG-CD2 3.77Å; E498-L817 HydrophobicContact CG-CG 4.05Å; E498-Q818 WeakPolarHBondContact OE2-CG 3.46Å; E498-Q818 PolarHBondContact OE2-NE2 2.99Å; E498-A821 HydrophobicContact CB-CB 3.99Å
499	A	92.3	Very high	93	Very high	9 Å²	9	37.2 Å²	37.2	7%	0.074	19%	0.191	C	C	.	.	H	α-helix	trans	-82.6	-21.6	179.9	0	0	0	0	0	113.8	L495 E496 R501 L506 A821	L495-A499 VanDerWaalsContact O-CB 3.26Å; L495-A499 WeakPolarHBondContact O-CB 3.13Å; L495-A499 PolarHBondContact O-N 3.35Å; E496-A499 PolarHBondContact O-N 3.11Å; A499-R501 PolarHBondContact O-N 3.15Å; A499-L506 HydrophobicContact CB-CD1 3.85Å; A499-L506 HydrophobicContact CB-CD2 3.86Å; A499-A821 HydrophobicContact CB-CB 4.03Å
500	G	90.9	Very high	93	Very high	68 Å²	68	37.2 Å²	37.2	70%	0.701	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.9	17.9	-176.7	0	0	0	0	0	114.2	E496	E496-G500 WeakPolarHBondContact O-CA 3.4Å; E496-G500 PolarHBondContact O-N 2.99Å
501	R	90.9	Very high	93.1	Very high	120 Å²	120	37 Å²	37	45%	0.453	19%	0.19	S	C	.	.	S	Bend	trans	-139.1	149.4	179.5	-67.8	-170	-179.7	-168.6	-1.1	110.5	A499 L506 L825	A499-R501 PolarHBondContact O-N 3.15Å; R501-L506 HydrophobicContact CB-CD2 4Å; R501-L825 HydrophobicContact CG-CD2 4.28Å
502	P	91	Very high	93.2	Very high	58 Å²	58	36.9 Å²	36.9	38%	0.377	19%	0.189	S	C	.	.			trans	-67	149.5	178.2	29.4	-35.8	0	0	0	111.8	R504 E505 L506	P502-R504 PolarHBondContact O-N 3.37Å; P502-R504 VanDerWaalsContact O-N 3.08Å; P502-E505 HydrophobicContact CG-CB 4.32Å; P502-E505 VanDerWaalsContact CG-CD 3.5Å; P502-E505 HydrophobicContact CG-CG 3.86Å; P502-E505 WeakPolarHBondContact CG-OE1 3.38Å; P502-E505 PolarHBondContact O-N 3.24Å; P502-L506 PolarHBondContact O-N 3.41Å
503	T	91.9	Very high	93.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-54.1	-36.1	-176.5	-59.4	0	0	0	0	112.4	L476 L492 E496 E505 L506 F507 I523 M529	L476-T503 HydrophobicContact CD2-CG2 3.81Å; L492-T503 HydrophobicContact CD2-CG2 3.87Å; E496-T503 VanDerWaalsContact CD-OG1 3.26Å; E496-T503 VanDerWaalsContact CG-OG1 3.24Å; E496-T503 WeakPolarHBondContact CG-OG1 3.43Å; E496-T503 VanDerWaalsContact OE1-CB 3.28Å; E496-T503 WeakPolarHBondContact OE1-CB 3.49Å; E496-T503 PolarHBondContact OE1-N 3.33Å; E496-T503 PolarHBondContact OE1-OG1 3.21Å; T503-E505 PolarHBondContact O-N 2.67Å; T503-L506 PolarHBondContact O-N 2.82Å; T503-L506 VanDerWaalsContact O-N 3.11Å; T503-F507 HydrophobicContact CG2-CD2 3.85Å; T503-F507 HydrophobicContact CG2-CE2 4.06Å; T503-F507 PolarHBondContact O-N 2.98Å; T503-I523 HydrophobicContact CG2-CD1 4.05Å; T503-I523 HydrophobicContact CG2-CG2 4.13Å; T503-M529 HydrophobicContact CG2-CE 4.17Å; T503-M529 WeakPolarHBondContact OG1-CE 3.26Å
504	R	91.2	Very high	93.1	Very high	85 Å²	85	36 Å²	36	32%	0.321	19%	0.185	S	C	.	.	H	α-helix	trans	-57.6	-28.5	177.6	-175.5	-174.7	142.5	88	14.2	113.5	P502 I523 I524 F574 P575	P502-R504 PolarHBondContact O-N 3.37Å; P502-R504 VanDerWaalsContact O-N 3.08Å; R504-I523 HydrophobicContact CB-CG2 4.1Å; R504-I524 PolarHBondContact NH1-O 3.19Å; R504-F574 VanDerWaalsContact CZ-O 3.28Å; R504-F574 PolarHBondContact NH1-O 2.77Å; R504-F574 PolarHBondContact NH2-O 2.97Å; R504-P575 HydrophobicContact CG-CG 4.4Å
505	E	90.9	Very high	93.2	Very high	86 Å²	86	35.4 Å²	35.4	40%	0.402	18%	0.18	S	C	.	.	H	α-helix	trans	-93.9	-18.9	179.4	-66.3	174.5	-158.1	0	0	113	P502 T503	P502-E505 HydrophobicContact CG-CB 4.32Å; P502-E505 VanDerWaalsContact CG-CD 3.5Å; P502-E505 HydrophobicContact CG-CG 3.86Å; P502-E505 WeakPolarHBondContact CG-OE1 3.38Å; P502-E505 PolarHBondContact O-N 3.24Å; T503-E505 PolarHBondContact O-N 2.67Å
506	L	91.5	Very high	93.3	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-77.6	-28.5	-179.2	-63.6	-179.7	0	0	0	112.5	R474 L495 A499 R501 P502 T503 L824 L825	R474-L506 VanDerWaalsContact CD-O 3.31Å; R474-L506 WeakPolarHBondContact CD-O 3.46Å; R474-L506 PolarHBondContact NE-O 3Å; R474-L506 PolarHBondContact NH1-O 3.08Å; L495-L506 HydrophobicContact CD2-CD1 4.45Å; L495-L506 HydrophobicContact CG-CD1 4.28Å; A499-L506 HydrophobicContact CB-CD1 3.85Å; A499-L506 HydrophobicContact CB-CD2 3.86Å; R501-L506 HydrophobicContact CB-CD2 4Å; P502-L506 PolarHBondContact O-N 3.41Å; T503-L506 PolarHBondContact O-N 2.82Å; T503-L506 VanDerWaalsContact O-N 3.11Å; L506-L824 HydrophobicContact CD2-CB 4.49Å; L506-L825 HydrophobicContact CD2-CD2 4.28Å
507	F	94.5	Very high	93.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.171	C	C	.	.			trans	-123.2	141.9	-173.2	-62.1	-78.2	0	0	0	112.4	R474 L476 L495 T503 V510 V712 L824	R474-F507 HydrophobicContact CB-CD1 4.1Å; L476-F507 HydrophobicContact CB-CB 4.15Å; L476-F507 HydrophobicContact CB-CD1 3.67Å; L476-F507 HydrophobicContact CB-CD2 3.87Å; L476-F507 HydrophobicContact CB-CE1 3.95Å; L476-F507 HydrophobicContact CB-CE2 4.15Å; L476-F507 HydrophobicContact CB-CG 3.62Å; L476-F507 HydrophobicContact CB-CZ 4.18Å; L476-F507 HydrophobicContact CD1-CE1 4.44Å; L476-F507 HydrophobicContact CD1-CE2 4.13Å; L476-F507 HydrophobicContact CD1-CZ 4.02Å; L476-F507 HydrophobicContact CD2-CD2 3.86Å; L476-F507 HydrophobicContact CD2-CE2 3.98Å; L476-F507 HydrophobicContact CD2-CG 4.42Å; L476-F507 HydrophobicContact CG-CD2 4.34Å; L476-F507 HydrophobicContact CG-CE2 4.32Å; L495-F507 HydrophobicContact CD2-CE2 3.95Å; L495-F507 HydrophobicContact CD2-CZ 3.93Å; T503-F507 HydrophobicContact CG2-CD2 3.85Å; T503-F507 HydrophobicContact CG2-CE2 4.06Å; T503-F507 PolarHBondContact O-N 2.98Å; F507-V510 HydrophobicContact CB-CG2 4.29Å; F507-V712 HydrophobicContact CE1-CB 4.01Å; F507-V712 HydrophobicContact CE1-CG2 3.73Å; F507-V712 HydrophobicContact CZ-CB 4.17Å; F507-V712 HydrophobicContact CZ-CG2 4.01Å; F507-L824 HydrophobicContact CD1-CD2 4.23Å; F507-L824 HydrophobicContact CE1-CD1 4.2Å; F507-L824 HydrophobicContact CE1-CD2 3.65Å; F507-L824 HydrophobicContact CE2-CD1 4.45Å; F507-L824 HydrophobicContact CZ-CD1 3.77Å; F507-L824 HydrophobicContact CZ-CD2 4.1Å
508	D	93.8	Very high	93.4	Very high	6 Å²	6	25.8 Å²	25.8	3%	0.032	14%	0.138	C	C	.	.	S	Bend	trans	-92.4	-30.6	177.8	-52.4	-70.2	0	0	0	111.1	R474 F574 R576	R474-D508 IonicContact CZ-OD1 2.72Å; R474-D508 IonicContact CZ-OD2 3.57Å; R474-D508 PolarHBondContact N-OD2 3.48Å; R474-D508 IonicContact NE-OD2 2.76Å; R474-D508 PolarHBondContact NE-OD2 3.39Å; R474-D508 IonicContact NH2-OD1 3.76Å; R474-D508 PolarHBondContact NH2-OD1 2.98Å; R474-D508 IonicContact NH2-OD2 3.56Å; R474-D508 PolarHBondContact NH2-OD2 3.25Å; R474-D508 PolarHBondContact O-N 3.3Å; D508-F574 HydrophobicContact CB-CE2 4.4Å; D508-R576 PolarHBondContact O-N 3Å
509	W	95.3	Very high	93.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	137.8	176.1	-63.2	87.7	0	0	0	110.9	D473 R474 L475 L476 R576 M578 Y597 I689 F692	D473-W509 PolarHBondContact OD2-NE1 3.15Å; R474-W509 PolarHBondContact O-N 2.97Å; L475-W509 WeakPolarHBondContact CA-O 3.31Å; L475-W509 HydrophobicContact CB-CB 4.38Å; L475-W509 HydrophobicContact CD1-CB 3.63Å; L476-W509 PolarHBondContact N-O 3.15Å; W509-R576 CarbonylContact C-O 3.53Å; W509-R576 VanDerWaalsContact CA-O 3.31Å; W509-R576 WeakPolarHBondContact CA-O 3.42Å; W509-R576 HydrophobicContact CD2-CB 3.84Å; W509-R576 VanDerWaalsContact CE2-NH1 3.35Å; W509-R576 HydrophobicContact CE3-CB 3.33Å; W509-R576 HydrophobicContact CE3-CG 4.24Å; W509-R576 HydrophobicContact CH2-CB 4.26Å; W509-R576 HydrophobicContact CH2-CG 4.38Å; W509-R576 HydrophobicContact CZ3-CB 3.56Å; W509-R576 VanDerWaalsContact CZ3-CD 3.41Å; W509-R576 HydrophobicContact CZ3-CG 4.14Å; W509-M578 HydrophobicContact CD2-CE 4.28Å; W509-M578 HydrophobicContact CE3-CE 3.27Å; W509-M578 HydrophobicContact CH2-CE 4.32Å; W509-M578 HydrophobicContact CZ3-CE 3.31Å; W509-Y597 HydrophobicContact CE3-CE1 4.31Å; W509-Y597 AromaticContact CZ3-CD1 3.99Å; W509-Y597 HydrophobicContact CZ3-CD1 3.99Å; W509-Y597 AromaticContact CZ3-CE1 3.59Å; W509-Y597 HydrophobicContact CZ3-CE1 3.59Å; W509-Y597 HydrophobicContact CZ3-CE2 4.18Å; W509-Y597 HydrophobicContact CZ3-CG 4.47Å; W509-Y597 AromaticContact CZ3-CZ 3.72Å; W509-I689 HydrophobicContact CB-CD1 4.16Å; W509-I689 HydrophobicContact CD2-CD1 4.01Å; W509-I689 HydrophobicContact CD2-CG1 3.87Å; W509-I689 HydrophobicContact CE3-CD1 4.47Å; W509-I689 HydrophobicContact CE3-CG1 4.05Å; W509-I689 HydrophobicContact CG-CD1 3.88Å; W509-I689 HydrophobicContact CG-CG1 4.29Å; W509-I689 HydrophobicContact CH2-CG1 4.43Å; W509-I689 HydrophobicContact CZ2-CG1 4.28Å; W509-I689 HydrophobicContact CZ3-CG1 4.34Å; W509-F692 HydrophobicContact CH2-CB 4.33Å; W509-F692 AromaticContact CH2-CD1 3.53Å; W509-F692 HydrophobicContact CH2-CD1 3.53Å; W509-F692 HydrophobicContact CH2-CD2 4.36Å; W509-F692 AromaticContact CH2-CE1 3.81Å; W509-F692 HydrophobicContact CH2-CE1 3.81Å; W509-F692 AromaticContact CH2-CG 3.82Å; W509-F692 HydrophobicContact CH2-CG 3.82Å; W509-F692 HydrophobicContact CH2-CZ 4.36Å; W509-F692 AromaticContact CZ2-CD1 3.67Å; W509-F692 HydrophobicContact CZ2-CD1 3.67Å; W509-F692 AromaticContact CZ2-CE1 3.88Å; W509-F692 HydrophobicContact CZ2-CE1 3.88Å; W509-F692 HydrophobicContact CZ2-CG 4.39Å
510	V	96.8	Very high	93.7	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	124.2	173.2	-172	0	0	0	0	109.6	L476 L478 F507 A520 P575 R576 V577 M578	L476-V510 HydrophobicContact CB-CG1 4.36Å; L476-V510 HydrophobicContact CB-CG2 4.37Å; L476-V510 HydrophobicContact CD2-CG1 4.08Å; L476-V510 HydrophobicContact CD2-CG2 4.47Å; L476-V510 HydrophobicContact CG-CG1 4.32Å; L476-V510 CarbonylContact O-C 3.34Å; L476-V510 WeakPolarHBondContact O-CA 3.47Å; L478-V510 HydrophobicContact CD1-CG1 4.27Å; F507-V510 HydrophobicContact CB-CG2 4.29Å; V510-A520 HydrophobicContact CG1-CB 3.69Å; V510-P575 HydrophobicContact CG2-CB 4.28Å; V510-P575 HydrophobicContact CG2-CG 4.06Å; V510-R576 PolarHBondContact N-O 2.87Å; V510-V577 HydrophobicContact CB-CG2 3.9Å; V510-V577 HydrophobicContact CG2-CG2 4.5Å; V510-V577 CarbonylContact O-C 3.57Å; V510-V577 WeakPolarHBondContact O-CA 3.47Å; V510-M578 PolarHBondContact O-N 2.96Å
511	A	97.1	Very high	93.7	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.008	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	140.9	175	0	0	0	0	0	110	L475 L476 C477 L478 M578 P681 A685	L475-A511 HydrophobicContact CD1-CB 4.41Å; L476-A511 PolarHBondContact O-N 3.43Å; C477-A511 CarbonylContact C-O 3.58Å; C477-A511 WeakPolarHBondContact CA-O 3.37Å; L478-A511 PolarHBondContact N-O 3.21Å; A511-M578 CarbonylContact C-O 3.33Å; A511-M578 VanDerWaalsContact CA-O 3.3Å; A511-M578 WeakPolarHBondContact CA-O 3.32Å; A511-M578 HydrophobicContact CB-CB 4.13Å; A511-P681 HydrophobicContact CB-CB 4.12Å; A511-P681 HydrophobicContact CB-CG 4.14Å; A511-A685 HydrophobicContact CB-CB 3.62Å
512	G	97.1	Very high	93.8	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	144.2	-178	0	0	0	0	0	113.5	L478 M578 V579 T580	L478-G512 WeakPolarHBondContact O-CA 3.07Å; G512-M578 PolarHBondContact N-O 3.34Å; G512-V579 WeakPolarHBondContact O-CA 3.4Å; G512-T580 PolarHBondContact O-N 3.41Å; G512-T580 VanDerWaalsContact O-N 3.11Å
513	T	95.6	Very high	93.8	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	139.4	172.3	-57.4	0	0	0	0	110.4	L478 G480 T515 G516 G517 T580 G674 A678	L478-T513 PolarHBondContact O-N 2.95Å; L478-T513 VanDerWaalsContact O-N 3.09Å; G480-T513 WeakPolarHBondContact CA-O 3.34Å; G480-T513 PolarHBondContact N-O 3.41Å; T513-T515 PolarHBondContact O-N 3.12Å; T513-G516 WeakPolarHBondContact O-CA 3.49Å; T513-G516 PolarHBondContact O-N 3.07Å; T513-G517 PolarHBondContact O-N 3.47Å; T513-T580 WeakPolarHBondContact CA-OG1 3.27Å; T513-T580 VanDerWaalsContact CB-OG1 3.26Å; T513-T580 WeakPolarHBondContact CB-OG1 3.27Å; T513-T580 WeakPolarHBondContact CG2-OG1 3.45Å; T513-T580 PolarHBondContact OG1-OG1 3.04Å; T513-G674 VanDerWaalsContact CG2-C 3.43Å; T513-A678 WeakPolarHBondContact CB-O 3.34Å; T513-A678 WeakPolarHBondContact CG2-O 3.5Å; T513-A678 PolarHBondContact OG1-O 2.82Å
514	S	93	Very high	93.5	Very high	6 Å²	6	10.2 Å²	10.2	4%	0.042	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	-121.2	177.4	-165	0	0	0	0	111.8	G516 G517 I518 S658 D673	S514-G516 VanDerWaalsContact C-N 3.27Å; S514-G516 PolarHBondContact O-N 3.45Å; S514-G517 WeakPolarHBondContact O-CA 3.21Å; S514-G517 PolarHBondContact O-N 3.28Å; S514-I518 PolarHBondContact O-N 3.04Å; S514-I518 VanDerWaalsContact O-N 3.12Å; S514-S658 WeakPolarHBondContact CA-O 3.19Å; S514-S658 PolarHBondContact N-OG 3.22Å; S514-D673 VanDerWaalsContact CB-OD1 3.25Å; S514-D673 WeakPolarHBondContact CB-OD1 3.29Å; S514-D673 WeakPolarHBondContact CB-OD2 3.29Å; S514-D673 PolarHBondContact OG-OD2 3.37Å
515	T	93.8	Very high	93.2	Very high	5 Å²	5	9.3 Å²	9.3	3%	0.031	5%	0.046	C	C	.	.	H	α-helix	trans	-57.2	-36.2	173.3	-146.5	0	0	0	0	113.6	G482 G485 L488 T513 G517 I518 L519 Y536 T716	G482-T515 WeakPolarHBondContact O-CB 3.35Å; G482-T515 WeakPolarHBondContact O-CG2 3.42Å; G482-T515 PolarHBondContact O-OG1 2.84Å; G485-T515 VanDerWaalsContact CA-CG2 3.45Å; L488-T515 HydrophobicContact CD1-CG2 4.37Å; T513-T515 PolarHBondContact O-N 3.12Å; T515-G517 PolarHBondContact O-N 3.01Å; T515-I518 PolarHBondContact O-N 3.08Å; T515-L519 WeakPolarHBondContact O-CB 3.42Å; T515-L519 PolarHBondContact O-N 3.41Å; T515-Y536 PolarHBondContact O-OH 3.4Å; T515-Y536 VanDerWaalsContact OG1-CE1 3.26Å; T515-Y536 WeakPolarHBondContact OG1-CE1 3.4Å; T515-Y536 PolarHBondContact OG1-OH 3.33Å; T515-T716 HydrophobicContact CG2-CG2 4.36Å
516	G	95	Very high	92.9	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-65.7	-29.2	173.4	0	0	0	0	0	112	D479 T513 S514 A520	D479-G516 PolarHBondContact O-N 3.23Å; T513-G516 WeakPolarHBondContact O-CA 3.49Å; T513-G516 PolarHBondContact O-N 3.07Å; S514-G516 VanDerWaalsContact C-N 3.27Å; S514-G516 PolarHBondContact O-N 3.45Å; G516-A520 WeakPolarHBondContact O-CB 3.45Å; G516-A520 PolarHBondContact O-N 3.29Å
517	G	93.9	Very high	92.7	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-68	-45.4	170.8	0	0	0	0	0	112.4	T513 S514 T515 L519 A520 L521	T513-G517 PolarHBondContact O-N 3.47Å; S514-G517 WeakPolarHBondContact O-CA 3.21Å; S514-G517 PolarHBondContact O-N 3.28Å; T515-G517 PolarHBondContact O-N 3.01Å; G517-L519 VanDerWaalsContact C-N 3.32Å; G517-L519 PolarHBondContact O-N 3.49Å; G517-A520 PolarHBondContact O-N 2.96Å; G517-L521 WeakPolarHBondContact O-CG 3.43Å; G517-L521 PolarHBondContact O-N 3.27Å
518	I	93.6	Very high	92.5	Very high	12 Å²	12	12.6 Å²	12.6	6%	0.062	8%	0.082	C	C	.	.	H	α-helix	trans	-59.4	-45.6	173.7	-58.8	174.1	0	0	0	110.1	S514 T515 L521 A522 L559 F563 A655	S514-I518 PolarHBondContact O-N 3.04Å; S514-I518 VanDerWaalsContact O-N 3.12Å; T515-I518 PolarHBondContact O-N 3.08Å; I518-L521 PolarHBondContact O-N 2.98Å; I518-A522 WeakPolarHBondContact O-CB 3.45Å; I518-A522 PolarHBondContact O-N 2.98Å; I518-L559 HydrophobicContact CD1-CD2 4.4Å; I518-L559 HydrophobicContact CG1-CD2 4.45Å; I518-L559 HydrophobicContact CG2-CD2 4.2Å; I518-F563 HydrophobicContact CG2-CE2 4.08Å; I518-F563 HydrophobicContact CG2-CZ 4.05Å; I518-A655 HydrophobicContact CG1-CB 4.28Å
519	L	94.7	Very high	92.3	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-65.9	-43.4	178.5	-176.9	55.2	0	0	0	112	L478 L488 I489 L492 T515 G517 L521 A522 I523 M529 L532	L478-L519 HydrophobicContact CD1-CB 4.14Å; L478-L519 HydrophobicContact CD1-CD2 4.07Å; L478-L519 HydrophobicContact CD1-CG 3.91Å; L488-L519 HydrophobicContact CB-CD2 3.68Å; L488-L519 HydrophobicContact CD1-CD2 4.27Å; I489-L519 HydrophobicContact CD1-CD1 4.42Å; I489-L519 HydrophobicContact CG1-CD1 3.84Å; I489-L519 HydrophobicContact CG1-CD2 3.78Å; I489-L519 HydrophobicContact CG1-CG 4.47Å; L492-L519 HydrophobicContact CD1-CD2 3.89Å; L492-L519 HydrophobicContact CD1-CG 4.31Å; T515-L519 WeakPolarHBondContact O-CB 3.42Å; T515-L519 PolarHBondContact O-N 3.41Å; G517-L519 VanDerWaalsContact C-N 3.32Å; G517-L519 PolarHBondContact O-N 3.49Å; L519-L521 VanDerWaalsContact C-N 3.3Å; L519-L521 PolarHBondContact O-N 3.5Å; L519-A522 WeakPolarHBondContact O-CB 3.25Å; L519-A522 PolarHBondContact O-N 3.35Å; L519-I523 HydrophobicContact CG-CD1 4.35Å; L519-I523 VanDerWaalsContact O-CG1 3.27Å; L519-I523 WeakPolarHBondContact O-CG1 3.49Å; L519-I523 PolarHBondContact O-N 3.13Å; L519-M529 HydrophobicContact CD1-SD 4.28Å; L519-L532 HydrophobicContact CD1-CD1 3.55Å
520	A	94.3	Very high	92.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-55.5	-46.9	174.9	0	0	0	0	0	111	L478 V510 G516 G517 A522 I523 I524 V577	L478-A520 HydrophobicContact CD1-CB 4.24Å; V510-A520 HydrophobicContact CG1-CB 3.69Å; G516-A520 WeakPolarHBondContact O-CB 3.45Å; G516-A520 PolarHBondContact O-N 3.29Å; G517-A520 PolarHBondContact O-N 2.96Å; A520-A522 VanDerWaalsContact C-N 3.33Å; A520-A522 PolarHBondContact O-N 3.1Å; A520-I523 WeakPolarHBondContact O-CB 3.26Å; A520-I523 PolarHBondContact O-N 3.28Å; A520-I524 VanDerWaalsContact O-CG1 3.32Å; A520-I524 WeakPolarHBondContact O-CG1 3.3Å; A520-I524 PolarHBondContact O-N 2.89Å; A520-V577 HydrophobicContact CB-CG1 4.07Å
521	L	92.8	Very high	91.8	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-64.5	-37	176.4	-65.4	169.7	0	0	0	112	G517 I518 L519 I524 H525 F563 M569 V577 V579 I651 A655	G517-L521 WeakPolarHBondContact O-CG 3.43Å; G517-L521 PolarHBondContact O-N 3.27Å; I518-L521 PolarHBondContact O-N 2.98Å; L519-L521 VanDerWaalsContact C-N 3.3Å; L519-L521 PolarHBondContact O-N 3.5Å; L521-I524 HydrophobicContact CD2-CD1 3.92Å; L521-I524 WeakPolarHBondContact O-CB 3.18Å; L521-I524 PolarHBondContact O-N 3.12Å; L521-H525 PolarHBondContact O-CD2 2.92Å; L521-H525 PolarHBondContact O-N 3.24Å; L521-F563 HydrophobicContact CB-CE1 3.99Å; L521-F563 HydrophobicContact CB-CZ 4.16Å; L521-M569 HydrophobicContact CD2-CE 4.02Å; L521-M569 HydrophobicContact CD2-SD 3.68Å; L521-V577 HydrophobicContact CD2-CG1 4.34Å; L521-V579 HydrophobicContact CD1-CG2 4.14Å; L521-V579 HydrophobicContact CD2-CG2 4.1Å; L521-V579 HydrophobicContact CG-CG2 3.95Å; L521-I651 HydrophobicContact CB-CG2 4.17Å; L521-I651 HydrophobicContact CD1-CG2 3.96Å; L521-I651 HydrophobicContact CD2-CG2 4.12Å; L521-I651 HydrophobicContact CG-CG2 4.29Å; L521-A655 HydrophobicContact CD1-CB 3.67Å
522	A	92.2	Very high	91.6	Very high	2 Å²	2	22 Å²	22	2%	0.017	12%	0.122	C	C	.	.	H	α-helix	trans	-65.7	-37.3	176.3	0	0	0	0	0	113.8	I518 L519 A520 I524 H525 K527 L532 F563	I518-A522 WeakPolarHBondContact O-CB 3.45Å; I518-A522 PolarHBondContact O-N 2.98Å; L519-A522 WeakPolarHBondContact O-CB 3.25Å; L519-A522 PolarHBondContact O-N 3.35Å; A520-A522 VanDerWaalsContact C-N 3.33Å; A520-A522 PolarHBondContact O-N 3.1Å; A522-I524 VanDerWaalsContact C-N 3.28Å; A522-I524 PolarHBondContact O-N 2.9Å; A522-H525 PolarHBondContact O-N 3.27Å; A522-K527 HydrophobicContact CB-CD 4.48Å; A522-K527 PolarHBondContact O-N 3.31Å; A522-L532 HydrophobicContact CB-CD1 3.57Å; A522-L532 HydrophobicContact CB-CD2 3.67Å; A522-L532 HydrophobicContact CB-CG 4.29Å; A522-F563 HydrophobicContact CB-CE1 4.08Å; A522-F563 HydrophobicContact CB-CZ 4.21Å
523	I	89.9	Confident	91.4	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.015	12%	0.124	C	C	.	.	H	α-helix	trans	-59.9	-42.3	174.8	-66.4	168.1	0	0	0	110.5	L476 L478 L492 T503 R504 L519 A520 H525 G526 M529	L476-I523 HydrophobicContact CD2-CD1 4.16Å; L478-I523 HydrophobicContact CD1-CD1 3.92Å; L492-I523 HydrophobicContact CD1-CD1 3.99Å; T503-I523 HydrophobicContact CG2-CD1 4.05Å; T503-I523 HydrophobicContact CG2-CG2 4.13Å; R504-I523 HydrophobicContact CB-CG2 4.1Å; L519-I523 HydrophobicContact CG-CD1 4.35Å; L519-I523 VanDerWaalsContact O-CG1 3.27Å; L519-I523 WeakPolarHBondContact O-CG1 3.49Å; L519-I523 PolarHBondContact O-N 3.13Å; A520-I523 WeakPolarHBondContact O-CB 3.26Å; A520-I523 PolarHBondContact O-N 3.28Å; I523-H525 VanDerWaalsContact C-N 3.29Å; I523-H525 PolarHBondContact O-N 3.03Å; I523-G526 PolarHBondContact O-N 3.01Å; I523-M529 HydrophobicContact CD1-CE 4.02Å; I523-M529 HydrophobicContact CG1-CE 3.48Å; I523-M529 VanDerWaalsContact CG1-CE 3.48Å
524	I	85.9	Confident	91.3	Very high	6 Å²	6	23.2 Å²	23.2	3%	0.031	13%	0.129	C	C	.	.	H	α-helix	trans	-61.9	-40.7	-179.1	-57.7	165.2	0	0	0	111.2	R504 A520 L521 A522 G526 I572 P575 V577	R504-I524 PolarHBondContact NH1-O 3.19Å; A520-I524 VanDerWaalsContact O-CG1 3.32Å; A520-I524 WeakPolarHBondContact O-CG1 3.3Å; A520-I524 PolarHBondContact O-N 2.89Å; L521-I524 HydrophobicContact CD2-CD1 3.92Å; L521-I524 WeakPolarHBondContact O-CB 3.18Å; L521-I524 PolarHBondContact O-N 3.12Å; A522-I524 VanDerWaalsContact C-N 3.28Å; A522-I524 PolarHBondContact O-N 2.9Å; I524-G526 PolarHBondContact O-N 2.94Å; I524-G526 VanDerWaalsContact O-N 3.14Å; I524-I572 HydrophobicContact CB-CD1 4.26Å; I524-I572 HydrophobicContact CG2-CB 3.62Å; I524-I572 HydrophobicContact CG2-CD1 3.43Å; I524-I572 VanDerWaalsContact CG2-CD1 3.43Å; I524-I572 HydrophobicContact CG2-CG1 4.07Å; I524-I572 HydrophobicContact CG2-CG2 3.07Å; I524-P575 HydrophobicContact CG1-CG 4.42Å; I524-V577 HydrophobicContact CD1-CB 3.43Å; I524-V577 VanDerWaalsContact CD1-CB 3.43Å; I524-V577 HydrophobicContact CD1-CG1 3.76Å; I524-V577 HydrophobicContact CD1-CG2 3.1Å; I524-V577 HydrophobicContact CG1-CB 4.2Å; I524-V577 HydrophobicContact CG1-CG2 3.29Å
525	H	84.9	Confident	91.1	Very high	66 Å²	66	23.4 Å²	23.4	31%	0.306	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-0.3	177.6	-84	-87.6	0	0	0	114	L521 A522 I523 K527 F563 I651	L521-H525 PolarHBondContact O-CD2 2.92Å; L521-H525 PolarHBondContact O-N 3.24Å; A522-H525 PolarHBondContact O-N 3.27Å; I523-H525 VanDerWaalsContact C-N 3.29Å; I523-H525 PolarHBondContact O-N 3.03Å; H525-K527 VanDerWaalsContact C-N 3.28Å; H525-K527 HydrophobicContact CB-CG 4.27Å; H525-K527 PolarHBondContact O-N 3.44Å; H525-F563 AromaticContact CD2-CD1 3.67Å; H525-F563 AromaticContact NE2-CD1 3.85Å; H525-I651 VanDerWaalsContact NE2-CD1 3.33Å; H525-I651 WeakPolarHBondContact NE2-CD1 3.49Å
526	G	84.3	Confident	91.1	Very high	54 Å²	54	23.3 Å²	23.3	56%	0.557	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	71	22.9	177.9	0	0	0	0	0	113.5	I523 I524	I523-G526 PolarHBondContact O-N 3.01Å; I524-G526 PolarHBondContact O-N 2.94Å; I524-G526 VanDerWaalsContact O-N 3.14Å
527	K	87.3	Confident	90.9	Very high	41 Å²	41	23.5 Å²	23.5	18%	0.178	13%	0.13	C	C	.	.			trans	-72.4	136.1	176.5	-65.6	-173.8	173.4	-174.3	0	110.1	A522 H525 Y531 L532 E562	A522-K527 HydrophobicContact CB-CD 4.48Å; A522-K527 PolarHBondContact O-N 3.31Å; H525-K527 VanDerWaalsContact C-N 3.28Å; H525-K527 HydrophobicContact CB-CG 4.27Å; H525-K527 PolarHBondContact O-N 3.44Å; K527-Y531 HydrophobicContact CB-CD1 4.34Å; K527-Y531 HydrophobicContact CD-CD1 4.33Å; K527-Y531 HydrophobicContact CD-CE1 4.01Å; K527-L532 HydrophobicContact CB-CD1 4.33Å; K527-L532 HydrophobicContact CB-CD2 4.1Å; K527-L532 HydrophobicContact CB-CG 4.19Å; K527-L532 HydrophobicContact CD-CD2 3.99Å; K527-E562 WeakPolarHBondContact CE-O 3.3Å; K527-E562 VanDerWaalsContact NZ-C 3.35Å; K527-E562 PolarHBondContact NZ-O 2.84Å; K527-E562 IonicContact NZ-OE2 3.9Å; K527-E562 PolarHBondContact NZ-OE2 3.47Å
528	S	90.4	Very high	90.7	Very high	61 Å²	61	26.2 Å²	26.2	43%	0.427	14%	0.14	S	C	.	.			trans	-62.1	140.2	174	165.9	0	0	0	0	111.1	E530 Y531 L532	S528-E530 VanDerWaalsContact C-N 3.28Å; S528-E530 PolarHBondContact O-N 3.36Å; S528-E530 PolarHBondContact OG-N 2.99Å; S528-Y531 WeakPolarHBondContact O-CB 3.47Å; S528-Y531 PolarHBondContact O-N 2.95Å; S528-L532 WeakPolarHBondContact O-CG 3.46Å; S528-L532 PolarHBondContact O-N 2.98Å
529	M	90.8	Very high	90.5	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-63.8	-34.4	176.6	-62.5	-62.5	162.8	0	0	112.6	I489 L492 I493 E496 T503 L519 I523 Y531 L532 R533	I489-M529 HydrophobicContact CG2-CB 4.17Å; I489-M529 WeakPolarHBondContact CG2-O 3.37Å; L492-M529 HydrophobicContact CB-CE 4.36Å; L492-M529 HydrophobicContact CB-CG 4.17Å; L492-M529 HydrophobicContact CB-SD 3.97Å; L492-M529 HydrophobicContact CD1-CE 4.02Å; L492-M529 HydrophobicContact CD1-SD 3.88Å; I493-M529 HydrophobicContact CD1-CB 4.17Å; I493-M529 HydrophobicContact CG1-CB 3.37Å; I493-M529 HydrophobicContact CG1-CG 4.41Å; E496-M529 VanDerWaalsContact OE2-CG 3.29Å; E496-M529 WeakPolarHBondContact OE2-CG 3.49Å; T503-M529 HydrophobicContact CG2-CE 4.17Å; T503-M529 WeakPolarHBondContact OG1-CE 3.26Å; L519-M529 HydrophobicContact CD1-SD 4.28Å; I523-M529 HydrophobicContact CD1-CE 4.02Å; I523-M529 HydrophobicContact CG1-CE 3.48Å; I523-M529 VanDerWaalsContact CG1-CE 3.48Å; M529-Y531 VanDerWaalsContact C-N 3.31Å; M529-Y531 PolarHBondContact O-N 3.48Å; M529-L532 PolarHBondContact O-N 3.14Å; M529-L532 HydrophobicContact SD-CD1 4.14Å; M529-R533 PolarHBondContact O-N 3.38Å
530	E	90.7	Very high	90.2	Very high	113 Å²	113	26.1 Å²	26.1	53%	0.528	14%	0.139	S	C	.	.	H	α-helix	trans	-64	-39.6	175.6	-64	178.9	166.1	0	0	111.4	I493 S528 R533 C534	I493-E530 HydrophobicContact CD1-CG 4.3Å; S528-E530 VanDerWaalsContact C-N 3.28Å; S528-E530 PolarHBondContact O-N 3.36Å; S528-E530 PolarHBondContact OG-N 2.99Å; E530-R533 PolarHBondContact O-N 3.38Å; E530-C534 PolarHBondContact O-N 3.44Å; E530-C534 PolarHBondContact O-SG 3.09Å
531	Y	91	Very high	89.6	Confident	85 Å²	85	29.3 Å²	29.3	33%	0.333	15%	0.154	S	C	.	.	H	α-helix	trans	-62.7	-44.5	172.4	169.7	-97.3	0	0	0	110.9	K527 S528 M529 R533 C534 L535 E562	K527-Y531 HydrophobicContact CB-CD1 4.34Å; K527-Y531 HydrophobicContact CD-CD1 4.33Å; K527-Y531 HydrophobicContact CD-CE1 4.01Å; S528-Y531 WeakPolarHBondContact O-CB 3.47Å; S528-Y531 PolarHBondContact O-N 2.95Å; M529-Y531 VanDerWaalsContact C-N 3.31Å; M529-Y531 PolarHBondContact O-N 3.48Å; Y531-R533 PolarHBondContact O-N 2.73Å; Y531-C534 PolarHBondContact O-N 3.22Å; Y531-L535 HydrophobicContact CE1-CB 4.4Å; Y531-L535 HydrophobicContact CE1-CD2 3.93Å; Y531-L535 VanDerWaalsContact O-CB 3.29Å; Y531-L535 WeakPolarHBondContact O-CB 3.37Å; Y531-L535 PolarHBondContact O-N 3.46Å; Y531-E562 PolarHBondContact OH-OE1 2.91Å; Y531-E562 VanDerWaalsContact OH-OE1 3.13Å; Y531-E562 PolarHBondContact OH-OE2 3.27Å
532	L	92	Very high	89.2	Confident	3 Å²	3	33.5 Å²	33.5	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-64.9	-37.3	179.7	-65.9	175.5	0	0	0	112.7	I489 L519 A522 K527 S528 M529 L535 Y536	I489-L532 HydrophobicContact CD1-CB 4.05Å; L519-L532 HydrophobicContact CD1-CD1 3.55Å; A522-L532 HydrophobicContact CB-CD1 3.57Å; A522-L532 HydrophobicContact CB-CD2 3.67Å; A522-L532 HydrophobicContact CB-CG 4.29Å; K527-L532 HydrophobicContact CB-CD1 4.33Å; K527-L532 HydrophobicContact CB-CD2 4.1Å; K527-L532 HydrophobicContact CB-CG 4.19Å; K527-L532 HydrophobicContact CD-CD2 3.99Å; S528-L532 WeakPolarHBondContact O-CG 3.46Å; S528-L532 PolarHBondContact O-N 2.98Å; M529-L532 PolarHBondContact O-N 3.14Å; M529-L532 HydrophobicContact SD-CD1 4.14Å; L532-L535 HydrophobicContact CD2-CD2 3.98Å; L532-L535 WeakPolarHBondContact O-CB 3.38Å; L532-L535 PolarHBondContact O-N 2.8Å; L532-Y536 VanDerWaalsContact O-CD2 3.31Å; L532-Y536 WeakPolarHBondContact O-CD2 3.4Å; L532-Y536 PolarHBondContact O-N 3.49Å
533	R	93.6	Very high	89	Confident	10 Å²	10	33.6 Å²	33.6	4%	0.038	17%	0.174	C	C	.	.	H	α-helix	trans	-57.3	-52.8	172.3	-177.7	173.7	60.9	-165.1	2.1	110.4	V374 L486 I489 M529 E530 Y531 L535 Y536 F537	V374-R533 VanDerWaalsContact O-CZ 3.22Å; V374-R533 PolarHBondContact O-NH1 3.16Å; V374-R533 PolarHBondContact O-NH2 3.48Å; L486-R533 HydrophobicContact CD2-CG 4.02Å; I489-R533 HydrophobicContact CG2-CB 3.87Å; M529-R533 PolarHBondContact O-N 3.38Å; E530-R533 PolarHBondContact O-N 3.38Å; Y531-R533 PolarHBondContact O-N 2.73Å; R533-L535 VanDerWaalsContact C-N 3.29Å; R533-L535 PolarHBondContact O-N 3Å; R533-Y536 PolarHBondContact O-N 2.81Å; R533-F537 HydrophobicContact CG-CD2 4.44Å; R533-F537 HydrophobicContact CG-CE2 4.36Å; R533-F537 WeakPolarHBondContact O-CD2 3.44Å; R533-F537 PolarHBondContact O-N 3.25Å
534	C	92.4	Very high	88.8	Confident	17 Å²	17	34.9 Å²	34.9	12%	0.115	18%	0.18	C	C	.	.	H	α-helix	trans	-61.1	-38.6	177.8	-65	0	0	0	0	112.2	T341 E530 Y531 F537 R538	T341-C534 WeakPolarHBondContact O-CB 3.22Å; E530-C534 PolarHBondContact O-N 3.44Å; E530-C534 PolarHBondContact O-SG 3.09Å; Y531-C534 PolarHBondContact O-N 3.22Å; C534-F537 PolarHBondContact O-N 3.14Å; C534-R538 WeakPolarHBondContact O-CG 3.46Å; C534-R538 PolarHBondContact O-N 3.34Å; C534-R538 VanDerWaalsContact O-N 3.12Å
535	L	90.7	Very high	88.6	Confident	10 Å²	10	42.3 Å²	42.3	5%	0.052	21%	0.207	C	C	.	.	H	α-helix	trans	-62.3	-43.1	177.4	-174.6	67.6	0	0	0	112	Y531 L532 R533 R538 M539 F558 E562	Y531-L535 HydrophobicContact CE1-CB 4.4Å; Y531-L535 HydrophobicContact CE1-CD2 3.93Å; Y531-L535 VanDerWaalsContact O-CB 3.29Å; Y531-L535 WeakPolarHBondContact O-CB 3.37Å; Y531-L535 PolarHBondContact O-N 3.46Å; L532-L535 HydrophobicContact CD2-CD2 3.98Å; L532-L535 WeakPolarHBondContact O-CB 3.38Å; L532-L535 PolarHBondContact O-N 2.8Å; R533-L535 VanDerWaalsContact C-N 3.29Å; R533-L535 PolarHBondContact O-N 3Å; L535-R538 PolarHBondContact O-N 3.49Å; L535-R538 VanDerWaalsContact O-N 3.15Å; L535-M539 VanDerWaalsContact O-CB 3.3Å; L535-M539 WeakPolarHBondContact O-CB 3.47Å; L535-M539 PolarHBondContact O-N 2.81Å; L535-F558 HydrophobicContact CD1-CE2 3.54Å; L535-F558 HydrophobicContact CD1-CZ 4.05Å; L535-F558 HydrophobicContact CD2-CE2 4.09Å; L535-F558 HydrophobicContact CD2-CZ 3.7Å; L535-F558 HydrophobicContact CG-CE2 3.65Å; L535-F558 HydrophobicContact CG-CZ 3.64Å; L535-E562 HydrophobicContact CD1-CG 4.21Å; L535-E562 WeakPolarHBondContact CD1-OE1 3.4Å; L535-E562 HydrophobicContact CD2-CG 3.94Å; L535-E562 WeakPolarHBondContact CD2-OE2 3.49Å
536	Y	92.1	Very high	88.5	Confident	3 Å²	3	42.6 Å²	42.6	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-64.1	-40.8	178.2	-91.2	-126.5	0	0	0	112.2	I483 L486 I489 T515 L532 R533 R538 M539 K540	I483-Y536 HydrophobicContact CD1-CD1 4.16Å; L486-Y536 HydrophobicContact CD2-CG 4.34Å; L486-Y536 HydrophobicContact CG-CD1 4.28Å; I489-Y536 HydrophobicContact CD1-CD1 4.25Å; I489-Y536 HydrophobicContact CD1-CD2 3.9Å; I489-Y536 HydrophobicContact CD1-CE1 4.4Å; I489-Y536 HydrophobicContact CD1-CE2 4.07Å; I489-Y536 HydrophobicContact CD1-CG 4.01Å; T515-Y536 PolarHBondContact O-OH 3.4Å; T515-Y536 VanDerWaalsContact OG1-CE1 3.26Å; T515-Y536 WeakPolarHBondContact OG1-CE1 3.4Å; T515-Y536 PolarHBondContact OG1-OH 3.33Å; L532-Y536 VanDerWaalsContact O-CD2 3.31Å; L532-Y536 WeakPolarHBondContact O-CD2 3.4Å; L532-Y536 PolarHBondContact O-N 3.49Å; R533-Y536 PolarHBondContact O-N 2.81Å; Y536-R538 VanDerWaalsContact C-N 3.28Å; Y536-R538 PolarHBondContact O-N 3.36Å; Y536-M539 HydrophobicContact CD1-CE 4.34Å; Y536-M539 HydrophobicContact CG-CE 4.5Å; Y536-M539 PolarHBondContact O-N 3.26Å; Y536-K540 PolarHBondContact O-N 2.99Å
537	F	91.9	Very high	88.3	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-32	172.9	-86.9	-87.2	0	0	0	113.1	M337 T341 F375 L486 R533 C534 K540 D796 L799 V800 L803	M337-F537 HydrophobicContact CE-CE1 4.17Å; T341-F537 HydrophobicContact CG2-CB 3.36Å; T341-F537 HydrophobicContact CG2-CD1 4.05Å; T341-F537 HydrophobicContact CG2-CD2 4.34Å; T341-F537 HydrophobicContact CG2-CG 3.69Å; F375-F537 HydrophobicContact CE2-CE2 4.11Å; F375-F537 HydrophobicContact CE2-CZ 4.25Å; F375-F537 AromaticContact CZ-CD2 3.82Å; F375-F537 HydrophobicContact CZ-CD2 3.82Å; F375-F537 AromaticContact CZ-CE2 3.7Å; F375-F537 HydrophobicContact CZ-CE2 3.7Å; F375-F537 HydrophobicContact CZ-CG 4.35Å; F375-F537 HydrophobicContact CZ-CZ 4.14Å; L486-F537 HydrophobicContact CD1-CD2 4.21Å; L486-F537 HydrophobicContact CD1-CE2 3.83Å; L486-F537 HydrophobicContact CD1-CZ 4.14Å; L486-F537 HydrophobicContact CD2-CD2 3.89Å; L486-F537 HydrophobicContact CD2-CE2 3.84Å; R533-F537 HydrophobicContact CG-CD2 4.44Å; R533-F537 HydrophobicContact CG-CE2 4.36Å; R533-F537 WeakPolarHBondContact O-CD2 3.44Å; R533-F537 PolarHBondContact O-N 3.25Å; C534-F537 PolarHBondContact O-N 3.14Å; F537-K540 HydrophobicContact CD1-CD 4.47Å; F537-K540 VanDerWaalsContact CD1-CE 3.5Å; F537-K540 WeakPolarHBondContact O-CE 3.2Å; F537-K540 WeakPolarHBondContact O-CG 3.46Å; F537-D796 WeakPolarHBondContact CD1-OD1 3.37Å; F537-L799 HydrophobicContact CE1-CB 3.96Å; F537-L799 HydrophobicContact CE1-CD1 4.18Å; F537-L799 HydrophobicContact CZ-CB 3.95Å; F537-V800 HydrophobicContact CZ-CG2 4.33Å; F537-L803 HydrophobicContact CE2-CD1 3.77Å; F537-L803 HydrophobicContact CZ-CD1 3.99Å
538	R	89.1	Confident	88.1	Confident	56 Å²	56	48.1 Å²	48.1	21%	0.211	25%	0.247	C	C	.	.	H	α-helix	trans	-78.7	-35.8	173.8	-67.4	-179.5	-63.2	-159.8	1	112.2	C534 L535 Y536 Q542	C534-R538 WeakPolarHBondContact O-CG 3.46Å; C534-R538 PolarHBondContact O-N 3.34Å; C534-R538 VanDerWaalsContact O-N 3.12Å; L535-R538 PolarHBondContact O-N 3.49Å; L535-R538 VanDerWaalsContact O-N 3.15Å; Y536-R538 VanDerWaalsContact C-N 3.28Å; Y536-R538 PolarHBondContact O-N 3.36Å; R538-Q542 WeakPolarHBondContact O-CG 3.4Å; R538-Q542 PolarHBondContact O-N 3.47Å
539	M	88.8	Confident	87.8	Confident	11 Å²	11	48.7 Å²	48.7	5%	0.054	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-44.9	-179.7	-177.7	-167.6	75.1	0	0	111.5	I483 L535 Y536 E541 Q542 V543 F558	I483-M539 HydrophobicContact CD1-CE 4.36Å; L535-M539 VanDerWaalsContact O-CB 3.3Å; L535-M539 WeakPolarHBondContact O-CB 3.47Å; L535-M539 PolarHBondContact O-N 2.81Å; Y536-M539 HydrophobicContact CD1-CE 4.34Å; Y536-M539 HydrophobicContact CG-CE 4.5Å; Y536-M539 PolarHBondContact O-N 3.26Å; M539-E541 PolarHBondContact O-N 3.09Å; M539-Q542 PolarHBondContact O-N 3.31Å; M539-V543 HydrophobicContact CG-CB 4.44Å; M539-V543 HydrophobicContact CG-CG2 3.63Å; M539-V543 WeakPolarHBondContact O-CB 3.47Å; M539-V543 WeakPolarHBondContact O-CG2 3.46Å; M539-V543 PolarHBondContact O-N 3.49Å; M539-F558 HydrophobicContact CB-CD2 4.14Å; M539-F558 HydrophobicContact CB-CE2 3.64Å; M539-F558 HydrophobicContact CB-CZ 3.86Å; M539-F558 HydrophobicContact CG-CD1 4.04Å; M539-F558 HydrophobicContact CG-CD2 3.94Å; M539-F558 HydrophobicContact CG-CE1 3.89Å; M539-F558 HydrophobicContact CG-CE2 3.76Å; M539-F558 HydrophobicContact CG-CG 4.07Å; M539-F558 HydrophobicContact CG-CZ 3.73Å; M539-F558 HydrophobicContact SD-CD1 3.88Å; M539-F558 HydrophobicContact SD-CE1 3.36Å; M539-F558 WeakPolarHBondContact SD-CE1 3.48Å; M539-F558 HydrophobicContact SD-CE2 4.22Å; M539-F558 HydrophobicContact SD-CZ 3.55Å; M539-F558 VanDerWaalsContact SD-CZ 3.55Å
540	K	89.3	Confident	87.5	Confident	1 Å²	1	49.8 Å²	49.8	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-55	-40.2	-179.5	75.2	-171	172.6	72.4	0	111.9	I483 Y536 F537 Q542 F544 V794 D796 L799	I483-K540 HydrophobicContact CD1-CB 3.79Å; I483-K540 HydrophobicContact CD1-CD 4.5Å; I483-K540 HydrophobicContact CG1-CB 4.26Å; Y536-K540 PolarHBondContact O-N 2.99Å; F537-K540 HydrophobicContact CD1-CD 4.47Å; F537-K540 VanDerWaalsContact CD1-CE 3.5Å; F537-K540 WeakPolarHBondContact O-CE 3.2Å; F537-K540 WeakPolarHBondContact O-CG 3.46Å; K540-Q542 VanDerWaalsContact C-N 3.28Å; K540-Q542 PolarHBondContact O-N 2.89Å; K540-F544 HydrophobicContact CB-CD2 3.94Å; K540-F544 HydrophobicContact CB-CE2 4.18Å; K540-F544 PolarHBondContact O-N 3.4Å; K540-F544 VanDerWaalsContact O-N 3.08Å; K540-V794 PolarHBondContact NZ-O 3.3Å; K540-D796 WeakPolarHBondContact CE-OD1 3.34Å; K540-D796 IonicContact NZ-OD1 2.89Å; K540-D796 PolarHBondContact NZ-OD1 2.88Å; K540-L799 HydrophobicContact CD-CD1 3.39Å
541	E	82.6	Confident	87.1	Confident	66 Å²	66	51.7 Å²	51.7	31%	0.308	26%	0.262	S	S	.	.	H	α-helix	trans	-69.9	-23.1	179.8	-67.4	-59.2	135.8	0	0	113.2	M539 R545	M539-E541 PolarHBondContact O-N 3.09Å; E541-R545 WeakPolarHBondContact O-CG 3.29Å; E541-R545 PolarHBondContact O-NE 3.12Å; E541-R545 PolarHBondContact O-NH2 3.42Å
542	Q	84	Confident	86.7	Confident	89 Å²	89	49.5 Å²	49.5	42%	0.416	26%	0.259	S	S	.	.	H	α-helix	trans	-94.9	-37.4	-179.3	-66.7	175.6	12.2	0	0	111.6	R538 M539 K540 P554	R538-Q542 WeakPolarHBondContact O-CG 3.4Å; R538-Q542 PolarHBondContact O-N 3.47Å; M539-Q542 PolarHBondContact O-N 3.31Å; K540-Q542 VanDerWaalsContact C-N 3.28Å; K540-Q542 PolarHBondContact O-N 2.89Å; Q542-P554 WeakPolarHBondContact O-CB 3.3Å
543	V	86.6	Confident	86.5	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.024	28%	0.277	C	S	.	.	H	α-helix	trans	-88.5	-40.5	-170.6	173.5	0	0	0	0	112.3	M539 R545 L555 F665	M539-V543 HydrophobicContact CG-CB 4.44Å; M539-V543 HydrophobicContact CG-CG2 3.63Å; M539-V543 WeakPolarHBondContact O-CB 3.47Å; M539-V543 WeakPolarHBondContact O-CG2 3.46Å; M539-V543 PolarHBondContact O-N 3.49Å; V543-R545 VanDerWaalsContact C-N 3.29Å; V543-R545 PolarHBondContact O-N 3.37Å; V543-L555 HydrophobicContact CG1-CB 4.06Å; V543-L555 HydrophobicContact CG1-CD1 4.42Å; V543-L555 HydrophobicContact CG2-CB 4.18Å; V543-L555 HydrophobicContact CG2-CD1 4.22Å; V543-F665 HydrophobicContact CG1-CE1 3.85Å; V543-F665 HydrophobicContact CG1-CZ 3.47Å; V543-F665 VanDerWaalsContact CG1-CZ 3.47Å
544	F	86.6	Confident	86.2	Confident	31 Å²	31	53 Å²	53	14%	0.136	29%	0.287	C	S	.	.	S	Bend	trans	-93.6	54.1	-176.5	-54.8	-49.2	0	0	0	111.9	I483 K540 Y550 F665 D792 V794	I483-F544 HydrophobicContact CB-CE2 4.28Å; K540-F544 HydrophobicContact CB-CD2 3.94Å; K540-F544 HydrophobicContact CB-CE2 4.18Å; K540-F544 PolarHBondContact O-N 3.4Å; K540-F544 VanDerWaalsContact O-N 3.08Å; F544-Y550 AromaticContact CD1-CD2 3.9Å; F544-Y550 HydrophobicContact CD1-CD2 3.9Å; F544-Y550 AromaticContact CD1-CE2 3.65Å; F544-Y550 HydrophobicContact CD1-CE2 3.65Å; F544-Y550 HydrophobicContact CE1-CE2 4.37Å; F544-Y550 HydrophobicContact CG-CE2 4.48Å; F544-F665 HydrophobicContact CD1-CZ 4.28Å; F544-F665 HydrophobicContact CE1-CE2 4.09Å; F544-F665 AromaticContact CE1-CZ 3.83Å; F544-F665 HydrophobicContact CE1-CZ 3.83Å; F544-D792 HydrophobicContact CD1-CB 3.74Å; F544-D792 HydrophobicContact CD2-CB 4.09Å; F544-D792 HydrophobicContact CE1-CB 3.79Å; F544-D792 HydrophobicContact CE2-CB 4.16Å; F544-D792 HydrophobicContact CG-CB 3.89Å; F544-D792 HydrophobicContact CZ-CB 4.01Å; F544-V794 HydrophobicContact CB-CG1 3.85Å; F544-V794 HydrophobicContact CD2-CG1 4.1Å; F544-V794 HydrophobicContact CG-CG1 4.46Å
545	R	81.8	Confident	86	Confident	161 Å²	161	52.6 Å²	52.6	61%	0.608	28%	0.284	S	S	*	.			trans	-104.3	131.8	175.1	-67.1	-172.1	178.7	169	9.6	110.9	E541 V543	E541-R545 WeakPolarHBondContact O-CG 3.29Å; E541-R545 PolarHBondContact O-NE 3.12Å; E541-R545 PolarHBondContact O-NH2 3.42Å; V543-R545 VanDerWaalsContact C-N 3.29Å; V543-R545 PolarHBondContact O-N 3.37Å
546	G	81.9	Confident	85.9	Confident	73 Å²	73	54 Å²	54	75%	0.753	29%	0.29	S	S	*	.	S	Bend	trans	96.3	-152.8	177	0	0	0	0	0	113.3
547	S	80.7	Confident	85.9	Confident	99 Å²	99	58.5 Å²	58.5	69%	0.692	31%	0.314	S	S	*	.	S	Bend	trans	-108.4	152.1	-179.3	53.4	0	0	0	0	111.6	P549	S547-P549 CarbonylContact O-C 3.39Å
548	R	84.1	Confident	85.8	Confident	112 Å²	112	58.9 Å²	58.9	42%	0.423	32%	0.316	S	S	.	.	S	Bend	trans	-70.2	142.7	178	-61.2	-176	-167.4	168.1	6.8	111.2	Y550 Y664 D792	R548-Y550 HydrophobicContact CG-CD2 4.43Å; R548-Y550 HydrophobicContact CG-CE1 4.23Å; R548-Y550 HydrophobicContact CG-CE2 3.82Å; R548-Y664 PolarHBondContact NH1-OH 2.94Å; R548-D792 IonicContact CZ-OD1 3.68Å; R548-D792 IonicContact CZ-OD2 2.99Å; R548-D792 IonicContact NE-OD2 3.83Å; R548-D792 PolarHBondContact NE-OD2 2.94Å; R548-D792 IonicContact NH2-OD1 3.59Å; R548-D792 PolarHBondContact NH2-OD1 2.93Å; R548-D792 IonicContact NH2-OD2 2.69Å; R548-D792 PolarHBondContact NH2-OD2 2.69Å
549	P	83.3	Confident	85.8	Confident	73 Å²	73	56.2 Å²	56.2	47%	0.474	31%	0.306	S	S	.	.	S	Bend	cis	-73.1	139.4	-6.7	30.5	-34.1	0	0	0	111.8	S547 Y664	S547-P549 CarbonylContact O-C 3.39Å; P549-Y664 CarbonylContact C-O 3.6Å; P549-Y664 WeakPolarHBondContact CA-O 3.29Å
550	Y	84.9	Confident	86	Confident	24 Å²	24	58 Å²	58	9%	0.094	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-68.7	152.7	-179.5	-58.2	-63.3	0	0	0	112	F544 R548 Y664 F665 D792	F544-Y550 AromaticContact CD1-CD2 3.9Å; F544-Y550 HydrophobicContact CD1-CD2 3.9Å; F544-Y550 AromaticContact CD1-CE2 3.65Å; F544-Y550 HydrophobicContact CD1-CE2 3.65Å; F544-Y550 HydrophobicContact CE1-CE2 4.37Å; F544-Y550 HydrophobicContact CG-CE2 4.48Å; R548-Y550 HydrophobicContact CG-CD2 4.43Å; R548-Y550 HydrophobicContact CG-CE1 4.23Å; R548-Y550 HydrophobicContact CG-CE2 3.82Å; Y550-Y664 WeakPolarHBondContact CD2-O 3.33Å; Y550-Y664 HydrophobicContact CE2-CD1 4.01Å; Y550-Y664 PolarHBondContact N-O 3.11Å; Y550-F665 HydrophobicContact CD2-CE1 4.33Å; Y550-F665 HydrophobicContact CD2-CZ 4.23Å; Y550-D792 HydrophobicContact CE2-CB 4.18Å; Y550-D792 PolarHBondContact OH-OD2 2.69Å
551	E	82.6	Confident	86.1	Confident	153 Å²	153	66.1 Å²	66.1	72%	0.715	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-62.2	137.3	170.5	-67	-175	174.7	0	0	110.2	P554	E551-P554 WeakPolarHBondContact O-CD 3.29Å
552	S	81.9	Confident	86.4	Confident	39 Å²	39	64.2 Å²	64.2	27%	0.273	34%	0.34	S	S	.	.	S	Bend	trans	-82.3	-20	-177.6	66.3	0	0	0	0	113.6	L555 E556 R656	S552-L555 PolarHBondContact O-N 3.15Å; S552-E556 WeakPolarHBondContact CB-OE1 3.32Å; S552-E556 WeakPolarHBondContact O-CG 3.42Å; S552-E556 PolarHBondContact O-N 3.24Å; S552-E556 PolarHBondContact OG-OE1 3.49Å; S552-R656 VanDerWaalsContact CB-NH2 3.35Å
553	A	86.8	Confident	86.6	Confident	47 Å²	47	60.3 Å²	60.3	39%	0.388	32%	0.322	S	S	.	.	H	α-helix	trans	-57	-47	-176.7	0	0	0	0	0	113.4	L555 E556 D557	A553-L555 VanDerWaalsContact C-N 3.33Å; A553-L555 PolarHBondContact O-N 3.2Å; A553-E556 PolarHBondContact O-N 3.26Å; A553-E556 VanDerWaalsContact O-N 3.17Å; A553-D557 WeakPolarHBondContact O-CB 3.43Å; A553-D557 VanDerWaalsContact O-CG 3.31Å; A553-D557 PolarHBondContact O-N 3.19Å
554	P	89	Confident	86.7	Confident	41 Å²	41	61.4 Å²	61.4	27%	0.266	33%	0.333	S	S	.	.	H	α-helix	trans	-59.6	-39.8	178.7	-25.2	35.3	0	0	0	113.8	Q542 E551 F558	Q542-P554 WeakPolarHBondContact O-CB 3.3Å; E551-P554 WeakPolarHBondContact O-CD 3.29Å; P554-F558 WeakPolarHBondContact O-CB 3.33Å; P554-F558 PolarHBondContact O-N 3.41Å
555	L	87.2	Confident	86.9	Confident	8 Å²	8	65.1 Å²	65.1	4%	0.042	35%	0.351	C	S	.	.	H	α-helix	trans	-70.7	-40.6	177.1	179.1	60.9	0	0	0	111.2	V543 S552 A553 F558 L559 F665	V543-L555 HydrophobicContact CG1-CB 4.06Å; V543-L555 HydrophobicContact CG1-CD1 4.42Å; V543-L555 HydrophobicContact CG2-CB 4.18Å; V543-L555 HydrophobicContact CG2-CD1 4.22Å; S552-L555 PolarHBondContact O-N 3.15Å; A553-L555 VanDerWaalsContact C-N 3.33Å; A553-L555 PolarHBondContact O-N 3.2Å; L555-F558 HydrophobicContact CD1-CD1 4.41Å; L555-F558 PolarHBondContact O-N 3.02Å; L555-L559 HydrophobicContact CD1-CD1 4.2Å; L555-L559 HydrophobicContact CD1-CG 4.26Å; L555-L559 HydrophobicContact CG-CD1 4.09Å; L555-L559 WeakPolarHBondContact O-CG 3.4Å; L555-L559 PolarHBondContact O-N 3.4Å; L555-F665 HydrophobicContact CB-CE1 4.45Å; L555-F665 HydrophobicContact CD2-CD1 4.39Å; L555-F665 HydrophobicContact CD2-CE1 4.11Å; L555-F665 HydrophobicContact CD2-CE2 4.26Å; L555-F665 HydrophobicContact CD2-CZ 4.04Å
556	E	89.7	Confident	87.3	Confident	40 Å²	40	63.6 Å²	63.6	19%	0.187	36%	0.355	C	S	.	.	H	α-helix	trans	-65.3	-46.4	177.7	-72	173.6	-146.3	0	0	111.9	S552 A553 F558 L559 K560 W652 R656	S552-E556 WeakPolarHBondContact CB-OE1 3.32Å; S552-E556 WeakPolarHBondContact O-CG 3.42Å; S552-E556 PolarHBondContact O-N 3.24Å; S552-E556 PolarHBondContact OG-OE1 3.49Å; A553-E556 PolarHBondContact O-N 3.26Å; A553-E556 VanDerWaalsContact O-N 3.17Å; E556-F558 VanDerWaalsContact C-N 3.31Å; E556-F558 PolarHBondContact O-N 3.4Å; E556-L559 PolarHBondContact O-N 2.78Å; E556-K560 WeakPolarHBondContact O-CB 2.94Å; E556-K560 VanDerWaalsContact O-CG 3.28Å; E556-K560 WeakPolarHBondContact O-CG 3.49Å; E556-K560 PolarHBondContact O-N 3.18Å; E556-W652 HydrophobicContact CB-CZ3 4.32Å; E556-W652 HydrophobicContact CG-CZ3 4.17Å; E556-R656 HydrophobicContact CG-CG 4.16Å; E556-R656 IonicContact OE1-NE 3.84Å
557	D	90.5	Very high	87.6	Confident	96 Å²	96	61.8 Å²	61.8	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-64.1	-38.5	177.7	-69.1	-19.8	0	0	0	111.4	A553 K560 K561	A553-D557 WeakPolarHBondContact O-CB 3.43Å; A553-D557 VanDerWaalsContact O-CG 3.31Å; A553-D557 PolarHBondContact O-N 3.19Å; D557-K560 PolarHBondContact O-N 3.4Å; D557-K561 VanDerWaalsContact O-CB 3.27Å; D557-K561 WeakPolarHBondContact O-CB 3.5Å; D557-K561 PolarHBondContact O-N 3.03Å
558	F	89.8	Confident	87.9	Confident	12 Å²	12	60.8 Å²	60.8	5%	0.053	31%	0.312	C	S	.	.	H	α-helix	trans	-58.4	-51.5	171	169.6	-92.9	0	0	0	111.5	L535 M539 P554 L555 E556 K560 K561 E562	L535-F558 HydrophobicContact CD1-CE2 3.54Å; L535-F558 HydrophobicContact CD1-CZ 4.05Å; L535-F558 HydrophobicContact CD2-CE2 4.09Å; L535-F558 HydrophobicContact CD2-CZ 3.7Å; L535-F558 HydrophobicContact CG-CE2 3.65Å; L535-F558 HydrophobicContact CG-CZ 3.64Å; M539-F558 HydrophobicContact CB-CD2 4.14Å; M539-F558 HydrophobicContact CB-CE2 3.64Å; M539-F558 HydrophobicContact CB-CZ 3.86Å; M539-F558 HydrophobicContact CG-CD1 4.04Å; M539-F558 HydrophobicContact CG-CD2 3.94Å; M539-F558 HydrophobicContact CG-CE1 3.89Å; M539-F558 HydrophobicContact CG-CE2 3.76Å; M539-F558 HydrophobicContact CG-CG 4.07Å; M539-F558 HydrophobicContact CG-CZ 3.73Å; M539-F558 HydrophobicContact SD-CD1 3.88Å; M539-F558 HydrophobicContact SD-CE1 3.36Å; M539-F558 WeakPolarHBondContact SD-CE1 3.48Å; M539-F558 HydrophobicContact SD-CE2 4.22Å; M539-F558 HydrophobicContact SD-CZ 3.55Å; M539-F558 VanDerWaalsContact SD-CZ 3.55Å; P554-F558 WeakPolarHBondContact O-CB 3.33Å; P554-F558 PolarHBondContact O-N 3.41Å; L555-F558 HydrophobicContact CD1-CD1 4.41Å; L555-F558 PolarHBondContact O-N 3.02Å; E556-F558 VanDerWaalsContact C-N 3.31Å; E556-F558 PolarHBondContact O-N 3.4Å; F558-K560 VanDerWaalsContact C-N 3.35Å; F558-K560 PolarHBondContact O-N 3.37Å; F558-K561 PolarHBondContact O-N 2.92Å; F558-E562 HydrophobicContact CD2-CG 4.26Å; F558-E562 HydrophobicContact CE1-CG 4.38Å; F558-E562 HydrophobicContact CE2-CG 3.97Å; F558-E562 HydrophobicContact CZ-CG 4.02Å; F558-E562 WeakPolarHBondContact O-CB 3.48Å; F558-E562 VanDerWaalsContact O-CG 3.3Å; F558-E562 WeakPolarHBondContact O-CG 3.44Å; F558-E562 PolarHBondContact O-N 3.25Å
559	L	90.6	Very high	87.9	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-39	-179	-66.9	169.4	0	0	0	111.7	I518 L555 E556 E562 F563 W652 A655 R656	I518-L559 HydrophobicContact CD1-CD2 4.4Å; I518-L559 HydrophobicContact CG1-CD2 4.45Å; I518-L559 HydrophobicContact CG2-CD2 4.2Å; L555-L559 HydrophobicContact CD1-CD1 4.2Å; L555-L559 HydrophobicContact CD1-CG 4.26Å; L555-L559 HydrophobicContact CG-CD1 4.09Å; L555-L559 WeakPolarHBondContact O-CG 3.4Å; L555-L559 PolarHBondContact O-N 3.4Å; E556-L559 PolarHBondContact O-N 2.78Å; L559-E562 PolarHBondContact O-N 2.8Å; L559-F563 HydrophobicContact CB-CD2 4.33Å; L559-F563 HydrophobicContact CD2-CD2 3.98Å; L559-F563 HydrophobicContact CD2-CE2 3.61Å; L559-F563 WeakPolarHBondContact O-CB 3.41Å; L559-F563 WeakPolarHBondContact O-CD2 3.39Å; L559-F563 PolarHBondContact O-N 2.96Å; L559-W652 HydrophobicContact CB-CB 3.93Å; L559-A655 HydrophobicContact CD1-CB 4.23Å; L559-A655 HydrophobicContact CD2-CB 3.94Å; L559-R656 HydrophobicContact CD1-CB 3.66Å; L559-R656 HydrophobicContact CD1-CG 4.5Å
560	K	91.8	Very high	87.9	Confident	50 Å²	50	54.8 Å²	54.8	22%	0.217	29%	0.287	C	S	.	.	H	α-helix	trans	-63.8	-44.3	175	-73.1	174.1	-176.6	-177.8	0	112	E556 D557 F558 E562 G564 E565 W652	E556-K560 WeakPolarHBondContact O-CB 2.94Å; E556-K560 VanDerWaalsContact O-CG 3.28Å; E556-K560 WeakPolarHBondContact O-CG 3.49Å; E556-K560 PolarHBondContact O-N 3.18Å; D557-K560 PolarHBondContact O-N 3.4Å; F558-K560 VanDerWaalsContact C-N 3.35Å; F558-K560 PolarHBondContact O-N 3.37Å; K560-E562 VanDerWaalsContact C-N 3.31Å; K560-E562 PolarHBondContact O-N 2.76Å; K560-G564 CarbonylContact O-C 3.56Å; K560-G564 WeakPolarHBondContact O-CA 3.34Å; K560-G564 PolarHBondContact O-N 3.09Å; K560-E565 HydrophobicContact CD-CG 4.45Å; K560-E565 IonicContact NZ-OE1 2.78Å; K560-W652 HydrophobicContact CG-CD2 3.76Å; K560-W652 HydrophobicContact CG-CE3 4.11Å; K560-W652 HydrophobicContact CG-CG 3.99Å; K560-W652 HydrophobicContact CG-CZ2 4.42Å
561	K	91.3	Very high	87.9	Confident	170 Å²	170	58.3 Å²	58.3	74%	0.739	31%	0.308	S	S	*	.	H	α-helix	trans	-62.2	-41.2	177	-178.7	179.7	177.1	-178.8	0	111.4	D557 F558	D557-K561 VanDerWaalsContact O-CB 3.27Å; D557-K561 WeakPolarHBondContact O-CB 3.5Å; D557-K561 PolarHBondContact O-N 3.03Å; F558-K561 PolarHBondContact O-N 2.92Å
562	E	89.8	Confident	87.9	Confident	26 Å²	26	52.4 Å²	52.4	12%	0.121	28%	0.28	C	S	.	.	H	α-helix	trans	-82	-39.2	-174	-70.3	-59.9	139.7	0	0	113.3	K527 Y531 L535 F558 L559 K560	K527-E562 WeakPolarHBondContact CE-O 3.3Å; K527-E562 VanDerWaalsContact NZ-C 3.35Å; K527-E562 PolarHBondContact NZ-O 2.84Å; K527-E562 IonicContact NZ-OE2 3.9Å; K527-E562 PolarHBondContact NZ-OE2 3.47Å; Y531-E562 PolarHBondContact OH-OE1 2.91Å; Y531-E562 VanDerWaalsContact OH-OE1 3.13Å; Y531-E562 PolarHBondContact OH-OE2 3.27Å; L535-E562 HydrophobicContact CD1-CG 4.21Å; L535-E562 WeakPolarHBondContact CD1-OE1 3.4Å; L535-E562 HydrophobicContact CD2-CG 3.94Å; L535-E562 WeakPolarHBondContact CD2-OE2 3.49Å; F558-E562 HydrophobicContact CD2-CG 4.26Å; F558-E562 HydrophobicContact CE1-CG 4.38Å; F558-E562 HydrophobicContact CE2-CG 3.97Å; F558-E562 HydrophobicContact CZ-CG 4.02Å; F558-E562 WeakPolarHBondContact O-CB 3.48Å; F558-E562 VanDerWaalsContact O-CG 3.3Å; F558-E562 WeakPolarHBondContact O-CG 3.44Å; F558-E562 PolarHBondContact O-N 3.25Å; L559-E562 PolarHBondContact O-N 2.8Å; K560-E562 VanDerWaalsContact C-N 3.31Å; K560-E562 PolarHBondContact O-N 2.76Å
563	F	88.8	Confident	87.8	Confident	8 Å²	8	61 Å²	61	4%	0.035	31%	0.307	C	S	.	.	H	α-helix	trans	-102.5	-10.1	-176.5	-62.6	-63.9	0	0	0	114	I518 L521 A522 H525 L559 T567 I651 A655	I518-F563 HydrophobicContact CG2-CE2 4.08Å; I518-F563 HydrophobicContact CG2-CZ 4.05Å; L521-F563 HydrophobicContact CB-CE1 3.99Å; L521-F563 HydrophobicContact CB-CZ 4.16Å; A522-F563 HydrophobicContact CB-CE1 4.08Å; A522-F563 HydrophobicContact CB-CZ 4.21Å; H525-F563 AromaticContact CD2-CD1 3.67Å; H525-F563 AromaticContact NE2-CD1 3.85Å; L559-F563 HydrophobicContact CB-CD2 4.33Å; L559-F563 HydrophobicContact CD2-CD2 3.98Å; L559-F563 HydrophobicContact CD2-CE2 3.61Å; L559-F563 WeakPolarHBondContact O-CB 3.41Å; L559-F563 WeakPolarHBondContact O-CD2 3.39Å; L559-F563 PolarHBondContact O-N 2.96Å; F563-T567 VanDerWaalsContact O-CB 3.25Å; F563-T567 WeakPolarHBondContact O-CB 3.38Å; F563-T567 PolarHBondContact O-OG1 3.49Å; F563-I651 HydrophobicContact CB-CB 4.42Å; F563-I651 HydrophobicContact CB-CG2 3.88Å; F563-I651 HydrophobicContact CD1-CG2 4.02Å; F563-I651 HydrophobicContact CG-CG2 3.89Å; F563-A655 HydrophobicContact CE2-CB 4.37Å
564	G	88.4	Confident	87.7	Confident	26 Å²	26	62.3 Å²	62.3	27%	0.268	30%	0.304	S	S	.	.			trans	85.5	140.1	-171.5	0	0	0	0	0	111.9	K560 N566	K560-G564 CarbonylContact O-C 3.56Å; K560-G564 WeakPolarHBondContact O-CA 3.34Å; K560-G564 PolarHBondContact O-N 3.09Å; G564-N566 VanDerWaalsContact C-N 3.33Å; G564-N566 PolarHBondContact O-N 3.31Å
565	E	90.5	Very high	87.7	Confident	109 Å²	109	60.4 Å²	60.4	51%	0.509	29%	0.291	S	S	.	.	S	Bend	trans	-68.1	-33.1	-176.1	-175.3	164.8	-149	0	0	113.1	K560 W652	K560-E565 HydrophobicContact CD-CG 4.45Å; K560-E565 IonicContact NZ-OE1 2.78Å; E565-W652 PolarHBondContact O-NE1 3.35Å
566	N	88.8	Confident	87.9	Confident	130 Å²	130	63 Å²	63	70%	0.695	30%	0.3	S	S	*	.	S	Bend	trans	-109.9	4.4	-173.5	-63.9	-39	0	0	0	113.9	G564 K568	G564-N566 VanDerWaalsContact C-N 3.33Å; G564-N566 PolarHBondContact O-N 3.31Å; N566-K568 PolarHBondContact O-N 2.87Å
567	T	88.8	Confident	88.1	Confident	34 Å²	34	61 Å²	61	21%	0.209	29%	0.292	C	S	.	.			trans	-72.7	126.2	-177.6	-42.4	0	0	0	0	110.5	F563 L650 I651	F563-T567 VanDerWaalsContact O-CB 3.25Å; F563-T567 WeakPolarHBondContact O-CB 3.38Å; F563-T567 PolarHBondContact O-OG1 3.49Å; T567-L650 WeakPolarHBondContact O-CA 3.22Å; T567-I651 HydrophobicContact CG2-CD1 3.58Å; T567-I651 HydrophobicContact CG2-CG1 4.41Å; T567-I651 PolarHBondContact O-N 3.17Å
568	K	88.4	Confident	88.3	Confident	78 Å²	78	56.7 Å²	56.7	34%	0.339	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-96.5	151.3	-178.9	-57.9	179.5	172.3	-168.6	0	111.3	N566 T570 D571 E647 Q649 L650	N566-K568 PolarHBondContact O-N 2.87Å; K568-T570 PolarHBondContact O-N 2.9Å; K568-D571 PolarHBondContact N-OD2 2.97Å; K568-D571 WeakPolarHBondContact O-CB 3.49Å; K568-D571 PolarHBondContact O-N 3.45Å; K568-D571 VanDerWaalsContact O-N 3.1Å; K568-E647 WeakPolarHBondContact CD-O 3.5Å; K568-Q649 CarbonylContact C-O 3.55Å; K568-Q649 VanDerWaalsContact CA-O 3.3Å; K568-Q649 WeakPolarHBondContact CA-O 3.26Å; K568-L650 HydrophobicContact CG-CD2 4.23Å
569	M	83.7	Confident	88.5	Confident	4 Å²	4	56.1 Å²	56.1	2%	0.02	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-57.4	-37.6	175.4	-71.8	-71.8	-70.6	0	0	111.7	L521 D571 I572 F594 N596 Q649 I651 A654	L521-M569 HydrophobicContact CD2-CE 4.02Å; L521-M569 HydrophobicContact CD2-SD 3.68Å; M569-D571 VanDerWaalsContact C-N 3.25Å; M569-D571 PolarHBondContact O-N 2.71Å; M569-I572 PolarHBondContact O-N 3.48Å; M569-F594 HydrophobicContact CE-CB 4.35Å; M569-N596 WeakPolarHBondContact O-CB 3.41Å; M569-Q649 HydrophobicContact CB-CB 4.37Å; M569-Q649 HydrophobicContact CG-CB 4.06Å; M569-Q649 PolarHBondContact N-O 3.09Å; M569-I651 HydrophobicContact CG-CG1 4.21Å; M569-I651 HydrophobicContact SD-CB 4.44Å; M569-I651 HydrophobicContact SD-CG1 3.85Å; M569-A654 HydrophobicContact SD-CB 4.3Å
570	T	82.8	Confident	88.7	Confident	56 Å²	56	56.3 Å²	56.3	34%	0.344	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-71.3	-15.3	179.6	51.3	0	0	0	0	114.4	K568 I572	K568-T570 PolarHBondContact O-N 2.9Å; T570-I572 PolarHBondContact O-N 3.29Å
571	D	85.3	Confident	88.7	Confident	98 Å²	98	53.9 Å²	53.9	52%	0.524	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-66.5	-21.2	179.6	-62.7	-20.4	0	0	0	111.1	K568 M569	K568-D571 PolarHBondContact N-OD2 2.97Å; K568-D571 WeakPolarHBondContact O-CB 3.49Å; K568-D571 PolarHBondContact O-N 3.45Å; K568-D571 VanDerWaalsContact O-N 3.1Å; M569-D571 VanDerWaalsContact C-N 3.25Å; M569-D571 PolarHBondContact O-N 2.71Å
572	I	81.3	Confident	88.6	Confident	28 Å²	28	46.2 Å²	46.2	14%	0.144	22%	0.224	C	C	.	.			trans	-116.4	119.2	-178.5	-39.6	172	0	0	0	111.3	I524 M569 T570 N596 I651	I524-I572 HydrophobicContact CB-CD1 4.26Å; I524-I572 HydrophobicContact CG2-CB 3.62Å; I524-I572 HydrophobicContact CG2-CD1 3.43Å; I524-I572 VanDerWaalsContact CG2-CD1 3.43Å; I524-I572 HydrophobicContact CG2-CG1 4.07Å; I524-I572 HydrophobicContact CG2-CG2 3.07Å; M569-I572 PolarHBondContact O-N 3.48Å; T570-I572 PolarHBondContact O-N 3.29Å; I572-N596 WeakPolarHBondContact O-CB 3.2Å; I572-N596 PolarHBondContact O-ND2 3.05Å; I572-I651 HydrophobicContact CD1-CD1 3.87Å
573	R	80.1	Confident	88.3	Confident	221 Å²	221	45.5 Å²	45.5	83%	0.834	22%	0.221	S	C	*	.			trans	-95.3	-19.3	-172.8	-58.6	-174.4	-172.6	-175.5	3	115.1
574	F	84.4	Confident	88	Confident	74 Å²	74	47.1 Å²	47.1	33%	0.325	24%	0.235	S	C	.	.	S	Bend	trans	-151.2	142	-176.2	-174.2	-92.1	0	0	0	110.8	R504 D508	R504-F574 VanDerWaalsContact CZ-O 3.28Å; R504-F574 PolarHBondContact NH1-O 2.77Å; R504-F574 PolarHBondContact NH2-O 2.97Å; D508-F574 HydrophobicContact CB-CE2 4.4Å
575	P	89	Confident	87.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.231	C	C	.	.	S	Bend	cis	-64.2	165.5	-10.3	28.5	-35.6	0	0	0	111.9	R504 V510 I524 V577 N596	R504-P575 HydrophobicContact CG-CG 4.4Å; V510-P575 HydrophobicContact CG2-CB 4.28Å; V510-P575 HydrophobicContact CG2-CG 4.06Å; I524-P575 HydrophobicContact CG1-CG 4.42Å; P575-V577 HydrophobicContact CG-CG2 4.42Å; P575-N596 PolarHBondContact O-ND2 2.95Å
576	R	92.6	Very high	86.3	Confident	62 Å²	62	46.4 Å²	46.4	23%	0.234	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	128.4	175.7	-67	-178.9	-167	122.9	-3.1	109.1	D473 D508 W509 V510 N596 Y597	D473-R576 IonicContact OD2-NH1 3.61Å; D508-R576 PolarHBondContact O-N 3Å; W509-R576 CarbonylContact C-O 3.53Å; W509-R576 VanDerWaalsContact CA-O 3.31Å; W509-R576 WeakPolarHBondContact CA-O 3.42Å; W509-R576 HydrophobicContact CD2-CB 3.84Å; W509-R576 VanDerWaalsContact CE2-NH1 3.35Å; W509-R576 HydrophobicContact CE3-CB 3.33Å; W509-R576 HydrophobicContact CE3-CG 4.24Å; W509-R576 HydrophobicContact CH2-CB 4.26Å; W509-R576 HydrophobicContact CH2-CG 4.38Å; W509-R576 HydrophobicContact CZ3-CB 3.56Å; W509-R576 VanDerWaalsContact CZ3-CD 3.41Å; W509-R576 HydrophobicContact CZ3-CG 4.14Å; V510-R576 PolarHBondContact N-O 2.87Å; R576-N596 WeakPolarHBondContact CA-OD1 3.4Å; R576-Y597 HydrophobicContact CB-CD1 3.87Å; R576-Y597 HydrophobicContact CB-CE1 4.32Å; R576-Y597 HydrophobicContact CG-CD1 4.26Å
577	V	94	Very high	85.6	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	142.1	-173.1	176.3	0	0	0	0	113.4	V510 A520 L521 I524 P575 V579 R595 N596	V510-V577 HydrophobicContact CB-CG2 3.9Å; V510-V577 HydrophobicContact CG2-CG2 4.5Å; V510-V577 CarbonylContact O-C 3.57Å; V510-V577 WeakPolarHBondContact O-CA 3.47Å; A520-V577 HydrophobicContact CB-CG1 4.07Å; L521-V577 HydrophobicContact CD2-CG1 4.34Å; I524-V577 HydrophobicContact CD1-CB 3.43Å; I524-V577 VanDerWaalsContact CD1-CB 3.43Å; I524-V577 HydrophobicContact CD1-CG1 3.76Å; I524-V577 HydrophobicContact CD1-CG2 3.1Å; I524-V577 HydrophobicContact CG1-CB 4.2Å; I524-V577 HydrophobicContact CG1-CG2 3.29Å; P575-V577 HydrophobicContact CG-CG2 4.42Å; V577-V579 HydrophobicContact CG1-CG2 4.03Å; V577-R595 WeakPolarHBondContact O-CA 3.41Å; V577-N596 PolarHBondContact N-OD1 3.3Å
578	M	93.8	Very high	85.1	Confident	4 Å²	4	50 Å²	50	2%	0.02	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122.5	178.3	-53.4	-179.1	-171.2	0	0	109	W509 V510 A511 G512 I593 F594 Y597 A685 E688 I689	W509-M578 HydrophobicContact CD2-CE 4.28Å; W509-M578 HydrophobicContact CE3-CE 3.27Å; W509-M578 HydrophobicContact CH2-CE 4.32Å; W509-M578 HydrophobicContact CZ3-CE 3.31Å; V510-M578 PolarHBondContact O-N 2.96Å; A511-M578 CarbonylContact C-O 3.33Å; A511-M578 VanDerWaalsContact CA-O 3.3Å; A511-M578 WeakPolarHBondContact CA-O 3.32Å; A511-M578 HydrophobicContact CB-CB 4.13Å; G512-M578 PolarHBondContact N-O 3.34Å; M578-I593 HydrophobicContact CB-CG2 3.76Å; M578-I593 HydrophobicContact CG-CG2 4.25Å; M578-F594 CarbonylContact C-O 3.55Å; M578-F594 WeakPolarHBondContact CA-O 3.39Å; M578-Y597 HydrophobicContact CE-CE1 4.25Å; M578-Y597 WeakPolarHBondContact CE-OH 3.39Å; M578-Y597 HydrophobicContact CG-CE1 3.98Å; M578-Y597 WeakPolarHBondContact CG-OH 3.4Å; M578-A685 HydrophobicContact SD-CB 3.98Å; M578-E688 HydrophobicContact CE-CB 4.02Å; M578-E688 HydrophobicContact CE-CG 3.61Å; M578-E688 HydrophobicContact SD-CB 3.9Å; M578-E688 HydrophobicContact SD-CG 3.69Å; M578-I689 HydrophobicContact CE-CD1 4.33Å; M578-I689 HydrophobicContact CE-CG1 3.61Å
579	V	94.8	Very high	84.8	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	123.5	173.9	177.9	0	0	0	0	109.7	G512 L521 V577 I593 F594 S658	G512-V579 WeakPolarHBondContact O-CA 3.4Å; L521-V579 HydrophobicContact CD1-CG2 4.14Å; L521-V579 HydrophobicContact CD2-CG2 4.1Å; L521-V579 HydrophobicContact CG-CG2 3.95Å; V577-V579 HydrophobicContact CG1-CG2 4.03Å; V579-I593 WeakPolarHBondContact O-CA 3.46Å; V579-F594 HydrophobicContact CB-CB 4.2Å; V579-F594 PolarHBondContact N-O 3.47Å; V579-F594 PolarHBondContact O-N 3.06Å; V579-S658 WeakPolarHBondContact CG1-OG 3.11Å
580	T	94.1	Very high	84.8	Confident	4 Å²	4	50.9 Å²	50.9	3%	0.025	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	146.4	-174.7	66.4	0	0	0	0	112.2	G512 T513 H592 S658 A678 P681	G512-T580 PolarHBondContact O-N 3.41Å; G512-T580 VanDerWaalsContact O-N 3.11Å; T513-T580 WeakPolarHBondContact CA-OG1 3.27Å; T513-T580 VanDerWaalsContact CB-OG1 3.26Å; T513-T580 WeakPolarHBondContact CB-OG1 3.27Å; T513-T580 WeakPolarHBondContact CG2-OG1 3.45Å; T513-T580 PolarHBondContact OG1-OG1 3.04Å; T580-H592 CarbonylContact C-O 3.46Å; T580-S658 WeakPolarHBondContact O-CB 3.45Å; T580-S658 PolarHBondContact O-OG 3.13Å; T580-A678 HydrophobicContact CG2-CB 4.15Å; T580-P681 HydrophobicContact CG2-CB 3.95Å
581	S	91.8	Very high	85	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	158.2	173.1	179.1	0	0	0	0	110	H592 S657 F671 L672	S581-H592 PolarHBondContact N-O 3.39Å; S581-H592 PolarHBondContact O-N 3.43Å; S581-S657 PolarHBondContact OG-O 2.94Å; S581-F671 WeakPolarHBondContact OG-CB 3.46Å; S581-L672 PolarHBondContact OG-O 3.17Å
582	V	89.9	Confident	85.2	Confident	9 Å²	9	47.6 Å²	47.6	6%	0.055	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.8	177.9	179.8	0	0	0	0	110.6	A584 F671 L672 D673 L676 L677	V582-A584 PolarHBondContact O-N 3.07Å; V582-F671 WeakPolarHBondContact O-CA 3.29Å; V582-L672 HydrophobicContact CB-CB 4.3Å; V582-L672 PolarHBondContact N-O 3.16Å; V582-L672 PolarHBondContact O-N 2.87Å; V582-D673 WeakPolarHBondContact CG2-O 3.48Å; V582-L676 HydrophobicContact CG2-CB 4.04Å; V582-L677 HydrophobicContact CB-CD1 4.41Å; V582-L677 HydrophobicContact CG1-CD1 3.93Å; V582-L677 HydrophobicContact CG1-CG 4.36Å; V582-L677 HydrophobicContact CG2-CB 3.89Å; V582-L677 HydrophobicContact CG2-CD1 3.77Å; V582-L677 HydrophobicContact CG2-CG 3.67Å
583	L	82.9	Confident	85.5	Confident	11 Å²	11	47.3 Å²	47.3	6%	0.058	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	107	168.9	-71.9	166.4	0	0	0	109.4	G589 E590 H592 R670 F671	L583-G589 WeakPolarHBondContact O-CA 3.43Å; L583-E590 HydrophobicContact CB-CB 4.43Å; L583-E590 WeakPolarHBondContact CB-O 3.26Å; L583-E590 HydrophobicContact CD1-CB 4.41Å; L583-E590 PolarHBondContact N-O 3.42Å; L583-E590 PolarHBondContact O-N 3.29Å; L583-H592 HydrophobicContact CD1-CB 3.92Å; L583-H592 HydrophobicContact CD2-CB 4.48Å; L583-H592 HydrophobicContact CG-CB 3.83Å; L583-R670 HydrophobicContact CD2-CG 4.04Å; L583-F671 HydrophobicContact CD2-CD1 3.81Å; L583-F671 HydrophobicContact CD2-CE1 3.37Å; L583-F671 HydrophobicContact CD2-CZ 4.07Å; L583-F671 HydrophobicContact CG-CE1 4.23Å
584	A	81.9	Confident	86	Confident	41 Å²	41	37.4 Å²	37.4	34%	0.339	19%	0.192	S	C	.	.			trans	-100.4	5	-178.7	0	0	0	0	0	113.4	V582 R586 R670 L672	V582-A584 PolarHBondContact O-N 3.07Å; A584-R586 PolarHBondContact O-N 3.05Å; A584-R670 PolarHBondContact N-O 2.93Å; A584-L672 HydrophobicContact CB-CD1 3.48Å; A584-L672 VanDerWaalsContact CB-CD1 3.48Å; A584-L672 HydrophobicContact CB-CG 3.61Å
585	D	72.6	Confident	86.2	Confident	32 Å²	32	35.4 Å²	35.4	17%	0.171	18%	0.183	C	C	.	.	S	Bend	trans	-75.1	0.5	173.4	63.3	-7.7	0	0	0	113.9	F614 R670	D585-F614 HydrophobicContact CB-CD1 4.08Å; D585-F614 HydrophobicContact CB-CD2 4.14Å; D585-F614 HydrophobicContact CB-CE1 4.28Å; D585-F614 HydrophobicContact CB-CE2 4.35Å; D585-F614 HydrophobicContact CB-CG 4.01Å; D585-F614 HydrophobicContact CB-CZ 4.41Å; D585-F614 VanDerWaalsContact O-CD2 3.29Å; D585-F614 WeakPolarHBondContact O-CD2 3.33Å; D585-R670 HydrophobicContact CB-CB 3.78Å; D585-R670 WeakPolarHBondContact OD2-CD 3.42Å
586	R	70.5	Confident	86.2	Confident	88 Å²	88	36.2 Å²	36.2	33%	0.332	19%	0.187	S	C	.	.	S	Bend	trans	-145.2	158.4	-172.9	64.3	-167.3	71.7	-172	6	111.5	A584 P588 E590	A584-R586 PolarHBondContact O-N 3.05Å; R586-P588 WeakPolarHBondContact CG-O 3.46Å; R586-E590 VanDerWaalsContact CD-CD 3.43Å; R586-E590 WeakPolarHBondContact CD-OE2 3.32Å; R586-E590 IonicContact CZ-OE2 3.9Å; R586-E590 IonicContact NE-OE2 2.71Å; R586-E590 IonicContact NH1-OE1 3.81Å; R586-E590 IonicContact NH1-OE2 3.69Å; R586-E590 PolarHBondContact NH1-OE2 2.74Å
587	H	75.6	Confident	85.9	Confident	185 Å²	185	34.4 Å²	34.4	86%	0.856	18%	0.18	S	C	*	.	S	Bend	trans	-131	123.6	172.9	-175	76.3	0	0	0	109.3
588	P	78.4	Confident	85.3	Confident	54 Å²	54	40.3 Å²	40.3	35%	0.351	21%	0.212	S	C	.	.	S	Bend	cis	-66.4	150.3	-0.9	29.2	-35	0	0	0	112.6	R586 Y608	R586-P588 WeakPolarHBondContact CG-O 3.46Å; P588-Y608 HydrophobicContact CG-CD2 4.48Å; P588-Y608 HydrophobicContact CG-CE1 4Å; P588-Y608 HydrophobicContact CG-CE2 3.97Å
589	G	80.9	Confident	84.5	Confident	36 Å²	36	42.9 Å²	42.9	37%	0.371	23%	0.229	S	C	.	.			trans	-65.6	145.4	175.5	0	0	0	0	0	111.1	L583	L583-G589 WeakPolarHBondContact O-CA 3.43Å
590	E	84.1	Confident	83.7	Confident	66 Å²	66	44.1 Å²	44.1	31%	0.308	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	146.8	-175.8	-70.8	173.9	-177.1	0	0	111.4	L583 R586	L583-E590 HydrophobicContact CB-CB 4.43Å; L583-E590 WeakPolarHBondContact CB-O 3.26Å; L583-E590 HydrophobicContact CD1-CB 4.41Å; L583-E590 PolarHBondContact N-O 3.42Å; L583-E590 PolarHBondContact O-N 3.29Å; R586-E590 VanDerWaalsContact CD-CD 3.43Å; R586-E590 WeakPolarHBondContact CD-OE2 3.32Å; R586-E590 IonicContact CZ-OE2 3.9Å; R586-E590 IonicContact NE-OE2 2.71Å; R586-E590 IonicContact NH1-OE1 3.81Å; R586-E590 IonicContact NH1-OE2 3.69Å; R586-E590 PolarHBondContact NH1-OE2 2.74Å
591	L	87.3	Confident	82.5	Confident	55 Å²	55	47.4 Å²	47.4	29%	0.288	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	129.3	172	-176.8	68.1	0	0	0	110.2	L677 A678 D684	L591-L677 HydrophobicContact CB-CD1 4.27Å; L591-L677 HydrophobicContact CD1-CB 4.36Å; L591-A678 HydrophobicContact CD1-CB 3.8Å; L591-A678 HydrophobicContact CD2-CB 4.22Å; L591-D684 HydrophobicContact CD2-CB 4.07Å; L591-D684 WeakPolarHBondContact CD2-OD1 3.41Å
592	H	88.4	Confident	81	Confident	30 Å²	30	50 Å²	50	14%	0.139	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137.7	169.9	-174.5	72.9	0	0	0	110.3	T580 S581 L583 F594 F671	T580-H592 CarbonylContact C-O 3.46Å; S581-H592 PolarHBondContact N-O 3.39Å; S581-H592 PolarHBondContact O-N 3.43Å; L583-H592 HydrophobicContact CD1-CB 3.92Å; L583-H592 HydrophobicContact CD2-CB 4.48Å; L583-H592 HydrophobicContact CG-CB 3.83Å; H592-F594 AromaticContact CD2-CD1 3.97Å; H592-F594 AromaticContact CD2-CD2 3.94Å; H592-F594 AromaticContact CD2-CE1 3.81Å; H592-F594 AromaticContact CD2-CE2 3.79Å; H592-F594 AromaticContact CD2-CZ 3.73Å; H592-F594 AromaticContact NE2-CD1 3.71Å; H592-F594 AromaticContact NE2-CE1 3.66Å; H592-F671 HydrophobicContact CB-CE1 4.23Å; H592-F671 AromaticContact CD2-CE1 3.57Å; H592-F671 AromaticContact CG-CE1 3.92Å
593	I	89.1	Confident	79.1	Confident	22 Å²	22	61.1 Å²	61.1	11%	0.113	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	111.7	176.2	-58	176.7	0	0	0	107.7	M578 V579 E688	M578-I593 HydrophobicContact CB-CG2 3.76Å; M578-I593 HydrophobicContact CG-CG2 4.25Å; V579-I593 WeakPolarHBondContact O-CA 3.46Å; I593-E688 HydrophobicContact CD1-CB 4.35Å; I593-E688 HydrophobicContact CD1-CG 4.35Å
594	F	90.7	Very high	77.8	Confident	12 Å²	12	69.3 Å²	69.3	5%	0.053	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	134.5	165.5	-64.6	-79.4	0	0	0	108.7	M569 M578 V579 H592 A654 F671	M569-F594 HydrophobicContact CE-CB 4.35Å; M578-F594 CarbonylContact C-O 3.55Å; M578-F594 WeakPolarHBondContact CA-O 3.39Å; V579-F594 HydrophobicContact CB-CB 4.2Å; V579-F594 PolarHBondContact N-O 3.47Å; V579-F594 PolarHBondContact O-N 3.06Å; H592-F594 AromaticContact CD2-CD1 3.97Å; H592-F594 AromaticContact CD2-CD2 3.94Å; H592-F594 AromaticContact CD2-CE1 3.81Å; H592-F594 AromaticContact CD2-CE2 3.79Å; H592-F594 AromaticContact CD2-CZ 3.73Å; H592-F594 AromaticContact NE2-CD1 3.71Å; H592-F594 AromaticContact NE2-CE1 3.66Å; F594-A654 HydrophobicContact CB-CB 3.94Å; F594-A654 HydrophobicContact CD1-CB 3.83Å; F594-A654 HydrophobicContact CD2-CB 4.05Å; F594-A654 HydrophobicContact CE1-CB 4.31Å; F594-A654 HydrophobicContact CG-CB 3.68Å; F594-F671 HydrophobicContact CE1-CE1 4.42Å; F594-F671 HydrophobicContact CE1-CE2 4.48Å; F594-F671 HydrophobicContact CE1-CZ 4.09Å; F594-F671 HydrophobicContact CE2-CD1 4.32Å; F594-F671 HydrophobicContact CE2-CE1 4.28Å; F594-F671 AromaticContact CZ-CD1 3.99Å; F594-F671 HydrophobicContact CZ-CD1 3.99Å; F594-F671 HydrophobicContact CZ-CD2 4.24Å; F594-F671 AromaticContact CZ-CE1 3.67Å; F594-F671 HydrophobicContact CZ-CE1 3.67Å; F594-F671 AromaticContact CZ-CE2 3.95Å; F594-F671 HydrophobicContact CZ-CE2 3.95Å; F594-F671 HydrophobicContact CZ-CG 4.25Å; F594-F671 AromaticContact CZ-CZ 3.65Å; F594-F671 HydrophobicContact CZ-CZ 3.65Å
595	R	87.9	Confident	76.4	Confident	33 Å²	33	75.9 Å²	75.9	13%	0.125	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152	-170.9	53	-170.8	130.8	68	10.4	112	V577 Y597 P599 D646	V577-R595 WeakPolarHBondContact O-CA 3.41Å; R595-Y597 HydrophobicContact CB-CD1 4.06Å; R595-Y597 HydrophobicContact CB-CE1 3.68Å; R595-Y597 HydrophobicContact CB-CE2 4.32Å; R595-Y597 WeakPolarHBondContact CD-O 3.38Å; R595-Y597 WeakPolarHBondContact CG-O 3.47Å; R595-P599 VanDerWaalsContact NH1-CB 3.27Å; R595-P599 VanDerWaalsContact NH1-CD 3.33Å; R595-D646 IonicContact CZ-OD2 3.2Å; R595-D646 IonicContact NH1-OD1 3.84Å; R595-D646 IonicContact NH1-OD2 3.02Å; R595-D646 PolarHBondContact NH1-OD2 2.7Å; R595-D646 IonicContact NH2-OD2 3.53Å
596	N	88.9	Confident	75.5	Confident	16 Å²	16	80 Å²	80	9%	0.086	40%	0.399	C	S	.	.	S	Bend	trans	-99.5	10.1	174.2	70.1	-26.1	0	0	0	113.5	M569 I572 P575 R576 V577	M569-N596 WeakPolarHBondContact O-CB 3.41Å; I572-N596 WeakPolarHBondContact O-CB 3.2Å; I572-N596 PolarHBondContact O-ND2 3.05Å; P575-N596 PolarHBondContact O-ND2 2.95Å; R576-N596 WeakPolarHBondContact CA-OD1 3.4Å; V577-N596 PolarHBondContact N-OD1 3.3Å
597	Y	85.9	Confident	74.7	Confident	24 Å²	24	80.3 Å²	80.3	9%	0.094	41%	0.414	C	S	.	.	S	Bend	trans	-131.4	161.7	179.8	60.4	-91.2	0	0	0	109.9	W509 R576 M578 R595 E688 F692	W509-Y597 HydrophobicContact CE3-CE1 4.31Å; W509-Y597 AromaticContact CZ3-CD1 3.99Å; W509-Y597 HydrophobicContact CZ3-CD1 3.99Å; W509-Y597 AromaticContact CZ3-CE1 3.59Å; W509-Y597 HydrophobicContact CZ3-CE1 3.59Å; W509-Y597 HydrophobicContact CZ3-CE2 4.18Å; W509-Y597 HydrophobicContact CZ3-CG 4.47Å; W509-Y597 AromaticContact CZ3-CZ 3.72Å; R576-Y597 HydrophobicContact CB-CD1 3.87Å; R576-Y597 HydrophobicContact CB-CE1 4.32Å; R576-Y597 HydrophobicContact CG-CD1 4.26Å; M578-Y597 HydrophobicContact CE-CE1 4.25Å; M578-Y597 WeakPolarHBondContact CE-OH 3.39Å; M578-Y597 HydrophobicContact CG-CE1 3.98Å; M578-Y597 WeakPolarHBondContact CG-OH 3.4Å; R595-Y597 HydrophobicContact CB-CD1 4.06Å; R595-Y597 HydrophobicContact CB-CE1 3.68Å; R595-Y597 HydrophobicContact CB-CE2 4.32Å; R595-Y597 WeakPolarHBondContact CD-O 3.38Å; R595-Y597 WeakPolarHBondContact CG-O 3.47Å; Y597-E688 WeakPolarHBondContact OH-CG 3.21Å; Y597-E688 PolarHBondContact OH-OE1 2.99Å; Y597-F692 AromaticContact CD2-CD2 3.84Å; Y597-F692 HydrophobicContact CD2-CD2 3.84Å; Y597-F692 AromaticContact CD2-CE2 3.81Å; Y597-F692 HydrophobicContact CD2-CE2 3.81Å; Y597-F692 HydrophobicContact CE2-CD2 4.05Å; Y597-F692 HydrophobicContact CE2-CE2 4.47Å
598	D	80.8	Confident	73.9	Confident	124 Å²	124	77.8 Å²	77.8	66%	0.663	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-62.8	136.9	-176.6	-61.3	-39.6	0	0	0	111.9
599	P	77.6	Confident	72.8	Confident	59 Å²	59	81.4 Å²	81.4	38%	0.383	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-57.2	144.6	176.9	16.5	-23.9	0	0	0	111.6	R595 S601	R595-P599 VanDerWaalsContact NH1-CB 3.27Å; R595-P599 VanDerWaalsContact NH1-CD 3.33Å; P599-S601 PolarHBondContact O-N 3.38Å
600	P	77.7	Confident	71.4	Confident	26 Å²	26	86.4 Å²	86.4	17%	0.169	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-55.6	125.5	169.6	-21.6	31.6	0	0	0	111.2	V602 E688 Q691 F692	P600-V602 VanDerWaalsContact C-N 3.27Å; P600-V602 PolarHBondContact O-N 3.16Å; P600-E688 WeakPolarHBondContact CD-OE1 3.31Å; P600-Q691 HydrophobicContact CB-CB 3.94Å; P600-Q691 HydrophobicContact CG-CB 3.99Å; P600-F692 HydrophobicContact CG-CB 4.32Å
601	S	68.8	Low	69.6	Low	73 Å²	73	89.7 Å²	89.7	51%	0.51	47%	0.468	S	S	.	.			trans	-79.7	-5.2	-174.6	67.6	0	0	0	0	114.2	P599 R603 S695 E699	P599-S601 PolarHBondContact O-N 3.38Å; S601-R603 PolarHBondContact O-N 2.93Å; S601-S695 PolarHBondContact N-OG 2.83Å; S601-S695 PolarHBondContact OG-OG 3.36Å; S601-E699 PolarHBondContact OG-OE1 3.24Å
602	V	61.1	Low	67.6	Low	53 Å²	53	90.7 Å²	90.7	32%	0.321	48%	0.484	S	S	.	.			trans	-66.5	108.9	-177.8	-175.8	0	0	0	0	109.7	P600 R604 K694	P600-V602 VanDerWaalsContact C-N 3.27Å; P600-V602 PolarHBondContact O-N 3.16Å; V602-R604 PolarHBondContact O-N 3.24Å; V602-K694 HydrophobicContact CG2-CB 4.43Å; V602-K694 HydrophobicContact CG2-CD 4.39Å; V602-K694 HydrophobicContact CG2-CG 4.21Å
603	R	49.5	Very low	65.6	Low	244 Å²	244	95.4 Å²	95.4	92%	0.921	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-57.3	119.7	177.9	-77.3	-177	176.7	-176.1	-0.7	110.8	S601	S601-R603 PolarHBondContact O-N 2.93Å
604	R	55.7	Low	63.6	Low	183 Å²	183	97.9 Å²	97.9	69%	0.691	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-78.7	142.8	157	-68.3	-177.7	-176	-175	3.5	108.4	V602 Q691	V602-R604 PolarHBondContact O-N 3.24Å; R604-Q691 VanDerWaalsContact NH2-NE2 3.18Å
605	E	53.3	Low	61.3	Low	179 Å²	179	103.7 Å²	103.7	84%	0.836	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-59.9	132.2	158.7	-72.3	-177.9	169.2	0	0	107.6	S607	E605-S607 PolarHBondContact O-N 3.33Å
606	P	54	Low	59.2	Low	118 Å²	118	104 Å²	104	77%	0.766	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-61.5	116.1	177.5	23.7	-30.6	0	0	0	108.5	Y608	P606-Y608 PolarHBondContact O-N 3.23Å
607	S	52.7	Low	56.8	Low	94 Å²	94	111.9 Å²	111.9	66%	0.657	60%	0.598	S	S	*	*	S	Bend	trans	-67.9	-18.3	-176.2	41.2	0	0	0	0	113.5	E605	E605-S607 PolarHBondContact O-N 3.33Å
608	Y	58.8	Low	54.3	Low	132 Å²	132	115.8 Å²	115.8	52%	0.518	63%	0.625	S	S	.	*	S	Bend	trans	-139.1	137.9	-177.5	-56.8	-72.7	0	0	0	111.9	P588 P606	P588-Y608 HydrophobicContact CG-CD2 4.48Å; P588-Y608 HydrophobicContact CG-CE1 4Å; P588-Y608 HydrophobicContact CG-CE2 3.97Å; P606-Y608 PolarHBondContact O-N 3.23Å
609	T	56.3	Low	52.3	Low	131 Å²	131	115 Å²	115	80%	0.804	62%	0.619	S	S	*	*			trans	-74.1	121.2	168.2	28	0	0	0	0	109.8	T611	T609-T611 PolarHBondContact O-N 3.13Å
610	T	50.6	Low	50.2	Low	140 Å²	140	115.3 Å²	115.3	86%	0.859	62%	0.621	S	S	*	*			trans	-78.4	102.9	-175.4	-29.9	0	0	0	0	111
611	T	47.3	Very low	48	Very low	136 Å²	136	123.9 Å²	123.9	83%	0.834	66%	0.659	S	S	*	*			trans	-109.1	-6.9	178.4	42.1	0	0	0	0	114.5	T609	T609-T611 PolarHBondContact O-N 3.13Å
612	A	45	Very low	46.5	Very low	76 Å²	76	124 Å²	124	63%	0.628	67%	0.671	S	S	*	*			trans	-96.8	133.9	-167.8	0	0	0	0	0	114.8
613	T	46.4	Very low	45.6	Very low	128 Å²	128	125.9 Å²	125.9	79%	0.785	67%	0.673	S	S	*	*			trans	-100.5	112	160.3	39.1	0	0	0	0	109.4
614	F	45.8	Very low	45	Very low	75 Å²	75	123 Å²	123	33%	0.329	67%	0.67	S	S	.	*			trans	-78.4	137.9	177.5	-176.5	-106.6	0	0	0	111.4	D585 P616 L629	D585-F614 HydrophobicContact CB-CD1 4.08Å; D585-F614 HydrophobicContact CB-CD2 4.14Å; D585-F614 HydrophobicContact CB-CE1 4.28Å; D585-F614 HydrophobicContact CB-CE2 4.35Å; D585-F614 HydrophobicContact CB-CG 4.01Å; D585-F614 HydrophobicContact CB-CZ 4.41Å; D585-F614 VanDerWaalsContact O-CD2 3.29Å; D585-F614 WeakPolarHBondContact O-CD2 3.33Å; F614-P616 HydrophobicContact CE1-CB 3.75Å; F614-P616 HydrophobicContact CE1-CG 4.16Å; F614-P616 HydrophobicContact CZ-CB 4.26Å; F614-L629 HydrophobicContact CD1-CD1 3.99Å; F614-L629 HydrophobicContact CE1-CD1 4.44Å; F614-L629 VanDerWaalsContact O-CD2 3.25Å; F614-L629 WeakPolarHBondContact O-CD2 3.34Å
615	K	43.5	Very low	44.1	Very low	133 Å²	133	121.8 Å²	121.8	58%	0.578	68%	0.677	S	S	*	*			trans	-125.2	114.5	164.8	-88.8	-173.5	174.4	-174	0	108.5	V631	K615-V631 WeakPolarHBondContact CE-O 3.12Å; K615-V631 PolarHBondContact NZ-O 3.36Å
616	P	44.3	Very low	43.4	Very low	40 Å²	40	119.6 Å²	119.6	26%	0.26	67%	0.667	S	S	.	*			trans	-68.9	136.1	175.7	24	-25.9	0	0	0	109.1	F614 T618 L629	F614-P616 HydrophobicContact CE1-CB 3.75Å; F614-P616 HydrophobicContact CE1-CG 4.16Å; F614-P616 HydrophobicContact CZ-CB 4.26Å; P616-T618 PolarHBondContact O-N 3.08Å; P616-L629 HydrophobicContact CG-CB 4.13Å; P616-L629 HydrophobicContact CG-CD1 3.9Å
617	L	37.3	Very low	42.7	Very low	182 Å²	182	120 Å²	120	95%	0.953	66%	0.662	S	S	*	*	S	Bend	trans	-71.6	-12.6	-179.3	-78.1	159.3	0	0	0	113.3
618	T	34.8	Very low	41.7	Very low	106 Å²	106	118.4 Å²	118.4	65%	0.65	65%	0.649	S	S	*	*			trans	-147.4	134	176	40.7	0	0	0	0	110.5	P616	P616-T618 PolarHBondContact O-N 3.08Å
619	I	37.5	Very low	40.4	Very low	106 Å²	106	115.2 Å²	115.2	54%	0.544	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-102.6	119.8	169.6	-58.9	168.9	0	0	0	106.1	W623	I619-W623 HydrophobicContact CG2-CB 4.42Å
620	P	34.2	Very low	39	Very low	66 Å²	66	116.8 Å²	116.8	43%	0.429	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-65.7	139.4	175.3	-14.6	28	0	0	0	110.8	G622 W623	P620-G622 PolarHBondContact O-N 3.29Å; P620-W623 HydrophobicContact CB-CG 4.37Å; P620-W623 HydrophobicContact CG-CD2 4.35Å; P620-W623 HydrophobicContact CG-CG 4.34Å; P620-W623 PolarHBondContact O-N 2.67Å
621	Q	30.4	Very low	38	Very low	206 Å²	206	114 Å²	114	96%	0.963	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	129	169.6	-82.9	177.1	-24.5	0	0	109.6
622	G	37.7	Very low	37	Very low	75 Å²	75	109.6 Å²	109.6	77%	0.773	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	105.7	3.1	-176.2	0	0	0	0	0	115.5	P620	P620-G622 PolarHBondContact O-N 3.29Å
623	W	43	Very low	36.4	Very low	94 Å²	94	117.4 Å²	117.4	36%	0.356	62%	0.621	S	S	.	*			trans	-100.3	34.8	176	-75.7	49.6	0	0	0	112.6	I619 P620 V628 G669	I619-W623 HydrophobicContact CG2-CB 4.42Å; P620-W623 HydrophobicContact CB-CG 4.37Å; P620-W623 HydrophobicContact CG-CD2 4.35Å; P620-W623 HydrophobicContact CG-CG 4.34Å; P620-W623 PolarHBondContact O-N 2.67Å; W623-V628 HydrophobicContact CE3-CB 3.96Å; W623-V628 HydrophobicContact CE3-CG1 4.02Å; W623-V628 HydrophobicContact CE3-CG2 3.85Å; W623-V628 HydrophobicContact CZ3-CB 4.27Å; W623-V628 HydrophobicContact CZ3-CG1 4.07Å; W623-V628 HydrophobicContact CZ3-CG2 3.81Å; W623-G669 VanDerWaalsContact CH2-CA 3.44Å
624	E	37.5	Very low	35.7	Very low	183 Å²	183	116.4 Å²	116.4	86%	0.855	62%	0.615	S	S	*	*			trans	-82.4	-22.5	177.9	-68.9	-171.4	168.3	0	0	112.9
625	D	36.1	Very low	35.1	Very low	158 Å²	158	121.5 Å²	121.5	85%	0.845	65%	0.646	S	S	*	*	S	Bend	trans	-116	88.2	-178.2	-74.5	-43.8	0	0	0	112
626	E	38.7	Very low	34.3	Very low	133 Å²	133	121.8 Å²	121.8	62%	0.621	65%	0.649	S	S	*	*	S	Bend	trans	137.3	93	150.2	-72.4	-149.2	153	0	0	112.1	V628	E626-V628 PolarHBondContact O-N 3.29Å
627	D	38.6	Very low	33.6	Very low	125 Å²	125	125.2 Å²	125.2	67%	0.668	67%	0.671	S	S	*	*			trans	47.1	54.5	155.9	-73.5	-11.9	0	0	0	118.3
628	V	32.2	Very low	33.5	Very low	61 Å²	61	122.5 Å²	122.5	37%	0.37	67%	0.665	S	S	.	*			trans	-131.5	97.1	167.7	-172	0	0	0	0	112.2	W623 E626	W623-V628 HydrophobicContact CE3-CB 3.96Å; W623-V628 HydrophobicContact CE3-CG1 4.02Å; W623-V628 HydrophobicContact CE3-CG2 3.85Å; W623-V628 HydrophobicContact CZ3-CB 4.27Å; W623-V628 HydrophobicContact CZ3-CG1 4.07Å; W623-V628 HydrophobicContact CZ3-CG2 3.81Å; E626-V628 PolarHBondContact O-N 3.29Å
629	L	31.5	Very low	33.4	Very low	66 Å²	66	128 Å²	128	35%	0.346	67%	0.674	S	S	.	*			trans	56.9	78.8	149.5	-71.1	145.8	0	0	0	118.2	F614 P616 V631	F614-L629 HydrophobicContact CD1-CD1 3.99Å; F614-L629 HydrophobicContact CE1-CD1 4.44Å; F614-L629 VanDerWaalsContact O-CD2 3.25Å; F614-L629 WeakPolarHBondContact O-CD2 3.34Å; P616-L629 HydrophobicContact CG-CB 4.13Å; P616-L629 HydrophobicContact CG-CD1 3.9Å; L629-V631 HydrophobicContact CD2-CG2 4.38Å
630	I	26.9	Very low	33.1	Very low	164 Å²	164	132.8 Å²	132.8	84%	0.841	69%	0.69	S	S	*	*			trans	-106.5	102.7	143.2	-58.8	176.9	0	0	0	107.6
631	V	30.1	Very low	33.1	Very low	81 Å²	81	140.8 Å²	140.8	49%	0.491	71%	0.712	S	S	.	*			trans	-107.3	80.9	162.5	-177.1	0	0	0	0	107.4	K615 L629	K615-V631 WeakPolarHBondContact CE-O 3.12Å; K615-V631 PolarHBondContact NZ-O 3.36Å; L629-V631 HydrophobicContact CD2-CG2 4.38Å
632	G	26.5	Very low	33.1	Very low	43 Å²	43	138.1 Å²	138.1	44%	0.443	69%	0.693	S	S	.	*			trans	-84	149.3	154.4	0	0	0	0	0	109	T634	G632-T634 PolarHBondContact O-N 3.41Å
633	Y	32.5	Very low	33.1	Very low	240 Å²	240	143.3 Å²	143.3	94%	0.941	69%	0.694	S	S	*	*			trans	-63.4	102.9	165.1	-85.8	-93.8	0	0	0	107.9
634	T	30	Very low	33	Very low	107 Å²	107	143 Å²	143	66%	0.656	70%	0.702	S	S	*	*			trans	-134.3	131.4	161.6	51.6	0	0	0	0	107.4	G632 E636	G632-T634 PolarHBondContact O-N 3.41Å; T634-E636 PolarHBondContact O-N 2.81Å
635	D	33	Very low	33.4	Very low	182 Å²	182	137.4 Å²	137.4	97%	0.973	68%	0.681	S	S	*	*	S	Bend	trans	-64.9	24.7	-179.5	-73.9	-44.9	0	0	0	114.4
636	E	27.7	Very low	34	Very low	140 Å²	140	132.4 Å²	132.4	65%	0.654	65%	0.654	S	S	*	*	S	Bend	trans	-96.8	138.5	175.4	-70.6	-164.9	172.1	0	0	111.3	T634	T634-E636 PolarHBondContact O-N 2.81Å
637	P	30.6	Very low	34.5	Very low	111 Å²	111	132.7 Å²	132.7	72%	0.721	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-61.6	143	-178.9	25.2	-32.7	0	0	0	110.7	R639	P637-R639 PolarHBondContact O-N 3.18Å
638	P	34.8	Very low	35.6	Very low	126 Å²	126	129.6 Å²	129.6	82%	0.818	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-58.9	116.5	-175	22.8	-32.3	0	0	0	110.2	K640	P638-K640 PolarHBondContact O-N 2.73Å
639	R	32.5	Very low	37.8	Very low	222 Å²	222	127.7 Å²	127.7	84%	0.838	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-54.4	129	169	-72.1	-177.2	178.5	-177.4	1.1	107.9	P637 R641	P637-R639 PolarHBondContact O-N 3.18Å; R639-R641 PolarHBondContact O-N 3.16Å; R639-R641 VanDerWaalsContact O-N 3.1Å
640	K	31.5	Very low	40.5	Very low	205 Å²	205	125.8 Å²	125.8	89%	0.891	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-47.1	116.1	-174.6	-77	174.9	174	175.5	0	110.6	P638 R642	P638-K640 PolarHBondContact O-N 2.73Å; K640-R642 PolarHBondContact O-N 3.28Å
641	R	33.3	Very low	43.6	Very low	234 Å²	234	118 Å²	118	88%	0.883	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-53.2	116.2	170.9	-67.4	175.4	178.2	179.9	-1.9	109.4	R639 K643	R639-R641 PolarHBondContact O-N 3.16Å; R639-R641 VanDerWaalsContact O-N 3.1Å; R641-K643 PolarHBondContact O-N 3.27Å
642	R	31.1	Very low	46.5	Very low	151 Å²	151	114.9 Å²	114.9	57%	0.57	55%	0.554	S	S	*	*			trans	-78	106.6	163.5	-165.4	176.2	173.9	175.7	-3.5	106.7	K640 V644 E648	K640-R642 PolarHBondContact O-N 3.28Å; R642-V644 PolarHBondContact O-N 3.14Å; R642-V644 VanDerWaalsContact O-N 3.16Å; R642-E648 IonicContact CZ-OE1 3.78Å; R642-E648 IonicContact NE-OE1 3.15Å; R642-E648 IonicContact NH2-OE1 2.97Å; R642-E648 PolarHBondContact NH2-OE1 3.39Å
643	K	36.8	Very low	49.5	Very low	184 Å²	184	118.6 Å²	118.6	80%	0.8	56%	0.555	S	S	*	*			trans	-63	116	163.4	-87.9	179.6	173.3	-179.6	0	105.3	R641 T645	R641-K643 PolarHBondContact O-N 3.27Å; K643-T645 PolarHBondContact O-N 3.37Å
644	V	41	Very low	52.2	Low	86 Å²	86	107.2 Å²	107.2	52%	0.521	51%	0.51	S	S	.	.			trans	-50.5	109.4	160.3	179.9	0	0	0	0	105.4	R642 E648	R642-V644 PolarHBondContact O-N 3.14Å; R642-V644 VanDerWaalsContact O-N 3.16Å; V644-E648 HydrophobicContact CG1-CB 3.76Å
645	T	46.8	Very low	55.1	Low	67 Å²	67	102.1 Å²	102.1	41%	0.411	48%	0.479	S	S	.	.			trans	-69	153.8	178.8	43.1	0	0	0	0	107.9	K643 E647 E648	K643-T645 PolarHBondContact O-N 3.37Å; T645-E647 PolarHBondContact O-N 2.78Å; T645-E648 PolarHBondContact O-N 3.44Å
646	D	48.6	Very low	57.9	Low	53 Å²	53	93.6 Å²	93.6	28%	0.283	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-56.1	-20.8	178.9	-66.6	-29.2	0	0	0	111.9	R595 E648 Q649	R595-D646 IonicContact CZ-OD2 3.2Å; R595-D646 IonicContact NH1-OD1 3.84Å; R595-D646 IonicContact NH1-OD2 3.02Å; R595-D646 PolarHBondContact NH1-OD2 2.7Å; R595-D646 IonicContact NH2-OD2 3.53Å; D646-E648 VanDerWaalsContact C-N 3.31Å; D646-E648 PolarHBondContact O-N 2.89Å; D646-Q649 PolarHBondContact OD1-NE2 3Å
647	E	49.5	Very low	60.8	Low	139 Å²	139	87.1 Å²	87.1	65%	0.65	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-69.9	-10.6	173.2	-58.5	179.6	-177.2	0	0	116	K568 T645	K568-E647 WeakPolarHBondContact CD-O 3.5Å; T645-E647 PolarHBondContact O-N 2.78Å
648	E	61.1	Low	63.6	Low	59 Å²	59	81.9 Å²	81.9	28%	0.276	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-110.9	4.5	-179.4	-69.3	175.2	166.5	0	0	112.4	R642 V644 T645 D646 L650	R642-E648 IonicContact CZ-OE1 3.78Å; R642-E648 IonicContact NE-OE1 3.15Å; R642-E648 IonicContact NH2-OE1 2.97Å; R642-E648 PolarHBondContact NH2-OE1 3.39Å; V644-E648 HydrophobicContact CG1-CB 3.76Å; T645-E648 PolarHBondContact O-N 3.44Å; D646-E648 VanDerWaalsContact C-N 3.31Å; D646-E648 PolarHBondContact O-N 2.89Å; E648-L650 PolarHBondContact O-N 3.47Å
649	Q	79	Confident	65.9	Low	21 Å²	21	76.4 Å²	76.4	10%	0.098	34%	0.336	C	S	.	.			trans	-72.7	117.2	-176.6	-66.8	-176.9	0.4	0	0	112.2	K568 M569 D646	K568-Q649 CarbonylContact C-O 3.55Å; K568-Q649 VanDerWaalsContact CA-O 3.3Å; K568-Q649 WeakPolarHBondContact CA-O 3.26Å; M569-Q649 HydrophobicContact CB-CB 4.37Å; M569-Q649 HydrophobicContact CG-CB 4.06Å; M569-Q649 PolarHBondContact N-O 3.09Å; D646-Q649 PolarHBondContact OD1-NE2 3Å
650	L	88.1	Confident	68	Low	27 Å²	27	65.9 Å²	65.9	14%	0.141	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-80.7	136.5	175.6	-64.3	173.8	0	0	0	111.6	T567 K568 E648 W652 R653 A654	T567-L650 WeakPolarHBondContact O-CA 3.22Å; K568-L650 HydrophobicContact CG-CD2 4.23Å; E648-L650 PolarHBondContact O-N 3.47Å; L650-W652 PolarHBondContact O-N 3.2Å; L650-R653 HydrophobicContact CB-CB 4.23Å; L650-R653 HydrophobicContact CB-CG 3.96Å; L650-R653 HydrophobicContact CD1-CG 4.35Å; L650-R653 PolarHBondContact O-N 3.41Å; L650-A654 PolarHBondContact O-N 3Å; L650-A654 VanDerWaalsContact O-N 3.07Å
651	I	90.4	Very high	70.4	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-48.9	-177	-65.6	-177.8	0	0	0	111.4	L521 H525 F563 T567 M569 I572 R653 A654 A655	L521-I651 HydrophobicContact CB-CG2 4.17Å; L521-I651 HydrophobicContact CD1-CG2 3.96Å; L521-I651 HydrophobicContact CD2-CG2 4.12Å; L521-I651 HydrophobicContact CG-CG2 4.29Å; H525-I651 VanDerWaalsContact NE2-CD1 3.33Å; H525-I651 WeakPolarHBondContact NE2-CD1 3.49Å; F563-I651 HydrophobicContact CB-CB 4.42Å; F563-I651 HydrophobicContact CB-CG2 3.88Å; F563-I651 HydrophobicContact CD1-CG2 4.02Å; F563-I651 HydrophobicContact CG-CG2 3.89Å; T567-I651 HydrophobicContact CG2-CD1 3.58Å; T567-I651 HydrophobicContact CG2-CG1 4.41Å; T567-I651 PolarHBondContact O-N 3.17Å; M569-I651 HydrophobicContact CG-CG1 4.21Å; M569-I651 HydrophobicContact SD-CB 4.44Å; M569-I651 HydrophobicContact SD-CG1 3.85Å; I572-I651 HydrophobicContact CD1-CD1 3.87Å; I651-R653 PolarHBondContact O-N 3.42Å; I651-A654 PolarHBondContact O-N 2.99Å; I651-A654 VanDerWaalsContact O-N 3.17Å; I651-A655 WeakPolarHBondContact O-CB 3.15Å; I651-A655 PolarHBondContact O-N 3.3Å
652	W	90.8	Very high	72.1	Confident	14 Å²	14	48.5 Å²	48.5	5%	0.053	24%	0.236	C	C	.	.	H	α-helix	trans	-63.5	-31.9	-178.3	73.8	-97	0	0	0	112.1	E556 L559 K560 E565 L650 R656 M668	E556-W652 HydrophobicContact CB-CZ3 4.32Å; E556-W652 HydrophobicContact CG-CZ3 4.17Å; L559-W652 HydrophobicContact CB-CB 3.93Å; K560-W652 HydrophobicContact CG-CD2 3.76Å; K560-W652 HydrophobicContact CG-CE3 4.11Å; K560-W652 HydrophobicContact CG-CG 3.99Å; K560-W652 HydrophobicContact CG-CZ2 4.42Å; E565-W652 PolarHBondContact O-NE1 3.35Å; L650-W652 PolarHBondContact O-N 3.2Å; W652-R656 WeakPolarHBondContact O-CB 3.34Å; W652-R656 PolarHBondContact O-N 3.13Å; W652-M668 HydrophobicContact CE3-CE 4.43Å; W652-M668 HydrophobicContact CH2-CE 4.06Å; W652-M668 HydrophobicContact CZ3-CE 3.68Å
653	R	89.4	Confident	74.2	Confident	122 Å²	122	46 Å²	46	46%	0.46	24%	0.237	S	C	.	.	H	α-helix	trans	-70.5	-41.7	175.7	-65.5	-169.6	175	171	-1.4	111.4	L650 I651 R656 S657 M668	L650-R653 HydrophobicContact CB-CB 4.23Å; L650-R653 HydrophobicContact CB-CG 3.96Å; L650-R653 HydrophobicContact CD1-CG 4.35Å; L650-R653 PolarHBondContact O-N 3.41Å; I651-R653 PolarHBondContact O-N 3.42Å; R653-R656 PolarHBondContact O-N 2.69Å; R653-S657 VanDerWaalsContact O-CB 3.28Å; R653-S657 WeakPolarHBondContact O-CB 3.45Å; R653-S657 PolarHBondContact O-N 2.95Å; R653-S657 PolarHBondContact O-OG 3.41Å; R653-M668 HydrophobicContact CB-CE 3.99Å; R653-M668 HydrophobicContact CG-CE 3.8Å
654	A	89.7	Confident	76.3	Confident	1 Å²	1	38 Å²	38	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-62.5	-45.1	174.4	0	0	0	0	0	111.2	M569 F594 L650 I651 R656 S657 S658	M569-A654 HydrophobicContact SD-CB 4.3Å; F594-A654 HydrophobicContact CB-CB 3.94Å; F594-A654 HydrophobicContact CD1-CB 3.83Å; F594-A654 HydrophobicContact CD2-CB 4.05Å; F594-A654 HydrophobicContact CE1-CB 4.31Å; F594-A654 HydrophobicContact CG-CB 3.68Å; L650-A654 PolarHBondContact O-N 3Å; L650-A654 VanDerWaalsContact O-N 3.07Å; I651-A654 PolarHBondContact O-N 2.99Å; I651-A654 VanDerWaalsContact O-N 3.17Å; A654-R656 PolarHBondContact O-N 3.41Å; A654-S657 PolarHBondContact O-N 2.89Å; A654-S658 WeakPolarHBondContact O-CB 3.37Å; A654-S658 PolarHBondContact O-N 2.93Å
655	A	91.5	Very high	78.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.7	-48	175.2	0	0	0	0	0	111.8	I518 L521 L559 F563 I651 S658 G659	I518-A655 HydrophobicContact CG1-CB 4.28Å; L521-A655 HydrophobicContact CD1-CB 3.67Å; L559-A655 HydrophobicContact CD1-CB 4.23Å; L559-A655 HydrophobicContact CD2-CB 3.94Å; F563-A655 HydrophobicContact CE2-CB 4.37Å; I651-A655 WeakPolarHBondContact O-CB 3.15Å; I651-A655 PolarHBondContact O-N 3.3Å; A655-S658 PolarHBondContact O-N 3.07Å; A655-G659 PolarHBondContact O-N 2.89Å
656	R	90.9	Very high	79.9	Confident	3 Å²	3	39 Å²	39	1%	0.011	19%	0.19	C	C	.	.	H	α-helix	trans	-65	-42.2	178.1	179.6	64.4	-178.3	107.8	17.8	112.2	S552 E556 L559 W652 R653 A654 S658 G659 A660 R666 M668	S552-R656 VanDerWaalsContact CB-NH2 3.35Å; E556-R656 HydrophobicContact CG-CG 4.16Å; E556-R656 IonicContact OE1-NE 3.84Å; L559-R656 HydrophobicContact CD1-CB 3.66Å; L559-R656 HydrophobicContact CD1-CG 4.5Å; W652-R656 WeakPolarHBondContact O-CB 3.34Å; W652-R656 PolarHBondContact O-N 3.13Å; R653-R656 PolarHBondContact O-N 2.69Å; A654-R656 PolarHBondContact O-N 3.41Å; R656-S658 VanDerWaalsContact C-N 3.27Å; R656-S658 PolarHBondContact O-N 2.89Å; R656-G659 PolarHBondContact O-N 2.62Å; R656-A660 VanDerWaalsContact O-CB 3.26Å; R656-A660 WeakPolarHBondContact O-CB 3.47Å; R656-A660 PolarHBondContact O-N 2.93Å; R656-R666 PolarHBondContact NH2-O 3.36Å; R656-M668 HydrophobicContact CB-CE 4.33Å; R656-M668 HydrophobicContact CB-SD 3.54Å; R656-M668 VanDerWaalsContact CB-SD 3.54Å; R656-M668 HydrophobicContact CG-CB 4.34Å; R656-M668 HydrophobicContact CG-CE 4.17Å; R656-M668 HydrophobicContact CG-CG 4.21Å; R656-M668 HydrophobicContact CG-SD 3.3Å; R656-M668 WeakPolarHBondContact CG-SD 3.46Å
657	S	89.1	Confident	81.1	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.028	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-35.2	178.9	-62	0	0	0	0	112.2	S581 R653 A654 L672	S581-S657 PolarHBondContact OG-O 2.94Å; R653-S657 VanDerWaalsContact O-CB 3.28Å; R653-S657 WeakPolarHBondContact O-CB 3.45Å; R653-S657 PolarHBondContact O-N 2.95Å; R653-S657 PolarHBondContact O-OG 3.41Å; A654-S657 PolarHBondContact O-N 2.89Å; S657-L672 CarbonylContact O-C 3.46Å
658	S	89.9	Confident	82.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-79.4	-42.9	176.1	-168	0	0	0	0	112.8	S514 V579 T580 A654 A655 R656 A660 D673	S514-S658 WeakPolarHBondContact CA-O 3.19Å; S514-S658 PolarHBondContact N-OG 3.22Å; V579-S658 WeakPolarHBondContact CG1-OG 3.11Å; T580-S658 WeakPolarHBondContact O-CB 3.45Å; T580-S658 PolarHBondContact O-OG 3.13Å; A654-S658 WeakPolarHBondContact O-CB 3.37Å; A654-S658 PolarHBondContact O-N 2.93Å; A655-S658 PolarHBondContact O-N 3.07Å; R656-S658 VanDerWaalsContact C-N 3.27Å; R656-S658 PolarHBondContact O-N 2.89Å; S658-A660 VanDerWaalsContact C-N 3.33Å; S658-A660 PolarHBondContact O-N 2.97Å; S658-D673 VanDerWaalsContact O-CA 3.3Å; S658-D673 WeakPolarHBondContact O-CA 2.97Å
659	G	83.4	Confident	83	Confident	12 Å²	12	33.2 Å²	33.2	12%	0.124	18%	0.177	C	C	.	.	S	Bend	trans	-82.8	5	-174.1	0	0	0	0	0	116.4	A655 R656 A661	A655-G659 PolarHBondContact O-N 2.89Å; R656-G659 PolarHBondContact O-N 2.62Å; G659-A661 PolarHBondContact O-N 2.8Å
660	A	76.8	Confident	83	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.194	C	C	.	.			trans	-91.3	75.3	-173	0	0	0	0	0	113.4	R656 S658 P662 D673	R656-A660 VanDerWaalsContact O-CB 3.26Å; R656-A660 WeakPolarHBondContact O-CB 3.47Å; R656-A660 PolarHBondContact O-N 2.93Å; S658-A660 VanDerWaalsContact C-N 3.33Å; S658-A660 PolarHBondContact O-N 2.97Å; A660-P662 WeakPolarHBondContact O-CD 3.31Å; A660-D673 WeakPolarHBondContact O-CB 3.49Å; A660-D673 PolarHBondContact O-N 3.14Å
661	A	80.7	Confident	82.9	Confident	15 Å²	15	37.6 Å²	37.6	12%	0.124	19%	0.192	C	C	.	.			trans	-56.9	122	175.9	0	0	0	0	0	111	G659 T663 Y664 F665 D673	G659-A661 PolarHBondContact O-N 2.8Å; A661-T663 PolarHBondContact O-N 3.2Å; A661-Y664 HydrophobicContact CB-CD2 3.68Å; A661-Y664 HydrophobicContact CB-CG 4.35Å; A661-Y664 PolarHBondContact O-N 3.17Å; A661-F665 PolarHBondContact O-N 2.84Å; A661-D673 PolarHBondContact N-OD2 3.45Å
662	P	69	Low	82.8	Confident	59 Å²	59	39 Å²	39	38%	0.383	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.5	-167.6	-20.5	27.5	0	0	0	115.7	A660 L672 L676	A660-P662 WeakPolarHBondContact O-CD 3.31Å; P662-L672 HydrophobicContact CB-CD2 4.38Å; P662-L672 HydrophobicContact CG-CB 4.35Å; P662-L672 HydrophobicContact CG-CD1 4.37Å; P662-L672 HydrophobicContact CG-CD2 4.16Å; P662-L676 HydrophobicContact CG-CD1 4.05Å
663	T	74.8	Confident	82.7	Confident	99 Å²	99	38.8 Å²	38.8	61%	0.607	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-16.1	176.3	46.9	0	0	0	0	113.2	A661	A661-T663 PolarHBondContact O-N 3.2Å
664	Y	80.8	Confident	82.6	Confident	16 Å²	16	33 Å²	33	6%	0.063	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-39.4	-176.8	-66.3	-94.4	0	0	0	111.5	R548 P549 Y550 A661 L791 D792	R548-Y664 PolarHBondContact NH1-OH 2.94Å; P549-Y664 CarbonylContact C-O 3.6Å; P549-Y664 WeakPolarHBondContact CA-O 3.29Å; Y550-Y664 WeakPolarHBondContact CD2-O 3.33Å; Y550-Y664 HydrophobicContact CE2-CD1 4.01Å; Y550-Y664 PolarHBondContact N-O 3.11Å; A661-Y664 HydrophobicContact CB-CD2 3.68Å; A661-Y664 HydrophobicContact CB-CG 4.35Å; A661-Y664 PolarHBondContact O-N 3.17Å; Y664-L791 HydrophobicContact CD2-CD1 4.44Å; Y664-L791 HydrophobicContact CE1-CB 4.24Å; Y664-L791 HydrophobicContact CE2-CB 4.15Å; Y664-L791 HydrophobicContact CE2-CD1 3.65Å; Y664-L791 HydrophobicContact CE2-CG 4.45Å; Y664-D792 HydrophobicContact CD1-CB 3.89Å; Y664-D792 HydrophobicContact CE1-CB 3.73Å; Y664-D792 WeakPolarHBondContact CE1-OD1 3.31Å; Y664-D792 WeakPolarHBondContact CE1-OD2 3.18Å
665	F	82.7	Confident	82.5	Confident	11 Å²	11	33.2 Å²	33.2	5%	0.048	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-128.2	152.4	-177.6	-63.2	-79.9	0	0	0	111.2	V543 F544 Y550 L555 A661	V543-F665 HydrophobicContact CG1-CE1 3.85Å; V543-F665 HydrophobicContact CG1-CZ 3.47Å; V543-F665 VanDerWaalsContact CG1-CZ 3.47Å; F544-F665 HydrophobicContact CD1-CZ 4.28Å; F544-F665 HydrophobicContact CE1-CE2 4.09Å; F544-F665 AromaticContact CE1-CZ 3.83Å; F544-F665 HydrophobicContact CE1-CZ 3.83Å; Y550-F665 HydrophobicContact CD2-CE1 4.33Å; Y550-F665 HydrophobicContact CD2-CZ 4.23Å; L555-F665 HydrophobicContact CB-CE1 4.45Å; L555-F665 HydrophobicContact CD2-CD1 4.39Å; L555-F665 HydrophobicContact CD2-CE1 4.11Å; L555-F665 HydrophobicContact CD2-CE2 4.26Å; L555-F665 HydrophobicContact CD2-CZ 4.04Å; A661-F665 PolarHBondContact O-N 2.84Å
666	R	81.1	Confident	82.4	Confident	164 Å²	164	36.4 Å²	36.4	62%	0.619	20%	0.196	S	C	*	.			trans	-65.6	148.9	167.5	-65.6	-171.6	-179.2	-172.8	2	110.7	R656	R656-R666 PolarHBondContact NH2-O 3.36Å
667	P	74.2	Confident	82.3	Confident	75 Å²	75	40.7 Å²	40.7	49%	0.487	22%	0.219	S	C	.	.			trans	-56.1	148.4	175.2	-24	33.7	0	0	0	112.4	L672	P667-L672 HydrophobicContact CB-CD2 3.61Å; P667-L672 HydrophobicContact CG-CD2 3.58Å
668	M	73.9	Confident	82.3	Confident	17 Å²	17	40.7 Å²	40.7	8%	0.084	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-98.5	97.1	172.6	-169.1	-175.1	-167.8	0	0	109.6	W652 R653 R656 R670 F671	W652-M668 HydrophobicContact CE3-CE 4.43Å; W652-M668 HydrophobicContact CH2-CE 4.06Å; W652-M668 HydrophobicContact CZ3-CE 3.68Å; R653-M668 HydrophobicContact CB-CE 3.99Å; R653-M668 HydrophobicContact CG-CE 3.8Å; R656-M668 HydrophobicContact CB-CE 4.33Å; R656-M668 HydrophobicContact CB-SD 3.54Å; R656-M668 VanDerWaalsContact CB-SD 3.54Å; R656-M668 HydrophobicContact CG-CB 4.34Å; R656-M668 HydrophobicContact CG-CE 4.17Å; R656-M668 HydrophobicContact CG-CG 4.21Å; R656-M668 HydrophobicContact CG-SD 3.3Å; R656-M668 WeakPolarHBondContact CG-SD 3.46Å; M668-R670 PolarHBondContact O-N 3.14Å; M668-F671 PolarHBondContact N-O 3.43Å; M668-F671 PolarHBondContact O-N 2.98Å
669	G	75.7	Confident	82.4	Confident	37 Å²	37	41.7 Å²	41.7	38%	0.381	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	-111.7	-175.4	0	0	0	0	0	111.6	W623	W623-G669 VanDerWaalsContact CH2-CA 3.44Å
670	R	80.5	Confident	83	Confident	116 Å²	116	41.5 Å²	41.5	44%	0.438	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-0.5	179.9	63.8	177.4	-179.4	-164.7	-3.5	114.9	L583 A584 D585 M668	L583-R670 HydrophobicContact CD2-CG 4.04Å; A584-R670 PolarHBondContact N-O 2.93Å; D585-R670 HydrophobicContact CB-CB 3.78Å; D585-R670 WeakPolarHBondContact OD2-CD 3.42Å; M668-R670 PolarHBondContact O-N 3.14Å
671	F	85.5	Confident	84	Confident	24 Å²	24	41.6 Å²	41.6	11%	0.105	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	139.9	-170.4	-63	-74.1	0	0	0	112.1	S581 V582 L583 H592 F594 M668	S581-F671 WeakPolarHBondContact OG-CB 3.46Å; V582-F671 WeakPolarHBondContact O-CA 3.29Å; L583-F671 HydrophobicContact CD2-CD1 3.81Å; L583-F671 HydrophobicContact CD2-CE1 3.37Å; L583-F671 HydrophobicContact CD2-CZ 4.07Å; L583-F671 HydrophobicContact CG-CE1 4.23Å; H592-F671 HydrophobicContact CB-CE1 4.23Å; H592-F671 AromaticContact CD2-CE1 3.57Å; H592-F671 AromaticContact CG-CE1 3.92Å; F594-F671 HydrophobicContact CE1-CE1 4.42Å; F594-F671 HydrophobicContact CE1-CE2 4.48Å; F594-F671 HydrophobicContact CE1-CZ 4.09Å; F594-F671 HydrophobicContact CE2-CD1 4.32Å; F594-F671 HydrophobicContact CE2-CE1 4.28Å; F594-F671 AromaticContact CZ-CD1 3.99Å; F594-F671 HydrophobicContact CZ-CD1 3.99Å; F594-F671 HydrophobicContact CZ-CD2 4.24Å; F594-F671 AromaticContact CZ-CE1 3.67Å; F594-F671 HydrophobicContact CZ-CE1 3.67Å; F594-F671 AromaticContact CZ-CE2 3.95Å; F594-F671 HydrophobicContact CZ-CE2 3.95Å; F594-F671 HydrophobicContact CZ-CG 4.25Å; F594-F671 AromaticContact CZ-CZ 3.65Å; F594-F671 HydrophobicContact CZ-CZ 3.65Å; M668-F671 PolarHBondContact N-O 3.43Å; M668-F671 PolarHBondContact O-N 2.98Å
672	L	87.6	Confident	84.7	Confident	30 Å²	30	40.9 Å²	40.9	16%	0.157	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	166.7	168.5	-62.6	179.9	0	0	0	110.3	S581 V582 A584 S657 P662 P667 G674 L676	S581-L672 PolarHBondContact OG-O 3.17Å; V582-L672 HydrophobicContact CB-CB 4.3Å; V582-L672 PolarHBondContact N-O 3.16Å; V582-L672 PolarHBondContact O-N 2.87Å; A584-L672 HydrophobicContact CB-CD1 3.48Å; A584-L672 VanDerWaalsContact CB-CD1 3.48Å; A584-L672 HydrophobicContact CB-CG 3.61Å; S657-L672 CarbonylContact O-C 3.46Å; P662-L672 HydrophobicContact CB-CD2 4.38Å; P662-L672 HydrophobicContact CG-CB 4.35Å; P662-L672 HydrophobicContact CG-CD1 4.37Å; P662-L672 HydrophobicContact CG-CD2 4.16Å; P667-L672 HydrophobicContact CB-CD2 3.61Å; P667-L672 HydrophobicContact CG-CD2 3.58Å; L672-G674 PolarHBondContact O-N 2.92Å; L672-L676 HydrophobicContact CB-CD1 4.29Å; L672-L676 HydrophobicContact CD1-CD1 4.08Å
673	D	89.6	Confident	86	Confident	10 Å²	10	40.5 Å²	40.5	5%	0.053	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.4	131.8	176	-162.9	-37.7	0	0	0	112	S514 V582 S658 A660 A661 G675 L676	S514-D673 VanDerWaalsContact CB-OD1 3.25Å; S514-D673 WeakPolarHBondContact CB-OD1 3.29Å; S514-D673 WeakPolarHBondContact CB-OD2 3.29Å; S514-D673 PolarHBondContact OG-OD2 3.37Å; V582-D673 WeakPolarHBondContact CG2-O 3.48Å; S658-D673 VanDerWaalsContact O-CA 3.3Å; S658-D673 WeakPolarHBondContact O-CA 2.97Å; A660-D673 WeakPolarHBondContact O-CB 3.49Å; A660-D673 PolarHBondContact O-N 3.14Å; A661-D673 PolarHBondContact N-OD2 3.45Å; D673-G675 PolarHBondContact O-N 3.23Å; D673-G675 VanDerWaalsContact O-N 3.17Å; D673-G675 PolarHBondContact OD1-N 3.46Å; D673-L676 PolarHBondContact O-N 3.07Å
674	G	87.3	Confident	86.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-20.6	174.8	0	0	0	0	0	113.1	T513 L672 L676 L677 A678	T513-G674 VanDerWaalsContact CG2-C 3.43Å; L672-G674 PolarHBondContact O-N 2.92Å; G674-L676 PolarHBondContact O-N 3.23Å; G674-L676 VanDerWaalsContact O-N 3.08Å; G674-L677 PolarHBondContact O-N 2.88Å; G674-L677 VanDerWaalsContact O-N 3.07Å; G674-A678 CarbonylContact O-C 3.55Å; G674-A678 PolarHBondContact O-N 3.4Å
675	G	88.2	Confident	87.6	Confident	5 Å²	5	37.7 Å²	37.7	5%	0.052	19%	0.192	C	C	.	.	H	α-helix	trans	-56.3	-23.2	178.2	0	0	0	0	0	114.6	D673 N679	D673-G675 PolarHBondContact O-N 3.23Å; D673-G675 VanDerWaalsContact O-N 3.17Å; D673-G675 PolarHBondContact OD1-N 3.46Å; G675-N679 WeakPolarHBondContact O-CB 3.41Å
676	L	88.2	Confident	88.2	Confident	67 Å²	67	38.3 Å²	38.3	35%	0.351	20%	0.196	S	C	.	.	H	α-helix	trans	-71.7	-25.9	177.2	-68	175.9	0	0	0	114.2	V582 P662 L672 D673 G674	V582-L676 HydrophobicContact CG2-CB 4.04Å; P662-L676 HydrophobicContact CG-CD1 4.05Å; L672-L676 HydrophobicContact CB-CD1 4.29Å; L672-L676 HydrophobicContact CD1-CD1 4.08Å; D673-L676 PolarHBondContact O-N 3.07Å; G674-L676 PolarHBondContact O-N 3.23Å; G674-L676 VanDerWaalsContact O-N 3.08Å
677	L	88.5	Confident	88.8	Confident	93 Å²	93	32.5 Å²	32.5	49%	0.487	18%	0.183	S	C	.	.	H	α-helix	trans	-121.9	-33.9	-177.9	-72	-177.1	0	0	0	113.4	V582 L591 G674	V582-L677 HydrophobicContact CB-CD1 4.41Å; V582-L677 HydrophobicContact CG1-CD1 3.93Å; V582-L677 HydrophobicContact CG1-CG 4.36Å; V582-L677 HydrophobicContact CG2-CB 3.89Å; V582-L677 HydrophobicContact CG2-CD1 3.77Å; V582-L677 HydrophobicContact CG2-CG 3.67Å; L591-L677 HydrophobicContact CB-CD1 4.27Å; L591-L677 HydrophobicContact CD1-CB 4.36Å; G674-L677 PolarHBondContact O-N 2.88Å; G674-L677 VanDerWaalsContact O-N 3.07Å
678	A	90.6	Very high	89.6	Confident	4 Å²	4	29.7 Å²	29.7	3%	0.033	16%	0.163	C	C	.	.	H	α-helix	trans	-141.6	51.1	-170.9	0	0	0	0	0	111.4	T513 T580 L591 G674 N680 D684	T513-A678 WeakPolarHBondContact CB-O 3.34Å; T513-A678 WeakPolarHBondContact CG2-O 3.5Å; T513-A678 PolarHBondContact OG1-O 2.82Å; T580-A678 HydrophobicContact CG2-CB 4.15Å; L591-A678 HydrophobicContact CD1-CB 3.8Å; L591-A678 HydrophobicContact CD2-CB 4.22Å; G674-A678 CarbonylContact O-C 3.55Å; G674-A678 PolarHBondContact O-N 3.4Å; A678-N680 PolarHBondContact O-N 3.16Å; A678-D684 VanDerWaalsContact CB-OD2 3.31Å; A678-D684 WeakPolarHBondContact CB-OD2 3.47Å
679	N	92.2	Very high	90.5	Very high	21 Å²	21	29 Å²	29	11%	0.112	16%	0.16	C	C	.	.	S	Bend	trans	-59.5	-34.8	-177.9	-160	32.2	0	0	0	113.2	D479 G480 G675 T757	D479-N679 WeakPolarHBondContact CA-O 3.27Å; G480-N679 WeakPolarHBondContact CA-OD1 3.49Å; G480-N679 PolarHBondContact N-O 3Å; G480-N679 PolarHBondContact N-OD1 3.38Å; G675-N679 WeakPolarHBondContact O-CB 3.41Å; N679-T757 PolarHBondContact ND2-O 2.94Å
680	N	95.6	Very high	91.2	Very high	9 Å²	9	33.4 Å²	33.4	5%	0.048	17%	0.17	C	C	.	.	S	Bend	trans	-103	107	163.4	-178.1	-35	0	0	0	108.5	D479 A678 T682 S759 A763 R780	D479-N680 VanDerWaalsContact OD1-CG 3.28Å; A678-N680 PolarHBondContact O-N 3.16Å; N680-T682 PolarHBondContact O-N 3.35Å; N680-T682 VanDerWaalsContact O-N 3.11Å; N680-T682 WeakPolarHBondContact OD1-CB 3.34Å; N680-T682 PolarHBondContact OD1-N 3.41Å; N680-T682 PolarHBondContact OD1-OG1 2.98Å; N680-S759 PolarHBondContact ND2-O 3.09Å; N680-A763 HydrophobicContact CB-CB 4.34Å; N680-R780 PolarHBondContact ND2-NH1 3.36Å
681	P	96.3	Very high	91.6	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.006	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	4.3	-173.2	31.2	-35.5	0	0	0	113.6	C477 A511 T580 L683 D684 A685	C477-P681 HydrophobicContact CB-CG 4.33Å; A511-P681 HydrophobicContact CB-CB 4.12Å; A511-P681 HydrophobicContact CB-CG 4.14Å; T580-P681 HydrophobicContact CG2-CB 3.95Å; P681-L683 PolarHBondContact O-N 3.16Å; P681-D684 PolarHBondContact O-N 2.75Å; P681-A685 WeakPolarHBondContact O-CB 3.46Å; P681-A685 PolarHBondContact O-N 3.39Å
682	T	96.6	Very high	91.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.8	-47.8	-169.2	-56.9	0	0	0	0	113	C477 N680 M686 V711 S713 A767 Y778	C477-T682 VanDerWaalsContact CB-OG1 3.31Å; C477-T682 WeakPolarHBondContact CB-OG1 3.46Å; N680-T682 PolarHBondContact O-N 3.35Å; N680-T682 VanDerWaalsContact O-N 3.11Å; N680-T682 WeakPolarHBondContact OD1-CB 3.34Å; N680-T682 PolarHBondContact OD1-N 3.41Å; N680-T682 PolarHBondContact OD1-OG1 2.98Å; T682-M686 HydrophobicContact CG2-SD 4.12Å; T682-M686 WeakPolarHBondContact O-CB 3.33Å; T682-M686 VanDerWaalsContact O-CG 3.24Å; T682-M686 WeakPolarHBondContact O-CG 3.38Å; T682-M686 PolarHBondContact O-N 3.28Å; T682-V711 HydrophobicContact CG2-CG1 3.72Å; T682-S713 PolarHBondContact OG1-OG 3.29Å; T682-A767 HydrophobicContact CG2-CB 3.77Å; T682-Y778 HydrophobicContact CG2-CE2 4.01Å
683	L	95.3	Very high	91.9	Very high	52 Å²	52	29.4 Å²	29.4	27%	0.272	16%	0.157	S	C	.	.	H	α-helix	trans	-66.6	-43.7	-179.6	-69.9	171.8	0	0	0	111.3	P681 M686 A687 R766 A767	P681-L683 PolarHBondContact O-N 3.16Å; L683-M686 PolarHBondContact O-N 3.14Å; L683-A687 WeakPolarHBondContact O-CB 3.41Å; L683-A687 PolarHBondContact O-N 3.06Å; L683-R766 HydrophobicContact CD1-CB 3.95Å; L683-R766 HydrophobicContact CD2-CB 4.19Å; L683-A767 HydrophobicContact CD2-CB 4.02Å; L683-A767 HydrophobicContact CG-CB 4.34Å
684	D	95	Very high	91.8	Very high	52 Å²	52	34.6 Å²	34.6	28%	0.278	18%	0.179	S	C	.	.	H	α-helix	trans	-65	-41.9	178.9	-60.5	-73	0	0	0	111.7	L591 A678 P681 A687 E688	L591-D684 HydrophobicContact CD2-CB 4.07Å; L591-D684 WeakPolarHBondContact CD2-OD1 3.41Å; A678-D684 VanDerWaalsContact CB-OD2 3.31Å; A678-D684 WeakPolarHBondContact CB-OD2 3.47Å; P681-D684 PolarHBondContact O-N 2.75Å; D684-A687 PolarHBondContact O-N 2.92Å; D684-E688 WeakPolarHBondContact O-CB 3.34Å; D684-E688 PolarHBondContact O-N 3.01Å
685	A	95.3	Very high	91.8	Very high	3 Å²	3	34.8 Å²	34.8	3%	0.025	18%	0.18	C	C	.	.	H	α-helix	trans	-65.1	-42.6	176.8	0	0	0	0	0	111.9	L475 A511 M578 P681 A687 E688 I689	L475-A685 HydrophobicContact CD1-CB 4.33Å; L475-A685 HydrophobicContact CD2-CB 4.07Å; A511-A685 HydrophobicContact CB-CB 3.62Å; M578-A685 HydrophobicContact SD-CB 3.98Å; P681-A685 WeakPolarHBondContact O-CB 3.46Å; P681-A685 PolarHBondContact O-N 3.39Å; A685-A687 VanDerWaalsContact C-N 3.33Å; A685-A687 PolarHBondContact O-N 3.03Å; A685-E688 PolarHBondContact O-N 2.68Å; A685-I689 WeakPolarHBondContact O-CB 3.48Å; A685-I689 VanDerWaalsContact O-CG1 3.25Å; A685-I689 WeakPolarHBondContact O-CG1 3.47Å; A685-I689 PolarHBondContact O-N 3.21Å
686	M	95.1	Very high	91.7	Very high	24 Å²	24	34.9 Å²	34.9	12%	0.118	18%	0.179	C	C	.	.	H	α-helix	trans	-61.3	-42.5	174	-72.8	173.2	67.5	0	0	111.6	L475 T682 L683 H690 L708 W770 C771 I774	L475-M686 HydrophobicContact CD2-CG 4.3Å; T682-M686 HydrophobicContact CG2-SD 4.12Å; T682-M686 WeakPolarHBondContact O-CB 3.33Å; T682-M686 VanDerWaalsContact O-CG 3.24Å; T682-M686 WeakPolarHBondContact O-CG 3.38Å; T682-M686 PolarHBondContact O-N 3.28Å; L683-M686 PolarHBondContact O-N 3.14Å; M686-H690 WeakPolarHBondContact O-CB 3.27Å; M686-H690 PolarHBondContact O-N 3.15Å; M686-L708 HydrophobicContact CG-CD2 4.12Å; M686-W770 HydrophobicContact CE-CB 4.32Å; M686-C771 VanDerWaalsContact CE-SG 3.51Å; M686-C771 VanDerWaalsContact SD-SG 3.65Å; M686-I774 HydrophobicContact CE-CD1 3.86Å
687	A	92.9	Very high	91.6	Very high	43 Å²	43	37.7 Å²	37.7	36%	0.355	19%	0.189	S	C	.	.	H	α-helix	trans	-64.7	-39.8	177.2	0	0	0	0	0	112.1	L683 D684 A685 Q691	L683-A687 WeakPolarHBondContact O-CB 3.41Å; L683-A687 PolarHBondContact O-N 3.06Å; D684-A687 PolarHBondContact O-N 2.92Å; A685-A687 VanDerWaalsContact C-N 3.33Å; A685-A687 PolarHBondContact O-N 3.03Å; A687-Q691 WeakPolarHBondContact O-CG 3.4Å; A687-Q691 PolarHBondContact O-N 3.45Å; A687-Q691 PolarHBondContact O-NE2 3.09Å
688	E	92.3	Very high	91.4	Very high	15 Å²	15	37.1 Å²	37.1	7%	0.07	20%	0.198	C	C	.	.	H	α-helix	trans	-67.4	-46.4	177	-178.9	66.6	-175.6	0	0	111.5	M578 I593 Y597 P600 D684 A685 H690 Q691 F692	M578-E688 HydrophobicContact CE-CB 4.02Å; M578-E688 HydrophobicContact CE-CG 3.61Å; M578-E688 HydrophobicContact SD-CB 3.9Å; M578-E688 HydrophobicContact SD-CG 3.69Å; I593-E688 HydrophobicContact CD1-CB 4.35Å; I593-E688 HydrophobicContact CD1-CG 4.35Å; Y597-E688 WeakPolarHBondContact OH-CG 3.21Å; Y597-E688 PolarHBondContact OH-OE1 2.99Å; P600-E688 WeakPolarHBondContact CD-OE1 3.31Å; D684-E688 WeakPolarHBondContact O-CB 3.34Å; D684-E688 PolarHBondContact O-N 3.01Å; A685-E688 PolarHBondContact O-N 2.68Å; E688-H690 VanDerWaalsContact C-N 3.3Å; E688-H690 PolarHBondContact O-N 2.91Å; E688-Q691 PolarHBondContact O-N 3.37Å; E688-Q691 VanDerWaalsContact O-N 3.14Å; E688-F692 WeakPolarHBondContact O-CB 3.42Å; E688-F692 PolarHBondContact O-N 3.11Å
689	I	92.3	Very high	91.2	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-42.2	175.8	-70.2	167.5	0	0	0	110.9	L475 W509 M578 A685 F692 N693 L708	L475-I689 HydrophobicContact CB-CD1 4.4Å; L475-I689 HydrophobicContact CD1-CD1 4.04Å; L475-I689 HydrophobicContact CD2-CD1 3.86Å; L475-I689 HydrophobicContact CG-CD1 4.32Å; W509-I689 HydrophobicContact CB-CD1 4.16Å; W509-I689 HydrophobicContact CD2-CD1 4.01Å; W509-I689 HydrophobicContact CD2-CG1 3.87Å; W509-I689 HydrophobicContact CE3-CD1 4.47Å; W509-I689 HydrophobicContact CE3-CG1 4.05Å; W509-I689 HydrophobicContact CG-CD1 3.88Å; W509-I689 HydrophobicContact CG-CG1 4.29Å; W509-I689 HydrophobicContact CH2-CG1 4.43Å; W509-I689 HydrophobicContact CZ2-CG1 4.28Å; W509-I689 HydrophobicContact CZ3-CG1 4.34Å; M578-I689 HydrophobicContact CE-CD1 4.33Å; M578-I689 HydrophobicContact CE-CG1 3.61Å; A685-I689 WeakPolarHBondContact O-CB 3.48Å; A685-I689 VanDerWaalsContact O-CG1 3.25Å; A685-I689 WeakPolarHBondContact O-CG1 3.47Å; A685-I689 PolarHBondContact O-N 3.21Å; I689-F692 PolarHBondContact O-N 3.19Å; I689-N693 WeakPolarHBondContact O-CB 3.5Å; I689-N693 PolarHBondContact O-N 2.8Å; I689-L708 HydrophobicContact CD1-CD1 4.35Å
690	H	90.9	Very high	90.7	Very high	129 Å²	129	43.4 Å²	43.4	60%	0.597	24%	0.243	S	C	*	.	H	α-helix	trans	-61.3	-44.9	175.7	179.8	76.3	0	0	0	111.7	M686 E688 N693 K694	M686-H690 WeakPolarHBondContact O-CB 3.27Å; M686-H690 PolarHBondContact O-N 3.15Å; E688-H690 VanDerWaalsContact C-N 3.3Å; E688-H690 PolarHBondContact O-N 2.91Å; H690-N693 PolarHBondContact O-N 3.08Å; H690-K694 WeakPolarHBondContact O-CB 3.41Å; H690-K694 PolarHBondContact O-N 2.97Å
691	Q	88.5	Confident	90.1	Very high	41 Å²	41	48.7 Å²	48.7	19%	0.192	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-42.6	177.1	-77.5	164.9	72.7	0	0	112.2	P600 R604 A687 E688 K694 S695	P600-Q691 HydrophobicContact CB-CB 3.94Å; P600-Q691 HydrophobicContact CG-CB 3.99Å; R604-Q691 VanDerWaalsContact NH2-NE2 3.18Å; A687-Q691 WeakPolarHBondContact O-CG 3.4Å; A687-Q691 PolarHBondContact O-N 3.45Å; A687-Q691 PolarHBondContact O-NE2 3.09Å; E688-Q691 PolarHBondContact O-N 3.37Å; E688-Q691 VanDerWaalsContact O-N 3.14Å; Q691-K694 WeakPolarHBondContact O-CB 3.36Å; Q691-K694 PolarHBondContact O-N 3.37Å; Q691-S695 PolarHBondContact O-N 3.21Å
692	F	88.9	Confident	89.2	Confident	22 Å²	22	54.1 Å²	54.1	10%	0.096	29%	0.287	C	S	.	.	H	α-helix	trans	-59.1	-48.5	175.6	-179.8	-98.8	0	0	0	111.4	W509 Y597 P600 E688 I689 K694 S695 L696	W509-F692 HydrophobicContact CH2-CB 4.33Å; W509-F692 AromaticContact CH2-CD1 3.53Å; W509-F692 HydrophobicContact CH2-CD1 3.53Å; W509-F692 HydrophobicContact CH2-CD2 4.36Å; W509-F692 AromaticContact CH2-CE1 3.81Å; W509-F692 HydrophobicContact CH2-CE1 3.81Å; W509-F692 AromaticContact CH2-CG 3.82Å; W509-F692 HydrophobicContact CH2-CG 3.82Å; W509-F692 HydrophobicContact CH2-CZ 4.36Å; W509-F692 AromaticContact CZ2-CD1 3.67Å; W509-F692 HydrophobicContact CZ2-CD1 3.67Å; W509-F692 AromaticContact CZ2-CE1 3.88Å; W509-F692 HydrophobicContact CZ2-CE1 3.88Å; W509-F692 HydrophobicContact CZ2-CG 4.39Å; Y597-F692 AromaticContact CD2-CD2 3.84Å; Y597-F692 HydrophobicContact CD2-CD2 3.84Å; Y597-F692 AromaticContact CD2-CE2 3.81Å; Y597-F692 HydrophobicContact CD2-CE2 3.81Å; Y597-F692 HydrophobicContact CE2-CD2 4.05Å; Y597-F692 HydrophobicContact CE2-CE2 4.47Å; P600-F692 HydrophobicContact CG-CB 4.32Å; E688-F692 WeakPolarHBondContact O-CB 3.42Å; E688-F692 PolarHBondContact O-N 3.11Å; I689-F692 PolarHBondContact O-N 3.19Å; F692-K694 VanDerWaalsContact C-N 3.3Å; F692-K694 PolarHBondContact O-N 3.48Å; F692-S695 VanDerWaalsContact O-CB 3.32Å; F692-S695 WeakPolarHBondContact O-CB 2.96Å; F692-S695 PolarHBondContact O-N 2.66Å; F692-S695 VanDerWaalsContact O-N 3.16Å; F692-L696 HydrophobicContact CD1-CD1 3.91Å; F692-L696 HydrophobicContact CD1-CG 4.42Å; F692-L696 HydrophobicContact CE1-CD1 3.41Å; F692-L696 VanDerWaalsContact CE1-CD1 3.41Å; F692-L696 HydrophobicContact CE1-CG 4.1Å; F692-L696 HydrophobicContact CZ-CD1 3.95Å; F692-L696 HydrophobicContact CZ-CD2 4.44Å; F692-L696 HydrophobicContact CZ-CG 4.28Å; F692-L696 WeakPolarHBondContact O-CG 3.39Å; F692-L696 PolarHBondContact O-N 3.49Å
693	N	89.5	Confident	88.1	Confident	23 Å²	23	58.7 Å²	58.7	12%	0.123	33%	0.325	C	S	.	.	H	α-helix	trans	-62.1	-37.1	176	-78.8	-20.5	0	0	0	112.5	I689 H690 L696 K697 I705 K706	I689-N693 WeakPolarHBondContact O-CB 3.5Å; I689-N693 PolarHBondContact O-N 2.8Å; H690-N693 PolarHBondContact O-N 3.08Å; N693-L696 PolarHBondContact O-N 2.85Å; N693-K697 PolarHBondContact O-N 2.92Å; N693-I705 HydrophobicContact CB-CG2 4.21Å; N693-K706 PolarHBondContact ND2-O 3.44Å; N693-K706 VanDerWaalsContact ND2-O 3.1Å
694	K	88.2	Confident	87.3	Confident	119 Å²	119	59.5 Å²	59.5	52%	0.517	33%	0.33	S	S	.	.	H	α-helix	trans	-66.5	-38.9	174.7	-170.2	179.5	179.4	-179.4	0	112	V602 H690 Q691 F692 K697 A698	V602-K694 HydrophobicContact CG2-CB 4.43Å; V602-K694 HydrophobicContact CG2-CD 4.39Å; V602-K694 HydrophobicContact CG2-CG 4.21Å; H690-K694 WeakPolarHBondContact O-CB 3.41Å; H690-K694 PolarHBondContact O-N 2.97Å; Q691-K694 WeakPolarHBondContact O-CB 3.36Å; Q691-K694 PolarHBondContact O-N 3.37Å; F692-K694 VanDerWaalsContact C-N 3.3Å; F692-K694 PolarHBondContact O-N 3.48Å; K694-K697 WeakPolarHBondContact O-CB 2.97Å; K694-K697 PolarHBondContact O-N 3.17Å; K694-A698 PolarHBondContact O-N 3.29Å
695	S	86.8	Confident	86.6	Confident	4 Å²	4	59.9 Å²	59.9	3%	0.028	33%	0.331	C	S	.	.	H	α-helix	trans	-60.7	-49.6	173.5	-165.8	0	0	0	0	111.2	S601 Q691 F692 K697 A698 E699	S601-S695 PolarHBondContact N-OG 2.83Å; S601-S695 PolarHBondContact OG-OG 3.36Å; Q691-S695 PolarHBondContact O-N 3.21Å; F692-S695 VanDerWaalsContact O-CB 3.32Å; F692-S695 WeakPolarHBondContact O-CB 2.96Å; F692-S695 PolarHBondContact O-N 2.66Å; F692-S695 VanDerWaalsContact O-N 3.16Å; S695-K697 PolarHBondContact O-N 2.76Å; S695-A698 WeakPolarHBondContact O-CB 3.26Å; S695-A698 PolarHBondContact O-N 3.22Å; S695-E699 WeakPolarHBondContact O-CG 3.45Å; S695-E699 PolarHBondContact O-N 3.34Å; S695-E699 PolarHBondContact OG-OE1 2.89Å
696	L	86.3	Confident	86.1	Confident	6 Å²	6	62.3 Å²	62.3	3%	0.031	34%	0.341	C	S	.	.	H	α-helix	trans	-58.3	-37.4	176.8	-71.3	178.7	0	0	0	112.3	F692 N693 E699 G700 R701 N704 I705	F692-L696 HydrophobicContact CD1-CD1 3.91Å; F692-L696 HydrophobicContact CD1-CG 4.42Å; F692-L696 HydrophobicContact CE1-CD1 3.41Å; F692-L696 VanDerWaalsContact CE1-CD1 3.41Å; F692-L696 HydrophobicContact CE1-CG 4.1Å; F692-L696 HydrophobicContact CZ-CD1 3.95Å; F692-L696 HydrophobicContact CZ-CD2 4.44Å; F692-L696 HydrophobicContact CZ-CG 4.28Å; F692-L696 WeakPolarHBondContact O-CG 3.39Å; F692-L696 PolarHBondContact O-N 3.49Å; N693-L696 PolarHBondContact O-N 2.85Å; L696-E699 PolarHBondContact O-N 3.07Å; L696-G700 PolarHBondContact O-N 3.09Å; L696-R701 HydrophobicContact CB-CB 4.48Å; L696-R701 HydrophobicContact CD2-CB 4.19Å; L696-R701 WeakPolarHBondContact O-CA 3.16Å; L696-R701 PolarHBondContact O-N 3.16Å; L696-N704 HydrophobicContact CD1-CB 4.29Å; L696-I705 HydrophobicContact CB-CG1 4.05Å
697	K	86.3	Confident	85.8	Confident	126 Å²	126	66.5 Å²	66.5	55%	0.548	36%	0.358	S	S	.	.	H	α-helix	trans	-64.2	-45.9	174.3	-166.6	171.9	-176.6	175.5	0	111.9	N693 K694 S695 E699 G700 E702 I705	N693-K697 PolarHBondContact O-N 2.92Å; K694-K697 WeakPolarHBondContact O-CB 2.97Å; K694-K697 PolarHBondContact O-N 3.17Å; S695-K697 PolarHBondContact O-N 2.76Å; K697-E699 VanDerWaalsContact C-N 3.29Å; K697-E699 PolarHBondContact O-N 3.41Å; K697-G700 PolarHBondContact O-N 2.96Å; K697-G700 VanDerWaalsContact O-N 3.15Å; K697-E702 WeakPolarHBondContact CE-OE1 3.31Å; K697-E702 HydrophobicContact CG-CG 4.15Å; K697-E702 WeakPolarHBondContact CG-OE1 3.18Å; K697-I705 HydrophobicContact CB-CD1 3.71Å; K697-I705 HydrophobicContact CG-CD1 4.24Å
698	A	85.3	Confident	85.7	Confident	82 Å²	82	65.1 Å²	65.1	68%	0.678	35%	0.345	S	S	*	.	H	α-helix	trans	-64.4	-33	178.9	0	0	0	0	0	112.8	K694 S695 G700	K694-A698 PolarHBondContact O-N 3.29Å; S695-A698 WeakPolarHBondContact O-CB 3.26Å; S695-A698 PolarHBondContact O-N 3.22Å; A698-G700 PolarHBondContact O-N 3.19Å
699	E	85.4	Confident	85.7	Confident	94 Å²	94	65 Å²	65	44%	0.439	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	1.3	176	-69.9	162.4	-145	0	0	113.7	S601 S695 L696 K697 R701	S601-E699 PolarHBondContact OG-OE1 3.24Å; S695-E699 WeakPolarHBondContact O-CG 3.45Å; S695-E699 PolarHBondContact O-N 3.34Å; S695-E699 PolarHBondContact OG-OE1 2.89Å; L696-E699 PolarHBondContact O-N 3.07Å; K697-E699 VanDerWaalsContact C-N 3.29Å; K697-E699 PolarHBondContact O-N 3.41Å; E699-R701 VanDerWaalsContact C-N 3.28Å; E699-R701 HydrophobicContact CB-CG 4.31Å; E699-R701 PolarHBondContact O-N 3.36Å; E699-R701 IonicContact OE2-NH1 3.79Å
700	G	82.1	Confident	85.8	Confident	63 Å²	63	65.3 Å²	65.3	65%	0.649	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	14.7	-178	0	0	0	0	0	114.5	L696 K697 A698 E702	L696-G700 PolarHBondContact O-N 3.09Å; K697-G700 PolarHBondContact O-N 2.96Å; K697-G700 VanDerWaalsContact O-N 3.15Å; A698-G700 PolarHBondContact O-N 3.19Å; G700-E702 VanDerWaalsContact C-N 3.33Å; G700-E702 PolarHBondContact O-N 2.83Å
701	R	83.2	Confident	86.1	Confident	119 Å²	119	59.2 Å²	59.2	45%	0.449	32%	0.321	S	S	.	.			trans	-95.3	41.6	-179.1	-63	174.9	68.6	-168.8	2	112.2	L696 E699 A703 N704	L696-R701 HydrophobicContact CB-CB 4.48Å; L696-R701 HydrophobicContact CD2-CB 4.19Å; L696-R701 WeakPolarHBondContact O-CA 3.16Å; L696-R701 PolarHBondContact O-N 3.16Å; E699-R701 VanDerWaalsContact C-N 3.28Å; E699-R701 HydrophobicContact CB-CG 4.31Å; E699-R701 PolarHBondContact O-N 3.36Å; E699-R701 IonicContact OE2-NH1 3.79Å; R701-A703 PolarHBondContact O-N 3.34Å; R701-A703 VanDerWaalsContact O-N 3.15Å; R701-N704 PolarHBondContact NE-ND2 2.72Å; R701-N704 PolarHBondContact O-N 3.11Å
702	E	77.2	Confident	86.5	Confident	115 Å²	115	57.2 Å²	57.2	54%	0.537	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-59.5	-29.8	-173.6	-64.7	-166	153.5	0	0	113.8	K697 G700 N704 I705	K697-E702 WeakPolarHBondContact CE-OE1 3.31Å; K697-E702 HydrophobicContact CG-CG 4.15Å; K697-E702 WeakPolarHBondContact CG-OE1 3.18Å; G700-E702 VanDerWaalsContact C-N 3.33Å; G700-E702 PolarHBondContact O-N 2.83Å; E702-N704 PolarHBondContact O-N 3.28Å; E702-N704 VanDerWaalsContact O-N 3.11Å; E702-I705 HydrophobicContact CB-CD1 4.35Å; E702-I705 HydrophobicContact CG-CD1 4.37Å; E702-I705 WeakPolarHBondContact O-CB 3.28Å; E702-I705 PolarHBondContact O-N 2.89Å; E702-I705 VanDerWaalsContact O-N 3.09Å
703	A	74	Confident	87	Confident	96 Å²	96	56.2 Å²	56.2	79%	0.793	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-63	-16.5	177.4	0	0	0	0	0	114.3	R701	R701-A703 PolarHBondContact O-N 3.34Å; R701-A703 VanDerWaalsContact O-N 3.15Å
704	N	78.1	Confident	87.4	Confident	70 Å²	70	55.2 Å²	55.2	37%	0.374	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-96.6	-6.7	178.7	-63.6	-25.6	0	0	0	113	L696 R701 E702	L696-N704 HydrophobicContact CD1-CB 4.29Å; R701-N704 PolarHBondContact NE-ND2 2.72Å; R701-N704 PolarHBondContact O-N 3.11Å; E702-N704 PolarHBondContact O-N 3.28Å; E702-N704 VanDerWaalsContact O-N 3.11Å
705	I	80.4	Confident	87.8	Confident	59 Å²	59	49.6 Å²	49.6	30%	0.303	28%	0.278	S	S	.	.			trans	-74	129	179.2	-60.8	174	0	0	0	108.8	N693 L696 K697 E702	N693-I705 HydrophobicContact CB-CG2 4.21Å; L696-I705 HydrophobicContact CB-CG1 4.05Å; K697-I705 HydrophobicContact CB-CD1 3.71Å; K697-I705 HydrophobicContact CG-CD1 4.24Å; E702-I705 HydrophobicContact CB-CD1 4.35Å; E702-I705 HydrophobicContact CG-CD1 4.37Å; E702-I705 WeakPolarHBondContact O-CB 3.28Å; E702-I705 PolarHBondContact O-N 2.89Å; E702-I705 VanDerWaalsContact O-N 3.09Å
706	K	84.8	Confident	88.2	Confident	54 Å²	54	49.6 Å²	49.6	24%	0.235	28%	0.278	C	S	.	.			trans	-123.2	141.2	174.3	-67.3	176.5	176	-170.5	0	109.7	K470 D473 N693	K470-K706 WeakPolarHBondContact O-CE 3.3Å; D473-K706 HydrophobicContact CB-CB 4.24Å; D473-K706 WeakPolarHBondContact OD1-CD 3.42Å; D473-K706 IonicContact OD1-NZ 2.73Å; N693-K706 PolarHBondContact ND2-O 3.44Å; N693-K706 VanDerWaalsContact ND2-O 3.1Å
707	K	88.3	Confident	88.5	Confident	112 Å²	112	49.6 Å²	49.6	49%	0.487	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	132.8	174.4	-174	-177.9	174.9	-176.5	0	108.1	I472 D473 G709 I774 D775	I472-K707 WeakPolarHBondContact CA-O 3.5Å; D473-K707 PolarHBondContact N-O 3.44Å; K707-G709 PolarHBondContact O-N 3.35Å; K707-I774 WeakPolarHBondContact CE-O 3.33Å; K707-I774 PolarHBondContact NZ-O 3.02Å; K707-D775 IonicContact NZ-OD2 3.96Å
708	L	91.7	Very high	88.7	Confident	15 Å²	15	47.2 Å²	47.2	8%	0.079	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	121	168.3	-174	64.9	0	0	0	108.1	L475 M686 I689 V711 T776	L475-L708 HydrophobicContact CB-CD1 3.66Å; L475-L708 HydrophobicContact CD2-CD2 4.48Å; M686-L708 HydrophobicContact CG-CD2 4.12Å; I689-L708 HydrophobicContact CD1-CD1 4.35Å; L708-V711 HydrophobicContact CD1-CG2 4.24Å; L708-V711 HydrophobicContact CD2-CG2 3.6Å; L708-V711 HydrophobicContact CG-CG2 3.96Å; L708-T776 HydrophobicContact CD2-CG2 4.41Å; L708-T776 HydrophobicContact CG-CG2 4.09Å; L708-T776 PolarHBondContact O-OG1 3.43Å
709	G	90.9	Very high	88.8	Confident	13 Å²	13	46.7 Å²	46.7	13%	0.134	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	-26.7	-177.7	0	0	0	0	0	114.2	I472 D473 K707 I777	I472-G709 VanDerWaalsContact CG2-CA 3.45Å; D473-G709 PolarHBondContact O-N 3.07Å; K707-G709 PolarHBondContact O-N 3.35Å; G709-I777 PolarHBondContact O-N 2.79Å
710	I	95.3	Very high	88.9	Confident	10 Å²	10	44 Å²	44	5%	0.051	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	134.2	-179.4	-50.5	173.2	0	0	0	109.1	R474 L475 V712 I777 L820 T823 L824	R474-I710 HydrophobicContact CG-CD1 4.32Å; L475-I710 PolarHBondContact N-O 3.17Å; I710-V712 HydrophobicContact CG2-CG2 4.07Å; I710-I777 CarbonylContact C-O 3.35Å; I710-I777 WeakPolarHBondContact CA-O 3.46Å; I710-L820 HydrophobicContact CG2-CD1 4.41Å; I710-T823 HydrophobicContact CD1-CG2 3.48Å; I710-T823 VanDerWaalsContact CD1-CG2 3.48Å; I710-T823 WeakPolarHBondContact CD1-O 3.29Å; I710-T823 HydrophobicContact CG1-CG2 4.31Å; I710-L824 HydrophobicContact CD1-CD2 4.2Å; I710-L824 HydrophobicContact CG2-CD2 4.35Å
711	V	97.3	Very high	89	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	119.1	171.8	177.4	0	0	0	0	108.4	L475 T682 L708 T776 I777 Y778 H779	L475-V711 HydrophobicContact CB-CG2 4.25Å; L475-V711 HydrophobicContact CD2-CG1 4.16Å; L475-V711 HydrophobicContact CD2-CG2 4.09Å; L475-V711 WeakPolarHBondContact O-CA 3.46Å; T682-V711 HydrophobicContact CG2-CG1 3.72Å; L708-V711 HydrophobicContact CD1-CG2 4.24Å; L708-V711 HydrophobicContact CD2-CG2 3.6Å; L708-V711 HydrophobicContact CG-CG2 3.96Å; V711-T776 HydrophobicContact CB-CG2 4.44Å; V711-T776 HydrophobicContact CG2-CG2 3.68Å; V711-I777 PolarHBondContact N-O 2.94Å; V711-Y778 HydrophobicContact CB-CD2 4.01Å; V711-Y778 HydrophobicContact CG1-CD2 3.76Å; V711-Y778 HydrophobicContact CG1-CE2 4Å; V711-Y778 WeakPolarHBondContact O-CA 3.39Å; V711-H779 PolarHBondContact O-N 3.19Å
712	V	97.6	Very high	88.8	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115	174.2	-176.8	0	0	0	0	108.1	L475 L476 C477 F507 I710 L714 H779 L820	L475-V712 PolarHBondContact O-N 2.86Å; L476-V712 CarbonylContact C-O 3.56Å; L476-V712 WeakPolarHBondContact CA-O 3.48Å; L476-V712 HydrophobicContact CD1-CB 4.25Å; L476-V712 HydrophobicContact CD1-CG1 4.2Å; C477-V712 PolarHBondContact N-O 3.11Å; F507-V712 HydrophobicContact CE1-CB 4.01Å; F507-V712 HydrophobicContact CE1-CG2 3.73Å; F507-V712 HydrophobicContact CZ-CB 4.17Å; F507-V712 HydrophobicContact CZ-CG2 4.01Å; I710-V712 HydrophobicContact CG2-CG2 4.07Å; V712-L714 HydrophobicContact CG1-CD2 3.8Å; V712-L714 HydrophobicContact CG1-CG 4.25Å; V712-H779 WeakPolarHBondContact CA-O 3.47Å; V712-L820 HydrophobicContact CG1-CD2 4.14Å; V712-L820 HydrophobicContact CG2-CD1 3.67Å; V712-L820 HydrophobicContact CG2-CD2 4.09Å; V712-L820 HydrophobicContact CG2-CG 4.46Å
713	S	97.8	Very high	88.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	121.8	176	178.4	0	0	0	0	109.8	C477 T682 H779 R780 L781	C477-S713 WeakPolarHBondContact O-CA 3.23Å; T682-S713 PolarHBondContact OG1-OG 3.29Å; S713-H779 PolarHBondContact N-O 3.39Å; S713-R780 WeakPolarHBondContact O-CA 3.46Å; S713-R780 WeakPolarHBondContact O-CD 3.32Å; S713-R780 PolarHBondContact OG-NH1 2.66Å; S713-L781 PolarHBondContact O-N 3.03Å
714	L	97.8	Very high	88.7	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.016	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.8	-178.6	-59.4	-171.3	0	0	0	110	L476 C477 L478 D479 L488 M491 L492 V712 L781	L476-L714 HydrophobicContact CD1-CD1 3.92Å; L476-L714 HydrophobicContact CD1-CG 4.03Å; C477-L714 PolarHBondContact O-N 3.2Å; L478-L714 HydrophobicContact CD2-CB 4.05Å; L478-L714 HydrophobicContact CD2-CD1 3.83Å; L478-L714 HydrophobicContact CD2-CG 4.25Å; D479-L714 VanDerWaalsContact CG-O 3.31Å; D479-L714 PolarHBondContact N-O 3.04Å; D479-L714 VanDerWaalsContact N-O 3.14Å; L488-L714 VanDerWaalsContact CD2-C 3.47Å; L488-L714 HydrophobicContact CD2-CB 3.69Å; L488-L714 VanDerWaalsContact CD2-O 3.22Å; L488-L714 WeakPolarHBondContact CD2-O 3.39Å; M491-L714 HydrophobicContact CB-CD1 4.48Å; M491-L714 HydrophobicContact CE-CB 4.05Å; M491-L714 HydrophobicContact CE-CD2 4.4Å; L492-L714 HydrophobicContact CD2-CD1 3.56Å; L492-L714 HydrophobicContact CG-CD1 3.82Å; V712-L714 HydrophobicContact CG1-CD2 3.8Å; V712-L714 HydrophobicContact CG1-CG 4.25Å; L714-L781 WeakPolarHBondContact CA-O 3.45Å; L714-L781 HydrophobicContact CD2-CB 3.81Å; L714-L781 HydrophobicContact CD2-CD1 3.92Å; L714-L781 HydrophobicContact CD2-CG 4.24Å
715	G	96.5	Very high	87.8	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.295	C	S	.	.			trans	-100.1	152.1	179.6	0	0	0	0	0	113.6	D479 L488 M491 G717 R780 L781	D479-G715 WeakPolarHBondContact OD2-CA 3.49Å; L488-G715 VanDerWaalsContact CD2-C 3.48Å; L488-G715 WeakPolarHBondContact CD2-O 3.44Å; M491-G715 WeakPolarHBondContact CE-O 3.46Å; G715-G717 PolarHBondContact O-N 3.36Å; G715-G717 VanDerWaalsContact O-N 3.07Å; G715-R780 VanDerWaalsContact CA-NH2 3.27Å; G715-L781 PolarHBondContact N-O 3.47Å
716	T	95.2	Very high	86.7	Confident	4 Å²	4	57.3 Å²	57.3	3%	0.025	32%	0.315	C	S	.	.	S	Bend	trans	-80.7	24	179.4	61.6	0	0	0	0	114	G480 L488 T515	G480-T716 PolarHBondContact O-OG1 3.3Å; L488-T716 HydrophobicContact CD1-CG2 3.89Å; L488-T716 HydrophobicContact CD2-CG2 4.07Å; L488-T716 HydrophobicContact CG-CG2 3.88Å; T515-T716 HydrophobicContact CG2-CG2 4.36Å
717	G	92.9	Very high	85.4	Confident	6 Å²	6	57.3 Å²	57.3	6%	0.062	32%	0.32	C	S	.	.			trans	87.4	147.4	-177.8	0	0	0	0	0	114.3	G715 P783	G715-G717 PolarHBondContact O-N 3.36Å; G715-G717 VanDerWaalsContact O-N 3.07Å; G717-P783 CarbonylContact C-O 3.54Å; G717-P783 WeakPolarHBondContact CA-O 3.39Å
718	K	91.3	Very high	83.9	Confident	77 Å²	77	57 Å²	57	34%	0.335	32%	0.323	S	S	.	.	B	Isolated β-bridge	trans	-96.4	125.8	-178.9	-60.9	178.7	-178.4	-175.7	0	110.2	D760 P783 Q784 L785	K718-D760 WeakPolarHBondContact CE-OD1 3.26Å; K718-D760 HydrophobicContact CG-CB 4.34Å; K718-D760 IonicContact NZ-OD1 2.7Å; K718-P783 PolarHBondContact N-O 2.95Å; K718-Q784 PolarHBondContact O-NE2 2.75Å; K718-Q784 VanDerWaalsContact O-NE2 3.16Å; K718-L785 WeakPolarHBondContact O-CB 3.09Å; K718-L785 PolarHBondContact O-N 2.97Å
719	P	88	Confident	82.3	Confident	70 Å²	70	59.6 Å²	59.6	46%	0.455	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-65.5	158.4	172.1	29.3	-33.8	0	0	0	110.9	Q784	P719-Q784 VanDerWaalsContact C-NE2 3.32Å; P719-Q784 PolarHBondContact O-NE2 2.93Å
720	P	87.7	Confident	80.6	Confident	39 Å²	39	66 Å²	66	25%	0.253	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-63.3	149.2	171.8	28.9	-35.4	0	0	0	110.8	E722	P720-E722 PolarHBondContact O-N 3.43Å
721	Q	83	Confident	78.7	Confident	199 Å²	199	76.9 Å²	76.9	93%	0.93	41%	0.405	S	S	*	.			trans	-79.3	115.8	177.3	-172.6	176.9	1.5	0	0	110
722	E	79	Confident	76.6	Confident	138 Å²	138	79 Å²	79	65%	0.645	42%	0.419	S	S	*	.			trans	-103.1	144.1	176.7	-62.7	-171.2	171.2	0	0	111.6	P720	P720-E722 PolarHBondContact O-N 3.43Å
723	V	77.8	Confident	74.7	Confident	138 Å²	138	83.7 Å²	83.7	84%	0.836	45%	0.451	S	S	*	.			trans	-85.2	114.7	176.9	-179	0	0	0	0	108.9	T725	V723-T725 PolarHBondContact O-N 2.73Å
724	V	72.1	Confident	73.2	Confident	99 Å²	99	88.6 Å²	88.6	60%	0.6	48%	0.477	S	S	*	.			trans	-84.8	111.5	175.1	-175.8	0	0	0	0	109.7	S726 V727	V724-S726 PolarHBondContact O-N 2.85Å; V724-V727 HydrophobicContact CG1-CG2 3.96Å
725	T	58.1	Low	71.3	Confident	121 Å²	121	93.7 Å²	93.7	74%	0.742	51%	0.511	S	S	*	.			trans	-79.5	101.1	175.2	53.2	0	0	0	0	110.6	V723	V723-T725 PolarHBondContact O-N 2.73Å
726	S	57.2	Low	69.6	Low	105 Å²	105	100.3 Å²	100.3	73%	0.734	55%	0.545	S	S	*	.			trans	50.2	105.4	168.3	60.7	0	0	0	0	117.4	V724 D728	V724-S726 PolarHBondContact O-N 2.85Å; S726-D728 PolarHBondContact O-N 3.44Å
727	V	58.9	Low	68	Low	54 Å²	54	104 Å²	104	33%	0.327	56%	0.562	S	S	.	*			trans	-87.8	81.2	164.6	-174	0	0	0	0	108.3	V724 V729 L748	V724-V727 HydrophobicContact CG1-CG2 3.96Å; V727-V729 HydrophobicContact CG1-CG2 3.87Å; V727-L748 HydrophobicContact CG1-CB 3.87Å; V727-L748 HydrophobicContact CG1-CD1 4.04Å; V727-L748 HydrophobicContact CG1-CG 4.47Å
728	D	55.1	Low	66.5	Low	106 Å²	106	107.8 Å²	107.8	57%	0.567	58%	0.58	S	S	*	*			trans	-96.7	99.5	179.2	-157.5	9.7	0	0	0	110.3	S726 F730	S726-D728 PolarHBondContact O-N 3.44Å; D728-F730 PolarHBondContact O-N 3.32Å; D728-F730 WeakPolarHBondContact OD1-CD2 3.48Å; D728-F730 WeakPolarHBondContact OD1-CE2 3.44Å
729	V	58.1	Low	65	Low	69 Å²	69	106.6 Å²	106.6	42%	0.418	59%	0.585	S	S	.	*			trans	-101.5	69.4	-176.8	-167.1	0	0	0	0	109.6	V727 T741 L748	V727-V729 HydrophobicContact CG1-CG2 3.87Å; V729-T741 HydrophobicContact CG1-CG2 4.2Å; V729-L748 HydrophobicContact CG2-CD2 4.21Å
730	F	56.8	Low	63.8	Low	149 Å²	149	110.5 Å²	110.5	65%	0.654	60%	0.595	S	S	*	*			trans	-80.6	149.3	170.1	-93.7	-85.3	0	0	0	112.1	D728 P732 T741	D728-F730 PolarHBondContact O-N 3.32Å; D728-F730 WeakPolarHBondContact OD1-CD2 3.48Å; D728-F730 WeakPolarHBondContact OD1-CE2 3.44Å; F730-P732 WeakPolarHBondContact O-CD 3.2Å; F730-T741 WeakPolarHBondContact O-CG2 3.45Å; F730-T741 PolarHBondContact O-OG1 3.5Å
731	R	54.4	Low	62.7	Low	238 Å²	238	110 Å²	110	90%	0.898	59%	0.591	S	S	*	*			trans	-68.5	114.3	170.8	-169.4	176.4	-172.8	152.4	1	108.3
732	P	53.3	Low	61.7	Low	45 Å²	45	107.3 Å²	107.3	29%	0.292	58%	0.577	S	S	.	*			trans	-74.2	139.4	-164.3	24.6	-30	0	0	0	112.3	F730 E737 L738	F730-P732 WeakPolarHBondContact O-CD 3.2Å; P732-E737 HydrophobicContact CB-CB 3.89Å; P732-L738 HydrophobicContact CB-CB 4.28Å; P732-L738 HydrophobicContact CB-CD1 4.4Å; P732-L738 HydrophobicContact CG-CB 4.31Å; P732-L738 HydrophobicContact CG-CD1 3.62Å; P732-L738 HydrophobicContact CG-CG 4.43Å
733	S	59	Low	61	Low	97 Å²	97	105.1 Å²	105.1	68%	0.678	57%	0.572	S	S	*	*	S	Bend	trans	-96	-23.2	175.6	7.6	0	0	0	0	112.5	E737	S733-E737 PolarHBondContact N-OE2 2.69Å; S733-E737 PolarHBondContact OG-OE2 2.97Å
734	N	64.9	Low	60.5	Low	104 Å²	104	99 Å²	99	56%	0.556	54%	0.538	S	S	*	.	S	Bend	trans	-133.7	158.8	-176.5	-81.1	-23.8	0	0	0	113.5	L736 E737 L738	N734-L736 VanDerWaalsContact C-N 3.3Å; N734-L736 PolarHBondContact O-N 2.96Å; N734-E737 HydrophobicContact CB-CG 4.45Å; N734-E737 PolarHBondContact N-OE2 3.09Å; N734-E737 WeakPolarHBondContact O-CB 3.29Å; N734-E737 PolarHBondContact O-N 3Å; N734-E737 VanDerWaalsContact O-N 3.07Å; N734-L738 PolarHBondContact O-N 3.22Å
735	P	58.8	Low	60.3	Low	110 Å²	110	96.6 Å²	96.6	71%	0.714	53%	0.528	S	S	*	.	H	α-helix	trans	-61	-31.1	-178.8	-23.3	33.1	0	0	0	115	L738 A739	P735-L738 WeakPolarHBondContact O-CB 3.43Å; P735-A739 PolarHBondContact O-N 2.84Å
736	L	59.5	Low	61.1	Low	138 Å²	138	98.2 Å²	98.2	72%	0.723	52%	0.524	S	S	*	.	H	α-helix	trans	-74.4	-31.6	176.1	-168.9	70.7	0	0	0	112.1	N734 K740	N734-L736 VanDerWaalsContact C-N 3.3Å; N734-L736 PolarHBondContact O-N 2.96Å; L736-K740 PolarHBondContact O-N 3.32Å
737	E	61.7	Low	61.9	Low	83 Å²	83	97.2 Å²	97.2	39%	0.388	51%	0.508	S	S	.	.	H	α-helix	trans	-72.2	-35.2	173.3	-67.6	179.8	164.3	0	0	110.9	P732 S733 N734 A739 K740 T741	P732-E737 HydrophobicContact CB-CB 3.89Å; S733-E737 PolarHBondContact N-OE2 2.69Å; S733-E737 PolarHBondContact OG-OE2 2.97Å; N734-E737 HydrophobicContact CB-CG 4.45Å; N734-E737 PolarHBondContact N-OE2 3.09Å; N734-E737 WeakPolarHBondContact O-CB 3.29Å; N734-E737 PolarHBondContact O-N 3Å; N734-E737 VanDerWaalsContact O-N 3.07Å; E737-A739 VanDerWaalsContact C-N 3.29Å; E737-A739 PolarHBondContact O-N 2.99Å; E737-K740 PolarHBondContact O-N 3.36Å; E737-K740 VanDerWaalsContact O-N 3.09Å; E737-T741 PolarHBondContact O-N 2.79Å; E737-T741 PolarHBondContact O-OG1 3.08Å
738	L	61.8	Low	62.8	Low	84 Å²	84	97.5 Å²	97.5	44%	0.44	51%	0.508	S	S	.	.	H	α-helix	trans	-54.7	-44.9	174	-164.7	93.4	0	0	0	111.3	P732 N734 P735 K740 T741 F742	P732-L738 HydrophobicContact CB-CB 4.28Å; P732-L738 HydrophobicContact CB-CD1 4.4Å; P732-L738 HydrophobicContact CG-CB 4.31Å; P732-L738 HydrophobicContact CG-CD1 3.62Å; P732-L738 HydrophobicContact CG-CG 4.43Å; N734-L738 PolarHBondContact O-N 3.22Å; P735-L738 WeakPolarHBondContact O-CB 3.43Å; L738-K740 PolarHBondContact O-N 2.77Å; L738-T741 PolarHBondContact O-N 3.01Å; L738-F742 HydrophobicContact CD1-CE2 4.36Å; L738-F742 HydrophobicContact CD2-CD2 4.28Å; L738-F742 HydrophobicContact CD2-CE2 3.69Å; L738-F742 HydrophobicContact CG-CD2 3.97Å; L738-F742 HydrophobicContact CG-CE2 3.64Å; L738-F742 WeakPolarHBondContact O-CD2 3.41Å; L738-F742 PolarHBondContact O-N 3.36Å
739	A	60.2	Low	63.8	Low	53 Å²	53	94 Å²	94	44%	0.438	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-39.5	177	0	0	0	0	0	112.7	P735 E737 F742 V743	P735-A739 PolarHBondContact O-N 2.84Å; E737-A739 VanDerWaalsContact C-N 3.29Å; E737-A739 PolarHBondContact O-N 2.99Å; A739-F742 PolarHBondContact O-N 3.14Å; A739-V743 WeakPolarHBondContact O-CG2 3.38Å; A739-V743 PolarHBondContact O-N 3.2Å; A739-V743 VanDerWaalsContact O-N 3.17Å
740	K	62.1	Low	64.8	Low	152 Å²	152	94.9 Å²	94.9	66%	0.661	50%	0.495	S	S	*	.	H	α-helix	trans	-67	-40.4	174.3	-69.6	-177.2	177.9	-178.2	0	111.9	L736 E737 L738 F742 V743 G744	L736-K740 PolarHBondContact O-N 3.32Å; E737-K740 PolarHBondContact O-N 3.36Å; E737-K740 VanDerWaalsContact O-N 3.09Å; L738-K740 PolarHBondContact O-N 2.77Å; K740-F742 VanDerWaalsContact C-N 3.34Å; K740-F742 PolarHBondContact O-N 3.17Å; K740-V743 PolarHBondContact O-N 3.45Å; K740-G744 PolarHBondContact O-N 2.82Å
741	T	64.2	Low	65.9	Low	28 Å²	28	92.2 Å²	92.2	17%	0.172	49%	0.486	C	S	.	.	H	α-helix	trans	-64	-37.5	174.3	-51.2	0	0	0	0	111.6	V729 F730 E737 L738 G744 A745	V729-T741 HydrophobicContact CG1-CG2 4.2Å; F730-T741 WeakPolarHBondContact O-CG2 3.45Å; F730-T741 PolarHBondContact O-OG1 3.5Å; E737-T741 PolarHBondContact O-N 2.79Å; E737-T741 PolarHBondContact O-OG1 3.08Å; L738-T741 PolarHBondContact O-N 3.01Å; T741-G744 PolarHBondContact O-N 3.38Å; T741-A745 WeakPolarHBondContact O-CB 3.41Å; T741-A745 PolarHBondContact O-N 3.45Å
742	F	62	Low	67.3	Low	143 Å²	143	85.7 Å²	85.7	63%	0.627	47%	0.468	S	S	*	.	H	α-helix	trans	-64.2	-42.5	175.4	-88.2	-68.7	0	0	0	112.5	L738 A739 K740 K746	L738-F742 HydrophobicContact CD1-CE2 4.36Å; L738-F742 HydrophobicContact CD2-CD2 4.28Å; L738-F742 HydrophobicContact CD2-CE2 3.69Å; L738-F742 HydrophobicContact CG-CD2 3.97Å; L738-F742 HydrophobicContact CG-CE2 3.64Å; L738-F742 WeakPolarHBondContact O-CD2 3.41Å; L738-F742 PolarHBondContact O-N 3.36Å; A739-F742 PolarHBondContact O-N 3.14Å; K740-F742 VanDerWaalsContact C-N 3.34Å; K740-F742 PolarHBondContact O-N 3.17Å; F742-K746 WeakPolarHBondContact O-CB 3.41Å; F742-K746 PolarHBondContact O-N 3.15Å; F742-K746 VanDerWaalsContact O-N 3.12Å
743	V	65.9	Low	68.7	Low	91 Å²	91	87.4 Å²	87.4	55%	0.552	48%	0.478	S	S	*	.	H	α-helix	trans	-65.8	-47.4	174.5	176.1	0	0	0	0	110.2	A739 K740 A745 K746 E747	A739-V743 WeakPolarHBondContact O-CG2 3.38Å; A739-V743 PolarHBondContact O-N 3.2Å; A739-V743 VanDerWaalsContact O-N 3.17Å; K740-V743 PolarHBondContact O-N 3.45Å; V743-A745 PolarHBondContact O-N 3.01Å; V743-K746 WeakPolarHBondContact O-CB 3.38Å; V743-K746 PolarHBondContact O-N 3.02Å; V743-E747 WeakPolarHBondContact O-CG 3.27Å; V743-E747 PolarHBondContact O-N 2.98Å
744	G	66.1	Low	69.8	Low	11 Å²	11	86.5 Å²	86.5	11%	0.113	47%	0.465	C	S	.	.	H	α-helix	trans	-61.6	-38.3	178.1	0	0	0	0	0	113.8	K740 T741 E747 L748	K740-G744 PolarHBondContact O-N 2.82Å; T741-G744 PolarHBondContact O-N 3.38Å; G744-E747 PolarHBondContact O-N 3.48Å; G744-L748 WeakPolarHBondContact O-CB 3.22Å; G744-L748 PolarHBondContact O-N 2.88Å
745	A	69.3	Low	70.7	Confident	47 Å²	47	85.9 Å²	85.9	39%	0.388	47%	0.468	S	S	.	.	H	α-helix	trans	-68.8	-34.9	176	0	0	0	0	0	112.5	T741 V743 G749	T741-A745 WeakPolarHBondContact O-CB 3.41Å; T741-A745 PolarHBondContact O-N 3.45Å; V743-A745 PolarHBondContact O-N 3.01Å; A745-G749 PolarHBondContact O-N 3.09Å
746	K	73	Confident	71.9	Confident	155 Å²	155	84.4 Å²	84.4	67%	0.674	46%	0.459	S	S	*	.	H	α-helix	trans	-66.6	-46.1	174.1	-175.3	-172.9	173.8	-168.4	0	111.4	F742 V743 G749 K750	F742-K746 WeakPolarHBondContact O-CB 3.41Å; F742-K746 PolarHBondContact O-N 3.15Å; F742-K746 VanDerWaalsContact O-N 3.12Å; V743-K746 WeakPolarHBondContact O-CB 3.38Å; V743-K746 PolarHBondContact O-N 3.02Å; K746-G749 PolarHBondContact O-N 3.33Å; K746-K750 PolarHBondContact O-N 3.29Å
747	E	74.1	Confident	73.2	Confident	84 Å²	84	79.7 Å²	79.7	39%	0.393	44%	0.436	S	S	.	.	H	α-helix	trans	-64.2	-41.1	176.8	-66.4	-51.8	135.9	0	0	111.8	V743 G744 G749 K750 M751	V743-E747 WeakPolarHBondContact O-CG 3.27Å; V743-E747 PolarHBondContact O-N 2.98Å; G744-E747 PolarHBondContact O-N 3.48Å; E747-G749 VanDerWaalsContact C-N 3.32Å; E747-G749 PolarHBondContact O-N 3.34Å; E747-K750 PolarHBondContact O-N 3.37Å; E747-M751 WeakPolarHBondContact O-CB 3.44Å; E747-M751 PolarHBondContact O-N 3.01Å
748	L	77.6	Confident	74.4	Confident	61 Å²	61	79.6 Å²	79.6	32%	0.319	44%	0.438	S	S	.	.	H	α-helix	trans	-61.2	-41.7	173	-174.1	68.1	0	0	0	111.7	V727 V729 G744 M751 L752	V727-L748 HydrophobicContact CG1-CB 3.87Å; V727-L748 HydrophobicContact CG1-CD1 4.04Å; V727-L748 HydrophobicContact CG1-CG 4.47Å; V729-L748 HydrophobicContact CG2-CD2 4.21Å; G744-L748 WeakPolarHBondContact O-CB 3.22Å; G744-L748 PolarHBondContact O-N 2.88Å; L748-M751 HydrophobicContact CD1-CE 3.86Å; L748-M751 PolarHBondContact O-N 3.26Å; L748-L752 WeakPolarHBondContact O-CG 3.43Å; L748-L752 PolarHBondContact O-N 3.48Å
749	G	77.9	Confident	75.7	Confident	33 Å²	33	76.2 Å²	76.2	34%	0.34	42%	0.422	S	S	.	.	H	α-helix	trans	-61.2	-44	175.1	0	0	0	0	0	112.6	A745 K746 E747 L752 V753	A745-G749 PolarHBondContact O-N 3.09Å; K746-G749 PolarHBondContact O-N 3.33Å; E747-G749 VanDerWaalsContact C-N 3.32Å; E747-G749 PolarHBondContact O-N 3.34Å; G749-L752 PolarHBondContact O-N 3.11Å; G749-V753 WeakPolarHBondContact O-CG2 3.21Å; G749-V753 PolarHBondContact O-N 3.13Å
750	K	77.3	Confident	77	Confident	86 Å²	86	75 Å²	75	37%	0.374	41%	0.408	S	S	.	.	H	α-helix	trans	-59.8	-50	174	-170.9	-175	174.6	-173.2	0	110.2	K746 E747 L752 V753 D754 E788	K746-K750 PolarHBondContact O-N 3.29Å; E747-K750 PolarHBondContact O-N 3.37Å; K750-L752 VanDerWaalsContact C-N 3.3Å; K750-L752 PolarHBondContact O-N 2.86Å; K750-V753 PolarHBondContact O-N 3.2Å; K750-D754 VanDerWaalsContact O-CG 3.26Å; K750-D754 PolarHBondContact O-N 2.68Å; K750-E788 IonicContact NZ-OE1 3.61Å; K750-E788 PolarHBondContact NZ-OE1 3.16Å; K750-E788 IonicContact NZ-OE2 3.41Å; K750-E788 PolarHBondContact NZ-OE2 3.06Å
751	M	80.4	Confident	78.3	Confident	93 Å²	93	69 Å²	69	46%	0.458	39%	0.389	S	S	.	.	H	α-helix	trans	-58.6	-38	179.3	-166.8	-176.4	80.8	0	0	112.9	E747 L748 D754 C755	E747-M751 WeakPolarHBondContact O-CB 3.44Å; E747-M751 PolarHBondContact O-N 3.01Å; L748-M751 HydrophobicContact CD1-CE 3.86Å; L748-M751 PolarHBondContact O-N 3.26Å; M751-D754 PolarHBondContact O-N 3.19Å; M751-C755 WeakPolarHBondContact O-CB 3.47Å; M751-C755 PolarHBondContact O-N 2.76Å; M751-C755 PolarHBondContact O-SG 3.08Å
752	L	83.3	Confident	79.4	Confident	102 Å²	102	71.2 Å²	71.2	53%	0.534	41%	0.405	S	S	.	.	H	α-helix	trans	-64.3	-42.5	175	-77.6	170.1	0	0	0	112.2	L748 G749 K750 C755 C756	L748-L752 WeakPolarHBondContact O-CG 3.43Å; L748-L752 PolarHBondContact O-N 3.48Å; G749-L752 PolarHBondContact O-N 3.11Å; K750-L752 VanDerWaalsContact C-N 3.3Å; K750-L752 PolarHBondContact O-N 2.86Å; L752-C755 PolarHBondContact O-N 2.97Å; L752-C756 PolarHBondContact O-N 2.77Å; L752-C756 PolarHBondContact O-SG 2.87Å
753	V	83.4	Confident	80.8	Confident	81 Å²	81	65.4 Å²	65.4	49%	0.491	38%	0.384	S	S	.	.	H	α-helix	trans	-65.4	-42.9	175.9	175.3	0	0	0	0	110.3	G749 K750 C755 C756 T757	G749-V753 WeakPolarHBondContact O-CG2 3.21Å; G749-V753 PolarHBondContact O-N 3.13Å; K750-V753 PolarHBondContact O-N 3.2Å; V753-C755 VanDerWaalsContact C-N 3.35Å; V753-C755 PolarHBondContact O-N 3.14Å; V753-C756 PolarHBondContact O-N 3.21Å; V753-T757 HydrophobicContact CG1-CG2 4.31Å; V753-T757 WeakPolarHBondContact O-CB 3.44Å; V753-T757 WeakPolarHBondContact O-CG2 3.26Å; V753-T757 PolarHBondContact O-N 3.38Å; V753-T757 PolarHBondContact O-OG1 3.41Å
754	D	82.4	Confident	82.2	Confident	77 Å²	77	61.3 Å²	61.3	41%	0.412	36%	0.359	S	S	.	.	H	α-helix	trans	-61.6	-43.2	178	-64.5	-19.4	0	0	0	110.9	K750 M751 C756 T757 D758	K750-D754 VanDerWaalsContact O-CG 3.26Å; K750-D754 PolarHBondContact O-N 2.68Å; M751-D754 PolarHBondContact O-N 3.19Å; D754-C756 PolarHBondContact O-N 3.25Å; D754-T757 CarbonylContact O-C 3.17Å; D754-T757 PolarHBondContact O-N 3.01Å; D754-D758 WeakPolarHBondContact O-CB 3.11Å; D754-D758 PolarHBondContact O-N 2.86Å
755	C	83.6	Confident	83.5	Confident	92 Å²	92	65.3 Å²	65.3	62%	0.622	38%	0.378	S	S	*	.	H	α-helix	trans	-63.3	-38.3	174.3	-73.9	0	0	0	0	113.2	M751 L752 V753 T757	M751-C755 WeakPolarHBondContact O-CB 3.47Å; M751-C755 PolarHBondContact O-N 2.76Å; M751-C755 PolarHBondContact O-SG 3.08Å; L752-C755 PolarHBondContact O-N 2.97Å; V753-C755 VanDerWaalsContact C-N 3.35Å; V753-C755 PolarHBondContact O-N 3.14Å; C755-T757 VanDerWaalsContact C-N 3.32Å
756	C	84.6	Confident	84.8	Confident	78 Å²	78	70.1 Å²	70.1	53%	0.527	39%	0.386	S	S	.	.	H	α-helix	trans	-73.4	-27.5	178.9	-66.2	0	0	0	0	112.5	L752 V753 D754	L752-C756 PolarHBondContact O-N 2.77Å; L752-C756 PolarHBondContact O-SG 2.87Å; V753-C756 PolarHBondContact O-N 3.21Å; D754-C756 PolarHBondContact O-N 3.25Å
757	T	86	Confident	85.8	Confident	39 Å²	39	62.7 Å²	62.7	24%	0.239	35%	0.354	C	S	.	.	H	α-helix	trans	-108.2	6.8	-174.5	61.6	0	0	0	0	113	N679 V753 D754 C755 S759	N679-T757 PolarHBondContact ND2-O 2.94Å; V753-T757 HydrophobicContact CG1-CG2 4.31Å; V753-T757 WeakPolarHBondContact O-CB 3.44Å; V753-T757 WeakPolarHBondContact O-CG2 3.26Å; V753-T757 PolarHBondContact O-N 3.38Å; V753-T757 PolarHBondContact O-OG1 3.41Å; D754-T757 CarbonylContact O-C 3.17Å; D754-T757 PolarHBondContact O-N 3.01Å; C755-T757 VanDerWaalsContact C-N 3.32Å; T757-S759 PolarHBondContact O-N 2.93Å
758	D	88.1	Confident	86.9	Confident	81 Å²	81	63.1 Å²	63.1	43%	0.433	35%	0.352	S	S	.	.			trans	-61.3	130	176.8	178.6	26.6	0	0	0	111.3	D754 D760 G761	D754-D758 WeakPolarHBondContact O-CB 3.11Å; D754-D758 PolarHBondContact O-N 2.86Å; D758-D760 PolarHBondContact OD1-N 2.86Å; D758-G761 PolarHBondContact OD1-N 3.24Å; D758-G761 WeakPolarHBondContact OD2-CA 3.47Å; D758-G761 PolarHBondContact OD2-N 3.48Å; D758-G761 VanDerWaalsContact OD2-N 3.12Å
759	S	89.3	Confident	87.7	Confident	14 Å²	14	62.8 Å²	62.8	10%	0.098	36%	0.358	C	S	.	.	S	Bend	trans	-113.4	-16.6	-178.1	57.6	0	0	0	0	113.7	D479 N680 T757 R780	D479-S759 WeakPolarHBondContact OD2-CB 3.17Å; N680-S759 PolarHBondContact ND2-O 3.09Å; T757-S759 PolarHBondContact O-N 2.93Å; S759-R780 PolarHBondContact O-NH2 2.83Å
760	D	87.5	Confident	88.6	Confident	26 Å²	26	68.2 Å²	68.2	14%	0.139	37%	0.368	C	S	.	.	S	Bend	trans	-111.2	-20.1	-171.7	-105	-63.3	0	0	0	113.8	K718 D758 V764 R780 S782	K718-D760 WeakPolarHBondContact CE-OD1 3.26Å; K718-D760 HydrophobicContact CG-CB 4.34Å; K718-D760 IonicContact NZ-OD1 2.7Å; D758-D760 PolarHBondContact OD1-N 2.86Å; D760-V764 WeakPolarHBondContact O-CB 3.25Å; D760-V764 VanDerWaalsContact O-CG2 3.32Å; D760-V764 WeakPolarHBondContact O-CG2 3.35Å; D760-R780 IonicContact OD1-CZ 2.95Å; D760-R780 IonicContact OD1-NE 3.83Å; D760-R780 PolarHBondContact OD1-NE 2.77Å; D760-R780 IonicContact OD1-NH2 3.51Å; D760-R780 PolarHBondContact OD1-NH2 2.79Å; D760-R780 IonicContact OD2-CZ 3.24Å; D760-R780 IonicContact OD2-NE 2.7Å; D760-R780 IonicContact OD2-NH2 3.9Å; D760-R780 PolarHBondContact OD2-NH2 2.82Å; D760-S782 WeakPolarHBondContact OD2-CB 3.45Å; D760-S782 PolarHBondContact OD2-OG 3.02Å
761	G	87.5	Confident	89.4	Confident	26 Å²	26	64.1 Å²	64.1	27%	0.268	35%	0.35	S	S	.	.	S	Bend	trans	-77.4	-122.7	180	0	0	0	0	0	113.9	D758 A763 V764	D758-G761 PolarHBondContact OD1-N 3.24Å; D758-G761 WeakPolarHBondContact OD2-CA 3.47Å; D758-G761 PolarHBondContact OD2-N 3.48Å; D758-G761 VanDerWaalsContact OD2-N 3.12Å; G761-A763 PolarHBondContact O-N 3.32Å; G761-V764 PolarHBondContact O-N 2.96Å
762	C	88.8	Confident	90.1	Very high	76 Å²	76	65.9 Å²	65.9	51%	0.514	36%	0.357	S	S	.	.	H	α-helix	trans	-57.9	-27.6	-169.3	-66.6	0	0	0	0	114.3	V764 D765 R766	C762-V764 VanDerWaalsContact C-N 3.31Å; C762-V764 PolarHBondContact O-N 2.93Å; C762-D765 PolarHBondContact O-N 3.22Å; C762-R766 WeakPolarHBondContact O-CB 3.49Å; C762-R766 WeakPolarHBondContact O-CD 3.42Å; C762-R766 WeakPolarHBondContact O-CG 3.46Å; C762-R766 PolarHBondContact O-N 3.34Å
763	A	91	Very high	90.6	Very high	21 Å²	21	67 Å²	67	17%	0.174	36%	0.362	C	S	.	.	H	α-helix	trans	-60.6	-40.7	177.3	0	0	0	0	0	112.1	N680 G761 A767	N680-A763 HydrophobicContact CB-CB 4.34Å; G761-A763 PolarHBondContact O-N 3.32Å; A763-A767 VanDerWaalsContact O-CB 3.31Å; A763-A767 WeakPolarHBondContact O-CB 3.42Å; A763-A767 PolarHBondContact O-N 3.33Å
764	V	94.3	Very high	91.1	Very high	5 Å²	5	66.1 Å²	66.1	3%	0.03	35%	0.353	C	S	.	.	H	α-helix	trans	-69.3	-43.8	-179.8	172.3	0	0	0	0	111.2	D760 G761 C762 A767 R768 Y778 R780	D760-V764 WeakPolarHBondContact O-CB 3.25Å; D760-V764 VanDerWaalsContact O-CG2 3.32Å; D760-V764 WeakPolarHBondContact O-CG2 3.35Å; G761-V764 PolarHBondContact O-N 2.96Å; C762-V764 VanDerWaalsContact C-N 3.31Å; C762-V764 PolarHBondContact O-N 2.93Å; V764-A767 PolarHBondContact O-N 3.5Å; V764-R768 WeakPolarHBondContact O-CB 3.23Å; V764-R768 PolarHBondContact O-N 2.89Å; V764-Y778 HydrophobicContact CG1-CE1 4.04Å; V764-R780 HydrophobicContact CG1-CB 4.11Å; V764-R780 HydrophobicContact CG1-CG 3.86Å; V764-R780 HydrophobicContact CG2-CG 4.22Å
765	D	94.1	Very high	91.5	Very high	95 Å²	95	68.7 Å²	68.7	51%	0.508	37%	0.367	S	S	.	.	H	α-helix	trans	-67.6	-40.1	-179.4	-68.3	-30	0	0	0	111.7	C762 R768 A769	C762-D765 PolarHBondContact O-N 3.22Å; D765-R768 PolarHBondContact O-N 3.35Å; D765-R768 IonicContact OD1-NH1 3.8Å; D765-R768 PolarHBondContact OD1-NH1 3.33Å; D765-A769 WeakPolarHBondContact O-CB 3.4Å; D765-A769 PolarHBondContact O-N 3.5Å
766	R	95.6	Very high	91.9	Very high	147 Å²	147	64.7 Å²	64.7	56%	0.555	34%	0.34	S	S	*	.	H	α-helix	trans	-59.7	-54.9	170.9	-69.9	169	-167.5	171.6	6.2	109.7	L683 C762 R768 A769 W770	L683-R766 HydrophobicContact CD1-CB 3.95Å; L683-R766 HydrophobicContact CD2-CB 4.19Å; C762-R766 WeakPolarHBondContact O-CB 3.49Å; C762-R766 WeakPolarHBondContact O-CD 3.42Å; C762-R766 WeakPolarHBondContact O-CG 3.46Å; C762-R766 PolarHBondContact O-N 3.34Å; R766-R768 VanDerWaalsContact C-N 3.26Å; R766-R768 PolarHBondContact O-N 3.3Å; R766-A769 PolarHBondContact O-N 2.86Å; R766-W770 PolarHBondContact O-N 3.39Å
767	A	95.5	Very high	92.4	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-55.8	-42.3	-178.2	0	0	0	0	0	112.1	T682 L683 A763 V764 C771 Y778	T682-A767 HydrophobicContact CG2-CB 3.77Å; L683-A767 HydrophobicContact CD2-CB 4.02Å; L683-A767 HydrophobicContact CG-CB 4.34Å; A763-A767 VanDerWaalsContact O-CB 3.31Å; A763-A767 WeakPolarHBondContact O-CB 3.42Å; A763-A767 PolarHBondContact O-N 3.33Å; V764-A767 PolarHBondContact O-N 3.5Å; A767-C771 WeakPolarHBondContact O-CB 3.47Å; A767-C771 PolarHBondContact O-N 2.91Å; A767-C771 PolarHBondContact O-SG 2.67Å; A767-Y778 HydrophobicContact CB-CE2 4.15Å
768	R	96.2	Very high	92.9	Very high	92 Å²	92	64.4 Å²	64.4	35%	0.347	33%	0.328	S	S	.	.	H	α-helix	trans	-59.4	-54.7	175.3	-173.2	-178.7	-60.4	117	3.3	112	V764 D765 R766 W770 C771 E772 Y778	V764-R768 WeakPolarHBondContact O-CB 3.23Å; V764-R768 PolarHBondContact O-N 2.89Å; D765-R768 PolarHBondContact O-N 3.35Å; D765-R768 IonicContact OD1-NH1 3.8Å; D765-R768 PolarHBondContact OD1-NH1 3.33Å; R766-R768 VanDerWaalsContact C-N 3.26Å; R766-R768 PolarHBondContact O-N 3.3Å; R768-W770 VanDerWaalsContact C-N 3.32Å; R768-W770 PolarHBondContact O-N 3.2Å; R768-C771 WeakPolarHBondContact O-CB 3.37Å; R768-C771 PolarHBondContact O-N 3.04Å; R768-C771 VanDerWaalsContact O-N 3.16Å; R768-E772 WeakPolarHBondContact CG-OE1 3.36Å; R768-E772 WeakPolarHBondContact O-CG 3.33Å; R768-E772 PolarHBondContact O-N 3.01Å; R768-Y778 HydrophobicContact CB-CD1 3.61Å; R768-Y778 HydrophobicContact CB-CE1 3.9Å; R768-Y778 HydrophobicContact CG-CD1 3.96Å
769	A	95.8	Very high	93.2	Very high	54 Å²	54	62.2 Å²	62.2	45%	0.446	32%	0.316	S	S	.	.	H	α-helix	trans	-61	-40.4	-178.6	0	0	0	0	0	112.4	D765 R766 E772 M773	D765-A769 WeakPolarHBondContact O-CB 3.4Å; D765-A769 PolarHBondContact O-N 3.5Å; R766-A769 PolarHBondContact O-N 2.86Å; A769-E772 PolarHBondContact O-N 3.24Å; A769-M773 PolarHBondContact O-N 3.39Å; A769-M773 VanDerWaalsContact O-N 3.09Å
770	W	95.8	Very high	93.6	Very high	147 Å²	147	63.1 Å²	63.1	56%	0.557	32%	0.317	S	S	*	.	H	α-helix	trans	-68.1	-37.6	176.4	-77.5	98.3	0	0	0	112.2	M686 R766 R768 M773 I774	M686-W770 HydrophobicContact CE-CB 4.32Å; R766-W770 PolarHBondContact O-N 3.39Å; R768-W770 VanDerWaalsContact C-N 3.32Å; R768-W770 PolarHBondContact O-N 3.2Å; W770-M773 HydrophobicContact CE3-CE 3.42Å; W770-M773 VanDerWaalsContact CE3-CE 3.42Å; W770-M773 HydrophobicContact CE3-SD 4.39Å; W770-M773 HydrophobicContact CZ3-CE 3.45Å; W770-M773 VanDerWaalsContact CZ3-CE 3.45Å; W770-M773 HydrophobicContact CZ3-SD 4.35Å; W770-M773 WeakPolarHBondContact O-CB 3.45Å; W770-M773 PolarHBondContact O-N 3.04Å; W770-I774 WeakPolarHBondContact O-CG1 3.18Å; W770-I774 PolarHBondContact O-N 3.03Å
771	C	94.8	Very high	94	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.7	-42.8	174.1	-74	0	0	0	0	112.1	M686 A767 R768 M773 I774 D775 T776 Y778	M686-C771 VanDerWaalsContact CE-SG 3.51Å; M686-C771 VanDerWaalsContact SD-SG 3.65Å; A767-C771 WeakPolarHBondContact O-CB 3.47Å; A767-C771 PolarHBondContact O-N 2.91Å; A767-C771 PolarHBondContact O-SG 2.67Å; R768-C771 WeakPolarHBondContact O-CB 3.37Å; R768-C771 PolarHBondContact O-N 3.04Å; R768-C771 VanDerWaalsContact O-N 3.16Å; C771-M773 VanDerWaalsContact C-N 3.28Å; C771-M773 PolarHBondContact O-N 3.21Å; C771-I774 VanDerWaalsContact O-CG1 3.31Å; C771-I774 WeakPolarHBondContact O-CG1 3.44Å; C771-I774 PolarHBondContact O-N 3.48Å; C771-D775 PolarHBondContact O-N 3.43Å; C771-T776 CarbonylContact C-O 3.51Å; C771-T776 PolarHBondContact O-N 2.85Å; C771-Y778 HydrophobicContact CB-CG 4.5Å
772	E	93.6	Very high	94.3	Very high	131 Å²	131	61.4 Å²	61.4	61%	0.612	30%	0.302	S	S	*	.	H	α-helix	trans	-58.9	-40.5	174.7	-72.9	170.4	-171.4	0	0	111.3	R768 A769 I774 D775	R768-E772 WeakPolarHBondContact CG-OE1 3.36Å; R768-E772 WeakPolarHBondContact O-CG 3.33Å; R768-E772 PolarHBondContact O-N 3.01Å; A769-E772 PolarHBondContact O-N 3.24Å; E772-I774 VanDerWaalsContact C-N 3.29Å; E772-I774 PolarHBondContact O-N 2.92Å; E772-D775 PolarHBondContact O-N 2.94Å
773	M	95.1	Very high	94.6	Very high	126 Å²	126	57.8 Å²	57.8	62%	0.621	28%	0.278	S	S	*	.	H	α-helix	trans	-64.1	-29.2	178.4	-167.7	-172.7	71.7	0	0	113.8	A769 W770 C771	A769-M773 PolarHBondContact O-N 3.39Å; A769-M773 VanDerWaalsContact O-N 3.09Å; W770-M773 HydrophobicContact CE3-CE 3.42Å; W770-M773 VanDerWaalsContact CE3-CE 3.42Å; W770-M773 HydrophobicContact CE3-SD 4.39Å; W770-M773 HydrophobicContact CZ3-CE 3.45Å; W770-M773 VanDerWaalsContact CZ3-CE 3.45Å; W770-M773 HydrophobicContact CZ3-SD 4.35Å; W770-M773 WeakPolarHBondContact O-CB 3.45Å; W770-M773 PolarHBondContact O-N 3.04Å; C771-M773 VanDerWaalsContact C-N 3.28Å; C771-M773 PolarHBondContact O-N 3.21Å
774	I	92.6	Very high	94.7	Very high	62 Å²	62	61.9 Å²	61.9	32%	0.318	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	10.3	-178.6	62.7	169	0	0	0	113.1	M686 K707 W770 C771 E772 T776	M686-I774 HydrophobicContact CE-CD1 3.86Å; K707-I774 WeakPolarHBondContact CE-O 3.33Å; K707-I774 PolarHBondContact NZ-O 3.02Å; W770-I774 WeakPolarHBondContact O-CG1 3.18Å; W770-I774 PolarHBondContact O-N 3.03Å; C771-I774 VanDerWaalsContact O-CG1 3.31Å; C771-I774 WeakPolarHBondContact O-CG1 3.44Å; C771-I774 PolarHBondContact O-N 3.48Å; E772-I774 VanDerWaalsContact C-N 3.29Å; E772-I774 PolarHBondContact O-N 2.92Å; I774-T776 VanDerWaalsContact C-N 3.34Å; I774-T776 VanDerWaalsContact CD1-OG1 3.26Å; I774-T776 WeakPolarHBondContact CD1-OG1 3.46Å; I774-T776 VanDerWaalsContact CG1-OG1 3.28Å; I774-T776 WeakPolarHBondContact CG1-OG1 3.48Å; I774-T776 PolarHBondContact O-N 3.11Å
775	D	91.3	Very high	94.7	Very high	131 Å²	131	61.9 Å²	61.9	70%	0.701	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	48.3	-172.1	-47.7	-61.5	0	0	0	112.7	K707 C771 E772	K707-D775 IonicContact NZ-OD2 3.96Å; C771-D775 PolarHBondContact O-N 3.43Å; E772-D775 PolarHBondContact O-N 2.94Å
776	T	93.3	Very high	94.4	Very high	8 Å²	8	61 Å²	61	5%	0.049	30%	0.295	C	S	.	.			trans	-110.9	134.1	175.3	-63.7	0	0	0	0	109.6	L708 V711 C771 I774 Y778	L708-T776 HydrophobicContact CD2-CG2 4.41Å; L708-T776 HydrophobicContact CG-CG2 4.09Å; L708-T776 PolarHBondContact O-OG1 3.43Å; V711-T776 HydrophobicContact CB-CG2 4.44Å; V711-T776 HydrophobicContact CG2-CG2 3.68Å; C771-T776 CarbonylContact C-O 3.51Å; C771-T776 PolarHBondContact O-N 2.85Å; I774-T776 VanDerWaalsContact C-N 3.34Å; I774-T776 VanDerWaalsContact CD1-OG1 3.26Å; I774-T776 WeakPolarHBondContact CD1-OG1 3.46Å; I774-T776 VanDerWaalsContact CG1-OG1 3.28Å; I774-T776 WeakPolarHBondContact CG1-OG1 3.48Å; I774-T776 PolarHBondContact O-N 3.11Å; T776-Y778 PolarHBondContact O-N 2.94Å
777	I	94.1	Very high	94.2	Very high	80 Å²	80	58.5 Å²	58.5	41%	0.41	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	122.9	178.4	-57.1	173	0	0	0	108.7	G709 I710 V711 H779 T823	G709-I777 PolarHBondContact O-N 2.79Å; I710-I777 CarbonylContact C-O 3.35Å; I710-I777 WeakPolarHBondContact CA-O 3.46Å; V711-I777 PolarHBondContact N-O 2.94Å; I777-H779 VanDerWaalsContact CG2-NE2 3.3Å; I777-H779 WeakPolarHBondContact CG2-NE2 3.41Å; I777-T823 HydrophobicContact CD1-CG2 4.01Å
778	Y	96.1	Very high	93.9	Very high	30 Å²	30	62.3 Å²	62.3	12%	0.118	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.2	178	-179.5	-115.3	0	0	0	111.8	T682 V711 V764 A767 R768 C771 T776 R780	T682-Y778 HydrophobicContact CG2-CE2 4.01Å; V711-Y778 HydrophobicContact CB-CD2 4.01Å; V711-Y778 HydrophobicContact CG1-CD2 3.76Å; V711-Y778 HydrophobicContact CG1-CE2 4Å; V711-Y778 WeakPolarHBondContact O-CA 3.39Å; V764-Y778 HydrophobicContact CG1-CE1 4.04Å; A767-Y778 HydrophobicContact CB-CE2 4.15Å; R768-Y778 HydrophobicContact CB-CD1 3.61Å; R768-Y778 HydrophobicContact CB-CE1 3.9Å; R768-Y778 HydrophobicContact CG-CD1 3.96Å; C771-Y778 HydrophobicContact CB-CG 4.5Å; T776-Y778 PolarHBondContact O-N 2.94Å; Y778-R780 HydrophobicContact CE1-CB 3.97Å
779	H	96.2	Very high	93.6	Very high	36 Å²	36	58.2 Å²	58.2	17%	0.167	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	121.1	172.7	-71.5	-83.7	0	0	0	110.2	V711 V712 S713 I777	V711-H779 PolarHBondContact O-N 3.19Å; V712-H779 WeakPolarHBondContact CA-O 3.47Å; S713-H779 PolarHBondContact N-O 3.39Å; I777-H779 VanDerWaalsContact CG2-NE2 3.3Å; I777-H779 WeakPolarHBondContact CG2-NE2 3.41Å
780	R	96.1	Very high	93.4	Very high	32 Å²	32	59.3 Å²	59.3	12%	0.121	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	120.9	168.7	176.3	61.5	175.1	-177	2.4	109.4	D479 N680 S713 G715 S759 D760 V764 Y778	D479-R780 IonicContact OD1-NH1 3.63Å; D479-R780 PolarHBondContact OD1-NH1 3.16Å; D479-R780 IonicContact OD2-CZ 3.85Å; D479-R780 IonicContact OD2-NH1 3.94Å; D479-R780 PolarHBondContact OD2-NH1 3.15Å; D479-R780 IonicContact OD2-NH2 2.9Å; D479-R780 PolarHBondContact OD2-NH2 2.93Å; N680-R780 PolarHBondContact ND2-NH1 3.36Å; S713-R780 WeakPolarHBondContact O-CA 3.46Å; S713-R780 WeakPolarHBondContact O-CD 3.32Å; S713-R780 PolarHBondContact OG-NH1 2.66Å; G715-R780 VanDerWaalsContact CA-NH2 3.27Å; S759-R780 PolarHBondContact O-NH2 2.83Å; D760-R780 IonicContact OD1-CZ 2.95Å; D760-R780 IonicContact OD1-NE 3.83Å; D760-R780 PolarHBondContact OD1-NE 2.77Å; D760-R780 IonicContact OD1-NH2 3.51Å; D760-R780 PolarHBondContact OD1-NH2 2.79Å; D760-R780 IonicContact OD2-CZ 3.24Å; D760-R780 IonicContact OD2-NE 2.7Å; D760-R780 IonicContact OD2-NH2 3.9Å; D760-R780 PolarHBondContact OD2-NH2 2.82Å; V764-R780 HydrophobicContact CG1-CB 4.11Å; V764-R780 HydrophobicContact CG1-CG 3.86Å; V764-R780 HydrophobicContact CG2-CG 4.22Å; Y778-R780 HydrophobicContact CE1-CB 3.97Å
781	L	96	Very high	93	Very high	11 Å²	11	55 Å²	55	6%	0.058	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	120.1	172.2	-59	175.8	0	0	0	109	M491 S713 L714 G715 Y809 L817 L820	M491-L781 HydrophobicContact SD-CB 3.73Å; S713-L781 PolarHBondContact O-N 3.03Å; L714-L781 WeakPolarHBondContact CA-O 3.45Å; L714-L781 HydrophobicContact CD2-CB 3.81Å; L714-L781 HydrophobicContact CD2-CD1 3.92Å; L714-L781 HydrophobicContact CD2-CG 4.24Å; G715-L781 PolarHBondContact N-O 3.47Å; L781-Y809 HydrophobicContact CB-CE1 4.41Å; L781-Y809 HydrophobicContact CD2-CE1 4.44Å; L781-L817 HydrophobicContact CD1-CD1 4.48Å; L781-L820 HydrophobicContact CD1-CD2 4.45Å
782	S	94.9	Very high	92.8	Very high	6 Å²	6	55.7 Å²	55.7	4%	0.042	28%	0.28	C	S	.	.			trans	-157.3	112.4	177.2	-174.3	0	0	0	0	107.7	D760 Y809	D760-S782 WeakPolarHBondContact OD2-CB 3.45Å; D760-S782 PolarHBondContact OD2-OG 3.02Å; S782-Y809 PolarHBondContact N-OH 3.41Å
783	P	94.8	Very high	92.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-71.3	150.8	-176.4	28.8	-34.8	0	0	0	111.5	V487 G717 K718 L785 T806 Y809	V487-P783 HydrophobicContact CG1-CG 3.53Å; G717-P783 CarbonylContact C-O 3.54Å; G717-P783 WeakPolarHBondContact CA-O 3.39Å; K718-P783 PolarHBondContact N-O 2.95Å; P783-L785 HydrophobicContact CG-CD2 4.43Å; P783-T806 HydrophobicContact CG-CG2 4.21Å; P783-Y809 HydrophobicContact CB-CD1 3.88Å; P783-Y809 HydrophobicContact CB-CD2 4.31Å; P783-Y809 HydrophobicContact CB-CG 3.72Å
784	Q	93.2	Very high	92.5	Very high	107 Å²	107	48.3 Å²	48.3	50%	0.5	25%	0.248	S	C	.	.	B	Isolated β-bridge	trans	-81.2	123.7	169.2	-175.6	61.5	48	0	0	109	K718 P719	K718-Q784 PolarHBondContact O-NE2 2.75Å; K718-Q784 VanDerWaalsContact O-NE2 3.16Å; P719-Q784 VanDerWaalsContact C-NE2 3.32Å; P719-Q784 PolarHBondContact O-NE2 2.93Å
785	L	93.1	Very high	92.5	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.026	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-91.8	148.6	177.8	-54.5	-179.1	0	0	0	110.5	K718 P783 V789 M802 E805	K718-L785 WeakPolarHBondContact O-CB 3.09Å; K718-L785 PolarHBondContact O-N 2.97Å; P783-L785 HydrophobicContact CG-CD2 4.43Å; L785-V789 HydrophobicContact CD1-CG2 4.4Å; L785-M802 HydrophobicContact CD1-CG 4.26Å; L785-M802 HydrophobicContact CD2-CG 3.83Å; L785-E805 VanDerWaalsContact CA-OE2 3.27Å; L785-E805 WeakPolarHBondContact CA-OE2 3.34Å
786	S	89.4	Confident	92.6	Very high	77 Å²	77	41.6 Å²	41.6	54%	0.538	22%	0.216	S	C	.	.	S	Bend	trans	-75.4	-24.5	177.2	63.3	0	0	0	0	113.9	E805	S786-E805 WeakPolarHBondContact CB-OE1 3.44Å; S786-E805 PolarHBondContact N-OE2 2.83Å; S786-E805 PolarHBondContact OG-OE1 3.03Å
787	Q	91.1	Very high	92.6	Very high	93 Å²	93	45.5 Å²	45.5	44%	0.435	23%	0.234	S	C	.	.	S	Bend	trans	-140.5	160.1	-177.8	63.2	175.3	53.5	0	0	112.2	V789 V798	Q787-V789 HydrophobicContact CG-CG2 4.3Å; Q787-V789 PolarHBondContact O-N 3.43Å; Q787-V798 VanDerWaalsContact NE2-CG1 3.27Å
788	E	88.3	Confident	92.6	Very high	80 Å²	80	43 Å²	43	37%	0.374	22%	0.222	S	C	.	.			trans	-72	108.4	171.6	-169.5	-179.3	-175.6	0	0	109.6	K750	K750-E788 IonicContact NZ-OE1 3.61Å; K750-E788 PolarHBondContact NZ-OE1 3.16Å; K750-E788 IonicContact NZ-OE2 3.41Å; K750-E788 PolarHBondContact NZ-OE2 3.06Å
789	V	91.3	Very high	92.5	Very high	6 Å²	6	41.6 Å²	41.6	4%	0.036	22%	0.216	C	C	.	.			trans	-90.9	123.8	173.9	-179.4	0	0	0	0	109.6	K484 L785 Q787 E793 V798 L799 M802	K484-V789 HydrophobicContact CD-CB 3.99Å; K484-V789 HydrophobicContact CD-CG1 4.18Å; K484-V789 WeakPolarHBondContact CD-O 3.37Å; K484-V789 HydrophobicContact CG-CB 4.32Å; K484-V789 HydrophobicContact CG-CG1 3.96Å; L785-V789 HydrophobicContact CD1-CG2 4.4Å; Q787-V789 HydrophobicContact CG-CG2 4.3Å; Q787-V789 PolarHBondContact O-N 3.43Å; V789-E793 HydrophobicContact CG1-CB 3.94Å; V789-E793 HydrophobicContact CG1-CG 4.18Å; V789-V798 HydrophobicContact CG1-CG1 4.39Å; V789-V798 HydrophobicContact CG2-CG1 4.05Å; V789-L799 HydrophobicContact CG1-CD2 4.45Å; V789-M802 HydrophobicContact CB-SD 4.4Å; V789-M802 HydrophobicContact CG1-SD 4.11Å; V789-M802 HydrophobicContact CG2-CB 4.47Å; V789-M802 HydrophobicContact CG2-CG 4.5Å; V789-M802 HydrophobicContact CG2-SD 4.28Å
790	M	89.9	Confident	92.4	Very high	77 Å²	77	39.9 Å²	39.9	38%	0.379	21%	0.208	S	C	.	.			trans	-71.8	157.4	-179.5	-61.7	-58.8	-69	0	0	112.1	D792 E793	M790-D792 VanDerWaalsContact C-N 3.28Å; M790-D792 PolarHBondContact O-N 3.43Å; M790-E793 PolarHBondContact O-N 2.85Å
791	L	87.3	Confident	92.3	Very high	56 Å²	56	40 Å²	40	29%	0.293	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-25.3	-176.7	-64	174.1	0	0	0	113.7	G481 I483 Y664	G481-L791 VanDerWaalsContact O-CD2 3.27Å; G481-L791 WeakPolarHBondContact O-CD2 3.43Å; I483-L791 WeakPolarHBondContact CG2-O 3.48Å; I483-L791 PolarHBondContact N-O 3.29Å; Y664-L791 HydrophobicContact CD2-CD1 4.44Å; Y664-L791 HydrophobicContact CE1-CB 4.24Å; Y664-L791 HydrophobicContact CE2-CB 4.15Å; Y664-L791 HydrophobicContact CE2-CD1 3.65Å; Y664-L791 HydrophobicContact CE2-CG 4.45Å
792	D	90.6	Very high	92.3	Very high	16 Å²	16	39.6 Å²	39.6	9%	0.086	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	29.5	178.8	66.7	-25.3	0	0	0	112.5	F544 R548 Y550 Y664 M790 V794	F544-D792 HydrophobicContact CD1-CB 3.74Å; F544-D792 HydrophobicContact CD2-CB 4.09Å; F544-D792 HydrophobicContact CE1-CB 3.79Å; F544-D792 HydrophobicContact CE2-CB 4.16Å; F544-D792 HydrophobicContact CG-CB 3.89Å; F544-D792 HydrophobicContact CZ-CB 4.01Å; R548-D792 IonicContact CZ-OD1 3.68Å; R548-D792 IonicContact CZ-OD2 2.99Å; R548-D792 IonicContact NE-OD2 3.83Å; R548-D792 PolarHBondContact NE-OD2 2.94Å; R548-D792 IonicContact NH2-OD1 3.59Å; R548-D792 PolarHBondContact NH2-OD1 2.93Å; R548-D792 IonicContact NH2-OD2 2.69Å; R548-D792 PolarHBondContact NH2-OD2 2.69Å; Y550-D792 HydrophobicContact CE2-CB 4.18Å; Y550-D792 PolarHBondContact OH-OD2 2.69Å; Y664-D792 HydrophobicContact CD1-CB 3.89Å; Y664-D792 HydrophobicContact CE1-CB 3.73Å; Y664-D792 WeakPolarHBondContact CE1-OD1 3.31Å; Y664-D792 WeakPolarHBondContact CE1-OD2 3.18Å; M790-D792 VanDerWaalsContact C-N 3.28Å; M790-D792 PolarHBondContact O-N 3.43Å; D792-V794 PolarHBondContact O-N 2.88Å
793	E	92.8	Very high	92.3	Very high	41 Å²	41	39.3 Å²	39.3	19%	0.192	21%	0.208	C	C	.	.			trans	-58	132.1	175	-178.3	57.9	-103.8	0	0	111.3	I483 V789 M790 S795 V798 L799	I483-E793 HydrophobicContact CG2-CB 3.97Å; V789-E793 HydrophobicContact CG1-CB 3.94Å; V789-E793 HydrophobicContact CG1-CG 4.18Å; M790-E793 PolarHBondContact O-N 2.85Å; E793-S795 VanDerWaalsContact OE1-CB 3.25Å; E793-S795 WeakPolarHBondContact OE1-CB 3.17Å; E793-S795 PolarHBondContact OE1-N 2.78Å; E793-V798 HydrophobicContact CG-CB 4.1Å; E793-V798 HydrophobicContact CG-CG1 3.84Å; E793-L799 HydrophobicContact CB-CD2 4.16Å; E793-L799 HydrophobicContact CG-CD2 3.97Å; E793-L799 HydrophobicContact CG-CG 4.15Å
794	V	91.3	Very high	92.1	Very high	61 Å²	61	40.6 Å²	40.6	37%	0.37	21%	0.212	S	C	.	.			trans	-117.3	-13.7	-177.9	-66.3	0	0	0	0	112.8	K540 F544 D792 D796	K540-V794 PolarHBondContact NZ-O 3.3Å; F544-V794 HydrophobicContact CB-CG1 3.85Å; F544-V794 HydrophobicContact CD2-CG1 4.1Å; F544-V794 HydrophobicContact CG-CG1 4.46Å; D792-V794 PolarHBondContact O-N 2.88Å; V794-D796 PolarHBondContact O-N 3.06Å
795	S	92.4	Very high	92.1	Very high	40 Å²	40	37.5 Å²	37.5	28%	0.28	20%	0.198	S	C	.	.			trans	-68.2	119.8	179	177.3	0	0	0	0	111.6	E793 E797 V798 L799	E793-S795 VanDerWaalsContact OE1-CB 3.25Å; E793-S795 WeakPolarHBondContact OE1-CB 3.17Å; E793-S795 PolarHBondContact OE1-N 2.78Å; S795-E797 PolarHBondContact O-N 3.13Å; S795-E797 PolarHBondContact OG-N 3.03Å; S795-V798 PolarHBondContact O-N 3.28Å; S795-V798 PolarHBondContact OG-N 3.09Å; S795-L799 VanDerWaalsContact O-CG 3.31Å; S795-L799 WeakPolarHBondContact O-CG 3.09Å; S795-L799 PolarHBondContact O-N 2.76Å; S795-L799 VanDerWaalsContact O-N 3.1Å
796	D	91.8	Very high	92.1	Very high	12 Å²	12	37.3 Å²	37.3	6%	0.064	20%	0.197	C	C	.	.	H	α-helix	trans	-60.9	-36.2	175.7	-80.6	-7.1	0	0	0	111.4	F333 M337 F537 K540 V794 L799 V800	F333-D796 HydrophobicContact CE1-CB 4.01Å; F333-D796 HydrophobicContact CZ-CB 4.44Å; M337-D796 HydrophobicContact CB-CB 4.45Å; M337-D796 VanDerWaalsContact CB-OD2 3.26Å; M337-D796 WeakPolarHBondContact CB-OD2 3.45Å; M337-D796 HydrophobicContact CG-CB 4.21Å; F537-D796 WeakPolarHBondContact CD1-OD1 3.37Å; K540-D796 WeakPolarHBondContact CE-OD1 3.34Å; K540-D796 IonicContact NZ-OD1 2.89Å; K540-D796 PolarHBondContact NZ-OD1 2.88Å; V794-D796 PolarHBondContact O-N 3.06Å; D796-L799 PolarHBondContact O-N 2.86Å; D796-V800 VanDerWaalsContact O-CB 3.23Å; D796-V800 WeakPolarHBondContact O-CB 3.49Å; D796-V800 WeakPolarHBondContact O-CG2 3.15Å; D796-V800 PolarHBondContact O-N 3.36Å
797	E	93	Very high	92.1	Very high	90 Å²	90	35.9 Å²	35.9	42%	0.421	18%	0.182	S	C	.	.	H	α-helix	trans	-63.1	-47.3	178.4	-175.2	178.8	177.5	0	0	111.7	F333 S795 V800 N801	F333-E797 HydrophobicContact CE1-CB 4.12Å; S795-E797 PolarHBondContact O-N 3.13Å; S795-E797 PolarHBondContact OG-N 3.03Å; E797-V800 PolarHBondContact O-N 2.63Å; E797-N801 WeakPolarHBondContact O-CB 3.41Å; E797-N801 PolarHBondContact O-N 3.37Å; E797-N801 PolarHBondContact O-ND2 3.44Å
798	V	94.6	Very high	92	Very high	27 Å²	27	33 Å²	33	16%	0.164	17%	0.169	C	C	.	.	H	α-helix	trans	-64.3	-45.2	179.2	173.4	0	0	0	0	110.7	Q787 V789 E793 S795 N801 M802	Q787-V798 VanDerWaalsContact NE2-CG1 3.27Å; V789-V798 HydrophobicContact CG1-CG1 4.39Å; V789-V798 HydrophobicContact CG2-CG1 4.05Å; E793-V798 HydrophobicContact CG-CB 4.1Å; E793-V798 HydrophobicContact CG-CG1 3.84Å; S795-V798 PolarHBondContact O-N 3.28Å; S795-V798 PolarHBondContact OG-N 3.09Å; V798-N801 PolarHBondContact O-N 2.96Å; V798-M802 WeakPolarHBondContact O-CB 3.49Å; V798-M802 PolarHBondContact O-N 3.26Å
799	L	94.8	Very high	92.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.4	-38.7	-179.7	-64.8	176.8	0	0	0	112.1	I483 L486 F537 K540 V789 E793 S795 D796 M802 L803	I483-L799 HydrophobicContact CG1-CD1 4.11Å; I483-L799 HydrophobicContact CG1-CD2 4.23Å; I483-L799 HydrophobicContact CG2-CD2 4.05Å; L486-L799 HydrophobicContact CD1-CB 4.35Å; L486-L799 HydrophobicContact CD1-CD1 4.13Å; L486-L799 HydrophobicContact CD1-CD2 4.24Å; L486-L799 HydrophobicContact CD1-CG 4.49Å; F537-L799 HydrophobicContact CE1-CB 3.96Å; F537-L799 HydrophobicContact CE1-CD1 4.18Å; F537-L799 HydrophobicContact CZ-CB 3.95Å; K540-L799 HydrophobicContact CD-CD1 3.39Å; V789-L799 HydrophobicContact CG1-CD2 4.45Å; E793-L799 HydrophobicContact CB-CD2 4.16Å; E793-L799 HydrophobicContact CG-CD2 3.97Å; E793-L799 HydrophobicContact CG-CG 4.15Å; S795-L799 VanDerWaalsContact O-CG 3.31Å; S795-L799 WeakPolarHBondContact O-CG 3.09Å; S795-L799 PolarHBondContact O-N 2.76Å; S795-L799 VanDerWaalsContact O-N 3.1Å; D796-L799 PolarHBondContact O-N 2.86Å; L799-M802 HydrophobicContact CD2-CE 3.9Å; L799-M802 PolarHBondContact O-N 3.06Å; L799-L803 WeakPolarHBondContact O-CB 3.42Å; L799-L803 WeakPolarHBondContact O-CG 3.43Å; L799-L803 PolarHBondContact O-N 3.38Å
800	V	94.5	Very high	92.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.5	-41.4	174.3	166.8	0	0	0	0	110.9	F333 M337 K370 F537 D796 E797 L803 W804	F333-V800 HydrophobicContact CZ-CG2 4.26Å; M337-V800 HydrophobicContact CE-CG2 3.47Å; M337-V800 VanDerWaalsContact CE-CG2 3.47Å; M337-V800 HydrophobicContact SD-CG2 4.04Å; K370-V800 HydrophobicContact CB-CG1 3.95Å; F537-V800 HydrophobicContact CZ-CG2 4.33Å; D796-V800 VanDerWaalsContact O-CB 3.23Å; D796-V800 WeakPolarHBondContact O-CB 3.49Å; D796-V800 WeakPolarHBondContact O-CG2 3.15Å; D796-V800 PolarHBondContact O-N 3.36Å; E797-V800 PolarHBondContact O-N 2.63Å; V800-L803 PolarHBondContact O-N 2.93Å; V800-W804 VanDerWaalsContact O-CB 3.27Å; V800-W804 WeakPolarHBondContact O-CB 3.28Å; V800-W804 PolarHBondContact O-N 3.41Å
801	N	93.6	Very high	91.9	Very high	35 Å²	35	30.3 Å²	30.3	19%	0.187	15%	0.153	C	C	.	.	H	α-helix	trans	-63.9	-41.6	175.6	-78.4	-46.1	0	0	0	112	E367 K370 E797 V798 L803 W804 E805	E367-N801 PolarHBondContact OE2-ND2 2.84Å; K370-N801 VanDerWaalsContact CD-OD1 3.24Å; K370-N801 WeakPolarHBondContact CD-OD1 3.41Å; K370-N801 WeakPolarHBondContact CE-OD1 3.4Å; K370-N801 PolarHBondContact NZ-OD1 3.42Å; E797-N801 WeakPolarHBondContact O-CB 3.41Å; E797-N801 PolarHBondContact O-N 3.37Å; E797-N801 PolarHBondContact O-ND2 3.44Å; V798-N801 PolarHBondContact O-N 2.96Å; N801-L803 VanDerWaalsContact C-N 3.35Å; N801-L803 PolarHBondContact O-N 3.29Å; N801-W804 WeakPolarHBondContact O-CB 3.17Å; N801-W804 PolarHBondContact O-N 3.25Å; N801-E805 WeakPolarHBondContact O-CG 3.18Å; N801-E805 PolarHBondContact O-N 2.83Å
802	M	95.2	Very high	92	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.015	17%	0.172	C	C	.	.	H	α-helix	trans	-59.9	-43.2	173	178.5	-169	67.1	0	0	112.1	K484 L486 V487 L785 V789 V798 L799 W804 E805 T806	K484-M802 HydrophobicContact CB-SD 4.24Å; K484-M802 HydrophobicContact CG-SD 3.99Å; L486-M802 HydrophobicContact CB-CE 3.96Å; L486-M802 HydrophobicContact CD1-CE 4.42Å; V487-M802 HydrophobicContact CG2-CE 3.84Å; V487-M802 HydrophobicContact CG2-CG 3.77Å; V487-M802 HydrophobicContact CG2-SD 3.62Å; L785-M802 HydrophobicContact CD1-CG 4.26Å; L785-M802 HydrophobicContact CD2-CG 3.83Å; V789-M802 HydrophobicContact CB-SD 4.4Å; V789-M802 HydrophobicContact CG1-SD 4.11Å; V789-M802 HydrophobicContact CG2-CB 4.47Å; V789-M802 HydrophobicContact CG2-CG 4.5Å; V789-M802 HydrophobicContact CG2-SD 4.28Å; V798-M802 WeakPolarHBondContact O-CB 3.49Å; V798-M802 PolarHBondContact O-N 3.26Å; L799-M802 HydrophobicContact CD2-CE 3.9Å; L799-M802 PolarHBondContact O-N 3.06Å; M802-W804 VanDerWaalsContact C-N 3.35Å; M802-E805 PolarHBondContact O-N 2.85Å; M802-T806 PolarHBondContact O-N 3.15Å; M802-T806 PolarHBondContact O-OG1 2.8Å
803	L	94.6	Very high	92	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-68.7	-35.2	176.2	-73.9	-178.7	0	0	0	112.5	V374 L486 Q490 F537 L799 V800 N801 T806 Q807	V374-L803 HydrophobicContact CB-CB 4.5Å; V374-L803 HydrophobicContact CG1-CB 3.61Å; V374-L803 HydrophobicContact CG1-CD1 3.59Å; V374-L803 HydrophobicContact CG1-CG 4.23Å; V374-L803 HydrophobicContact CG2-CB 4Å; L486-L803 HydrophobicContact CB-CD2 3.97Å; L486-L803 HydrophobicContact CB-CG 4.47Å; L486-L803 WeakPolarHBondContact O-CD2 3.4Å; Q490-L803 HydrophobicContact CB-CD2 3.8Å; Q490-L803 HydrophobicContact CG-CD2 4.23Å; F537-L803 HydrophobicContact CE2-CD1 3.77Å; F537-L803 HydrophobicContact CZ-CD1 3.99Å; L799-L803 WeakPolarHBondContact O-CB 3.42Å; L799-L803 WeakPolarHBondContact O-CG 3.43Å; L799-L803 PolarHBondContact O-N 3.38Å; V800-L803 PolarHBondContact O-N 2.93Å; N801-L803 VanDerWaalsContact C-N 3.35Å; N801-L803 PolarHBondContact O-N 3.29Å; L803-T806 WeakPolarHBondContact O-CB 3.41Å; L803-T806 PolarHBondContact O-N 2.88Å; L803-Q807 PolarHBondContact O-N 2.83Å
804	W	91.7	Very high	91.8	Very high	26 Å²	26	42.1 Å²	42.1	10%	0.098	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-48.4	173.8	174.8	-98.8	0	0	0	111.2	K370 I373 V374 M408 V412 V800 N801 M802 T806 Q807 M808	K370-W804 HydrophobicContact CB-CD2 4.41Å; K370-W804 HydrophobicContact CB-CE3 4.26Å; K370-W804 HydrophobicContact CB-CG 4.49Å; K370-W804 HydrophobicContact CD-CG 4.28Å; K370-W804 HydrophobicContact CG-CD2 4.06Å; K370-W804 HydrophobicContact CG-CE3 4.27Å; K370-W804 HydrophobicContact CG-CG 4.17Å; I373-W804 HydrophobicContact CB-CZ3 4.1Å; I373-W804 HydrophobicContact CD1-CH2 4.44Å; I373-W804 HydrophobicContact CD1-CZ3 4.01Å; I373-W804 HydrophobicContact CG2-CZ3 3.83Å; V374-W804 HydrophobicContact CG2-CB 4.28Å; V374-W804 HydrophobicContact CG2-CE3 4.43Å; M408-W804 HydrophobicContact CB-CH2 4.37Å; M408-W804 HydrophobicContact CB-CZ2 4.22Å; M408-W804 HydrophobicContact CE-CH2 4.45Å; M408-W804 HydrophobicContact CE-CZ2 4.06Å; M408-W804 HydrophobicContact CG-CH2 3.14Å; M408-W804 HydrophobicContact CG-CZ2 3.24Å; M408-W804 HydrophobicContact CG-CZ3 4.08Å; M408-W804 HydrophobicContact SD-CH2 4Å; M408-W804 HydrophobicContact SD-CZ2 4.16Å; M408-W804 HydrophobicContact SD-CZ3 4.43Å; V412-W804 HydrophobicContact CG2-CH2 3.56Å; V412-W804 HydrophobicContact CG2-CZ3 3.97Å; V800-W804 VanDerWaalsContact O-CB 3.27Å; V800-W804 WeakPolarHBondContact O-CB 3.28Å; V800-W804 PolarHBondContact O-N 3.41Å; N801-W804 WeakPolarHBondContact O-CB 3.17Å; N801-W804 PolarHBondContact O-N 3.25Å; M802-W804 VanDerWaalsContact C-N 3.35Å; W804-T806 VanDerWaalsContact C-N 3.26Å; W804-T806 PolarHBondContact O-N 3.13Å; W804-Q807 WeakPolarHBondContact O-CA 3.27Å; W804-Q807 VanDerWaalsContact O-CB 3.3Å; W804-Q807 WeakPolarHBondContact O-CB 3.43Å; W804-Q807 PolarHBondContact O-N 3.4Å; W804-M808 HydrophobicContact CH2-CE 3.43Å; W804-M808 VanDerWaalsContact CH2-CE 3.43Å; W804-M808 HydrophobicContact CH2-SD 4.17Å; W804-M808 HydrophobicContact CZ2-CE 3.25Å; W804-M808 HydrophobicContact CZ2-CG 4.08Å; W804-M808 HydrophobicContact CZ2-SD 3.36Å; W804-M808 WeakPolarHBondContact CZ2-SD 3.43Å; W804-M808 HydrophobicContact CZ3-CE 4.21Å; W804-M808 WeakPolarHBondContact O-CG 3.4Å; W804-M808 PolarHBondContact O-N 2.6Å
805	E	92.1	Very high	91.7	Very high	43 Å²	43	45.9 Å²	45.9	20%	0.201	21%	0.213	C	C	.	.	H	α-helix	trans	-59.2	-39	174.4	-72.5	171.3	-174.3	0	0	112	L785 S786 N801 M802 Q807 M808 Y809	L785-E805 VanDerWaalsContact CA-OE2 3.27Å; L785-E805 WeakPolarHBondContact CA-OE2 3.34Å; S786-E805 WeakPolarHBondContact CB-OE1 3.44Å; S786-E805 PolarHBondContact N-OE2 2.83Å; S786-E805 PolarHBondContact OG-OE1 3.03Å; N801-E805 WeakPolarHBondContact O-CG 3.18Å; N801-E805 PolarHBondContact O-N 2.83Å; M802-E805 PolarHBondContact O-N 2.85Å; E805-Q807 VanDerWaalsContact C-N 3.32Å; E805-Q807 PolarHBondContact O-N 3.15Å; E805-M808 PolarHBondContact O-N 2.89Å; E805-Y809 PolarHBondContact O-N 3.39Å
806	T	93.3	Very high	91.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.8	-41.3	173.8	-55.7	0	0	0	0	111.3	V487 Q490 M491 P783 M802 L803 W804 Y809 L810	V487-T806 HydrophobicContact CG1-CG2 4Å; Q490-T806 HydrophobicContact CB-CG2 4.06Å; Q490-T806 HydrophobicContact CG-CG2 4.05Å; M491-T806 HydrophobicContact CG-CG2 3.98Å; P783-T806 HydrophobicContact CG-CG2 4.21Å; M802-T806 PolarHBondContact O-N 3.15Å; M802-T806 PolarHBondContact O-OG1 2.8Å; L803-T806 WeakPolarHBondContact O-CB 3.41Å; L803-T806 PolarHBondContact O-N 2.88Å; W804-T806 VanDerWaalsContact C-N 3.26Å; W804-T806 PolarHBondContact O-N 3.13Å; T806-Y809 PolarHBondContact O-N 3.33Å; T806-L810 HydrophobicContact CG2-CD1 4.09Å; T806-L810 WeakPolarHBondContact O-CB 3.37Å; T806-L810 VanDerWaalsContact O-CG 3.24Å; T806-L810 WeakPolarHBondContact O-CG 3.35Å; T806-L810 PolarHBondContact O-N 3.31Å
807	Q	89.8	Confident	91.7	Very high	48 Å²	48	46.5 Å²	46.5	22%	0.224	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-41.1	176	-167	69.5	13	0	0	111.8	L803 W804 E805 L810 F811	L803-Q807 PolarHBondContact O-N 2.83Å; W804-Q807 WeakPolarHBondContact O-CA 3.27Å; W804-Q807 VanDerWaalsContact O-CB 3.3Å; W804-Q807 WeakPolarHBondContact O-CB 3.43Å; W804-Q807 PolarHBondContact O-N 3.4Å; E805-Q807 VanDerWaalsContact C-N 3.32Å; E805-Q807 PolarHBondContact O-N 3.15Å; Q807-L810 PolarHBondContact O-N 3.36Å; Q807-F811 PolarHBondContact O-N 3.38Å
808	M	88.4	Confident	91.6	Very high	32 Å²	32	46.9 Å²	46.9	16%	0.158	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-47.2	175.3	-61.6	-64.6	87.9	0	0	111.6	S411 V412 W804 E805 L810 F811 E812	S411-M808 WeakPolarHBondContact CB-SD 3.23Å; S411-M808 WeakPolarHBondContact O-CE 3.32Å; V412-M808 HydrophobicContact CG2-CE 3.91Å; W804-M808 HydrophobicContact CH2-CE 3.43Å; W804-M808 VanDerWaalsContact CH2-CE 3.43Å; W804-M808 HydrophobicContact CH2-SD 4.17Å; W804-M808 HydrophobicContact CZ2-CE 3.25Å; W804-M808 HydrophobicContact CZ2-CG 4.08Å; W804-M808 HydrophobicContact CZ2-SD 3.36Å; W804-M808 WeakPolarHBondContact CZ2-SD 3.43Å; W804-M808 HydrophobicContact CZ3-CE 4.21Å; W804-M808 WeakPolarHBondContact O-CG 3.4Å; W804-M808 PolarHBondContact O-N 2.6Å; E805-M808 PolarHBondContact O-N 2.89Å; M808-L810 VanDerWaalsContact C-N 3.3Å; M808-L810 PolarHBondContact O-N 3.42Å; M808-F811 WeakPolarHBondContact O-CB 3.39Å; M808-F811 PolarHBondContact O-N 2.81Å; M808-F811 VanDerWaalsContact O-N 3.16Å; M808-E812 PolarHBondContact O-N 3.43Å
809	Y	91.9	Very high	91.6	Very high	37 Å²	37	48.8 Å²	48.8	15%	0.145	23%	0.231	C	C	.	.	H	α-helix	trans	-57.3	-43.5	175	170.1	-100.4	0	0	0	112.2	L781 S782 P783 E805 T806 F811 E812 K813	L781-Y809 HydrophobicContact CB-CE1 4.41Å; L781-Y809 HydrophobicContact CD2-CE1 4.44Å; S782-Y809 PolarHBondContact N-OH 3.41Å; P783-Y809 HydrophobicContact CB-CD1 3.88Å; P783-Y809 HydrophobicContact CB-CD2 4.31Å; P783-Y809 HydrophobicContact CB-CG 3.72Å; E805-Y809 PolarHBondContact O-N 3.39Å; T806-Y809 PolarHBondContact O-N 3.33Å; Y809-F811 VanDerWaalsContact C-N 3.32Å; Y809-F811 PolarHBondContact O-N 2.8Å; Y809-E812 PolarHBondContact O-N 3.05Å; Y809-K813 HydrophobicContact CD2-CG 4.2Å; Y809-K813 HydrophobicContact CE1-CG 4.28Å; Y809-K813 HydrophobicContact CE2-CG 3.8Å; Y809-K813 WeakPolarHBondContact O-CB 3.32Å; Y809-K813 WeakPolarHBondContact O-CG 3.35Å; Y809-K813 PolarHBondContact O-N 2.92Å
810	L	90	Very high	91.5	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.052	23%	0.231	C	C	.	.	H	α-helix	trans	-65.4	-36.3	178.3	-72.9	167.8	0	0	0	112.1	Q490 M491 A494 T806 Q807 M808 K813 R814 L817	Q490-L810 HydrophobicContact CG-CD1 4.41Å; M491-L810 HydrophobicContact CB-CD2 4.5Å; M491-L810 HydrophobicContact CG-CD1 4.28Å; M491-L810 HydrophobicContact CG-CD2 4.06Å; M491-L810 HydrophobicContact CG-CG 4.45Å; A494-L810 HydrophobicContact CB-CD1 3.74Å; A494-L810 HydrophobicContact CB-CD2 4.29Å; A494-L810 HydrophobicContact CB-CG 4.49Å; T806-L810 HydrophobicContact CG2-CD1 4.09Å; T806-L810 WeakPolarHBondContact O-CB 3.37Å; T806-L810 VanDerWaalsContact O-CG 3.24Å; T806-L810 WeakPolarHBondContact O-CG 3.35Å; T806-L810 PolarHBondContact O-N 3.31Å; Q807-L810 PolarHBondContact O-N 3.36Å; M808-L810 VanDerWaalsContact C-N 3.3Å; M808-L810 PolarHBondContact O-N 3.42Å; L810-K813 CarbonylContact O-C 3.59Å; L810-K813 PolarHBondContact O-N 3.48Å; L810-R814 WeakPolarHBondContact O-CA 3.27Å; L810-R814 PolarHBondContact O-N 2.79Å; L810-L817 HydrophobicContact CD2-CD2 4.48Å
811	F	86.9	Confident	91.4	Very high	59 Å²	59	48.9 Å²	48.9	26%	0.259	23%	0.232	S	C	.	.	H	α-helix	trans	-64.9	-45.2	174.1	-177.7	-103.2	0	0	0	112.1	C410 S411 G413 Q807 M808 Y809 K813 R814	C410-F811 VanDerWaalsContact O-CZ 3.24Å; C410-F811 WeakPolarHBondContact O-CZ 3.15Å; S411-F811 WeakPolarHBondContact O-CB 3.36Å; S411-F811 VanDerWaalsContact O-CD1 3.3Å; S411-F811 WeakPolarHBondContact O-CD1 3.41Å; S411-F811 VanDerWaalsContact O-CD2 3.3Å; S411-F811 WeakPolarHBondContact O-CD2 3.36Å; S411-F811 WeakPolarHBondContact O-CG 3.43Å; G413-F811 VanDerWaalsContact CA-CE2 3.45Å; Q807-F811 PolarHBondContact O-N 3.38Å; M808-F811 WeakPolarHBondContact O-CB 3.39Å; M808-F811 PolarHBondContact O-N 2.81Å; M808-F811 VanDerWaalsContact O-N 3.16Å; Y809-F811 VanDerWaalsContact C-N 3.32Å; Y809-F811 PolarHBondContact O-N 2.8Å; F811-K813 PolarHBondContact O-N 3.4Å; F811-R814 WeakPolarHBondContact O-CB 3.42Å; F811-R814 WeakPolarHBondContact O-CG 3.31Å; F811-R814 PolarHBondContact O-N 3.42Å
812	E	88.8	Confident	91.3	Very high	151 Å²	151	55.2 Å²	55.2	71%	0.706	26%	0.258	S	S	*	.	H	α-helix	trans	-60.9	-34.3	174.1	-69.3	-179.9	177.3	0	0	112.1	M808 Y809	M808-E812 PolarHBondContact O-N 3.43Å; Y809-E812 PolarHBondContact O-N 3.05Å
813	K	89.8	Confident	91	Very high	87 Å²	87	57.8 Å²	57.8	38%	0.378	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	14.8	-180	-62.6	-62.4	-179	-174.5	0	114.3	Y809 L810 F811 E815 V816 L817	Y809-K813 HydrophobicContact CD2-CG 4.2Å; Y809-K813 HydrophobicContact CE1-CG 4.28Å; Y809-K813 HydrophobicContact CE2-CG 3.8Å; Y809-K813 WeakPolarHBondContact O-CB 3.32Å; Y809-K813 WeakPolarHBondContact O-CG 3.35Å; Y809-K813 PolarHBondContact O-N 2.92Å; L810-K813 CarbonylContact O-C 3.59Å; L810-K813 PolarHBondContact O-N 3.48Å; F811-K813 PolarHBondContact O-N 3.4Å; K813-E815 VanDerWaalsContact C-N 3.26Å; K813-E815 PolarHBondContact O-N 2.88Å; K813-E815 VanDerWaalsContact O-N 3.15Å; K813-V816 HydrophobicContact CD-CG2 4.33Å; K813-V816 WeakPolarHBondContact O-CA 3.36Å; K813-V816 WeakPolarHBondContact O-CB 2.85Å; K813-V816 PolarHBondContact O-N 2.86Å; K813-L817 PolarHBondContact O-N 3.29Å
814	R	88.6	Confident	90.8	Very high	123 Å²	123	57.8 Å²	57.8	46%	0.464	27%	0.274	S	S	.	.	H	α-helix	trans	-53.8	-38.7	-175.9	69.7	-172.5	-174.5	-173.1	0.3	114	L810 F811 L817 Q818	L810-R814 WeakPolarHBondContact O-CA 3.27Å; L810-R814 PolarHBondContact O-N 2.79Å; F811-R814 WeakPolarHBondContact O-CB 3.42Å; F811-R814 WeakPolarHBondContact O-CG 3.31Å; F811-R814 PolarHBondContact O-N 3.42Å; R814-L817 PolarHBondContact O-N 3.46Å; R814-Q818 WeakPolarHBondContact O-CB 3.34Å; R814-Q818 VanDerWaalsContact O-CG 3.3Å; R814-Q818 WeakPolarHBondContact O-CG 3.44Å; R814-Q818 PolarHBondContact O-N 3.4Å
815	E	89.8	Confident	90.5	Very high	140 Å²	140	61.5 Å²	61.5	65%	0.654	30%	0.295	S	S	*	.	H	α-helix	trans	-68.3	-37.9	179.5	-65	-177.8	-178.2	0	0	111.7	K813 S819	K813-E815 VanDerWaalsContact C-N 3.26Å; K813-E815 PolarHBondContact O-N 2.88Å; K813-E815 VanDerWaalsContact O-N 3.15Å; E815-S819 VanDerWaalsContact O-CB 3.3Å; E815-S819 WeakPolarHBondContact O-CB 3.48Å; E815-S819 PolarHBondContact O-N 2.84Å
816	V	92.2	Very high	90.5	Very high	56 Å²	56	62.5 Å²	62.5	34%	0.339	30%	0.3	S	S	.	.	H	α-helix	trans	-66.1	-42.4	174.7	-178.5	0	0	0	0	109.8	K813 S819 L820	K813-V816 HydrophobicContact CD-CG2 4.33Å; K813-V816 WeakPolarHBondContact O-CA 3.36Å; K813-V816 WeakPolarHBondContact O-CB 2.85Å; K813-V816 PolarHBondContact O-N 2.86Å; V816-S819 PolarHBondContact O-N 3.41Å; V816-L820 VanDerWaalsContact O-CB 3.28Å; V816-L820 WeakPolarHBondContact O-CB 3.41Å; V816-L820 PolarHBondContact O-N 2.78Å
817	L	91.9	Very high	90.3	Very high	9 Å²	9	65.7 Å²	65.7	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-43.3	178.7	-167.6	68.2	0	0	0	112	A494 L495 E498 L781 L810 K813 R814 L820 A821	A494-L817 HydrophobicContact CB-CD2 3.79Å; L495-L817 HydrophobicContact CB-CD1 4.15Å; L495-L817 HydrophobicContact CD1-CD1 3.82Å; E498-L817 HydrophobicContact CG-CD2 3.77Å; E498-L817 HydrophobicContact CG-CG 4.05Å; L781-L817 HydrophobicContact CD1-CD1 4.48Å; L810-L817 HydrophobicContact CD2-CD2 4.48Å; K813-L817 PolarHBondContact O-N 3.29Å; R814-L817 PolarHBondContact O-N 3.46Å; L817-L820 PolarHBondContact O-N 3.04Å; L817-A821 WeakPolarHBondContact O-CB 3.23Å; L817-A821 PolarHBondContact O-N 3.09Å
818	Q	92	Very high	90.3	Very high	98 Å²	98	66.7 Å²	66.7	46%	0.458	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-43.7	175.1	-77.8	173.6	-7.5	0	0	112.4	E498 R814 K822	E498-Q818 WeakPolarHBondContact OE2-CG 3.46Å; E498-Q818 PolarHBondContact OE2-NE2 2.99Å; R814-Q818 WeakPolarHBondContact O-CB 3.34Å; R814-Q818 VanDerWaalsContact O-CG 3.3Å; R814-Q818 WeakPolarHBondContact O-CG 3.44Å; R814-Q818 PolarHBondContact O-N 3.4Å; Q818-K822 WeakPolarHBondContact O-CB 3.21Å; Q818-K822 PolarHBondContact O-N 3.48Å
819	S	93.7	Very high	90.5	Very high	67 Å²	67	68.8 Å²	68.8	47%	0.469	33%	0.33	S	S	.	.	H	α-helix	trans	-62.1	-44.1	174.6	-174.5	0	0	0	0	111.4	E815 V816 K822 T823	E815-S819 VanDerWaalsContact O-CB 3.3Å; E815-S819 WeakPolarHBondContact O-CB 3.48Å; E815-S819 PolarHBondContact O-N 2.84Å; V816-S819 PolarHBondContact O-N 3.41Å; S819-K822 PolarHBondContact O-N 3.01Å; S819-T823 PolarHBondContact O-N 3.48Å; S819-T823 PolarHBondContact O-OG1 3.19Å
820	L	93.3	Very high	90.4	Very high	1 Å²	1	70.8 Å²	70.8	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-62	-50.2	177	174.6	58.6	0	0	0	111.4	L495 I710 V712 L781 V816 L817 K822 T823 L824	L495-L820 HydrophobicContact CD1-CD2 4.06Å; L495-L820 HydrophobicContact CD1-CG 4.13Å; I710-L820 HydrophobicContact CG2-CD1 4.41Å; V712-L820 HydrophobicContact CG1-CD2 4.14Å; V712-L820 HydrophobicContact CG2-CD1 3.67Å; V712-L820 HydrophobicContact CG2-CD2 4.09Å; V712-L820 HydrophobicContact CG2-CG 4.46Å; L781-L820 HydrophobicContact CD1-CD2 4.45Å; V816-L820 VanDerWaalsContact O-CB 3.28Å; V816-L820 WeakPolarHBondContact O-CB 3.41Å; V816-L820 PolarHBondContact O-N 2.78Å; L817-L820 PolarHBondContact O-N 3.04Å; L820-K822 VanDerWaalsContact C-N 3.29Å; L820-K822 PolarHBondContact O-N 3.05Å; L820-T823 PolarHBondContact O-N 3.41Å; L820-L824 HydrophobicContact CD1-CD1 4.01Å; L820-L824 HydrophobicContact CD1-CG 4.06Å; L820-L824 HydrophobicContact CG-CD1 4Å; L820-L824 HydrophobicContact CG-CG 4.48Å; L820-L824 WeakPolarHBondContact O-CG 3.31Å; L820-L824 PolarHBondContact O-N 3.45Å
821	A	92.4	Very high	90.4	Very high	2 Å²	2	74.8 Å²	74.8	2%	0.017	36%	0.361	C	S	.	.	H	α-helix	trans	-55.7	-45	177.4	0	0	0	0	0	111.4	L495 E498 A499 L817 T823 L824 L825	L495-A821 HydrophobicContact CD1-CB 4.37Å; E498-A821 HydrophobicContact CB-CB 3.99Å; A499-A821 HydrophobicContact CB-CB 4.03Å; L817-A821 WeakPolarHBondContact O-CB 3.23Å; L817-A821 PolarHBondContact O-N 3.09Å; A821-T823 VanDerWaalsContact C-N 3.29Å; A821-T823 PolarHBondContact O-N 3.08Å; A821-L824 PolarHBondContact O-N 3.31Å; A821-L825 WeakPolarHBondContact O-CG 3.07Å; A821-L825 PolarHBondContact O-N 2.75Å
822	K	91.3	Very high	90.6	Very high	168 Å²	168	75.9 Å²	75.9	73%	0.73	37%	0.369	S	S	*	.	H	α-helix	trans	-62.8	-33.2	175.9	-173.5	177.8	179.1	-177.9	0	113.3	Q818 S819 L820	Q818-K822 WeakPolarHBondContact O-CB 3.21Å; Q818-K822 PolarHBondContact O-N 3.48Å; S819-K822 PolarHBondContact O-N 3.01Å; L820-K822 VanDerWaalsContact C-N 3.29Å; L820-K822 PolarHBondContact O-N 3.05Å
823	T	89.7	Confident	90.8	Very high	56 Å²	56	70.2 Å²	70.2	34%	0.344	34%	0.343	S	S	.	.	H	α-helix	trans	-77.9	-26.1	179.3	-46.8	0	0	0	0	111.8	I710 I777 S819 L820 A821	I710-T823 HydrophobicContact CD1-CG2 3.48Å; I710-T823 VanDerWaalsContact CD1-CG2 3.48Å; I710-T823 WeakPolarHBondContact CD1-O 3.29Å; I710-T823 HydrophobicContact CG1-CG2 4.31Å; I777-T823 HydrophobicContact CD1-CG2 4.01Å; S819-T823 PolarHBondContact O-N 3.48Å; S819-T823 PolarHBondContact O-OG1 3.19Å; L820-T823 PolarHBondContact O-N 3.41Å; A821-T823 VanDerWaalsContact C-N 3.29Å; A821-T823 PolarHBondContact O-N 3.08Å
824	L	88.5	Confident	90.9	Very high	1 Å²	1	68.8 Å²	68.8	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-79.1	-28.4	178.3	-70.3	170.4	0	0	0	113.7	R474 L495 L506 F507 I710 L820 A821	R474-L824 HydrophobicContact CB-CD2 4.34Å; R474-L824 HydrophobicContact CG-CD2 4.23Å; R474-L824 PolarHBondContact NH1-O 3.2Å; L495-L824 HydrophobicContact CD1-CD1 4.09Å; L495-L824 HydrophobicContact CD2-CD1 4.08Å; L495-L824 HydrophobicContact CG-CD1 4.48Å; L506-L824 HydrophobicContact CD2-CB 4.49Å; F507-L824 HydrophobicContact CD1-CD2 4.23Å; F507-L824 HydrophobicContact CE1-CD1 4.2Å; F507-L824 HydrophobicContact CE1-CD2 3.65Å; F507-L824 HydrophobicContact CE2-CD1 4.45Å; F507-L824 HydrophobicContact CZ-CD1 3.77Å; F507-L824 HydrophobicContact CZ-CD2 4.1Å; I710-L824 HydrophobicContact CD1-CD2 4.2Å; I710-L824 HydrophobicContact CG2-CD2 4.35Å; L820-L824 HydrophobicContact CD1-CD1 4.01Å; L820-L824 HydrophobicContact CD1-CG 4.06Å; L820-L824 HydrophobicContact CG-CD1 4Å; L820-L824 HydrophobicContact CG-CG 4.48Å; L820-L824 WeakPolarHBondContact O-CG 3.31Å; L820-L824 PolarHBondContact O-N 3.45Å; A821-L824 PolarHBondContact O-N 3.31Å
825	L	86.9	Confident	91.1	Very high	104 Å²	104	63.8 Å²	63.8	55%	0.545	33%	0.328	S	S	.	.			trans	-76.4	0	176.5	-67.4	174.3	0	0	0	111.6	K470 R501 L506 A821	K470-L825 PolarHBondContact NZ-O 3.49Å; R501-L825 HydrophobicContact CG-CD2 4.28Å; L506-L825 HydrophobicContact CD2-CD2 4.28Å; A821-L825 WeakPolarHBondContact O-CG 3.07Å; A821-L825 PolarHBondContact O-N 2.75Å

Retrieved 825 of 825 residues in 530.4 ms (Link to these results)

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