A0A061IP22_CRIGR Loading...

Anaphase-promoting complex subunit 4

Component of the anaphase promoting complex/cyclosome (APC/C), a cell cycle-regulated E3 ubiquitin ligase that controls progression through mitosis and the G1 phase of the cell cycle. The APC/C complex acts by mediating ubiquitination and subsequent degradation of target proteins: it mainly mediates the formation of 'Lys-11'-linked polyubiquitin chains and, to a lower extent, the formation of 'Lys-48'- and 'Lys-63'-linked polyubiquitin chains. The APC/C complex catalyzes assembly of branched 'Lys-11'-/'Lys-48'-linked branched ubiquitin chains on target proteins.

AlphaFold DB , UniProt , Accession A0A061IP22, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Anapc4, Length 821 aa.

						>A0A061IP22_CRIGR|A0A061IP22|Anapc4
MLRFPTCFPSFRVVGEKQLPQEIVFLCWSPKRDLIALANTTGEVLLHRLASFHRVWSFPPNENTGKEVTCLAWRPDGKLLAFALADTKKIILCDVEKPESLHSFSVEAPVSCMHWMEVTVESSVLTSFYNAEDESNLLLPKLPTLPKNYSNTSKIFSEENSDEIIKLLGDVRLNILVLGGSSGFIELYAYGMFKIARVTGIAGTCLALCLSSDLKSLSVVTEVSSGGEAEVSYFQLETNLLYSFLPEVTRMARKFTHISALLQYINLSLTCMCEAWEEILMQMDSRLTKFVQEKTTTTSVQDEFMHLLLWGKASAELQTLLMNQLTVKGLKKLGQSIESSYSSIQKLVISHLQSGSESLLYHLSELKGMASWKQKYEPLGLDATGIEDAITAVGSFILKANELLQVIDSSMKNFKAFFRWLYVAMLRMTEDHVLPELNKMTQKDITFVAEFLTEHFNEAPDLYNRKGKYFNVERVGQYLKDEDDDLVSPPNTEGNQWYDFLQNSSHLKESPLLFPYYPRKSLHFVKRRMENIIDQCLQKPADVIGRSMNQAICIPLYRDARSMDSARRLLKFPFLWNNKTSNLHYLLFTILEDSVYKMCILRRHTDISQSVNNGLIGIKFGSFTYATAEKVRRSRTFSSSTYSCLDAQFYDDETVTVILKDSMGREGRDRILVQLPLSLVYNSEDAEEYQFTGTYSTRLDEQGSIIPTRTMHFEKHWRLLESMKAQYVAGNGLRKVSCVLSSNLRHVRVFEMDIDDEWELDESSDDEEEAGGKPMKIKEEVLSESESESETETETEAHQDAAALDPDIVIKVEKLDPELDS
					

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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	34.9	Very low	63	Low	245 Å²	245	95.4 Å²	95.4	100%	1.207	46%	0.457	S	S	*	.				0	97.5	0	-87.5	174.3	172.9	0	0	108.2
2	L	34.8	Very low	65.5	Low	164 Å²	164	92.3 Å²	92.3	86%	0.859	44%	0.437	S	S	*	.			trans	-76.7	118.5	167.6	-77.5	149.7	0	0	0	106.2	F4	L2-F4 PolarHBondContact O-N 2.69Å
3	R	35.9	Very low	67.7	Low	245 Å²	245	88.7 Å²	88.7	93%	0.925	42%	0.424	S	S	*	.			trans	-66.7	115.8	168.6	-78.5	-177.3	175.9	177.9	-2.5	106.9
4	F	46.9	Very low	69.4	Low	171 Å²	171	85.6 Å²	85.6	75%	0.75	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-61.3	137.3	166.4	-72.9	-87.8	0	0	0	108.2	L2 T6	L2-F4 PolarHBondContact O-N 2.69Å; F4-T6 PolarHBondContact O-N 3.38Å
5	P	53.6	Low	70.9	Confident	47 Å²	47	80.3 Å²	80.3	31%	0.305	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-63.9	116.6	170	-13.1	27.6	0	0	0	108.5	K630 V631	P5-K630 HydrophobicContact CG-CB 3.81Å; P5-V631 HydrophobicContact CB-CG2 4.07Å; P5-V631 HydrophobicContact CG-CG2 3.54Å
6	T	64.7	Low	72.3	Confident	76 Å²	76	81.3 Å²	81.3	47%	0.466	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-78.9	131.4	173.2	50.2	0	0	0	0	109.7	F4 E759	F4-T6 PolarHBondContact O-N 3.38Å; T6-E759 VanDerWaalsContact CA-OE1 3.25Å; T6-E759 WeakPolarHBondContact CA-OE1 3.25Å
7	C	74.6	Confident	73.6	Confident	12 Å²	12	81.4 Å²	81.4	8%	0.081	39%	0.392	C	S	.	.			trans	-119	120.1	179	-167.3	0	0	0	0	110.7	T627 E759 L760	C7-T627 PolarHBondContact SG-OG1 3.22Å; C7-E759 WeakPolarHBondContact O-CG 3Å; C7-L760 HydrophobicContact CB-CD1 4.48Å; C7-L760 PolarHBondContact O-N 2.96Å
8	F	82.8	Confident	74.7	Confident	73 Å²	73	82.8 Å²	82.8	32%	0.32	40%	0.398	S	S	.	.			trans	-107	142.3	177.3	-62.6	-79.2	0	0	0	110.1	D755 D756 E757 E759	F8-D755 HydrophobicContact CB-CB 4.09Å; F8-D756 VanDerWaalsContact CD1-O 3.24Å; F8-D756 WeakPolarHBondContact CD1-O 3.49Å; F8-E757 WeakPolarHBondContact CE1-O 3.24Å; F8-E759 HydrophobicContact CE1-CB 4.22Å
9	P	85.3	Confident	75.8	Confident	6 Å²	6	78.9 Å²	78.9	4%	0.039	38%	0.38	C	S	.	.			trans	-73.1	143.7	175.6	25.6	-23.7	0	0	0	110.8	F11 R718 D755 D756 W758 L760	P9-F11 PolarHBondContact O-N 3.26Å; P9-R718 HydrophobicContact CB-CG 4.05Å; P9-D755 WeakPolarHBondContact O-CA 3.39Å; P9-D756 HydrophobicContact CG-CB 3.58Å; P9-D756 PolarHBondContact O-N 3.13Å; P9-W758 VanDerWaalsContact CD-O 3.23Å; P9-W758 WeakPolarHBondContact CD-O 3.5Å; P9-L760 HydrophobicContact CB-CD1 4Å; P9-L760 HydrophobicContact CB-CD2 4.28Å; P9-L760 HydrophobicContact CB-CG 4.07Å; P9-L760 HydrophobicContact CG-CD1 4.42Å; P9-L760 HydrophobicContact CG-CG 4.1Å
10	S	86.2	Confident	76.6	Confident	10 Å²	10	80.1 Å²	80.1	7%	0.07	39%	0.394	C	S	.	.	S	Bend	trans	-72.3	-2.6	-165.2	-64.6	0	0	0	0	117.2	H716 D755	S10-H716 PolarHBondContact OG-N 3.3Å; S10-D755 VanDerWaalsContact CA-OD1 3.31Å; S10-D755 WeakPolarHBondContact CA-OD1 3.48Å
11	F	93.4	Very high	77.5	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	39%	0.391	C	S	.	.	S	Bend	trans	-133.2	132.5	-178.9	-49.7	-45.8	0	0	0	109.9	P9 L672 Q674 H716 R718 F750 M752	P9-F11 PolarHBondContact O-N 3.26Å; F11-L672 HydrophobicContact CD2-CD2 3.83Å; F11-L672 HydrophobicContact CD2-CG 4.25Å; F11-L672 HydrophobicContact CE2-CB 4.34Å; F11-L672 HydrophobicContact CE2-CD2 4.04Å; F11-L672 HydrophobicContact CE2-CG 3.98Å; F11-Q674 HydrophobicContact CE1-CG 3.99Å; F11-Q674 HydrophobicContact CZ-CB 4.44Å; F11-Q674 HydrophobicContact CZ-CG 3.73Å; F11-H716 HydrophobicContact CE1-CB 4.27Å; F11-H716 HydrophobicContact CZ-CB 4.39Å; F11-H716 WeakPolarHBondContact CZ-O 3.22Å; F11-R718 HydrophobicContact CD2-CB 3.51Å; F11-R718 HydrophobicContact CE2-CB 4.07Å; F11-R718 HydrophobicContact CG-CB 4.38Å; F11-R718 PolarHBondContact O-NH1 2.9Å; F11-F750 HydrophobicContact CB-CB 4.42Å; F11-F750 HydrophobicContact CB-CD1 4.16Å; F11-M752 HydrophobicContact CB-SD 4.03Å; F11-M752 HydrophobicContact CD1-CB 4.28Å; F11-M752 HydrophobicContact CD1-CE 3.5Å; F11-M752 HydrophobicContact CD1-SD 3.68Å; F11-M752 HydrophobicContact CD2-CE 3.75Å; F11-M752 HydrophobicContact CD2-SD 4.18Å; F11-M752 HydrophobicContact CE1-CE 3.37Å; F11-M752 HydrophobicContact CE1-SD 4.18Å; F11-M752 HydrophobicContact CE2-CE 3.61Å; F11-M752 HydrophobicContact CG-CE 3.71Å; F11-M752 HydrophobicContact CG-SD 3.7Å; F11-M752 HydrophobicContact CZ-CE 3.42Å; F11-M752 VanDerWaalsContact CZ-CE 3.42Å
12	R	93.3	Very high	80.3	Confident	59 Å²	59	70.3 Å²	70.3	22%	0.223	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	136	-179.8	178	-175.5	-68.2	-149.7	-19.1	111.7	F750 E751 I754 D755 E757	R12-F750 CarbonylContact O-C 3.55Å; R12-F750 WeakPolarHBondContact O-CA 3.48Å; R12-E751 HydrophobicContact CB-CB 4.49Å; R12-E751 PolarHBondContact N-O 3.43Å; R12-E751 PolarHBondContact O-N 3.09Å; R12-I754 WeakPolarHBondContact CB-O 3.23Å; R12-I754 PolarHBondContact N-O 3.24Å; R12-I754 VanDerWaalsContact N-O 3.12Å; R12-D755 PolarHBondContact NE-O 3.36Å; R12-E757 IonicContact CZ-OE1 2.8Å; R12-E757 IonicContact NH1-OE1 3.89Å; R12-E757 PolarHBondContact NH1-OE1 3.15Å; R12-E757 IonicContact NH2-OE1 3.19Å; R12-E757 PolarHBondContact NH2-OE1 2.97Å
13	V	93.2	Very high	83.1	Confident	45 Å²	45	62.5 Å²	62.5	27%	0.273	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	122.9	173.2	-179.2	0	0	0	0	109.8	R748 F750	V13-R748 HydrophobicContact CG1-CG 3.91Å; V13-R748 HydrophobicContact CG2-CG 4.31Å; V13-F750 HydrophobicContact CG2-CD1 3.85Å; V13-F750 HydrophobicContact CG2-CE1 3.55Å; V13-F750 HydrophobicContact CG2-CZ 4.46Å
14	V	92.6	Very high	85.8	Confident	45 Å²	45	52.8 Å²	52.8	27%	0.273	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-21.5	-179.3	-173	0	0	0	0	112.2	L49 S51 V749 E751	V14-L49 HydrophobicContact CG1-CG 4.34Å; V14-S51 PolarHBondContact O-N 3.45Å; V14-V749 PolarHBondContact N-O 2.83Å; V14-E751 HydrophobicContact CG2-CB 3.62Å
15	G	91.6	Very high	88.1	Confident	7 Å²	7	46.1 Å²	46.1	7%	0.072	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	141.7	178.4	0	0	0	0	0	111.6	V749	G15-V749 PolarHBondContact N-O 2.96Å; G15-V749 PolarHBondContact O-N 2.68Å
16	E	93.5	Very high	90	Very high	96 Å²	96	44 Å²	44	45%	0.449	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	128.7	174.6	-176.1	164.5	176.5	0	0	108.5	H746 V747 R748	E16-H746 WeakPolarHBondContact CG-NE2 3.44Å; E16-H746 IonicContact OE1-CD2 3.33Å; E16-H746 IonicContact OE1-CE1 2.77Å; E16-H746 PolarHBondContact OE1-CE1 3.07Å; E16-H746 IonicContact OE1-NE2 3.04Å; E16-H746 PolarHBondContact OE1-NE2 2.68Å; E16-V747 WeakPolarHBondContact CA-O 3.19Å; E16-R748 HydrophobicContact CB-CG 4.4Å; E16-R748 HydrophobicContact CG-CG 4.41Å; E16-R748 IonicContact OE1-CZ 3.64Å; E16-R748 IonicContact OE1-NE 2.8Å; E16-R748 PolarHBondContact OE1-NE 2.81Å; E16-R748 IonicContact OE1-NH2 3.45Å; E16-R748 PolarHBondContact OE1-NH2 2.97Å; E16-R748 IonicContact OE2-CZ 3.47Å; E16-R748 IonicContact OE2-NE 3.59Å; E16-R748 PolarHBondContact OE2-NE 2.8Å; E16-R748 IonicContact OE2-NH2 2.7Å; E16-R748 PolarHBondContact OE2-NH2 3.18Å
17	K	94.1	Very high	91.4	Very high	82 Å²	82	41.4 Å²	41.4	36%	0.357	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	136.2	-175	-159.3	173.7	-170.7	173.6	0	111.3	L19 F52 V747	K17-L19 HydrophobicContact CD-CD2 4.11Å; K17-L19 HydrophobicContact CG-CD2 4.38Å; K17-F52 HydrophobicContact CB-CD1 4Å; K17-F52 HydrophobicContact CD-CD1 3.87Å; K17-V747 PolarHBondContact N-O 2.93Å; K17-V747 PolarHBondContact O-N 2.64Å
18	Q	94	Very high	92.4	Very high	107 Å²	107	41.8 Å²	41.8	50%	0.5	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.9	165.6	-171.5	69.1	16.6	0	0	108.6	N743 H746	Q18-N743 PolarHBondContact NE2-ND2 3.3Å; Q18-H746 VanDerWaalsContact OE1-CA 3.26Å
19	L	94	Very high	93	Very high	10 Å²	10	38.3 Å²	38.3	5%	0.052	20%	0.197	C	C	.	.			trans	-82.1	146.9	177.4	-61.8	175.7	0	0	0	110.8	K17 I23 L37 F52 R745 V747	K17-L19 HydrophobicContact CD-CD2 4.11Å; K17-L19 HydrophobicContact CG-CD2 4.38Å; L19-I23 HydrophobicContact CD1-CD1 3.73Å; L19-I23 HydrophobicContact CD1-CG1 3.72Å; L19-L37 HydrophobicContact CD1-CD2 4.21Å; L19-F52 HydrophobicContact CD1-CE1 4.43Å; L19-F52 HydrophobicContact CD2-CE1 4.31Å; L19-R745 WeakPolarHBondContact CB-O 3.33Å; L19-R745 PolarHBondContact N-O 2.87Å; L19-R745 WeakPolarHBondContact O-CB 3.31Å; L19-V747 HydrophobicContact CD1-CG2 3.9Å
20	P	93.4	Very high	93.3	Very high	101 Å²	101	40.2 Å²	40.2	66%	0.656	21%	0.21	S	C	*	.	S	Bend	trans	-69.8	-35.6	-179.4	26.5	-33.4	0	0	0	112.2	R745	P20-R745 PolarHBondContact O-NH1 2.85Å; P20-R745 VanDerWaalsContact O-NH1 3.09Å
21	Q	94.3	Very high	93.5	Very high	72 Å²	72	45.1 Å²	45.1	34%	0.336	23%	0.23	S	C	.	.	S	Bend	trans	-108.2	151	-176.5	-59.5	-60.4	-18.9	0	0	111.3	N39 T41	Q21-N39 HydrophobicContact CB-CB 3.93Å; Q21-T41 HydrophobicContact CG-CG2 4.12Å
22	E	93.9	Very high	93.3	Very high	48 Å²	48	48.7 Å²	48.7	22%	0.224	24%	0.243	C	C	.	.			trans	-69	137	173.7	-73	163.4	-153.4	0	0	110.7	N39 T40 R567 L744 R745	E22-N39 CarbonylContact O-C 3.56Å; E22-N39 WeakPolarHBondContact O-CA 3.49Å; E22-N39 WeakPolarHBondContact O-CB 3.32Å; E22-T40 HydrophobicContact CB-CG2 3.61Å; E22-T40 PolarHBondContact O-N 3.3Å; E22-R567 IonicContact OE2-NH1 2.67Å; E22-R567 PolarHBondContact OE2-NH1 2.72Å; E22-L744 CarbonylContact C-O 3.53Å; E22-L744 WeakPolarHBondContact CA-O 3.32Å; E22-L744 HydrophobicContact CB-CB 4.07Å; E22-L744 HydrophobicContact CG-CB 4.17Å; E22-R745 HydrophobicContact CG-CG 4.05Å; E22-R745 IonicContact OE1-CZ 3.18Å; E22-R745 IonicContact OE1-NE 2.69Å; E22-R745 IonicContact OE1-NH2 3.35Å; E22-R745 PolarHBondContact OE1-NH2 3.13Å
23	I	94.2	Very high	93.2	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126.3	177.8	-60.4	-49.5	0	0	0	109.7	L19 F25 L26 L37 A38 N39 L740 L744	L19-I23 HydrophobicContact CD1-CD1 3.73Å; L19-I23 HydrophobicContact CD1-CG1 3.72Å; I23-F25 WeakPolarHBondContact CG2-O 3.38Å; I23-L26 HydrophobicContact CG2-CB 4.31Å; I23-L26 HydrophobicContact CG2-CD2 3.81Å; I23-L37 HydrophobicContact CD1-CB 4.15Å; I23-L37 HydrophobicContact CD1-CD2 4.18Å; I23-L37 HydrophobicContact CG1-CD2 4.11Å; I23-L37 HydrophobicContact CG2-CB 4.41Å; I23-L37 HydrophobicContact CG2-CD2 4.24Å; I23-A38 WeakPolarHBondContact CA-O 3.29Å; I23-N39 HydrophobicContact CD1-CB 4.1Å; I23-L740 HydrophobicContact CB-CD1 4.42Å; I23-L740 HydrophobicContact CB-CD2 4.26Å; I23-L740 HydrophobicContact CG2-CD2 4.37Å; I23-L744 PolarHBondContact N-O 3.27Å
24	V	92.4	Very high	93.2	Very high	41 Å²	41	46.2 Å²	46.2	25%	0.248	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-28.6	176.7	-64.4	0	0	0	0	112.4	A38 T40 L569	V24-A38 HydrophobicContact CG2-CB 3.69Å; V24-A38 VanDerWaalsContact CG2-O 3.31Å; V24-A38 WeakPolarHBondContact CG2-O 3.07Å; V24-A38 PolarHBondContact N-O 3.09Å; V24-T40 HydrophobicContact CG1-CG2 3.51Å; V24-L569 WeakPolarHBondContact O-CD2 3.44Å; V24-L569 WeakPolarHBondContact O-CG 3.23Å
25	F	94.1	Very high	93.4	Very high	30 Å²	30	44 Å²	44	13%	0.132	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	148.6	179	-161.4	-90	0	0	0	111.3	I23 C27 L37 A38 L71 K571	I23-F25 WeakPolarHBondContact CG2-O 3.38Å; F25-C27 HydrophobicContact CE1-CB 4.11Å; F25-L37 CarbonylContact O-C 3.44Å; F25-L37 WeakPolarHBondContact O-CA 3.49Å; F25-A38 HydrophobicContact CB-CB 4.47Å; F25-A38 PolarHBondContact N-O 3.32Å; F25-A38 PolarHBondContact O-N 3Å; F25-L71 HydrophobicContact CB-CD1 4.07Å; F25-L71 HydrophobicContact CD1-CB 3.79Å; F25-L71 HydrophobicContact CD1-CD1 3.65Å; F25-L71 HydrophobicContact CD1-CG 4.24Å; F25-L71 HydrophobicContact CE1-CB 3.98Å; F25-L71 WeakPolarHBondContact CE1-O 3.34Å; F25-L71 HydrophobicContact CG-CD1 4.31Å; F25-K571 HydrophobicContact CE2-CG 4.31Å
26	L	94.1	Very high	93.6	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	141.5	173.6	64.3	121.6	0	0	0	112.3	I23 I35 A36 L37 L569 K571 A729 L740	I23-L26 HydrophobicContact CG2-CB 4.31Å; I23-L26 HydrophobicContact CG2-CD2 3.81Å; L26-I35 HydrophobicContact CD1-CD1 3.83Å; L26-A36 CarbonylContact C-O 3.58Å; L26-A36 VanDerWaalsContact CA-O 3.24Å; L26-A36 WeakPolarHBondContact CA-O 3.26Å; L26-L37 HydrophobicContact CB-CB 4.44Å; L26-L37 HydrophobicContact CB-CD2 4.11Å; L26-L37 HydrophobicContact CB-CG 4.02Å; L26-L569 HydrophobicContact CD2-CD2 4.39Å; L26-K571 WeakPolarHBondContact O-CE 3.33Å; L26-K571 PolarHBondContact O-NZ 3.42Å; L26-A729 HydrophobicContact CD1-CB 3.42Å; L26-A729 VanDerWaalsContact CD1-CB 3.42Å; L26-L740 HydrophobicContact CD2-CB 4.21Å; L26-L740 HydrophobicContact CD2-CD2 3.71Å; L26-L740 HydrophobicContact CD2-CG 4.45Å
27	C	94.8	Very high	93.7	Very high	22 Å²	22	39.1 Å²	39.1	15%	0.149	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	139.6	178.9	57.8	0	0	0	0	112.1	F25 A36 W73	F25-C27 HydrophobicContact CE1-CB 4.11Å; C27-A36 PolarHBondContact N-O 3.47Å; C27-A36 PolarHBondContact O-N 3.37Å; C27-W73 PolarHBondContact O-NE1 3.16Å; C27-W73 VanDerWaalsContact O-NE1 3.14Å; C27-W73 PolarHBondContact SG-NE1 3.41Å; C27-W73 VanDerWaalsContact SG-NE1 3.38Å
28	W	95.5	Very high	93.8	Very high	19 Å²	19	35.2 Å²	35.2	7%	0.072	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	145.4	175	-77.4	107.8	0	0	0	111.4	L34 I35 L49 W73 A729 N731 V736 C738 V749	W28-L34 VanDerWaalsContact CE3-O 3.3Å; W28-I35 HydrophobicContact CD2-CB 3.96Å; W28-I35 HydrophobicContact CD2-CD1 4.1Å; W28-I35 HydrophobicContact CD2-CG1 4.12Å; W28-I35 HydrophobicContact CE3-CB 3.67Å; W28-I35 HydrophobicContact CE3-CG1 4.35Å; W28-I35 HydrophobicContact CG-CD1 4.5Å; W28-I35 HydrophobicContact CG-CG1 4.46Å; W28-I35 HydrophobicContact CH2-CB 4.13Å; W28-I35 HydrophobicContact CH2-CG2 4.29Å; W28-I35 HydrophobicContact CZ2-CB 4.44Å; W28-I35 HydrophobicContact CZ2-CD1 4.03Å; W28-I35 HydrophobicContact CZ3-CB 3.75Å; W28-I35 HydrophobicContact CZ3-CG2 4.2Å; W28-L49 HydrophobicContact CH2-CD1 3.93Å; W28-W73 VanDerWaalsContact O-CD1 3.26Å; W28-A729 PolarHBondContact NE1-O 3.47Å; W28-N731 HydrophobicContact CB-CB 3.95Å; W28-N731 HydrophobicContact CG-CB 4.05Å; W28-V736 HydrophobicContact CD2-CG2 4.04Å; W28-V736 HydrophobicContact CE3-CG2 3.98Å; W28-V736 HydrophobicContact CH2-CB 4.27Å; W28-V736 HydrophobicContact CH2-CG2 3.91Å; W28-V736 HydrophobicContact CZ2-CB 4.19Å; W28-V736 HydrophobicContact CZ2-CG2 3.89Å; W28-V736 HydrophobicContact CZ3-CG2 3.95Å; W28-C738 HydrophobicContact CZ2-CB 3.73Å; W28-V749 HydrophobicContact CH2-CG1 4Å; W28-V749 HydrophobicContact CZ2-CG1 3.94Å
29	S	94.9	Very high	93.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.155	C	C	.	.			trans	-60.5	135.3	164.8	-178.3	0	0	0	0	109.4	K31 R32 L34 N731	S29-K31 VanDerWaalsContact C-N 3.27Å; S29-K31 PolarHBondContact O-N 2.87Å; S29-R32 PolarHBondContact OG-N 3.28Å; S29-L34 VanDerWaalsContact CB-O 3.29Å; S29-L34 WeakPolarHBondContact CB-O 3.4Å; S29-L34 PolarHBondContact N-O 2.82Å; S29-N731 PolarHBondContact O-ND2 2.68Å
30	P	91.7	Very high	93.7	Very high	47 Å²	47	32 Å²	32	31%	0.305	17%	0.166	S	C	.	.	S	Bend	trans	-62.3	-32.9	-179.7	-25.8	34.1	0	0	0	113.4	W73 N731 L733	P30-W73 HydrophobicContact CG-CB 3.84Å; P30-N731 PolarHBondContact O-ND2 2.86Å; P30-L733 WeakPolarHBondContact O-CD2 3.33Å
31	K	89.6	Confident	93.6	Very high	112 Å²	112	30.1 Å²	30.1	49%	0.487	15%	0.153	S	C	.	.	S	Bend	trans	-118.2	-24	-172.2	-66.1	-171.7	-179.9	176.7	0	115	S29 P75 L733	S29-K31 VanDerWaalsContact C-N 3.27Å; S29-K31 PolarHBondContact O-N 2.87Å; K31-P75 VanDerWaalsContact CE-O 3.29Å; K31-P75 WeakPolarHBondContact CE-O 3.46Å; K31-L733 HydrophobicContact CG-CD2 4.42Å
32	R	91	Very high	93.4	Very high	75 Å²	75	27 Å²	27	28%	0.283	14%	0.14	S	C	.	.	S	Bend	trans	-107.4	163	-173.9	-59.8	-179.4	177.5	-162.5	-4.2	111.5	S29 L34 E96	S29-R32 PolarHBondContact OG-N 3.28Å; R32-L34 HydrophobicContact CB-CB 4.4Å; R32-L34 HydrophobicContact CB-CD1 3.97Å; R32-L34 HydrophobicContact CB-CG 4.08Å; R32-L34 PolarHBondContact O-N 3.41Å; R32-E96 IonicContact CZ-OE1 2.97Å; R32-E96 IonicContact NH1-OE1 3.89Å; R32-E96 PolarHBondContact NH1-OE1 3.38Å; R32-E96 IonicContact NH2-OE1 2.75Å
33	D	89.8	Confident	93.4	Very high	37 Å²	37	26.7 Å²	26.7	20%	0.198	14%	0.138	C	C	.	.	S	Bend	trans	-78.4	39.9	174	63.8	-44.3	0	0	0	112.8	R48 L49	D33-R48 WeakPolarHBondContact OD2-CG 3.33Å; D33-R48 IonicContact OD2-CZ 3.94Å; D33-R48 IonicContact OD2-NE 3.07Å; D33-R48 PolarHBondContact OD2-NE 3.3Å; D33-L49 HydrophobicContact CB-CB 4.15Å; D33-L49 PolarHBondContact O-N 3.06Å
34	L	94.7	Very high	93.5	Very high	15 Å²	15	26.7 Å²	26.7	8%	0.079	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	141.6	-172.9	-63.2	170.9	0	0	0	110.5	W28 S29 R32 L46 H47 R48 V55 W73 V95	W28-L34 VanDerWaalsContact CE3-O 3.3Å; S29-L34 VanDerWaalsContact CB-O 3.29Å; S29-L34 WeakPolarHBondContact CB-O 3.4Å; S29-L34 PolarHBondContact N-O 2.82Å; R32-L34 HydrophobicContact CB-CB 4.4Å; R32-L34 HydrophobicContact CB-CD1 3.97Å; R32-L34 HydrophobicContact CB-CG 4.08Å; R32-L34 PolarHBondContact O-N 3.41Å; L34-L46 HydrophobicContact CB-CD1 4.26Å; L34-L46 HydrophobicContact CD1-CD2 4.31Å; L34-L46 HydrophobicContact CD2-CD2 4.47Å; L34-H47 CarbonylContact C-O 3.51Å; L34-H47 WeakPolarHBondContact CA-O 3.42Å; L34-R48 HydrophobicContact CD2-CB 4.26Å; L34-R48 HydrophobicContact CD2-CG 4.23Å; L34-V55 HydrophobicContact CD2-CG2 3.99Å; L34-W73 HydrophobicContact CB-CH2 4.25Å; L34-V95 HydrophobicContact CD1-CG1 3.67Å
35	I	95.8	Very high	93.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.9	175.9	-170.9	174.3	0	0	0	109.8	L26 W28 L37 H47 F52 C738	L26-I35 HydrophobicContact CD1-CD1 3.83Å; W28-I35 HydrophobicContact CD2-CB 3.96Å; W28-I35 HydrophobicContact CD2-CD1 4.1Å; W28-I35 HydrophobicContact CD2-CG1 4.12Å; W28-I35 HydrophobicContact CE3-CB 3.67Å; W28-I35 HydrophobicContact CE3-CG1 4.35Å; W28-I35 HydrophobicContact CG-CD1 4.5Å; W28-I35 HydrophobicContact CG-CG1 4.46Å; W28-I35 HydrophobicContact CH2-CB 4.13Å; W28-I35 HydrophobicContact CH2-CG2 4.29Å; W28-I35 HydrophobicContact CZ2-CB 4.44Å; W28-I35 HydrophobicContact CZ2-CD1 4.03Å; W28-I35 HydrophobicContact CZ3-CB 3.75Å; W28-I35 HydrophobicContact CZ3-CG2 4.2Å; I35-L37 HydrophobicContact CG2-CD1 4.22Å; I35-H47 HydrophobicContact CG2-CB 3.83Å; I35-H47 PolarHBondContact N-O 3.05Å; I35-H47 PolarHBondContact O-N 2.69Å; I35-F52 HydrophobicContact CG2-CE2 3.71Å; I35-F52 HydrophobicContact CG2-CZ 4.3Å; I35-C738 HydrophobicContact CD1-CB 3.84Å
36	A	96.6	Very high	93.8	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	137.3	173.9	0	0	0	0	0	109.7	L26 C27 L45 L46 L71 W73 L80	L26-A36 CarbonylContact C-O 3.58Å; L26-A36 VanDerWaalsContact CA-O 3.24Å; L26-A36 WeakPolarHBondContact CA-O 3.26Å; C27-A36 PolarHBondContact N-O 3.47Å; C27-A36 PolarHBondContact O-N 3.37Å; A36-L45 CarbonylContact C-O 3.48Å; A36-L45 WeakPolarHBondContact CA-O 3.32Å; A36-L46 HydrophobicContact CB-CD1 4.13Å; A36-L71 HydrophobicContact CB-CD2 4.25Å; A36-W73 HydrophobicContact CB-CZ2 3.78Å; A36-L80 HydrophobicContact CB-CD1 4.07Å; A36-L80 HydrophobicContact CB-CD2 3.73Å
37	L	95.4	Very high	93.8	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.1	176	-51.5	98	0	0	0	109.6	L19 I23 F25 L26 I35 V44 L45 H47 F52	L19-L37 HydrophobicContact CD1-CD2 4.21Å; I23-L37 HydrophobicContact CD1-CB 4.15Å; I23-L37 HydrophobicContact CD1-CD2 4.18Å; I23-L37 HydrophobicContact CG1-CD2 4.11Å; I23-L37 HydrophobicContact CG2-CB 4.41Å; I23-L37 HydrophobicContact CG2-CD2 4.24Å; F25-L37 CarbonylContact O-C 3.44Å; F25-L37 WeakPolarHBondContact O-CA 3.49Å; L26-L37 HydrophobicContact CB-CB 4.44Å; L26-L37 HydrophobicContact CB-CD2 4.11Å; L26-L37 HydrophobicContact CB-CG 4.02Å; I35-L37 HydrophobicContact CG2-CD1 4.22Å; L37-V44 CarbonylContact O-C 3.56Å; L37-V44 WeakPolarHBondContact O-CA 3.34Å; L37-L45 HydrophobicContact CB-CB 4.5Å; L37-L45 PolarHBondContact N-O 3.48Å; L37-L45 PolarHBondContact O-N 2.62Å; L37-H47 HydrophobicContact CD1-CB 4.27Å; L37-H47 VanDerWaalsContact CD1-ND1 3.27Å; L37-H47 WeakPolarHBondContact CD1-ND1 3.42Å; L37-F52 HydrophobicContact CD1-CZ 3.99Å; L37-F52 HydrophobicContact CD2-CZ 4.1Å
38	A	95.3	Very high	93.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	139.9	166.8	0	0	0	0	0	108.9	I23 V24 F25 V68 L71	I23-A38 WeakPolarHBondContact CA-O 3.29Å; V24-A38 HydrophobicContact CG2-CB 3.69Å; V24-A38 VanDerWaalsContact CG2-O 3.31Å; V24-A38 WeakPolarHBondContact CG2-O 3.07Å; V24-A38 PolarHBondContact N-O 3.09Å; F25-A38 HydrophobicContact CB-CB 4.47Å; F25-A38 PolarHBondContact N-O 3.32Å; F25-A38 PolarHBondContact O-N 3Å; A38-V68 HydrophobicContact CB-CB 4.18Å; A38-V68 HydrophobicContact CB-CG1 3.74Å; A38-L71 HydrophobicContact CB-CD1 3.59Å; A38-L71 HydrophobicContact CB-CG 4.48Å
39	N	94	Very high	93.3	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.016	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	171.4	178.8	69.9	22.3	0	0	0	112.8	Q21 E22 I23 T41 G42 E43	Q21-N39 HydrophobicContact CB-CB 3.93Å; E22-N39 CarbonylContact O-C 3.56Å; E22-N39 WeakPolarHBondContact O-CA 3.49Å; E22-N39 WeakPolarHBondContact O-CB 3.32Å; I23-N39 HydrophobicContact CD1-CB 4.1Å; N39-T41 PolarHBondContact ND2-OG1 2.97Å; N39-T41 PolarHBondContact O-N 2.99Å; N39-T41 PolarHBondContact OD1-N 3.36Å; N39-T41 VanDerWaalsContact OD1-N 3.1Å; N39-T41 PolarHBondContact OD1-OG1 3.17Å; N39-G42 PolarHBondContact O-N 3.15Å; N39-G42 VanDerWaalsContact O-N 3.11Å; N39-G42 PolarHBondContact OD1-N 3.42Å; N39-E43 PolarHBondContact N-O 3.39Å; N39-E43 VanDerWaalsContact N-O 3.09Å; N39-E43 PolarHBondContact ND2-OE2 3.45Å; N39-E43 WeakPolarHBondContact OD1-CB 3.36Å; N39-E43 PolarHBondContact OD1-N 3.41Å; N39-E43 PolarHBondContact OD1-O 2.96Å
40	T	92	Very high	92.9	Very high	46 Å²	46	31.9 Å²	31.9	28%	0.282	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-12.4	-179.1	53.6	0	0	0	0	114.4	E22 V24 G42	E22-T40 HydrophobicContact CB-CG2 3.61Å; E22-T40 PolarHBondContact O-N 3.3Å; V24-T40 HydrophobicContact CG1-CG2 3.51Å; T40-G42 VanDerWaalsContact C-N 3.28Å
41	T	91.6	Very high	92.5	Very high	61 Å²	61	33.7 Å²	33.7	37%	0.374	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-0.5	173.9	53.5	0	0	0	0	112.8	Q21 N39 E43	Q21-T41 HydrophobicContact CG-CG2 4.12Å; N39-T41 PolarHBondContact ND2-OG1 2.97Å; N39-T41 PolarHBondContact O-N 2.99Å; N39-T41 PolarHBondContact OD1-N 3.36Å; N39-T41 VanDerWaalsContact OD1-N 3.1Å; N39-T41 PolarHBondContact OD1-OG1 3.17Å; T41-E43 VanDerWaalsContact C-N 3.35Å
42	G	90.9	Very high	92.6	Very high	6 Å²	6	28.4 Å²	28.4	6%	0.062	16%	0.155	C	C	.	.	S	Bend	trans	83.2	10.1	-178.4	0	0	0	0	0	114.5	N39 T40 K66 V68	N39-G42 PolarHBondContact O-N 3.15Å; N39-G42 VanDerWaalsContact O-N 3.11Å; N39-G42 PolarHBondContact OD1-N 3.42Å; T40-G42 VanDerWaalsContact C-N 3.28Å; G42-K66 WeakPolarHBondContact CA-O 3.48Å; G42-V68 WeakPolarHBondContact O-CG2 3.36Å
43	E	93.8	Very high	92.6	Very high	43 Å²	43	30.6 Å²	30.6	20%	0.201	17%	0.168	C	C	.	.			trans	-93.3	134.7	-179.2	174.5	-170.9	-136.3	0	0	109.6	N39 T41 L45 S57 F58	N39-E43 PolarHBondContact N-O 3.39Å; N39-E43 VanDerWaalsContact N-O 3.09Å; N39-E43 PolarHBondContact ND2-OE2 3.45Å; N39-E43 WeakPolarHBondContact OD1-CB 3.36Å; N39-E43 PolarHBondContact OD1-N 3.41Å; N39-E43 PolarHBondContact OD1-O 2.96Å; T41-E43 VanDerWaalsContact C-N 3.35Å; E43-L45 HydrophobicContact CG-CD2 4.19Å; E43-L45 HydrophobicContact CG-CG 4.39Å; E43-S57 WeakPolarHBondContact CG-OG 3.23Å; E43-S57 WeakPolarHBondContact OE1-CB 3.44Å; E43-S57 PolarHBondContact OE1-OG 3.41Å; E43-F58 WeakPolarHBondContact CA-O 3.43Å
44	V	95.9	Very high	92.8	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.5	175.4	180	0	0	0	0	109	L37 W56 F58 V68 L71 L80 F82	L37-V44 CarbonylContact O-C 3.56Å; L37-V44 WeakPolarHBondContact O-CA 3.34Å; V44-W56 HydrophobicContact CG1-CH2 4.47Å; V44-W56 HydrophobicContact CG1-CZ3 4.36Å; V44-W56 WeakPolarHBondContact O-CZ3 3.45Å; V44-F58 HydrophobicContact CB-CB 4.26Å; V44-F58 PolarHBondContact N-O 2.82Å; V44-F58 WeakPolarHBondContact O-CB 3.18Å; V44-F58 PolarHBondContact O-N 2.84Å; V44-V68 HydrophobicContact CG2-CG1 4.24Å; V44-V68 HydrophobicContact CG2-CG2 4.02Å; V44-L71 HydrophobicContact CG1-CD2 3.69Å; V44-L71 HydrophobicContact CG2-CD2 4.4Å; V44-L80 HydrophobicContact CG1-CD2 4.11Å; V44-F82 HydrophobicContact CG2-CD1 4.37Å; V44-F82 HydrophobicContact CG2-CD2 4.12Å; V44-F82 HydrophobicContact CG2-CE2 4.35Å; V44-F82 HydrophobicContact CG2-CG 4.11Å
45	L	95.6	Very high	92.8	Very high	13 Å²	13	37.9 Å²	37.9	7%	0.068	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	136.9	-174.5	-62.4	163.1	0	0	0	109.8	A36 L37 E43 S57	A36-L45 CarbonylContact C-O 3.48Å; A36-L45 WeakPolarHBondContact CA-O 3.32Å; L37-L45 HydrophobicContact CB-CB 4.5Å; L37-L45 PolarHBondContact N-O 3.48Å; L37-L45 PolarHBondContact O-N 2.62Å; E43-L45 HydrophobicContact CG-CD2 4.19Å; E43-L45 HydrophobicContact CG-CG 4.39Å; L45-S57 WeakPolarHBondContact CD2-OG 3.18Å
46	L	96.6	Very high	92.8	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.2	170.8	-167.7	72.4	0	0	0	110.1	L34 A36 V55 W56 W73 V95	L34-L46 HydrophobicContact CB-CD1 4.26Å; L34-L46 HydrophobicContact CD1-CD2 4.31Å; L34-L46 HydrophobicContact CD2-CD2 4.47Å; A36-L46 HydrophobicContact CB-CD1 4.13Å; L46-V55 HydrophobicContact CB-CB 4.39Å; L46-V55 HydrophobicContact CD2-CB 4.26Å; L46-V55 HydrophobicContact CD2-CG1 4.37Å; L46-V55 HydrophobicContact CG-CB 4.42Å; L46-V55 PolarHBondContact O-N 3.2Å; L46-W56 HydrophobicContact CB-CD2 3.74Å; L46-W56 HydrophobicContact CB-CE3 4.07Å; L46-W56 HydrophobicContact CB-CG 4.33Å; L46-W56 HydrophobicContact CB-CH2 4.01Å; L46-W56 HydrophobicContact CB-CZ2 3.68Å; L46-W56 HydrophobicContact CB-CZ3 4.19Å; L46-W56 HydrophobicContact CD2-CD2 4.48Å; L46-W56 HydrophobicContact CD2-CZ2 3.77Å; L46-W56 VanDerWaalsContact CD2-NE1 3.28Å; L46-W56 HydrophobicContact CG-CZ2 4.2Å; L46-W56 PolarHBondContact N-O 2.68Å; L46-W73 HydrophobicContact CD1-CH2 3.64Å; L46-W73 HydrophobicContact CD1-CZ2 3.62Å; L46-V95 HydrophobicContact CD2-CG1 3.88Å; L46-V95 WeakPolarHBondContact CD2-O 3.45Å
47	H	95	Very high	92.7	Very high	3 Å²	3	40.2 Å²	40.2	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	150.5	178.3	-69.2	74.8	0	0	0	111.2	L34 I35 L37 F52 H53	L34-H47 CarbonylContact C-O 3.51Å; L34-H47 WeakPolarHBondContact CA-O 3.42Å; I35-H47 HydrophobicContact CG2-CB 3.83Å; I35-H47 PolarHBondContact N-O 3.05Å; I35-H47 PolarHBondContact O-N 2.69Å; L37-H47 HydrophobicContact CD1-CB 4.27Å; L37-H47 VanDerWaalsContact CD1-ND1 3.27Å; L37-H47 WeakPolarHBondContact CD1-ND1 3.42Å; H47-F52 HydrophobicContact CB-CD2 4.33Å; H47-F52 HydrophobicContact CB-CE1 4.35Å; H47-F52 HydrophobicContact CB-CE2 4.16Å; H47-F52 HydrophobicContact CB-CZ 4.16Å; H47-F52 AromaticContact CD2-CD1 3.68Å; H47-F52 AromaticContact CD2-CE1 3.67Å; H47-F52 PolarHBondContact CD2-O 3.19Å; H47-F52 AromaticContact CG-CE1 3.91Å; H47-H53 CarbonylContact C-O 3.57Å; H47-H53 VanDerWaalsContact CA-O 3.25Å; H47-H53 WeakPolarHBondContact CA-O 3.44Å
48	R	92.7	Very high	92.6	Very high	129 Å²	129	40.7 Å²	40.7	49%	0.487	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	151.9	171.9	-160.8	175.2	-153.3	157	12.3	110.2	D33 L34 F52 H53 V55	D33-R48 WeakPolarHBondContact OD2-CG 3.33Å; D33-R48 IonicContact OD2-CZ 3.94Å; D33-R48 IonicContact OD2-NE 3.07Å; D33-R48 PolarHBondContact OD2-NE 3.3Å; L34-R48 HydrophobicContact CD2-CB 4.26Å; L34-R48 HydrophobicContact CD2-CG 4.23Å; R48-F52 VanDerWaalsContact O-CA 3.28Å; R48-F52 WeakPolarHBondContact O-CA 3.13Å; R48-H53 PolarHBondContact N-O 2.71Å; R48-H53 PolarHBondContact O-N 3.25Å; R48-V55 HydrophobicContact CB-CG2 4.17Å
49	L	87.4	Confident	92.5	Very high	22 Å²	22	44.3 Å²	44.3	12%	0.115	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-55.2	177	177.8	66.7	0	0	0	113.2	V14 W28 D33 S51 F52 V736 V749	V14-L49 HydrophobicContact CG1-CG 4.34Å; W28-L49 HydrophobicContact CH2-CD1 3.93Å; D33-L49 HydrophobicContact CB-CB 4.15Å; D33-L49 PolarHBondContact O-N 3.06Å; L49-S51 PolarHBondContact O-N 3.03Å; L49-S51 VanDerWaalsContact O-N 3.12Å; L49-F52 PolarHBondContact O-N 3.13Å; L49-F52 VanDerWaalsContact O-N 3.1Å; L49-V736 HydrophobicContact CD1-CB 4.07Å; L49-V736 HydrophobicContact CD1-CG1 3.55Å; L49-V736 HydrophobicContact CD2-CG1 3.45Å; L49-V736 VanDerWaalsContact CD2-CG1 3.45Å; L49-V736 HydrophobicContact CG-CG1 4.11Å; L49-V749 HydrophobicContact CD1-CG1 3.41Å; L49-V749 VanDerWaalsContact CD1-CG1 3.41Å
50	A	85	Confident	92.4	Very high	56 Å²	56	46.5 Å²	46.5	46%	0.463	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-59.4	117.1	-174.2	0	0	0	0	0	111	F52 H53	A50-F52 PolarHBondContact O-N 2.68Å; A50-H53 PolarHBondContact O-N 3.35Å
51	S	83.8	Confident	92.1	Very high	85 Å²	85	48 Å²	48	59%	0.594	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	56.4	13.7	-177	69.8	0	0	0	0	115.9	V14 L49 H53	V14-S51 PolarHBondContact O-N 3.45Å; L49-S51 PolarHBondContact O-N 3.03Å; L49-S51 VanDerWaalsContact O-N 3.12Å; S51-H53 VanDerWaalsContact C-N 3.27Å; S51-H53 PolarHBondContact O-N 3.48Å
52	F	91	Very high	91.5	Very high	1 Å²	1	54.3 Å²	54.3	0%	0.004	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	50.9	46.9	-172.2	-153.6	-109.2	0	0	0	112.6	K17 L19 I35 L37 H47 R48 L49 A50 V747 V749	K17-F52 HydrophobicContact CB-CD1 4Å; K17-F52 HydrophobicContact CD-CD1 3.87Å; L19-F52 HydrophobicContact CD1-CE1 4.43Å; L19-F52 HydrophobicContact CD2-CE1 4.31Å; I35-F52 HydrophobicContact CG2-CE2 3.71Å; I35-F52 HydrophobicContact CG2-CZ 4.3Å; L37-F52 HydrophobicContact CD1-CZ 3.99Å; L37-F52 HydrophobicContact CD2-CZ 4.1Å; H47-F52 HydrophobicContact CB-CD2 4.33Å; H47-F52 HydrophobicContact CB-CE1 4.35Å; H47-F52 HydrophobicContact CB-CE2 4.16Å; H47-F52 HydrophobicContact CB-CZ 4.16Å; H47-F52 AromaticContact CD2-CD1 3.68Å; H47-F52 AromaticContact CD2-CE1 3.67Å; H47-F52 PolarHBondContact CD2-O 3.19Å; H47-F52 AromaticContact CG-CE1 3.91Å; R48-F52 VanDerWaalsContact O-CA 3.28Å; R48-F52 WeakPolarHBondContact O-CA 3.13Å; L49-F52 PolarHBondContact O-N 3.13Å; L49-F52 VanDerWaalsContact O-N 3.1Å; A50-F52 PolarHBondContact O-N 2.68Å; F52-V747 HydrophobicContact CE1-CB 4.42Å; F52-V747 HydrophobicContact CE1-CG1 4.23Å; F52-V747 HydrophobicContact CE2-CG1 3.94Å; F52-V747 HydrophobicContact CZ-CB 4.37Å; F52-V747 HydrophobicContact CZ-CG1 3.76Å; F52-V749 HydrophobicContact CD2-CG2 3.47Å; F52-V749 VanDerWaalsContact CD2-CG2 3.47Å; F52-V749 HydrophobicContact CE2-CG2 3.72Å; F52-V749 HydrophobicContact CG-CG2 4.37Å
53	H	92.1	Very high	90.8	Very high	120 Å²	120	57.4 Å²	57.4	56%	0.556	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	137.3	-179.3	-172	77.4	0	0	0	111.3	H47 R48 A50 S51	H47-H53 CarbonylContact C-O 3.57Å; H47-H53 VanDerWaalsContact CA-O 3.25Å; H47-H53 WeakPolarHBondContact CA-O 3.44Å; R48-H53 PolarHBondContact N-O 2.71Å; R48-H53 PolarHBondContact O-N 3.25Å; A50-H53 PolarHBondContact O-N 3.35Å; S51-H53 VanDerWaalsContact C-N 3.27Å; S51-H53 PolarHBondContact O-N 3.48Å
54	R	94.4	Very high	90	Very high	133 Å²	133	55.6 Å²	55.6	50%	0.502	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	121.5	179	-177	176.2	59.6	-177.8	-2.4	109.8
55	V	94.5	Very high	89.4	Confident	72 Å²	72	55.9 Å²	55.9	44%	0.436	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-54.2	177.2	-176.1	0	0	0	0	110.2	L34 L46 R48	L34-V55 HydrophobicContact CD2-CG2 3.99Å; L46-V55 HydrophobicContact CB-CB 4.39Å; L46-V55 HydrophobicContact CD2-CB 4.26Å; L46-V55 HydrophobicContact CD2-CG1 4.37Å; L46-V55 HydrophobicContact CG-CB 4.42Å; L46-V55 PolarHBondContact O-N 3.2Å; R48-V55 HydrophobicContact CB-CG2 4.17Å
56	W	95.4	Very high	89.1	Confident	19 Å²	19	62.4 Å²	62.4	7%	0.072	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	170.6	176.1	51.8	-111	0	0	0	111	V44 L46 F58 L80 V95 P98	V44-W56 HydrophobicContact CG1-CH2 4.47Å; V44-W56 HydrophobicContact CG1-CZ3 4.36Å; V44-W56 WeakPolarHBondContact O-CZ3 3.45Å; L46-W56 HydrophobicContact CB-CD2 3.74Å; L46-W56 HydrophobicContact CB-CE3 4.07Å; L46-W56 HydrophobicContact CB-CG 4.33Å; L46-W56 HydrophobicContact CB-CH2 4.01Å; L46-W56 HydrophobicContact CB-CZ2 3.68Å; L46-W56 HydrophobicContact CB-CZ3 4.19Å; L46-W56 HydrophobicContact CD2-CD2 4.48Å; L46-W56 HydrophobicContact CD2-CZ2 3.77Å; L46-W56 VanDerWaalsContact CD2-NE1 3.28Å; L46-W56 HydrophobicContact CG-CZ2 4.2Å; L46-W56 PolarHBondContact N-O 2.68Å; W56-F58 HydrophobicContact CE3-CB 4.15Å; W56-F58 HydrophobicContact CZ3-CB 3.69Å; W56-L80 HydrophobicContact CH2-CD2 4.35Å; W56-V95 PolarHBondContact NE1-O 3.5Å; W56-P98 HydrophobicContact CB-CB 4.1Å; W56-P98 HydrophobicContact CB-CG 4.11Å; W56-P98 HydrophobicContact CD2-CB 3.88Å; W56-P98 HydrophobicContact CE3-CB 3.85Å; W56-P98 HydrophobicContact CG-CB 4.01Å; W56-P98 HydrophobicContact CG-CG 4.38Å
57	S	94.3	Very high	88.8	Confident	30 Å²	30	68.2 Å²	68.2	21%	0.21	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	139	169.9	-164.5	0	0	0	0	110.9	E43 L45 P59	E43-S57 WeakPolarHBondContact CG-OG 3.23Å; E43-S57 WeakPolarHBondContact OE1-CB 3.44Å; E43-S57 PolarHBondContact OE1-OG 3.41Å; L45-S57 WeakPolarHBondContact CD2-OG 3.18Å; S57-P59 WeakPolarHBondContact O-CD 3.29Å
58	F	94.3	Very high	88.8	Confident	10 Å²	10	68.6 Å²	68.6	4%	0.044	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	93.8	176.1	-165.9	-73.6	0	0	0	108.8	E43 V44 W56 T64 F82 P98	E43-F58 WeakPolarHBondContact CA-O 3.43Å; V44-F58 HydrophobicContact CB-CB 4.26Å; V44-F58 PolarHBondContact N-O 2.82Å; V44-F58 WeakPolarHBondContact O-CB 3.18Å; V44-F58 PolarHBondContact O-N 2.84Å; W56-F58 HydrophobicContact CE3-CB 4.15Å; W56-F58 HydrophobicContact CZ3-CB 3.69Å; F58-T64 HydrophobicContact CE1-CG2 3.88Å; F58-T64 HydrophobicContact CZ-CG2 4.06Å; F58-F82 HydrophobicContact CD1-CZ 4.05Å; F58-F82 AromaticContact CE1-CZ 3.91Å; F58-F82 HydrophobicContact CE1-CZ 3.91Å; F58-F82 HydrophobicContact CZ-CZ 4.36Å; F58-P98 VanDerWaalsContact CD2-C 3.49Å; F58-P98 HydrophobicContact CD2-CB 4.14Å; F58-P98 VanDerWaalsContact CD2-O 3.31Å; F58-P98 WeakPolarHBondContact CD2-O 3.48Å; F58-P98 WeakPolarHBondContact CE2-O 3.12Å
59	P	92.3	Very high	88.8	Confident	77 Å²	77	64.3 Å²	64.3	50%	0.5	34%	0.34	S	S	.	.			trans	-74.5	153.3	179.4	30.9	-34.9	0	0	0	111.6	S57	S57-P59 WeakPolarHBondContact O-CD 3.29Å
60	P	91.3	Very high	89.1	Confident	49 Å²	49	63.3 Å²	63.3	32%	0.318	34%	0.335	S	S	.	.			trans	-63.9	140.1	172.6	28.9	-35.8	0	0	0	110.7	G65 K66	P60-G65 WeakPolarHBondContact CB-O 3.45Å; P60-K66 HydrophobicContact CB-CG 4.41Å
61	N	86.9	Confident	89.6	Confident	77 Å²	77	60.9 Å²	60.9	41%	0.412	32%	0.315	S	S	.	.			trans	-133.3	177.5	174.8	64.8	55	0	0	0	110.2	N63 T64 G65	N61-N63 PolarHBondContact O-N 3.32Å; N61-N63 VanDerWaalsContact O-N 3.13Å; N61-N63 WeakPolarHBondContact OD1-CA 3.44Å; N61-N63 WeakPolarHBondContact OD1-CB 3.31Å; N61-N63 PolarHBondContact OD1-N 3.49Å; N61-T64 PolarHBondContact N-OG1 2.83Å; N61-T64 PolarHBondContact ND2-OG1 3.35Å; N61-T64 PolarHBondContact O-N 3.41Å; N61-T64 VanDerWaalsContact O-N 3.16Å; N61-T64 PolarHBondContact OD1-N 3.42Å; N61-T64 PolarHBondContact OD1-OG1 2.75Å; N61-T64 VanDerWaalsContact OD1-OG1 3.12Å; N61-G65 PolarHBondContact O-N 2.72Å
62	E	79.4	Confident	90.2	Very high	194 Å²	194	57.2 Å²	57.2	91%	0.907	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-29.1	-178	-65.4	-173.1	168.8	0	0	113.2
63	N	74.6	Confident	90.5	Very high	70 Å²	70	57.9 Å²	57.9	37%	0.374	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-24.7	-177.8	-61	-23	0	0	0	112.9	N61 N151	N61-N63 PolarHBondContact O-N 3.32Å; N61-N63 VanDerWaalsContact O-N 3.13Å; N61-N63 WeakPolarHBondContact OD1-CA 3.44Å; N61-N63 WeakPolarHBondContact OD1-CB 3.31Å; N61-N63 PolarHBondContact OD1-N 3.49Å; N63-N151 PolarHBondContact ND2-O 3.24Å
64	T	77.4	Confident	90.5	Very high	6 Å²	6	52.5 Å²	52.5	4%	0.037	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	1.2	-169.7	57.6	0	0	0	0	115.4	F58 N61 L84 I91	F58-T64 HydrophobicContact CE1-CG2 3.88Å; F58-T64 HydrophobicContact CZ-CG2 4.06Å; N61-T64 PolarHBondContact N-OG1 2.83Å; N61-T64 PolarHBondContact ND2-OG1 3.35Å; N61-T64 PolarHBondContact O-N 3.41Å; N61-T64 VanDerWaalsContact O-N 3.16Å; N61-T64 PolarHBondContact OD1-N 3.42Å; N61-T64 PolarHBondContact OD1-OG1 2.75Å; N61-T64 VanDerWaalsContact OD1-OG1 3.12Å; T64-L84 WeakPolarHBondContact O-CD1 3.48Å; T64-L84 WeakPolarHBondContact O-CD2 3.22Å; T64-L84 WeakPolarHBondContact O-CG 3.33Å; T64-I91 HydrophobicContact CG2-CD1 3.1Å
65	G	83.6	Confident	90.4	Very high	7 Å²	7	47 Å²	47	7%	0.072	25%	0.248	C	C	.	.			trans	66.5	-177.8	177.2	0	0	0	0	0	114.2	P60 N61 D86	P60-G65 WeakPolarHBondContact CB-O 3.45Å; N61-G65 PolarHBondContact O-N 2.72Å; G65-D86 VanDerWaalsContact CA-OD2 3.32Å; G65-D86 WeakPolarHBondContact CA-OD2 3.48Å
66	K	89.4	Confident	90.2	Very high	150 Å²	150	45.2 Å²	45.2	65%	0.652	24%	0.236	S	C	*	.	S	Bend	trans	-122.3	-12.6	-168.6	-63.8	-177.2	-178.9	178.6	0	114.9	G42 P60 D86	G42-K66 WeakPolarHBondContact CA-O 3.48Å; P60-K66 HydrophobicContact CB-CG 4.41Å; K66-D86 PolarHBondContact N-OD2 3.22Å
67	E	91	Very high	89.9	Confident	122 Å²	122	44.3 Å²	44.3	57%	0.57	23%	0.232	S	C	*	.			trans	-121.1	93.8	-172.6	-68	-173.2	179	0	0	111.6	L84 A85 D86	E67-L84 CarbonylContact O-C 3.55Å; E67-L84 VanDerWaalsContact O-CA 3.3Å; E67-L84 WeakPolarHBondContact O-CA 3.23Å; E67-A85 HydrophobicContact CB-CB 4.21Å; E67-A85 PolarHBondContact O-N 3.02Å; E67-D86 HydrophobicContact CB-CB 4.45Å
68	V	94.1	Very high	89.7	Confident	11 Å²	11	47.6 Å²	47.6	7%	0.067	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	126.6	175.6	-178	0	0	0	0	110	A38 G42 V44 F82 A83 L84	A38-V68 HydrophobicContact CB-CB 4.18Å; A38-V68 HydrophobicContact CB-CG1 3.74Å; G42-V68 WeakPolarHBondContact O-CG2 3.36Å; V44-V68 HydrophobicContact CG2-CG1 4.24Å; V44-V68 HydrophobicContact CG2-CG2 4.02Å; V68-F82 HydrophobicContact CG1-CB 4.2Å; V68-F82 HydrophobicContact CG1-CD2 4.37Å; V68-F82 HydrophobicContact CG2-CD2 4.17Å; V68-A83 WeakPolarHBondContact CA-O 3.36Å; V68-L84 HydrophobicContact CG2-CD2 3.76Å
69	T	92.3	Very high	89.6	Confident	40 Å²	40	47.1 Å²	47.1	25%	0.245	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-39.5	-179.4	56	0	0	0	0	113.7	A83 A85 V110	T69-A83 PolarHBondContact N-O 2.96Å; T69-A85 HydrophobicContact CG2-CB 3.65Å; T69-V110 WeakPolarHBondContact CB-O 3.28Å; T69-V110 PolarHBondContact OG1-O 3.17Å
70	C	93.3	Very high	89.7	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	155.9	-172.2	47.7	0	0	0	0	112.2	F82 A83 M113	C70-F82 VanDerWaalsContact O-CA 3.28Å; C70-F82 WeakPolarHBondContact O-CA 3.33Å; C70-A83 PolarHBondContact O-N 3.08Å; C70-A83 VanDerWaalsContact O-N 3.13Å; C70-M113 HydrophobicContact CB-CG 4.32Å; C70-M113 HydrophobicContact CB-SD 4.31Å; C70-M113 VanDerWaalsContact SG-CG 3.52Å; C70-M113 PolarHBondContact SG-SD 3.4Å
71	L	96.2	Very high	89.9	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.026	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	142.6	178.5	-69.9	135.1	0	0	0	109.3	F25 A36 A38 V44 L80 A81 F82	F25-L71 HydrophobicContact CB-CD1 4.07Å; F25-L71 HydrophobicContact CD1-CB 3.79Å; F25-L71 HydrophobicContact CD1-CD1 3.65Å; F25-L71 HydrophobicContact CD1-CG 4.24Å; F25-L71 HydrophobicContact CE1-CB 3.98Å; F25-L71 WeakPolarHBondContact CE1-O 3.34Å; F25-L71 HydrophobicContact CG-CD1 4.31Å; A36-L71 HydrophobicContact CB-CD2 4.25Å; A38-L71 HydrophobicContact CB-CD1 3.59Å; A38-L71 HydrophobicContact CB-CG 4.48Å; V44-L71 HydrophobicContact CG1-CD2 3.69Å; V44-L71 HydrophobicContact CG2-CD2 4.4Å; L71-L80 HydrophobicContact CB-CD1 4.44Å; L71-L80 HydrophobicContact CD2-CD1 4.01Å; L71-L80 HydrophobicContact CD2-CD2 3.87Å; L71-L80 HydrophobicContact CD2-CG 4.12Å; L71-A81 CarbonylContact C-O 3.4Å; L71-A81 WeakPolarHBondContact CA-O 3.39Å; L71-F82 HydrophobicContact CD2-CB 3.95Å; L71-F82 HydrophobicContact CG-CB 4.28Å
72	A	96.9	Very high	90.4	Very high	7 Å²	7	37.6 Å²	37.6	6%	0.058	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	126.4	172.7	0	0	0	0	0	111	A81 M113 W115 L176	A72-A81 PolarHBondContact N-O 2.73Å; A72-A81 PolarHBondContact O-N 3.45Å; A72-M113 HydrophobicContact CB-CB 3.75Å; A72-M113 HydrophobicContact CB-CE 4.29Å; A72-W115 HydrophobicContact CB-CB 4.35Å; A72-L176 HydrophobicContact CB-CD1 4.09Å
73	W	96.4	Very high	91.1	Very high	15 Å²	15	28.4 Å²	28.4	6%	0.057	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	137.5	173.2	-74.6	90.4	0	0	0	110.8	C27 W28 P30 L34 A36 L46 L80 V95 W115	C27-W73 PolarHBondContact O-NE1 3.16Å; C27-W73 VanDerWaalsContact O-NE1 3.14Å; C27-W73 PolarHBondContact SG-NE1 3.41Å; C27-W73 VanDerWaalsContact SG-NE1 3.38Å; W28-W73 VanDerWaalsContact O-CD1 3.26Å; P30-W73 HydrophobicContact CG-CB 3.84Å; L34-W73 HydrophobicContact CB-CH2 4.25Å; A36-W73 HydrophobicContact CB-CZ2 3.78Å; L46-W73 HydrophobicContact CD1-CH2 3.64Å; L46-W73 HydrophobicContact CD1-CZ2 3.62Å; W73-L80 HydrophobicContact CD2-CD1 3.9Å; W73-L80 HydrophobicContact CG-CD1 4.01Å; W73-L80 HydrophobicContact CZ2-CD1 4.38Å; W73-V95 HydrophobicContact CE3-CG2 4.14Å; W73-V95 HydrophobicContact CH2-CG1 3.84Å; W73-V95 HydrophobicContact CH2-CG2 3.96Å; W73-V95 HydrophobicContact CZ3-CB 4.25Å; W73-V95 HydrophobicContact CZ3-CG1 3.82Å; W73-V95 HydrophobicContact CZ3-CG2 3.33Å; W73-W115 WeakPolarHBondContact O-CB 3.45Å
74	R	93.7	Very high	92.1	Very high	7 Å²	7	25.2 Å²	25.2	3%	0.026	12%	0.123	C	C	.	.			trans	-63	142.1	164.7	-168.2	168	70.7	178.7	1.2	109	D76 G77 L79 W115 K166 L167	R74-D76 WeakPolarHBondContact CB-OD1 3.21Å; R74-D76 WeakPolarHBondContact CG-OD1 3.37Å; R74-D76 IonicContact CZ-OD1 2.97Å; R74-D76 IonicContact CZ-OD2 2.91Å; R74-D76 IonicContact NE-OD1 3.19Å; R74-D76 PolarHBondContact NE-OD1 3.41Å; R74-D76 IonicContact NE-OD2 3.65Å; R74-D76 PolarHBondContact NE-OD2 3.22Å; R74-D76 VanDerWaalsContact NE-OD2 3.1Å; R74-D76 IonicContact NH2-OD1 2.88Å; R74-D76 IonicContact NH2-OD2 3.27Å; R74-D76 PolarHBondContact NH2-OD2 2.94Å; R74-D76 PolarHBondContact O-N 2.93Å; R74-G77 PolarHBondContact O-N 3.14Å; R74-L79 HydrophobicContact CB-CB 4.01Å; R74-L79 VanDerWaalsContact CZ-CD1 3.43Å; R74-L79 PolarHBondContact N-O 3.1Å; R74-W115 HydrophobicContact CB-CD2 3.97Å; R74-W115 HydrophobicContact CB-CE3 3.89Å; R74-W115 HydrophobicContact CB-CH2 3.99Å; R74-W115 HydrophobicContact CB-CZ2 4.06Å; R74-W115 HydrophobicContact CB-CZ3 3.87Å; R74-W115 HydrophobicContact CG-CD2 4.17Å; R74-W115 HydrophobicContact CG-CH2 4.23Å; R74-W115 HydrophobicContact CG-CZ2 3.82Å; R74-K166 PolarHBondContact NH1-O 3.36Å; R74-K166 PolarHBondContact NH2-O 3.46Å; R74-L167 PolarHBondContact NH1-O 3.44Å; R74-L167 VanDerWaalsContact NH1-O 3.11Å
75	P	91.6	Very high	92.8	Very high	18 Å²	18	25.9 Å²	25.9	12%	0.117	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-23.1	-177.3	-31.8	38.3	0	0	0	115.8	K31 G77 E117	K31-P75 VanDerWaalsContact CE-O 3.29Å; K31-P75 WeakPolarHBondContact CE-O 3.46Å; P75-G77 VanDerWaalsContact C-N 3.32Å; P75-E117 HydrophobicContact CB-CB 3.86Å; P75-E117 HydrophobicContact CG-CB 3.8Å
76	D	89.1	Confident	93.2	Very high	34 Å²	34	28.8 Å²	28.8	18%	0.182	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-12.3	175	74.1	-16	0	0	0	114.3	R74 K78	R74-D76 WeakPolarHBondContact CB-OD1 3.21Å; R74-D76 WeakPolarHBondContact CG-OD1 3.37Å; R74-D76 IonicContact CZ-OD1 2.97Å; R74-D76 IonicContact CZ-OD2 2.91Å; R74-D76 IonicContact NE-OD1 3.19Å; R74-D76 PolarHBondContact NE-OD1 3.41Å; R74-D76 IonicContact NE-OD2 3.65Å; R74-D76 PolarHBondContact NE-OD2 3.22Å; R74-D76 VanDerWaalsContact NE-OD2 3.1Å; R74-D76 IonicContact NH2-OD1 2.88Å; R74-D76 IonicContact NH2-OD2 3.27Å; R74-D76 PolarHBondContact NH2-OD2 2.94Å; R74-D76 PolarHBondContact O-N 2.93Å; D76-K78 VanDerWaalsContact C-N 3.3Å; D76-K78 PolarHBondContact O-N 2.75Å; D76-K78 PolarHBondContact OD1-N 2.76Å; D76-K78 WeakPolarHBondContact OD2-CB 3.5Å; D76-K78 WeakPolarHBondContact OD2-CD 3.29Å; D76-K78 WeakPolarHBondContact OD2-CG 3.19Å
77	G	90.7	Very high	93.3	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	71.9	15.8	-178.5	0	0	0	0	0	114.8	R74 P75	R74-G77 PolarHBondContact O-N 3.14Å; P75-G77 VanDerWaalsContact C-N 3.32Å
78	K	89.1	Confident	93.5	Very high	100 Å²	100	22.6 Å²	22.6	44%	0.435	12%	0.118	S	C	.	.	S	Bend	trans	-99.2	-19.4	-179.4	-61.6	-175.5	-176.8	175.5	0	114.2	D76 V95	D76-K78 VanDerWaalsContact C-N 3.3Å; D76-K78 PolarHBondContact O-N 2.75Å; D76-K78 PolarHBondContact OD1-N 2.76Å; D76-K78 WeakPolarHBondContact OD2-CB 3.5Å; D76-K78 WeakPolarHBondContact OD2-CD 3.29Å; D76-K78 WeakPolarHBondContact OD2-CG 3.19Å; K78-V95 VanDerWaalsContact C-CG2 3.45Å; K78-V95 WeakPolarHBondContact O-CG2 3.45Å
79	L	91.8	Very high	93.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	147.4	176.4	-68.6	-176.6	0	0	0	110.9	R74 L101 W115 L167	R74-L79 HydrophobicContact CB-CB 4.01Å; R74-L79 VanDerWaalsContact CZ-CD1 3.43Å; R74-L79 PolarHBondContact N-O 3.1Å; L79-L101 HydrophobicContact CD2-CD1 3.4Å; L79-L101 VanDerWaalsContact CD2-CD1 3.4Å; L79-W115 HydrophobicContact CB-CH2 4.42Å; L79-W115 HydrophobicContact CD1-CH2 4.43Å; L79-L167 HydrophobicContact CD1-CD1 4.15Å
80	L	95.3	Very high	93.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.1	171.5	178.6	68.5	0	0	0	108.6	A36 V44 W56 L71 W73 L92 C93	A36-L80 HydrophobicContact CB-CD1 4.07Å; A36-L80 HydrophobicContact CB-CD2 3.73Å; V44-L80 HydrophobicContact CG1-CD2 4.11Å; W56-L80 HydrophobicContact CH2-CD2 4.35Å; L71-L80 HydrophobicContact CB-CD1 4.44Å; L71-L80 HydrophobicContact CD2-CD1 4.01Å; L71-L80 HydrophobicContact CD2-CD2 3.87Å; L71-L80 HydrophobicContact CD2-CG 4.12Å; W73-L80 HydrophobicContact CD2-CD1 3.9Å; W73-L80 HydrophobicContact CG-CD1 4.01Å; W73-L80 HydrophobicContact CZ2-CD1 4.38Å; L80-L92 WeakPolarHBondContact O-CA 3.48Å; L80-C93 PolarHBondContact N-O 2.83Å; L80-C93 VanDerWaalsContact N-O 3.11Å; L80-C93 PolarHBondContact O-N 2.92Å; L80-C93 PolarHBondContact O-SG 2.9Å
81	A	95.9	Very high	93.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	140.7	170.4	0	0	0	0	0	110	L71 A72 I91 L92 M113 W115 L176	L71-A81 CarbonylContact C-O 3.4Å; L71-A81 WeakPolarHBondContact CA-O 3.39Å; A72-A81 PolarHBondContact N-O 2.73Å; A72-A81 PolarHBondContact O-N 3.45Å; A81-I91 CarbonylContact C-O 3.56Å; A81-I91 VanDerWaalsContact CA-O 3.27Å; A81-I91 WeakPolarHBondContact CA-O 3.39Å; A81-L92 HydrophobicContact CB-CD2 3.46Å; A81-L92 VanDerWaalsContact CB-CD2 3.46Å; A81-M113 HydrophobicContact CB-CE 3.59Å; A81-W115 HydrophobicContact CB-CE3 4Å; A81-W115 HydrophobicContact CB-CZ3 3.64Å; A81-L176 HydrophobicContact CB-CD2 4.23Å
82	F	96	Very high	93.2	Very high	3 Å²	3	22.6 Å²	22.6	1%	0.013	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	146.3	167.9	61.4	-86.8	0	0	0	111.3	V44 F58 V68 C70 L71 L84 I90 I91 C93	V44-F82 HydrophobicContact CG2-CD1 4.37Å; V44-F82 HydrophobicContact CG2-CD2 4.12Å; V44-F82 HydrophobicContact CG2-CE2 4.35Å; V44-F82 HydrophobicContact CG2-CG 4.11Å; F58-F82 HydrophobicContact CD1-CZ 4.05Å; F58-F82 AromaticContact CE1-CZ 3.91Å; F58-F82 HydrophobicContact CE1-CZ 3.91Å; F58-F82 HydrophobicContact CZ-CZ 4.36Å; V68-F82 HydrophobicContact CG1-CB 4.2Å; V68-F82 HydrophobicContact CG1-CD2 4.37Å; V68-F82 HydrophobicContact CG2-CD2 4.17Å; C70-F82 VanDerWaalsContact O-CA 3.28Å; C70-F82 WeakPolarHBondContact O-CA 3.33Å; L71-F82 HydrophobicContact CD2-CB 3.95Å; L71-F82 HydrophobicContact CG-CB 4.28Å; F82-L84 HydrophobicContact CD2-CD2 4.36Å; F82-L84 HydrophobicContact CD2-CG 4.4Å; F82-L84 HydrophobicContact CE2-CD1 4.46Å; F82-L84 HydrophobicContact CE2-CD2 4.28Å; F82-L84 HydrophobicContact CE2-CG 4.44Å; F82-I90 WeakPolarHBondContact O-CA 3.27Å; F82-I91 HydrophobicContact CD1-CB 4.23Å; F82-I91 HydrophobicContact CD1-CG2 4.46Å; F82-I91 HydrophobicContact CD2-CB 4.3Å; F82-I91 HydrophobicContact CE1-CB 3.73Å; F82-I91 HydrophobicContact CE1-CG2 3.6Å; F82-I91 HydrophobicContact CE2-CB 3.82Å; F82-I91 HydrophobicContact CE2-CD1 3.71Å; F82-I91 HydrophobicContact CE2-CG1 4.12Å; F82-I91 HydrophobicContact CE2-CG2 4.33Å; F82-I91 HydrophobicContact CG-CB 4.5Å; F82-I91 HydrophobicContact CZ-CB 3.52Å; F82-I91 HydrophobicContact CZ-CD1 3.74Å; F82-I91 HydrophobicContact CZ-CG1 4.15Å; F82-I91 HydrophobicContact CZ-CG2 3.53Å; F82-I91 PolarHBondContact N-O 3.38Å; F82-I91 PolarHBondContact O-N 2.82Å; F82-C93 HydrophobicContact CE1-CB 4.24Å
83	A	95.8	Very high	92.9	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.008	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	146.3	-178	0	0	0	0	0	112.2	V68 T69 C70 I90 V110 M113	V68-A83 WeakPolarHBondContact CA-O 3.36Å; T69-A83 PolarHBondContact N-O 2.96Å; C70-A83 PolarHBondContact O-N 3.08Å; C70-A83 VanDerWaalsContact O-N 3.13Å; A83-I90 HydrophobicContact CB-CG1 4.05Å; A83-V110 HydrophobicContact CB-CB 3.83Å; A83-V110 HydrophobicContact CB-CG1 4.28Å; A83-V110 HydrophobicContact CB-CG2 4.24Å; A83-M113 HydrophobicContact CB-SD 3.75Å
84	L	94.4	Very high	92.4	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.016	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.3	-174.9	-61.9	152.3	0	0	0	109.9	T64 E67 V68 F82 T87 K88 K89 I91	T64-L84 WeakPolarHBondContact O-CD1 3.48Å; T64-L84 WeakPolarHBondContact O-CD2 3.22Å; T64-L84 WeakPolarHBondContact O-CG 3.33Å; E67-L84 CarbonylContact O-C 3.55Å; E67-L84 VanDerWaalsContact O-CA 3.3Å; E67-L84 WeakPolarHBondContact O-CA 3.23Å; V68-L84 HydrophobicContact CG2-CD2 3.76Å; F82-L84 HydrophobicContact CD2-CD2 4.36Å; F82-L84 HydrophobicContact CD2-CG 4.4Å; F82-L84 HydrophobicContact CE2-CD1 4.46Å; F82-L84 HydrophobicContact CE2-CD2 4.28Å; F82-L84 HydrophobicContact CE2-CG 4.44Å; L84-T87 WeakPolarHBondContact CB-OG1 3.33Å; L84-K88 VanDerWaalsContact O-CA 3.28Å; L84-K88 WeakPolarHBondContact O-CA 3.49Å; L84-K88 PolarHBondContact O-N 2.72Å; L84-K88 VanDerWaalsContact O-N 3.15Å; L84-K89 WeakPolarHBondContact CB-O 3.27Å; L84-K89 HydrophobicContact CD1-CB 4.13Å; L84-K89 PolarHBondContact N-O 3.35Å; L84-K89 PolarHBondContact O-N 3.4Å; L84-I91 HydrophobicContact CD1-CD1 3.49Å; L84-I91 VanDerWaalsContact CD1-CD1 3.49Å; L84-I91 HydrophobicContact CD1-CG1 3.78Å
85	A	92.3	Very high	92.2	Very high	20 Å²	20	21.7 Å²	21.7	17%	0.165	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-40.3	-177	0	0	0	0	0	112.9	E67 T69 P109	E67-A85 HydrophobicContact CB-CB 4.21Å; E67-A85 PolarHBondContact O-N 3.02Å; T69-A85 HydrophobicContact CG2-CB 3.65Å; A85-P109 HydrophobicContact CB-CB 4.42Å
86	D	91.7	Very high	91.9	Very high	68 Å²	68	26.8 Å²	26.8	36%	0.364	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-50.5	-171.8	61.5	-22.4	0	0	0	112.4	G65 K66 E67	G65-D86 VanDerWaalsContact CA-OD2 3.32Å; G65-D86 WeakPolarHBondContact CA-OD2 3.48Å; K66-D86 PolarHBondContact N-OD2 3.22Å; E67-D86 HydrophobicContact CB-CB 4.45Å
87	T	91.7	Very high	91.7	Very high	50 Å²	50	28.5 Å²	28.5	31%	0.307	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-10.7	-179.7	55.6	0	0	0	0	113	L84 K89	L84-T87 WeakPolarHBondContact CB-OG1 3.33Å; T87-K89 VanDerWaalsContact C-N 3.29Å; T87-K89 PolarHBondContact O-N 2.84Å
88	K	94.4	Very high	91.5	Very high	91 Å²	91	31.2 Å²	31.2	40%	0.396	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	48.4	-174.7	-52.5	174.5	-173.6	177.3	0	111.3	L84 S105 V106 P109	L84-K88 VanDerWaalsContact O-CA 3.28Å; L84-K88 WeakPolarHBondContact O-CA 3.49Å; L84-K88 PolarHBondContact O-N 2.72Å; L84-K88 VanDerWaalsContact O-N 3.15Å; K88-S105 WeakPolarHBondContact O-CA 3.37Å; K88-V106 HydrophobicContact CB-CG2 4.23Å; K88-V106 WeakPolarHBondContact CB-O 3.33Å; K88-V106 VanDerWaalsContact O-CG2 3.23Å; K88-V106 WeakPolarHBondContact O-CG2 2.99Å; K88-V106 PolarHBondContact O-N 3.36Å; K88-P109 HydrophobicContact CG-CG 4.4Å
89	K	92.1	Very high	91.1	Very high	57 Å²	57	29.1 Å²	29.1	25%	0.248	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	152.6	179.3	-70.5	-177.8	-175.9	178.9	0	110.8	L84 T87 F104	L84-K89 WeakPolarHBondContact CB-O 3.27Å; L84-K89 HydrophobicContact CD1-CB 4.13Å; L84-K89 PolarHBondContact N-O 3.35Å; L84-K89 PolarHBondContact O-N 3.4Å; T87-K89 VanDerWaalsContact C-N 3.29Å; T87-K89 PolarHBondContact O-N 2.84Å; K89-F104 WeakPolarHBondContact CA-O 3.5Å
90	I	94.5	Very high	90.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	136.4	168.1	-63.9	-179.9	0	0	0	107.9	F82 A83 L92 S103 F104 V106 V110 M113 L178	F82-I90 WeakPolarHBondContact O-CA 3.27Å; A83-I90 HydrophobicContact CB-CG1 4.05Å; I90-L92 HydrophobicContact CG2-CD2 4.43Å; I90-S103 VanDerWaalsContact O-CA 3.26Å; I90-S103 WeakPolarHBondContact O-CA 3.48Å; I90-F104 HydrophobicContact CB-CD1 4.37Å; I90-F104 HydrophobicContact CB-CD2 4.4Å; I90-F104 HydrophobicContact CB-CE1 3.82Å; I90-F104 HydrophobicContact CB-CE2 3.89Å; I90-F104 HydrophobicContact CB-CZ 3.58Å; I90-F104 HydrophobicContact CD1-CE2 3.75Å; I90-F104 HydrophobicContact CD1-CZ 3.73Å; I90-F104 HydrophobicContact CG1-CE2 4.19Å; I90-F104 HydrophobicContact CG1-CZ 4.18Å; I90-F104 HydrophobicContact CG2-CE1 3.73Å; I90-F104 HydrophobicContact CG2-CE2 4.46Å; I90-F104 HydrophobicContact CG2-CZ 3.66Å; I90-F104 PolarHBondContact N-O 3.4Å; I90-F104 PolarHBondContact O-N 2.93Å; I90-V106 HydrophobicContact CD1-CG1 3.8Å; I90-V106 HydrophobicContact CG1-CG1 4.13Å; I90-V110 HydrophobicContact CD1-CG2 4.32Å; I90-M113 HydrophobicContact CD1-CE 4.38Å; I90-M113 HydrophobicContact CG2-CE 4.12Å; I90-L178 HydrophobicContact CD1-CD1 3.22Å; I90-L178 HydrophobicContact CD1-CD2 3.5Å; I90-L178 HydrophobicContact CD1-CG 3.99Å
91	I	92.4	Very high	90	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.8	179.2	-58.7	-173.9	0	0	0	108.6	T64 A81 F82 L84	T64-I91 HydrophobicContact CG2-CD1 3.1Å; A81-I91 CarbonylContact C-O 3.56Å; A81-I91 VanDerWaalsContact CA-O 3.27Å; A81-I91 WeakPolarHBondContact CA-O 3.39Å; F82-I91 HydrophobicContact CD1-CB 4.23Å; F82-I91 HydrophobicContact CD1-CG2 4.46Å; F82-I91 HydrophobicContact CD2-CB 4.3Å; F82-I91 HydrophobicContact CE1-CB 3.73Å; F82-I91 HydrophobicContact CE1-CG2 3.6Å; F82-I91 HydrophobicContact CE2-CB 3.82Å; F82-I91 HydrophobicContact CE2-CD1 3.71Å; F82-I91 HydrophobicContact CE2-CG1 4.12Å; F82-I91 HydrophobicContact CE2-CG2 4.33Å; F82-I91 HydrophobicContact CG-CB 4.5Å; F82-I91 HydrophobicContact CZ-CB 3.52Å; F82-I91 HydrophobicContact CZ-CD1 3.74Å; F82-I91 HydrophobicContact CZ-CG1 4.15Å; F82-I91 HydrophobicContact CZ-CG2 3.53Å; F82-I91 PolarHBondContact N-O 3.38Å; F82-I91 PolarHBondContact O-N 2.82Å; L84-I91 HydrophobicContact CD1-CD1 3.49Å; L84-I91 VanDerWaalsContact CD1-CD1 3.49Å; L84-I91 HydrophobicContact CD1-CG1 3.78Å
92	L	91.5	Very high	89.4	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	113.8	168.5	-53.1	-177.6	0	0	0	107.6	L80 A81 I90 L101 H102 W115 L167 M192	L80-L92 WeakPolarHBondContact O-CA 3.48Å; A81-L92 HydrophobicContact CB-CD2 3.46Å; A81-L92 VanDerWaalsContact CB-CD2 3.46Å; I90-L92 HydrophobicContact CG2-CD2 4.43Å; L92-L101 WeakPolarHBondContact O-CB 3.43Å; L92-L101 PolarHBondContact O-N 3.24Å; L92-H102 HydrophobicContact CB-CB 4.2Å; L92-H102 HydrophobicContact CD1-CB 4.18Å; L92-H102 HydrophobicContact CG-CB 4.44Å; L92-H102 PolarHBondContact N-O 3.44Å; L92-H102 PolarHBondContact O-N 3.05Å; L92-H102 VanDerWaalsContact O-N 3.15Å; L92-W115 HydrophobicContact CD2-CH2 3.91Å; L92-W115 HydrophobicContact CD2-CZ3 4.01Å; L92-L167 HydrophobicContact CB-CD1 4.49Å; L92-L167 HydrophobicContact CD1-CD1 3.99Å; L92-M192 HydrophobicContact CD1-CG 4.38Å
93	C	89.8	Confident	88.9	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	154.3	176.6	64.7	0	0	0	0	112.2	L80 F82 E99	L80-C93 PolarHBondContact N-O 2.83Å; L80-C93 VanDerWaalsContact N-O 3.11Å; L80-C93 PolarHBondContact O-N 2.92Å; L80-C93 PolarHBondContact O-SG 2.9Å; F82-C93 HydrophobicContact CE1-CB 4.24Å; C93-E99 WeakPolarHBondContact CA-O 3.48Å; C93-E99 VanDerWaalsContact CB-O 3.27Å; C93-E99 WeakPolarHBondContact CB-O 3.39Å
94	D	86.8	Confident	88.6	Confident	7 Å²	7	33.2 Å²	33.2	4%	0.037	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	146.1	167.7	-161	-22.3	0	0	0	109.8	E96 E99 L101 K166	D94-E96 VanDerWaalsContact C-N 3.35Å; D94-E96 PolarHBondContact OD1-N 3.16Å; D94-E99 PolarHBondContact N-O 3.43Å; D94-L101 HydrophobicContact CB-CD1 3.84Å; D94-L101 HydrophobicContact CB-CD2 4.49Å; D94-L101 HydrophobicContact CB-CG 4.15Å; D94-K166 WeakPolarHBondContact OD1-CE 3.44Å; D94-K166 IonicContact OD1-NZ 3.32Å; D94-K166 PolarHBondContact OD1-NZ 3.01Å; D94-K166 IonicContact OD2-NZ 2.79Å; D94-K166 PolarHBondContact OD2-NZ 2.83Å
95	V	88.6	Confident	88.4	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.018	20%	0.198	C	C	.	.	S	Bend	trans	-78.7	-25.6	173.1	178.6	0	0	0	0	110.7	L34 L46 W56 W73 K78	L34-V95 HydrophobicContact CD1-CG1 3.67Å; L46-V95 HydrophobicContact CD2-CG1 3.88Å; L46-V95 WeakPolarHBondContact CD2-O 3.45Å; W56-V95 PolarHBondContact NE1-O 3.5Å; W73-V95 HydrophobicContact CE3-CG2 4.14Å; W73-V95 HydrophobicContact CH2-CG1 3.84Å; W73-V95 HydrophobicContact CH2-CG2 3.96Å; W73-V95 HydrophobicContact CZ3-CB 4.25Å; W73-V95 HydrophobicContact CZ3-CG1 3.82Å; W73-V95 HydrophobicContact CZ3-CG2 3.33Å; K78-V95 VanDerWaalsContact C-CG2 3.45Å; K78-V95 WeakPolarHBondContact O-CG2 3.45Å
96	E	87	Confident	88.5	Confident	124 Å²	124	36.6 Å²	36.6	58%	0.579	19%	0.194	S	C	*	.	S	Bend	trans	-87.9	-32.3	-175.7	-51.7	-140.6	168.2	0	0	113	R32 D94	R32-E96 IonicContact CZ-OE1 2.97Å; R32-E96 IonicContact NH1-OE1 3.89Å; R32-E96 PolarHBondContact NH1-OE1 3.38Å; R32-E96 IonicContact NH2-OE1 2.75Å; D94-E96 VanDerWaalsContact C-N 3.35Å; D94-E96 PolarHBondContact OD1-N 3.16Å
97	K	84.7	Confident	88.5	Confident	70 Å²	70	38.3 Å²	38.3	30%	0.304	20%	0.2	S	C	.	.	S	Bend	trans	-125.1	139.1	177.7	-61.1	177.4	-174.6	165.9	0	110	E99 E158 E163	K97-E99 HydrophobicContact CB-CG 4.22Å; K97-E99 PolarHBondContact O-N 2.95Å; K97-E158 IonicContact NZ-OE1 2.9Å; K97-E158 PolarHBondContact NZ-OE1 2.95Å; K97-E158 IonicContact NZ-OE2 2.66Å; K97-E158 PolarHBondContact NZ-OE2 3.23Å; K97-E163 IonicContact NZ-OE1 3.25Å
98	P	85.3	Confident	88.5	Confident	57 Å²	57	36.7 Å²	36.7	37%	0.37	19%	0.192	S	C	.	.	S	Bend	trans	-76.2	60.1	177.1	34.2	-36.6	0	0	0	111.1	W56 F58	W56-P98 HydrophobicContact CB-CB 4.1Å; W56-P98 HydrophobicContact CB-CG 4.11Å; W56-P98 HydrophobicContact CD2-CB 3.88Å; W56-P98 HydrophobicContact CE3-CB 3.85Å; W56-P98 HydrophobicContact CG-CB 4.01Å; W56-P98 HydrophobicContact CG-CG 4.38Å; F58-P98 VanDerWaalsContact CD2-C 3.49Å; F58-P98 HydrophobicContact CD2-CB 4.14Å; F58-P98 VanDerWaalsContact CD2-O 3.31Å; F58-P98 WeakPolarHBondContact CD2-O 3.48Å; F58-P98 WeakPolarHBondContact CE2-O 3.12Å
99	E	81.6	Confident	88.5	Confident	57 Å²	57	34.6 Å²	34.6	27%	0.266	19%	0.188	S	C	.	.			trans	-127.2	141.4	-176.5	-61.7	-163.9	-153.7	0	0	111.4	C93 D94 K97 L101 K154	C93-E99 WeakPolarHBondContact CA-O 3.48Å; C93-E99 VanDerWaalsContact CB-O 3.27Å; C93-E99 WeakPolarHBondContact CB-O 3.39Å; D94-E99 PolarHBondContact N-O 3.43Å; K97-E99 HydrophobicContact CB-CG 4.22Å; K97-E99 PolarHBondContact O-N 2.95Å; E99-L101 PolarHBondContact O-N 3.41Å; E99-K154 WeakPolarHBondContact OE2-CD 3.19Å; E99-K154 IonicContact OE2-NZ 2.77Å; E99-K154 PolarHBondContact OE2-NZ 2.85Å
100	S	83.3	Confident	88.7	Confident	25 Å²	25	32.3 Å²	32.3	18%	0.175	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	107.5	173.6	173.3	0	0	0	0	108.7
101	L	79.8	Confident	88.6	Confident	6 Å²	6	33 Å²	33	3%	0.031	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	-56.1	172.6	-66.3	173.4	0	0	0	108.5	L79 L92 D94 E99 S153 I155 L167	L79-L101 HydrophobicContact CD2-CD1 3.4Å; L79-L101 VanDerWaalsContact CD2-CD1 3.4Å; L92-L101 WeakPolarHBondContact O-CB 3.43Å; L92-L101 PolarHBondContact O-N 3.24Å; D94-L101 HydrophobicContact CB-CD1 3.84Å; D94-L101 HydrophobicContact CB-CD2 4.49Å; D94-L101 HydrophobicContact CB-CG 4.15Å; E99-L101 PolarHBondContact O-N 3.41Å; L101-S153 WeakPolarHBondContact O-CA 3.47Å; L101-I155 WeakPolarHBondContact O-CD1 3.35Å; L101-I155 WeakPolarHBondContact O-CG1 3.23Å; L101-L167 HydrophobicContact CB-CD1 4.42Å
102	H	83	Confident	88.7	Confident	6 Å²	6	33.5 Å²	33.5	3%	0.028	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	148.5	-176.6	-174	75.2	0	0	0	111	L92 F104 I155 L167 Q263	L92-H102 HydrophobicContact CB-CB 4.2Å; L92-H102 HydrophobicContact CD1-CB 4.18Å; L92-H102 HydrophobicContact CG-CB 4.44Å; L92-H102 PolarHBondContact N-O 3.44Å; L92-H102 PolarHBondContact O-N 3.05Å; L92-H102 VanDerWaalsContact O-N 3.15Å; H102-F104 AromaticContact CD2-CD1 3.79Å; H102-F104 AromaticContact NE2-CD1 3.88Å; H102-I155 HydrophobicContact CB-CD1 4.06Å; H102-L167 HydrophobicContact CB-CD1 3.85Å; H102-L167 HydrophobicContact CB-CD2 4.02Å; H102-Q263 PolarHBondContact CE1-NE2 2.73Å; H102-Q263 VanDerWaalsContact CE1-NE2 3.32Å; H102-Q263 PolarHBondContact CE1-OE1 3.17Å; H102-Q263 VanDerWaalsContact CE1-OE1 3.27Å; H102-Q263 PolarHBondContact ND1-OE1 3.03Å
103	S	86.8	Confident	89	Confident	27 Å²	27	34.7 Å²	34.7	19%	0.189	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	144	171	63	0	0	0	0	110.4	I90 T152	I90-S103 VanDerWaalsContact O-CA 3.26Å; I90-S103 WeakPolarHBondContact O-CA 3.48Å; S103-T152 PolarHBondContact OG-O 3.36Å; S103-T152 VanDerWaalsContact OG-O 3.13Å
104	F	88.6	Confident	89.4	Confident	25 Å²	25	37 Å²	37	11%	0.11	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	151.6	174	61.9	-87.4	0	0	0	110.2	K89 I90 H102 V106 L178 Y188 G191	K89-F104 WeakPolarHBondContact CA-O 3.5Å; I90-F104 HydrophobicContact CB-CD1 4.37Å; I90-F104 HydrophobicContact CB-CD2 4.4Å; I90-F104 HydrophobicContact CB-CE1 3.82Å; I90-F104 HydrophobicContact CB-CE2 3.89Å; I90-F104 HydrophobicContact CB-CZ 3.58Å; I90-F104 HydrophobicContact CD1-CE2 3.75Å; I90-F104 HydrophobicContact CD1-CZ 3.73Å; I90-F104 HydrophobicContact CG1-CE2 4.19Å; I90-F104 HydrophobicContact CG1-CZ 4.18Å; I90-F104 HydrophobicContact CG2-CE1 3.73Å; I90-F104 HydrophobicContact CG2-CE2 4.46Å; I90-F104 HydrophobicContact CG2-CZ 3.66Å; I90-F104 PolarHBondContact N-O 3.4Å; I90-F104 PolarHBondContact O-N 2.93Å; H102-F104 AromaticContact CD2-CD1 3.79Å; H102-F104 AromaticContact NE2-CD1 3.88Å; F104-V106 HydrophobicContact CD2-CG1 4.14Å; F104-V106 HydrophobicContact CE2-CG1 3.88Å; F104-L178 HydrophobicContact CE2-CD1 4.46Å; F104-Y188 HydrophobicContact CD2-CD1 4.34Å; F104-Y188 AromaticContact CD2-CE1 3.65Å; F104-Y188 HydrophobicContact CD2-CE1 3.65Å; F104-Y188 AromaticContact CE2-CD1 3.71Å; F104-Y188 HydrophobicContact CE2-CD1 3.71Å; F104-Y188 HydrophobicContact CE2-CD2 4.48Å; F104-Y188 AromaticContact CE2-CE1 3.3Å; F104-Y188 HydrophobicContact CE2-CE1 3.3Å; F104-Y188 HydrophobicContact CE2-CE2 4.16Å; F104-Y188 HydrophobicContact CE2-CG 4.28Å; F104-Y188 AromaticContact CE2-CZ 3.56Å; F104-Y188 AromaticContact CZ-CD1 3.88Å; F104-Y188 HydrophobicContact CZ-CD1 3.88Å; F104-Y188 AromaticContact CZ-CE1 3.98Å; F104-Y188 HydrophobicContact CZ-CE1 3.98Å; F104-Y188 HydrophobicContact CZ-CG 4.28Å; F104-G191 WeakPolarHBondContact CE1-O 3.49Å
105	S	91.3	Very high	89.8	Confident	81 Å²	81	37.6 Å²	37.6	57%	0.566	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	145.4	179.4	-54.2	0	0	0	0	110.3	K88	K88-S105 WeakPolarHBondContact O-CA 3.37Å
106	V	93.1	Very high	90.1	Very high	14 Å²	14	38 Å²	38	9%	0.085	21%	0.206	C	C	.	.			trans	-116.7	154.8	175	-67.6	0	0	0	0	109.7	K88 I90 F104 A108 V110 L178	K88-V106 HydrophobicContact CB-CG2 4.23Å; K88-V106 WeakPolarHBondContact CB-O 3.33Å; K88-V106 VanDerWaalsContact O-CG2 3.23Å; K88-V106 WeakPolarHBondContact O-CG2 2.99Å; K88-V106 PolarHBondContact O-N 3.36Å; I90-V106 HydrophobicContact CD1-CG1 3.8Å; I90-V106 HydrophobicContact CG1-CG1 4.13Å; F104-V106 HydrophobicContact CD2-CG1 4.14Å; F104-V106 HydrophobicContact CE2-CG1 3.88Å; V106-A108 VanDerWaalsContact C-N 3.31Å; V106-A108 VanDerWaalsContact CG2-O 3.29Å; V106-A108 WeakPolarHBondContact CG2-O 3.4Å; V106-A108 PolarHBondContact O-N 2.91Å; V106-V110 HydrophobicContact CG2-CG2 4.13Å; V106-L178 HydrophobicContact CG1-CD1 4.14Å
107	E	91.6	Very high	90.4	Very high	103 Å²	103	34 Å²	34	48%	0.481	19%	0.188	S	C	.	.	S	Bend	trans	-69.6	-29.9	-174.9	-68.4	177.9	-153.1	0	0	112.7	F184 K194 R197	E107-F184 HydrophobicContact CB-CZ 4.02Å; E107-K194 IonicContact OE1-NZ 2.72Å; E107-R197 VanDerWaalsContact CD-NH1 3.31Å; E107-R197 IonicContact OE1-CZ 3.78Å; E107-R197 IonicContact OE1-NH1 3.27Å; E107-R197 PolarHBondContact OE1-NH1 3.03Å; E107-R197 IonicContact OE1-NH2 2.74Å; E107-R197 IonicContact OE2-CZ 3.42Å; E107-R197 IonicContact OE2-NH1 3.99Å; E107-R197 PolarHBondContact OE2-NH1 3.15Å; E107-R197 IonicContact OE2-NH2 2.88Å; E107-R197 PolarHBondContact OE2-NH2 3.32Å
108	A	93.2	Very high	90.6	Very high	16 Å²	16	31 Å²	31	13%	0.132	18%	0.176	C	C	.	.	S	Bend	trans	-140.7	158.2	-175.2	0	0	0	0	0	112.5	V106 S182 F184	V106-A108 VanDerWaalsContact C-N 3.31Å; V106-A108 VanDerWaalsContact CG2-O 3.29Å; V106-A108 WeakPolarHBondContact CG2-O 3.4Å; V106-A108 PolarHBondContact O-N 2.91Å; A108-S182 VanDerWaalsContact CB-CB 3.42Å; A108-F184 HydrophobicContact CB-CE1 4.32Å; A108-F184 HydrophobicContact CB-CZ 3.88Å
109	P	93.9	Very high	90.5	Very high	48 Å²	48	31.2 Å²	31.2	31%	0.312	18%	0.176	S	C	.	.			trans	-59.2	138.6	174.7	-23.2	34.6	0	0	0	112.5	A85 K88	A85-P109 HydrophobicContact CB-CB 4.42Å; K88-P109 HydrophobicContact CG-CG 4.4Å
110	V	95.7	Very high	90	Very high	9 Å²	9	31 Å²	31	6%	0.055	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.5	-179.5	-175.8	0	0	0	0	109.2	T69 A83 I90 V106 C112 M113 L178 G179	T69-V110 WeakPolarHBondContact CB-O 3.28Å; T69-V110 PolarHBondContact OG1-O 3.17Å; A83-V110 HydrophobicContact CB-CB 3.83Å; A83-V110 HydrophobicContact CB-CG1 4.28Å; A83-V110 HydrophobicContact CB-CG2 4.24Å; I90-V110 HydrophobicContact CD1-CG2 4.32Å; V106-V110 HydrophobicContact CG2-CG2 4.13Å; V110-C112 VanDerWaalsContact CG1-O 3.27Å; V110-C112 WeakPolarHBondContact CG1-O 3.42Å; V110-M113 HydrophobicContact CG1-CG 3.81Å; V110-L178 HydrophobicContact CG1-CB 4.35Å; V110-L178 HydrophobicContact CG1-CD2 4.43Å; V110-G179 WeakPolarHBondContact CG1-O 3.26Å
111	S	93.6	Very high	89.2	Confident	15 Å²	15	36.2 Å²	36.2	11%	0.105	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-31.2	176.5	57.1	0	0	0	0	112.7	G179 G180 C205 L570	S111-G179 PolarHBondContact N-O 3.16Å; S111-G179 PolarHBondContact OG-O 3.32Å; S111-G179 VanDerWaalsContact OG-O 3.1Å; S111-G180 WeakPolarHBondContact OG-CA 3.17Å; S111-C205 WeakPolarHBondContact CB-O 3.32Å; S111-C205 PolarHBondContact OG-O 2.89Å; S111-L570 WeakPolarHBondContact O-CD1 3.07Å
112	C	94.6	Very high	88.4	Confident	11 Å²	11	37.9 Å²	37.9	7%	0.074	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	154.2	178.1	58.8	0	0	0	0	112.6	V110 G179 C205 L206	V110-C112 VanDerWaalsContact CG1-O 3.27Å; V110-C112 WeakPolarHBondContact CG1-O 3.42Å; C112-G179 PolarHBondContact N-O 3.12Å; C112-G179 VanDerWaalsContact N-O 3.13Å; C112-G179 PolarHBondContact O-N 2.71Å; C112-C205 WeakPolarHBondContact SG-CB 3.29Å; C112-C205 PolarHBondContact SG-O 3.35Å; C112-C205 VanDerWaalsContact SG-O 3.36Å; C112-L206 WeakPolarHBondContact CB-O 3.28Å
113	M	97.2	Very high	87.4	Confident	25 Å²	25	42.2 Å²	42.2	12%	0.123	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.5	-178.8	-64.5	171.9	75.9	0	0	110.3	C70 A72 A81 A83 I90 V110 L176 V177 L178	C70-M113 HydrophobicContact CB-CG 4.32Å; C70-M113 HydrophobicContact CB-SD 4.31Å; C70-M113 VanDerWaalsContact SG-CG 3.52Å; C70-M113 PolarHBondContact SG-SD 3.4Å; A72-M113 HydrophobicContact CB-CB 3.75Å; A72-M113 HydrophobicContact CB-CE 4.29Å; A81-M113 HydrophobicContact CB-CE 3.59Å; A83-M113 HydrophobicContact CB-SD 3.75Å; I90-M113 HydrophobicContact CD1-CE 4.38Å; I90-M113 HydrophobicContact CG2-CE 4.12Å; V110-M113 HydrophobicContact CG1-CG 3.81Å; M113-L176 HydrophobicContact CB-CD1 4.33Å; M113-L176 HydrophobicContact CE-CD1 3.74Å; M113-L176 HydrophobicContact CE-CD2 3.82Å; M113-L176 HydrophobicContact CE-CG 4.24Å; M113-V177 WeakPolarHBondContact CA-O 3.32Å; M113-L178 HydrophobicContact CB-CD2 4.46Å; M113-L178 HydrophobicContact CE-CD2 3.78Å; M113-L178 HydrophobicContact CG-CD2 3.71Å; M113-L178 HydrophobicContact SD-CD2 4.37Å
114	H	97.2	Very high	86.9	Confident	49 Å²	49	44.7 Å²	44.7	23%	0.227	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	122.9	172.3	175.7	-105.7	0	0	0	110.1	V177 L208 L210	H114-V177 HydrophobicContact CB-CB 4.48Å; H114-V177 PolarHBondContact N-O 3.35Å; H114-V177 PolarHBondContact O-N 3.17Å; H114-L208 HydrophobicContact CB-CB 4.07Å; H114-L208 VanDerWaalsContact CB-O 3.3Å; H114-L208 WeakPolarHBondContact CB-O 3.41Å; H114-L210 PolarHBondContact ND1-N 3.28Å
115	W	96.9	Very high	86.2	Confident	18 Å²	18	43.5 Å²	43.5	7%	0.068	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.4	178.4	-152.6	-23.4	0	0	0	110.2	A72 W73 R74 L79 A81 L92 N174 I175 L176	A72-W115 HydrophobicContact CB-CB 4.35Å; W73-W115 WeakPolarHBondContact O-CB 3.45Å; R74-W115 HydrophobicContact CB-CD2 3.97Å; R74-W115 HydrophobicContact CB-CE3 3.89Å; R74-W115 HydrophobicContact CB-CH2 3.99Å; R74-W115 HydrophobicContact CB-CZ2 4.06Å; R74-W115 HydrophobicContact CB-CZ3 3.87Å; R74-W115 HydrophobicContact CG-CD2 4.17Å; R74-W115 HydrophobicContact CG-CH2 4.23Å; R74-W115 HydrophobicContact CG-CZ2 3.82Å; L79-W115 HydrophobicContact CB-CH2 4.42Å; L79-W115 HydrophobicContact CD1-CH2 4.43Å; A81-W115 HydrophobicContact CB-CE3 4Å; A81-W115 HydrophobicContact CB-CZ3 3.64Å; L92-W115 HydrophobicContact CD2-CH2 3.91Å; L92-W115 HydrophobicContact CD2-CZ3 4.01Å; W115-N174 PolarHBondContact NE1-OD1 2.99Å; W115-I175 WeakPolarHBondContact CA-O 3.38Å; W115-L176 HydrophobicContact CB-CD1 4.01Å; W115-L176 HydrophobicContact CD2-CB 4.16Å; W115-L176 HydrophobicContact CD2-CD1 4.12Å; W115-L176 HydrophobicContact CE3-CD1 4.17Å; W115-L176 HydrophobicContact CG-CB 4.2Å; W115-L176 HydrophobicContact CG-CD1 4.11Å
116	M	94.4	Very high	85.3	Confident	11 Å²	11	43 Å²	43	5%	0.054	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	160.2	-177.8	60.6	123.3	-65.4	0	0	112	V118 N174 I175 L210 L214	M116-V118 HydrophobicContact CE-CB 4.38Å; M116-V118 HydrophobicContact CE-CG2 3.64Å; M116-V118 VanDerWaalsContact CE-N 3.26Å; M116-N174 CarbonylContact O-C 3.55Å; M116-N174 WeakPolarHBondContact O-CA 3.3Å; M116-N174 WeakPolarHBondContact O-CB 3.35Å; M116-I175 HydrophobicContact CG-CB 4.35Å; M116-I175 PolarHBondContact N-O 3.47Å; M116-I175 PolarHBondContact O-N 3.03Å; M116-L210 HydrophobicContact CG-CB 4.04Å; M116-L210 HydrophobicContact CG-CD2 4.06Å; M116-L210 HydrophobicContact CG-CG 4.27Å; M116-L210 HydrophobicContact SD-CB 3.9Å; M116-L210 HydrophobicContact SD-CD2 3.46Å; M116-L210 WeakPolarHBondContact SD-CD2 3.45Å; M116-L210 HydrophobicContact SD-CG 3.52Å; M116-L210 VanDerWaalsContact SD-CG 3.52Å; M116-L214 HydrophobicContact CE-CD2 4.11Å; M116-L214 HydrophobicContact SD-CD2 3.75Å
117	E	92.3	Very high	84.6	Confident	40 Å²	40	45.7 Å²	45.7	19%	0.187	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.4	172.9	175.5	178.4	-128	0	0	109.6	P75 R172 N174	P75-E117 HydrophobicContact CB-CB 3.86Å; P75-E117 HydrophobicContact CG-CB 3.8Å; E117-R172 HydrophobicContact CG-CB 4.46Å; E117-N174 HydrophobicContact CB-CB 4.2Å
118	V	90.5	Very high	83.8	Confident	8 Å²	8	41.6 Å²	41.6	5%	0.048	25%	0.245	C	C	.	.			trans	-71.9	130.6	-177.9	177.7	0	0	0	0	109.6	M116 V120 L173 S212 L214 L245	M116-V118 HydrophobicContact CE-CB 4.38Å; M116-V118 HydrophobicContact CE-CG2 3.64Å; M116-V118 VanDerWaalsContact CE-N 3.26Å; V118-V120 HydrophobicContact CG1-CB 3.99Å; V118-V120 HydrophobicContact CG1-CG2 4.31Å; V118-L173 HydrophobicContact CG2-CB 4.17Å; V118-L173 HydrophobicContact CG2-CD2 4.25Å; V118-L173 HydrophobicContact CG2-CG 4.33Å; V118-L173 WeakPolarHBondContact CG2-O 3.42Å; V118-L173 PolarHBondContact N-O 3.47Å; V118-S212 WeakPolarHBondContact CA-O 3.48Å; V118-L214 HydrophobicContact CG2-CD1 3.76Å; V118-L214 HydrophobicContact CG2-CD2 4.03Å; V118-L214 HydrophobicContact CG2-CG 3.86Å; V118-L245 HydrophobicContact CG1-CD1 4.06Å; V118-L245 HydrophobicContact CG1-CD2 3.79Å; V118-L245 HydrophobicContact CG2-CD1 4.16Å
119	T	81.9	Confident	82.9	Confident	61 Å²	61	42.6 Å²	42.6	37%	0.374	25%	0.246	S	C	.	.			trans	-98.4	-8.3	178.2	54.3	0	0	0	0	113.5	E121 S212 K579	T119-E121 PolarHBondContact O-N 3.47Å; T119-S212 PolarHBondContact N-O 3.18Å; T119-S212 WeakPolarHBondContact OG1-CB 3.38Å; T119-S212 PolarHBondContact OG1-OG 3.41Å; T119-K579 HydrophobicContact CG2-CD 4.04Å
120	V	71.3	Confident	82.1	Confident	52 Å²	52	44.7 Å²	44.7	32%	0.315	26%	0.255	S	S	.	.			trans	-71.1	112.5	180	-177.1	0	0	0	0	109.6	V118 D213 L245	V118-V120 HydrophobicContact CG1-CB 3.99Å; V118-V120 HydrophobicContact CG1-CG2 4.31Å; V120-D213 HydrophobicContact CG2-CB 4.1Å; V120-L245 HydrophobicContact CB-CD2 3.94Å; V120-L245 HydrophobicContact CG1-CD2 4.16Å
121	E	66.1	Low	81.1	Confident	136 Å²	136	46.6 Å²	46.6	64%	0.636	27%	0.271	S	S	*	.			trans	-94.2	130.3	175.2	-63.4	-176.1	168.2	0	0	109.7	T119 R172	T119-E121 PolarHBondContact O-N 3.47Å; E121-R172 IonicContact OE1-CZ 2.86Å; E121-R172 IonicContact OE1-NH1 3.04Å; E121-R172 PolarHBondContact OE1-NH1 3.27Å; E121-R172 IonicContact OE1-NH2 3.78Å; E121-R172 PolarHBondContact OE1-NH2 2.96Å
122	S	63.5	Low	80.2	Confident	40 Å²	40	46.1 Å²	46.1	28%	0.28	27%	0.267	S	S	.	.			trans	-130.6	142.5	175.3	171.3	0	0	0	0	108.7	V124 L125 T126	S122-V124 PolarHBondContact O-N 2.9Å; S122-V124 PolarHBondContact OG-N 3.44Å; S122-L125 WeakPolarHBondContact O-CA 3.5Å; S122-L125 WeakPolarHBondContact O-CB 3.23Å; S122-L125 PolarHBondContact O-N 3.26Å; S122-T126 PolarHBondContact O-N 3.14Å; S122-T126 PolarHBondContact O-OG1 3.33Å
123	S	62.9	Low	79	Confident	98 Å²	98	49.6 Å²	49.6	69%	0.685	29%	0.285	S	S	*	.	H	α-helix	trans	-56.7	-32.2	175.8	56	0	0	0	0	112.4	T126 S127	S123-T126 PolarHBondContact O-N 3.5Å; S123-S127 PolarHBondContact O-N 3.28Å
124	V	74.4	Confident	77.8	Confident	78 Å²	78	55.1 Å²	55.1	47%	0.473	31%	0.31	S	S	.	.	H	α-helix	trans	-65.9	-43.2	174.4	-179.9	0	0	0	0	110.9	S122 S127 F128 P246	S122-V124 PolarHBondContact O-N 2.9Å; S122-V124 PolarHBondContact OG-N 3.44Å; V124-S127 PolarHBondContact O-N 3.41Å; V124-S127 PolarHBondContact O-OG 3.43Å; V124-F128 WeakPolarHBondContact O-CB 3.1Å; V124-F128 PolarHBondContact O-N 3.12Å; V124-P246 HydrophobicContact CG1-CB 4.09Å; V124-P246 HydrophobicContact CG1-CG 4.49Å
125	L	73.9	Confident	76.6	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-45.1	176.8	-74.1	170.1	0	0	0	110.8	S122 S127 F128 Y129 L245 P246 T249	S122-L125 WeakPolarHBondContact O-CA 3.5Å; S122-L125 WeakPolarHBondContact O-CB 3.23Å; S122-L125 PolarHBondContact O-N 3.26Å; L125-S127 VanDerWaalsContact C-N 3.34Å; L125-S127 PolarHBondContact O-N 2.93Å; L125-F128 WeakPolarHBondContact O-CB 3.44Å; L125-F128 PolarHBondContact O-N 3.48Å; L125-F128 VanDerWaalsContact O-N 3.13Å; L125-Y129 HydrophobicContact CB-CE1 4.34Å; L125-Y129 HydrophobicContact CB-CE2 4Å; L125-Y129 HydrophobicContact CD2-CE1 4.32Å; L125-Y129 WeakPolarHBondContact O-CD1 3.42Å; L125-Y129 VanDerWaalsContact O-CD2 3.28Å; L125-Y129 WeakPolarHBondContact O-CD2 3.39Å; L125-Y129 PolarHBondContact O-N 2.97Å; L125-L245 HydrophobicContact CD1-CD2 3.96Å; L125-L245 HydrophobicContact CD1-CG 4.23Å; L125-P246 HydrophobicContact CD2-CB 4.1Å; L125-P246 HydrophobicContact CD2-CG 4.38Å; L125-P246 HydrophobicContact CG-CB 4.44Å; L125-P246 HydrophobicContact CG-CG 4.3Å; L125-T249 HydrophobicContact CD2-CG2 4.25Å
126	T	73	Confident	75.2	Confident	71 Å²	71	55.1 Å²	55.1	44%	0.436	31%	0.314	S	S	.	.	H	α-helix	trans	-60.2	-43.1	176.5	-48.2	0	0	0	0	112	S122 S123 F128 Y129 N130	S122-T126 PolarHBondContact O-N 3.14Å; S122-T126 PolarHBondContact O-OG1 3.33Å; S123-T126 PolarHBondContact O-N 3.5Å; T126-F128 VanDerWaalsContact C-N 3.31Å; T126-F128 PolarHBondContact O-N 3.03Å; T126-Y129 PolarHBondContact O-N 3.15Å; T126-N130 PolarHBondContact O-N 3.21Å; T126-N130 PolarHBondContact O-ND2 3.27Å
127	S	78.6	Confident	74	Confident	69 Å²	69	61.7 Å²	61.7	48%	0.483	35%	0.349	S	S	.	.	H	α-helix	trans	-64.2	-36.8	175.9	73.8	0	0	0	0	112.5	S123 V124 L125 A131	S123-S127 PolarHBondContact O-N 3.28Å; V124-S127 PolarHBondContact O-N 3.41Å; V124-S127 PolarHBondContact O-OG 3.43Å; L125-S127 VanDerWaalsContact C-N 3.34Å; L125-S127 PolarHBondContact O-N 2.93Å; S127-A131 PolarHBondContact O-N 3.04Å; S127-A131 VanDerWaalsContact O-N 3.1Å
128	F	75.3	Confident	72.6	Confident	17 Å²	17	66.9 Å²	66.9	8%	0.075	38%	0.377	C	S	.	.	H	α-helix	trans	-67.1	-42.2	175.9	169.5	-111.1	0	0	0	111.6	V124 L125 T126 N130 A131 E132 V171 T249 R250 R253	V124-F128 WeakPolarHBondContact O-CB 3.1Å; V124-F128 PolarHBondContact O-N 3.12Å; L125-F128 WeakPolarHBondContact O-CB 3.44Å; L125-F128 PolarHBondContact O-N 3.48Å; L125-F128 VanDerWaalsContact O-N 3.13Å; T126-F128 VanDerWaalsContact C-N 3.31Å; T126-F128 PolarHBondContact O-N 3.03Å; F128-N130 VanDerWaalsContact C-N 3.29Å; F128-N130 PolarHBondContact O-N 3.42Å; F128-A131 PolarHBondContact O-N 3.48Å; F128-A131 VanDerWaalsContact O-N 3.15Å; F128-E132 HydrophobicContact CE2-CB 4.26Å; F128-E132 WeakPolarHBondContact CE2-OE2 3.31Å; F128-E132 HydrophobicContact CZ-CB 4.23Å; F128-E132 HydrophobicContact CZ-CG 4.34Å; F128-E132 PolarHBondContact O-N 3.43Å; F128-V171 HydrophobicContact CD1-CG1 4.28Å; F128-V171 HydrophobicContact CE1-CG1 3.77Å; F128-V171 HydrophobicContact CZ-CG1 4.48Å; F128-T249 HydrophobicContact CD1-CG2 4.45Å; F128-T249 HydrophobicContact CE1-CG2 4.14Å; F128-R250 HydrophobicContact CD2-CB 4.26Å; F128-R250 HydrophobicContact CD2-CG 3.98Å; F128-R250 HydrophobicContact CE1-CB 4.22Å; F128-R250 HydrophobicContact CE2-CB 3.86Å; F128-R250 HydrophobicContact CE2-CG 3.41Å; F128-R250 VanDerWaalsContact CE2-CG 3.41Å; F128-R250 HydrophobicContact CZ-CB 3.84Å; F128-R250 HydrophobicContact CZ-CG 3.78Å; F128-R253 HydrophobicContact CZ-CB 4.32Å; F128-R253 HydrophobicContact CZ-CG 4.5Å
129	Y	74.3	Confident	71.3	Confident	37 Å²	37	68.1 Å²	68.1	15%	0.145	38%	0.384	C	S	.	.	H	α-helix	trans	-57.5	-45.4	178	-57.7	-24.3	0	0	0	111.1	L125 T126 A131 E132 D133 V171 R172 T249	L125-Y129 HydrophobicContact CB-CE1 4.34Å; L125-Y129 HydrophobicContact CB-CE2 4Å; L125-Y129 HydrophobicContact CD2-CE1 4.32Å; L125-Y129 WeakPolarHBondContact O-CD1 3.42Å; L125-Y129 VanDerWaalsContact O-CD2 3.28Å; L125-Y129 WeakPolarHBondContact O-CD2 3.39Å; L125-Y129 PolarHBondContact O-N 2.97Å; T126-Y129 PolarHBondContact O-N 3.15Å; Y129-A131 PolarHBondContact O-N 3.19Å; Y129-E132 PolarHBondContact O-N 3.3Å; Y129-D133 PolarHBondContact O-N 2.92Å; Y129-D133 VanDerWaalsContact O-N 3.16Å; Y129-V171 HydrophobicContact CD1-CB 3.48Å; Y129-V171 VanDerWaalsContact CD1-CB 3.48Å; Y129-V171 HydrophobicContact CD1-CG1 3.32Å; Y129-V171 HydrophobicContact CE1-CB 4.05Å; Y129-V171 HydrophobicContact CE1-CG1 3.9Å; Y129-V171 HydrophobicContact CG-CB 4Å; Y129-V171 HydrophobicContact CG-CG1 4.21Å; Y129-R172 HydrophobicContact CE2-CG 4.13Å; Y129-T249 HydrophobicContact CE1-CG2 4.35Å
130	N	75.6	Confident	70.5	Confident	93 Å²	93	69.3 Å²	69.3	50%	0.497	39%	0.392	S	S	.	.	H	α-helix	trans	-63.8	-42.4	176.2	-61.1	-20	0	0	0	112.4	T126 F128 D133 E134	T126-N130 PolarHBondContact O-N 3.21Å; T126-N130 PolarHBondContact O-ND2 3.27Å; F128-N130 VanDerWaalsContact C-N 3.29Å; F128-N130 PolarHBondContact O-N 3.42Å; N130-D133 PolarHBondContact O-N 3.23Å; N130-E134 PolarHBondContact O-N 2.97Å
131	A	75.9	Confident	70.5	Confident	49 Å²	49	73.8 Å²	73.8	41%	0.405	41%	0.408	S	S	.	.	H	α-helix	trans	-67.3	-35.9	-179.8	0	0	0	0	0	112.8	S127 F128 Y129 E134 S135	S127-A131 PolarHBondContact O-N 3.04Å; S127-A131 VanDerWaalsContact O-N 3.1Å; F128-A131 PolarHBondContact O-N 3.48Å; F128-A131 VanDerWaalsContact O-N 3.15Å; Y129-A131 PolarHBondContact O-N 3.19Å; A131-E134 PolarHBondContact O-N 3.37Å; A131-S135 PolarHBondContact O-N 2.98Å
132	E	74.7	Confident	71	Confident	4 Å²	4	69.3 Å²	69.3	2%	0.019	39%	0.388	C	S	.	.	H	α-helix	trans	-68.2	-41.2	176.7	-163.2	66.9	-162.1	0	0	110.8	F128 Y129 E134 S135 N136 V171 R253 K254 H257	F128-E132 HydrophobicContact CE2-CB 4.26Å; F128-E132 WeakPolarHBondContact CE2-OE2 3.31Å; F128-E132 HydrophobicContact CZ-CB 4.23Å; F128-E132 HydrophobicContact CZ-CG 4.34Å; F128-E132 PolarHBondContact O-N 3.43Å; Y129-E132 PolarHBondContact O-N 3.3Å; E132-E134 VanDerWaalsContact C-N 3.34Å; E132-E134 PolarHBondContact O-N 3.5Å; E132-S135 PolarHBondContact O-N 2.94Å; E132-S135 PolarHBondContact O-OG 3.34Å; E132-N136 PolarHBondContact O-N 3.23Å; E132-N136 PolarHBondContact O-ND2 2.88Å; E132-N136 VanDerWaalsContact O-ND2 3.1Å; E132-V171 HydrophobicContact CB-CG1 4.31Å; E132-R253 HydrophobicContact CG-CG 4.21Å; E132-K254 IonicContact OE1-NZ 2.61Å; E132-K254 PolarHBondContact OE1-NZ 3.08Å; E132-K254 WeakPolarHBondContact OE2-CE 3.3Å; E132-K254 IonicContact OE2-NZ 3.28Å; E132-K254 PolarHBondContact OE2-NZ 3.39Å; E132-H257 IonicContact OE1-CD2 3.5Å; E132-H257 IonicContact OE1-NE2 3.19Å
133	D	68.5	Low	71.8	Confident	85 Å²	85	69.7 Å²	69.7	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-60.7	-42.1	174.2	-75.3	-15.5	0	0	0	111.7	Y129 N130 N136 L137	Y129-D133 PolarHBondContact O-N 2.92Å; Y129-D133 VanDerWaalsContact O-N 3.16Å; N130-D133 PolarHBondContact O-N 3.23Å; D133-N136 PolarHBondContact O-N 3.08Å; D133-L137 WeakPolarHBondContact O-CD1 3.45Å; D133-L137 WeakPolarHBondContact O-CG 3.48Å; D133-L137 PolarHBondContact O-N 2.96Å
134	E	72.6	Confident	72.4	Confident	140 Å²	140	68 Å²	68	65%	0.654	37%	0.374	S	S	*	.	H	α-helix	trans	-62.8	-40.4	173.2	-75.2	-178.5	-179.6	0	0	112.7	N130 A131 E132 N136 L137 L138	N130-E134 PolarHBondContact O-N 2.97Å; A131-E134 PolarHBondContact O-N 3.37Å; E132-E134 VanDerWaalsContact C-N 3.34Å; E132-E134 PolarHBondContact O-N 3.5Å; E134-N136 PolarHBondContact O-N 3.3Å; E134-L137 WeakPolarHBondContact O-CB 3.39Å; E134-L137 PolarHBondContact O-N 3.06Å; E134-L138 PolarHBondContact O-N 3.02Å; E134-L138 VanDerWaalsContact O-N 3.12Å
135	S	71.4	Confident	72.4	Confident	11 Å²	11	64.7 Å²	64.7	8%	0.077	35%	0.354	C	S	.	.	H	α-helix	trans	-65.1	-38.8	178.1	74.9	0	0	0	0	112.4	A131 E132 L137 L138 L139	A131-S135 PolarHBondContact O-N 2.98Å; E132-S135 PolarHBondContact O-N 2.94Å; E132-S135 PolarHBondContact O-OG 3.34Å; S135-L137 VanDerWaalsContact C-N 3.26Å; S135-L137 PolarHBondContact O-N 3.41Å; S135-L138 PolarHBondContact O-N 3.35Å; S135-L139 WeakPolarHBondContact O-CG 3.18Å; S135-L139 PolarHBondContact O-N 3.03Å
136	N	68.4	Low	72.2	Confident	56 Å²	56	67.6 Å²	67.6	30%	0.299	37%	0.373	S	S	.	.	H	α-helix	trans	-68.6	-24.3	176.6	-72.9	-42.1	0	0	0	112.8	E132 D133 E134	E132-N136 PolarHBondContact O-N 3.23Å; E132-N136 PolarHBondContact O-ND2 2.88Å; E132-N136 VanDerWaalsContact O-ND2 3.1Å; D133-N136 PolarHBondContact O-N 3.08Å; E134-N136 PolarHBondContact O-N 3.3Å
137	L	68	Low	71.7	Confident	150 Å²	150	70.4 Å²	70.4	79%	0.785	38%	0.379	S	S	*	.	H	α-helix	trans	-79.4	-31.4	173.8	-75.4	157.5	0	0	0	112.4	D133 E134 S135	D133-L137 WeakPolarHBondContact O-CD1 3.45Å; D133-L137 WeakPolarHBondContact O-CG 3.48Å; D133-L137 PolarHBondContact O-N 2.96Å; E134-L137 WeakPolarHBondContact O-CB 3.39Å; E134-L137 PolarHBondContact O-N 3.06Å; S135-L137 VanDerWaalsContact C-N 3.26Å; S135-L137 PolarHBondContact O-N 3.41Å
138	L	64.5	Low	70.7	Confident	148 Å²	148	73.4 Å²	73.4	78%	0.775	39%	0.39	S	S	*	.	H	α-helix	trans	-83.2	-32.8	-177.7	-171.2	65.8	0	0	0	112.8	E134 S135	E134-L138 PolarHBondContact O-N 3.02Å; E134-L138 VanDerWaalsContact O-N 3.12Å; S135-L138 PolarHBondContact O-N 3.35Å
139	L	63	Low	69.6	Low	35 Å²	35	76.2 Å²	76.2	18%	0.183	40%	0.4	C	S	.	.	S	Bend	trans	-71.7	136.9	175.1	-69.6	174.5	0	0	0	110.7	S135 K141 Y361	S135-L139 WeakPolarHBondContact O-CG 3.18Å; S135-L139 PolarHBondContact O-N 3.03Å; L139-K141 PolarHBondContact O-N 3.07Å; L139-Y361 HydrophobicContact CD1-CD1 3.72Å; L139-Y361 HydrophobicContact CD1-CE1 3.75Å; L139-Y361 HydrophobicContact CD2-CD1 3.78Å; L139-Y361 HydrophobicContact CD2-CD2 4.43Å; L139-Y361 HydrophobicContact CD2-CE1 4.1Å; L139-Y361 HydrophobicContact CD2-CG 3.95Å; L139-Y361 HydrophobicContact CG-CD1 4.23Å; L139-Y361 HydrophobicContact CG-CE1 4.18Å
140	P	63.7	Low	68.5	Low	86 Å²	86	75.6 Å²	75.6	56%	0.558	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-62	129.7	175.3	26.3	-32.5	0	0	0	109.6	L142	P140-L142 PolarHBondContact O-N 2.95Å
141	K	71.6	Confident	67.5	Low	146 Å²	146	77.1 Å²	77.1	64%	0.635	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-60.2	128.1	174.3	-73.3	-170.7	173.6	-168.7	0	109.6	L139 S161	L139-K141 PolarHBondContact O-N 3.07Å; K141-S161 PolarHBondContact NZ-OG 2.77Å
142	L	77.4	Confident	66.2	Low	42 Å²	42	78.3 Å²	78.3	22%	0.22	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-64.5	133.2	177.5	-61	171.8	0	0	0	109.9	P140 L261 Y264	P140-L142 PolarHBondContact O-N 2.95Å; L142-L261 HydrophobicContact CD1-CD2 3.52Å; L142-Y264 HydrophobicContact CB-CE1 4.29Å; L142-Y264 HydrophobicContact CB-CE2 4.42Å; L142-Y264 HydrophobicContact CD1-CD1 4.09Å; L142-Y264 HydrophobicContact CD1-CE1 4.19Å; L142-Y264 HydrophobicContact CD1-CG 4.35Å; L142-Y264 HydrophobicContact CD2-CE1 4.12Å; L142-Y264 HydrophobicContact CG-CE1 4.43Å
143	P	79.6	Confident	65.3	Low	47 Å²	47	78.3 Å²	78.3	31%	0.305	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-69	149.8	176.7	26.4	-31.1	0	0	0	111.1	Y264 S350	P143-Y264 WeakPolarHBondContact CD-OH 3.27Å; P143-Y264 WeakPolarHBondContact O-CE2 3.5Å; P143-Y264 PolarHBondContact O-OH 3.2Å; P143-S350 WeakPolarHBondContact CD-O 3.05Å; P143-S350 WeakPolarHBondContact CG-O 3.33Å
144	T	76.1	Confident	65	Low	62 Å²	62	78.5 Å²	78.5	38%	0.38	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-69.8	146	177.2	56.2	0	0	0	0	110.5	F156 E158 H351	T144-F156 CarbonylContact C-O 3.53Å; T144-F156 VanDerWaalsContact CA-O 3.28Å; T144-F156 WeakPolarHBondContact CA-O 3.34Å; T144-F156 WeakPolarHBondContact CB-O 3.36Å; T144-E158 WeakPolarHBondContact CG2-O 3.44Å; T144-H351 PolarHBondContact O-NE2 3.46Å
145	L	74	Confident	64.5	Low	10 Å²	10	72.2 Å²	72.2	5%	0.052	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-83.2	147.9	174.2	-73	168.2	0	0	0	110.1	K147 F156 S157 Y264 L267 L347 H351	L145-K147 PolarHBondContact O-N 3.4Å; L145-F156 HydrophobicContact CD1-CB 4.02Å; L145-F156 HydrophobicContact CG-CB 4.46Å; L145-F156 PolarHBondContact N-O 3.25Å; L145-S157 WeakPolarHBondContact O-CA 3.45Å; L145-Y264 HydrophobicContact CD1-CD2 3.98Å; L145-Y264 HydrophobicContact CD1-CE2 3.99Å; L145-Y264 HydrophobicContact CG-CD2 4.43Å; L145-Y264 HydrophobicContact CG-CE2 3.93Å; L145-L267 HydrophobicContact CD1-CB 3.53Å; L145-L347 HydrophobicContact CD2-CD2 4.13Å; L145-H351 HydrophobicContact CD2-CB 4.5Å; L145-H351 WeakPolarHBondContact CD2-CD2 3.37Å
146	P	70.2	Confident	64	Low	61 Å²	61	72.1 Å²	72.1	40%	0.396	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-58.8	137.8	177.4	-22	32.6	0	0	0	112.5	N148 Y149	P146-N148 PolarHBondContact O-N 2.95Å; P146-Y149 HydrophobicContact CB-CD2 4.01Å; P146-Y149 HydrophobicContact CB-CE2 4Å
147	K	61.5	Low	63.5	Low	131 Å²	131	70.1 Å²	70.1	57%	0.57	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-14.1	-171.7	-70.9	179.9	-177.4	175.6	0	116.1	L145 Y149 S157 E159	L145-K147 PolarHBondContact O-N 3.4Å; K147-Y149 VanDerWaalsContact C-N 3.3Å; K147-Y149 PolarHBondContact O-N 3.22Å; K147-S157 VanDerWaalsContact CG-O 3.25Å; K147-S157 WeakPolarHBondContact CG-O 3.45Å; K147-E159 IonicContact NZ-OE2 3.83Å
148	N	57.6	Low	63	Low	131 Å²	131	65.4 Å²	65.4	70%	0.701	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-6.6	-169.3	-64.9	-9.5	0	0	0	114.5	P146	P146-N148 PolarHBondContact O-N 2.95Å
149	Y	53.4	Low	62.4	Low	76 Å²	76	65.6 Å²	65.6	30%	0.298	34%	0.34	S	S	.	.	S	Bend	trans	-132.5	5.6	-153.9	-52.4	-60.7	0	0	0	116.2	P146 K147 C271 E274	P146-Y149 HydrophobicContact CB-CD2 4.01Å; P146-Y149 HydrophobicContact CB-CE2 4Å; K147-Y149 VanDerWaalsContact C-N 3.3Å; K147-Y149 PolarHBondContact O-N 3.22Å; Y149-C271 VanDerWaalsContact CB-SG 3.55Å; Y149-E274 WeakPolarHBondContact CD1-OE2 3.36Å
150	S	51.2	Low	61.9	Low	24 Å²	24	68.5 Å²	68.5	17%	0.168	36%	0.355	C	S	.	.			trans	-108.3	108.8	-179.7	-169.2	0	0	0	0	113.4	S153	S150-S153 VanDerWaalsContact OG-C 3.28Å; S150-S153 PolarHBondContact OG-O 3.02Å
151	N	53.4	Low	61.5	Low	125 Å²	125	66.2 Å²	66.2	67%	0.668	34%	0.341	S	S	*	.	S	Bend	trans	-91.9	-22.6	178.4	-71.5	-24.8	0	0	0	113.9	N63	N63-N151 PolarHBondContact ND2-O 3.24Å
152	T	50.4	Low	61.1	Low	74 Å²	74	64 Å²	64	45%	0.454	34%	0.337	S	S	.	.	S	Bend	trans	-115.7	-25	-168.8	53.1	0	0	0	0	115.2	S103	S103-T152 PolarHBondContact OG-O 3.36Å; S103-T152 VanDerWaalsContact OG-O 3.13Å
153	S	54.5	Low	60.6	Low	5 Å²	5	62.9 Å²	62.9	4%	0.035	33%	0.33	C	S	.	.			trans	-155.3	107.5	-178.9	57	0	0	0	0	111.6	L101 S150 I155	L101-S153 WeakPolarHBondContact O-CA 3.47Å; S150-S153 VanDerWaalsContact OG-C 3.28Å; S150-S153 PolarHBondContact OG-O 3.02Å; S153-I155 PolarHBondContact O-N 2.86Å
154	K	63	Low	59.9	Low	88 Å²	88	62.5 Å²	62.5	38%	0.383	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-77	-2.1	-178.3	-71.2	-173.1	-178.6	-176.1	0	114.7	E99 F156 S157	E99-K154 WeakPolarHBondContact OE2-CD 3.19Å; E99-K154 IonicContact OE2-NZ 2.77Å; E99-K154 PolarHBondContact OE2-NZ 2.85Å; K154-F156 PolarHBondContact O-N 3.17Å; K154-S157 WeakPolarHBondContact CA-OG 3.24Å; K154-S157 PolarHBondContact O-N 3.04Å; K154-S157 PolarHBondContact O-OG 3.12Å
155	I	61.4	Low	59.6	Low	8 Å²	8	64 Å²	64	4%	0.041	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-41.9	-40.6	-178.7	-61	159.9	0	0	0	113.7	L101 H102 S153 I164 L167	L101-I155 WeakPolarHBondContact O-CD1 3.35Å; L101-I155 WeakPolarHBondContact O-CG1 3.23Å; H102-I155 HydrophobicContact CB-CD1 4.06Å; S153-I155 PolarHBondContact O-N 2.86Å; I155-I164 HydrophobicContact CG2-CB 4.2Å; I155-I164 HydrophobicContact CG2-CD1 4.28Å; I155-I164 HydrophobicContact CG2-CG1 3.22Å; I155-L167 HydrophobicContact CD1-CD2 3.44Å; I155-L167 VanDerWaalsContact CD1-CD2 3.44Å; I155-L167 HydrophobicContact CG1-CD2 4.01Å
156	F	61.2	Low	59.6	Low	10 Å²	10	65.9 Å²	65.9	4%	0.044	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-99.8	-1.6	-172.6	-54.7	-73	0	0	0	113.3	T144 L145 K154 I164 A260 Q263 Y264 L267	T144-F156 CarbonylContact C-O 3.53Å; T144-F156 VanDerWaalsContact CA-O 3.28Å; T144-F156 WeakPolarHBondContact CA-O 3.34Å; T144-F156 WeakPolarHBondContact CB-O 3.36Å; L145-F156 HydrophobicContact CD1-CB 4.02Å; L145-F156 HydrophobicContact CG-CB 4.46Å; L145-F156 PolarHBondContact N-O 3.25Å; K154-F156 PolarHBondContact O-N 3.17Å; F156-I164 HydrophobicContact CD1-CD1 3.67Å; F156-I164 HydrophobicContact CD1-CG1 4.19Å; F156-I164 HydrophobicContact CE1-CD1 3.66Å; F156-I164 HydrophobicContact CE1-CG1 3.99Å; F156-A260 HydrophobicContact CZ-CB 4.47Å; F156-A260 WeakPolarHBondContact CZ-O 3.42Å; F156-Q263 HydrophobicContact CE2-CB 4.37Å; F156-Y264 HydrophobicContact CB-CD2 3.95Å; F156-Y264 HydrophobicContact CB-CE2 4.26Å; F156-Y264 AromaticContact CD1-CD2 3.37Å; F156-Y264 HydrophobicContact CD1-CD2 3.37Å; F156-Y264 HydrophobicContact CD1-CE2 4.05Å; F156-Y264 HydrophobicContact CD1-CG 4.19Å; F156-Y264 HydrophobicContact CD2-CD2 4.23Å; F156-Y264 AromaticContact CE1-CD2 3.85Å; F156-Y264 HydrophobicContact CE1-CD2 3.85Å; F156-Y264 HydrophobicContact CE1-CG 4.23Å; F156-Y264 AromaticContact CG-CD2 3.58Å; F156-Y264 HydrophobicContact CG-CD2 3.58Å; F156-Y264 HydrophobicContact CG-CE2 4.32Å; F156-Y264 HydrophobicContact CZ-CD2 4.46Å; F156-L267 HydrophobicContact CD2-CD1 3.61Å; F156-L267 HydrophobicContact CE2-CD1 4.05Å
157	S	57.3	Low	59.7	Low	14 Å²	14	63.3 Å²	63.3	10%	0.098	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-15	-171.7	65.2	0	0	0	0	114.6	L145 K147 K154	L145-S157 WeakPolarHBondContact O-CA 3.45Å; K147-S157 VanDerWaalsContact CG-O 3.25Å; K147-S157 WeakPolarHBondContact CG-O 3.45Å; K154-S157 WeakPolarHBondContact CA-OG 3.24Å; K154-S157 PolarHBondContact O-N 3.04Å; K154-S157 PolarHBondContact O-OG 3.12Å
158	E	57.5	Low	60.1	Low	51 Å²	51	57.5 Å²	57.5	24%	0.238	30%	0.296	C	S	.	.	S	Bend	trans	-94.3	143.2	-178.1	-160.9	155.6	172.4	0	0	111.6	K97 T144 N160	K97-E158 IonicContact NZ-OE1 2.9Å; K97-E158 PolarHBondContact NZ-OE1 2.95Å; K97-E158 IonicContact NZ-OE2 2.66Å; K97-E158 PolarHBondContact NZ-OE2 3.23Å; T144-E158 WeakPolarHBondContact CG2-O 3.44Å; E158-N160 PolarHBondContact O-N 3Å
159	E	52.9	Low	60.7	Low	151 Å²	151	51.9 Å²	51.9	71%	0.706	27%	0.269	S	S	*	.	S	Bend	trans	-60.9	-8.1	-168.5	-85.7	168.2	133.2	0	0	115.2	K147	K147-E159 IonicContact NZ-OE2 3.83Å
160	N	52.5	Low	61.5	Low	96 Å²	96	52.8 Å²	52.8	51%	0.513	28%	0.279	S	S	.	.			trans	-114.6	120.7	-175.3	-61.5	-21.6	0	0	0	110.8	E158 D162 E163	E158-N160 PolarHBondContact O-N 3Å; N160-D162 HydrophobicContact CB-CB 4.41Å; N160-D162 PolarHBondContact O-N 2.94Å; N160-E163 PolarHBondContact O-N 3.5Å
161	S	54.7	Low	62.5	Low	38 Å²	38	51.9 Å²	51.9	27%	0.266	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-8.7	171.8	57.4	0	0	0	0	114.7	K141 E163	K141-S161 PolarHBondContact NZ-OG 2.77Å; S161-E163 VanDerWaalsContact C-N 3.3Å; S161-E163 PolarHBondContact O-N 3.06Å
162	D	62.8	Low	64	Low	100 Å²	100	49.5 Å²	49.5	54%	0.535	25%	0.254	S	S	.	.	H	α-helix	trans	-71	-21.6	-173.9	-63.3	-13.7	0	0	0	112.8	N160 I165 K166	N160-D162 HydrophobicContact CB-CB 4.41Å; N160-D162 PolarHBondContact O-N 2.94Å; D162-I165 PolarHBondContact O-N 3.45Å; D162-K166 WeakPolarHBondContact O-CB 3.35Å; D162-K166 PolarHBondContact O-N 3.34Å
163	E	66.8	Low	66	Low	18 Å²	18	46 Å²	46	8%	0.084	23%	0.233	C	C	.	.	H	α-helix	trans	-72.3	-40	179.2	-64.4	-163.5	161.4	0	0	113	K97 N160 S161 I165 K166 L167	K97-E163 IonicContact NZ-OE1 3.25Å; N160-E163 PolarHBondContact O-N 3.5Å; S161-E163 VanDerWaalsContact C-N 3.3Å; S161-E163 PolarHBondContact O-N 3.06Å; E163-I165 VanDerWaalsContact C-N 3.31Å; E163-K166 PolarHBondContact O-N 2.99Å; E163-L167 WeakPolarHBondContact O-CB 3.35Å; E163-L167 PolarHBondContact O-N 3.37Å
164	I	65.3	Low	67.8	Low	40 Å²	40	46 Å²	46	21%	0.205	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-45.8	172.2	-64.2	162.2	0	0	0	109.5	I155 F156 K166 L167 L168	I155-I164 HydrophobicContact CG2-CB 4.2Å; I155-I164 HydrophobicContact CG2-CD1 4.28Å; I155-I164 HydrophobicContact CG2-CG1 3.22Å; F156-I164 HydrophobicContact CD1-CD1 3.67Å; F156-I164 HydrophobicContact CD1-CG1 4.19Å; F156-I164 HydrophobicContact CE1-CD1 3.66Å; F156-I164 HydrophobicContact CE1-CG1 3.99Å; I164-K166 VanDerWaalsContact C-N 3.33Å; I164-K166 PolarHBondContact O-N 3.33Å; I164-L167 PolarHBondContact O-N 2.66Å; I164-L168 HydrophobicContact CG2-CD1 3.81Å; I164-L168 HydrophobicContact CG2-CG 4.38Å; I164-L168 WeakPolarHBondContact O-CB 3.37Å; I164-L168 VanDerWaalsContact O-CG 3.29Å; I164-L168 WeakPolarHBondContact O-CG 3.49Å; I164-L168 PolarHBondContact O-N 3.04Å
165	I	70.7	Confident	69.4	Low	94 Å²	94	41.9 Å²	41.9	48%	0.482	21%	0.214	S	C	.	.	H	α-helix	trans	-64.3	-40.5	178.4	-62	170.9	0	0	0	110.3	D162 E163 L167 L168 G169	D162-I165 PolarHBondContact O-N 3.45Å; E163-I165 VanDerWaalsContact C-N 3.31Å; I165-L167 VanDerWaalsContact C-N 3.34Å; I165-L167 PolarHBondContact O-N 3.42Å; I165-L168 PolarHBondContact O-N 3.45Å; I165-G169 WeakPolarHBondContact O-CA 3.21Å; I165-G169 PolarHBondContact O-N 3.38Å
166	K	73.4	Confident	71.1	Confident	49 Å²	49	41.5 Å²	41.5	21%	0.213	21%	0.212	C	C	.	.	H	α-helix	trans	-64	-39.9	176.6	-176.7	174.9	-178.1	173.4	0	111.8	R74 D94 D162 E163 I164 G169	R74-K166 PolarHBondContact NH1-O 3.36Å; R74-K166 PolarHBondContact NH2-O 3.46Å; D94-K166 WeakPolarHBondContact OD1-CE 3.44Å; D94-K166 IonicContact OD1-NZ 3.32Å; D94-K166 PolarHBondContact OD1-NZ 3.01Å; D94-K166 IonicContact OD2-NZ 2.79Å; D94-K166 PolarHBondContact OD2-NZ 2.83Å; D162-K166 WeakPolarHBondContact O-CB 3.35Å; D162-K166 PolarHBondContact O-N 3.34Å; E163-K166 PolarHBondContact O-N 2.99Å; I164-K166 VanDerWaalsContact C-N 3.33Å; I164-K166 PolarHBondContact O-N 3.33Å; K166-G169 PolarHBondContact O-N 3.49Å
167	L	72.7	Confident	72.9	Confident	6 Å²	6	41 Å²	41	3%	0.031	21%	0.21	C	C	.	.	H	α-helix	trans	-66.8	-50.4	176.7	-173.1	70.2	0	0	0	111	R74 L79 L92 L101 H102 I155 E163 I164 I165 G169 M192	R74-L167 PolarHBondContact NH1-O 3.44Å; R74-L167 VanDerWaalsContact NH1-O 3.11Å; L79-L167 HydrophobicContact CD1-CD1 4.15Å; L92-L167 HydrophobicContact CB-CD1 4.49Å; L92-L167 HydrophobicContact CD1-CD1 3.99Å; L101-L167 HydrophobicContact CB-CD1 4.42Å; H102-L167 HydrophobicContact CB-CD1 3.85Å; H102-L167 HydrophobicContact CB-CD2 4.02Å; I155-L167 HydrophobicContact CD1-CD2 3.44Å; I155-L167 VanDerWaalsContact CD1-CD2 3.44Å; I155-L167 HydrophobicContact CG1-CD2 4.01Å; E163-L167 WeakPolarHBondContact O-CB 3.35Å; E163-L167 PolarHBondContact O-N 3.37Å; I164-L167 PolarHBondContact O-N 2.66Å; I165-L167 VanDerWaalsContact C-N 3.34Å; I165-L167 PolarHBondContact O-N 3.42Å; L167-G169 PolarHBondContact O-N 3.36Å; L167-M192 HydrophobicContact CB-CE 4.36Å; L167-M192 HydrophobicContact CD1-CE 4.29Å; L167-M192 HydrophobicContact CD1-SD 4.42Å; L167-M192 HydrophobicContact CD2-CE 4.02Å; L167-M192 HydrophobicContact CD2-SD 3.5Å; L167-M192 VanDerWaalsContact CD2-SD 3.5Å; L167-M192 HydrophobicContact CG-CE 3.51Å; L167-M192 HydrophobicContact CG-SD 3.67Å; L167-M192 VanDerWaalsContact O-CE 3.28Å; L167-M192 WeakPolarHBondContact O-CE 3.24Å
168	L	70.3	Confident	74.8	Confident	9 Å²	9	40.5 Å²	40.5	5%	0.047	21%	0.206	C	C	.	.	H	α-helix	trans	-59.8	-30.8	173.7	-70.8	170.7	0	0	0	111.9	I164 I165 Y190 M192 R253 T256	I164-L168 HydrophobicContact CG2-CD1 3.81Å; I164-L168 HydrophobicContact CG2-CG 4.38Å; I164-L168 WeakPolarHBondContact O-CB 3.37Å; I164-L168 VanDerWaalsContact O-CG 3.29Å; I164-L168 WeakPolarHBondContact O-CG 3.49Å; I164-L168 PolarHBondContact O-N 3.04Å; I165-L168 PolarHBondContact O-N 3.45Å; L168-Y190 WeakPolarHBondContact O-CD1 3.45Å; L168-M192 HydrophobicContact CD2-CE 4.24Å; L168-R253 PolarHBondContact O-NH1 3.34Å; L168-T256 HydrophobicContact CD2-CG2 3.45Å; L168-T256 VanDerWaalsContact CD2-CG2 3.45Å
169	G	68.9	Low	76.6	Confident	13 Å²	13	38.2 Å²	38.2	13%	0.134	20%	0.196	C	C	.	.			trans	65.5	-168.4	-179.9	0	0	0	0	0	113	I165 K166 L167 R253	I165-G169 WeakPolarHBondContact O-CA 3.21Å; I165-G169 PolarHBondContact O-N 3.38Å; K166-G169 PolarHBondContact O-N 3.49Å; L167-G169 PolarHBondContact O-N 3.36Å; G169-R253 PolarHBondContact O-NH2 2.81Å
170	D	71.1	Confident	78.5	Confident	95 Å²	95	31.1 Å²	31.1	51%	0.508	16%	0.164	S	C	.	.	S	Bend	trans	-55.1	153.1	168.9	-164.9	-18	0	0	0	110	R172 R253	D170-R172 PolarHBondContact O-N 3.17Å; D170-R253 PolarHBondContact O-NH1 3.45Å
171	V	71.6	Confident	80.4	Confident	5 Å²	5	30.1 Å²	30.1	3%	0.03	16%	0.164	C	C	.	.	S	Bend	trans	-66	-22.4	179.7	-160.9	0	0	0	0	111	F128 Y129 E132 L173 Y190	F128-V171 HydrophobicContact CD1-CG1 4.28Å; F128-V171 HydrophobicContact CE1-CG1 3.77Å; F128-V171 HydrophobicContact CZ-CG1 4.48Å; Y129-V171 HydrophobicContact CD1-CB 3.48Å; Y129-V171 VanDerWaalsContact CD1-CB 3.48Å; Y129-V171 HydrophobicContact CD1-CG1 3.32Å; Y129-V171 HydrophobicContact CE1-CB 4.05Å; Y129-V171 HydrophobicContact CE1-CG1 3.9Å; Y129-V171 HydrophobicContact CG-CB 4Å; Y129-V171 HydrophobicContact CG-CG1 4.21Å; E132-V171 HydrophobicContact CB-CG1 4.31Å; V171-L173 PolarHBondContact O-N 2.95Å; V171-Y190 PolarHBondContact O-OH 2.96Å
172	R	85.8	Confident	82.1	Confident	76 Å²	76	30.5 Å²	30.5	29%	0.287	17%	0.167	S	C	.	.	S	Bend	trans	-53.4	128.7	174.3	-68.1	-172.5	-177.3	-132.3	-2.6	111.9	E117 E121 Y129 D170 N174 Y190	E117-R172 HydrophobicContact CG-CB 4.46Å; E121-R172 IonicContact OE1-CZ 2.86Å; E121-R172 IonicContact OE1-NH1 3.04Å; E121-R172 PolarHBondContact OE1-NH1 3.27Å; E121-R172 IonicContact OE1-NH2 3.78Å; E121-R172 PolarHBondContact OE1-NH2 2.96Å; Y129-R172 HydrophobicContact CE2-CG 4.13Å; D170-R172 PolarHBondContact O-N 3.17Å; R172-N174 PolarHBondContact O-N 3.49Å; R172-N174 PolarHBondContact O-ND2 3.47Å; R172-Y190 WeakPolarHBondContact O-CE1 3.32Å
173	L	90.6	Very high	83.4	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	15%	0.151	C	C	.	.			trans	-64	122	179.7	-178.3	65.2	0	0	0	110.2	V118 V171 I175 A189 Y190 L214 L245 V248 T249 A252	V118-L173 HydrophobicContact CG2-CB 4.17Å; V118-L173 HydrophobicContact CG2-CD2 4.25Å; V118-L173 HydrophobicContact CG2-CG 4.33Å; V118-L173 WeakPolarHBondContact CG2-O 3.42Å; V118-L173 PolarHBondContact N-O 3.47Å; V171-L173 PolarHBondContact O-N 2.95Å; L173-I175 HydrophobicContact CD1-CG1 4.29Å; L173-I175 HydrophobicContact CD2-CD1 4.09Å; L173-I175 HydrophobicContact CD2-CG1 4.35Å; L173-I175 HydrophobicContact CG-CD1 4.37Å; L173-I175 HydrophobicContact CG-CG1 4.1Å; L173-A189 HydrophobicContact CD1-CB 3.91Å; L173-Y190 HydrophobicContact CD1-CE2 3.98Å; L173-L214 HydrophobicContact CD2-CD1 4.32Å; L173-L245 HydrophobicContact CD2-CD1 3.96Å; L173-V248 HydrophobicContact CD2-CG1 4.35Å; L173-T249 HydrophobicContact CB-CG2 4Å; L173-A252 HydrophobicContact CD1-CB 4.4Å
174	N	93.4	Very high	84.8	Confident	5 Å²	5	26.9 Å²	26.9	3%	0.027	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.6	166.8	62.4	86.2	0	0	0	109.2	W115 M116 E117 R172 Y190	W115-N174 PolarHBondContact NE1-OD1 2.99Å; M116-N174 CarbonylContact O-C 3.55Å; M116-N174 WeakPolarHBondContact O-CA 3.3Å; M116-N174 WeakPolarHBondContact O-CB 3.35Å; E117-N174 HydrophobicContact CB-CB 4.2Å; R172-N174 PolarHBondContact O-N 3.49Å; R172-N174 PolarHBondContact O-ND2 3.47Å; N174-Y190 WeakPolarHBondContact ND2-CD1 3.4Å; N174-Y190 PolarHBondContact O-N 3.36Å; N174-Y190 WeakPolarHBondContact OD1-CA 3.35Å
175	I	96.2	Very high	86.3	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	126.6	-173.6	-59.2	169.3	0	0	0	108.4	W115 M116 L173 V177 L187 Y188 I195 L210 L214	W115-I175 WeakPolarHBondContact CA-O 3.38Å; M116-I175 HydrophobicContact CG-CB 4.35Å; M116-I175 PolarHBondContact N-O 3.47Å; M116-I175 PolarHBondContact O-N 3.03Å; L173-I175 HydrophobicContact CD1-CG1 4.29Å; L173-I175 HydrophobicContact CD2-CD1 4.09Å; L173-I175 HydrophobicContact CD2-CG1 4.35Å; L173-I175 HydrophobicContact CG-CD1 4.37Å; L173-I175 HydrophobicContact CG-CG1 4.1Å; I175-V177 HydrophobicContact CG2-CG2 4.16Å; I175-L187 HydrophobicContact CG2-CB 3.84Å; I175-L187 HydrophobicContact CG2-CD2 4.19Å; I175-L187 HydrophobicContact CG2-CG 4.03Å; I175-Y188 WeakPolarHBondContact CA-O 3.35Å; I175-I195 HydrophobicContact CD1-CD1 3.82Å; I175-I195 HydrophobicContact CG1-CD1 4.07Å; I175-I195 HydrophobicContact CG2-CD1 4.41Å; I175-L210 HydrophobicContact CB-CD2 4.18Å; I175-L210 HydrophobicContact CD1-CD2 3.88Å; I175-L210 HydrophobicContact CG2-CD2 4.07Å; I175-L214 HydrophobicContact CD1-CD1 4.46Å; I175-L214 HydrophobicContact CD1-CD2 3.96Å
176	L	97.5	Very high	87.5	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	112.8	168.6	176.5	62.4	0	0	0	108.7	A72 A81 M113 W115 L178 Y188	A72-L176 HydrophobicContact CB-CD1 4.09Å; A81-L176 HydrophobicContact CB-CD2 4.23Å; M113-L176 HydrophobicContact CB-CD1 4.33Å; M113-L176 HydrophobicContact CE-CD1 3.74Å; M113-L176 HydrophobicContact CE-CD2 3.82Å; M113-L176 HydrophobicContact CE-CG 4.24Å; W115-L176 HydrophobicContact CB-CD1 4.01Å; W115-L176 HydrophobicContact CD2-CB 4.16Å; W115-L176 HydrophobicContact CD2-CD1 4.12Å; W115-L176 HydrophobicContact CE3-CD1 4.17Å; W115-L176 HydrophobicContact CG-CB 4.2Å; W115-L176 HydrophobicContact CG-CD1 4.11Å; L176-L178 HydrophobicContact CD1-CD2 4.2Å; L176-L178 HydrophobicContact CD2-CD2 4.05Å; L176-L178 HydrophobicContact CG-CD2 3.79Å; L176-L178 HydrophobicContact CG-CG 4.47Å; L176-Y188 PolarHBondContact N-O 3.46Å; L176-Y188 PolarHBondContact O-N 2.82Å
177	V	98	Very high	88.7	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	132.1	178.3	-164.6	0	0	0	0	108.9	M113 H114 I175 I185 E186 L187 L208 L210 L217	M113-V177 WeakPolarHBondContact CA-O 3.32Å; H114-V177 HydrophobicContact CB-CB 4.48Å; H114-V177 PolarHBondContact N-O 3.35Å; H114-V177 PolarHBondContact O-N 3.17Å; I175-V177 HydrophobicContact CG2-CG2 4.16Å; V177-I185 HydrophobicContact CG1-CG2 3.63Å; V177-E186 WeakPolarHBondContact CA-O 3.3Å; V177-L187 HydrophobicContact CG1-CD1 4.03Å; V177-L187 HydrophobicContact CG1-CG 4.25Å; V177-L187 HydrophobicContact CG2-CG 4.31Å; V177-L208 HydrophobicContact CB-CD1 4.43Å; V177-L208 HydrophobicContact CG1-CB 4.5Å; V177-L208 HydrophobicContact CG1-CD1 3.96Å; V177-L208 HydrophobicContact CG1-CD2 4.48Å; V177-L210 HydrophobicContact CG2-CB 3.93Å; V177-L210 HydrophobicContact CG2-CD2 4Å; V177-L217 HydrophobicContact CG1-CD1 4.29Å
178	L	97.9	Very high	89.8	Confident	4 Å²	4	18.8 Å²	18.8	2%	0.021	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.7	-177.2	-51.6	176.3	0	0	0	110.1	I90 F104 V106 V110 M113 L176 I185 E186 Y188	I90-L178 HydrophobicContact CD1-CD1 3.22Å; I90-L178 HydrophobicContact CD1-CD2 3.5Å; I90-L178 HydrophobicContact CD1-CG 3.99Å; F104-L178 HydrophobicContact CE2-CD1 4.46Å; V106-L178 HydrophobicContact CG1-CD1 4.14Å; V110-L178 HydrophobicContact CG1-CB 4.35Å; V110-L178 HydrophobicContact CG1-CD2 4.43Å; M113-L178 HydrophobicContact CB-CD2 4.46Å; M113-L178 HydrophobicContact CE-CD2 3.78Å; M113-L178 HydrophobicContact CG-CD2 3.71Å; M113-L178 HydrophobicContact SD-CD2 4.37Å; L176-L178 HydrophobicContact CD1-CD2 4.2Å; L176-L178 HydrophobicContact CD2-CD2 4.05Å; L176-L178 HydrophobicContact CG-CD2 3.79Å; L176-L178 HydrophobicContact CG-CG 4.47Å; L178-I185 WeakPolarHBondContact O-CA 3.21Å; L178-I185 WeakPolarHBondContact O-CG2 3.31Å; L178-E186 HydrophobicContact CB-CB 4.45Å; L178-E186 PolarHBondContact N-O 2.89Å; L178-E186 PolarHBondContact O-N 2.87Å; L178-Y188 HydrophobicContact CD1-CD2 3.46Å; L178-Y188 VanDerWaalsContact CD1-CD2 3.46Å; L178-Y188 HydrophobicContact CD1-CE2 3.4Å; L178-Y188 HydrophobicContact CD1-CG 4.44Å; L178-Y188 HydrophobicContact CG-CD2 4.12Å; L178-Y188 HydrophobicContact CG-CE2 4.44Å
179	G	95.8	Very high	90.9	Very high	2 Å²	2	18.4 Å²	18.4	2%	0.021	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	146.8	174.9	0	0	0	0	0	110.8	V110 S111 C112 L208	V110-G179 WeakPolarHBondContact CG1-O 3.26Å; S111-G179 PolarHBondContact N-O 3.16Å; S111-G179 PolarHBondContact OG-O 3.32Å; S111-G179 VanDerWaalsContact OG-O 3.1Å; C112-G179 PolarHBondContact N-O 3.12Å; C112-G179 VanDerWaalsContact N-O 3.13Å; C112-G179 PolarHBondContact O-N 2.71Å; G179-L208 VanDerWaalsContact N-CD1 3.33Å
180	G	93.3	Very high	91.9	Very high	3 Å²	3	17.8 Å²	17.8	3%	0.031	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	-160.2	-179.1	0	0	0	0	0	112.2	S111 C205	S111-G180 WeakPolarHBondContact OG-CA 3.17Å; G180-C205 PolarHBondContact O-N 3.42Å; G180-C205 VanDerWaalsContact O-N 3.08Å
181	S	91.4	Very high	92.8	Very high	74 Å²	74	13.3 Å²	13.3	52%	0.517	8%	0.078	S	C	.	.	S	Bend	trans	-95	3.3	173.2	55.7	0	0	0	0	113.7	G183 T204	S181-G183 VanDerWaalsContact C-N 3.31Å; S181-G183 PolarHBondContact O-N 2.89Å; S181-T204 WeakPolarHBondContact CB-OG1 3.31Å
182	S	90	Very high	93.5	Very high	47 Å²	47	13.8 Å²	13.8	33%	0.329	8%	0.081	S	C	.	.	S	Bend	trans	-83.6	-2.1	-174.3	55	0	0	0	0	114.8	A108 F184	A108-S182 VanDerWaalsContact CB-CB 3.42Å; S182-F184 VanDerWaalsContact OG-CD1 3.32Å; S182-F184 WeakPolarHBondContact OG-CD1 3.28Å; S182-F184 WeakPolarHBondContact OG-CE1 3.14Å; S182-F184 VanDerWaalsContact OG-CZ 3.28Å; S182-F184 WeakPolarHBondContact OG-CZ 3.23Å
183	G	91.3	Very high	93.7	Very high	19 Å²	19	10.7 Å²	10.7	20%	0.196	7%	0.069	C	C	.	.	S	Bend	trans	75.4	19.6	179.8	0	0	0	0	0	115.7	S181 G200 I201	S181-G183 VanDerWaalsContact C-N 3.31Å; S181-G183 PolarHBondContact O-N 2.89Å; G183-G200 PolarHBondContact O-N 3.48Å; G183-G200 VanDerWaalsContact O-N 3.15Å; G183-I201 WeakPolarHBondContact CA-O 3.46Å; G183-I201 PolarHBondContact O-N 3.49Å
184	F	94.8	Very high	93.9	Very high	23 Å²	23	12.7 Å²	12.7	10%	0.101	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	157.2	170	62.7	-99.8	0	0	0	111.9	E107 A108 S182 E186 R197 V198 T199	E107-F184 HydrophobicContact CB-CZ 4.02Å; A108-F184 HydrophobicContact CB-CE1 4.32Å; A108-F184 HydrophobicContact CB-CZ 3.88Å; S182-F184 VanDerWaalsContact OG-CD1 3.32Å; S182-F184 WeakPolarHBondContact OG-CD1 3.28Å; S182-F184 WeakPolarHBondContact OG-CE1 3.14Å; S182-F184 VanDerWaalsContact OG-CZ 3.28Å; S182-F184 WeakPolarHBondContact OG-CZ 3.23Å; F184-E186 HydrophobicContact CD2-CG 3.67Å; F184-E186 HydrophobicContact CE2-CG 3.72Å; F184-R197 HydrophobicContact CB-CG 4.48Å; F184-R197 HydrophobicContact CD2-CG 4.47Å; F184-V198 CarbonylContact C-O 3.52Å; F184-V198 WeakPolarHBondContact CA-O 3.35Å; F184-V198 WeakPolarHBondContact CB-O 3.43Å; F184-T199 HydrophobicContact CB-CG2 4.16Å
185	I	96.9	Very high	94	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	136.2	173.5	-67.8	164.5	0	0	0	107.8	V177 L178 L187 R197 V198 I201 L208 L217 V219	V177-I185 HydrophobicContact CG1-CG2 3.63Å; L178-I185 WeakPolarHBondContact O-CA 3.21Å; L178-I185 WeakPolarHBondContact O-CG2 3.31Å; I185-L187 HydrophobicContact CG2-CD1 3.92Å; I185-R197 CarbonylContact O-C 3.51Å; I185-R197 WeakPolarHBondContact O-CA 3.48Å; I185-V198 PolarHBondContact N-O 3.29Å; I185-V198 PolarHBondContact O-N 3.18Å; I185-I201 HydrophobicContact CD1-CD1 3.87Å; I185-I201 HydrophobicContact CD1-CG1 3.79Å; I185-I201 HydrophobicContact CD1-CG2 4.37Å; I185-I201 HydrophobicContact CG1-CG1 3.99Å; I185-L208 HydrophobicContact CD1-CD2 3.78Å; I185-L208 HydrophobicContact CG1-CD2 4.25Å; I185-L208 HydrophobicContact CG2-CD2 4.44Å; I185-L217 HydrophobicContact CD1-CD2 4.49Å; I185-L217 HydrophobicContact CG2-CD2 4.26Å; I185-V219 HydrophobicContact CD1-CB 4.41Å; I185-V219 HydrophobicContact CD1-CG1 3.88Å; I185-V219 HydrophobicContact CD1-CG2 3.62Å
186	E	97.1	Very high	94	Very high	6 Å²	6	12.4 Å²	12.4	3%	0.028	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138.5	178.2	-57.6	-172.9	126.3	0	0	110.7	V177 L178 F184 Y188 K194 A196 R197	V177-E186 WeakPolarHBondContact CA-O 3.3Å; L178-E186 HydrophobicContact CB-CB 4.45Å; L178-E186 PolarHBondContact N-O 2.89Å; L178-E186 PolarHBondContact O-N 2.87Å; F184-E186 HydrophobicContact CD2-CG 3.67Å; F184-E186 HydrophobicContact CE2-CG 3.72Å; E186-Y188 HydrophobicContact CB-CD2 4.09Å; E186-Y188 HydrophobicContact CB-CE2 3.61Å; E186-Y188 HydrophobicContact CG-CE2 4.49Å; E186-K194 HydrophobicContact CB-CD 4.14Å; E186-K194 HydrophobicContact CG-CD 4.09Å; E186-K194 VanDerWaalsContact OE1-CD 3.27Å; E186-K194 WeakPolarHBondContact OE1-CD 3.29Å; E186-K194 IonicContact OE1-NZ 2.76Å; E186-K194 PolarHBondContact OE1-NZ 3.47Å; E186-A196 WeakPolarHBondContact CA-O 3.45Å; E186-R197 HydrophobicContact CG-CG 4.37Å
187	L	97.6	Very high	93.9	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	120.9	176.4	-78	68.4	0	0	0	108.8	I175 V177 I185 K194 I195 A196 L210 L241 M548	I175-L187 HydrophobicContact CG2-CB 3.84Å; I175-L187 HydrophobicContact CG2-CD2 4.19Å; I175-L187 HydrophobicContact CG2-CG 4.03Å; V177-L187 HydrophobicContact CG1-CD1 4.03Å; V177-L187 HydrophobicContact CG1-CG 4.25Å; V177-L187 HydrophobicContact CG2-CG 4.31Å; I185-L187 HydrophobicContact CG2-CD1 3.92Å; L187-K194 CarbonylContact O-C 3.59Å; L187-K194 WeakPolarHBondContact O-CA 3.41Å; L187-I195 HydrophobicContact CB-CD1 4.32Å; L187-I195 HydrophobicContact CB-CG1 3.87Å; L187-I195 VanDerWaalsContact O-CG1 3.29Å; L187-I195 WeakPolarHBondContact O-CG1 3.48Å; L187-I195 PolarHBondContact O-N 2.95Å; L187-A196 HydrophobicContact CB-CB 4.09Å; L187-A196 HydrophobicContact CD1-CB 4.4Å; L187-A196 HydrophobicContact CD2-CB 4.34Å; L187-A196 PolarHBondContact N-O 3.11Å; L187-A196 PolarHBondContact O-N 3.27Å; L187-L210 HydrophobicContact CD2-CD2 4.07Å; L187-L241 HydrophobicContact CD2-CD1 3.98Å; L187-M548 HydrophobicContact CD2-CE 4.01Å
188	Y	95.8	Very high	93.8	Very high	13 Å²	13	15.1 Å²	15.1	5%	0.051	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	107.8	179.5	-77.4	-104.5	0	0	0	110.6	F104 I175 L176 L178 E186 G191 F193 K194	F104-Y188 HydrophobicContact CD2-CD1 4.34Å; F104-Y188 AromaticContact CD2-CE1 3.65Å; F104-Y188 HydrophobicContact CD2-CE1 3.65Å; F104-Y188 AromaticContact CE2-CD1 3.71Å; F104-Y188 HydrophobicContact CE2-CD1 3.71Å; F104-Y188 HydrophobicContact CE2-CD2 4.48Å; F104-Y188 AromaticContact CE2-CE1 3.3Å; F104-Y188 HydrophobicContact CE2-CE1 3.3Å; F104-Y188 HydrophobicContact CE2-CE2 4.16Å; F104-Y188 HydrophobicContact CE2-CG 4.28Å; F104-Y188 AromaticContact CE2-CZ 3.56Å; F104-Y188 AromaticContact CZ-CD1 3.88Å; F104-Y188 HydrophobicContact CZ-CD1 3.88Å; F104-Y188 AromaticContact CZ-CE1 3.98Å; F104-Y188 HydrophobicContact CZ-CE1 3.98Å; F104-Y188 HydrophobicContact CZ-CG 4.28Å; I175-Y188 WeakPolarHBondContact CA-O 3.35Å; L176-Y188 PolarHBondContact N-O 3.46Å; L176-Y188 PolarHBondContact O-N 2.82Å; L178-Y188 HydrophobicContact CD1-CD2 3.46Å; L178-Y188 VanDerWaalsContact CD1-CD2 3.46Å; L178-Y188 HydrophobicContact CD1-CE2 3.4Å; L178-Y188 HydrophobicContact CD1-CG 4.44Å; L178-Y188 HydrophobicContact CG-CD2 4.12Å; L178-Y188 HydrophobicContact CG-CE2 4.44Å; E186-Y188 HydrophobicContact CB-CD2 4.09Å; E186-Y188 HydrophobicContact CB-CE2 3.61Å; E186-Y188 HydrophobicContact CG-CE2 4.49Å; Y188-G191 PolarHBondContact O-N 3.22Å; Y188-F193 CarbonylContact C-O 3.57Å; Y188-F193 VanDerWaalsContact CA-O 3.25Å; Y188-F193 WeakPolarHBondContact CA-O 3.4Å; Y188-K194 HydrophobicContact CD1-CB 4.22Å; Y188-K194 HydrophobicContact CE1-CB 3.89Å; Y188-K194 HydrophobicContact CE2-CB 4.28Å; Y188-K194 HydrophobicContact CE2-CD 4.04Å; Y188-K194 HydrophobicContact CE2-CG 4.15Å
189	A	93.3	Very high	93.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	136	171.9	0	0	0	0	0	110.8	L173 G191 M192 F193 I195 A252	L173-A189 HydrophobicContact CD1-CB 3.91Å; A189-G191 PolarHBondContact O-N 2.9Å; A189-M192 PolarHBondContact O-N 3.38Å; A189-F193 PolarHBondContact N-O 3.28Å; A189-F193 PolarHBondContact O-N 3.33Å; A189-I195 HydrophobicContact CB-CD1 4.25Å; A189-I195 HydrophobicContact CB-CG1 4.31Å; A189-I195 HydrophobicContact CB-CG2 3.51Å; A189-A252 HydrophobicContact CB-CB 3.6Å
190	Y	90.9	Very high	93.3	Very high	1 Å²	1	22.5 Å²	22.5	0%	0.004	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	16.2	-173.9	-53.8	-81.5	0	0	0	114	L168 V171 R172 L173 N174 M192 A252 R253	L168-Y190 WeakPolarHBondContact O-CD1 3.45Å; V171-Y190 PolarHBondContact O-OH 2.96Å; R172-Y190 WeakPolarHBondContact O-CE1 3.32Å; L173-Y190 HydrophobicContact CD1-CE2 3.98Å; N174-Y190 WeakPolarHBondContact ND2-CD1 3.4Å; N174-Y190 PolarHBondContact O-N 3.36Å; N174-Y190 WeakPolarHBondContact OD1-CA 3.35Å; Y190-M192 PolarHBondContact O-N 3.2Å; Y190-A252 HydrophobicContact CE2-CB 4.28Å; Y190-R253 HydrophobicContact CE2-CB 4.38Å
191	G	89.5	Confident	93.2	Very high	0 Å²	0	23 Å²	23	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	9.6	-172.3	0	0	0	0	0	114.6	F104 Y188 A189	F104-G191 WeakPolarHBondContact CE1-O 3.49Å; Y188-G191 PolarHBondContact O-N 3.22Å; A189-G191 PolarHBondContact O-N 2.9Å
192	M	87.1	Confident	93.1	Very high	15 Å²	15	21.9 Å²	21.9	7%	0.074	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.3	-45.4	-173.9	-75.7	-178.3	-96.8	0	0	113	L92 L167 L168 A189 Y190 T256	L92-M192 HydrophobicContact CD1-CG 4.38Å; L167-M192 HydrophobicContact CB-CE 4.36Å; L167-M192 HydrophobicContact CD1-CE 4.29Å; L167-M192 HydrophobicContact CD1-SD 4.42Å; L167-M192 HydrophobicContact CD2-CE 4.02Å; L167-M192 HydrophobicContact CD2-SD 3.5Å; L167-M192 VanDerWaalsContact CD2-SD 3.5Å; L167-M192 HydrophobicContact CG-CE 3.51Å; L167-M192 HydrophobicContact CG-SD 3.67Å; L167-M192 VanDerWaalsContact O-CE 3.28Å; L167-M192 WeakPolarHBondContact O-CE 3.24Å; L168-M192 HydrophobicContact CD2-CE 4.24Å; A189-M192 PolarHBondContact O-N 3.38Å; Y190-M192 PolarHBondContact O-N 3.2Å; M192-T256 HydrophobicContact CB-CG2 3.88Å; M192-T256 HydrophobicContact CE-CG2 3.61Å; M192-T256 HydrophobicContact CG-CG2 4.35Å; M192-T256 HydrophobicContact SD-CG2 3.57Å; M192-T256 VanDerWaalsContact SD-CG2 3.57Å
193	F	89.9	Confident	93.1	Very high	12 Å²	12	21 Å²	21	5%	0.053	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	124	-170.8	-179.7	-103	0	0	0	112.3	Y188 A189 I195 F255 L537	Y188-F193 CarbonylContact C-O 3.57Å; Y188-F193 VanDerWaalsContact CA-O 3.25Å; Y188-F193 WeakPolarHBondContact CA-O 3.4Å; A189-F193 PolarHBondContact N-O 3.28Å; A189-F193 PolarHBondContact O-N 3.33Å; F193-I195 HydrophobicContact CD1-CG2 3.6Å; F193-I195 HydrophobicContact CE1-CG2 3.91Å; F193-I195 PolarHBondContact O-N 3.48Å; F193-F255 HydrophobicContact CD1-CB 3.7Å; F193-F255 AromaticContact CD1-CD2 3.94Å; F193-F255 HydrophobicContact CD1-CD2 3.94Å; F193-F255 HydrophobicContact CD1-CG 4.26Å; F193-F255 HydrophobicContact CD2-CB 3.72Å; F193-F255 HydrophobicContact CD2-CG 4.49Å; F193-F255 HydrophobicContact CE1-CB 3.75Å; F193-F255 AromaticContact CE1-CD2 3.2Å; F193-F255 HydrophobicContact CE1-CD2 3.2Å; F193-F255 AromaticContact CE1-CE2 3.94Å; F193-F255 HydrophobicContact CE1-CE2 3.94Å; F193-F255 AromaticContact CE1-CG 3.8Å; F193-F255 HydrophobicContact CE1-CG 3.8Å; F193-F255 HydrophobicContact CE2-CB 3.76Å; F193-F255 HydrophobicContact CE2-CD2 4.19Å; F193-F255 HydrophobicContact CE2-CG 4.05Å; F193-F255 HydrophobicContact CG-CB 3.69Å; F193-F255 HydrophobicContact CZ-CB 3.76Å; F193-F255 HydrophobicContact CZ-CD1 4.47Å; F193-F255 AromaticContact CZ-CD2 3.34Å; F193-F255 HydrophobicContact CZ-CD2 3.34Å; F193-F255 AromaticContact CZ-CE2 3.88Å; F193-F255 HydrophobicContact CZ-CE2 3.88Å; F193-F255 AromaticContact CZ-CG 3.66Å; F193-F255 HydrophobicContact CZ-CG 3.66Å; F193-L537 HydrophobicContact CD2-CD2 4.5Å; F193-L537 HydrophobicContact CE2-CB 3.84Å; F193-L537 HydrophobicContact CE2-CD1 4.43Å; F193-L537 HydrophobicContact CE2-CD2 3.68Å; F193-L537 HydrophobicContact CE2-CG 4.16Å; F193-L537 HydrophobicContact CZ-CB 4.33Å; F193-L537 HydrophobicContact CZ-CD2 4.17Å; F193-L537 VanDerWaalsContact CZ-O 3.28Å; F193-L537 WeakPolarHBondContact CZ-O 3.41Å
194	K	94.7	Very high	93.3	Very high	42 Å²	42	22.3 Å²	22.3	18%	0.183	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	107.1	179.2	-171.2	164.4	68.6	-173.7	0	110.7	E107 E186 L187 Y188 A541	E107-K194 IonicContact OE1-NZ 2.72Å; E186-K194 HydrophobicContact CB-CD 4.14Å; E186-K194 HydrophobicContact CG-CD 4.09Å; E186-K194 VanDerWaalsContact OE1-CD 3.27Å; E186-K194 WeakPolarHBondContact OE1-CD 3.29Å; E186-K194 IonicContact OE1-NZ 2.76Å; E186-K194 PolarHBondContact OE1-NZ 3.47Å; L187-K194 CarbonylContact O-C 3.59Å; L187-K194 WeakPolarHBondContact O-CA 3.41Å; Y188-K194 HydrophobicContact CD1-CB 4.22Å; Y188-K194 HydrophobicContact CE1-CB 3.89Å; Y188-K194 HydrophobicContact CE2-CB 4.28Å; Y188-K194 HydrophobicContact CE2-CD 4.04Å; Y188-K194 HydrophobicContact CE2-CG 4.15Å; K194-A541 HydrophobicContact CG-CB 4.15Å
195	I	95.1	Very high	93.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-20.6	-179.8	55.8	162.3	0	0	0	113.8	I175 L187 A189 F193 L241 A252 A541 I544	I175-I195 HydrophobicContact CD1-CD1 3.82Å; I175-I195 HydrophobicContact CG1-CD1 4.07Å; I175-I195 HydrophobicContact CG2-CD1 4.41Å; L187-I195 HydrophobicContact CB-CD1 4.32Å; L187-I195 HydrophobicContact CB-CG1 3.87Å; L187-I195 VanDerWaalsContact O-CG1 3.29Å; L187-I195 WeakPolarHBondContact O-CG1 3.48Å; L187-I195 PolarHBondContact O-N 2.95Å; A189-I195 HydrophobicContact CB-CD1 4.25Å; A189-I195 HydrophobicContact CB-CG1 4.31Å; A189-I195 HydrophobicContact CB-CG2 3.51Å; F193-I195 HydrophobicContact CD1-CG2 3.6Å; F193-I195 HydrophobicContact CE1-CG2 3.91Å; F193-I195 PolarHBondContact O-N 3.48Å; I195-L241 HydrophobicContact CD1-CD2 4.35Å; I195-A252 HydrophobicContact CG2-CB 3.93Å; I195-A541 WeakPolarHBondContact O-CA 3.29Å; I195-I544 WeakPolarHBondContact O-CD1 3.44Å
196	A	96.5	Very high	93.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	145.1	177.4	0	0	0	0	0	111.5	E186 L187 A541 I544 M548	E186-A196 WeakPolarHBondContact CA-O 3.45Å; L187-A196 HydrophobicContact CB-CB 4.09Å; L187-A196 HydrophobicContact CD1-CB 4.4Å; L187-A196 HydrophobicContact CD2-CB 4.34Å; L187-A196 PolarHBondContact N-O 3.11Å; L187-A196 PolarHBondContact O-N 3.27Å; A196-A541 CarbonylContact C-O 3.57Å; A196-A541 WeakPolarHBondContact CA-O 3.5Å; A196-I544 HydrophobicContact CB-CB 4.24Å; A196-I544 HydrophobicContact CB-CG2 3.79Å; A196-M548 HydrophobicContact CB-CE 3.86Å
197	R	95.7	Very high	93.1	Very high	53 Å²	53	21.9 Å²	21.9	20%	0.2	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	105.1	168.6	-178.4	-175	-177	165	10.8	110	E107 F184 I185 E186 T199 A541 G545	E107-R197 VanDerWaalsContact CD-NH1 3.31Å; E107-R197 IonicContact OE1-CZ 3.78Å; E107-R197 IonicContact OE1-NH1 3.27Å; E107-R197 PolarHBondContact OE1-NH1 3.03Å; E107-R197 IonicContact OE1-NH2 2.74Å; E107-R197 IonicContact OE2-CZ 3.42Å; E107-R197 IonicContact OE2-NH1 3.99Å; E107-R197 PolarHBondContact OE2-NH1 3.15Å; E107-R197 IonicContact OE2-NH2 2.88Å; E107-R197 PolarHBondContact OE2-NH2 3.32Å; F184-R197 HydrophobicContact CB-CG 4.48Å; F184-R197 HydrophobicContact CD2-CG 4.47Å; I185-R197 CarbonylContact O-C 3.51Å; I185-R197 WeakPolarHBondContact O-CA 3.48Å; E186-R197 HydrophobicContact CG-CG 4.37Å; R197-T199 HydrophobicContact CG-CG2 4.46Å; R197-A541 PolarHBondContact N-O 3.06Å; R197-G545 VanDerWaalsContact O-CA 3.26Å; R197-G545 WeakPolarHBondContact O-CA 3.27Å
198	V	95.5	Very high	93.1	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.024	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.7	177.6	-170.4	0	0	0	0	109.1	F184 I185 I201 L236 M548	F184-V198 CarbonylContact C-O 3.52Å; F184-V198 WeakPolarHBondContact CA-O 3.35Å; F184-V198 WeakPolarHBondContact CB-O 3.43Å; I185-V198 PolarHBondContact N-O 3.29Å; I185-V198 PolarHBondContact O-N 3.18Å; V198-I201 HydrophobicContact CG1-CD1 4.46Å; V198-L236 HydrophobicContact CG1-CD2 3.65Å; V198-M548 HydrophobicContact CG1-CB 4.35Å; V198-M548 HydrophobicContact CG2-CB 3.92Å; V198-M548 HydrophobicContact CG2-CG 4.14Å; V198-M548 HydrophobicContact CG2-SD 3.32Å; V198-M548 WeakPolarHBondContact CG2-SD 3.37Å
199	T	93.6	Very high	93.1	Very high	96 Å²	96	21.8 Å²	21.8	59%	0.589	15%	0.146	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115	166.3	179.8	60	0	0	0	0	110.8	F184 R197	F184-T199 HydrophobicContact CB-CG2 4.16Å; R197-T199 HydrophobicContact CG-CG2 4.46Å
200	G	89.4	Confident	93.4	Very high	64 Å²	64	21.8 Å²	21.8	66%	0.66	15%	0.146	S	C	*	.			trans	87.8	19.5	179.6	0	0	0	0	0	113.8	G183	G183-G200 PolarHBondContact O-N 3.48Å; G183-G200 VanDerWaalsContact O-N 3.15Å
201	I	90.9	Very high	93.6	Very high	13 Å²	13	21.8 Å²	21.8	7%	0.067	15%	0.146	C	C	.	.			trans	-81.8	125.4	175.3	-54.6	-60.1	0	0	0	108.3	G183 I185 V198 T221 L236	G183-I201 WeakPolarHBondContact CA-O 3.46Å; G183-I201 PolarHBondContact O-N 3.49Å; I185-I201 HydrophobicContact CD1-CD1 3.87Å; I185-I201 HydrophobicContact CD1-CG1 3.79Å; I185-I201 HydrophobicContact CD1-CG2 4.37Å; I185-I201 HydrophobicContact CG1-CG1 3.99Å; V198-I201 HydrophobicContact CG1-CD1 4.46Å; I201-T221 HydrophobicContact CG2-CG2 3.69Å; I201-L236 HydrophobicContact CD1-CD2 4.15Å
202	A	90.6	Very high	93.8	Very high	52 Å²	52	21.9 Å²	21.9	43%	0.43	15%	0.146	S	C	.	.			trans	-87.5	129.6	-178.8	0	0	0	0	0	111.3	T221 V223	A202-T221 WeakPolarHBondContact O-CB 3.44Å; A202-T221 PolarHBondContact O-OG1 2.91Å; A202-V223 HydrophobicContact CB-CG2 4.2Å
203	G	90.3	Very high	94.1	Very high	29 Å²	29	21.6 Å²	21.6	30%	0.299	15%	0.145	S	C	.	.	S	Bend	trans	80.1	-155.3	174.1	0	0	0	0	0	114.6	E222	G203-E222 WeakPolarHBondContact CA-O 3.21Å
204	T	93.5	Very high	94.3	Very high	46 Å²	46	21 Å²	21	28%	0.282	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127.6	179.9	-56.7	0	0	0	0	110.3	S181 L206 T221 E222	S181-T204 WeakPolarHBondContact CB-OG1 3.31Å; T204-L206 PolarHBondContact O-N 3.13Å; T204-T221 CarbonylContact O-C 3.56Å; T204-T221 VanDerWaalsContact O-CA 3.26Å; T204-T221 WeakPolarHBondContact O-CA 3.39Å; T204-E222 PolarHBondContact N-O 2.91Å; T204-E222 PolarHBondContact O-N 3.46Å
205	C	94.9	Very high	94.3	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.007	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	126.3	174	-63.7	0	0	0	0	110.8	S111 C112 G180	S111-C205 WeakPolarHBondContact CB-O 3.32Å; S111-C205 PolarHBondContact OG-O 2.89Å; C112-C205 WeakPolarHBondContact SG-CB 3.29Å; C112-C205 PolarHBondContact SG-O 3.35Å; C112-C205 VanDerWaalsContact SG-O 3.36Å; G180-C205 PolarHBondContact O-N 3.42Å; G180-C205 VanDerWaalsContact O-N 3.08Å
206	L	93.9	Very high	94.3	Very high	7 Å²	7	20.8 Å²	20.8	4%	0.037	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	-41	174.7	-62.1	-175.1	0	0	0	111.9	C112 T204 V220 E222 V231 L570	C112-L206 WeakPolarHBondContact CB-O 3.28Å; T204-L206 PolarHBondContact O-N 3.13Å; L206-V220 HydrophobicContact CB-CG1 4.36Å; L206-V220 HydrophobicContact CD1-CG1 4.49Å; L206-V220 PolarHBondContact N-O 3Å; L206-E222 HydrophobicContact CD1-CB 3.83Å; L206-E222 HydrophobicContact CD2-CB 4.13Å; L206-E222 HydrophobicContact CG-CB 3.9Å; L206-V231 HydrophobicContact CD1-CG1 4.36Å; L206-V231 HydrophobicContact CD1-CG2 4.34Å; L206-L570 HydrophobicContact CD2-CD2 3.65Å
207	A	95.9	Very high	94.4	Very high	11 Å²	11	20.8 Å²	20.8	9%	0.091	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	145.4	-179	0	0	0	0	0	111	V220 L575	A207-V220 HydrophobicContact CB-CB 4.17Å; A207-V220 HydrophobicContact CB-CG2 4.42Å; A207-V220 PolarHBondContact N-O 3.3Å; A207-V220 PolarHBondContact O-N 3.39Å; A207-L575 HydrophobicContact CB-CB 4.33Å; A207-L575 HydrophobicContact CB-CD1 3.86Å; A207-L575 HydrophobicContact CB-CG 3.98Å
208	L	97.4	Very high	94.5	Very high	10 Å²	10	18.3 Å²	18.3	5%	0.052	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137.9	178.2	-68.4	168.5	0	0	0	109.2	H114 V177 G179 I185 V219	H114-L208 HydrophobicContact CB-CB 4.07Å; H114-L208 VanDerWaalsContact CB-O 3.3Å; H114-L208 WeakPolarHBondContact CB-O 3.41Å; V177-L208 HydrophobicContact CB-CD1 4.43Å; V177-L208 HydrophobicContact CG1-CB 4.5Å; V177-L208 HydrophobicContact CG1-CD1 3.96Å; V177-L208 HydrophobicContact CG1-CD2 4.48Å; G179-L208 VanDerWaalsContact N-CD1 3.33Å; I185-L208 HydrophobicContact CD1-CD2 3.78Å; I185-L208 HydrophobicContact CG1-CD2 4.25Å; I185-L208 HydrophobicContact CG2-CD2 4.44Å; L208-V219 HydrophobicContact CD2-CB 4.25Å; L208-V219 HydrophobicContact CD2-CG1 3.84Å; L208-V219 HydrophobicContact CD2-CG2 3.82Å
209	C	97.6	Very high	94.6	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.007	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	107.8	171.3	-169.6	0	0	0	0	111.3	S218 L575 N577 H584	C209-S218 WeakPolarHBondContact CB-OG 2.99Å; C209-S218 PolarHBondContact N-O 2.95Å; C209-S218 PolarHBondContact O-N 3.4Å; C209-S218 PolarHBondContact O-OG 3.42Å; C209-S218 VanDerWaalsContact O-OG 3.05Å; C209-L575 HydrophobicContact CB-CB 3.62Å; C209-L575 HydrophobicContact CB-CD1 4.05Å; C209-L575 HydrophobicContact CB-CG 4.41Å; C209-N577 WeakPolarHBondContact SG-CB 3.36Å; C209-N577 PolarHBondContact SG-N 3.28Å; C209-N577 VanDerWaalsContact SG-N 3.39Å; C209-H584 PolarHBondContact O-CE1 2.88Å
210	L	97.6	Very high	94.8	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.005	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	132	172.5	-177.8	60.1	0	0	0	109.1	H114 M116 I175 V177 L187 L214 L217 T238	H114-L210 PolarHBondContact ND1-N 3.28Å; M116-L210 HydrophobicContact CG-CB 4.04Å; M116-L210 HydrophobicContact CG-CD2 4.06Å; M116-L210 HydrophobicContact CG-CG 4.27Å; M116-L210 HydrophobicContact SD-CB 3.9Å; M116-L210 HydrophobicContact SD-CD2 3.46Å; M116-L210 WeakPolarHBondContact SD-CD2 3.45Å; M116-L210 HydrophobicContact SD-CG 3.52Å; M116-L210 VanDerWaalsContact SD-CG 3.52Å; I175-L210 HydrophobicContact CB-CD2 4.18Å; I175-L210 HydrophobicContact CD1-CD2 3.88Å; I175-L210 HydrophobicContact CG2-CD2 4.07Å; V177-L210 HydrophobicContact CG2-CB 3.93Å; V177-L210 HydrophobicContact CG2-CD2 4Å; L187-L210 HydrophobicContact CD2-CD2 4.07Å; L210-L214 HydrophobicContact CD1-CD2 4.33Å; L210-L214 HydrophobicContact CD2-CD2 3.87Å; L210-L214 HydrophobicContact CG-CD2 3.96Å; L210-L217 HydrophobicContact CB-CD1 3.96Å; L210-L217 HydrophobicContact CD1-CB 3.99Å; L210-L217 HydrophobicContact CD1-CD1 4.33Å; L210-T238 HydrophobicContact CD1-CG2 4.33Å
211	S	96.1	Very high	95.1	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	7%	0.072	C	C	.	.			trans	-68.4	145.1	-178.1	65.5	0	0	0	0	112.3	D213 L214 K215 S216	S211-D213 WeakPolarHBondContact CB-OD1 3.45Å; S211-D213 PolarHBondContact O-N 2.94Å; S211-D213 PolarHBondContact OG-OD1 3.46Å; S211-L214 PolarHBondContact O-N 3.23Å; S211-L214 PolarHBondContact OG-N 3.41Å; S211-K215 PolarHBondContact OG-N 2.99Å; S211-K215 VanDerWaalsContact OG-N 3.07Å; S211-S216 WeakPolarHBondContact CB-O 3.45Å; S211-S216 PolarHBondContact N-O 2.85Å; S211-S216 VanDerWaalsContact N-O 3.08Å; S211-S216 PolarHBondContact OG-N 3.44Å; S211-S216 PolarHBondContact OG-O 3.27Å; S211-S216 VanDerWaalsContact OG-O 3.11Å
212	S	93.4	Very high	95.2	Very high	2 Å²	2	11.1 Å²	11.1	1%	0.014	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-17.7	179	59.9	0	0	0	0	114.1	V118 T119 N577	V118-S212 WeakPolarHBondContact CA-O 3.48Å; T119-S212 PolarHBondContact N-O 3.18Å; T119-S212 WeakPolarHBondContact OG1-CB 3.38Å; T119-S212 PolarHBondContact OG1-OG 3.41Å; S212-N577 PolarHBondContact N-OD1 3.2Å; S212-N577 PolarHBondContact OG-OD1 3.41Å
213	D	92.9	Very high	95.4	Very high	10 Å²	10	11.2 Å²	11.2	5%	0.053	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-1.6	172.8	67.6	-0.8	0	0	0	113.7	V120 S211 K215 Y242 T605	V120-D213 HydrophobicContact CG2-CB 4.1Å; S211-D213 WeakPolarHBondContact CB-OD1 3.45Å; S211-D213 PolarHBondContact O-N 2.94Å; S211-D213 PolarHBondContact OG-OD1 3.46Å; D213-K215 HydrophobicContact CB-CG 4.42Å; D213-K215 PolarHBondContact O-N 3.21Å; D213-K215 PolarHBondContact OD1-N 3.37Å; D213-K215 VanDerWaalsContact OD1-N 3.07Å; D213-K215 WeakPolarHBondContact OD2-CD 3.48Å; D213-Y242 VanDerWaalsContact O-CD2 3.31Å; D213-Y242 WeakPolarHBondContact O-CD2 3.43Å; D213-T605 WeakPolarHBondContact OD2-CB 3.36Å; D213-T605 PolarHBondContact OD2-OG1 3.43Å
214	L	94.6	Very high	95.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.083	C	C	.	.	S	Bend	trans	54.8	24.8	-176	-54.3	-175.2	0	0	0	115.3	M116 V118 L173 I175 L210 S211 T238 L241 Y242 L245	M116-L214 HydrophobicContact CE-CD2 4.11Å; M116-L214 HydrophobicContact SD-CD2 3.75Å; V118-L214 HydrophobicContact CG2-CD1 3.76Å; V118-L214 HydrophobicContact CG2-CD2 4.03Å; V118-L214 HydrophobicContact CG2-CG 3.86Å; L173-L214 HydrophobicContact CD2-CD1 4.32Å; I175-L214 HydrophobicContact CD1-CD1 4.46Å; I175-L214 HydrophobicContact CD1-CD2 3.96Å; L210-L214 HydrophobicContact CD1-CD2 4.33Å; L210-L214 HydrophobicContact CD2-CD2 3.87Å; L210-L214 HydrophobicContact CG-CD2 3.96Å; S211-L214 PolarHBondContact O-N 3.23Å; S211-L214 PolarHBondContact OG-N 3.41Å; L214-T238 WeakPolarHBondContact O-CB 3.38Å; L214-T238 PolarHBondContact O-OG1 3.19Å; L214-L241 HydrophobicContact CB-CB 4.21Å; L214-L241 HydrophobicContact CD1-CB 4.18Å; L214-Y242 WeakPolarHBondContact O-CB 3.27Å; L214-L245 HydrophobicContact CD1-CD1 3.65Å
215	K	94.3	Very high	95	Very high	37 Å²	37	15.3 Å²	15.3	16%	0.161	10%	0.096	C	C	.	.	S	Bend	trans	-79.1	-35.2	175.2	-71.1	-169	175.5	-169.7	0	114.1	S211 D213 T238 Y242 T605 D606	S211-K215 PolarHBondContact OG-N 2.99Å; S211-K215 VanDerWaalsContact OG-N 3.07Å; D213-K215 HydrophobicContact CB-CG 4.42Å; D213-K215 PolarHBondContact O-N 3.21Å; D213-K215 PolarHBondContact OD1-N 3.37Å; D213-K215 VanDerWaalsContact OD1-N 3.07Å; D213-K215 WeakPolarHBondContact OD2-CD 3.48Å; K215-T238 PolarHBondContact O-N 3.02Å; K215-T238 VanDerWaalsContact O-N 3.1Å; K215-T238 PolarHBondContact O-OG1 3.35Å; K215-Y242 HydrophobicContact CG-CD1 4.46Å; K215-Y242 HydrophobicContact CG-CD2 3.88Å; K215-Y242 HydrophobicContact CG-CE2 4.17Å; K215-Y242 HydrophobicContact CG-CG 4.03Å; K215-T605 WeakPolarHBondContact CB-O 3.43Å; K215-D606 HydrophobicContact CD-CB 3.76Å; K215-D606 IonicContact NZ-OD2 3.06Å; K215-D606 PolarHBondContact NZ-OD2 3.26Å
216	S	96.2	Very high	94.1	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	153.4	176.3	57.9	0	0	0	0	114.3	S211 Q235 L236 T238 H584 T605	S211-S216 WeakPolarHBondContact CB-O 3.45Å; S211-S216 PolarHBondContact N-O 2.85Å; S211-S216 VanDerWaalsContact N-O 3.08Å; S211-S216 PolarHBondContact OG-N 3.44Å; S211-S216 PolarHBondContact OG-O 3.27Å; S211-S216 VanDerWaalsContact OG-O 3.11Å; S216-Q235 PolarHBondContact OG-NE2 2.96Å; S216-L236 CarbonylContact C-O 3.52Å; S216-L236 WeakPolarHBondContact CA-O 3.29Å; S216-L236 WeakPolarHBondContact CB-O 3.35Å; S216-T238 WeakPolarHBondContact CA-OG1 3.47Å; S216-T238 PolarHBondContact N-OG1 2.92Å; S216-H584 PolarHBondContact O-NE2 3.39Å; S216-H584 PolarHBondContact OG-CD2 3.2Å; S216-H584 PolarHBondContact OG-NE2 3.43Å; S216-T605 VanDerWaalsContact CB-O 3.24Å; S216-T605 WeakPolarHBondContact CB-O 3.16Å; S216-T605 PolarHBondContact OG-O 2.82Å
217	L	97.9	Very high	93.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	120.6	171	171.9	63.4	0	0	0	109	V177 I185 L210 V219 Q235 L236 T238	V177-L217 HydrophobicContact CG1-CD1 4.29Å; I185-L217 HydrophobicContact CD1-CD2 4.49Å; I185-L217 HydrophobicContact CG2-CD2 4.26Å; L210-L217 HydrophobicContact CB-CD1 3.96Å; L210-L217 HydrophobicContact CD1-CB 3.99Å; L210-L217 HydrophobicContact CD1-CD1 4.33Å; L217-V219 HydrophobicContact CD1-CG2 4.44Å; L217-V219 HydrophobicContact CD2-CG2 4.15Å; L217-V219 HydrophobicContact CG-CG2 3.86Å; L217-Q235 WeakPolarHBondContact O-CA 3.4Å; L217-L236 HydrophobicContact CB-CB 4.35Å; L217-L236 PolarHBondContact N-O 3.44Å; L217-L236 PolarHBondContact O-N 3.3Å; L217-T238 HydrophobicContact CB-CG2 4.14Å
218	S	97.6	Very high	93.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	139.2	170.6	62	0	0	0	0	111.2	C209 F234 H584	C209-S218 WeakPolarHBondContact CB-OG 2.99Å; C209-S218 PolarHBondContact N-O 2.95Å; C209-S218 PolarHBondContact O-N 3.4Å; C209-S218 PolarHBondContact O-OG 3.42Å; C209-S218 VanDerWaalsContact O-OG 3.05Å; S218-F234 CarbonylContact C-O 3.58Å; S218-F234 WeakPolarHBondContact CA-O 3.36Å; S218-H584 PolarHBondContact OG-ND1 2.86Å
219	V	97.6	Very high	92.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	135.8	-173.8	-175.8	0	0	0	0	108.7	I185 L208 L217 T221 Y233 F234 L236	I185-V219 HydrophobicContact CD1-CB 4.41Å; I185-V219 HydrophobicContact CD1-CG1 3.88Å; I185-V219 HydrophobicContact CD1-CG2 3.62Å; L208-V219 HydrophobicContact CD2-CB 4.25Å; L208-V219 HydrophobicContact CD2-CG1 3.84Å; L208-V219 HydrophobicContact CD2-CG2 3.82Å; L217-V219 HydrophobicContact CD1-CG2 4.44Å; L217-V219 HydrophobicContact CD2-CG2 4.15Å; L217-V219 HydrophobicContact CG-CG2 3.86Å; V219-T221 HydrophobicContact CG1-CG2 3.67Å; V219-Y233 CarbonylContact O-C 3.46Å; V219-Y233 WeakPolarHBondContact O-CA 3.43Å; V219-F234 HydrophobicContact CB-CB 4.3Å; V219-F234 PolarHBondContact N-O 3.35Å; V219-F234 PolarHBondContact O-N 3.46Å; V219-L236 HydrophobicContact CB-CD1 4.31Å; V219-L236 HydrophobicContact CG2-CD1 3.53Å
220	V	97.4	Very high	92.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.6	167.1	177.7	0	0	0	0	108.3	L206 A207 V231 S232 Y233 P573 L575 L586	L206-V220 HydrophobicContact CB-CG1 4.36Å; L206-V220 HydrophobicContact CD1-CG1 4.49Å; L206-V220 PolarHBondContact N-O 3Å; A207-V220 HydrophobicContact CB-CB 4.17Å; A207-V220 HydrophobicContact CB-CG2 4.42Å; A207-V220 PolarHBondContact N-O 3.3Å; A207-V220 PolarHBondContact O-N 3.39Å; V220-V231 HydrophobicContact CG1-CG1 3.42Å; V220-V231 VanDerWaalsContact CG1-CG1 3.42Å; V220-S232 WeakPolarHBondContact CA-O 3.35Å; V220-Y233 HydrophobicContact CG2-CD2 4.32Å; V220-P573 HydrophobicContact CG1-CB 4.48Å; V220-P573 HydrophobicContact CG1-CG 4.42Å; V220-L575 HydrophobicContact CG2-CD1 4.02Å; V220-L575 HydrophobicContact CG2-CD2 4.22Å; V220-L575 HydrophobicContact CG2-CG 4.03Å; V220-L586 HydrophobicContact CG2-CD1 3.7Å; V220-L586 HydrophobicContact CG2-CD2 4.45Å
221	T	95.8	Very high	92.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	157.5	177	78.7	0	0	0	0	112	I201 A202 T204 V219 V231 S232 F234	I201-T221 HydrophobicContact CG2-CG2 3.69Å; A202-T221 WeakPolarHBondContact O-CB 3.44Å; A202-T221 PolarHBondContact O-OG1 2.91Å; T204-T221 CarbonylContact O-C 3.56Å; T204-T221 VanDerWaalsContact O-CA 3.26Å; T204-T221 WeakPolarHBondContact O-CA 3.39Å; V219-T221 HydrophobicContact CG1-CG2 3.67Å; T221-V231 VanDerWaalsContact O-CA 3.3Å; T221-V231 WeakPolarHBondContact O-CA 3.42Å; T221-S232 PolarHBondContact N-O 3.07Å; T221-S232 PolarHBondContact O-N 3.36Å; T221-F234 HydrophobicContact CG2-CD2 4.1Å; T221-F234 HydrophobicContact CG2-CE2 4.09Å; T221-F234 WeakPolarHBondContact OG1-CE2 3.45Å
222	E	94.4	Very high	92.6	Very high	26 Å²	26	27.5 Å²	27.5	12%	0.121	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.7	177.2	-175.2	175.1	-122.2	0	0	109.8	G203 T204 L206 A229 E230 V231 S562 R568	G203-E222 WeakPolarHBondContact CA-O 3.21Å; T204-E222 PolarHBondContact N-O 2.91Å; T204-E222 PolarHBondContact O-N 3.46Å; L206-E222 HydrophobicContact CD1-CB 3.83Å; L206-E222 HydrophobicContact CD2-CB 4.13Å; L206-E222 HydrophobicContact CG-CB 3.9Å; E222-A229 HydrophobicContact CG-CB 3.76Å; E222-E230 WeakPolarHBondContact CA-O 3.47Å; E222-V231 HydrophobicContact CB-CG2 4.43Å; E222-V231 HydrophobicContact CG-CG2 4.25Å; E222-S562 VanDerWaalsContact OE1-CB 3.23Å; E222-S562 WeakPolarHBondContact OE1-CB 3.28Å; E222-R568 IonicContact OE1-NH1 2.78Å; E222-R568 PolarHBondContact OE1-NH1 3.5Å; E222-R568 IonicContact OE2-NH1 2.94Å
223	V	94.1	Very high	92.8	Very high	55 Å²	55	27.5 Å²	27.5	33%	0.333	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	113.9	176.1	-178.7	0	0	0	0	108.5	A202 E230	A202-V223 HydrophobicContact CB-CG2 4.2Å; V223-E230 PolarHBondContact N-O 2.82Å; V223-E230 PolarHBondContact O-N 2.93Å
224	S	89.7	Confident	92.9	Very high	84 Å²	84	27.8 Å²	27.8	59%	0.587	19%	0.189	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84	125.3	177.5	-48.6	0	0	0	0	110.8	E228	S224-E228 WeakPolarHBondContact CA-O 3.06Å
225	S	85.3	Confident	93	Very high	77 Å²	77	27.9 Å²	27.9	54%	0.538	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	122.1	178.2	176.6	0	0	0	0	110.8	G227 E228	S225-G227 VanDerWaalsContact C-N 3.29Å; S225-G227 PolarHBondContact O-N 3.34Å; S225-E228 PolarHBondContact N-O 3.15Å; S225-E228 PolarHBondContact O-N 2.84Å; S225-E228 VanDerWaalsContact O-N 3.16Å; S225-E228 VanDerWaalsContact O-O 3.1Å
226	G	75.8	Confident	93.1	Very high	91 Å²	91	26.2 Å²	26.2	94%	0.938	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	25	166.5	0	0	0	0	0	116.3
227	G	81.5	Confident	93.1	Very high	46 Å²	46	28.4 Å²	28.4	47%	0.474	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.6	-7.3	-178.9	0	0	0	0	0	114.6	S225	S225-G227 VanDerWaalsContact C-N 3.29Å; S225-G227 PolarHBondContact O-N 3.34Å
228	E	87.7	Confident	93	Very high	92 Å²	92	28.4 Å²	28.4	43%	0.43	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	160.6	172.9	-64.3	177.2	168.5	0	0	110	S224 S225 R558	S224-E228 WeakPolarHBondContact CA-O 3.06Å; S225-E228 PolarHBondContact N-O 3.15Å; S225-E228 PolarHBondContact O-N 2.84Å; S225-E228 VanDerWaalsContact O-N 3.16Å; S225-E228 VanDerWaalsContact O-O 3.1Å; E228-R558 HydrophobicContact CB-CG 3.87Å; E228-R558 WeakPolarHBondContact OE2-CD 3.34Å; E228-R558 WeakPolarHBondContact OE2-CG 3.4Å
229	A	91	Very high	92.7	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.008	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130	171.5	0	0	0	0	0	110.4	E222 R558 D559 S562	E222-A229 HydrophobicContact CG-CB 3.76Å; A229-R558 WeakPolarHBondContact O-CA 3.25Å; A229-D559 PolarHBondContact N-O 2.85Å; A229-D559 PolarHBondContact O-N 3.29Å; A229-S562 WeakPolarHBondContact CB-OG 3.26Å
230	E	94.8	Very high	92.5	Very high	43 Å²	43	32.9 Å²	32.9	20%	0.201	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	127.7	173.1	-178.5	170.3	-163.9	0	0	109.9	E222 V223 Y557 R558	E222-E230 WeakPolarHBondContact CA-O 3.47Å; V223-E230 PolarHBondContact N-O 2.82Å; V223-E230 PolarHBondContact O-N 2.93Å; E230-Y557 WeakPolarHBondContact CA-O 3.34Å; E230-R558 HydrophobicContact CB-CB 4.16Å; E230-R558 HydrophobicContact CB-CG 4.13Å; E230-R558 HydrophobicContact CG-CB 4.4Å; E230-R558 IonicContact OE1-NH2 2.78Å; E230-R558 IonicContact OE2-CZ 3.16Å; E230-R558 IonicContact OE2-NE 3.67Å; E230-R558 PolarHBondContact OE2-NE 3.13Å; E230-R558 IonicContact OE2-NH2 2.94Å; E230-R558 PolarHBondContact OE2-NH2 3.05Å
231	V	95.7	Very high	92.3	Very high	1 Å²	1	33 Å²	33	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.6	175.9	-176.8	0	0	0	0	109.4	L206 V220 T221 E222 L556 Y557 P573	L206-V231 HydrophobicContact CD1-CG1 4.36Å; L206-V231 HydrophobicContact CD1-CG2 4.34Å; V220-V231 HydrophobicContact CG1-CG1 3.42Å; V220-V231 VanDerWaalsContact CG1-CG1 3.42Å; T221-V231 VanDerWaalsContact O-CA 3.3Å; T221-V231 WeakPolarHBondContact O-CA 3.42Å; E222-V231 HydrophobicContact CB-CG2 4.43Å; E222-V231 HydrophobicContact CG-CG2 4.25Å; V231-L556 HydrophobicContact CG1-CD1 4.06Å; V231-L556 WeakPolarHBondContact O-CB 3.27Å; V231-L556 PolarHBondContact O-N 3.42Å; V231-Y557 HydrophobicContact CB-CE1 4.09Å; V231-Y557 HydrophobicContact CB-CE2 4.07Å; V231-Y557 HydrophobicContact CG1-CE1 4.41Å; V231-Y557 HydrophobicContact CG2-CD2 4.42Å; V231-Y557 HydrophobicContact CG2-CE1 4.41Å; V231-Y557 HydrophobicContact CG2-CE2 3.66Å; V231-Y557 PolarHBondContact N-O 3.47Å; V231-Y557 PolarHBondContact O-N 2.73Å; V231-P573 HydrophobicContact CG1-CG 4.3Å
232	S	96.3	Very high	92.2	Very high	12 Å²	12	37.9 Å²	37.9	8%	0.084	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	145.3	-178.3	-66.5	0	0	0	0	111.7	V220 T221	V220-S232 WeakPolarHBondContact CA-O 3.35Å; T221-S232 PolarHBondContact N-O 3.07Å; T221-S232 PolarHBondContact O-N 3.36Å
233	Y	97.6	Very high	92.1	Very high	3 Å²	3	40.2 Å²	40.2	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	133.8	172	169.8	-90.1	0	0	0	110.3	V219 V220 Q235 C553 I554 L575 L586 L601	V219-Y233 CarbonylContact O-C 3.46Å; V219-Y233 WeakPolarHBondContact O-CA 3.43Å; V220-Y233 HydrophobicContact CG2-CD2 4.32Å; Y233-Q235 HydrophobicContact CE1-CB 3.96Å; Y233-C553 CarbonylContact O-C 3.5Å; Y233-C553 WeakPolarHBondContact O-CA 3.34Å; Y233-I554 HydrophobicContact CD1-CB 4.26Å; Y233-I554 HydrophobicContact CD1-CD1 3.85Å; Y233-I554 HydrophobicContact CD1-CG1 4.1Å; Y233-I554 HydrophobicContact CE1-CD1 4.26Å; Y233-I554 PolarHBondContact N-O 3.11Å; Y233-I554 PolarHBondContact O-N 2.82Å; Y233-L575 HydrophobicContact CD2-CD2 4.31Å; Y233-L575 HydrophobicContact CE2-CD2 4.01Å; Y233-L586 HydrophobicContact CD2-CD2 3.9Å; Y233-L586 HydrophobicContact CG-CD2 4.32Å; Y233-L601 HydrophobicContact CD1-CD2 4.2Å; Y233-L601 HydrophobicContact CD2-CD2 4.44Å; Y233-L601 HydrophobicContact CE1-CD2 4.45Å; Y233-L601 HydrophobicContact CG-CD2 4.19Å
234	F	96.4	Very high	92	Very high	16 Å²	16	40 Å²	40	7%	0.07	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	144.3	174.1	-59.4	-86.2	0	0	0	110.3	S218 V219 T221 L236 Q550 I552 C553	S218-F234 CarbonylContact C-O 3.58Å; S218-F234 WeakPolarHBondContact CA-O 3.36Å; V219-F234 HydrophobicContact CB-CB 4.3Å; V219-F234 PolarHBondContact N-O 3.35Å; V219-F234 PolarHBondContact O-N 3.46Å; T221-F234 HydrophobicContact CG2-CD2 4.1Å; T221-F234 HydrophobicContact CG2-CE2 4.09Å; T221-F234 WeakPolarHBondContact OG1-CE2 3.45Å; F234-L236 HydrophobicContact CB-CD1 4.13Å; F234-Q550 HydrophobicContact CD1-CG 3.92Å; F234-I552 WeakPolarHBondContact CA-O 3.35Å; F234-C553 HydrophobicContact CD1-CB 3.88Å; F234-C553 HydrophobicContact CE1-CB 3.77Å; F234-C553 WeakPolarHBondContact CE1-SG 3.31Å
235	Q	96.6	Very high	92.2	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.2	167.5	-166.6	176.8	-1	0	0	108.1	S216 L217 Y233 A551 I552 H604 I607	S216-Q235 PolarHBondContact OG-NE2 2.96Å; L217-Q235 WeakPolarHBondContact O-CA 3.4Å; Y233-Q235 HydrophobicContact CE1-CB 3.96Å; Q235-A551 PolarHBondContact O-N 3.02Å; Q235-A551 VanDerWaalsContact O-N 3.09Å; Q235-I552 HydrophobicContact CB-CB 4.04Å; Q235-I552 HydrophobicContact CB-CD1 3.86Å; Q235-I552 HydrophobicContact CG-CD1 4.27Å; Q235-I552 PolarHBondContact N-O 2.98Å; Q235-I552 VanDerWaalsContact N-O 3.12Å; Q235-I552 PolarHBondContact O-N 2.8Å; Q235-I552 VanDerWaalsContact O-N 3.16Å; Q235-H604 PolarHBondContact NE2-O 3.31Å; Q235-I607 HydrophobicContact CG-CG1 4.39Å
236	L	96.3	Very high	92.5	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	141.2	179	-62.9	87.4	0	0	0	109.3	V198 I201 S216 L217 V219 F234	V198-L236 HydrophobicContact CG1-CD2 3.65Å; I201-L236 HydrophobicContact CD1-CD2 4.15Å; S216-L236 CarbonylContact C-O 3.52Å; S216-L236 WeakPolarHBondContact CA-O 3.29Å; S216-L236 WeakPolarHBondContact CB-O 3.35Å; L217-L236 HydrophobicContact CB-CB 4.35Å; L217-L236 PolarHBondContact N-O 3.44Å; L217-L236 PolarHBondContact O-N 3.3Å; V219-L236 HydrophobicContact CB-CD1 4.31Å; V219-L236 HydrophobicContact CG2-CD1 3.53Å; F234-L236 HydrophobicContact CB-CD1 4.13Å
237	E	95.6	Very high	93.3	Very high	45 Å²	45	30.9 Å²	30.9	21%	0.21	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	132.9	179.1	-169	164.6	-160.5	0	0	110.6	N239 M548 N549 I607	E237-N239 HydrophobicContact CG-CB 4.38Å; E237-N239 WeakPolarHBondContact CG-ND2 3.39Å; E237-N239 VanDerWaalsContact CG-OD1 3.23Å; E237-N239 WeakPolarHBondContact CG-OD1 3.2Å; E237-N239 VanDerWaalsContact OE1-CG 3.27Å; E237-N239 PolarHBondContact OE1-ND2 2.98Å; E237-N239 PolarHBondContact OE1-OD1 2.72Å; E237-N239 VanDerWaalsContact OE1-OD1 3.08Å; E237-M548 WeakPolarHBondContact O-CA 3.42Å; E237-N549 PolarHBondContact N-O 3.35Å; E237-N549 VanDerWaalsContact N-O 3.13Å; E237-I607 HydrophobicContact CB-CD1 3.38Å; E237-I607 HydrophobicContact CG-CD1 3.63Å
238	T	95.3	Very high	93.8	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	15%	0.145	C	C	.	.			trans	-118	40.9	-177.5	50.9	0	0	0	0	112.1	L210 L214 K215 S216 L217 L240 L241 Y242 M548	L210-T238 HydrophobicContact CD1-CG2 4.33Å; L214-T238 WeakPolarHBondContact O-CB 3.38Å; L214-T238 PolarHBondContact O-OG1 3.19Å; K215-T238 PolarHBondContact O-N 3.02Å; K215-T238 VanDerWaalsContact O-N 3.1Å; K215-T238 PolarHBondContact O-OG1 3.35Å; S216-T238 WeakPolarHBondContact CA-OG1 3.47Å; S216-T238 PolarHBondContact N-OG1 2.92Å; L217-T238 HydrophobicContact CB-CG2 4.14Å; T238-L240 VanDerWaalsContact C-N 3.27Å; T238-L240 PolarHBondContact O-N 2.93Å; T238-L240 VanDerWaalsContact O-N 3.15Å; T238-L241 HydrophobicContact CG2-CD1 4.39Å; T238-L241 WeakPolarHBondContact O-CB 3.27Å; T238-L241 PolarHBondContact O-N 3.45Å; T238-Y242 PolarHBondContact O-N 3.37Å; T238-M548 HydrophobicContact CG2-CE 3.87Å; T238-M548 HydrophobicContact CG2-CG 4.17Å; T238-M548 HydrophobicContact CG2-SD 3.76Å
239	N	91.2	Very high	94	Very high	72 Å²	72	24.3 Å²	24.3	39%	0.385	13%	0.125	S	C	.	.	H	α-helix	trans	-51.8	-40	-174.5	-75.6	-16.4	0	0	0	115	E237 Y242 S243	E237-N239 HydrophobicContact CG-CB 4.38Å; E237-N239 WeakPolarHBondContact CG-ND2 3.39Å; E237-N239 VanDerWaalsContact CG-OD1 3.23Å; E237-N239 WeakPolarHBondContact CG-OD1 3.2Å; E237-N239 VanDerWaalsContact OE1-CG 3.27Å; E237-N239 PolarHBondContact OE1-ND2 2.98Å; E237-N239 PolarHBondContact OE1-OD1 2.72Å; E237-N239 VanDerWaalsContact OE1-OD1 3.08Å; N239-Y242 PolarHBondContact O-N 3.04Å; N239-S243 VanDerWaalsContact O-CB 3.26Å; N239-S243 WeakPolarHBondContact O-CB 3.26Å; N239-S243 PolarHBondContact O-N 3.39Å; N239-S243 PolarHBondContact O-OG 2.91Å
240	L	94	Very high	94	Very high	22 Å²	22	28.5 Å²	28.5	12%	0.115	14%	0.14	C	C	.	.	H	α-helix	trans	-68.2	-38.3	-179	-168.3	67.9	0	0	0	111.2	T238 F244 P378 L379 I544	T238-L240 VanDerWaalsContact C-N 3.27Å; T238-L240 PolarHBondContact O-N 2.93Å; T238-L240 VanDerWaalsContact O-N 3.15Å; L240-F244 HydrophobicContact CD1-CD2 3.58Å; L240-F244 HydrophobicContact CD1-CE2 3.72Å; L240-F244 HydrophobicContact CG-CD2 4.41Å; L240-F244 WeakPolarHBondContact O-CB 3.36Å; L240-F244 PolarHBondContact O-N 3.17Å; L240-P378 HydrophobicContact CD1-CB 3.98Å; L240-L379 HydrophobicContact CD1-CD2 4.1Å; L240-L379 HydrophobicContact CD2-CD2 3.99Å; L240-L379 HydrophobicContact CG-CD2 3.77Å; L240-I544 HydrophobicContact CD2-CB 4.31Å; L240-I544 HydrophobicContact CD2-CG1 3.83Å; L240-I544 HydrophobicContact CD2-CG2 4.44Å
241	L	94	Very high	93.9	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-67.7	-41.8	174.9	-66.7	-176.7	0	0	0	111.9	L187 I195 L214 T238 L245 V248 I544 M548	L187-L241 HydrophobicContact CD2-CD1 3.98Å; I195-L241 HydrophobicContact CD1-CD2 4.35Å; L214-L241 HydrophobicContact CB-CB 4.21Å; L214-L241 HydrophobicContact CD1-CB 4.18Å; T238-L241 HydrophobicContact CG2-CD1 4.39Å; T238-L241 WeakPolarHBondContact O-CB 3.27Å; T238-L241 PolarHBondContact O-N 3.45Å; L241-L245 VanDerWaalsContact O-CA 3.3Å; L241-L245 WeakPolarHBondContact O-CA 2.99Å; L241-L245 WeakPolarHBondContact O-CB 3.42Å; L241-L245 PolarHBondContact O-N 3.18Å; L241-V248 HydrophobicContact CD2-CG1 3.95Å; L241-V248 HydrophobicContact CD2-CG2 4.21Å; L241-I544 HydrophobicContact CD2-CG2 3.93Å; L241-I544 HydrophobicContact CG-CG2 4.3Å; L241-M548 HydrophobicContact CD1-CE 3.39Å; L241-M548 HydrophobicContact CG-CE 3.87Å
242	Y	92.8	Very high	93.7	Very high	104 Å²	104	26.4 Å²	26.4	41%	0.408	13%	0.131	S	C	.	.	H	α-helix	trans	-65.7	-51.9	177.7	172	-114.9	0	0	0	112.2	D213 L214 K215 T238 N239 F244	D213-Y242 VanDerWaalsContact O-CD2 3.31Å; D213-Y242 WeakPolarHBondContact O-CD2 3.43Å; L214-Y242 WeakPolarHBondContact O-CB 3.27Å; K215-Y242 HydrophobicContact CG-CD1 4.46Å; K215-Y242 HydrophobicContact CG-CD2 3.88Å; K215-Y242 HydrophobicContact CG-CE2 4.17Å; K215-Y242 HydrophobicContact CG-CG 4.03Å; T238-Y242 PolarHBondContact O-N 3.37Å; N239-Y242 PolarHBondContact O-N 3.04Å; Y242-F244 PolarHBondContact O-N 2.99Å
243	S	92.3	Very high	93.4	Very high	75 Å²	75	26.2 Å²	26.2	52%	0.524	13%	0.128	S	C	.	.	H	α-helix	trans	-70.8	-31.7	-171.6	-52.9	0	0	0	0	112.8	N239	N239-S243 VanDerWaalsContact O-CB 3.26Å; N239-S243 WeakPolarHBondContact O-CB 3.26Å; N239-S243 PolarHBondContact O-N 3.39Å; N239-S243 PolarHBondContact O-OG 2.91Å
244	F	93.3	Very high	93	Very high	50 Å²	50	26.1 Å²	26.1	22%	0.219	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	31	-178.2	-62.6	-90.1	0	0	0	112	L240 Y242 E247 V248 P378 L379	L240-F244 HydrophobicContact CD1-CD2 3.58Å; L240-F244 HydrophobicContact CD1-CE2 3.72Å; L240-F244 HydrophobicContact CG-CD2 4.41Å; L240-F244 WeakPolarHBondContact O-CB 3.36Å; L240-F244 PolarHBondContact O-N 3.17Å; Y242-F244 PolarHBondContact O-N 2.99Å; F244-E247 WeakPolarHBondContact CA-OE2 3.17Å; F244-E247 HydrophobicContact CB-CB 4.24Å; F244-E247 HydrophobicContact CD1-CG 4.4Å; F244-E247 PolarHBondContact O-N 2.75Å; F244-E247 VanDerWaalsContact O-N 3.13Å; F244-V248 HydrophobicContact CB-CG2 4.42Å; F244-V248 WeakPolarHBondContact O-CB 3.35Å; F244-V248 WeakPolarHBondContact O-CG2 3.32Å; F244-V248 PolarHBondContact O-N 2.82Å; F244-P378 HydrophobicContact CZ-CG 4.34Å; F244-L379 HydrophobicContact CB-CD1 4.45Å; F244-L379 HydrophobicContact CB-CD2 4.18Å
245	L	92.4	Very high	92.8	Very high	8 Å²	8	25.4 Å²	25.4	4%	0.042	12%	0.124	C	C	.	.	H	α-helix	trans	-52.2	-47.1	-177.7	166.4	65.9	0	0	0	113.2	V118 V120 L125 L173 L214 L241 E247 V248 T249	V118-L245 HydrophobicContact CG1-CD1 4.06Å; V118-L245 HydrophobicContact CG1-CD2 3.79Å; V118-L245 HydrophobicContact CG2-CD1 4.16Å; V120-L245 HydrophobicContact CB-CD2 3.94Å; V120-L245 HydrophobicContact CG1-CD2 4.16Å; L125-L245 HydrophobicContact CD1-CD2 3.96Å; L125-L245 HydrophobicContact CD1-CG 4.23Å; L173-L245 HydrophobicContact CD2-CD1 3.96Å; L214-L245 HydrophobicContact CD1-CD1 3.65Å; L241-L245 VanDerWaalsContact O-CA 3.3Å; L241-L245 WeakPolarHBondContact O-CA 2.99Å; L241-L245 WeakPolarHBondContact O-CB 3.42Å; L241-L245 PolarHBondContact O-N 3.18Å; L245-E247 PolarHBondContact O-N 2.82Å; L245-V248 PolarHBondContact O-N 3.4Å; L245-T249 VanDerWaalsContact O-CB 3.3Å; L245-T249 WeakPolarHBondContact O-CB 3.4Å; L245-T249 PolarHBondContact O-N 2.92Å; L245-T249 PolarHBondContact O-OG1 3.49Å
246	P	91.3	Very high	92.4	Very high	32 Å²	32	25.4 Å²	25.4	21%	0.208	12%	0.124	C	C	.	.	H	α-helix	trans	-61.7	-42.4	177.1	-22.3	33.7	0	0	0	113.2	V124 L125 T249 R250	V124-P246 HydrophobicContact CG1-CB 4.09Å; V124-P246 HydrophobicContact CG1-CG 4.49Å; L125-P246 HydrophobicContact CD2-CB 4.1Å; L125-P246 HydrophobicContact CD2-CG 4.38Å; L125-P246 HydrophobicContact CG-CB 4.44Å; L125-P246 HydrophobicContact CG-CG 4.3Å; P246-T249 PolarHBondContact O-N 3.49Å; P246-R250 WeakPolarHBondContact O-CB 3.21Å; P246-R250 PolarHBondContact O-N 2.65Å
247	E	92.4	Very high	91.9	Very high	20 Å²	20	26.1 Å²	26.1	9%	0.093	13%	0.128	C	C	.	.	H	α-helix	trans	-65.6	-45.8	179.5	-66.6	75.9	-172.4	0	0	111.3	F244 L245 R250 M251 K375 Y376 L379	F244-E247 WeakPolarHBondContact CA-OE2 3.17Å; F244-E247 HydrophobicContact CB-CB 4.24Å; F244-E247 HydrophobicContact CD1-CG 4.4Å; F244-E247 PolarHBondContact O-N 2.75Å; F244-E247 VanDerWaalsContact O-N 3.13Å; L245-E247 PolarHBondContact O-N 2.82Å; E247-R250 PolarHBondContact O-N 3.29Å; E247-M251 WeakPolarHBondContact O-CB 3.39Å; E247-M251 PolarHBondContact O-N 2.97Å; E247-K375 HydrophobicContact CG-CB 4.19Å; E247-K375 HydrophobicContact CG-CD 4.28Å; E247-K375 WeakPolarHBondContact OE1-CD 3.37Å; E247-K375 WeakPolarHBondContact OE1-CE 3.2Å; E247-K375 IonicContact OE1-NZ 2.72Å; E247-K375 PolarHBondContact OE1-NZ 3.16Å; E247-Y376 HydrophobicContact CB-CD1 4.46Å; E247-Y376 HydrophobicContact CB-CE1 3.78Å; E247-Y376 HydrophobicContact CG-CE1 4.29Å; E247-Y376 HydrophobicContact CG-CE2 4.17Å; E247-L379 HydrophobicContact CB-CD1 3.79Å
248	V	93.6	Very high	91.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.7	-43.4	176.3	171.7	0	0	0	0	110.8	L173 L241 F244 L245 M251 A252 L379	L173-V248 HydrophobicContact CD2-CG1 4.35Å; L241-V248 HydrophobicContact CD2-CG1 3.95Å; L241-V248 HydrophobicContact CD2-CG2 4.21Å; F244-V248 HydrophobicContact CB-CG2 4.42Å; F244-V248 WeakPolarHBondContact O-CB 3.35Å; F244-V248 WeakPolarHBondContact O-CG2 3.32Å; F244-V248 PolarHBondContact O-N 2.82Å; L245-V248 PolarHBondContact O-N 3.4Å; V248-M251 PolarHBondContact O-N 3.4Å; V248-A252 WeakPolarHBondContact O-CB 3.27Å; V248-A252 PolarHBondContact O-N 3.08Å; V248-L379 HydrophobicContact CG2-CD1 4.08Å; V248-L379 HydrophobicContact CG2-CD2 3.71Å
249	T	91.5	Very high	91.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.1	-50.4	178.2	-59.4	0	0	0	0	110.8	L125 F128 Y129 L173 L245 P246 A252 R253	L125-T249 HydrophobicContact CD2-CG2 4.25Å; F128-T249 HydrophobicContact CD1-CG2 4.45Å; F128-T249 HydrophobicContact CE1-CG2 4.14Å; Y129-T249 HydrophobicContact CE1-CG2 4.35Å; L173-T249 HydrophobicContact CB-CG2 4Å; L245-T249 VanDerWaalsContact O-CB 3.3Å; L245-T249 WeakPolarHBondContact O-CB 3.4Å; L245-T249 PolarHBondContact O-N 2.92Å; L245-T249 PolarHBondContact O-OG1 3.49Å; P246-T249 PolarHBondContact O-N 3.49Å; T249-A252 PolarHBondContact O-N 3.05Å; T249-R253 WeakPolarHBondContact O-CB 3.42Å; T249-R253 PolarHBondContact O-N 3.26Å
250	R	90.6	Very high	91	Very high	90 Å²	90	22.8 Å²	22.8	34%	0.34	12%	0.116	S	C	.	.	H	α-helix	trans	-64.6	-44	179.7	-177.1	167.1	-166.3	-169.9	0.6	112.2	F128 P246 E247 R253 K254 M369	F128-R250 HydrophobicContact CD2-CB 4.26Å; F128-R250 HydrophobicContact CD2-CG 3.98Å; F128-R250 HydrophobicContact CE1-CB 4.22Å; F128-R250 HydrophobicContact CE2-CB 3.86Å; F128-R250 HydrophobicContact CE2-CG 3.41Å; F128-R250 VanDerWaalsContact CE2-CG 3.41Å; F128-R250 HydrophobicContact CZ-CB 3.84Å; F128-R250 HydrophobicContact CZ-CG 3.78Å; P246-R250 WeakPolarHBondContact O-CB 3.21Å; P246-R250 PolarHBondContact O-N 2.65Å; E247-R250 PolarHBondContact O-N 3.29Å; R250-R253 PolarHBondContact O-N 3.08Å; R250-K254 WeakPolarHBondContact O-CG 3.42Å; R250-K254 PolarHBondContact O-N 2.92Å; R250-K254 VanDerWaalsContact O-N 3.11Å; R250-M369 HydrophobicContact CG-CE 3.67Å; R250-M369 HydrophobicContact CG-SD 3.87Å; R250-M369 VanDerWaalsContact NE-CE 3.34Å
251	M	93.1	Very high	90.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61.4	-50.3	177.6	-179.9	-177.7	75	0	0	111.3	E247 V248 R253 K254 F255 Y376 L379 L381 P540 I544	E247-M251 WeakPolarHBondContact O-CB 3.39Å; E247-M251 PolarHBondContact O-N 2.97Å; V248-M251 PolarHBondContact O-N 3.4Å; M251-R253 VanDerWaalsContact C-N 3.29Å; M251-R253 PolarHBondContact O-N 3.49Å; M251-K254 PolarHBondContact O-N 2.96Å; M251-F255 HydrophobicContact CE-CE2 4.21Å; M251-F255 HydrophobicContact CG-CD2 3.58Å; M251-F255 HydrophobicContact CG-CE2 3.25Å; M251-F255 HydrophobicContact CG-CZ 4.05Å; M251-F255 WeakPolarHBondContact O-CD2 3.33Å; M251-F255 WeakPolarHBondContact O-CG 3.4Å; M251-F255 PolarHBondContact O-N 3.41Å; M251-F255 HydrophobicContact SD-CD2 4.45Å; M251-F255 HydrophobicContact SD-CE2 3.68Å; M251-F255 HydrophobicContact SD-CZ 4.43Å; M251-Y376 HydrophobicContact CB-CE1 4.29Å; M251-L379 HydrophobicContact CE-CB 4.49Å; M251-L379 HydrophobicContact SD-CB 4.29Å; M251-L379 HydrophobicContact SD-CD1 4.38Å; M251-L381 HydrophobicContact SD-CD1 4.31Å; M251-P540 HydrophobicContact CE-CB 4.12Å; M251-P540 HydrophobicContact SD-CB 4.44Å; M251-P540 HydrophobicContact SD-CG 4.46Å; M251-I544 HydrophobicContact CE-CD1 4.05Å
252	A	92	Very high	90.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.1	-39.9	178.5	0	0	0	0	0	111.7	L173 A189 Y190 I195 V248 T249 F255 T256	L173-A252 HydrophobicContact CD1-CB 4.4Å; A189-A252 HydrophobicContact CB-CB 3.6Å; Y190-A252 HydrophobicContact CE2-CB 4.28Å; I195-A252 HydrophobicContact CG2-CB 3.93Å; V248-A252 WeakPolarHBondContact O-CB 3.27Å; V248-A252 PolarHBondContact O-N 3.08Å; T249-A252 PolarHBondContact O-N 3.05Å; A252-F255 PolarHBondContact O-N 3.46Å; A252-T256 PolarHBondContact O-N 3.34Å; A252-T256 PolarHBondContact O-OG1 2.91Å
253	R	88.8	Confident	90.1	Very high	8 Å²	8	20.3 Å²	20.3	3%	0.03	11%	0.108	C	C	.	.	H	α-helix	trans	-60.5	-49.8	176.4	-168	62.2	171.7	-158.6	-2.9	111.4	F128 E132 L168 G169 D170 Y190 T249 R250 M251 F255 T256 H257	F128-R253 HydrophobicContact CZ-CB 4.32Å; F128-R253 HydrophobicContact CZ-CG 4.5Å; E132-R253 HydrophobicContact CG-CG 4.21Å; L168-R253 PolarHBondContact O-NH1 3.34Å; G169-R253 PolarHBondContact O-NH2 2.81Å; D170-R253 PolarHBondContact O-NH1 3.45Å; Y190-R253 HydrophobicContact CE2-CB 4.38Å; T249-R253 WeakPolarHBondContact O-CB 3.42Å; T249-R253 PolarHBondContact O-N 3.26Å; R250-R253 PolarHBondContact O-N 3.08Å; M251-R253 VanDerWaalsContact C-N 3.29Å; M251-R253 PolarHBondContact O-N 3.49Å; R253-F255 VanDerWaalsContact C-N 3.35Å; R253-F255 PolarHBondContact O-N 2.73Å; R253-T256 PolarHBondContact O-N 2.58Å; R253-H257 PolarHBondContact O-CD2 3.34Å; R253-H257 PolarHBondContact O-N 3.19Å
254	K	90.4	Very high	89.8	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63.8	-39	178.2	-63.1	-59.1	170.8	-173.8	0	112.3	E132 R250 M251 H257 I258 E365 L366 M369	E132-K254 IonicContact OE1-NZ 2.61Å; E132-K254 PolarHBondContact OE1-NZ 3.08Å; E132-K254 WeakPolarHBondContact OE2-CE 3.3Å; E132-K254 IonicContact OE2-NZ 3.28Å; E132-K254 PolarHBondContact OE2-NZ 3.39Å; R250-K254 WeakPolarHBondContact O-CG 3.42Å; R250-K254 PolarHBondContact O-N 2.92Å; R250-K254 VanDerWaalsContact O-N 3.11Å; M251-K254 PolarHBondContact O-N 2.96Å; K254-H257 PolarHBondContact O-N 2.76Å; K254-I258 WeakPolarHBondContact O-CD1 3.45Å; K254-I258 VanDerWaalsContact O-CG1 3.27Å; K254-I258 WeakPolarHBondContact O-CG1 3.24Å; K254-I258 PolarHBondContact O-N 3.38Å; K254-E365 WeakPolarHBondContact CE-OE2 3.39Å; K254-E365 IonicContact NZ-OE2 3.05Å; K254-E365 PolarHBondContact NZ-OE2 2.91Å; K254-L366 HydrophobicContact CB-CD1 4.49Å; K254-M369 HydrophobicContact CG-CE 3.83Å
255	F	91.4	Very high	89.7	Confident	1 Å²	1	14.4 Å²	14.4	0%	0.004	7%	0.073	C	C	.	.	H	α-helix	trans	-64.9	-38.1	174.6	-72.7	-37	0	0	0	113.5	F193 M251 A252 R253 I258 S259 L366 L381 L537 P540	F193-F255 HydrophobicContact CD1-CB 3.7Å; F193-F255 AromaticContact CD1-CD2 3.94Å; F193-F255 HydrophobicContact CD1-CD2 3.94Å; F193-F255 HydrophobicContact CD1-CG 4.26Å; F193-F255 HydrophobicContact CD2-CB 3.72Å; F193-F255 HydrophobicContact CD2-CG 4.49Å; F193-F255 HydrophobicContact CE1-CB 3.75Å; F193-F255 AromaticContact CE1-CD2 3.2Å; F193-F255 HydrophobicContact CE1-CD2 3.2Å; F193-F255 AromaticContact CE1-CE2 3.94Å; F193-F255 HydrophobicContact CE1-CE2 3.94Å; F193-F255 AromaticContact CE1-CG 3.8Å; F193-F255 HydrophobicContact CE1-CG 3.8Å; F193-F255 HydrophobicContact CE2-CB 3.76Å; F193-F255 HydrophobicContact CE2-CD2 4.19Å; F193-F255 HydrophobicContact CE2-CG 4.05Å; F193-F255 HydrophobicContact CG-CB 3.69Å; F193-F255 HydrophobicContact CZ-CB 3.76Å; F193-F255 HydrophobicContact CZ-CD1 4.47Å; F193-F255 AromaticContact CZ-CD2 3.34Å; F193-F255 HydrophobicContact CZ-CD2 3.34Å; F193-F255 AromaticContact CZ-CE2 3.88Å; F193-F255 HydrophobicContact CZ-CE2 3.88Å; F193-F255 AromaticContact CZ-CG 3.66Å; F193-F255 HydrophobicContact CZ-CG 3.66Å; M251-F255 HydrophobicContact CE-CE2 4.21Å; M251-F255 HydrophobicContact CG-CD2 3.58Å; M251-F255 HydrophobicContact CG-CE2 3.25Å; M251-F255 HydrophobicContact CG-CZ 4.05Å; M251-F255 WeakPolarHBondContact O-CD2 3.33Å; M251-F255 WeakPolarHBondContact O-CG 3.4Å; M251-F255 PolarHBondContact O-N 3.41Å; M251-F255 HydrophobicContact SD-CD2 4.45Å; M251-F255 HydrophobicContact SD-CE2 3.68Å; M251-F255 HydrophobicContact SD-CZ 4.43Å; A252-F255 PolarHBondContact O-N 3.46Å; R253-F255 VanDerWaalsContact C-N 3.35Å; R253-F255 PolarHBondContact O-N 2.73Å; F255-I258 HydrophobicContact CD1-CD1 4.24Å; F255-I258 PolarHBondContact O-N 3.48Å; F255-S259 WeakPolarHBondContact O-CB 3.36Å; F255-S259 PolarHBondContact O-N 3.03Å; F255-L366 HydrophobicContact CD1-CD2 4.04Å; F255-L366 HydrophobicContact CE1-CD1 4.18Å; F255-L366 HydrophobicContact CE1-CD2 3.39Å; F255-L366 HydrophobicContact CE1-CG 4.41Å; F255-L366 HydrophobicContact CZ-CD1 4.43Å; F255-L366 HydrophobicContact CZ-CD2 4.15Å; F255-L381 HydrophobicContact CE1-CD1 4.3Å; F255-L381 HydrophobicContact CE2-CD1 4.31Å; F255-L381 HydrophobicContact CZ-CD1 3.53Å; F255-L537 HydrophobicContact CB-CD2 3.99Å; F255-L537 HydrophobicContact CD1-CD2 3.07Å; F255-L537 HydrophobicContact CE1-CD2 3.46Å; F255-L537 VanDerWaalsContact CE1-CD2 3.46Å; F255-L537 HydrophobicContact CG-CD2 3.67Å; F255-L537 HydrophobicContact CZ-CD2 4.34Å; F255-P540 HydrophobicContact CE2-CB 4.47Å; F255-P540 HydrophobicContact CE2-CG 3.87Å; F255-P540 HydrophobicContact CZ-CG 4.01Å
256	T	87.4	Confident	89.6	Confident	1 Å²	1	16 Å²	16	1%	0.006	8%	0.081	C	C	.	.	H	α-helix	trans	-63.5	-42.7	172.8	-56.2	0	0	0	0	111.3	L168 M192 A252 R253 S259 A260	L168-T256 HydrophobicContact CD2-CG2 3.45Å; L168-T256 VanDerWaalsContact CD2-CG2 3.45Å; M192-T256 HydrophobicContact CB-CG2 3.88Å; M192-T256 HydrophobicContact CE-CG2 3.61Å; M192-T256 HydrophobicContact CG-CG2 4.35Å; M192-T256 HydrophobicContact SD-CG2 3.57Å; M192-T256 VanDerWaalsContact SD-CG2 3.57Å; A252-T256 PolarHBondContact O-N 3.34Å; A252-T256 PolarHBondContact O-OG1 2.91Å; R253-T256 PolarHBondContact O-N 2.58Å; T256-S259 PolarHBondContact O-N 3.04Å; T256-A260 WeakPolarHBondContact O-CB 3.14Å; T256-A260 PolarHBondContact O-N 3.15Å
257	H	86.8	Confident	89.3	Confident	18 Å²	18	15.3 Å²	15.3	8%	0.083	8%	0.076	C	C	.	.	H	α-helix	trans	-59.9	-46.8	173.5	-79.4	-75.8	0	0	0	111.9	E132 R253 K254 S259 A260 L261	E132-H257 IonicContact OE1-CD2 3.5Å; E132-H257 IonicContact OE1-NE2 3.19Å; R253-H257 PolarHBondContact O-CD2 3.34Å; R253-H257 PolarHBondContact O-N 3.19Å; K254-H257 PolarHBondContact O-N 2.76Å; H257-S259 PolarHBondContact O-N 2.77Å; H257-A260 PolarHBondContact O-N 3.28Å; H257-L261 WeakPolarHBondContact O-CB 3.28Å; H257-L261 WeakPolarHBondContact O-CD1 3.45Å; H257-L261 VanDerWaalsContact O-CG 3.22Å; H257-L261 WeakPolarHBondContact O-CG 3.3Å; H257-L261 PolarHBondContact O-N 3.29Å
258	I	91.2	Very high	89.1	Confident	1 Å²	1	14.4 Å²	14.4	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-59.5	-47.7	177.6	-72	163.1	0	0	0	111.2	K254 F255 A260 L261 L262 L359 H362 L363 L366 I533 L537	K254-I258 WeakPolarHBondContact O-CD1 3.45Å; K254-I258 VanDerWaalsContact O-CG1 3.27Å; K254-I258 WeakPolarHBondContact O-CG1 3.24Å; K254-I258 PolarHBondContact O-N 3.38Å; F255-I258 HydrophobicContact CD1-CD1 4.24Å; F255-I258 PolarHBondContact O-N 3.48Å; I258-A260 PolarHBondContact O-N 2.99Å; I258-L261 PolarHBondContact O-N 2.9Å; I258-L262 HydrophobicContact CG2-CD1 4.47Å; I258-L262 WeakPolarHBondContact O-CG 3.48Å; I258-L262 PolarHBondContact O-N 2.7Å; I258-L359 HydrophobicContact CB-CD1 4.17Å; I258-L359 HydrophobicContact CG1-CD1 4.02Å; I258-L359 HydrophobicContact CG2-CD1 3.74Å; I258-H362 HydrophobicContact CD1-CB 4.46Å; I258-H362 HydrophobicContact CG1-CB 4.05Å; I258-L363 HydrophobicContact CD1-CD2 3.82Å; I258-L363 HydrophobicContact CD1-CG 4.32Å; I258-L366 HydrophobicContact CD1-CD2 4.13Å; I258-I533 HydrophobicContact CG2-CG2 3.71Å; I258-L537 HydrophobicContact CG2-CD2 4.49Å
259	S	88.2	Confident	89	Confident	29 Å²	29	14.6 Å²	14.6	20%	0.203	7%	0.073	C	C	.	.	H	α-helix	trans	-62.1	-44.3	178.9	-176.7	0	0	0	0	111.9	F255 T256 H257 L261 L262 Q263	F255-S259 WeakPolarHBondContact O-CB 3.36Å; F255-S259 PolarHBondContact O-N 3.03Å; T256-S259 PolarHBondContact O-N 3.04Å; H257-S259 PolarHBondContact O-N 2.77Å; S259-L261 VanDerWaalsContact C-N 3.33Å; S259-L261 PolarHBondContact O-N 2.93Å; S259-L262 PolarHBondContact O-N 2.72Å; S259-Q263 WeakPolarHBondContact O-CG 3.27Å; S259-Q263 PolarHBondContact O-N 3.19Å
260	A	83.9	Confident	88.8	Confident	19 Å²	19	17.8 Å²	17.8	16%	0.157	9%	0.092	C	C	.	.	H	α-helix	trans	-62.2	-40.3	175.7	0	0	0	0	0	112.1	F156 T256 H257 I258 Q263 Y264	F156-A260 HydrophobicContact CZ-CB 4.47Å; F156-A260 WeakPolarHBondContact CZ-O 3.42Å; T256-A260 WeakPolarHBondContact O-CB 3.14Å; T256-A260 PolarHBondContact O-N 3.15Å; H257-A260 PolarHBondContact O-N 3.28Å; I258-A260 PolarHBondContact O-N 2.99Å; A260-Q263 PolarHBondContact O-N 2.91Å; A260-Y264 WeakPolarHBondContact O-CB 3.38Å; A260-Y264 PolarHBondContact O-N 3.4Å
261	L	87.9	Confident	88.5	Confident	10 Å²	10	13.8 Å²	13.8	5%	0.052	8%	0.078	C	C	.	.	H	α-helix	trans	-66.3	-39.2	176.7	-74.7	166.8	0	0	0	112.5	L142 H257 I258 S259 Q263 Y264 I265 L359	L142-L261 HydrophobicContact CD1-CD2 3.52Å; H257-L261 WeakPolarHBondContact O-CB 3.28Å; H257-L261 WeakPolarHBondContact O-CD1 3.45Å; H257-L261 VanDerWaalsContact O-CG 3.22Å; H257-L261 WeakPolarHBondContact O-CG 3.3Å; H257-L261 PolarHBondContact O-N 3.29Å; I258-L261 PolarHBondContact O-N 2.9Å; S259-L261 VanDerWaalsContact C-N 3.33Å; S259-L261 PolarHBondContact O-N 2.93Å; L261-Q263 VanDerWaalsContact C-N 3.34Å; L261-Y264 WeakPolarHBondContact O-CB 3.43Å; L261-Y264 PolarHBondContact O-N 3.11Å; L261-I265 WeakPolarHBondContact O-CB 3.32Å; L261-I265 VanDerWaalsContact O-CG1 3.27Å; L261-I265 WeakPolarHBondContact O-CG1 3.43Å; L261-I265 PolarHBondContact O-N 2.61Å; L261-L359 HydrophobicContact CB-CB 4.49Å; L261-L359 HydrophobicContact CD1-CB 4.26Å
262	L	90.3	Very high	88.3	Confident	11 Å²	11	13.8 Å²	13.8	6%	0.058	8%	0.078	C	C	.	.	H	α-helix	trans	-61.6	-44	173.3	-73.5	178.8	0	0	0	111.4	I258 S259 Y264 I265 N266 L359 M529 E530 I533	I258-L262 HydrophobicContact CG2-CD1 4.47Å; I258-L262 WeakPolarHBondContact O-CG 3.48Å; I258-L262 PolarHBondContact O-N 2.7Å; S259-L262 PolarHBondContact O-N 2.72Å; L262-Y264 VanDerWaalsContact C-N 3.34Å; L262-Y264 PolarHBondContact O-N 3.27Å; L262-I265 PolarHBondContact O-N 3.19Å; L262-N266 WeakPolarHBondContact O-CB 3.5Å; L262-N266 VanDerWaalsContact O-CG 3.25Å; L262-N266 PolarHBondContact O-N 3.41Å; L262-N266 PolarHBondContact O-ND2 3.33Å; L262-L359 HydrophobicContact CD2-CD2 3.94Å; L262-M529 HydrophobicContact CD2-CE 3.91Å; L262-E530 HydrophobicContact CD2-CG 4.37Å; L262-I533 HydrophobicContact CD1-CB 4.3Å; L262-I533 HydrophobicContact CD1-CD1 4.38Å; L262-I533 HydrophobicContact CD1-CG2 3.77Å; L262-I533 HydrophobicContact CD2-CD1 3.89Å
263	Q	84.6	Confident	88.1	Confident	54 Å²	54	14.6 Å²	14.6	25%	0.252	8%	0.084	S	C	.	.	H	α-helix	trans	-60.8	-43.7	174.3	-68.8	-175.5	-1.5	0	0	111.6	H102 F156 S259 A260 L261 N266 L267	H102-Q263 PolarHBondContact CE1-NE2 2.73Å; H102-Q263 VanDerWaalsContact CE1-NE2 3.32Å; H102-Q263 PolarHBondContact CE1-OE1 3.17Å; H102-Q263 VanDerWaalsContact CE1-OE1 3.27Å; H102-Q263 PolarHBondContact ND1-OE1 3.03Å; F156-Q263 HydrophobicContact CE2-CB 4.37Å; S259-Q263 WeakPolarHBondContact O-CG 3.27Å; S259-Q263 PolarHBondContact O-N 3.19Å; A260-Q263 PolarHBondContact O-N 2.91Å; L261-Q263 VanDerWaalsContact C-N 3.34Å; Q263-N266 WeakPolarHBondContact O-CB 3.4Å; Q263-N266 PolarHBondContact O-N 3.5Å; Q263-L267 VanDerWaalsContact O-CD1 3.29Å; Q263-L267 WeakPolarHBondContact O-CD1 3.42Å; Q263-L267 WeakPolarHBondContact O-CG 3.16Å; Q263-L267 PolarHBondContact O-N 3.33Å
264	Y	85.6	Confident	87.8	Confident	1 Å²	1	17.5 Å²	17.5	0%	0.004	10%	0.098	C	C	.	.	H	α-helix	trans	-61.2	-44.9	176.6	-179.6	-105	0	0	0	113	L142 P143 L145 F156 A260 L261 L262 N266 L267 S268 H351	L142-Y264 HydrophobicContact CB-CE1 4.29Å; L142-Y264 HydrophobicContact CB-CE2 4.42Å; L142-Y264 HydrophobicContact CD1-CD1 4.09Å; L142-Y264 HydrophobicContact CD1-CE1 4.19Å; L142-Y264 HydrophobicContact CD1-CG 4.35Å; L142-Y264 HydrophobicContact CD2-CE1 4.12Å; L142-Y264 HydrophobicContact CG-CE1 4.43Å; P143-Y264 WeakPolarHBondContact CD-OH 3.27Å; P143-Y264 WeakPolarHBondContact O-CE2 3.5Å; P143-Y264 PolarHBondContact O-OH 3.2Å; L145-Y264 HydrophobicContact CD1-CD2 3.98Å; L145-Y264 HydrophobicContact CD1-CE2 3.99Å; L145-Y264 HydrophobicContact CG-CD2 4.43Å; L145-Y264 HydrophobicContact CG-CE2 3.93Å; F156-Y264 HydrophobicContact CB-CD2 3.95Å; F156-Y264 HydrophobicContact CB-CE2 4.26Å; F156-Y264 AromaticContact CD1-CD2 3.37Å; F156-Y264 HydrophobicContact CD1-CD2 3.37Å; F156-Y264 HydrophobicContact CD1-CE2 4.05Å; F156-Y264 HydrophobicContact CD1-CG 4.19Å; F156-Y264 HydrophobicContact CD2-CD2 4.23Å; F156-Y264 AromaticContact CE1-CD2 3.85Å; F156-Y264 HydrophobicContact CE1-CD2 3.85Å; F156-Y264 HydrophobicContact CE1-CG 4.23Å; F156-Y264 AromaticContact CG-CD2 3.58Å; F156-Y264 HydrophobicContact CG-CD2 3.58Å; F156-Y264 HydrophobicContact CG-CE2 4.32Å; F156-Y264 HydrophobicContact CZ-CD2 4.46Å; A260-Y264 WeakPolarHBondContact O-CB 3.38Å; A260-Y264 PolarHBondContact O-N 3.4Å; L261-Y264 WeakPolarHBondContact O-CB 3.43Å; L261-Y264 PolarHBondContact O-N 3.11Å; L262-Y264 VanDerWaalsContact C-N 3.34Å; L262-Y264 PolarHBondContact O-N 3.27Å; Y264-N266 VanDerWaalsContact C-N 3.3Å; Y264-N266 PolarHBondContact O-N 2.93Å; Y264-L267 PolarHBondContact O-N 3.38Å; Y264-S268 WeakPolarHBondContact O-CB 3.16Å; Y264-S268 PolarHBondContact O-N 3.4Å; Y264-S268 PolarHBondContact O-OG 3.23Å; Y264-H351 HydrophobicContact CE1-CB 4.14Å; Y264-H351 WeakPolarHBondContact CE1-O 3.3Å; Y264-H351 AromaticContact CZ-CD2 3.93Å; Y264-H351 WeakPolarHBondContact OH-CB 3.36Å; Y264-H351 PolarHBondContact OH-CD2 3.5Å
265	I	90.6	Very high	87.5	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.7	-42.4	175.8	-73.3	165.9	0	0	0	110.3	L261 L262 S268 L269 L352 L359 F396	L261-I265 WeakPolarHBondContact O-CB 3.32Å; L261-I265 VanDerWaalsContact O-CG1 3.27Å; L261-I265 WeakPolarHBondContact O-CG1 3.43Å; L261-I265 PolarHBondContact O-N 2.61Å; L262-I265 PolarHBondContact O-N 3.19Å; I265-S268 PolarHBondContact O-N 3.39Å; I265-L269 WeakPolarHBondContact O-CB 3.27Å; I265-L269 PolarHBondContact O-N 3.38Å; I265-L352 HydrophobicContact CG2-CD1 3.83Å; I265-L359 HydrophobicContact CD1-CD2 3.91Å; I265-F396 HydrophobicContact CG2-CE1 3.93Å; I265-F396 HydrophobicContact CG2-CZ 3.99Å
266	N	89.4	Confident	87.1	Confident	40 Å²	40	18.7 Å²	18.7	21%	0.214	11%	0.105	C	C	.	.	H	α-helix	trans	-62.9	-49.9	177	-76.9	-26.6	0	0	0	112.9	L262 Q263 Y264 S268 L269 T270 K526 E530	L262-N266 WeakPolarHBondContact O-CB 3.5Å; L262-N266 VanDerWaalsContact O-CG 3.25Å; L262-N266 PolarHBondContact O-N 3.41Å; L262-N266 PolarHBondContact O-ND2 3.33Å; Q263-N266 WeakPolarHBondContact O-CB 3.4Å; Q263-N266 PolarHBondContact O-N 3.5Å; Y264-N266 VanDerWaalsContact C-N 3.3Å; Y264-N266 PolarHBondContact O-N 2.93Å; N266-S268 VanDerWaalsContact C-N 3.29Å; N266-S268 PolarHBondContact O-N 3.05Å; N266-L269 PolarHBondContact O-N 3.45Å; N266-T270 PolarHBondContact O-N 3.11Å; N266-T270 PolarHBondContact O-OG1 3.48Å; N266-T270 VanDerWaalsContact O-OG1 3.07Å; N266-K526 VanDerWaalsContact OD1-CD 3.32Å; N266-K526 WeakPolarHBondContact OD1-CD 3.43Å; N266-K526 WeakPolarHBondContact OD1-CE 3.21Å; N266-K526 PolarHBondContact OD1-NZ 3.4Å; N266-E530 PolarHBondContact ND2-OE1 3.1Å; N266-E530 PolarHBondContact OD1-OE1 3.07Å
267	L	85.3	Confident	86.8	Confident	19 Å²	19	23.8 Å²	23.8	10%	0.099	13%	0.128	C	C	.	.	H	α-helix	trans	-60.8	-41.4	176.9	-72.9	151.1	0	0	0	111	L145 F156 Q263 Y264 L269 T270 C271	L145-L267 HydrophobicContact CD1-CB 3.53Å; F156-L267 HydrophobicContact CD2-CD1 3.61Å; F156-L267 HydrophobicContact CE2-CD1 4.05Å; Q263-L267 VanDerWaalsContact O-CD1 3.29Å; Q263-L267 WeakPolarHBondContact O-CD1 3.42Å; Q263-L267 WeakPolarHBondContact O-CG 3.16Å; Q263-L267 PolarHBondContact O-N 3.33Å; Y264-L267 PolarHBondContact O-N 3.38Å; L267-L269 VanDerWaalsContact C-N 3.35Å; L267-L269 PolarHBondContact O-N 2.76Å; L267-T270 PolarHBondContact O-N 2.89Å; L267-C271 PolarHBondContact O-N 2.86Å; L267-C271 PolarHBondContact O-SG 2.88Å
268	S	88.6	Confident	86.2	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.7	-43.6	176.2	-57.8	0	0	0	0	111.8	Y264 I265 N266 C271 M272	Y264-S268 WeakPolarHBondContact O-CB 3.16Å; Y264-S268 PolarHBondContact O-N 3.4Å; Y264-S268 PolarHBondContact O-OG 3.23Å; I265-S268 PolarHBondContact O-N 3.39Å; N266-S268 VanDerWaalsContact C-N 3.29Å; N266-S268 PolarHBondContact O-N 3.05Å; S268-C271 PolarHBondContact O-N 2.87Å; S268-M272 WeakPolarHBondContact O-CG 3.4Å; S268-M272 PolarHBondContact O-N 3.29Å; S268-M272 VanDerWaalsContact O-N 3.1Å
269	L	90.7	Very high	85.4	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-67.6	-39.9	177.8	-176.6	62.3	0	0	0	112	I265 N266 L267 M272 C273 L479 L522 K526	I265-L269 WeakPolarHBondContact O-CB 3.27Å; I265-L269 PolarHBondContact O-N 3.38Å; N266-L269 PolarHBondContact O-N 3.45Å; L267-L269 VanDerWaalsContact C-N 3.35Å; L267-L269 PolarHBondContact O-N 2.76Å; L269-M272 HydrophobicContact CD1-CE 4.44Å; L269-M272 WeakPolarHBondContact O-CB 3.42Å; L269-M272 PolarHBondContact O-N 3.42Å; L269-C273 PolarHBondContact O-N 3.47Å; L269-C273 PolarHBondContact O-SG 3.14Å; L269-L479 HydrophobicContact CD1-CD2 4.01Å; L269-L522 HydrophobicContact CD1-CD2 3.64Å; L269-K526 HydrophobicContact CD2-CD 3.49Å; L269-K526 VanDerWaalsContact CD2-CD 3.49Å; L269-K526 HydrophobicContact CD2-CG 4.34Å
270	T	87.6	Confident	84.5	Confident	67 Å²	67	27.4 Å²	27.4	41%	0.411	14%	0.143	S	C	.	.	H	α-helix	trans	-59.3	-48.3	174.2	-58.4	0	0	0	0	111	N266 L267 M272 C273 E274	N266-T270 PolarHBondContact O-N 3.11Å; N266-T270 PolarHBondContact O-OG1 3.48Å; N266-T270 VanDerWaalsContact O-OG1 3.07Å; L267-T270 PolarHBondContact O-N 2.89Å; T270-M272 PolarHBondContact O-N 2.88Å; T270-C273 WeakPolarHBondContact O-CB 3.3Å; T270-C273 PolarHBondContact O-N 2.87Å; T270-E274 WeakPolarHBondContact O-CG 3.3Å; T270-E274 PolarHBondContact O-N 3.35Å
271	C	85.2	Confident	84	Confident	6 Å²	6	33 Å²	33	4%	0.041	17%	0.168	C	C	.	.	H	α-helix	trans	-56.6	-37.8	175	-67.5	0	0	0	0	112.4	Y149 L267 S268 A275 L347	Y149-C271 VanDerWaalsContact CB-SG 3.55Å; L267-C271 PolarHBondContact O-N 2.86Å; L267-C271 PolarHBondContact O-SG 2.88Å; S268-C271 PolarHBondContact O-N 2.87Å; C271-A275 WeakPolarHBondContact O-CB 3.48Å; C271-A275 PolarHBondContact O-N 3.32Å; C271-A275 VanDerWaalsContact O-N 3.14Å; C271-L347 HydrophobicContact CB-CD1 4.09Å
272	M	88.6	Confident	83.1	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-67.8	-40.6	176	-70.9	169.6	51.9	0	0	112.3	S268 L269 T270 W276 I344 L347 V348 L352 L403 L479	S268-M272 WeakPolarHBondContact O-CG 3.4Å; S268-M272 PolarHBondContact O-N 3.29Å; S268-M272 VanDerWaalsContact O-N 3.1Å; L269-M272 HydrophobicContact CD1-CE 4.44Å; L269-M272 WeakPolarHBondContact O-CB 3.42Å; L269-M272 PolarHBondContact O-N 3.42Å; T270-M272 PolarHBondContact O-N 2.88Å; M272-W276 WeakPolarHBondContact O-CB 3.47Å; M272-W276 PolarHBondContact O-N 2.93Å; M272-I344 HydrophobicContact CE-CG2 4.12Å; M272-I344 HydrophobicContact CG-CG2 4.42Å; M272-L347 HydrophobicContact CG-CB 3.63Å; M272-L347 HydrophobicContact CG-CD1 3.78Å; M272-L347 HydrophobicContact CG-CG 4.34Å; M272-L347 HydrophobicContact SD-CB 4.18Å; M272-V348 HydrophobicContact CE-CG2 3.32Å; M272-V348 HydrophobicContact SD-CG2 3.82Å; M272-L352 HydrophobicContact SD-CD2 4.25Å; M272-L403 HydrophobicContact CE-CD2 3.72Å; M272-L479 HydrophobicContact CE-CD2 3.92Å
273	C	86.8	Confident	82.1	Confident	18 Å²	18	35 Å²	35	12%	0.122	18%	0.176	C	C	.	.	H	α-helix	trans	-64.6	-44.8	178.7	-64	0	0	0	0	111	L269 T270 W276 E277 H523	L269-C273 PolarHBondContact O-N 3.47Å; L269-C273 PolarHBondContact O-SG 3.14Å; T270-C273 WeakPolarHBondContact O-CB 3.3Å; T270-C273 PolarHBondContact O-N 2.87Å; C273-W276 CarbonylContact O-C 3.54Å; C273-W276 WeakPolarHBondContact O-CB 3.37Å; C273-W276 PolarHBondContact O-N 3.41Å; C273-W276 VanDerWaalsContact O-N 3.16Å; C273-E277 WeakPolarHBondContact O-CG 3.43Å; C273-E277 PolarHBondContact O-N 2.84Å; C273-H523 VanDerWaalsContact SG-CE1 3.6Å
274	E	83.6	Confident	81	Confident	68 Å²	68	33.8 Å²	33.8	32%	0.318	17%	0.172	S	C	.	.	H	α-helix	trans	-63.6	-44.4	178.1	-68.4	171.3	158.7	0	0	112	Y149 T270 W276 E277 E278	Y149-E274 WeakPolarHBondContact CD1-OE2 3.36Å; T270-E274 WeakPolarHBondContact O-CG 3.3Å; T270-E274 PolarHBondContact O-N 3.35Å; E274-W276 PolarHBondContact O-N 2.9Å; E274-E277 PolarHBondContact O-N 3.47Å; E274-E278 PolarHBondContact O-N 3.28Å
275	A	83.3	Confident	80.1	Confident	12 Å²	12	36.5 Å²	36.5	10%	0.099	19%	0.191	C	C	.	.	H	α-helix	trans	-62.3	-31.9	175	0	0	0	0	0	112.6	C271 I279 I344	C271-A275 WeakPolarHBondContact O-CB 3.48Å; C271-A275 PolarHBondContact O-N 3.32Å; C271-A275 VanDerWaalsContact O-N 3.14Å; A275-I279 PolarHBondContact O-N 3.43Å; A275-I344 HydrophobicContact CB-CD1 4.37Å; A275-I344 HydrophobicContact CB-CG1 3.9Å
276	W	83.3	Confident	78.9	Confident	15 Å²	15	43.4 Å²	43.4	6%	0.057	22%	0.217	C	C	.	.	H	α-helix	trans	-74.6	-40.5	174.2	171.4	78.1	0	0	0	112.5	M272 C273 E274 E278 I279 L280 I344 L479 K480	M272-W276 WeakPolarHBondContact O-CB 3.47Å; M272-W276 PolarHBondContact O-N 2.93Å; C273-W276 CarbonylContact O-C 3.54Å; C273-W276 WeakPolarHBondContact O-CB 3.37Å; C273-W276 PolarHBondContact O-N 3.41Å; C273-W276 VanDerWaalsContact O-N 3.16Å; E274-W276 PolarHBondContact O-N 2.9Å; W276-E278 PolarHBondContact O-N 3.33Å; W276-I279 WeakPolarHBondContact O-CB 3.49Å; W276-I279 PolarHBondContact O-N 2.86Å; W276-I279 VanDerWaalsContact O-N 3.12Å; W276-L280 HydrophobicContact CH2-CD1 3.5Å; W276-L280 HydrophobicContact CZ2-CD1 3.31Å; W276-L280 HydrophobicContact CZ3-CD1 4.39Å; W276-L280 PolarHBondContact O-N 3.14Å; W276-I344 HydrophobicContact CB-CD1 4.02Å; W276-L479 HydrophobicContact CB-CD1 3.59Å; W276-L479 HydrophobicContact CD2-CD1 4.43Å; W276-L479 HydrophobicContact CG-CD1 3.78Å; W276-K480 HydrophobicContact CH2-CG 4Å; W276-K480 HydrophobicContact CZ3-CG 4.45Å
277	E	80.4	Confident	77.7	Confident	107 Å²	107	42.9 Å²	42.9	50%	0.5	21%	0.214	S	C	.	.	H	α-helix	trans	-61.2	-35.3	175	-75.1	-175.3	176.3	0	0	111.7	C273 E274 L280 M281	C273-E277 WeakPolarHBondContact O-CG 3.43Å; C273-E277 PolarHBondContact O-N 2.84Å; E274-E277 PolarHBondContact O-N 3.47Å; E277-L280 PolarHBondContact O-N 3.46Å; E277-M281 WeakPolarHBondContact O-CB 3.39Å; E277-M281 VanDerWaalsContact O-CG 3.3Å; E277-M281 WeakPolarHBondContact O-CG 3.03Å; E277-M281 PolarHBondContact O-N 3.12Å
278	E	75.7	Confident	76.6	Confident	92 Å²	92	43 Å²	43	43%	0.43	22%	0.216	S	C	.	.	H	α-helix	trans	-60.8	-45.1	172.2	-169.5	-177.2	179.9	0	0	112	E274 W276 L280 Q282	E274-E278 PolarHBondContact O-N 3.28Å; W276-E278 PolarHBondContact O-N 3.33Å; E278-L280 VanDerWaalsContact C-N 3.33Å; E278-L280 PolarHBondContact O-N 3.11Å; E278-Q282 WeakPolarHBondContact O-CG 3.21Å; E278-Q282 PolarHBondContact O-N 2.92Å; E278-Q282 VanDerWaalsContact O-N 3.14Å
279	I	73.9	Confident	75.4	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-58.7	-48.1	174.5	-65.9	163.4	0	0	0	110.1	A275 W276 Q282 M283 I337 S340 Y341 I344	A275-I279 PolarHBondContact O-N 3.43Å; W276-I279 WeakPolarHBondContact O-CB 3.49Å; W276-I279 PolarHBondContact O-N 2.86Å; W276-I279 VanDerWaalsContact O-N 3.12Å; I279-Q282 PolarHBondContact O-N 3.25Å; I279-M283 PolarHBondContact O-N 2.69Å; I279-I337 HydrophobicContact CG2-CG1 4.41Å; I279-S340 VanDerWaalsContact CD1-CB 3.42Å; I279-Y341 HydrophobicContact CD1-CD2 4.3Å; I279-Y341 HydrophobicContact CD1-CE2 4.36Å; I279-Y341 HydrophobicContact CD1-CG 4.48Å; I279-I344 HydrophobicContact CD1-CD1 3.84Å
280	L	69.6	Low	74.1	Confident	30 Å²	30	48.8 Å²	48.8	16%	0.157	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-45.8	-176.3	-172.2	140.1	0	0	0	111.2	W276 E277 E278 Q282 M283 D284	W276-L280 HydrophobicContact CH2-CD1 3.5Å; W276-L280 HydrophobicContact CZ2-CD1 3.31Å; W276-L280 HydrophobicContact CZ3-CD1 4.39Å; W276-L280 PolarHBondContact O-N 3.14Å; E277-L280 PolarHBondContact O-N 3.46Å; E278-L280 VanDerWaalsContact C-N 3.33Å; E278-L280 PolarHBondContact O-N 3.11Å; L280-Q282 VanDerWaalsContact C-N 3.33Å; L280-Q282 PolarHBondContact O-N 3.23Å; L280-M283 PolarHBondContact O-N 3.46Å; L280-D284 WeakPolarHBondContact CD2-OD2 3.48Å; L280-D284 VanDerWaalsContact O-CB 3.27Å; L280-D284 WeakPolarHBondContact O-CB 3.49Å; L280-D284 PolarHBondContact O-N 3.12Å
281	M	73	Confident	72.8	Confident	138 Å²	138	47 Å²	47	68%	0.68	23%	0.23	S	C	*	.	H	α-helix	trans	-56.5	-44.2	175	-79.9	-95.8	-171.7	0	0	112.4	E277 S285	E277-M281 WeakPolarHBondContact O-CB 3.39Å; E277-M281 VanDerWaalsContact O-CG 3.3Å; E277-M281 WeakPolarHBondContact O-CG 3.03Å; E277-M281 PolarHBondContact O-N 3.12Å; M281-S285 WeakPolarHBondContact O-CB 3.44Å; M281-S285 PolarHBondContact O-N 3.4Å; M281-S285 PolarHBondContact O-OG 3.37Å
282	Q	69.8	Low	71.8	Confident	52 Å²	52	52.5 Å²	52.5	24%	0.243	26%	0.255	C	S	.	.	H	α-helix	trans	-69.7	-39	-178.8	-70.5	-174.5	14.8	0	0	112.9	E278 I279 L280 S285 R286 L333 S336	E278-Q282 WeakPolarHBondContact O-CG 3.21Å; E278-Q282 PolarHBondContact O-N 2.92Å; E278-Q282 VanDerWaalsContact O-N 3.14Å; I279-Q282 PolarHBondContact O-N 3.25Å; L280-Q282 VanDerWaalsContact C-N 3.33Å; L280-Q282 PolarHBondContact O-N 3.23Å; Q282-S285 PolarHBondContact O-OG 3.44Å; Q282-R286 WeakPolarHBondContact O-CG 3.49Å; Q282-L333 HydrophobicContact CB-CD1 4.15Å; Q282-S336 PolarHBondContact NE2-OG 3.28Å; Q282-S336 PolarHBondContact OE1-OG 2.89Å
283	M	67.5	Low	70.6	Confident	9 Å²	9	58.1 Å²	58.1	4%	0.044	28%	0.281	C	S	.	.	H	α-helix	trans	-72.2	-48.9	176.3	-78.8	-159.5	61.6	0	0	112.1	I279 L280 S285 R286 L287 I337 F414 V472	I279-M283 PolarHBondContact O-N 2.69Å; L280-M283 PolarHBondContact O-N 3.46Å; M283-S285 PolarHBondContact O-N 3.04Å; M283-R286 PolarHBondContact O-N 3.09Å; M283-L287 HydrophobicContact CE-CD1 3.49Å; M283-L287 VanDerWaalsContact CE-CD1 3.49Å; M283-L287 WeakPolarHBondContact O-CB 3.23Å; M283-L287 PolarHBondContact O-N 2.91Å; M283-I337 HydrophobicContact CG-CD1 3.83Å; M283-I337 HydrophobicContact SD-CD1 4.05Å; M283-F414 HydrophobicContact CE-CE1 4Å; M283-F414 HydrophobicContact CE-CZ 4.25Å; M283-F414 HydrophobicContact SD-CE1 3.67Å; M283-F414 HydrophobicContact SD-CZ 3.77Å; M283-V472 HydrophobicContact CE-CG1 4.45Å; M283-V472 HydrophobicContact CE-CG2 3.51Å; M283-V472 HydrophobicContact SD-CG1 3.89Å; M283-V472 HydrophobicContact SD-CG2 3.99Å
284	D	63.5	Low	69.4	Low	29 Å²	29	58.7 Å²	58.7	16%	0.155	28%	0.281	C	S	.	.	H	α-helix	trans	-64.5	-42.4	-177	-81.9	-9	0	0	0	111.3	L280 R286 T288	L280-D284 WeakPolarHBondContact CD2-OD2 3.48Å; L280-D284 VanDerWaalsContact O-CB 3.27Å; L280-D284 WeakPolarHBondContact O-CB 3.49Å; L280-D284 PolarHBondContact O-N 3.12Å; D284-R286 PolarHBondContact O-N 2.92Å; D284-R286 VanDerWaalsContact O-N 3.14Å; D284-T288 WeakPolarHBondContact O-CA 3.26Å; D284-T288 WeakPolarHBondContact O-CB 3.2Å; D284-T288 PolarHBondContact O-N 3.32Å; D284-T288 PolarHBondContact O-OG1 3.21Å
285	S	65.6	Low	68	Low	59 Å²	59	61.8 Å²	61.8	41%	0.413	31%	0.305	S	S	.	.	H	α-helix	trans	-63.4	-21.5	-179.4	63.4	0	0	0	0	114.4	M281 Q282 M283 K289	M281-S285 WeakPolarHBondContact O-CB 3.44Å; M281-S285 PolarHBondContact O-N 3.4Å; M281-S285 PolarHBondContact O-OG 3.37Å; Q282-S285 PolarHBondContact O-OG 3.44Å; M283-S285 PolarHBondContact O-N 3.04Å; S285-K289 WeakPolarHBondContact O-CD 3.35Å; S285-K289 WeakPolarHBondContact O-CG 3.48Å
286	R	66.5	Low	66.9	Low	144 Å²	144	64.1 Å²	64.1	54%	0.543	32%	0.318	S	S	.	.	H	α-helix	trans	-102.2	-40.4	-177.6	-64.8	-67.2	179.8	178	-3	112.9	Q282 M283 D284	Q282-R286 WeakPolarHBondContact O-CG 3.49Å; M283-R286 PolarHBondContact O-N 3.09Å; D284-R286 PolarHBondContact O-N 2.92Å; D284-R286 VanDerWaalsContact O-N 3.14Å
287	L	64.1	Low	66	Low	30 Å²	30	70.5 Å²	70.5	16%	0.157	36%	0.359	C	S	.	.	H	α-helix	trans	-87.7	-30.7	-178.2	-70.1	162.1	0	0	0	112.5	M283 F290 V291 F470	M283-L287 HydrophobicContact CE-CD1 3.49Å; M283-L287 VanDerWaalsContact CE-CD1 3.49Å; M283-L287 WeakPolarHBondContact O-CB 3.23Å; M283-L287 PolarHBondContact O-N 2.91Å; L287-F290 WeakPolarHBondContact O-CB 3.33Å; L287-F290 PolarHBondContact O-N 3.44Å; L287-V291 PolarHBondContact O-N 3.46Å; L287-F470 HydrophobicContact CB-CD2 3.96Å; L287-F470 HydrophobicContact CB-CE1 4.28Å; L287-F470 HydrophobicContact CB-CE2 3.34Å; L287-F470 HydrophobicContact CB-CZ 3.5Å; L287-F470 VanDerWaalsContact CB-CZ 3.5Å; L287-F470 WeakPolarHBondContact O-CE2 3.38Å; L287-F470 WeakPolarHBondContact O-CZ 3.13Å
288	T	60.8	Low	65.4	Low	21 Å²	21	68.5 Å²	68.5	13%	0.129	35%	0.354	C	S	.	.	H	α-helix	trans	-71.7	-36.4	179.5	-58	0	0	0	0	111.8	D284 F290 V291 Q292 Y469	D284-T288 WeakPolarHBondContact O-CA 3.26Å; D284-T288 WeakPolarHBondContact O-CB 3.2Å; D284-T288 PolarHBondContact O-N 3.32Å; D284-T288 PolarHBondContact O-OG1 3.21Å; T288-F290 PolarHBondContact O-N 2.94Å; T288-V291 PolarHBondContact O-N 3.48Å; T288-Q292 HydrophobicContact CG2-CG 4.31Å; T288-Q292 WeakPolarHBondContact O-CB 3.27Å; T288-Q292 WeakPolarHBondContact O-CG 3.47Å; T288-Q292 PolarHBondContact O-N 3.09Å; T288-Y469 HydrophobicContact CG2-CD2 3.48Å; T288-Y469 VanDerWaalsContact CG2-CD2 3.48Å; T288-Y469 HydrophobicContact CG2-CE2 3.65Å
289	K	63.7	Low	65.3	Low	117 Å²	117	64.7 Å²	64.7	51%	0.509	34%	0.337	S	S	.	.	H	α-helix	trans	-57.5	-39.8	170.9	-73.2	-173.2	-179.5	-175.1	0	111.6	S285 Q292 E293	S285-K289 WeakPolarHBondContact O-CD 3.35Å; S285-K289 WeakPolarHBondContact O-CG 3.48Å; K289-Q292 PolarHBondContact O-N 3.36Å; K289-E293 VanDerWaalsContact O-CB 3.26Å; K289-E293 WeakPolarHBondContact O-CB 2.99Å; K289-E293 VanDerWaalsContact O-CG 3.23Å; K289-E293 WeakPolarHBondContact O-CG 3.49Å; K289-E293 PolarHBondContact O-N 3.13Å
290	F	63.3	Low	65.3	Low	9 Å²	9	65.3 Å²	65.3	4%	0.039	34%	0.341	C	S	.	.	H	α-helix	trans	-62.3	-46.1	177	174.9	-120.1	0	0	0	112.8	L287 T288 Q292 E293 K294 V300 E303 L317 L320	L287-F290 WeakPolarHBondContact O-CB 3.33Å; L287-F290 PolarHBondContact O-N 3.44Å; T288-F290 PolarHBondContact O-N 2.94Å; F290-Q292 VanDerWaalsContact C-N 3.32Å; F290-Q292 PolarHBondContact O-N 3.4Å; F290-E293 PolarHBondContact O-N 3.44Å; F290-K294 HydrophobicContact CZ-CD 4.38Å; F290-K294 WeakPolarHBondContact O-CB 3.45Å; F290-K294 PolarHBondContact O-N 2.86Å; F290-V300 HydrophobicContact CD1-CG2 4.18Å; F290-V300 HydrophobicContact CE1-CG1 4.33Å; F290-V300 HydrophobicContact CE1-CG2 4.07Å; F290-E303 WeakPolarHBondContact CZ-OE2 3.4Å; F290-L317 HydrophobicContact CE1-CD1 4.44Å; F290-L317 HydrophobicContact CZ-CD1 4.05Å; F290-L320 HydrophobicContact CB-CD1 3.65Å; F290-L320 HydrophobicContact CB-CD2 3.98Å; F290-L320 HydrophobicContact CB-CG 4.4Å; F290-L320 HydrophobicContact CD1-CD2 3.76Å; F290-L320 HydrophobicContact CD2-CB 3.82Å; F290-L320 HydrophobicContact CD2-CD1 3.56Å; F290-L320 HydrophobicContact CD2-CD2 3.42Å; F290-L320 VanDerWaalsContact CD2-CD2 3.42Å; F290-L320 HydrophobicContact CD2-CG 3.74Å; F290-L320 HydrophobicContact CE1-CD2 4.02Å; F290-L320 HydrophobicContact CE2-CB 3.84Å; F290-L320 HydrophobicContact CE2-CD1 4.42Å; F290-L320 HydrophobicContact CE2-CD2 3.68Å; F290-L320 HydrophobicContact CE2-CG 4.15Å; F290-L320 HydrophobicContact CG-CD1 3.81Å; F290-L320 HydrophobicContact CG-CD2 3.42Å; F290-L320 VanDerWaalsContact CG-CD2 3.42Å; F290-L320 HydrophobicContact CG-CG 4.09Å; F290-L320 HydrophobicContact CZ-CD2 3.96Å
291	V	61.7	Low	65.8	Low	29 Å²	29	65.2 Å²	65.2	18%	0.176	34%	0.34	C	S	.	.	H	α-helix	trans	-67	-36	-179.8	-179.3	0	0	0	0	111.6	L287 T288 V300 Y469 F470	L287-V291 PolarHBondContact O-N 3.46Å; T288-V291 PolarHBondContact O-N 3.48Å; V291-V300 HydrophobicContact CG2-CG2 3.45Å; V291-V300 VanDerWaalsContact CG2-CG2 3.45Å; V291-Y469 HydrophobicContact CB-CD1 4.08Å; V291-Y469 HydrophobicContact CB-CE1 4.45Å; V291-Y469 HydrophobicContact CB-CG 4.14Å; V291-Y469 HydrophobicContact CG1-CD1 3.31Å; V291-Y469 HydrophobicContact CG1-CE1 3.57Å; V291-Y469 HydrophobicContact CG1-CG 3.87Å; V291-Y469 HydrophobicContact CG2-CG 4.49Å; V291-F470 HydrophobicContact CG2-CE1 4.11Å; V291-F470 HydrophobicContact CG2-CE2 4.11Å; V291-F470 HydrophobicContact CG2-CZ 3.38Å
292	Q	62.5	Low	66.2	Low	121 Å²	121	62.9 Å²	62.9	57%	0.565	33%	0.33	S	S	*	.	H	α-helix	trans	-75.9	-31.3	179.4	-70.2	178	-13.3	0	0	113.4	T288 K289 F290 K294 Y469	T288-Q292 HydrophobicContact CG2-CG 4.31Å; T288-Q292 WeakPolarHBondContact O-CB 3.27Å; T288-Q292 WeakPolarHBondContact O-CG 3.47Å; T288-Q292 PolarHBondContact O-N 3.09Å; K289-Q292 PolarHBondContact O-N 3.36Å; F290-Q292 VanDerWaalsContact C-N 3.32Å; F290-Q292 PolarHBondContact O-N 3.4Å; Q292-K294 VanDerWaalsContact C-N 3.35Å; Q292-Y469 HydrophobicContact CG-CE2 3.99Å
293	E	63.5	Low	66.7	Low	119 Å²	119	61.1 Å²	61.1	56%	0.556	32%	0.322	S	S	*	.	H	α-helix	trans	-84.7	-9.4	178.9	-71.3	174.1	-174	0	0	113	K289 F290 Q324	K289-E293 VanDerWaalsContact O-CB 3.26Å; K289-E293 WeakPolarHBondContact O-CB 2.99Å; K289-E293 VanDerWaalsContact O-CG 3.23Å; K289-E293 WeakPolarHBondContact O-CG 3.49Å; K289-E293 PolarHBondContact O-N 3.13Å; F290-E293 PolarHBondContact O-N 3.44Å; E293-Q324 PolarHBondContact OE2-NE2 2.84Å
294	K	62.2	Low	67.5	Low	30 Å²	30	60.9 Å²	60.9	13%	0.13	32%	0.321	C	S	.	.			trans	-75.6	137.9	-179.5	-144.6	-175.8	-173.6	-155.9	0	111.8	F290 Q292 T296 T298 E303 E316	F290-K294 HydrophobicContact CZ-CD 4.38Å; F290-K294 WeakPolarHBondContact O-CB 3.45Å; F290-K294 PolarHBondContact O-N 2.86Å; Q292-K294 VanDerWaalsContact C-N 3.35Å; K294-T296 WeakPolarHBondContact CD-OG1 3.26Å; K294-T296 WeakPolarHBondContact CE-OG1 3.5Å; K294-T296 WeakPolarHBondContact CG-OG1 3.41Å; K294-T296 PolarHBondContact NZ-OG1 2.87Å; K294-T298 PolarHBondContact NZ-O 3.39Å; K294-E303 WeakPolarHBondContact CE-OE1 3.48Å; K294-E303 WeakPolarHBondContact CE-OE2 3.35Å; K294-E303 IonicContact NZ-OE1 2.66Å; K294-E303 PolarHBondContact NZ-OE1 3.13Å; K294-E303 IonicContact NZ-OE2 3.66Å; K294-E303 PolarHBondContact NZ-OE2 3.49Å; K294-E316 VanDerWaalsContact CE-OE2 3.26Å; K294-E316 WeakPolarHBondContact CE-OE2 3.25Å; K294-E316 VanDerWaalsContact CG-OE2 3.25Å; K294-E316 WeakPolarHBondContact CG-OE2 3.28Å
295	T	54	Low	68.7	Low	132 Å²	132	61.2 Å²	61.2	81%	0.81	32%	0.322	S	S	*	.			trans	-101.4	-3	175.4	44.9	0	0	0	0	113.8	E316	T295-E316 PolarHBondContact OG1-OE1 3.44Å
296	T	59.7	Low	69.7	Low	62 Å²	62	62.8 Å²	62.8	38%	0.38	32%	0.323	S	S	.	.	S	Bend	trans	-99	152.1	-176.5	52.6	0	0	0	0	112.9	K294 T298 E316	K294-T296 WeakPolarHBondContact CD-OG1 3.26Å; K294-T296 WeakPolarHBondContact CE-OG1 3.5Å; K294-T296 WeakPolarHBondContact CG-OG1 3.41Å; K294-T296 PolarHBondContact NZ-OG1 2.87Å; T296-T298 VanDerWaalsContact C-N 3.26Å; T296-T298 PolarHBondContact O-N 3.45Å; T296-E316 WeakPolarHBondContact CG2-OE1 3.46Å; T296-E316 WeakPolarHBondContact CG2-OE2 3.38Å; T296-E316 PolarHBondContact OG1-OE2 3.48Å
297	T	65.1	Low	70.7	Confident	149 Å²	149	56.3 Å²	56.3	91%	0.914	30%	0.299	S	S	*	.	S	Bend	trans	-81.4	4	-179.3	55.5	0	0	0	0	114.3
298	T	68.4	Low	71.9	Confident	65 Å²	65	56.3 Å²	56.3	40%	0.399	30%	0.299	S	S	.	.			trans	-86.9	131.6	-173.3	-40.7	0	0	0	0	110.6	K294 T296 D302 E303	K294-T298 PolarHBondContact NZ-O 3.39Å; T296-T298 VanDerWaalsContact C-N 3.26Å; T296-T298 PolarHBondContact O-N 3.45Å; T298-D302 HydrophobicContact CG2-CB 3.77Å; T298-E303 HydrophobicContact CG2-CG 4.11Å
299	S	72.4	Confident	73.2	Confident	11 Å²	11	61.2 Å²	61.2	8%	0.077	32%	0.323	C	S	.	.			trans	-61.5	155.8	178	81.6	0	0	0	0	111.9	Q301 D302 E303 E458	S299-Q301 VanDerWaalsContact C-N 3.25Å; S299-Q301 PolarHBondContact O-N 2.96Å; S299-D302 PolarHBondContact O-N 3Å; S299-D302 WeakPolarHBondContact OG-CB 3.46Å; S299-D302 PolarHBondContact OG-N 3.11Å; S299-D302 PolarHBondContact OG-OD2 3.43Å; S299-E303 PolarHBondContact O-N 2.88Å; S299-E458 WeakPolarHBondContact CB-OE1 3.45Å
300	V	75.2	Confident	74.3	Confident	15 Å²	15	64.3 Å²	64.3	9%	0.091	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-36.1	175	-179.6	0	0	0	0	110.8	F290 V291 D302 E303 F304 F456 F470	F290-V300 HydrophobicContact CD1-CG2 4.18Å; F290-V300 HydrophobicContact CE1-CG1 4.33Å; F290-V300 HydrophobicContact CE1-CG2 4.07Å; V291-V300 HydrophobicContact CG2-CG2 3.45Å; V291-V300 VanDerWaalsContact CG2-CG2 3.45Å; V300-D302 PolarHBondContact O-N 3.34Å; V300-E303 PolarHBondContact O-N 3.49Å; V300-F304 HydrophobicContact CG1-CD2 3.58Å; V300-F304 HydrophobicContact CG1-CE2 3.62Å; V300-F304 WeakPolarHBondContact O-CD2 3.34Å; V300-F304 PolarHBondContact O-N 3.16Å; V300-F456 HydrophobicContact CB-CD1 3.91Å; V300-F456 HydrophobicContact CB-CE1 4.46Å; V300-F456 HydrophobicContact CG1-CD1 3.45Å; V300-F456 VanDerWaalsContact CG1-CD1 3.45Å; V300-F456 HydrophobicContact CG1-CE1 3.58Å; V300-F456 HydrophobicContact CG1-CG 4.43Å; V300-F470 HydrophobicContact CB-CE1 4.16Å; V300-F470 HydrophobicContact CG1-CE1 4.08Å; V300-F470 HydrophobicContact CG2-CE1 3.98Å; V300-F470 HydrophobicContact CG2-CZ 4.31Å
301	Q	79.1	Confident	75.2	Confident	29 Å²	29	66.6 Å²	66.6	14%	0.136	36%	0.358	C	S	.	.	H	α-helix	trans	-57.5	-50	175.5	-178.3	-177.7	-9.9	0	0	111.5	S299 E303 F304 M305 F456 N457	S299-Q301 VanDerWaalsContact C-N 3.25Å; S299-Q301 PolarHBondContact O-N 2.96Å; Q301-E303 VanDerWaalsContact C-N 3.31Å; Q301-E303 PolarHBondContact O-N 3.49Å; Q301-F304 PolarHBondContact O-N 3.08Å; Q301-M305 WeakPolarHBondContact O-CB 3Å; Q301-M305 PolarHBondContact O-N 2.78Å; Q301-F456 HydrophobicContact CB-CB 3.69Å; Q301-F456 WeakPolarHBondContact CB-O 3.44Å; Q301-F456 HydrophobicContact CG-CB 4.35Å; Q301-F456 PolarHBondContact OE1-O 2.83Å; Q301-N457 VanDerWaalsContact OE1-CA 3.28Å
302	D	81.1	Confident	76.1	Confident	88 Å²	88	72.5 Å²	72.5	47%	0.471	38%	0.381	S	S	.	.	H	α-helix	trans	-64.1	-37.5	-175.2	-67.3	-39	0	0	0	111.8	T298 S299 V300 M305 H306	T298-D302 HydrophobicContact CG2-CB 3.77Å; S299-D302 PolarHBondContact O-N 3Å; S299-D302 WeakPolarHBondContact OG-CB 3.46Å; S299-D302 PolarHBondContact OG-N 3.11Å; S299-D302 PolarHBondContact OG-OD2 3.43Å; V300-D302 PolarHBondContact O-N 3.34Å; D302-M305 PolarHBondContact O-N 2.61Å; D302-H306 VanDerWaalsContact O-CB 3.22Å; D302-H306 WeakPolarHBondContact O-CB 3.49Å; D302-H306 PolarHBondContact O-N 2.83Å
303	E	81.3	Confident	77.1	Confident	16 Å²	16	67.9 Å²	67.9	8%	0.075	36%	0.364	C	S	.	.	H	α-helix	trans	-67.8	-45.5	177.2	-71.5	-159.9	150.6	0	0	113.2	F290 K294 T298 S299 V300 Q301 M305 H306 L307 S314 L317	F290-E303 WeakPolarHBondContact CZ-OE2 3.4Å; K294-E303 WeakPolarHBondContact CE-OE1 3.48Å; K294-E303 WeakPolarHBondContact CE-OE2 3.35Å; K294-E303 IonicContact NZ-OE1 2.66Å; K294-E303 PolarHBondContact NZ-OE1 3.13Å; K294-E303 IonicContact NZ-OE2 3.66Å; K294-E303 PolarHBondContact NZ-OE2 3.49Å; T298-E303 HydrophobicContact CG2-CG 4.11Å; S299-E303 PolarHBondContact O-N 2.88Å; V300-E303 PolarHBondContact O-N 3.49Å; Q301-E303 VanDerWaalsContact C-N 3.31Å; Q301-E303 PolarHBondContact O-N 3.49Å; E303-M305 VanDerWaalsContact C-N 3.33Å; E303-H306 PolarHBondContact O-N 3.44Å; E303-L307 PolarHBondContact O-N 3.07Å; E303-S314 PolarHBondContact OE1-OG 3.23Å; E303-L317 HydrophobicContact CB-CD2 4.27Å
304	F	84.7	Confident	78	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.018	35%	0.351	C	S	.	.	H	α-helix	trans	-69	-33.9	176.4	-82.7	-77.2	0	0	0	111.8	V300 Q301 L307 L308 L317 F417 W420 L421 L452	V300-F304 HydrophobicContact CG1-CD2 3.58Å; V300-F304 HydrophobicContact CG1-CE2 3.62Å; V300-F304 WeakPolarHBondContact O-CD2 3.34Å; V300-F304 PolarHBondContact O-N 3.16Å; Q301-F304 PolarHBondContact O-N 3.08Å; F304-L307 PolarHBondContact O-N 2.74Å; F304-L308 WeakPolarHBondContact O-CB 3.41Å; F304-L308 PolarHBondContact O-N 2.76Å; F304-L317 HydrophobicContact CD2-CD1 4.47Å; F304-L317 HydrophobicContact CE1-CD1 4.14Å; F304-L317 HydrophobicContact CE2-CD1 3.91Å; F304-L317 HydrophobicContact CZ-CD1 3.73Å; F304-F417 HydrophobicContact CD1-CE2 4.4Å; F304-F417 HydrophobicContact CE1-CZ 4.36Å; F304-W420 AromaticContact CD1-CH2 3.96Å; F304-W420 HydrophobicContact CD1-CH2 3.96Å; F304-W420 AromaticContact CD1-CZ3 4Å; F304-W420 HydrophobicContact CD1-CZ3 4Å; F304-L421 HydrophobicContact CD1-CD1 4.5Å; F304-L421 HydrophobicContact CE1-CD1 3.86Å; F304-L421 HydrophobicContact CE1-CD2 4.23Å; F304-L452 HydrophobicContact CB-CD1 3.89Å; F304-L452 HydrophobicContact CB-CD2 3.51Å; F304-L452 HydrophobicContact CB-CG 4.36Å; F304-L452 HydrophobicContact CG-CD2 4.12Å
305	M	87	Confident	78.8	Confident	36 Å²	36	66.5 Å²	66.5	18%	0.177	38%	0.376	C	S	.	.	H	α-helix	trans	-68.8	-39.3	175.3	-163	64.2	69.9	0	0	111.2	Q301 D302 E303 L307 L308 L309 A449 L452	Q301-M305 WeakPolarHBondContact O-CB 3Å; Q301-M305 PolarHBondContact O-N 2.78Å; D302-M305 PolarHBondContact O-N 2.61Å; E303-M305 VanDerWaalsContact C-N 3.33Å; M305-L307 VanDerWaalsContact C-N 3.34Å; M305-L308 PolarHBondContact O-N 2.76Å; M305-L308 HydrophobicContact SD-CD2 4Å; M305-L309 HydrophobicContact CG-CD1 4.05Å; M305-L309 WeakPolarHBondContact O-CB 3.3Å; M305-L309 WeakPolarHBondContact O-CG 3.41Å; M305-L309 PolarHBondContact O-N 2.73Å; M305-A449 HydrophobicContact CE-CB 4.5Å; M305-A449 HydrophobicContact SD-CB 4.47Å; M305-L452 HydrophobicContact CE-CB 3.63Å; M305-L452 HydrophobicContact CE-CD1 3.97Å; M305-L452 HydrophobicContact CE-CG 4.47Å; M305-L452 HydrophobicContact SD-CD1 4.21Å
306	H	86.6	Confident	79.9	Confident	92 Å²	92	62.6 Å²	62.6	43%	0.426	35%	0.349	S	S	.	.	H	α-helix	trans	-64.1	-40.5	173.6	-169.4	-82.3	0	0	0	111.4	D302 E303 L308 W310 K312	D302-H306 VanDerWaalsContact O-CB 3.22Å; D302-H306 WeakPolarHBondContact O-CB 3.49Å; D302-H306 PolarHBondContact O-N 2.83Å; E303-H306 PolarHBondContact O-N 3.44Å; H306-L308 VanDerWaalsContact C-N 3.35Å; H306-W310 AromaticContact CD2-CD1 3.47Å; H306-W310 VanDerWaalsContact CD2-CD1 3.47Å; H306-W310 AromaticContact CD2-NE1 3.91Å; H306-W310 AromaticContact CE1-CD1 3.88Å; H306-W310 AromaticContact CG-CD1 3.77Å; H306-W310 AromaticContact NE2-CD1 3.55Å; H306-W310 WeakPolarHBondContact O-CB 3.49Å; H306-W310 PolarHBondContact O-N 2.97Å; H306-K312 PolarHBondContact ND1-O 3.23Å
307	L	88.6	Confident	80.9	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.042	33%	0.331	C	S	.	.	H	α-helix	trans	-61.7	-41.8	172.3	177.2	60.4	0	0	0	111.8	E303 F304 M305 G311 A313 L317 L321 W420	E303-L307 PolarHBondContact O-N 3.07Å; F304-L307 PolarHBondContact O-N 2.74Å; M305-L307 VanDerWaalsContact C-N 3.34Å; L307-G311 WeakPolarHBondContact O-CA 3.23Å; L307-G311 PolarHBondContact O-N 3.12Å; L307-A313 HydrophobicContact CD1-CB 4.1Å; L307-L317 HydrophobicContact CB-CD2 4.3Å; L307-L317 HydrophobicContact CD2-CD2 4Å; L307-L321 HydrophobicContact CD2-CD1 4.37Å; L307-W420 HydrophobicContact CB-CZ2 4.42Å; L307-W420 HydrophobicContact CD2-CH2 4.1Å; L307-W420 HydrophobicContact CD2-CZ2 4.18Å; L307-W420 HydrophobicContact CG-CH2 4.25Å; L307-W420 HydrophobicContact CG-CZ2 3.96Å
308	L	88.2	Confident	81.7	Confident	30 Å²	30	56.8 Å²	56.8	16%	0.157	31%	0.307	C	S	.	.	H	α-helix	trans	-64.6	-45.2	179.3	-177.5	66.1	0	0	0	112.2	F304 M305 H306 W420 I445 V448 A449 L452	F304-L308 WeakPolarHBondContact O-CB 3.41Å; F304-L308 PolarHBondContact O-N 2.76Å; M305-L308 PolarHBondContact O-N 2.76Å; M305-L308 HydrophobicContact SD-CD2 4Å; H306-L308 VanDerWaalsContact C-N 3.35Å; L308-W420 HydrophobicContact CB-CH2 4.25Å; L308-W420 HydrophobicContact CB-CZ2 3.71Å; L308-W420 HydrophobicContact CD1-CD2 4.09Å; L308-W420 VanDerWaalsContact CD1-CE2 3.47Å; L308-W420 HydrophobicContact CD1-CG 4.3Å; L308-W420 HydrophobicContact CD1-CZ2 3.81Å; L308-W420 VanDerWaalsContact CD1-NE1 3.31Å; L308-W420 HydrophobicContact CG-CZ2 4.38Å; L308-I445 HydrophobicContact CD1-CG2 4.4Å; L308-V448 HydrophobicContact CD1-CB 4.41Å; L308-V448 HydrophobicContact CD1-CG1 3.93Å; L308-V448 HydrophobicContact CD2-CB 4.38Å; L308-V448 HydrophobicContact CD2-CG1 3.97Å; L308-A449 HydrophobicContact CD2-CB 4.16Å; L308-L452 HydrophobicContact CD2-CD1 4.26Å
309	L	87.9	Confident	82.2	Confident	123 Å²	123	57.2 Å²	57.2	64%	0.644	31%	0.31	S	S	*	.	H	α-helix	trans	-79.2	-40	-175	-67.9	171.7	0	0	0	113	M305	M305-L309 HydrophobicContact CG-CD1 4.05Å; M305-L309 WeakPolarHBondContact O-CB 3.3Å; M305-L309 WeakPolarHBondContact O-CG 3.41Å; M305-L309 PolarHBondContact O-N 2.73Å
310	W	87.4	Confident	82.4	Confident	183 Å²	183	57.4 Å²	57.4	69%	0.693	31%	0.309	S	S	*	.	H	α-helix	trans	-112.5	-10.7	-169	-55.9	97.2	0	0	0	113.9	H306 K312	H306-W310 AromaticContact CD2-CD1 3.47Å; H306-W310 VanDerWaalsContact CD2-CD1 3.47Å; H306-W310 AromaticContact CD2-NE1 3.91Å; H306-W310 AromaticContact CE1-CD1 3.88Å; H306-W310 AromaticContact CG-CD1 3.77Å; H306-W310 AromaticContact NE2-CD1 3.55Å; H306-W310 WeakPolarHBondContact O-CB 3.49Å; H306-W310 PolarHBondContact O-N 2.97Å; W310-K312 PolarHBondContact O-N 3.38Å
311	G	82.8	Confident	82.6	Confident	57 Å²	57	56.7 Å²	56.7	59%	0.588	31%	0.305	S	S	*	.	S	Bend	trans	68.3	9.4	-177.8	0	0	0	0	0	114.5	L307	L307-G311 WeakPolarHBondContact O-CA 3.23Å; L307-G311 PolarHBondContact O-N 3.12Å
312	K	80.5	Confident	82.7	Confident	152 Å²	152	57.2 Å²	57.2	66%	0.661	31%	0.308	S	S	*	.			trans	-112.9	113.6	-179.5	-67	-174	179.2	-177.9	0	110.2	H306 W310	H306-K312 PolarHBondContact ND1-O 3.23Å; W310-K312 PolarHBondContact O-N 3.38Å
313	A	82.8	Confident	82.5	Confident	24 Å²	24	58.7 Å²	58.7	20%	0.198	32%	0.316	C	S	.	.			trans	-77.5	150.8	170.9	0	0	0	0	0	110.9	L307 L317 Q318 M428	L307-A313 HydrophobicContact CD1-CB 4.1Å; A313-L317 HydrophobicContact CB-CB 4.43Å; A313-L317 HydrophobicContact CB-CD2 4.19Å; A313-L317 HydrophobicContact CB-CG 4.47Å; A313-Q318 HydrophobicContact CB-CB 4.27Å; A313-M428 HydrophobicContact CB-CE 3.44Å; A313-M428 VanDerWaalsContact CB-CE 3.44Å; A313-M428 HydrophobicContact CB-SD 4.3Å
314	S	82.8	Confident	82.2	Confident	40 Å²	40	61.9 Å²	61.9	28%	0.28	33%	0.331	S	S	.	.			trans	-68.2	159.4	165.1	67.4	0	0	0	0	110.2	E303 E316 L317 Q318	E303-S314 PolarHBondContact OE1-OG 3.23Å; S314-E316 PolarHBondContact O-N 3.06Å; S314-L317 PolarHBondContact O-N 3.03Å; S314-L317 VanDerWaalsContact OG-CB 3.29Å; S314-L317 WeakPolarHBondContact OG-CB 3.44Å; S314-L317 PolarHBondContact OG-N 3.45Å; S314-L317 VanDerWaalsContact OG-N 3.15Å; S314-Q318 WeakPolarHBondContact O-CB 3.36Å; S314-Q318 PolarHBondContact O-N 3.19Å
315	A	80.2	Confident	81.8	Confident	80 Å²	80	63.1 Å²	63.1	66%	0.661	34%	0.338	S	S	*	.	H	α-helix	trans	-58.9	-36.6	177.8	0	0	0	0	0	111.8	T319	A315-T319 PolarHBondContact O-N 3.49Å; A315-T319 PolarHBondContact O-OG1 3.46Å
316	E	77	Confident	81.6	Confident	51 Å²	51	64 Å²	64	24%	0.238	35%	0.345	C	S	.	.	H	α-helix	trans	-69.2	-44.5	177.7	-59.9	179.9	159.4	0	0	112.2	K294 T295 T296 S314 Q318 T319 L320	K294-E316 VanDerWaalsContact CE-OE2 3.26Å; K294-E316 WeakPolarHBondContact CE-OE2 3.25Å; K294-E316 VanDerWaalsContact CG-OE2 3.25Å; K294-E316 WeakPolarHBondContact CG-OE2 3.28Å; T295-E316 PolarHBondContact OG1-OE1 3.44Å; T296-E316 WeakPolarHBondContact CG2-OE1 3.46Å; T296-E316 WeakPolarHBondContact CG2-OE2 3.38Å; T296-E316 PolarHBondContact OG1-OE2 3.48Å; S314-E316 PolarHBondContact O-N 3.06Å; E316-Q318 VanDerWaalsContact C-N 3.33Å; E316-Q318 PolarHBondContact O-N 3.36Å; E316-T319 WeakPolarHBondContact CA-OG1 3.44Å; E316-T319 PolarHBondContact O-N 3.24Å; E316-T319 PolarHBondContact O-OG1 3.4Å; E316-L320 PolarHBondContact O-N 3.35Å
317	L	79.4	Confident	81.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66.7	-36.9	176.3	-175.9	65.6	0	0	0	111.3	F290 E303 F304 L307 A313 S314 L320 L321	F290-L317 HydrophobicContact CE1-CD1 4.44Å; F290-L317 HydrophobicContact CZ-CD1 4.05Å; E303-L317 HydrophobicContact CB-CD2 4.27Å; F304-L317 HydrophobicContact CD2-CD1 4.47Å; F304-L317 HydrophobicContact CE1-CD1 4.14Å; F304-L317 HydrophobicContact CE2-CD1 3.91Å; F304-L317 HydrophobicContact CZ-CD1 3.73Å; L307-L317 HydrophobicContact CB-CD2 4.3Å; L307-L317 HydrophobicContact CD2-CD2 4Å; A313-L317 HydrophobicContact CB-CB 4.43Å; A313-L317 HydrophobicContact CB-CD2 4.19Å; A313-L317 HydrophobicContact CB-CG 4.47Å; S314-L317 PolarHBondContact O-N 3.03Å; S314-L317 VanDerWaalsContact OG-CB 3.29Å; S314-L317 WeakPolarHBondContact OG-CB 3.44Å; S314-L317 PolarHBondContact OG-N 3.45Å; S314-L317 VanDerWaalsContact OG-N 3.15Å; L317-L320 HydrophobicContact CD1-CD2 4.21Å; L317-L320 PolarHBondContact O-N 3.2Å; L317-L321 HydrophobicContact CD1-CD1 4.31Å; L317-L321 HydrophobicContact CD1-CG 4.36Å; L317-L321 HydrophobicContact CG-CD1 4.02Å; L317-L321 HydrophobicContact CG-CG 4.45Å; L317-L321 WeakPolarHBondContact O-CB 3.45Å; L317-L321 VanDerWaalsContact O-CG 3.28Å; L317-L321 WeakPolarHBondContact O-CG 3.4Å; L317-L321 PolarHBondContact O-N 2.92Å
318	Q	81.6	Confident	81.1	Confident	88 Å²	88	69.4 Å²	69.4	41%	0.411	37%	0.37	S	S	.	.	H	α-helix	trans	-66.6	-44.2	177.1	-179	165.4	6.1	0	0	111.9	A313 S314 E316 L320 L321 M322 M428	A313-Q318 HydrophobicContact CB-CB 4.27Å; S314-Q318 WeakPolarHBondContact O-CB 3.36Å; S314-Q318 PolarHBondContact O-N 3.19Å; E316-Q318 VanDerWaalsContact C-N 3.33Å; E316-Q318 PolarHBondContact O-N 3.36Å; Q318-L320 VanDerWaalsContact C-N 3.34Å; Q318-L321 PolarHBondContact O-N 3.14Å; Q318-M322 HydrophobicContact CG-CG 4.36Å; Q318-M322 WeakPolarHBondContact O-CB 3.41Å; Q318-M322 VanDerWaalsContact O-CG 3.25Å; Q318-M322 WeakPolarHBondContact O-CG 3.45Å; Q318-M322 PolarHBondContact O-N 2.91Å; Q318-M428 HydrophobicContact CB-CE 3.76Å; Q318-M428 HydrophobicContact CG-CE 3.56Å
319	T	79.1	Confident	80.8	Confident	75 Å²	75	69.2 Å²	69.2	46%	0.46	38%	0.375	S	S	.	.	H	α-helix	trans	-64.5	-37.7	174.3	34.5	0	0	0	0	112.2	A315 E316 N323	A315-T319 PolarHBondContact O-N 3.49Å; A315-T319 PolarHBondContact O-OG1 3.46Å; E316-T319 WeakPolarHBondContact CA-OG1 3.44Å; E316-T319 PolarHBondContact O-N 3.24Å; E316-T319 PolarHBondContact O-OG1 3.4Å; T319-N323 WeakPolarHBondContact O-CB 3.34Å; T319-N323 PolarHBondContact O-N 3.26Å
320	L	77.5	Confident	80.6	Confident	14 Å²	14	63.5 Å²	63.5	7%	0.073	35%	0.345	C	S	.	.	I	π-helix	trans	-58.3	-56.6	173.7	176.7	74.7	0	0	0	111.5	F290 E316 L317 Q318 M322 Q324 L325	F290-L320 HydrophobicContact CB-CD1 3.65Å; F290-L320 HydrophobicContact CB-CD2 3.98Å; F290-L320 HydrophobicContact CB-CG 4.4Å; F290-L320 HydrophobicContact CD1-CD2 3.76Å; F290-L320 HydrophobicContact CD2-CB 3.82Å; F290-L320 HydrophobicContact CD2-CD1 3.56Å; F290-L320 HydrophobicContact CD2-CD2 3.42Å; F290-L320 VanDerWaalsContact CD2-CD2 3.42Å; F290-L320 HydrophobicContact CD2-CG 3.74Å; F290-L320 HydrophobicContact CE1-CD2 4.02Å; F290-L320 HydrophobicContact CE2-CB 3.84Å; F290-L320 HydrophobicContact CE2-CD1 4.42Å; F290-L320 HydrophobicContact CE2-CD2 3.68Å; F290-L320 HydrophobicContact CE2-CG 4.15Å; F290-L320 HydrophobicContact CG-CD1 3.81Å; F290-L320 HydrophobicContact CG-CD2 3.42Å; F290-L320 VanDerWaalsContact CG-CD2 3.42Å; F290-L320 HydrophobicContact CG-CG 4.09Å; F290-L320 HydrophobicContact CZ-CD2 3.96Å; E316-L320 PolarHBondContact O-N 3.35Å; L317-L320 HydrophobicContact CD1-CD2 4.21Å; L317-L320 PolarHBondContact O-N 3.2Å; Q318-L320 VanDerWaalsContact C-N 3.34Å; L320-M322 VanDerWaalsContact C-N 3.32Å; L320-M322 PolarHBondContact O-N 2.92Å; L320-Q324 HydrophobicContact CD1-CB 4.2Å; L320-Q324 VanDerWaalsContact CD1-OE1 3.32Å; L320-Q324 PolarHBondContact O-N 3.25Å; L320-Q324 VanDerWaalsContact O-N 3.1Å; L320-L325 PolarHBondContact O-N 3.01Å
321	L	78.8	Confident	80.4	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	33%	0.334	C	S	.	.	I	π-helix	trans	-62.9	-41.1	-174.2	-69.4	173.8	0	0	0	110.8	L307 L317 Q318 L325 T326 L421 M425	L307-L321 HydrophobicContact CD2-CD1 4.37Å; L317-L321 HydrophobicContact CD1-CD1 4.31Å; L317-L321 HydrophobicContact CD1-CG 4.36Å; L317-L321 HydrophobicContact CG-CD1 4.02Å; L317-L321 HydrophobicContact CG-CG 4.45Å; L317-L321 WeakPolarHBondContact O-CB 3.45Å; L317-L321 VanDerWaalsContact O-CG 3.28Å; L317-L321 WeakPolarHBondContact O-CG 3.4Å; L317-L321 PolarHBondContact O-N 2.92Å; Q318-L321 PolarHBondContact O-N 3.14Å; L321-L325 HydrophobicContact CD2-CD2 4.02Å; L321-T326 WeakPolarHBondContact O-CA 3.37Å; L321-T326 PolarHBondContact O-N 2.88Å; L321-L421 HydrophobicContact CD1-CD1 4.07Å; L321-L421 HydrophobicContact CD2-CD1 3.91Å; L321-L421 HydrophobicContact CD2-CD2 4.21Å; L321-L421 HydrophobicContact CD2-CG 4.38Å; L321-M425 HydrophobicContact CB-CE 4.13Å; L321-M425 HydrophobicContact CB-CG 4.24Å; L321-M425 HydrophobicContact CB-SD 4.24Å; L321-M425 HydrophobicContact CD1-CG 4.39Å; L321-M425 HydrophobicContact CD2-CG 4.49Å; L321-M425 HydrophobicContact CD2-SD 4.06Å; L321-M425 WeakPolarHBondContact O-CE 3.17Å
322	M	80.8	Confident	80.5	Confident	40 Å²	40	64.6 Å²	64.6	20%	0.197	34%	0.339	C	S	.	.	I	π-helix	trans	-83.5	-40.6	-174.8	-60.3	-55.5	150.2	0	0	114	Q318 L320 M425 M428 T429	Q318-M322 HydrophobicContact CG-CG 4.36Å; Q318-M322 WeakPolarHBondContact O-CB 3.41Å; Q318-M322 VanDerWaalsContact O-CG 3.25Å; Q318-M322 WeakPolarHBondContact O-CG 3.45Å; Q318-M322 PolarHBondContact O-N 2.91Å; L320-M322 VanDerWaalsContact C-N 3.32Å; L320-M322 PolarHBondContact O-N 2.92Å; M322-M425 HydrophobicContact CE-CB 4.01Å; M322-M425 HydrophobicContact CE-CE 4.43Å; M322-M425 HydrophobicContact CE-CG 4.06Å; M322-M425 HydrophobicContact SD-CE 4.47Å; M322-M428 HydrophobicContact CE-CB 3.53Å; M322-M428 HydrophobicContact CE-CE 4.18Å; M322-M428 HydrophobicContact CE-CG 4.35Å; M322-M428 HydrophobicContact CE-SD 3.98Å; M322-T429 HydrophobicContact CE-CG2 4.14Å; M322-T429 HydrophobicContact SD-CG2 3.41Å; M322-T429 WeakPolarHBondContact SD-CG2 3.33Å
323	N	78.3	Confident	80.6	Confident	119 Å²	119	58.6 Å²	58.6	64%	0.636	31%	0.313	S	S	*	.	I	π-helix	trans	-96.7	-38.4	-171.5	-60.2	-15.1	0	0	0	113.1	T319	T319-N323 WeakPolarHBondContact O-CB 3.34Å; T319-N323 PolarHBondContact O-N 3.26Å
324	Q	74.4	Confident	80.6	Confident	82 Å²	82	58.1 Å²	58.1	38%	0.383	31%	0.311	S	S	.	.	I	π-helix	trans	-97.3	-44.9	-173.9	-63.1	-168.5	-2	0	0	113.1	E293 L320	E293-Q324 PolarHBondContact OE2-NE2 2.84Å; L320-Q324 HydrophobicContact CD1-CB 4.2Å; L320-Q324 VanDerWaalsContact CD1-OE1 3.32Å; L320-Q324 PolarHBondContact O-N 3.25Å; L320-Q324 VanDerWaalsContact O-N 3.1Å
325	L	76.6	Confident	80.7	Confident	30 Å²	30	62.5 Å²	62.5	16%	0.157	33%	0.327	C	S	.	.	I	π-helix	trans	-83.8	-47	-179.6	-168.6	64.3	0	0	0	111.2	L320 L321 G329 L330 L333	L320-L325 PolarHBondContact O-N 3.01Å; L321-L325 HydrophobicContact CD2-CD2 4.02Å; L325-G329 VanDerWaalsContact O-CA 3.22Å; L325-G329 WeakPolarHBondContact O-CA 3.48Å; L325-L330 HydrophobicContact CD2-CB 4.31Å; L325-L330 HydrophobicContact CD2-CD1 3.59Å; L325-L330 HydrophobicContact CG-CB 4.37Å; L325-L330 HydrophobicContact CG-CD1 4.41Å; L325-L333 HydrophobicContact CD1-CD2 4.19Å
326	T	83.1	Confident	80.9	Confident	56 Å²	56	59.9 Å²	59.9	34%	0.344	30%	0.304	S	S	.	.			trans	60.2	156.5	-174.2	76.2	0	0	0	0	113.7	L321 K328 G329 L330	L321-T326 WeakPolarHBondContact O-CA 3.37Å; L321-T326 PolarHBondContact O-N 2.88Å; T326-K328 VanDerWaalsContact C-N 3.28Å; T326-K328 PolarHBondContact O-N 3.03Å; T326-G329 PolarHBondContact O-N 3.48Å; T326-G329 PolarHBondContact OG1-N 3.06Å; T326-L330 PolarHBondContact O-N 3.5Å
327	V	81.6	Confident	81.2	Confident	34 Å²	34	57.6 Å²	57.6	21%	0.206	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-38.1	177.3	179.7	0	0	0	0	111.7	K331 Y422 M425 L426	V327-K331 PolarHBondContact O-N 3.39Å; V327-Y422 HydrophobicContact CG1-CD2 4.11Å; V327-Y422 HydrophobicContact CG1-CE2 3.48Å; V327-Y422 VanDerWaalsContact CG1-CE2 3.48Å; V327-M425 HydrophobicContact CG2-CB 4.28Å; V327-M425 HydrophobicContact CG2-CE 3.95Å; V327-L426 HydrophobicContact CG1-CD2 4.21Å
328	K	82.2	Confident	81.4	Confident	179 Å²	179	61.4 Å²	61.4	78%	0.778	31%	0.311	S	S	*	.	H	α-helix	trans	-71	-40.4	178.4	-171	178.5	-179.5	-179.7	0	111.7	T326 K331 K332	T326-K328 VanDerWaalsContact C-N 3.28Å; T326-K328 PolarHBondContact O-N 3.03Å; K328-K331 PolarHBondContact O-N 2.83Å; K328-K332 PolarHBondContact O-N 2.97Å; K328-K332 VanDerWaalsContact O-N 3.14Å
329	G	82.4	Confident	81.6	Confident	25 Å²	25	60.1 Å²	60.1	26%	0.258	31%	0.312	S	S	.	.	H	α-helix	trans	-67	-37.5	176.5	0	0	0	0	0	112.5	L325 T326 K331 K332 L333	L325-G329 VanDerWaalsContact O-CA 3.22Å; L325-G329 WeakPolarHBondContact O-CA 3.48Å; T326-G329 PolarHBondContact O-N 3.48Å; T326-G329 PolarHBondContact OG1-N 3.06Å; G329-K331 PolarHBondContact O-N 3.35Å; G329-K332 PolarHBondContact O-N 3.29Å; G329-L333 WeakPolarHBondContact O-CB 3.45Å; G329-L333 PolarHBondContact O-N 3.04Å
330	L	83.6	Confident	81.9	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-60	-45.1	173.3	-173.2	76.3	0	0	0	112	L325 T326 K332 L333 G334 F418 L421 Y422 M425	L325-L330 HydrophobicContact CD2-CB 4.31Å; L325-L330 HydrophobicContact CD2-CD1 3.59Å; L325-L330 HydrophobicContact CG-CB 4.37Å; L325-L330 HydrophobicContact CG-CD1 4.41Å; T326-L330 PolarHBondContact O-N 3.5Å; L330-K332 PolarHBondContact O-N 2.94Å; L330-L333 PolarHBondContact O-N 2.91Å; L330-G334 PolarHBondContact O-N 3.43Å; L330-F418 HydrophobicContact CD1-CD1 3.62Å; L330-F418 HydrophobicContact CD1-CE1 3.61Å; L330-F418 HydrophobicContact CG-CD1 4.09Å; L330-F418 HydrophobicContact CG-CE1 4.42Å; L330-L421 HydrophobicContact CD1-CD2 3.74Å; L330-L421 HydrophobicContact CD1-CG 4.26Å; L330-L421 HydrophobicContact CD2-CB 4.3Å; L330-L421 HydrophobicContact CD2-CD2 4.48Å; L330-L421 HydrophobicContact CD2-CG 4.11Å; L330-Y422 HydrophobicContact CD2-CD2 4.27Å; L330-M425 HydrophobicContact CB-SD 4.39Å; L330-M425 HydrophobicContact CD2-SD 3.77Å
331	K	83.4	Confident	82.3	Confident	106 Å²	106	56.3 Å²	56.3	46%	0.461	29%	0.289	S	S	.	.	H	α-helix	trans	-60.3	-45.4	175.8	-77	-168.5	-176.2	-179.5	0	112.1	V327 K328 G329 G334 Q335 Y422	V327-K331 PolarHBondContact O-N 3.39Å; K328-K331 PolarHBondContact O-N 2.83Å; G329-K331 PolarHBondContact O-N 3.35Å; K331-G334 PolarHBondContact O-N 3.01Å; K331-Q335 WeakPolarHBondContact O-CB 3.26Å; K331-Q335 WeakPolarHBondContact O-CG 3.45Å; K331-Q335 PolarHBondContact O-N 3.24Å; K331-Y422 HydrophobicContact CD-CE2 4.11Å; K331-Y422 WeakPolarHBondContact CE-OH 3.29Å; K331-Y422 HydrophobicContact CG-CD2 4.18Å; K331-Y422 HydrophobicContact CG-CE2 3.85Å; K331-Y422 PolarHBondContact NZ-OH 3.29Å
332	K	84.6	Confident	82.8	Confident	157 Å²	157	57.9 Å²	57.9	68%	0.683	30%	0.3	S	S	*	.	H	α-helix	trans	-63.9	-42	179.6	-171.7	178.9	177.6	-177.5	0	111.3	K328 G329 L330 Q335 S336	K328-K332 PolarHBondContact O-N 2.97Å; K328-K332 VanDerWaalsContact O-N 3.14Å; G329-K332 PolarHBondContact O-N 3.29Å; L330-K332 PolarHBondContact O-N 2.94Å; K332-Q335 PolarHBondContact O-N 3.48Å; K332-S336 WeakPolarHBondContact O-CB 3.43Å; K332-S336 PolarHBondContact O-N 3.26Å
333	L	82.8	Confident	83.2	Confident	25 Å²	25	58.6 Å²	58.6	13%	0.131	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-47.8	176.3	-178.3	64.6	0	0	0	111.4	Q282 L325 G329 L330 Q335 S336 I337 F418	Q282-L333 HydrophobicContact CB-CD1 4.15Å; L325-L333 HydrophobicContact CD1-CD2 4.19Å; G329-L333 WeakPolarHBondContact O-CB 3.45Å; G329-L333 PolarHBondContact O-N 3.04Å; L330-L333 PolarHBondContact O-N 2.91Å; L333-Q335 PolarHBondContact O-N 3.48Å; L333-S336 PolarHBondContact O-N 3Å; L333-I337 HydrophobicContact CD1-CD1 3.87Å; L333-I337 HydrophobicContact CD1-CG1 4.32Å; L333-I337 HydrophobicContact CG-CD1 3.87Å; L333-I337 WeakPolarHBondContact O-CG1 3.48Å; L333-I337 PolarHBondContact O-N 2.7Å; L333-F418 HydrophobicContact CD2-CE1 4.09Å; L333-F418 HydrophobicContact CD2-CZ 4.11Å; L333-F418 HydrophobicContact CG-CE1 4.3Å; L333-F418 HydrophobicContact CG-CZ 4.12Å
334	G	82.5	Confident	83.7	Confident	14 Å²	14	53 Å²	53	14%	0.144	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-43.7	177.6	0	0	0	0	0	112.7	L330 K331 E338	L330-G334 PolarHBondContact O-N 3.43Å; K331-G334 PolarHBondContact O-N 3.01Å; G334-E338 WeakPolarHBondContact O-CB 3.22Å; G334-E338 PolarHBondContact O-N 3.26Å
335	Q	86.1	Confident	84.5	Confident	132 Å²	132	51 Å²	51	62%	0.617	27%	0.27	S	S	*	.	H	α-helix	trans	-62.9	-43.6	175.8	-75.4	175.5	-10.6	0	0	112.3	K331 K332 L333 E338 S339	K331-Q335 WeakPolarHBondContact O-CB 3.26Å; K331-Q335 WeakPolarHBondContact O-CG 3.45Å; K331-Q335 PolarHBondContact O-N 3.24Å; K332-Q335 PolarHBondContact O-N 3.48Å; L333-Q335 PolarHBondContact O-N 3.48Å; Q335-E338 PolarHBondContact O-N 3.16Å; Q335-S339 WeakPolarHBondContact O-CB 3.4Å; Q335-S339 PolarHBondContact O-N 2.83Å; Q335-S339 PolarHBondContact O-OG 3.04Å
336	S	83.8	Confident	85.2	Confident	25 Å²	25	55.7 Å²	55.7	18%	0.175	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-46.7	179.1	-161.1	0	0	0	0	111.4	Q282 K332 L333 E338 S339 S340	Q282-S336 PolarHBondContact NE2-OG 3.28Å; Q282-S336 PolarHBondContact OE1-OG 2.89Å; K332-S336 WeakPolarHBondContact O-CB 3.43Å; K332-S336 PolarHBondContact O-N 3.26Å; L333-S336 PolarHBondContact O-N 3Å; S336-E338 PolarHBondContact O-N 3.43Å; S336-S339 WeakPolarHBondContact CA-OG 3.33Å; S336-S339 PolarHBondContact O-N 2.97Å; S336-S339 PolarHBondContact O-OG 2.93Å; S336-S340 PolarHBondContact O-N 2.86Å; S336-S340 PolarHBondContact O-OG 2.95Å; S336-S340 VanDerWaalsContact O-OG 3.07Å
337	I	82.3	Confident	85.6	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-63.3	-43.6	178.3	-67.6	171	0	0	0	110.8	I279 M283 L333 S339 S340 Y341 F418	I279-I337 HydrophobicContact CG2-CG1 4.41Å; M283-I337 HydrophobicContact CG-CD1 3.83Å; M283-I337 HydrophobicContact SD-CD1 4.05Å; L333-I337 HydrophobicContact CD1-CD1 3.87Å; L333-I337 HydrophobicContact CD1-CG1 4.32Å; L333-I337 HydrophobicContact CG-CD1 3.87Å; L333-I337 WeakPolarHBondContact O-CG1 3.48Å; L333-I337 PolarHBondContact O-N 2.7Å; I337-S339 PolarHBondContact O-N 3.27Å; I337-S340 PolarHBondContact O-N 2.7Å; I337-Y341 HydrophobicContact CG2-CD2 3.59Å; I337-Y341 HydrophobicContact CG2-CE2 3.7Å; I337-Y341 WeakPolarHBondContact O-CB 3.16Å; I337-Y341 WeakPolarHBondContact O-CD2 3.37Å; I337-Y341 PolarHBondContact O-N 3.21Å; I337-F418 HydrophobicContact CD1-CE2 3.79Å; I337-F418 HydrophobicContact CD1-CZ 3.67Å
338	E	84.1	Confident	86.1	Confident	80 Å²	80	52 Å²	52	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-62.5	-41.4	176.7	-171.3	170.2	-155	0	0	111.5	G334 Q335 S336 S342 M411 K415	G334-E338 WeakPolarHBondContact O-CB 3.22Å; G334-E338 PolarHBondContact O-N 3.26Å; Q335-E338 PolarHBondContact O-N 3.16Å; S336-E338 PolarHBondContact O-N 3.43Å; E338-S342 WeakPolarHBondContact O-CB 3.48Å; E338-S342 PolarHBondContact O-N 2.97Å; E338-M411 HydrophobicContact CG-CE 3.81Å; E338-K415 IonicContact OE1-NZ 2.72Å; E338-K415 PolarHBondContact OE1-NZ 3.42Å
339	S	85.9	Confident	86.4	Confident	61 Å²	61	47.1 Å²	47.1	43%	0.427	25%	0.247	S	C	.	.	H	α-helix	trans	-66.1	-41	176.7	59.9	0	0	0	0	113.1	Q335 S336 I337 S342 S343	Q335-S339 WeakPolarHBondContact O-CB 3.4Å; Q335-S339 PolarHBondContact O-N 2.83Å; Q335-S339 PolarHBondContact O-OG 3.04Å; S336-S339 WeakPolarHBondContact CA-OG 3.33Å; S336-S339 PolarHBondContact O-N 2.97Å; S336-S339 PolarHBondContact O-OG 2.93Å; I337-S339 PolarHBondContact O-N 3.27Å; S339-S342 PolarHBondContact O-N 3.31Å; S339-S343 WeakPolarHBondContact O-CB 3.38Å; S339-S343 PolarHBondContact O-N 3.39Å; S339-S343 PolarHBondContact O-OG 3.16Å
340	S	85.3	Confident	86.7	Confident	7 Å²	7	48.5 Å²	48.5	5%	0.049	25%	0.253	C	S	.	.	H	α-helix	trans	-69.4	-42.9	179	-58.3	0	0	0	0	111.1	I279 S336 I337 S342 S343 I344	I279-S340 VanDerWaalsContact CD1-CB 3.42Å; S336-S340 PolarHBondContact O-N 2.86Å; S336-S340 PolarHBondContact O-OG 2.95Å; S336-S340 VanDerWaalsContact O-OG 3.07Å; I337-S340 PolarHBondContact O-N 2.7Å; S340-S342 PolarHBondContact O-N 3.04Å; S340-S343 WeakPolarHBondContact O-CB 3.33Å; S340-S343 PolarHBondContact O-N 3.12Å; S340-S343 VanDerWaalsContact O-N 3.16Å; S340-I344 WeakPolarHBondContact O-CG1 3.31Å; S340-I344 PolarHBondContact O-N 3.44Å
341	Y	86.9	Confident	86.9	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-43.4	173.4	-90.6	-63.8	0	0	0	112.8	I279 I337 S343 I344 Q345 I407 S410 F414 V475	I279-Y341 HydrophobicContact CD1-CD2 4.3Å; I279-Y341 HydrophobicContact CD1-CE2 4.36Å; I279-Y341 HydrophobicContact CD1-CG 4.48Å; I337-Y341 HydrophobicContact CG2-CD2 3.59Å; I337-Y341 HydrophobicContact CG2-CE2 3.7Å; I337-Y341 WeakPolarHBondContact O-CB 3.16Å; I337-Y341 WeakPolarHBondContact O-CD2 3.37Å; I337-Y341 PolarHBondContact O-N 3.21Å; Y341-S343 VanDerWaalsContact C-N 3.25Å; Y341-S343 PolarHBondContact O-N 3.37Å; Y341-I344 PolarHBondContact O-N 3.12Å; Y341-Q345 VanDerWaalsContact O-CB 3.3Å; Y341-Q345 WeakPolarHBondContact O-CB 3.46Å; Y341-Q345 PolarHBondContact O-N 3.44Å; Y341-I407 HydrophobicContact CD1-CG2 3.93Å; Y341-S410 PolarHBondContact OH-OG 3.46Å; Y341-F414 AromaticContact CE2-CD2 3.91Å; Y341-F414 HydrophobicContact CE2-CD2 3.91Å; Y341-F414 HydrophobicContact CE2-CE2 4.06Å; Y341-V475 HydrophobicContact CE1-CG2 3.95Å
342	S	88.7	Confident	87.3	Confident	33 Å²	33	44.1 Å²	44.1	23%	0.231	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-35.6	175.1	-175.9	0	0	0	0	111.7	E338 S339 S340 K346	E338-S342 WeakPolarHBondContact O-CB 3.48Å; E338-S342 PolarHBondContact O-N 2.97Å; S339-S342 PolarHBondContact O-N 3.31Å; S340-S342 PolarHBondContact O-N 3.04Å; S342-K346 WeakPolarHBondContact O-CB 3.48Å; S342-K346 VanDerWaalsContact O-CG 3.25Å; S342-K346 WeakPolarHBondContact O-CG 3.37Å; S342-K346 PolarHBondContact O-N 3.47Å
343	S	88.5	Confident	87.6	Confident	56 Å²	56	38 Å²	38	39%	0.392	21%	0.208	S	C	.	.	H	α-helix	trans	-67.1	-47.8	176	-58.2	0	0	0	0	111.5	S339 S340 Y341 Q345 K346 L347	S339-S343 WeakPolarHBondContact O-CB 3.38Å; S339-S343 PolarHBondContact O-N 3.39Å; S339-S343 PolarHBondContact O-OG 3.16Å; S340-S343 WeakPolarHBondContact O-CB 3.33Å; S340-S343 PolarHBondContact O-N 3.12Å; S340-S343 VanDerWaalsContact O-N 3.16Å; Y341-S343 VanDerWaalsContact C-N 3.25Å; Y341-S343 PolarHBondContact O-N 3.37Å; S343-Q345 VanDerWaalsContact C-N 3.35Å; S343-Q345 PolarHBondContact O-N 3.31Å; S343-K346 PolarHBondContact O-N 2.63Å; S343-L347 WeakPolarHBondContact O-CG 3.43Å; S343-L347 PolarHBondContact O-N 3.34Å
344	I	89.5	Confident	87.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61	-44.5	175.9	-62.2	166.3	0	0	0	110.4	M272 A275 W276 I279 S340 Y341 K346 L347 V348 I407	M272-I344 HydrophobicContact CE-CG2 4.12Å; M272-I344 HydrophobicContact CG-CG2 4.42Å; A275-I344 HydrophobicContact CB-CD1 4.37Å; A275-I344 HydrophobicContact CB-CG1 3.9Å; W276-I344 HydrophobicContact CB-CD1 4.02Å; I279-I344 HydrophobicContact CD1-CD1 3.84Å; S340-I344 WeakPolarHBondContact O-CG1 3.31Å; S340-I344 PolarHBondContact O-N 3.44Å; Y341-I344 PolarHBondContact O-N 3.12Å; I344-K346 PolarHBondContact O-N 2.8Å; I344-L347 PolarHBondContact O-N 3.17Å; I344-V348 WeakPolarHBondContact O-CG2 3.25Å; I344-V348 PolarHBondContact O-N 3.37Å; I344-I407 HydrophobicContact CG2-CD1 3.66Å
345	Q	91.5	Very high	88.3	Confident	41 Å²	41	37 Å²	37	19%	0.192	20%	0.201	C	C	.	.	H	α-helix	trans	-58.7	-46.1	177.2	179.2	174.4	43	0	0	112	Y341 S343 V348 I349 L404 I407 D408	Y341-Q345 VanDerWaalsContact O-CB 3.3Å; Y341-Q345 WeakPolarHBondContact O-CB 3.46Å; Y341-Q345 PolarHBondContact O-N 3.44Å; S343-Q345 VanDerWaalsContact C-N 3.35Å; S343-Q345 PolarHBondContact O-N 3.31Å; Q345-V348 PolarHBondContact O-N 2.95Å; Q345-I349 HydrophobicContact CG-CD1 3.88Å; Q345-I349 WeakPolarHBondContact O-CG1 3.34Å; Q345-I349 PolarHBondContact O-N 3.05Å; Q345-I349 VanDerWaalsContact O-N 3.09Å; Q345-L404 HydrophobicContact CG-CD1 3.79Å; Q345-I407 HydrophobicContact CB-CG2 4.28Å; Q345-D408 PolarHBondContact NE2-OD1 2.85Å
346	K	90.4	Very high	88.7	Confident	128 Å²	128	30.7 Å²	30.7	56%	0.557	17%	0.171	S	C	*	.	H	α-helix	trans	-62.9	-41.3	176	-74.5	172.4	-175	176.4	0	111.8	S342 S343 I344 V348 I349 S350	S342-K346 WeakPolarHBondContact O-CB 3.48Å; S342-K346 VanDerWaalsContact O-CG 3.25Å; S342-K346 WeakPolarHBondContact O-CG 3.37Å; S342-K346 PolarHBondContact O-N 3.47Å; S343-K346 PolarHBondContact O-N 2.63Å; I344-K346 PolarHBondContact O-N 2.8Å; K346-V348 VanDerWaalsContact C-N 3.33Å; K346-V348 PolarHBondContact O-N 3.42Å; K346-I349 PolarHBondContact O-N 3.4Å; K346-S350 VanDerWaalsContact O-CB 3.26Å; K346-S350 WeakPolarHBondContact O-CB 3.44Å; K346-S350 PolarHBondContact O-N 2.88Å
347	L	90.5	Very high	89	Confident	14 Å²	14	34.5 Å²	34.5	7%	0.073	19%	0.186	C	C	.	.	I	π-helix	trans	-62.1	-39.4	176.2	-73.2	168.2	0	0	0	111.8	L145 C271 M272 S343 I344 H351 L352	L145-L347 HydrophobicContact CD2-CD2 4.13Å; C271-L347 HydrophobicContact CB-CD1 4.09Å; M272-L347 HydrophobicContact CG-CB 3.63Å; M272-L347 HydrophobicContact CG-CD1 3.78Å; M272-L347 HydrophobicContact CG-CG 4.34Å; M272-L347 HydrophobicContact SD-CB 4.18Å; S343-L347 WeakPolarHBondContact O-CG 3.43Å; S343-L347 PolarHBondContact O-N 3.34Å; I344-L347 PolarHBondContact O-N 3.17Å; L347-H351 VanDerWaalsContact O-CB 3.31Å; L347-H351 WeakPolarHBondContact O-CB 2.98Å; L347-H351 PolarHBondContact O-N 3.47Å; L347-L352 PolarHBondContact O-N 3.26Å
348	V	92.6	Very high	89.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.188	C	C	.	.	I	π-helix	trans	-64.5	-50.5	176.3	174.5	0	0	0	0	111.3	M272 I344 Q345 K346 L352 Q353 L403 L404 I407	M272-V348 HydrophobicContact CE-CG2 3.32Å; M272-V348 HydrophobicContact SD-CG2 3.82Å; I344-V348 WeakPolarHBondContact O-CG2 3.25Å; I344-V348 PolarHBondContact O-N 3.37Å; Q345-V348 PolarHBondContact O-N 2.95Å; K346-V348 VanDerWaalsContact C-N 3.33Å; K346-V348 PolarHBondContact O-N 3.42Å; V348-L352 WeakPolarHBondContact O-CB 3.44Å; V348-L352 PolarHBondContact O-N 2.93Å; V348-Q353 WeakPolarHBondContact O-CG 3.4Å; V348-Q353 PolarHBondContact O-N 3.33Å; V348-L403 HydrophobicContact CG2-CD2 4.35Å; V348-L404 HydrophobicContact CG1-CB 4.23Å; V348-I407 HydrophobicContact CG2-CD1 4.29Å
349	I	89.7	Confident	89.9	Confident	75 Å²	75	30.9 Å²	30.9	39%	0.385	17%	0.17	S	C	.	.	I	π-helix	trans	-73.8	-51.4	-173.5	-61.7	167	0	0	0	111.2	Q345 K346 L404	Q345-I349 HydrophobicContact CG-CD1 3.88Å; Q345-I349 WeakPolarHBondContact O-CG1 3.34Å; Q345-I349 PolarHBondContact O-N 3.05Å; Q345-I349 VanDerWaalsContact O-N 3.09Å; K346-I349 PolarHBondContact O-N 3.4Å; I349-L404 HydrophobicContact CD1-CD1 4.03Å; I349-L404 HydrophobicContact CD1-CD2 4.24Å; I349-L404 HydrophobicContact CG1-CD1 4.04Å; I349-L404 HydrophobicContact CG1-CD2 3.93Å
350	S	88	Confident	90.3	Very high	54 Å²	54	30.2 Å²	30.2	38%	0.378	16%	0.162	S	C	.	.	I	π-helix	trans	-83.8	-27.7	-169.5	-61.6	0	0	0	0	113.3	P143 K346 S354	P143-S350 WeakPolarHBondContact CD-O 3.05Å; P143-S350 WeakPolarHBondContact CG-O 3.33Å; K346-S350 VanDerWaalsContact O-CB 3.26Å; K346-S350 WeakPolarHBondContact O-CB 3.44Å; K346-S350 PolarHBondContact O-N 2.88Å; S350-S354 WeakPolarHBondContact O-CB 3.3Å; S350-S354 PolarHBondContact O-OG 3.17Å
351	H	88.6	Confident	90.7	Very high	19 Å²	19	33.2 Å²	33.2	9%	0.088	17%	0.172	C	C	.	.	I	π-helix	trans	-112.3	-56	-174.4	-54.7	63.6	0	0	0	111.5	T144 L145 Y264 L347 S354 G355	T144-H351 PolarHBondContact O-NE2 3.46Å; L145-H351 HydrophobicContact CD2-CB 4.5Å; L145-H351 WeakPolarHBondContact CD2-CD2 3.37Å; Y264-H351 HydrophobicContact CE1-CB 4.14Å; Y264-H351 WeakPolarHBondContact CE1-O 3.3Å; Y264-H351 AromaticContact CZ-CD2 3.93Å; Y264-H351 WeakPolarHBondContact OH-CB 3.36Å; Y264-H351 PolarHBondContact OH-CD2 3.5Å; L347-H351 VanDerWaalsContact O-CB 3.31Å; L347-H351 WeakPolarHBondContact O-CB 2.98Å; L347-H351 PolarHBondContact O-N 3.47Å; H351-S354 PolarHBondContact O-OG 2.92Å; H351-S354 VanDerWaalsContact O-OG 3.12Å; H351-G355 PolarHBondContact O-N 3.22Å
352	L	91.7	Very high	91	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.173	C	C	.	.	I	π-helix	trans	-68.4	-46.7	-173.7	-163.9	68.5	0	0	0	112.5	I265 M272 L347 V348 S356 F396 A400 L522	I265-L352 HydrophobicContact CG2-CD1 3.83Å; M272-L352 HydrophobicContact SD-CD2 4.25Å; L347-L352 PolarHBondContact O-N 3.26Å; V348-L352 WeakPolarHBondContact O-CB 3.44Å; V348-L352 PolarHBondContact O-N 2.93Å; L352-S356 VanDerWaalsContact O-CB 3.31Å; L352-S356 WeakPolarHBondContact O-CB 3.44Å; L352-S356 PolarHBondContact O-N 3.46Å; L352-S356 PolarHBondContact O-OG 3.48Å; L352-F396 HydrophobicContact CD1-CE1 3.96Å; L352-F396 HydrophobicContact CD1-CZ 3.9Å; L352-F396 HydrophobicContact CD2-CE1 4.45Å; L352-F396 HydrophobicContact CD2-CZ 4.23Å; L352-F396 HydrophobicContact CG-CE1 4.11Å; L352-F396 HydrophobicContact CG-CZ 4.25Å; L352-A400 HydrophobicContact CD2-CB 3.92Å; L352-L522 HydrophobicContact CD2-CD2 4.32Å
353	Q	90.5	Very high	91.3	Very high	29 Å²	29	32 Å²	32	14%	0.136	16%	0.163	C	C	.	.	I	π-helix	trans	-67.5	-50.1	178.3	-75.5	-179.1	-27.6	0	0	111.5	V348 G355 S356 E357	V348-Q353 WeakPolarHBondContact O-CG 3.4Å; V348-Q353 PolarHBondContact O-N 3.33Å; Q353-G355 VanDerWaalsContact C-N 3.32Å; Q353-G355 PolarHBondContact O-N 3.47Å; Q353-S356 PolarHBondContact O-N 3.1Å; Q353-S356 VanDerWaalsContact O-N 3.09Å; Q353-E357 WeakPolarHBondContact O-CB 3.09Å; Q353-E357 VanDerWaalsContact O-CG 3.27Å; Q353-E357 WeakPolarHBondContact O-CG 3.26Å; Q353-E357 PolarHBondContact O-N 2.97Å
354	S	89.4	Confident	91.5	Very high	16 Å²	16	32 Å²	32	11%	0.112	16%	0.164	C	C	.	.	H	α-helix	trans	-59.7	-40.2	179	65.8	0	0	0	0	112.9	S350 H351 S358	S350-S354 WeakPolarHBondContact O-CB 3.3Å; S350-S354 PolarHBondContact O-OG 3.17Å; H351-S354 PolarHBondContact O-OG 2.92Å; H351-S354 VanDerWaalsContact O-OG 3.12Å; S354-S358 WeakPolarHBondContact O-CB 3.39Å; S354-S358 PolarHBondContact O-N 2.9Å; S354-S358 PolarHBondContact O-OG 3.26Å
355	G	90.4	Very high	91.7	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-42.4	174	0	0	0	0	0	112.3	H351 Q353 L359	H351-G355 PolarHBondContact O-N 3.22Å; Q353-G355 VanDerWaalsContact C-N 3.32Å; Q353-G355 PolarHBondContact O-N 3.47Å; G355-L359 VanDerWaalsContact O-CB 3.32Å; G355-L359 WeakPolarHBondContact O-CB 3.47Å; G355-L359 PolarHBondContact O-N 3.44Å
356	S	93.7	Very high	91.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-70.5	-36.2	178.7	-56.3	0	0	0	0	112.9	L352 Q353 L359 L360 F396 I397	L352-S356 VanDerWaalsContact O-CB 3.31Å; L352-S356 WeakPolarHBondContact O-CB 3.44Å; L352-S356 PolarHBondContact O-N 3.46Å; L352-S356 PolarHBondContact O-OG 3.48Å; Q353-S356 PolarHBondContact O-N 3.1Å; Q353-S356 VanDerWaalsContact O-N 3.09Å; S356-L359 WeakPolarHBondContact O-CB 3.42Å; S356-L359 PolarHBondContact O-N 2.95Å; S356-L360 WeakPolarHBondContact O-CB 3.33Å; S356-L360 PolarHBondContact O-N 3.38Å; S356-F396 WeakPolarHBondContact OG-CE1 3.25Å; S356-I397 VanDerWaalsContact CB-CG1 3.47Å
357	E	91.4	Very high	92	Very high	106 Å²	106	28.8 Å²	28.8	50%	0.495	15%	0.15	S	C	.	.	H	α-helix	trans	-67.4	-43.6	175.1	-73	166.8	-168	0	0	111.4	Q353 L359 L360 Y361	Q353-E357 WeakPolarHBondContact O-CB 3.09Å; Q353-E357 VanDerWaalsContact O-CG 3.27Å; Q353-E357 WeakPolarHBondContact O-CG 3.26Å; Q353-E357 PolarHBondContact O-N 2.97Å; E357-L359 VanDerWaalsContact C-N 3.29Å; E357-L359 PolarHBondContact O-N 3.42Å; E357-L360 WeakPolarHBondContact O-CB 3.44Å; E357-L360 PolarHBondContact O-N 3.38Å; E357-Y361 PolarHBondContact O-N 3.49Å
358	S	90.4	Very high	92.2	Very high	8 Å²	8	29.9 Å²	29.9	6%	0.056	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-38.9	173.6	-57.9	0	0	0	0	111.3	S354 Y361 H362	S354-S358 WeakPolarHBondContact O-CB 3.39Å; S354-S358 PolarHBondContact O-N 2.9Å; S354-S358 PolarHBondContact O-OG 3.26Å; S358-Y361 WeakPolarHBondContact O-CB 3.37Å; S358-Y361 PolarHBondContact O-N 3.13Å; S358-H362 PolarHBondContact O-CD2 2.68Å; S358-H362 PolarHBondContact O-N 3.17Å
359	L	94	Very high	92.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.1	-45	174.9	177.7	61	0	0	0	111.3	I258 L261 L262 I265 G355 S356 E357 Y361 H362 L363 V393 M529 I533	I258-L359 HydrophobicContact CB-CD1 4.17Å; I258-L359 HydrophobicContact CG1-CD1 4.02Å; I258-L359 HydrophobicContact CG2-CD1 3.74Å; L261-L359 HydrophobicContact CB-CB 4.49Å; L261-L359 HydrophobicContact CD1-CB 4.26Å; L262-L359 HydrophobicContact CD2-CD2 3.94Å; I265-L359 HydrophobicContact CD1-CD2 3.91Å; G355-L359 VanDerWaalsContact O-CB 3.32Å; G355-L359 WeakPolarHBondContact O-CB 3.47Å; G355-L359 PolarHBondContact O-N 3.44Å; S356-L359 WeakPolarHBondContact O-CB 3.42Å; S356-L359 PolarHBondContact O-N 2.95Å; E357-L359 VanDerWaalsContact C-N 3.29Å; E357-L359 PolarHBondContact O-N 3.42Å; L359-Y361 VanDerWaalsContact C-N 3.33Å; L359-Y361 PolarHBondContact O-N 3.4Å; L359-H362 PolarHBondContact O-N 3.17Å; L359-L363 HydrophobicContact CD1-CD1 4.18Å; L359-L363 HydrophobicContact CD1-CG 4.3Å; L359-L363 HydrophobicContact CG-CD1 4.12Å; L359-L363 WeakPolarHBondContact O-CB 3.45Å; L359-L363 WeakPolarHBondContact O-CG 3.28Å; L359-L363 PolarHBondContact O-N 3.38Å; L359-V393 HydrophobicContact CD2-CG1 4.32Å; L359-V393 HydrophobicContact CD2-CG2 3.69Å; L359-V393 HydrophobicContact CG-CG1 4.42Å; L359-V393 HydrophobicContact CG-CG2 4.02Å; L359-M529 HydrophobicContact CD2-SD 4.29Å; L359-I533 HydrophobicContact CD1-CD1 4.48Å; L359-I533 HydrophobicContact CD2-CD1 4.06Å
360	L	94.6	Very high	92.5	Very high	47 Å²	47	26.8 Å²	26.8	25%	0.246	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-41.5	175.8	-175.9	63.8	0	0	0	111.7	S356 E357 L363 S364 I390 V393 I397	S356-L360 WeakPolarHBondContact O-CB 3.33Å; S356-L360 PolarHBondContact O-N 3.38Å; E357-L360 WeakPolarHBondContact O-CB 3.44Å; E357-L360 PolarHBondContact O-N 3.38Å; L360-L363 PolarHBondContact O-N 3.08Å; L360-S364 WeakPolarHBondContact O-CB 3.21Å; L360-S364 PolarHBondContact O-N 3.43Å; L360-I390 HydrophobicContact CD1-CB 4.44Å; L360-I390 HydrophobicContact CD1-CG2 3.77Å; L360-V393 HydrophobicContact CB-CG1 4.12Å; L360-V393 HydrophobicContact CD1-CG1 4.48Å; L360-I397 HydrophobicContact CD2-CD1 4.28Å
361	Y	93.5	Very high	92.8	Very high	70 Å²	70	27.7 Å²	27.7	28%	0.275	16%	0.155	S	C	.	.	H	α-helix	trans	-58.8	-54	175.5	170.2	-98.5	0	0	0	111.5	L139 E357 S358 L359 L363 S364 E365	L139-Y361 HydrophobicContact CD1-CD1 3.72Å; L139-Y361 HydrophobicContact CD1-CE1 3.75Å; L139-Y361 HydrophobicContact CD2-CD1 3.78Å; L139-Y361 HydrophobicContact CD2-CD2 4.43Å; L139-Y361 HydrophobicContact CD2-CE1 4.1Å; L139-Y361 HydrophobicContact CD2-CG 3.95Å; L139-Y361 HydrophobicContact CG-CD1 4.23Å; L139-Y361 HydrophobicContact CG-CE1 4.18Å; E357-Y361 PolarHBondContact O-N 3.49Å; S358-Y361 WeakPolarHBondContact O-CB 3.37Å; S358-Y361 PolarHBondContact O-N 3.13Å; L359-Y361 VanDerWaalsContact C-N 3.33Å; L359-Y361 PolarHBondContact O-N 3.4Å; Y361-L363 VanDerWaalsContact C-N 3.34Å; Y361-L363 PolarHBondContact O-N 2.72Å; Y361-S364 WeakPolarHBondContact O-CB 3.38Å; Y361-S364 PolarHBondContact O-N 3.05Å; Y361-S364 VanDerWaalsContact O-N 3.08Å; Y361-S364 PolarHBondContact O-OG 3.15Å; Y361-E365 HydrophobicContact CE1-CG 4.36Å; Y361-E365 HydrophobicContact CE2-CG 4.44Å; Y361-E365 PolarHBondContact O-N 2.87Å; Y361-E365 VanDerWaalsContact O-N 3.08Å; Y361-E365 PolarHBondContact OH-OE1 2.94Å
362	H	92.7	Very high	93.1	Very high	5 Å²	5	35.4 Å²	35.4	2%	0.023	18%	0.183	C	C	.	.	H	α-helix	trans	-65.5	-35.9	-179	-68.2	-53.9	0	0	0	112.9	I258 S358 L359 S364 E365 L366	I258-H362 HydrophobicContact CD1-CB 4.46Å; I258-H362 HydrophobicContact CG1-CB 4.05Å; S358-H362 PolarHBondContact O-CD2 2.68Å; S358-H362 PolarHBondContact O-N 3.17Å; L359-H362 PolarHBondContact O-N 3.17Å; H362-S364 VanDerWaalsContact C-N 3.31Å; H362-S364 PolarHBondContact O-N 3.14Å; H362-E365 IonicContact ND1-OE2 2.77Å; H362-E365 PolarHBondContact O-N 2.78Å; H362-L366 WeakPolarHBondContact O-CB 3.39Å; H362-L366 PolarHBondContact O-N 3.38Å
363	L	95.2	Very high	93.2	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-65	-35.4	172.8	-74.5	172.9	0	0	0	112.1	I258 L359 L360 Y361 L366 K367 I386 A389 I390 V393 I533	I258-L363 HydrophobicContact CD1-CD2 3.82Å; I258-L363 HydrophobicContact CD1-CG 4.32Å; L359-L363 HydrophobicContact CD1-CD1 4.18Å; L359-L363 HydrophobicContact CD1-CG 4.3Å; L359-L363 HydrophobicContact CG-CD1 4.12Å; L359-L363 WeakPolarHBondContact O-CB 3.45Å; L359-L363 WeakPolarHBondContact O-CG 3.28Å; L359-L363 PolarHBondContact O-N 3.38Å; L360-L363 PolarHBondContact O-N 3.08Å; Y361-L363 VanDerWaalsContact C-N 3.34Å; Y361-L363 PolarHBondContact O-N 2.72Å; L363-L366 HydrophobicContact CD2-CD2 4.47Å; L363-L366 PolarHBondContact O-N 3.24Å; L363-K367 PolarHBondContact O-N 2.87Å; L363-I386 HydrophobicContact CD2-CG2 4.47Å; L363-A389 HydrophobicContact CD1-CB 4.27Å; L363-A389 HydrophobicContact CD2-CB 4.35Å; L363-I390 HydrophobicContact CB-CD1 4.38Å; L363-I390 HydrophobicContact CB-CG1 3.72Å; L363-V393 HydrophobicContact CD1-CG2 3.68Å; L363-I533 HydrophobicContact CD1-CD1 4.45Å
364	S	93.4	Very high	93.3	Very high	58 Å²	58	48.8 Å²	48.8	41%	0.406	24%	0.244	S	C	.	.	H	α-helix	trans	-66.5	-40.5	176.2	80.2	0	0	0	0	112.3	L360 Y361 H362 L366 K367 G368	L360-S364 WeakPolarHBondContact O-CB 3.21Å; L360-S364 PolarHBondContact O-N 3.43Å; Y361-S364 WeakPolarHBondContact O-CB 3.38Å; Y361-S364 PolarHBondContact O-N 3.05Å; Y361-S364 VanDerWaalsContact O-N 3.08Å; Y361-S364 PolarHBondContact O-OG 3.15Å; H362-S364 VanDerWaalsContact C-N 3.31Å; H362-S364 PolarHBondContact O-N 3.14Å; S364-L366 VanDerWaalsContact C-N 3.32Å; S364-K367 WeakPolarHBondContact O-CB 3.45Å; S364-K367 PolarHBondContact O-N 3Å; S364-G368 PolarHBondContact O-N 3.25Å
365	E	92.7	Very high	93.4	Very high	41 Å²	41	52.2 Å²	52.2	19%	0.192	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-41.8	172.2	-66.6	-164.5	108.9	0	0	111	K254 Y361 H362 K367 G368 M369	K254-E365 WeakPolarHBondContact CE-OE2 3.39Å; K254-E365 IonicContact NZ-OE2 3.05Å; K254-E365 PolarHBondContact NZ-OE2 2.91Å; Y361-E365 HydrophobicContact CE1-CG 4.36Å; Y361-E365 HydrophobicContact CE2-CG 4.44Å; Y361-E365 PolarHBondContact O-N 2.87Å; Y361-E365 VanDerWaalsContact O-N 3.08Å; Y361-E365 PolarHBondContact OH-OE1 2.94Å; H362-E365 IonicContact ND1-OE2 2.77Å; H362-E365 PolarHBondContact O-N 2.78Å; E365-K367 VanDerWaalsContact C-N 3.34Å; E365-K367 PolarHBondContact O-N 3.18Å; E365-G368 CarbonylContact O-C 3.59Å; E365-G368 VanDerWaalsContact O-CA 3.31Å; E365-G368 WeakPolarHBondContact O-CA 3.07Å; E365-G368 PolarHBondContact O-N 2.91Å; E365-M369 HydrophobicContact CB-CE 4.23Å; E365-M369 WeakPolarHBondContact O-CG 3.08Å; E365-M369 PolarHBondContact O-N 3.37Å
366	L	94.4	Very high	93.6	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-64.9	-36.9	177.8	-165.7	72.5	0	0	0	111.9	K254 F255 I258 H362 L363 S364 G368 M369 A370 L381 I386	K254-L366 HydrophobicContact CB-CD1 4.49Å; F255-L366 HydrophobicContact CD1-CD2 4.04Å; F255-L366 HydrophobicContact CE1-CD1 4.18Å; F255-L366 HydrophobicContact CE1-CD2 3.39Å; F255-L366 HydrophobicContact CE1-CG 4.41Å; F255-L366 HydrophobicContact CZ-CD1 4.43Å; F255-L366 HydrophobicContact CZ-CD2 4.15Å; I258-L366 HydrophobicContact CD1-CD2 4.13Å; H362-L366 WeakPolarHBondContact O-CB 3.39Å; H362-L366 PolarHBondContact O-N 3.38Å; L363-L366 HydrophobicContact CD2-CD2 4.47Å; L363-L366 PolarHBondContact O-N 3.24Å; S364-L366 VanDerWaalsContact C-N 3.32Å; L366-G368 VanDerWaalsContact C-N 3.3Å; L366-G368 PolarHBondContact O-N 3.5Å; L366-M369 HydrophobicContact CD1-SD 4.3Å; L366-M369 WeakPolarHBondContact O-CB 3.15Å; L366-M369 PolarHBondContact O-N 2.95Å; L366-A370 WeakPolarHBondContact O-CB 3.32Å; L366-A370 PolarHBondContact O-N 3.42Å; L366-L381 HydrophobicContact CD1-CD1 4.09Å; L366-L381 HydrophobicContact CD1-CD2 3.95Å; L366-L381 HydrophobicContact CD2-CD1 4.27Å; L366-L381 HydrophobicContact CG-CD1 4.2Å; L366-L381 HydrophobicContact CG-CD2 4.22Å; L366-I386 HydrophobicContact CD2-CD1 3.76Å; L366-I386 HydrophobicContact CD2-CG1 4.02Å; L366-I386 HydrophobicContact CG-CD1 3.76Å; L366-I386 HydrophobicContact CG-CG1 4.49Å
367	K	94.6	Very high	93.6	Very high	59 Å²	59	59 Å²	59	26%	0.257	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-41.6	169.7	-176.7	-177.3	-174.5	172	0	110.8	L363 S364 E365 M369 A370 S371 I386 E387 I390	L363-K367 PolarHBondContact O-N 2.87Å; S364-K367 WeakPolarHBondContact O-CB 3.45Å; S364-K367 PolarHBondContact O-N 3Å; E365-K367 VanDerWaalsContact C-N 3.34Å; E365-K367 PolarHBondContact O-N 3.18Å; K367-M369 VanDerWaalsContact C-N 3.3Å; K367-M369 PolarHBondContact O-N 3.35Å; K367-A370 PolarHBondContact O-N 3.46Å; K367-S371 WeakPolarHBondContact O-CB 3.42Å; K367-S371 PolarHBondContact O-N 3.26Å; K367-S371 PolarHBondContact O-OG 2.91Å; K367-I386 HydrophobicContact CB-CG2 3.92Å; K367-E387 IonicContact NZ-OE1 2.81Å; K367-E387 PolarHBondContact NZ-OE1 3.49Å; K367-I390 HydrophobicContact CB-CD1 3.87Å; K367-I390 HydrophobicContact CD-CD1 3.8Å; K367-I390 HydrophobicContact CG-CD1 4.37Å
368	G	94.2	Very high	93.7	Very high	37 Å²	37	56.5 Å²	56.5	38%	0.381	28%	0.281	S	S	.	.	H	α-helix	trans	-54.1	-47.4	171.6	0	0	0	0	0	111.4	S364 E365 L366	S364-G368 PolarHBondContact O-N 3.25Å; E365-G368 CarbonylContact O-C 3.59Å; E365-G368 VanDerWaalsContact O-CA 3.31Å; E365-G368 WeakPolarHBondContact O-CA 3.07Å; E365-G368 PolarHBondContact O-N 2.91Å; L366-G368 VanDerWaalsContact C-N 3.3Å; L366-G368 PolarHBondContact O-N 3.5Å
369	M	94.1	Very high	93.9	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.039	28%	0.278	C	S	.	.	H	α-helix	trans	-64.9	-47.9	175.9	-62.2	176.6	-148.2	0	0	112.4	R250 K254 E365 L366 K367 S371 W372 Y376 L381	R250-M369 HydrophobicContact CG-CE 3.67Å; R250-M369 HydrophobicContact CG-SD 3.87Å; R250-M369 VanDerWaalsContact NE-CE 3.34Å; K254-M369 HydrophobicContact CG-CE 3.83Å; E365-M369 HydrophobicContact CB-CE 4.23Å; E365-M369 WeakPolarHBondContact O-CG 3.08Å; E365-M369 PolarHBondContact O-N 3.37Å; L366-M369 HydrophobicContact CD1-SD 4.3Å; L366-M369 WeakPolarHBondContact O-CB 3.15Å; L366-M369 PolarHBondContact O-N 2.95Å; K367-M369 VanDerWaalsContact C-N 3.3Å; K367-M369 PolarHBondContact O-N 3.35Å; M369-S371 PolarHBondContact O-N 3.49Å; M369-W372 WeakPolarHBondContact O-CB 3.3Å; M369-W372 PolarHBondContact O-N 2.86Å; M369-Y376 HydrophobicContact CB-CD1 4.29Å; M369-Y376 HydrophobicContact CB-CD2 3.99Å; M369-Y376 HydrophobicContact CB-CE1 4.07Å; M369-Y376 HydrophobicContact CB-CE2 3.75Å; M369-Y376 HydrophobicContact CB-CG 4.25Å; M369-Y376 HydrophobicContact CG-CE1 4.49Å; M369-Y376 HydrophobicContact CG-CE2 4.19Å; M369-Y376 WeakPolarHBondContact O-CD2 3.28Å; M369-Y376 HydrophobicContact SD-CE1 4.32Å; M369-L381 HydrophobicContact CB-CD2 4.09Å
370	A	95	Very high	93.9	Very high	2 Å²	2	56.5 Å²	56.5	2%	0.017	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-28.7	-178.7	0	0	0	0	0	113.1	L366 K367 W372 L381 A383 I386	L366-A370 WeakPolarHBondContact O-CB 3.32Å; L366-A370 PolarHBondContact O-N 3.42Å; K367-A370 PolarHBondContact O-N 3.46Å; A370-W372 PolarHBondContact O-N 2.93Å; A370-L381 HydrophobicContact CB-CD2 3.74Å; A370-L381 HydrophobicContact CB-CG 3.83Å; A370-A383 HydrophobicContact CB-CB 3.97Å; A370-I386 HydrophobicContact CB-CD1 3.62Å
371	S	94.4	Very high	93.8	Very high	72 Å²	72	54.8 Å²	54.8	50%	0.503	27%	0.273	S	S	.	.	H	α-helix	trans	-66.6	-23.6	174.8	-59.2	0	0	0	0	112.4	K367 M369 K373	K367-S371 WeakPolarHBondContact O-CB 3.42Å; K367-S371 PolarHBondContact O-N 3.26Å; K367-S371 PolarHBondContact O-OG 2.91Å; M369-S371 PolarHBondContact O-N 3.49Å; S371-K373 VanDerWaalsContact C-N 3.27Å; S371-K373 PolarHBondContact O-N 2.72Å
372	W	95.1	Very high	93.7	Very high	182 Å²	182	53.9 Å²	53.9	69%	0.689	27%	0.273	S	S	*	.			trans	-84.3	70.5	174.3	-70.8	60.1	0	0	0	110.6	M369 A370 Q374 K375 Y376	M369-W372 WeakPolarHBondContact O-CB 3.3Å; M369-W372 PolarHBondContact O-N 2.86Å; A370-W372 PolarHBondContact O-N 2.93Å; W372-Q374 VanDerWaalsContact C-N 3.27Å; W372-Q374 PolarHBondContact O-N 2.9Å; W372-Q374 VanDerWaalsContact O-N 3.17Å; W372-K375 PolarHBondContact O-N 2.96Å; W372-Y376 HydrophobicContact CB-CD2 4.3Å; W372-Y376 PolarHBondContact O-N 3.12Å; W372-Y376 VanDerWaalsContact O-N 3.12Å
373	K	93.2	Very high	93.8	Very high	129 Å²	129	54.9 Å²	54.9	56%	0.561	28%	0.282	S	S	*	.	H	α-helix	trans	-51.5	-42.6	-174	-63.4	-171.4	178.2	-171.6	0	113.5	S371 K375 Y376 E377	S371-K373 VanDerWaalsContact C-N 3.27Å; S371-K373 PolarHBondContact O-N 2.72Å; K373-K375 PolarHBondContact O-N 3.18Å; K373-Y376 PolarHBondContact O-N 2.93Å; K373-E377 HydrophobicContact CB-CB 4.3Å; K373-E377 WeakPolarHBondContact O-CB 3.44Å; K373-E377 PolarHBondContact O-N 3.29Å
374	Q	92.9	Very high	93.6	Very high	181 Å²	181	58.8 Å²	58.8	85%	0.846	31%	0.306	S	S	*	.	H	α-helix	trans	-54.5	-31.7	179.8	-171.9	-179.7	4.1	0	0	113.8	W372	W372-Q374 VanDerWaalsContact C-N 3.27Å; W372-Q374 PolarHBondContact O-N 2.9Å; W372-Q374 VanDerWaalsContact O-N 3.17Å
375	K	91.8	Very high	93.6	Very high	87 Å²	87	56.6 Å²	56.6	38%	0.378	29%	0.293	S	S	.	.	H	α-helix	trans	-98.1	-40.4	-177.5	-75.1	-172.4	166.3	-133.9	0	113.5	E247 W372 K373	E247-K375 HydrophobicContact CG-CB 4.19Å; E247-K375 HydrophobicContact CG-CD 4.28Å; E247-K375 WeakPolarHBondContact OE1-CD 3.37Å; E247-K375 WeakPolarHBondContact OE1-CE 3.2Å; E247-K375 IonicContact OE1-NZ 2.72Å; E247-K375 PolarHBondContact OE1-NZ 3.16Å; W372-K375 PolarHBondContact O-N 2.96Å; K373-K375 PolarHBondContact O-N 3.18Å
376	Y	94.6	Very high	93.8	Very high	15 Å²	15	54.7 Å²	54.7	6%	0.059	28%	0.284	C	S	.	.	H	α-helix	trans	-107.8	-14.8	-168.8	-71.5	-85.8	0	0	0	114.7	E247 M251 M369 W372 K373 L379 G380 L381	E247-Y376 HydrophobicContact CB-CD1 4.46Å; E247-Y376 HydrophobicContact CB-CE1 3.78Å; E247-Y376 HydrophobicContact CG-CE1 4.29Å; E247-Y376 HydrophobicContact CG-CE2 4.17Å; M251-Y376 HydrophobicContact CB-CE1 4.29Å; M369-Y376 HydrophobicContact CB-CD1 4.29Å; M369-Y376 HydrophobicContact CB-CD2 3.99Å; M369-Y376 HydrophobicContact CB-CE1 4.07Å; M369-Y376 HydrophobicContact CB-CE2 3.75Å; M369-Y376 HydrophobicContact CB-CG 4.25Å; M369-Y376 HydrophobicContact CG-CE1 4.49Å; M369-Y376 HydrophobicContact CG-CE2 4.19Å; M369-Y376 WeakPolarHBondContact O-CD2 3.28Å; M369-Y376 HydrophobicContact SD-CE1 4.32Å; W372-Y376 HydrophobicContact CB-CD2 4.3Å; W372-Y376 PolarHBondContact O-N 3.12Å; W372-Y376 VanDerWaalsContact O-N 3.12Å; K373-Y376 PolarHBondContact O-N 2.93Å; Y376-L379 HydrophobicContact CD1-CD1 3.9Å; Y376-L379 HydrophobicContact CE1-CD1 4.29Å; Y376-L379 PolarHBondContact O-N 3.48Å; Y376-G380 PolarHBondContact O-N 3.47Å; Y376-L381 HydrophobicContact CD1-CD2 3.9Å; Y376-L381 HydrophobicContact CG-CD2 4.16Å; Y376-L381 PolarHBondContact O-N 2.74Å
377	E	92.7	Very high	93.8	Very high	128 Å²	128	57.2 Å²	57.2	60%	0.598	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-41.8	173	-172.7	174.5	-157.4	0	0	112.2	K373 L379 G380	K373-E377 HydrophobicContact CB-CB 4.3Å; K373-E377 WeakPolarHBondContact O-CB 3.44Å; K373-E377 PolarHBondContact O-N 3.29Å; E377-L379 PolarHBondContact O-N 2.93Å; E377-G380 PolarHBondContact O-N 2.99Å
378	P	94.3	Very high	93.8	Very high	53 Å²	53	58.8 Å²	58.8	34%	0.344	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.4	174.2	-22.9	35.2	0	0	0	113.9	L240 F244 G380 V543	L240-P378 HydrophobicContact CD1-CB 3.98Å; F244-P378 HydrophobicContact CZ-CG 4.34Å; P378-G380 VanDerWaalsContact C-N 3.28Å; P378-V543 VanDerWaalsContact O-CG1 3.31Å; P378-V543 WeakPolarHBondContact O-CG1 3.22Å
379	L	94.4	Very high	93.9	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.1	176.6	-59.9	179.2	0	0	0	112.7	L240 F244 E247 V248 M251 Y376 E377 P540 I544	L240-L379 HydrophobicContact CD1-CD2 4.1Å; L240-L379 HydrophobicContact CD2-CD2 3.99Å; L240-L379 HydrophobicContact CG-CD2 3.77Å; F244-L379 HydrophobicContact CB-CD1 4.45Å; F244-L379 HydrophobicContact CB-CD2 4.18Å; E247-L379 HydrophobicContact CB-CD1 3.79Å; V248-L379 HydrophobicContact CG2-CD1 4.08Å; V248-L379 HydrophobicContact CG2-CD2 3.71Å; M251-L379 HydrophobicContact CE-CB 4.49Å; M251-L379 HydrophobicContact SD-CB 4.29Å; M251-L379 HydrophobicContact SD-CD1 4.38Å; Y376-L379 HydrophobicContact CD1-CD1 3.9Å; Y376-L379 HydrophobicContact CE1-CD1 4.29Å; Y376-L379 PolarHBondContact O-N 3.48Å; E377-L379 PolarHBondContact O-N 2.93Å; L379-P540 WeakPolarHBondContact O-CA 3Å; L379-P540 WeakPolarHBondContact O-CB 2.8Å; L379-I544 HydrophobicContact CD2-CD1 4.16Å; L379-I544 HydrophobicContact CD2-CG1 4.38Å
380	G	93.3	Very high	94	Very high	8 Å²	8	57.7 Å²	57.7	8%	0.082	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	15.4	178.4	0	0	0	0	0	114.9	Y376 E377 P378 D382 K539	Y376-G380 PolarHBondContact O-N 3.47Å; E377-G380 PolarHBondContact O-N 2.99Å; P378-G380 VanDerWaalsContact C-N 3.28Å; G380-D382 PolarHBondContact O-N 2.95Å; G380-K539 WeakPolarHBondContact O-CD 3.4Å; G380-K539 WeakPolarHBondContact O-CG 3.3Å
381	L	93.4	Very high	94	Very high	11 Å²	11	58.7 Å²	58.7	6%	0.058	30%	0.298	C	S	.	.			trans	-76.6	116.5	-178.9	-160.5	66.2	0	0	0	111	M251 F255 L366 M369 A370 Y376 I386	M251-L381 HydrophobicContact SD-CD1 4.31Å; F255-L381 HydrophobicContact CE1-CD1 4.3Å; F255-L381 HydrophobicContact CE2-CD1 4.31Å; F255-L381 HydrophobicContact CZ-CD1 3.53Å; L366-L381 HydrophobicContact CD1-CD1 4.09Å; L366-L381 HydrophobicContact CD1-CD2 3.95Å; L366-L381 HydrophobicContact CD2-CD1 4.27Å; L366-L381 HydrophobicContact CG-CD1 4.2Å; L366-L381 HydrophobicContact CG-CD2 4.22Å; M369-L381 HydrophobicContact CB-CD2 4.09Å; A370-L381 HydrophobicContact CB-CD2 3.74Å; A370-L381 HydrophobicContact CB-CG 3.83Å; Y376-L381 HydrophobicContact CD1-CD2 3.9Å; Y376-L381 HydrophobicContact CG-CD2 4.16Å; Y376-L381 PolarHBondContact O-N 2.74Å; L381-I386 HydrophobicContact CD1-CD1 3.79Å; L381-I386 HydrophobicContact CD2-CD1 4.24Å; L381-I386 HydrophobicContact CG-CD1 3.7Å
382	D	92	Very high	94.1	Very high	51 Å²	51	55.6 Å²	55.6	27%	0.273	28%	0.277	S	S	.	.			trans	-95.1	110.8	-173.7	-162.6	-12.5	0	0	0	112.6	G380 T384 G385 I386 K539	G380-D382 PolarHBondContact O-N 2.95Å; D382-T384 VanDerWaalsContact C-N 3.33Å; D382-T384 PolarHBondContact O-N 2.96Å; D382-T384 PolarHBondContact OD1-N 3.01Å; D382-T384 PolarHBondContact OD1-OG1 2.72Å; D382-G385 PolarHBondContact O-N 2.9Å; D382-I386 WeakPolarHBondContact O-CD1 3.44Å; D382-I386 VanDerWaalsContact O-CG1 3.27Å; D382-I386 WeakPolarHBondContact O-CG1 3.32Å; D382-I386 PolarHBondContact O-N 2.92Å; D382-K539 HydrophobicContact CB-CD 4.13Å; D382-K539 VanDerWaalsContact CG-NZ 3.3Å; D382-K539 IonicContact OD2-NZ 2.68Å; D382-K539 PolarHBondContact OD2-NZ 3.36Å
383	A	93.3	Very high	94.2	Very high	26 Å²	26	47 Å²	47	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-62.9	-37.7	-179.6	0	0	0	0	0	112.8	A370 E387	A370-A383 HydrophobicContact CB-CB 3.97Å; A383-E387 WeakPolarHBondContact O-CB 2.84Å; A383-E387 PolarHBondContact O-N 3.44Å; A383-E387 VanDerWaalsContact O-N 3.08Å
384	T	92.4	Very high	94.3	Very high	86 Å²	86	40.8 Å²	40.8	53%	0.528	22%	0.218	S	C	.	.	H	α-helix	trans	-73.7	-40.7	-179.7	51.9	0	0	0	0	111.1	D382 I386 E387 D388	D382-T384 VanDerWaalsContact C-N 3.33Å; D382-T384 PolarHBondContact O-N 2.96Å; D382-T384 PolarHBondContact OD1-N 3.01Å; D382-T384 PolarHBondContact OD1-OG1 2.72Å; T384-I386 VanDerWaalsContact C-N 3.32Å; T384-I386 PolarHBondContact O-N 3.46Å; T384-E387 WeakPolarHBondContact O-CB 3.46Å; T384-E387 PolarHBondContact O-N 3.03Å; T384-E387 VanDerWaalsContact O-N 3.17Å; T384-D388 PolarHBondContact O-N 3.16Å
385	G	93.5	Very high	94.4	Very high	12 Å²	12	32.4 Å²	32.4	12%	0.124	18%	0.179	C	C	.	.	H	α-helix	trans	-61	-40.2	175.4	0	0	0	0	0	112.5	D382 D388 A389 C536	D382-G385 PolarHBondContact O-N 2.9Å; G385-D388 PolarHBondContact O-N 3.02Å; G385-A389 PolarHBondContact O-N 3.19Å; G385-C536 PolarHBondContact O-SG 3.01Å; G385-C536 VanDerWaalsContact O-SG 3.36Å
386	I	95.3	Very high	94.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-69	-36	176.3	-64.6	160.4	0	0	0	111.3	L363 L366 K367 A370 L381 D382 T384 A389 I390	L363-I386 HydrophobicContact CD2-CG2 4.47Å; L366-I386 HydrophobicContact CD2-CD1 3.76Å; L366-I386 HydrophobicContact CD2-CG1 4.02Å; L366-I386 HydrophobicContact CG-CD1 3.76Å; L366-I386 HydrophobicContact CG-CG1 4.49Å; K367-I386 HydrophobicContact CB-CG2 3.92Å; A370-I386 HydrophobicContact CB-CD1 3.62Å; L381-I386 HydrophobicContact CD1-CD1 3.79Å; L381-I386 HydrophobicContact CD2-CD1 4.24Å; L381-I386 HydrophobicContact CG-CD1 3.7Å; D382-I386 WeakPolarHBondContact O-CD1 3.44Å; D382-I386 VanDerWaalsContact O-CG1 3.27Å; D382-I386 WeakPolarHBondContact O-CG1 3.32Å; D382-I386 PolarHBondContact O-N 2.92Å; T384-I386 VanDerWaalsContact C-N 3.32Å; T384-I386 PolarHBondContact O-N 3.46Å; I386-A389 WeakPolarHBondContact O-CB 3.35Å; I386-A389 PolarHBondContact O-N 3.08Å; I386-I390 HydrophobicContact CG2-CD1 4.08Å; I386-I390 HydrophobicContact CG2-CG1 4.49Å; I386-I390 VanDerWaalsContact O-CG1 3.28Å; I386-I390 WeakPolarHBondContact O-CG1 3.27Å; I386-I390 PolarHBondContact O-N 2.83Å
387	E	95	Very high	94.7	Very high	54 Å²	54	29.1 Å²	29.1	25%	0.252	17%	0.166	S	C	.	.	H	α-helix	trans	-63.7	-41.9	173.7	-176	158.2	-133.2	0	0	111.7	K367 A383 T384 A389 I390 T391	K367-E387 IonicContact NZ-OE1 2.81Å; K367-E387 PolarHBondContact NZ-OE1 3.49Å; A383-E387 WeakPolarHBondContact O-CB 2.84Å; A383-E387 PolarHBondContact O-N 3.44Å; A383-E387 VanDerWaalsContact O-N 3.08Å; T384-E387 WeakPolarHBondContact O-CB 3.46Å; T384-E387 PolarHBondContact O-N 3.03Å; T384-E387 VanDerWaalsContact O-N 3.17Å; E387-A389 VanDerWaalsContact C-N 3.33Å; E387-A389 PolarHBondContact O-N 3.1Å; E387-I390 WeakPolarHBondContact O-CB 3.48Å; E387-I390 PolarHBondContact O-N 2.98Å; E387-T391 WeakPolarHBondContact O-CG2 3.22Å; E387-T391 PolarHBondContact O-N 3.28Å
388	D	94.6	Very high	94.7	Very high	92 Å²	92	26.3 Å²	26.3	49%	0.492	16%	0.155	S	C	.	.	H	α-helix	trans	-63	-38.9	172.4	-68.1	-25.2	0	0	0	111.7	T384 G385 T391 A392 I532	T384-D388 PolarHBondContact O-N 3.16Å; G385-D388 PolarHBondContact O-N 3.02Å; D388-T391 PolarHBondContact O-N 3.3Å; D388-T391 PolarHBondContact O-OG1 3.24Å; D388-A392 WeakPolarHBondContact O-CB 3.35Å; D388-A392 PolarHBondContact O-N 2.68Å; D388-I532 HydrophobicContact CB-CG2 4.07Å
389	A	96.1	Very high	94.7	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-43.7	174.2	0	0	0	0	0	111.9	L363 G385 I386 E387 T391 A392 V393 I532 I533	L363-A389 HydrophobicContact CD1-CB 4.27Å; L363-A389 HydrophobicContact CD2-CB 4.35Å; G385-A389 PolarHBondContact O-N 3.19Å; I386-A389 WeakPolarHBondContact O-CB 3.35Å; I386-A389 PolarHBondContact O-N 3.08Å; E387-A389 VanDerWaalsContact C-N 3.33Å; E387-A389 PolarHBondContact O-N 3.1Å; A389-T391 PolarHBondContact O-N 3.38Å; A389-A392 PolarHBondContact O-N 2.99Å; A389-V393 WeakPolarHBondContact O-CG2 3.45Å; A389-V393 PolarHBondContact O-N 2.95Å; A389-I532 HydrophobicContact CB-CG2 3.99Å; A389-I533 HydrophobicContact CB-CG1 3.92Å
390	I	96.4	Very high	94.7	Very high	23 Å²	23	24 Å²	24	12%	0.118	14%	0.139	C	C	.	.	H	α-helix	trans	-59.3	-46.3	176.3	-74.6	165.7	0	0	0	110.6	L360 L363 K367 I386 E387 A392 V393 G394	L360-I390 HydrophobicContact CD1-CB 4.44Å; L360-I390 HydrophobicContact CD1-CG2 3.77Å; L363-I390 HydrophobicContact CB-CD1 4.38Å; L363-I390 HydrophobicContact CB-CG1 3.72Å; K367-I390 HydrophobicContact CB-CD1 3.87Å; K367-I390 HydrophobicContact CD-CD1 3.8Å; K367-I390 HydrophobicContact CG-CD1 4.37Å; I386-I390 HydrophobicContact CG2-CD1 4.08Å; I386-I390 HydrophobicContact CG2-CG1 4.49Å; I386-I390 VanDerWaalsContact O-CG1 3.28Å; I386-I390 WeakPolarHBondContact O-CG1 3.27Å; I386-I390 PolarHBondContact O-N 2.83Å; E387-I390 WeakPolarHBondContact O-CB 3.48Å; E387-I390 PolarHBondContact O-N 2.98Å; I390-A392 VanDerWaalsContact C-N 3.35Å; I390-A392 PolarHBondContact O-N 2.96Å; I390-V393 PolarHBondContact O-N 3.45Å; I390-G394 PolarHBondContact O-N 3.41Å
391	T	95.6	Very high	94.7	Very high	22 Å²	22	26.7 Å²	26.7	14%	0.135	15%	0.152	C	C	.	.	H	α-helix	trans	-66.2	-37.9	178.8	61.4	0	0	0	0	111.9	E387 D388 A389 G394 S395	E387-T391 WeakPolarHBondContact O-CG2 3.22Å; E387-T391 PolarHBondContact O-N 3.28Å; D388-T391 PolarHBondContact O-N 3.3Å; D388-T391 PolarHBondContact O-OG1 3.24Å; A389-T391 PolarHBondContact O-N 3.38Å; T391-G394 PolarHBondContact O-N 3.18Å; T391-S395 PolarHBondContact O-N 3.38Å; T391-S395 PolarHBondContact O-OG 3.22Å
392	A	96.1	Very high	94.6	Very high	8 Å²	8	26.8 Å²	26.8	7%	0.066	15%	0.152	C	C	.	.	H	α-helix	trans	-64.9	-41.3	175.9	0	0	0	0	0	112.8	D388 A389 I390 S395 F396 M529 I532	D388-A392 WeakPolarHBondContact O-CB 3.35Å; D388-A392 PolarHBondContact O-N 2.68Å; A389-A392 PolarHBondContact O-N 2.99Å; I390-A392 VanDerWaalsContact C-N 3.35Å; I390-A392 PolarHBondContact O-N 2.96Å; A392-S395 WeakPolarHBondContact O-CB 3.2Å; A392-S395 PolarHBondContact O-N 3.49Å; A392-F396 PolarHBondContact O-N 3.13Å; A392-M529 HydrophobicContact CB-CB 4.29Å; A392-M529 HydrophobicContact CB-CG 4.49Å; A392-I532 HydrophobicContact CB-CD1 3.88Å
393	V	96.8	Very high	94.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.5	-42.3	172.8	173.7	0	0	0	0	110.5	L359 L360 L363 A389 I390 S395 F396 I397 M529 I533	L359-V393 HydrophobicContact CD2-CG1 4.32Å; L359-V393 HydrophobicContact CD2-CG2 3.69Å; L359-V393 HydrophobicContact CG-CG1 4.42Å; L359-V393 HydrophobicContact CG-CG2 4.02Å; L360-V393 HydrophobicContact CB-CG1 4.12Å; L360-V393 HydrophobicContact CD1-CG1 4.48Å; L363-V393 HydrophobicContact CD1-CG2 3.68Å; A389-V393 WeakPolarHBondContact O-CG2 3.45Å; A389-V393 PolarHBondContact O-N 2.95Å; I390-V393 PolarHBondContact O-N 3.45Å; V393-S395 PolarHBondContact O-N 3.15Å; V393-F396 WeakPolarHBondContact O-CB 3.41Å; V393-F396 PolarHBondContact O-N 3.16Å; V393-F396 VanDerWaalsContact O-N 3.12Å; V393-I397 HydrophobicContact CG1-CD1 4.02Å; V393-I397 HydrophobicContact CG1-CG1 4.48Å; V393-I397 WeakPolarHBondContact O-CG1 3.19Å; V393-I397 PolarHBondContact O-N 3.49Å; V393-M529 HydrophobicContact CB-SD 4.35Å; V393-M529 HydrophobicContact CG2-CG 3.79Å; V393-M529 HydrophobicContact CG2-SD 3.73Å; V393-I533 HydrophobicContact CG2-CD1 4.06Å
394	G	95.9	Very high	94.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.7	-44.1	174	0	0	0	0	0	112.9	I390 T391 F396 I397 L398	I390-G394 PolarHBondContact O-N 3.41Å; T391-G394 PolarHBondContact O-N 3.18Å; G394-F396 VanDerWaalsContact C-N 3.31Å; G394-F396 PolarHBondContact O-N 3.42Å; G394-I397 PolarHBondContact O-N 2.87Å; G394-L398 WeakPolarHBondContact O-CG 3.29Å; G394-L398 PolarHBondContact O-N 3.05Å
395	S	95.1	Very high	94.5	Very high	5 Å²	5	25.9 Å²	25.9	4%	0.035	14%	0.136	C	C	.	.	H	α-helix	trans	-60.8	-38.8	173.2	-62.6	0	0	0	0	112.5	T391 A392 V393 L398 K399 P515	T391-S395 PolarHBondContact O-N 3.38Å; T391-S395 PolarHBondContact O-OG 3.22Å; A392-S395 WeakPolarHBondContact O-CB 3.2Å; A392-S395 PolarHBondContact O-N 3.49Å; V393-S395 PolarHBondContact O-N 3.15Å; S395-L398 PolarHBondContact O-N 3.1Å; S395-K399 WeakPolarHBondContact O-CB 3.29Å; S395-K399 PolarHBondContact O-N 3.38Å; S395-P515 WeakPolarHBondContact CB-O 3.33Å; S395-P515 WeakPolarHBondContact OG-CD 3.49Å; S395-P515 PolarHBondContact OG-O 2.9Å
396	F	96.1	Very high	94.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.7	-44.6	176.7	-177.6	-106.9	0	0	0	112	I265 L352 S356 A392 V393 G394 L398 K399 A400 L522 V525 K526 M529	I265-F396 HydrophobicContact CG2-CE1 3.93Å; I265-F396 HydrophobicContact CG2-CZ 3.99Å; L352-F396 HydrophobicContact CD1-CE1 3.96Å; L352-F396 HydrophobicContact CD1-CZ 3.9Å; L352-F396 HydrophobicContact CD2-CE1 4.45Å; L352-F396 HydrophobicContact CD2-CZ 4.23Å; L352-F396 HydrophobicContact CG-CE1 4.11Å; L352-F396 HydrophobicContact CG-CZ 4.25Å; S356-F396 WeakPolarHBondContact OG-CE1 3.25Å; A392-F396 PolarHBondContact O-N 3.13Å; V393-F396 WeakPolarHBondContact O-CB 3.41Å; V393-F396 PolarHBondContact O-N 3.16Å; V393-F396 VanDerWaalsContact O-N 3.12Å; G394-F396 VanDerWaalsContact C-N 3.31Å; G394-F396 PolarHBondContact O-N 3.42Å; F396-L398 VanDerWaalsContact C-N 3.34Å; F396-L398 PolarHBondContact O-N 3.34Å; F396-K399 PolarHBondContact O-N 3.19Å; F396-K399 VanDerWaalsContact O-N 3.15Å; F396-A400 PolarHBondContact O-N 2.88Å; F396-L522 HydrophobicContact CD2-CD1 3.89Å; F396-L522 HydrophobicContact CE2-CD1 3.47Å; F396-L522 VanDerWaalsContact CE2-CD1 3.47Å; F396-L522 HydrophobicContact CE2-CG 3.9Å; F396-L522 HydrophobicContact CZ-CD1 4.17Å; F396-V525 HydrophobicContact CB-CG1 4Å; F396-V525 HydrophobicContact CD2-CB 4.46Å; F396-V525 HydrophobicContact CD2-CG1 4.22Å; F396-K526 HydrophobicContact CD2-CB 4.31Å; F396-K526 HydrophobicContact CE2-CB 3.82Å; F396-K526 HydrophobicContact CE2-CG 4.02Å; F396-K526 HydrophobicContact CZ-CG 4.38Å; F396-M529 HydrophobicContact CB-SD 3.83Å; F396-M529 HydrophobicContact CD1-CE 4.35Å; F396-M529 HydrophobicContact CD1-SD 4Å; F396-M529 HydrophobicContact CG-CE 4.42Å; F396-M529 HydrophobicContact CG-SD 3.9Å
397	I	95.5	Very high	93.9	Very high	33 Å²	33	26.3 Å²	26.3	17%	0.169	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-44.2	175.5	-66.8	166.9	0	0	0	110.9	S356 L360 V393 G394 K399 A400 N401	S356-I397 VanDerWaalsContact CB-CG1 3.47Å; L360-I397 HydrophobicContact CD2-CD1 4.28Å; V393-I397 HydrophobicContact CG1-CD1 4.02Å; V393-I397 HydrophobicContact CG1-CG1 4.48Å; V393-I397 WeakPolarHBondContact O-CG1 3.19Å; V393-I397 PolarHBondContact O-N 3.49Å; G394-I397 PolarHBondContact O-N 2.87Å; I397-K399 VanDerWaalsContact C-N 3.31Å; I397-K399 PolarHBondContact O-N 3.4Å; I397-A400 PolarHBondContact O-N 3.15Å; I397-N401 PolarHBondContact O-N 3.47Å
398	L	94	Very high	93.6	Very high	69 Å²	69	26.2 Å²	26.2	36%	0.361	14%	0.138	S	C	.	.	H	α-helix	trans	-60.4	-42.1	175.8	-72.6	174.8	0	0	0	111.6	G394 S395 F396 N401 E402 F514	G394-L398 WeakPolarHBondContact O-CG 3.29Å; G394-L398 PolarHBondContact O-N 3.05Å; S395-L398 PolarHBondContact O-N 3.1Å; F396-L398 VanDerWaalsContact C-N 3.34Å; F396-L398 PolarHBondContact O-N 3.34Å; L398-N401 PolarHBondContact O-N 3.41Å; L398-E402 PolarHBondContact O-N 3Å; L398-F514 HydrophobicContact CD1-CB 3.86Å; L398-F514 HydrophobicContact CD1-CD2 3.99Å; L398-F514 HydrophobicContact CD1-CG 4.45Å; L398-F514 HydrophobicContact CG-CD2 4.38Å
399	K	94.2	Very high	93.1	Very high	3 Å²	3	24.6 Å²	24.6	1%	0.013	13%	0.134	C	C	.	.	H	α-helix	trans	-68	-36.2	177.8	-171.5	56.6	60.3	-178.4	0	112.2	S395 F396 I397 E402 L403 Y478 Y517 L522 V525	S395-K399 WeakPolarHBondContact O-CB 3.29Å; S395-K399 PolarHBondContact O-N 3.38Å; F396-K399 PolarHBondContact O-N 3.19Å; F396-K399 VanDerWaalsContact O-N 3.15Å; I397-K399 VanDerWaalsContact C-N 3.31Å; I397-K399 PolarHBondContact O-N 3.4Å; K399-E402 IonicContact NZ-OE1 2.9Å; K399-E402 PolarHBondContact NZ-OE1 2.79Å; K399-E402 IonicContact NZ-OE2 2.76Å; K399-E402 PolarHBondContact NZ-OE2 3.06Å; K399-E402 PolarHBondContact O-N 3.01Å; K399-L403 PolarHBondContact O-N 3.43Å; K399-Y478 HydrophobicContact CD-CD1 3.89Å; K399-Y478 HydrophobicContact CD-CE1 3.67Å; K399-Y517 WeakPolarHBondContact CE-O 3.46Å; K399-Y517 PolarHBondContact NZ-O 2.88Å; K399-L522 HydrophobicContact CB-CD1 4.05Å; K399-L522 HydrophobicContact CG-CB 4.43Å; K399-L522 HydrophobicContact CG-CD1 3.7Å; K399-V525 HydrophobicContact CG-CG2 4.39Å
400	A	93.9	Very high	92.4	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-64.4	-39	172.4	0	0	0	0	0	112	L352 F396 I397 L403 L404	L352-A400 HydrophobicContact CD2-CB 3.92Å; F396-A400 PolarHBondContact O-N 2.88Å; I397-A400 PolarHBondContact O-N 3.15Å; A400-L403 WeakPolarHBondContact O-CB 3.48Å; A400-L403 PolarHBondContact O-N 2.83Å; A400-L404 PolarHBondContact O-N 2.87Å
401	N	93.8	Very high	91.8	Very high	65 Å²	65	25.6 Å²	25.6	35%	0.348	14%	0.139	S	C	.	.	H	α-helix	trans	-69.4	-37.9	175.3	-167.2	27.2	0	0	0	112.4	I397 L398 L403 L404 Q405	I397-N401 PolarHBondContact O-N 3.47Å; L398-N401 PolarHBondContact O-N 3.41Å; N401-L403 VanDerWaalsContact C-N 3.35Å; N401-L404 WeakPolarHBondContact O-CB 3.38Å; N401-L404 PolarHBondContact O-N 2.68Å; N401-Q405 WeakPolarHBondContact O-CG 3.36Å; N401-Q405 PolarHBondContact O-N 3.29Å
402	E	91.9	Very high	91.3	Very high	13 Å²	13	30.7 Å²	30.7	6%	0.061	16%	0.159	C	C	.	.	H	α-helix	trans	-60.3	-44.8	171.5	-174.9	-176.8	128	0	0	111.2	L398 K399 L404 Q405 V406 Y478 P490 Y516	L398-E402 PolarHBondContact O-N 3Å; K399-E402 IonicContact NZ-OE1 2.9Å; K399-E402 PolarHBondContact NZ-OE1 2.79Å; K399-E402 IonicContact NZ-OE2 2.76Å; K399-E402 PolarHBondContact NZ-OE2 3.06Å; K399-E402 PolarHBondContact O-N 3.01Å; E402-L404 VanDerWaalsContact C-N 3.32Å; E402-L404 PolarHBondContact O-N 2.85Å; E402-Q405 PolarHBondContact O-N 3.14Å; E402-V406 WeakPolarHBondContact O-CG2 3.42Å; E402-V406 PolarHBondContact O-N 3.3Å; E402-Y478 HydrophobicContact CG-CE1 4.41Å; E402-Y478 WeakPolarHBondContact OE1-CE1 3.1Å; E402-Y478 PolarHBondContact OE1-OH 2.8Å; E402-P490 HydrophobicContact CG-CG 3.93Å; E402-P490 VanDerWaalsContact OE1-CG 3.32Å; E402-P490 WeakPolarHBondContact OE1-CG 3.34Å; E402-Y516 WeakPolarHBondContact OE2-CE2 3.44Å; E402-Y516 PolarHBondContact OE2-OH 3.49Å
403	L	92	Very high	90.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.7	-42.8	173.5	173.6	60.7	0	0	0	111.7	M272 V348 K399 A400 N401 Q405 V406 I407 V475 Y478 L479 L522	M272-L403 HydrophobicContact CE-CD2 3.72Å; V348-L403 HydrophobicContact CG2-CD2 4.35Å; K399-L403 PolarHBondContact O-N 3.43Å; A400-L403 WeakPolarHBondContact O-CB 3.48Å; A400-L403 PolarHBondContact O-N 2.83Å; N401-L403 VanDerWaalsContact C-N 3.35Å; L403-Q405 VanDerWaalsContact C-N 3.32Å; L403-Q405 PolarHBondContact O-N 3.05Å; L403-V406 PolarHBondContact O-N 3.41Å; L403-I407 HydrophobicContact CD1-CD1 3.97Å; L403-I407 HydrophobicContact CD1-CG1 4.1Å; L403-I407 HydrophobicContact CD2-CD1 4.47Å; L403-I407 HydrophobicContact CG-CD1 3.8Å; L403-I407 HydrophobicContact CG-CG1 4.4Å; L403-I407 VanDerWaalsContact O-CG1 3.32Å; L403-I407 WeakPolarHBondContact O-CG1 3.44Å; L403-I407 PolarHBondContact O-N 3.33Å; L403-V475 HydrophobicContact CD1-CG1 4.25Å; L403-Y478 HydrophobicContact CD1-CD2 4.05Å; L403-Y478 HydrophobicContact CD1-CG 3.99Å; L403-L479 HydrophobicContact CD2-CD2 4.07Å; L403-L522 HydrophobicContact CD2-CD2 3.82Å
404	L	92.3	Very high	89.8	Confident	20 Å²	20	30.8 Å²	30.8	11%	0.105	16%	0.158	C	C	.	.	H	α-helix	trans	-58.8	-43.3	176.7	-179.5	62.6	0	0	0	111.9	Q345 V348 I349 A400 N401 E402 V406 I407 D408	Q345-L404 HydrophobicContact CG-CD1 3.79Å; V348-L404 HydrophobicContact CG1-CB 4.23Å; I349-L404 HydrophobicContact CD1-CD1 4.03Å; I349-L404 HydrophobicContact CD1-CD2 4.24Å; I349-L404 HydrophobicContact CG1-CD1 4.04Å; I349-L404 HydrophobicContact CG1-CD2 3.93Å; A400-L404 PolarHBondContact O-N 2.87Å; N401-L404 WeakPolarHBondContact O-CB 3.38Å; N401-L404 PolarHBondContact O-N 2.68Å; E402-L404 VanDerWaalsContact C-N 3.32Å; E402-L404 PolarHBondContact O-N 2.85Å; L404-V406 VanDerWaalsContact C-N 3.34Å; L404-V406 PolarHBondContact O-N 2.89Å; L404-I407 PolarHBondContact O-N 3.09Å; L404-D408 PolarHBondContact O-N 3.13Å
405	Q	90.4	Very high	89.2	Confident	123 Å²	123	36.7 Å²	36.7	58%	0.575	18%	0.184	S	C	*	.	H	α-helix	trans	-63.8	-40	176.3	-67.5	174.7	15.5	0	0	112.1	N401 E402 L403 D408 S409	N401-Q405 WeakPolarHBondContact O-CG 3.36Å; N401-Q405 PolarHBondContact O-N 3.29Å; E402-Q405 PolarHBondContact O-N 3.14Å; L403-Q405 VanDerWaalsContact C-N 3.32Å; L403-Q405 PolarHBondContact O-N 3.05Å; Q405-D408 PolarHBondContact O-N 3.04Å; Q405-S409 WeakPolarHBondContact O-CB 3.49Å; Q405-S409 PolarHBondContact O-N 3.1Å
406	V	87.9	Confident	88.7	Confident	22 Å²	22	37 Å²	37	13%	0.133	19%	0.187	C	C	.	.	H	α-helix	trans	-65.2	-41.6	176.1	173.7	0	0	0	0	111	E402 L403 L404 S409 S410 R474 V475 Y478	E402-V406 WeakPolarHBondContact O-CG2 3.42Å; E402-V406 PolarHBondContact O-N 3.3Å; L403-V406 PolarHBondContact O-N 3.41Å; L404-V406 VanDerWaalsContact C-N 3.34Å; L404-V406 PolarHBondContact O-N 2.89Å; V406-S409 PolarHBondContact O-N 3.16Å; V406-S410 VanDerWaalsContact O-CB 3.24Å; V406-S410 WeakPolarHBondContact O-CB 3.43Å; V406-S410 PolarHBondContact O-N 3.16Å; V406-R474 HydrophobicContact CG1-CB 4.17Å; V406-V475 HydrophobicContact CG1-CG2 3.95Å; V406-Y478 HydrophobicContact CB-CE2 4.43Å; V406-Y478 HydrophobicContact CG1-CE2 4.28Å; V406-Y478 HydrophobicContact CG2-CE2 4Å
407	I	88.3	Confident	88.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.2	-48.5	174.5	-72.2	164.1	0	0	0	110.4	Y341 I344 Q345 V348 L403 L404 S409 S410 M411 V475	Y341-I407 HydrophobicContact CD1-CG2 3.93Å; I344-I407 HydrophobicContact CG2-CD1 3.66Å; Q345-I407 HydrophobicContact CB-CG2 4.28Å; V348-I407 HydrophobicContact CG2-CD1 4.29Å; L403-I407 HydrophobicContact CD1-CD1 3.97Å; L403-I407 HydrophobicContact CD1-CG1 4.1Å; L403-I407 HydrophobicContact CD2-CD1 4.47Å; L403-I407 HydrophobicContact CG-CD1 3.8Å; L403-I407 HydrophobicContact CG-CG1 4.4Å; L403-I407 VanDerWaalsContact O-CG1 3.32Å; L403-I407 WeakPolarHBondContact O-CG1 3.44Å; L403-I407 PolarHBondContact O-N 3.33Å; L404-I407 PolarHBondContact O-N 3.09Å; I407-S409 PolarHBondContact O-N 2.89Å; I407-S410 PolarHBondContact O-N 3.24Å; I407-M411 WeakPolarHBondContact O-CB 3.44Å; I407-M411 PolarHBondContact O-N 2.96Å; I407-V475 HydrophobicContact CG1-CG1 4.17Å; I407-V475 HydrophobicContact CG1-CG2 4.17Å
408	D	88.1	Confident	87.7	Confident	52 Å²	52	37.4 Å²	37.4	28%	0.278	19%	0.187	S	C	.	.	H	α-helix	trans	-63.3	-40.5	-179.7	-84.1	-24.1	0	0	0	112.8	Q345 L404 Q405 K412	Q345-D408 PolarHBondContact NE2-OD1 2.85Å; L404-D408 PolarHBondContact O-N 3.13Å; Q405-D408 PolarHBondContact O-N 3.04Å; D408-K412 WeakPolarHBondContact O-CD 3.46Å; D408-K412 VanDerWaalsContact O-CG 3.29Å; D408-K412 WeakPolarHBondContact O-CG 3.37Å; D408-K412 PolarHBondContact O-N 2.96Å
409	S	84.7	Confident	87.3	Confident	57 Å²	57	38.1 Å²	38.1	40%	0.399	19%	0.185	S	C	.	.	H	α-helix	trans	-64.6	-47.6	175.4	-167.5	0	0	0	0	110.9	Q405 V406 I407 M411 K412 N413	Q405-S409 WeakPolarHBondContact O-CB 3.49Å; Q405-S409 PolarHBondContact O-N 3.1Å; V406-S409 PolarHBondContact O-N 3.16Å; I407-S409 PolarHBondContact O-N 2.89Å; S409-M411 PolarHBondContact O-N 3.29Å; S409-K412 PolarHBondContact O-N 2.77Å; S409-N413 PolarHBondContact O-N 3.07Å
410	S	82.4	Confident	87	Confident	6 Å²	6	39.1 Å²	39.1	4%	0.042	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-47.7	177.8	-173.3	0	0	0	0	111.4	Y341 V406 I407 K412 N413 F414	Y341-S410 PolarHBondContact OH-OG 3.46Å; V406-S410 VanDerWaalsContact O-CB 3.24Å; V406-S410 WeakPolarHBondContact O-CB 3.43Å; V406-S410 PolarHBondContact O-N 3.16Å; I407-S410 PolarHBondContact O-N 3.24Å; S410-K412 VanDerWaalsContact C-N 3.33Å; S410-K412 PolarHBondContact O-N 2.99Å; S410-N413 PolarHBondContact O-N 3.01Å; S410-N413 VanDerWaalsContact O-N 3.15Å; S410-F414 WeakPolarHBondContact O-CB 3.45Å; S410-F414 VanDerWaalsContact O-CD2 3.29Å; S410-F414 WeakPolarHBondContact O-CD2 3.46Å; S410-F414 PolarHBondContact O-N 2.98Å; S410-F414 WeakPolarHBondContact OG-CD2 3.47Å; S410-F414 WeakPolarHBondContact OG-CE2 3.49Å
411	M	83.5	Confident	86.7	Confident	38 Å²	38	39.3 Å²	39.3	19%	0.187	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-39.5	-179.3	-168.9	-175.9	-179.2	0	0	112.2	E338 I407 S409 K415	E338-M411 HydrophobicContact CG-CE 3.81Å; I407-M411 WeakPolarHBondContact O-CB 3.44Å; I407-M411 PolarHBondContact O-N 2.96Å; S409-M411 PolarHBondContact O-N 3.29Å; M411-K415 VanDerWaalsContact O-CB 3.28Å; M411-K415 WeakPolarHBondContact O-CB 3.45Å; M411-K415 PolarHBondContact O-N 3.34Å
412	K	83.8	Confident	86.3	Confident	130 Å²	130	38 Å²	38	57%	0.565	18%	0.18	S	C	*	.	H	α-helix	trans	-64.4	-45.5	174.4	-73.1	168.2	-172.5	164.4	0	111.7	D408 S409 S410 K415 A416	D408-K412 WeakPolarHBondContact O-CD 3.46Å; D408-K412 VanDerWaalsContact O-CG 3.29Å; D408-K412 WeakPolarHBondContact O-CG 3.37Å; D408-K412 PolarHBondContact O-N 2.96Å; S409-K412 PolarHBondContact O-N 2.77Å; S410-K412 VanDerWaalsContact C-N 3.33Å; S410-K412 PolarHBondContact O-N 2.99Å; K412-K415 PolarHBondContact O-N 2.94Å; K412-A416 PolarHBondContact O-N 2.9Å
413	N	81.2	Confident	86	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-63.5	-46.1	179	-71.2	-5.1	0	0	0	111.4	S409 S410 K415 A416 F417 F451 E454	S409-N413 PolarHBondContact O-N 3.07Å; S410-N413 PolarHBondContact O-N 3.01Å; S410-N413 VanDerWaalsContact O-N 3.15Å; N413-K415 PolarHBondContact O-N 3.1Å; N413-A416 PolarHBondContact O-N 2.79Å; N413-F417 WeakPolarHBondContact O-CB 3.35Å; N413-F417 PolarHBondContact O-N 2.75Å; N413-F451 HydrophobicContact CB-CB 4.17Å; N413-F451 HydrophobicContact CB-CD2 3.89Å; N413-E454 PolarHBondContact ND2-OE2 3.47Å
414	F	80.3	Confident	85.7	Confident	6 Å²	6	38.5 Å²	38.5	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-59.9	-44.7	175	-90.3	-72.1	0	0	0	112.4	M283 Y341 S410 A416 F417 F418 F451 V472	M283-F414 HydrophobicContact CE-CE1 4Å; M283-F414 HydrophobicContact CE-CZ 4.25Å; M283-F414 HydrophobicContact SD-CE1 3.67Å; M283-F414 HydrophobicContact SD-CZ 3.77Å; Y341-F414 AromaticContact CE2-CD2 3.91Å; Y341-F414 HydrophobicContact CE2-CD2 3.91Å; Y341-F414 HydrophobicContact CE2-CE2 4.06Å; S410-F414 WeakPolarHBondContact O-CB 3.45Å; S410-F414 VanDerWaalsContact O-CD2 3.29Å; S410-F414 WeakPolarHBondContact O-CD2 3.46Å; S410-F414 PolarHBondContact O-N 2.98Å; S410-F414 WeakPolarHBondContact OG-CD2 3.47Å; S410-F414 WeakPolarHBondContact OG-CE2 3.49Å; F414-A416 PolarHBondContact O-N 3.06Å; F414-F417 PolarHBondContact O-N 3.42Å; F414-F418 HydrophobicContact CB-CD2 4.49Å; F414-F418 HydrophobicContact CD1-CD2 4.26Å; F414-F418 AromaticContact CD1-CE2 3.73Å; F414-F418 HydrophobicContact CD1-CE2 3.73Å; F414-F418 HydrophobicContact CE1-CE2 4.44Å; F414-F418 VanDerWaalsContact O-CD2 3.27Å; F414-F418 WeakPolarHBondContact O-CD2 3.31Å; F414-F418 PolarHBondContact O-N 3.27Å; F414-F451 AromaticContact CD1-CE2 3.53Å; F414-F451 HydrophobicContact CD1-CE2 3.53Å; F414-F451 AromaticContact CD1-CZ 3.73Å; F414-F451 HydrophobicContact CD1-CZ 3.73Å; F414-F451 AromaticContact CD2-CE2 3.99Å; F414-F451 HydrophobicContact CD2-CE2 3.99Å; F414-F451 AromaticContact CE1-CE2 3.51Å; F414-F451 HydrophobicContact CE1-CE2 3.51Å; F414-F451 AromaticContact CE1-CZ 3.52Å; F414-F451 HydrophobicContact CE1-CZ 3.52Å; F414-F451 AromaticContact CE2-CE2 3.93Å; F414-F451 HydrophobicContact CE2-CE2 3.93Å; F414-F451 AromaticContact CG-CE2 3.79Å; F414-F451 HydrophobicContact CG-CE2 3.79Å; F414-F451 HydrophobicContact CG-CZ 4.43Å; F414-F451 AromaticContact CZ-CE2 3.7Å; F414-F451 HydrophobicContact CZ-CE2 3.7Å; F414-F451 HydrophobicContact CZ-CZ 4.04Å; F414-V472 HydrophobicContact CE2-CG1 4.4Å; F414-V472 HydrophobicContact CZ-CG1 3.88Å
415	K	83.8	Confident	85.3	Confident	124 Å²	124	37.5 Å²	37.5	54%	0.539	18%	0.181	S	C	.	.	H	α-helix	trans	-63.5	-41	179.7	-171	166.2	-168.8	143.4	0	112	E338 M411 K412 N413 R419	E338-K415 IonicContact OE1-NZ 2.72Å; E338-K415 PolarHBondContact OE1-NZ 3.42Å; M411-K415 VanDerWaalsContact O-CB 3.28Å; M411-K415 WeakPolarHBondContact O-CB 3.45Å; M411-K415 PolarHBondContact O-N 3.34Å; K412-K415 PolarHBondContact O-N 2.94Å; N413-K415 PolarHBondContact O-N 3.1Å; K415-R419 VanDerWaalsContact O-CB 3.3Å; K415-R419 WeakPolarHBondContact O-CB 3.49Å; K415-R419 PolarHBondContact O-N 3.07Å; K415-R419 VanDerWaalsContact O-N 3.13Å
416	A	84.9	Confident	85	Confident	11 Å²	11	32.3 Å²	32.3	9%	0.091	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-47.3	174.5	0	0	0	0	0	111.4	K412 N413 F414 R419 W420 F447 V448	K412-A416 PolarHBondContact O-N 2.9Å; N413-A416 PolarHBondContact O-N 2.79Å; F414-A416 PolarHBondContact O-N 3.06Å; A416-R419 PolarHBondContact O-N 3.32Å; A416-W420 WeakPolarHBondContact O-CB 3.48Å; A416-W420 PolarHBondContact O-N 2.91Å; A416-F447 HydrophobicContact CB-CB 3.87Å; A416-V448 HydrophobicContact CB-CG2 4.22Å
417	F	85.5	Confident	84.7	Confident	12 Å²	12	38.7 Å²	38.7	5%	0.053	18%	0.178	C	C	.	.	H	α-helix	trans	-59.5	-51.4	177.6	173.3	-100	0	0	0	112.9	F304 N413 F414 R419 W420 L421 V448 F451 L452	F304-F417 HydrophobicContact CD1-CE2 4.4Å; F304-F417 HydrophobicContact CE1-CZ 4.36Å; N413-F417 WeakPolarHBondContact O-CB 3.35Å; N413-F417 PolarHBondContact O-N 2.75Å; F414-F417 PolarHBondContact O-N 3.42Å; F417-R419 VanDerWaalsContact C-N 3.33Å; F417-R419 PolarHBondContact O-N 3.21Å; F417-W420 AromaticContact CD2-CE3 3.88Å; F417-W420 HydrophobicContact CD2-CE3 3.88Å; F417-W420 AromaticContact CD2-CZ3 3.94Å; F417-W420 HydrophobicContact CD2-CZ3 3.94Å; F417-W420 HydrophobicContact CE2-CE3 4.05Å; F417-W420 AromaticContact CE2-CZ3 3.67Å; F417-W420 HydrophobicContact CE2-CZ3 3.67Å; F417-W420 PolarHBondContact O-N 3Å; F417-W420 VanDerWaalsContact O-N 3.14Å; F417-L421 HydrophobicContact CE1-CD2 3.88Å; F417-L421 HydrophobicContact CZ-CD2 3.76Å; F417-L421 WeakPolarHBondContact O-CB 3.13Å; F417-L421 PolarHBondContact O-N 3.14Å; F417-V448 HydrophobicContact CD2-CG1 4.35Å; F417-F451 HydrophobicContact CB-CD1 3.59Å; F417-F451 HydrophobicContact CB-CD2 4.4Å; F417-F451 HydrophobicContact CB-CE1 3.72Å; F417-F451 HydrophobicContact CB-CG 3.94Å; F417-F451 HydrophobicContact CB-CZ 4.24Å; F417-F451 HydrophobicContact CD1-CD1 4.19Å; F417-F451 AromaticContact CD1-CE1 3.48Å; F417-F451 HydrophobicContact CD1-CE1 3.48Å; F417-F451 VanDerWaalsContact CD1-CE1 3.48Å; F417-F451 AromaticContact CD1-CZ 3.89Å; F417-F451 HydrophobicContact CD1-CZ 3.89Å; F417-F451 AromaticContact CD2-CD1 3.34Å; F417-F451 HydrophobicContact CD2-CD1 3.34Å; F417-F451 AromaticContact CD2-CE1 3.34Å; F417-F451 HydrophobicContact CD2-CE1 3.34Å; F417-F451 HydrophobicContact CD2-CG 4.43Å; F417-F451 HydrophobicContact CD2-CZ 4.46Å; F417-F451 AromaticContact CE1-CE1 3.84Å; F417-F451 HydrophobicContact CE1-CE1 3.84Å; F417-F451 HydrophobicContact CE1-CZ 4.35Å; F417-F451 HydrophobicContact CE2-CD1 4Å; F417-F451 AromaticContact CE2-CE1 3.7Å; F417-F451 HydrophobicContact CE2-CE1 3.7Å; F417-F451 AromaticContact CG-CD1 3.43Å; F417-F451 HydrophobicContact CG-CD1 3.43Å; F417-F451 VanDerWaalsContact CG-CD1 3.43Å; F417-F451 AromaticContact CG-CE1 3.2Å; F417-F451 HydrophobicContact CG-CE1 3.2Å; F417-F451 HydrophobicContact CG-CG 4.28Å; F417-F451 AromaticContact CG-CZ 3.95Å; F417-F451 HydrophobicContact CG-CZ 3.95Å; F417-F451 AromaticContact CZ-CE1 3.94Å; F417-F451 HydrophobicContact CZ-CE1 3.94Å; F417-L452 HydrophobicContact CD2-CD2 4.3Å; F417-L452 HydrophobicContact CE2-CD2 3.85Å
418	F	85	Confident	84.4	Confident	29 Å²	29	40.9 Å²	40.9	13%	0.127	19%	0.189	C	C	.	.	H	α-helix	trans	-64	-38.6	-179.3	-84.8	-65.1	0	0	0	112.4	L330 L333 I337 F414 W420 Y422	L330-F418 HydrophobicContact CD1-CD1 3.62Å; L330-F418 HydrophobicContact CD1-CE1 3.61Å; L330-F418 HydrophobicContact CG-CD1 4.09Å; L330-F418 HydrophobicContact CG-CE1 4.42Å; L333-F418 HydrophobicContact CD2-CE1 4.09Å; L333-F418 HydrophobicContact CD2-CZ 4.11Å; L333-F418 HydrophobicContact CG-CE1 4.3Å; L333-F418 HydrophobicContact CG-CZ 4.12Å; I337-F418 HydrophobicContact CD1-CE2 3.79Å; I337-F418 HydrophobicContact CD1-CZ 3.67Å; F414-F418 HydrophobicContact CB-CD2 4.49Å; F414-F418 HydrophobicContact CD1-CD2 4.26Å; F414-F418 AromaticContact CD1-CE2 3.73Å; F414-F418 HydrophobicContact CD1-CE2 3.73Å; F414-F418 HydrophobicContact CE1-CE2 4.44Å; F414-F418 VanDerWaalsContact O-CD2 3.27Å; F414-F418 WeakPolarHBondContact O-CD2 3.31Å; F414-F418 PolarHBondContact O-N 3.27Å; F418-W420 VanDerWaalsContact C-N 3.3Å; F418-W420 PolarHBondContact O-N 2.76Å; F418-Y422 WeakPolarHBondContact O-CB 3.41Å; F418-Y422 PolarHBondContact O-N 3.49Å
419	R	85.3	Confident	83.9	Confident	84 Å²	84	40.9 Å²	40.9	32%	0.317	19%	0.191	S	C	.	.	H	α-helix	trans	-62.1	-41.8	174.9	-168	-173.6	172.8	-158.9	-3.3	110.7	K415 A416 F417 V423 K439 M440 D444	K415-R419 VanDerWaalsContact O-CB 3.3Å; K415-R419 WeakPolarHBondContact O-CB 3.49Å; K415-R419 PolarHBondContact O-N 3.07Å; K415-R419 VanDerWaalsContact O-N 3.13Å; A416-R419 PolarHBondContact O-N 3.32Å; F417-R419 VanDerWaalsContact C-N 3.33Å; F417-R419 PolarHBondContact O-N 3.21Å; R419-V423 WeakPolarHBondContact O-CG2 3.34Å; R419-V423 PolarHBondContact O-N 3.14Å; R419-K439 PolarHBondContact NH1-O 2.73Å; R419-K439 PolarHBondContact NH2-O 3.33Å; R419-M440 HydrophobicContact CB-CE 3.79Å; R419-M440 HydrophobicContact CG-CE 3.55Å; R419-M440 WeakPolarHBondContact O-CE 3.29Å; R419-D444 IonicContact NH1-OD2 3.7Å
420	W	89.1	Confident	83.2	Confident	25 Å²	25	47.1 Å²	47.1	10%	0.095	21%	0.214	C	C	.	.	H	α-helix	trans	-67	-51.1	178.9	163.6	74.2	0	0	0	111.4	F304 L307 L308 A416 F417 F418 Y422 V423 A424 M440 V448	F304-W420 AromaticContact CD1-CH2 3.96Å; F304-W420 HydrophobicContact CD1-CH2 3.96Å; F304-W420 AromaticContact CD1-CZ3 4Å; F304-W420 HydrophobicContact CD1-CZ3 4Å; L307-W420 HydrophobicContact CB-CZ2 4.42Å; L307-W420 HydrophobicContact CD2-CH2 4.1Å; L307-W420 HydrophobicContact CD2-CZ2 4.18Å; L307-W420 HydrophobicContact CG-CH2 4.25Å; L307-W420 HydrophobicContact CG-CZ2 3.96Å; L308-W420 HydrophobicContact CB-CH2 4.25Å; L308-W420 HydrophobicContact CB-CZ2 3.71Å; L308-W420 HydrophobicContact CD1-CD2 4.09Å; L308-W420 VanDerWaalsContact CD1-CE2 3.47Å; L308-W420 HydrophobicContact CD1-CG 4.3Å; L308-W420 HydrophobicContact CD1-CZ2 3.81Å; L308-W420 VanDerWaalsContact CD1-NE1 3.31Å; L308-W420 HydrophobicContact CG-CZ2 4.38Å; A416-W420 WeakPolarHBondContact O-CB 3.48Å; A416-W420 PolarHBondContact O-N 2.91Å; F417-W420 AromaticContact CD2-CE3 3.88Å; F417-W420 HydrophobicContact CD2-CE3 3.88Å; F417-W420 AromaticContact CD2-CZ3 3.94Å; F417-W420 HydrophobicContact CD2-CZ3 3.94Å; F417-W420 HydrophobicContact CE2-CE3 4.05Å; F417-W420 AromaticContact CE2-CZ3 3.67Å; F417-W420 HydrophobicContact CE2-CZ3 3.67Å; F417-W420 PolarHBondContact O-N 3Å; F417-W420 VanDerWaalsContact O-N 3.14Å; F418-W420 VanDerWaalsContact C-N 3.3Å; F418-W420 PolarHBondContact O-N 2.76Å; W420-Y422 VanDerWaalsContact C-N 3.26Å; W420-Y422 PolarHBondContact O-N 2.88Å; W420-V423 PolarHBondContact O-N 2.95Å; W420-V423 VanDerWaalsContact O-N 3.14Å; W420-A424 WeakPolarHBondContact O-CB 3.39Å; W420-A424 PolarHBondContact O-N 3.29Å; W420-M440 HydrophobicContact CB-CE 3.7Å; W420-M440 HydrophobicContact CB-SD 3.96Å; W420-V448 HydrophobicContact CB-CG2 3.83Å; W420-V448 HydrophobicContact CD2-CG1 3.81Å; W420-V448 HydrophobicContact CE3-CG1 3.62Å; W420-V448 HydrophobicContact CG-CG1 4.2Å; W420-V448 HydrophobicContact CG-CG2 4.24Å; W420-V448 HydrophobicContact CZ3-CG1 4.1Å
421	L	86.8	Confident	82.6	Confident	4 Å²	4	51 Å²	51	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-61.8	-37.8	-178.7	-173.1	56.9	0	0	0	111.5	F304 L321 L330 F417 A424 M425	F304-L421 HydrophobicContact CD1-CD1 4.5Å; F304-L421 HydrophobicContact CE1-CD1 3.86Å; F304-L421 HydrophobicContact CE1-CD2 4.23Å; L321-L421 HydrophobicContact CD1-CD1 4.07Å; L321-L421 HydrophobicContact CD2-CD1 3.91Å; L321-L421 HydrophobicContact CD2-CD2 4.21Å; L321-L421 HydrophobicContact CD2-CG 4.38Å; L330-L421 HydrophobicContact CD1-CD2 3.74Å; L330-L421 HydrophobicContact CD1-CG 4.26Å; L330-L421 HydrophobicContact CD2-CB 4.3Å; L330-L421 HydrophobicContact CD2-CD2 4.48Å; L330-L421 HydrophobicContact CD2-CG 4.11Å; F417-L421 HydrophobicContact CE1-CD2 3.88Å; F417-L421 HydrophobicContact CZ-CD2 3.76Å; F417-L421 WeakPolarHBondContact O-CB 3.13Å; F417-L421 PolarHBondContact O-N 3.14Å; L421-A424 PolarHBondContact O-N 3.5Å; L421-M425 HydrophobicContact CD1-CG 4.47Å; L421-M425 HydrophobicContact CG-SD 4.4Å; L421-M425 WeakPolarHBondContact O-CB 3.42Å; L421-M425 VanDerWaalsContact O-CG 3.3Å; L421-M425 WeakPolarHBondContact O-CG 3.05Å; L421-M425 PolarHBondContact O-N 3Å
422	Y	85.7	Confident	81.9	Confident	38 Å²	38	57.5 Å²	57.5	15%	0.149	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-45.7	175.1	-179.7	-102.4	0	0	0	112.4	V327 L330 K331 F418 W420 M425 L426 L437	V327-Y422 HydrophobicContact CG1-CD2 4.11Å; V327-Y422 HydrophobicContact CG1-CE2 3.48Å; V327-Y422 VanDerWaalsContact CG1-CE2 3.48Å; L330-Y422 HydrophobicContact CD2-CD2 4.27Å; K331-Y422 HydrophobicContact CD-CE2 4.11Å; K331-Y422 WeakPolarHBondContact CE-OH 3.29Å; K331-Y422 HydrophobicContact CG-CD2 4.18Å; K331-Y422 HydrophobicContact CG-CE2 3.85Å; K331-Y422 PolarHBondContact NZ-OH 3.29Å; F418-Y422 WeakPolarHBondContact O-CB 3.41Å; F418-Y422 PolarHBondContact O-N 3.49Å; W420-Y422 VanDerWaalsContact C-N 3.26Å; W420-Y422 PolarHBondContact O-N 2.88Å; Y422-M425 PolarHBondContact O-N 3.38Å; Y422-L426 HydrophobicContact CD1-CD1 4.03Å; Y422-L426 HydrophobicContact CE1-CD1 3.43Å; Y422-L426 VanDerWaalsContact CE1-CD1 3.43Å; Y422-L426 HydrophobicContact CE1-CG 4.29Å; Y422-L426 HydrophobicContact CE2-CD1 4.5Å; Y422-L426 WeakPolarHBondContact O-CG 3.39Å; Y422-L426 PolarHBondContact O-N 3.08Å; Y422-L426 VanDerWaalsContact O-N 3.13Å; Y422-L437 HydrophobicContact CD1-CD2 4Å; Y422-L437 HydrophobicContact CE1-CD1 3.92Å; Y422-L437 HydrophobicContact CE1-CD2 4.14Å
423	V	84.5	Confident	81.2	Confident	7 Å²	7	52.6 Å²	52.6	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-67.4	-39.2	176.8	174.2	0	0	0	0	111.3	R419 W420 L426 R427 V433 L437	R419-V423 WeakPolarHBondContact O-CG2 3.34Å; R419-V423 PolarHBondContact O-N 3.14Å; W420-V423 PolarHBondContact O-N 2.95Å; W420-V423 VanDerWaalsContact O-N 3.14Å; V423-L426 PolarHBondContact O-N 3.48Å; V423-R427 WeakPolarHBondContact O-CG 3.28Å; V423-R427 PolarHBondContact O-N 3.42Å; V423-R427 VanDerWaalsContact O-N 3.11Å; V423-V433 HydrophobicContact CG1-CG1 4.39Å; V423-L437 HydrophobicContact CG2-CB 4.13Å; V423-L437 HydrophobicContact CG2-CD2 4.32Å
424	A	85.4	Confident	80.5	Confident	16 Å²	16	57.5 Å²	57.5	13%	0.132	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-45.6	176.3	0	0	0	0	0	111.2	W420 L421 R427 M428	W420-A424 WeakPolarHBondContact O-CB 3.39Å; W420-A424 PolarHBondContact O-N 3.29Å; L421-A424 PolarHBondContact O-N 3.5Å; A424-R427 PolarHBondContact O-N 3.28Å; A424-M428 VanDerWaalsContact O-CG 3.27Å; A424-M428 WeakPolarHBondContact O-CG 3.41Å; A424-M428 PolarHBondContact O-N 3.15Å; A424-M428 VanDerWaalsContact O-N 3.12Å
425	M	85.4	Confident	79.5	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-43.2	178	-72.1	-179.9	66.5	0	0	112.8	L321 M322 V327 L330 L421 Y422 R427 M428 T429	L321-M425 HydrophobicContact CB-CE 4.13Å; L321-M425 HydrophobicContact CB-CG 4.24Å; L321-M425 HydrophobicContact CB-SD 4.24Å; L321-M425 HydrophobicContact CD1-CG 4.39Å; L321-M425 HydrophobicContact CD2-CG 4.49Å; L321-M425 HydrophobicContact CD2-SD 4.06Å; L321-M425 WeakPolarHBondContact O-CE 3.17Å; M322-M425 HydrophobicContact CE-CB 4.01Å; M322-M425 HydrophobicContact CE-CE 4.43Å; M322-M425 HydrophobicContact CE-CG 4.06Å; M322-M425 HydrophobicContact SD-CE 4.47Å; V327-M425 HydrophobicContact CG2-CB 4.28Å; V327-M425 HydrophobicContact CG2-CE 3.95Å; L330-M425 HydrophobicContact CB-SD 4.39Å; L330-M425 HydrophobicContact CD2-SD 3.77Å; L421-M425 HydrophobicContact CD1-CG 4.47Å; L421-M425 HydrophobicContact CG-SD 4.4Å; L421-M425 WeakPolarHBondContact O-CB 3.42Å; L421-M425 VanDerWaalsContact O-CG 3.3Å; L421-M425 WeakPolarHBondContact O-CG 3.05Å; L421-M425 PolarHBondContact O-N 3Å; Y422-M425 PolarHBondContact O-N 3.38Å; M425-R427 VanDerWaalsContact C-N 3.31Å; M425-R427 PolarHBondContact O-N 3.16Å; M425-M428 WeakPolarHBondContact O-CB 3.36Å; M425-M428 PolarHBondContact O-N 3.19Å; M425-M428 VanDerWaalsContact O-N 3.12Å; M425-T429 PolarHBondContact O-N 3.2Å; M425-T429 VanDerWaalsContact O-N 3.12Å; M425-T429 PolarHBondContact O-OG1 2.63Å
426	L	83.5	Confident	78.4	Confident	14 Å²	14	63.1 Å²	63.1	7%	0.073	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-37.7	176.4	-72.1	175.6	0	0	0	112.7	V327 Y422 V423 M428 T429 E430 D431 V433	V327-L426 HydrophobicContact CG1-CD2 4.21Å; Y422-L426 HydrophobicContact CD1-CD1 4.03Å; Y422-L426 HydrophobicContact CE1-CD1 3.43Å; Y422-L426 VanDerWaalsContact CE1-CD1 3.43Å; Y422-L426 HydrophobicContact CE1-CG 4.29Å; Y422-L426 HydrophobicContact CE2-CD1 4.5Å; Y422-L426 WeakPolarHBondContact O-CG 3.39Å; Y422-L426 PolarHBondContact O-N 3.08Å; Y422-L426 VanDerWaalsContact O-N 3.13Å; V423-L426 PolarHBondContact O-N 3.48Å; L426-M428 VanDerWaalsContact C-N 3.28Å; L426-M428 PolarHBondContact O-N 2.58Å; L426-T429 PolarHBondContact O-N 3.07Å; L426-T429 PolarHBondContact O-OG1 3.07Å; L426-E430 PolarHBondContact O-N 3.24Å; L426-D431 HydrophobicContact CD2-CB 3.97Å; L426-D431 PolarHBondContact O-N 2.79Å; L426-V433 HydrophobicContact CB-CG2 3.97Å
427	R	82.2	Confident	77.4	Confident	155 Å²	155	64.6 Å²	64.6	59%	0.585	31%	0.313	S	S	*	.	H	α-helix	trans	-67.4	-30.9	175.8	-71.5	-178.3	-172.7	178.1	3.8	112.3	V423 A424 M425 V433 N438	V423-R427 WeakPolarHBondContact O-CG 3.28Å; V423-R427 PolarHBondContact O-N 3.42Å; V423-R427 VanDerWaalsContact O-N 3.11Å; A424-R427 PolarHBondContact O-N 3.28Å; M425-R427 VanDerWaalsContact C-N 3.31Å; M425-R427 PolarHBondContact O-N 3.16Å; R427-V433 HydrophobicContact CG-CG2 4.05Å; R427-N438 PolarHBondContact NH2-OD1 2.73Å
428	M	81.6	Confident	76.4	Confident	46 Å²	46	68.1 Å²	68.1	23%	0.227	33%	0.333	C	S	.	.	H	α-helix	trans	-77.2	-23.4	178.1	-67.8	171.7	74.6	0	0	113.1	A313 Q318 M322 A424 M425 L426	A313-M428 HydrophobicContact CB-CE 3.44Å; A313-M428 VanDerWaalsContact CB-CE 3.44Å; A313-M428 HydrophobicContact CB-SD 4.3Å; Q318-M428 HydrophobicContact CB-CE 3.76Å; Q318-M428 HydrophobicContact CG-CE 3.56Å; M322-M428 HydrophobicContact CE-CB 3.53Å; M322-M428 HydrophobicContact CE-CE 4.18Å; M322-M428 HydrophobicContact CE-CG 4.35Å; M322-M428 HydrophobicContact CE-SD 3.98Å; A424-M428 VanDerWaalsContact O-CG 3.27Å; A424-M428 WeakPolarHBondContact O-CG 3.41Å; A424-M428 PolarHBondContact O-N 3.15Å; A424-M428 VanDerWaalsContact O-N 3.12Å; M425-M428 WeakPolarHBondContact O-CB 3.36Å; M425-M428 PolarHBondContact O-N 3.19Å; M425-M428 VanDerWaalsContact O-N 3.12Å; L426-M428 VanDerWaalsContact C-N 3.28Å; L426-M428 PolarHBondContact O-N 2.58Å
429	T	76.6	Confident	75.5	Confident	53 Å²	53	74 Å²	74	33%	0.325	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	1.3	174.9	55.4	0	0	0	0	113.7	M322 M425 L426 D431	M322-T429 HydrophobicContact CE-CG2 4.14Å; M322-T429 HydrophobicContact SD-CG2 3.41Å; M322-T429 WeakPolarHBondContact SD-CG2 3.33Å; M425-T429 PolarHBondContact O-N 3.2Å; M425-T429 VanDerWaalsContact O-N 3.12Å; M425-T429 PolarHBondContact O-OG1 2.63Å; L426-T429 PolarHBondContact O-N 3.07Å; L426-T429 PolarHBondContact O-OG1 3.07Å; T429-D431 WeakPolarHBondContact CB-OD2 3.35Å; T429-D431 PolarHBondContact O-N 3.01Å; T429-D431 VanDerWaalsContact O-N 3.17Å; T429-D431 VanDerWaalsContact OG1-CG 3.29Å; T429-D431 PolarHBondContact OG1-OD2 3.2Å
430	E	70.8	Confident	74.8	Confident	187 Å²	187	72.4 Å²	72.4	87%	0.874	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	19.1	-171.2	-58.8	-173.2	169.7	0	0	114	L426	L426-E430 PolarHBondContact O-N 3.24Å
431	D	69.9	Low	74.4	Confident	88 Å²	88	74.8 Å²	74.8	47%	0.471	37%	0.372	S	S	.	.			trans	-73.9	152.2	177.9	-76.1	-43.7	0	0	0	111.9	L426 T429 V433	L426-D431 HydrophobicContact CD2-CB 3.97Å; L426-D431 PolarHBondContact O-N 2.79Å; T429-D431 WeakPolarHBondContact CB-OD2 3.35Å; T429-D431 PolarHBondContact O-N 3.01Å; T429-D431 VanDerWaalsContact O-N 3.17Å; T429-D431 VanDerWaalsContact OG1-CG 3.29Å; T429-D431 PolarHBondContact OG1-OD2 3.2Å; D431-V433 PolarHBondContact O-N 2.99Å
432	H	69	Low	74.2	Confident	174 Å²	174	81.3 Å²	81.3	81%	0.806	40%	0.403	S	S	*	.			trans	-66.1	110.1	-178.8	-157.7	-30.3	0	0	0	111.4
433	V	68.6	Low	74	Confident	27 Å²	27	86.2 Å²	86.2	16%	0.164	43%	0.425	C	S	.	.			trans	-77.1	124.7	173.1	-174.9	0	0	0	0	109.1	V423 L426 R427 D431 L437	V423-V433 HydrophobicContact CG1-CG1 4.39Å; L426-V433 HydrophobicContact CB-CG2 3.97Å; R427-V433 HydrophobicContact CG-CG2 4.05Å; D431-V433 PolarHBondContact O-N 2.99Å; V433-L437 HydrophobicContact CG1-CB 4.48Å
434	L	66.8	Low	73.8	Confident	107 Å²	107	87.6 Å²	87.6	56%	0.56	43%	0.432	S	S	*	.			trans	-66.5	138.4	174.9	-70.4	163.1	0	0	0	110.4	E436 L437	L434-E436 PolarHBondContact O-N 3.16Å; L434-E436 VanDerWaalsContact O-N 3.08Å; L434-L437 HydrophobicContact CB-CD1 4.12Å; L434-L437 HydrophobicContact CD1-CD1 4.22Å; L434-L437 PolarHBondContact O-N 2.99Å; L434-L437 VanDerWaalsContact O-N 3.07Å
435	P	59.4	Low	73.8	Confident	96 Å²	96	89.8 Å²	89.8	62%	0.623	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-27.6	-178.1	-25.3	33	0	0	0	114.9	N438	P435-N438 PolarHBondContact O-N 2.79Å
436	E	59.9	Low	73.8	Confident	153 Å²	153	92.9 Å²	92.9	72%	0.715	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-32.5	179.1	-65	179.2	165.1	0	0	113.2	L434 N438	L434-E436 PolarHBondContact O-N 3.16Å; L434-E436 VanDerWaalsContact O-N 3.08Å; E436-N438 VanDerWaalsContact C-N 3.29Å; E436-N438 PolarHBondContact O-N 2.96Å
437	L	65.3	Low	73.7	Confident	42 Å²	42	94.6 Å²	94.6	22%	0.22	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-22.1	178	-85.1	151.8	0	0	0	112.2	Y422 V423 V433 L434 K439	Y422-L437 HydrophobicContact CD1-CD2 4Å; Y422-L437 HydrophobicContact CE1-CD1 3.92Å; Y422-L437 HydrophobicContact CE1-CD2 4.14Å; V423-L437 HydrophobicContact CG2-CB 4.13Å; V423-L437 HydrophobicContact CG2-CD2 4.32Å; V433-L437 HydrophobicContact CG1-CB 4.48Å; L434-L437 HydrophobicContact CB-CD1 4.12Å; L434-L437 HydrophobicContact CD1-CD1 4.22Å; L434-L437 PolarHBondContact O-N 2.99Å; L434-L437 VanDerWaalsContact O-N 3.07Å; L437-K439 VanDerWaalsContact C-N 3.28Å; L437-K439 PolarHBondContact O-N 2.93Å
438	N	64.6	Low	73.9	Confident	86 Å²	86	87.3 Å²	87.3	46%	0.46	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-6.4	-177.3	-131.6	8.5	0	0	0	114.1	R427 P435 E436 M440	R427-N438 PolarHBondContact NH2-OD1 2.73Å; P435-N438 PolarHBondContact O-N 2.79Å; E436-N438 VanDerWaalsContact C-N 3.29Å; E436-N438 PolarHBondContact O-N 2.96Å; N438-M440 VanDerWaalsContact C-N 3.33Å; N438-M440 PolarHBondContact O-N 3.27Å; N438-M440 VanDerWaalsContact O-N 3.08Å
439	K	64.9	Low	74	Confident	153 Å²	153	86.5 Å²	86.5	67%	0.665	44%	0.44	S	S	*	.			trans	-83.3	67.9	179.2	-63.8	-179.2	-178.7	175.6	0	111.7	R419 L437	R419-K439 PolarHBondContact NH1-O 2.73Å; R419-K439 PolarHBondContact NH2-O 3.33Å; L437-K439 VanDerWaalsContact C-N 3.28Å; L437-K439 PolarHBondContact O-N 2.93Å
440	M	71.2	Confident	74.1	Confident	49 Å²	49	88 Å²	88	24%	0.241	44%	0.444	C	S	.	.			trans	-89.4	129.9	166.3	-75.8	-173.4	171.3	0	0	110.2	R419 W420 N438	R419-M440 HydrophobicContact CB-CE 3.79Å; R419-M440 HydrophobicContact CG-CE 3.55Å; R419-M440 WeakPolarHBondContact O-CE 3.29Å; W420-M440 HydrophobicContact CB-CE 3.7Å; W420-M440 HydrophobicContact CB-SD 3.96Å; N438-M440 VanDerWaalsContact C-N 3.33Å; N438-M440 PolarHBondContact O-N 3.27Å; N438-M440 VanDerWaalsContact O-N 3.08Å
441	T	80.6	Confident	74.5	Confident	76 Å²	76	79.1 Å²	79.1	47%	0.466	40%	0.402	S	S	.	.			trans	-83.2	160.7	174.5	67.1	0	0	0	0	110.3	K443 D444 I445	T441-K443 PolarHBondContact O-N 3.46Å; T441-D444 PolarHBondContact N-OD2 2.82Å; T441-D444 WeakPolarHBondContact O-CB 3.23Å; T441-D444 PolarHBondContact O-N 3.46Å; T441-D444 PolarHBondContact OG1-N 3.41Å; T441-D444 PolarHBondContact OG1-OD2 3.12Å; T441-I445 PolarHBondContact O-N 2.86Å
442	Q	81.8	Confident	74.9	Confident	141 Å²	141	75 Å²	75	66%	0.659	38%	0.38	S	S	*	.	H	α-helix	trans	-57.2	-32.6	173.1	-170.8	62.2	27.1	0	0	111.9	I445 T446	Q442-I445 PolarHBondContact O-N 3.28Å; Q442-T446 PolarHBondContact O-N 2.81Å; Q442-T446 PolarHBondContact O-OG1 3.06Å
443	K	82.1	Confident	75.3	Confident	141 Å²	141	69.7 Å²	69.7	61%	0.613	36%	0.36	S	S	*	.	H	α-helix	trans	-65.2	-38.2	176.1	-167.5	178.6	-179	178.3	0	112.1	T441 I445 T446 F447	T441-K443 PolarHBondContact O-N 3.46Å; K443-I445 VanDerWaalsContact C-N 3.33Å; K443-T446 PolarHBondContact O-N 2.96Å; K443-F447 HydrophobicContact CD-CE2 4.08Å; K443-F447 HydrophobicContact CD-CZ 4.42Å; K443-F447 HydrophobicContact CG-CD2 4.23Å; K443-F447 HydrophobicContact CG-CE2 3.73Å; K443-F447 HydrophobicContact CG-CZ 4.23Å; K443-F447 VanDerWaalsContact O-CD2 3.23Å; K443-F447 WeakPolarHBondContact O-CD2 3.35Å; K443-F447 PolarHBondContact O-N 3.13Å
444	D	81.3	Confident	75.3	Confident	35 Å²	35	70.9 Å²	70.9	19%	0.187	36%	0.364	C	S	.	.	H	α-helix	trans	-64.2	-40	175.2	-59	-41	0	0	0	111	R419 T441 T446 F447 V448	R419-D444 IonicContact NH1-OD2 3.7Å; T441-D444 PolarHBondContact N-OD2 2.82Å; T441-D444 WeakPolarHBondContact O-CB 3.23Å; T441-D444 PolarHBondContact O-N 3.46Å; T441-D444 PolarHBondContact OG1-N 3.41Å; T441-D444 PolarHBondContact OG1-OD2 3.12Å; D444-T446 VanDerWaalsContact C-N 3.34Å; D444-T446 PolarHBondContact O-N 2.87Å; D444-F447 WeakPolarHBondContact O-CB 3.47Å; D444-F447 PolarHBondContact O-N 3.05Å; D444-V448 WeakPolarHBondContact O-CG2 3.43Å; D444-V448 PolarHBondContact O-N 2.81Å
445	I	84.2	Confident	75.4	Confident	62 Å²	62	66 Å²	66	32%	0.318	34%	0.338	S	S	.	.	H	α-helix	trans	-63.8	-41.4	176.2	-61.9	176.1	0	0	0	110.7	L308 T441 Q442 K443 V448 A449	L308-I445 HydrophobicContact CD1-CG2 4.4Å; T441-I445 PolarHBondContact O-N 2.86Å; Q442-I445 PolarHBondContact O-N 3.28Å; K443-I445 VanDerWaalsContact C-N 3.33Å; I445-V448 PolarHBondContact O-N 2.87Å; I445-A449 PolarHBondContact O-N 2.65Å
446	T	85.1	Confident	75.9	Confident	65 Å²	65	62.1 Å²	62.1	40%	0.399	31%	0.311	S	S	.	.	H	α-helix	trans	-60.4	-44	173.3	-56.4	0	0	0	0	111.4	Q442 K443 D444 V448 A449 E450	Q442-T446 PolarHBondContact O-N 2.81Å; Q442-T446 PolarHBondContact O-OG1 3.06Å; K443-T446 PolarHBondContact O-N 2.96Å; D444-T446 VanDerWaalsContact C-N 3.34Å; D444-T446 PolarHBondContact O-N 2.87Å; T446-V448 VanDerWaalsContact C-N 3.3Å; T446-V448 PolarHBondContact O-N 2.78Å; T446-A449 PolarHBondContact O-N 3.32Å; T446-A449 VanDerWaalsContact O-N 3.16Å; T446-E450 HydrophobicContact CG2-CG 4.43Å; T446-E450 WeakPolarHBondContact O-CB 3.32Å; T446-E450 WeakPolarHBondContact O-CG 3.5Å; T446-E450 PolarHBondContact O-N 3.27Å
447	F	83	Confident	76	Confident	51 Å²	51	59.2 Å²	59.2	22%	0.224	30%	0.301	C	S	.	.	H	α-helix	trans	-61.4	-36.5	175.2	-72.7	-49.8	0	0	0	113.1	A416 K443 D444 F451	A416-F447 HydrophobicContact CB-CB 3.87Å; K443-F447 HydrophobicContact CD-CE2 4.08Å; K443-F447 HydrophobicContact CD-CZ 4.42Å; K443-F447 HydrophobicContact CG-CD2 4.23Å; K443-F447 HydrophobicContact CG-CE2 3.73Å; K443-F447 HydrophobicContact CG-CZ 4.23Å; K443-F447 VanDerWaalsContact O-CD2 3.23Å; K443-F447 WeakPolarHBondContact O-CD2 3.35Å; K443-F447 PolarHBondContact O-N 3.13Å; D444-F447 WeakPolarHBondContact O-CB 3.47Å; D444-F447 PolarHBondContact O-N 3.05Å; F447-F451 VanDerWaalsContact O-CB 3.23Å; F447-F451 WeakPolarHBondContact O-CB 3.36Å; F447-F451 PolarHBondContact O-N 2.97Å
448	V	85.2	Confident	75.3	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.006	32%	0.318	C	S	.	.	H	α-helix	trans	-67.2	-42.1	174.8	178.8	0	0	0	0	110.9	L308 A416 F417 W420 D444 I445 T446 F451 L452	L308-V448 HydrophobicContact CD1-CB 4.41Å; L308-V448 HydrophobicContact CD1-CG1 3.93Å; L308-V448 HydrophobicContact CD2-CB 4.38Å; L308-V448 HydrophobicContact CD2-CG1 3.97Å; A416-V448 HydrophobicContact CB-CG2 4.22Å; F417-V448 HydrophobicContact CD2-CG1 4.35Å; W420-V448 HydrophobicContact CB-CG2 3.83Å; W420-V448 HydrophobicContact CD2-CG1 3.81Å; W420-V448 HydrophobicContact CE3-CG1 3.62Å; W420-V448 HydrophobicContact CG-CG1 4.2Å; W420-V448 HydrophobicContact CG-CG2 4.24Å; W420-V448 HydrophobicContact CZ3-CG1 4.1Å; D444-V448 WeakPolarHBondContact O-CG2 3.43Å; D444-V448 PolarHBondContact O-N 2.81Å; I445-V448 PolarHBondContact O-N 2.87Å; T446-V448 VanDerWaalsContact C-N 3.3Å; T446-V448 PolarHBondContact O-N 2.78Å; V448-F451 WeakPolarHBondContact O-CB 3.37Å; V448-F451 PolarHBondContact O-N 2.61Å; V448-L452 HydrophobicContact CG1-CD1 4.32Å; V448-L452 WeakPolarHBondContact O-CG 3.35Å; V448-L452 PolarHBondContact O-N 2.99Å
449	A	84	Confident	74.5	Confident	30 Å²	30	60.8 Å²	60.8	25%	0.248	31%	0.31	C	S	.	.	H	α-helix	trans	-65.5	-42.3	176.9	0	0	0	0	0	112.1	M305 L308 I445 T446 L452 T453	M305-A449 HydrophobicContact CE-CB 4.5Å; M305-A449 HydrophobicContact SD-CB 4.47Å; L308-A449 HydrophobicContact CD2-CB 4.16Å; I445-A449 PolarHBondContact O-N 2.65Å; T446-A449 PolarHBondContact O-N 3.32Å; T446-A449 VanDerWaalsContact O-N 3.16Å; A449-L452 PolarHBondContact O-N 2.95Å; A449-T453 WeakPolarHBondContact O-CB 3.06Å; A449-T453 PolarHBondContact O-N 3.4Å; A449-T453 PolarHBondContact O-OG1 3.08Å
450	E	78.2	Confident	73.5	Confident	85 Å²	85	57.6 Å²	57.6	40%	0.397	31%	0.305	S	S	.	.	H	α-helix	trans	-59.7	-48.4	171.7	-75.6	174.4	-178.3	0	0	110.3	T446 L452 T453 E454	T446-E450 HydrophobicContact CG2-CG 4.43Å; T446-E450 WeakPolarHBondContact O-CB 3.32Å; T446-E450 WeakPolarHBondContact O-CG 3.5Å; T446-E450 PolarHBondContact O-N 3.27Å; E450-L452 PolarHBondContact O-N 2.89Å; E450-T453 CarbonylContact O-C 3.47Å; E450-T453 PolarHBondContact O-N 2.97Å; E450-T453 VanDerWaalsContact O-N 3.16Å; E450-E454 VanDerWaalsContact O-CB 3.27Å; E450-E454 WeakPolarHBondContact O-CB 3.44Å; E450-E454 VanDerWaalsContact O-CG 3.23Å; E450-E454 WeakPolarHBondContact O-CG 3.49Å; E450-E454 PolarHBondContact O-N 2.54Å
451	F	79.6	Confident	72.1	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-56.2	-48.2	176.9	176.8	-94.8	0	0	0	112.5	N413 F414 F417 F447 V448 T453 E454 H455 F456	N413-F451 HydrophobicContact CB-CB 4.17Å; N413-F451 HydrophobicContact CB-CD2 3.89Å; F414-F451 AromaticContact CD1-CE2 3.53Å; F414-F451 HydrophobicContact CD1-CE2 3.53Å; F414-F451 AromaticContact CD1-CZ 3.73Å; F414-F451 HydrophobicContact CD1-CZ 3.73Å; F414-F451 AromaticContact CD2-CE2 3.99Å; F414-F451 HydrophobicContact CD2-CE2 3.99Å; F414-F451 AromaticContact CE1-CE2 3.51Å; F414-F451 HydrophobicContact CE1-CE2 3.51Å; F414-F451 AromaticContact CE1-CZ 3.52Å; F414-F451 HydrophobicContact CE1-CZ 3.52Å; F414-F451 AromaticContact CE2-CE2 3.93Å; F414-F451 HydrophobicContact CE2-CE2 3.93Å; F414-F451 AromaticContact CG-CE2 3.79Å; F414-F451 HydrophobicContact CG-CE2 3.79Å; F414-F451 HydrophobicContact CG-CZ 4.43Å; F414-F451 AromaticContact CZ-CE2 3.7Å; F414-F451 HydrophobicContact CZ-CE2 3.7Å; F414-F451 HydrophobicContact CZ-CZ 4.04Å; F417-F451 HydrophobicContact CB-CD1 3.59Å; F417-F451 HydrophobicContact CB-CD2 4.4Å; F417-F451 HydrophobicContact CB-CE1 3.72Å; F417-F451 HydrophobicContact CB-CG 3.94Å; F417-F451 HydrophobicContact CB-CZ 4.24Å; F417-F451 HydrophobicContact CD1-CD1 4.19Å; F417-F451 AromaticContact CD1-CE1 3.48Å; F417-F451 HydrophobicContact CD1-CE1 3.48Å; F417-F451 VanDerWaalsContact CD1-CE1 3.48Å; F417-F451 AromaticContact CD1-CZ 3.89Å; F417-F451 HydrophobicContact CD1-CZ 3.89Å; F417-F451 AromaticContact CD2-CD1 3.34Å; F417-F451 HydrophobicContact CD2-CD1 3.34Å; F417-F451 AromaticContact CD2-CE1 3.34Å; F417-F451 HydrophobicContact CD2-CE1 3.34Å; F417-F451 HydrophobicContact CD2-CG 4.43Å; F417-F451 HydrophobicContact CD2-CZ 4.46Å; F417-F451 AromaticContact CE1-CE1 3.84Å; F417-F451 HydrophobicContact CE1-CE1 3.84Å; F417-F451 HydrophobicContact CE1-CZ 4.35Å; F417-F451 HydrophobicContact CE2-CD1 4Å; F417-F451 AromaticContact CE2-CE1 3.7Å; F417-F451 HydrophobicContact CE2-CE1 3.7Å; F417-F451 AromaticContact CG-CD1 3.43Å; F417-F451 HydrophobicContact CG-CD1 3.43Å; F417-F451 VanDerWaalsContact CG-CD1 3.43Å; F417-F451 AromaticContact CG-CE1 3.2Å; F417-F451 HydrophobicContact CG-CE1 3.2Å; F417-F451 HydrophobicContact CG-CG 4.28Å; F417-F451 AromaticContact CG-CZ 3.95Å; F417-F451 HydrophobicContact CG-CZ 3.95Å; F417-F451 AromaticContact CZ-CE1 3.94Å; F417-F451 HydrophobicContact CZ-CE1 3.94Å; F447-F451 VanDerWaalsContact O-CB 3.23Å; F447-F451 WeakPolarHBondContact O-CB 3.36Å; F447-F451 PolarHBondContact O-N 2.97Å; V448-F451 WeakPolarHBondContact O-CB 3.37Å; V448-F451 PolarHBondContact O-N 2.61Å; F451-T453 VanDerWaalsContact C-N 3.32Å; F451-T453 PolarHBondContact O-N 3.11Å; F451-E454 PolarHBondContact O-N 3.32Å; F451-H455 AromaticContact CD2-CD2 3.14Å; F451-H455 WeakPolarHBondContact CD2-CD2 3.41Å; F451-H455 AromaticContact CD2-NE2 3.67Å; F451-H455 HydrophobicContact CE2-CB 4.43Å; F451-H455 AromaticContact CE2-CD2 3.28Å; F451-H455 WeakPolarHBondContact CE2-CD2 3.09Å; F451-H455 AromaticContact CE2-CG 3.89Å; F451-H455 AromaticContact CE2-NE2 3.74Å; F451-H455 AromaticContact CG-CD2 3.86Å; F451-H455 HydrophobicContact CZ-CB 4.47Å; F451-H455 WeakPolarHBondContact O-CB 3.24Å; F451-H455 PolarHBondContact O-CD2 2.98Å; F451-H455 PolarHBondContact O-N 2.81Å; F451-F456 HydrophobicContact CD1-CE2 4.33Å; F451-F456 HydrophobicContact CE1-CD2 4.45Å; F451-F456 AromaticContact CE1-CE2 3.65Å; F451-F456 HydrophobicContact CE1-CE2 3.65Å; F451-F456 HydrophobicContact CZ-CE2 4.28Å
452	L	79	Confident	70.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-41.4	178.5	-71.6	177.2	0	0	0	111.6	F304 M305 L308 F417 V448 A449 E450 F456	F304-L452 HydrophobicContact CB-CD1 3.89Å; F304-L452 HydrophobicContact CB-CD2 3.51Å; F304-L452 HydrophobicContact CB-CG 4.36Å; F304-L452 HydrophobicContact CG-CD2 4.12Å; M305-L452 HydrophobicContact CE-CB 3.63Å; M305-L452 HydrophobicContact CE-CD1 3.97Å; M305-L452 HydrophobicContact CE-CG 4.47Å; M305-L452 HydrophobicContact SD-CD1 4.21Å; L308-L452 HydrophobicContact CD2-CD1 4.26Å; F417-L452 HydrophobicContact CD2-CD2 4.3Å; F417-L452 HydrophobicContact CE2-CD2 3.85Å; V448-L452 HydrophobicContact CG1-CD1 4.32Å; V448-L452 WeakPolarHBondContact O-CG 3.35Å; V448-L452 PolarHBondContact O-N 2.99Å; A449-L452 PolarHBondContact O-N 2.95Å; E450-L452 PolarHBondContact O-N 2.89Å; L452-F456 HydrophobicContact CD2-CD2 3.87Å; L452-F456 HydrophobicContact CD2-CE2 4.06Å; L452-F456 WeakPolarHBondContact O-CB 3.47Å; L452-F456 PolarHBondContact O-N 3.33Å; L452-F456 VanDerWaalsContact O-N 3.1Å
453	T	76.1	Confident	68.3	Low	63 Å²	63	60.3 Å²	60.3	39%	0.387	31%	0.313	S	S	.	.	H	α-helix	trans	-72.8	-31.5	179.5	-50.6	0	0	0	0	112.2	A449 E450 F451 N457	A449-T453 WeakPolarHBondContact O-CB 3.06Å; A449-T453 PolarHBondContact O-N 3.4Å; A449-T453 PolarHBondContact O-OG1 3.08Å; E450-T453 CarbonylContact O-C 3.47Å; E450-T453 PolarHBondContact O-N 2.97Å; E450-T453 VanDerWaalsContact O-N 3.16Å; F451-T453 VanDerWaalsContact C-N 3.32Å; F451-T453 PolarHBondContact O-N 3.11Å; T453-N457 WeakPolarHBondContact O-CB 3.46Å
454	E	69.2	Low	66.3	Low	53 Å²	53	60.7 Å²	60.7	25%	0.248	32%	0.322	C	S	.	.	H	α-helix	trans	-83.6	-39.6	-178.3	-72.9	-171.6	148.9	0	0	112.6	N413 E450 F451 R474	N413-E454 PolarHBondContact ND2-OE2 3.47Å; E450-E454 VanDerWaalsContact O-CB 3.27Å; E450-E454 WeakPolarHBondContact O-CB 3.44Å; E450-E454 VanDerWaalsContact O-CG 3.23Å; E450-E454 WeakPolarHBondContact O-CG 3.49Å; E450-E454 PolarHBondContact O-N 2.54Å; F451-E454 PolarHBondContact O-N 3.32Å; E454-R474 IonicContact OE1-CZ 3.87Å; E454-R474 VanDerWaalsContact OE1-CZ 3.24Å; E454-R474 IonicContact OE1-NH1 3.22Å; E454-R474 PolarHBondContact OE1-NH1 3.37Å; E454-R474 IonicContact OE1-NH2 3.24Å; E454-R474 PolarHBondContact OE1-NH2 3.21Å; E454-R474 IonicContact OE2-CZ 2.73Å; E454-R474 IonicContact OE2-NH1 3.02Å; E454-R474 PolarHBondContact OE2-NH1 2.95Å
455	H	69.2	Low	64.4	Low	5 Å²	5	69.8 Å²	69.8	2%	0.023	35%	0.353	C	S	.	.	H	α-helix	trans	-98.9	-22	-172.4	-69.3	-73.5	0	0	0	114.8	F451 N471	F451-H455 AromaticContact CD2-CD2 3.14Å; F451-H455 WeakPolarHBondContact CD2-CD2 3.41Å; F451-H455 AromaticContact CD2-NE2 3.67Å; F451-H455 HydrophobicContact CE2-CB 4.43Å; F451-H455 AromaticContact CE2-CD2 3.28Å; F451-H455 WeakPolarHBondContact CE2-CD2 3.09Å; F451-H455 AromaticContact CE2-CG 3.89Å; F451-H455 AromaticContact CE2-NE2 3.74Å; F451-H455 AromaticContact CG-CD2 3.86Å; F451-H455 HydrophobicContact CZ-CB 4.47Å; F451-H455 WeakPolarHBondContact O-CB 3.24Å; F451-H455 PolarHBondContact O-CD2 2.98Å; F451-H455 PolarHBondContact O-N 2.81Å; H455-N471 WeakPolarHBondContact CA-O 3.47Å; H455-N471 PolarHBondContact ND1-O 3.34Å; H455-N471 WeakPolarHBondContact O-CA 3.47Å; H455-N471 PolarHBondContact O-N 3.31Å
456	F	68.9	Low	62.5	Low	14 Å²	14	72 Å²	72	6%	0.061	36%	0.36	C	S	.	.	S	Bend	trans	-113.1	7.1	-178.4	-63.7	-91.3	0	0	0	113.9	V300 Q301 F451 L452 E458 F470	V300-F456 HydrophobicContact CB-CD1 3.91Å; V300-F456 HydrophobicContact CB-CE1 4.46Å; V300-F456 HydrophobicContact CG1-CD1 3.45Å; V300-F456 VanDerWaalsContact CG1-CD1 3.45Å; V300-F456 HydrophobicContact CG1-CE1 3.58Å; V300-F456 HydrophobicContact CG1-CG 4.43Å; Q301-F456 HydrophobicContact CB-CB 3.69Å; Q301-F456 WeakPolarHBondContact CB-O 3.44Å; Q301-F456 HydrophobicContact CG-CB 4.35Å; Q301-F456 PolarHBondContact OE1-O 2.83Å; F451-F456 HydrophobicContact CD1-CE2 4.33Å; F451-F456 HydrophobicContact CE1-CD2 4.45Å; F451-F456 AromaticContact CE1-CE2 3.65Å; F451-F456 HydrophobicContact CE1-CE2 3.65Å; F451-F456 HydrophobicContact CZ-CE2 4.28Å; L452-F456 HydrophobicContact CD2-CD2 3.87Å; L452-F456 HydrophobicContact CD2-CE2 4.06Å; L452-F456 WeakPolarHBondContact O-CB 3.47Å; L452-F456 PolarHBondContact O-N 3.33Å; L452-F456 VanDerWaalsContact O-N 3.1Å; F456-E458 PolarHBondContact O-N 2.88Å; F456-F470 AromaticContact CD1-CD1 3.42Å; F456-F470 HydrophobicContact CD1-CD1 3.42Å; F456-F470 VanDerWaalsContact CD1-CD1 3.42Å; F456-F470 AromaticContact CD1-CE1 3.55Å; F456-F470 HydrophobicContact CD1-CE1 3.55Å; F456-F470 AromaticContact CE1-CD1 3.42Å; F456-F470 HydrophobicContact CE1-CD1 3.42Å; F456-F470 VanDerWaalsContact CE1-CD1 3.42Å; F456-F470 AromaticContact CE1-CE1 3.44Å; F456-F470 HydrophobicContact CE1-CE1 3.44Å; F456-F470 VanDerWaalsContact CE1-CE1 3.44Å
457	N	63.4	Low	60.5	Low	92 Å²	92	71.1 Å²	71.1	49%	0.492	36%	0.364	S	S	.	.			trans	-59	129.9	174.8	-145.8	-2.8	0	0	0	110.9	Q301 T453 A459	Q301-N457 VanDerWaalsContact OE1-CA 3.28Å; T453-N457 WeakPolarHBondContact O-CB 3.46Å; N457-A459 PolarHBondContact O-N 3.28Å; N457-A459 VanDerWaalsContact O-N 3.13Å
458	E	49.8	Very low	58.7	Low	123 Å²	123	72 Å²	72	58%	0.575	37%	0.368	S	S	*	.			trans	-64.3	114.4	176.3	-70.9	-173	159.1	0	0	109.7	S299 F456 P460	S299-E458 WeakPolarHBondContact CB-OE1 3.45Å; F456-E458 PolarHBondContact O-N 2.88Å; E458-P460 VanDerWaalsContact C-CD 3.45Å; E458-P460 WeakPolarHBondContact O-CD 3.48Å
459	A	47.5	Very low	56.8	Low	37 Å²	37	75.5 Å²	75.5	31%	0.306	38%	0.382	S	S	.	.			trans	-104.7	88.2	168.7	0	0	0	0	0	108.6	N457 D461 L462	N457-A459 PolarHBondContact O-N 3.28Å; N457-A459 VanDerWaalsContact O-N 3.13Å; A459-D461 PolarHBondContact O-N 3.32Å; A459-L462 HydrophobicContact CB-CB 4.29Å; A459-L462 HydrophobicContact CB-CD1 3.78Å; A459-L462 HydrophobicContact CB-CG 4.31Å; A459-L462 PolarHBondContact O-N 3.27Å
460	P	43.7	Very low	55.3	Low	87 Å²	87	74.7 Å²	74.7	57%	0.565	37%	0.373	S	S	*	.	H	α-helix	trans	-57.6	-20	-178	14.6	-26.2	0	0	0	114.3	E458 Y463	E458-P460 VanDerWaalsContact C-CD 3.45Å; E458-P460 WeakPolarHBondContact O-CD 3.48Å; P460-Y463 WeakPolarHBondContact O-CB 3.36Å; P460-Y463 PolarHBondContact O-N 2.83Å
461	D	42.5	Very low	54.1	Low	140 Å²	140	71.8 Å²	71.8	75%	0.749	36%	0.36	S	S	*	.	H	α-helix	trans	-76.3	-25.8	176.3	-63.4	-36	0	0	0	113.8	A459 Y463	A459-D461 PolarHBondContact O-N 3.32Å; D461-Y463 VanDerWaalsContact C-N 3.33Å
462	L	41.8	Very low	52.8	Low	41 Å²	41	72.4 Å²	72.4	22%	0.215	36%	0.364	C	S	.	.	H	α-helix	trans	-77.2	-23.1	173.5	-80.2	164.8	0	0	0	112.1	A459 N464	A459-L462 HydrophobicContact CB-CB 4.29Å; A459-L462 HydrophobicContact CB-CD1 3.78Å; A459-L462 HydrophobicContact CB-CG 4.31Å; A459-L462 PolarHBondContact O-N 3.27Å; L462-N464 VanDerWaalsContact C-N 3.31Å; L462-N464 PolarHBondContact O-N 2.74Å
463	Y	41.6	Very low	51.9	Low	142 Å²	142	72.8 Å²	72.8	56%	0.557	37%	0.366	S	S	*	.	H	α-helix	trans	-59.8	-36.7	179.3	-126.6	-94	0	0	0	112.8	P460 D461 Y469	P460-Y463 WeakPolarHBondContact O-CB 3.36Å; P460-Y463 PolarHBondContact O-N 2.83Å; D461-Y463 VanDerWaalsContact C-N 3.33Å; Y463-Y469 HydrophobicContact CE2-CD1 4.29Å; Y463-Y469 HydrophobicContact CE2-CE1 4.48Å
464	N	39.1	Very low	51.8	Low	149 Å²	149	73.8 Å²	73.8	80%	0.797	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-12.8	-171.9	-75.5	-34.9	0	0	0	114.9	L462	L462-N464 VanDerWaalsContact C-N 3.31Å; L462-N464 PolarHBondContact O-N 2.74Å
465	R	41.9	Very low	52.2	Low	225 Å²	225	71.3 Å²	71.3	85%	0.849	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-29.3	-172.4	-80.3	-175.6	175.2	-178.4	0	115.8
466	K	43.5	Very low	52.7	Low	108 Å²	108	71 Å²	71	47%	0.47	35%	0.349	S	S	.	.	S	Bend	trans	-143.6	0.9	-168.8	-69.9	-175.2	178	173.3	0	117.1	K468 E482	K466-K468 PolarHBondContact O-N 3.01Å; K466-E482 IonicContact NZ-OE1 3.6Å; K466-E482 PolarHBondContact NZ-OE1 2.88Å; K466-E482 IonicContact NZ-OE2 3.86Å; K466-E482 PolarHBondContact NZ-OE2 2.96Å
467	G	42.6	Very low	53.2	Low	47 Å²	47	71 Å²	71	49%	0.485	35%	0.349	S	S	.	.			trans	63.2	20.9	177.9	0	0	0	0	0	115.3	Y469	G467-Y469 WeakPolarHBondContact O-CE2 3.28Å
468	K	45.3	Very low	54.3	Low	69 Å²	69	66.6 Å²	66.6	30%	0.3	33%	0.326	S	S	.	.			trans	-101.7	130.8	177.4	-67.4	-170.6	174.9	-169.3	0	109.9	K466	K466-K468 PolarHBondContact O-N 3.01Å
469	Y	45.9	Very low	56	Low	75 Å²	75	61 Å²	61	29%	0.294	30%	0.3	S	S	.	.			trans	-103.2	-4.3	-168.9	-65.8	-90.5	0	0	0	114.9	T288 V291 Q292 Y463 G467	T288-Y469 HydrophobicContact CG2-CD2 3.48Å; T288-Y469 VanDerWaalsContact CG2-CD2 3.48Å; T288-Y469 HydrophobicContact CG2-CE2 3.65Å; V291-Y469 HydrophobicContact CB-CD1 4.08Å; V291-Y469 HydrophobicContact CB-CE1 4.45Å; V291-Y469 HydrophobicContact CB-CG 4.14Å; V291-Y469 HydrophobicContact CG1-CD1 3.31Å; V291-Y469 HydrophobicContact CG1-CE1 3.57Å; V291-Y469 HydrophobicContact CG1-CG 3.87Å; V291-Y469 HydrophobicContact CG2-CG 4.49Å; Q292-Y469 HydrophobicContact CG-CE2 3.99Å; Y463-Y469 HydrophobicContact CE2-CD1 4.29Å; Y463-Y469 HydrophobicContact CE2-CE1 4.48Å; G467-Y469 WeakPolarHBondContact O-CE2 3.28Å
470	F	53	Low	57.6	Low	13 Å²	13	61 Å²	61	6%	0.057	29%	0.293	C	S	.	.			trans	-133.9	141.5	-171.2	-56.6	-73.9	0	0	0	113.4	L287 V291 V300 F456 V472	L287-F470 HydrophobicContact CB-CD2 3.96Å; L287-F470 HydrophobicContact CB-CE1 4.28Å; L287-F470 HydrophobicContact CB-CE2 3.34Å; L287-F470 HydrophobicContact CB-CZ 3.5Å; L287-F470 VanDerWaalsContact CB-CZ 3.5Å; L287-F470 WeakPolarHBondContact O-CE2 3.38Å; L287-F470 WeakPolarHBondContact O-CZ 3.13Å; V291-F470 HydrophobicContact CG2-CE1 4.11Å; V291-F470 HydrophobicContact CG2-CE2 4.11Å; V291-F470 HydrophobicContact CG2-CZ 3.38Å; V300-F470 HydrophobicContact CB-CE1 4.16Å; V300-F470 HydrophobicContact CG1-CE1 4.08Å; V300-F470 HydrophobicContact CG2-CE1 3.98Å; V300-F470 HydrophobicContact CG2-CZ 4.31Å; F456-F470 AromaticContact CD1-CD1 3.42Å; F456-F470 HydrophobicContact CD1-CD1 3.42Å; F456-F470 VanDerWaalsContact CD1-CD1 3.42Å; F456-F470 AromaticContact CD1-CE1 3.55Å; F456-F470 HydrophobicContact CD1-CE1 3.55Å; F456-F470 AromaticContact CE1-CD1 3.42Å; F456-F470 HydrophobicContact CE1-CD1 3.42Å; F456-F470 VanDerWaalsContact CE1-CD1 3.42Å; F456-F470 AromaticContact CE1-CE1 3.44Å; F456-F470 HydrophobicContact CE1-CE1 3.44Å; F456-F470 VanDerWaalsContact CE1-CE1 3.44Å; F470-V472 VanDerWaalsContact C-N 3.29Å; F470-V472 HydrophobicContact CB-CG2 4.14Å; F470-V472 PolarHBondContact O-N 3.49Å
471	N	51.8	Low	59.3	Low	25 Å²	25	61.7 Å²	61.7	13%	0.134	29%	0.292	C	S	.	.			trans	-90.5	55.9	177	-159	-1.8	0	0	0	111.3	H455 E473	H455-N471 WeakPolarHBondContact CA-O 3.47Å; H455-N471 PolarHBondContact ND1-O 3.34Å; H455-N471 WeakPolarHBondContact O-CA 3.47Å; H455-N471 PolarHBondContact O-N 3.31Å; N471-E473 PolarHBondContact O-N 3.26Å; N471-E473 VanDerWaalsContact O-N 3.12Å; N471-E473 WeakPolarHBondContact OD1-CB 3.29Å
472	V	53.9	Low	60.8	Low	13 Å²	13	58.5 Å²	58.5	8%	0.079	27%	0.272	C	S	.	.			trans	-76.2	14.9	166.8	-167.6	0	0	0	0	110.6	M283 F414 F470 R474	M283-V472 HydrophobicContact CE-CG1 4.45Å; M283-V472 HydrophobicContact CE-CG2 3.51Å; M283-V472 HydrophobicContact SD-CG1 3.89Å; M283-V472 HydrophobicContact SD-CG2 3.99Å; F414-V472 HydrophobicContact CE2-CG1 4.4Å; F414-V472 HydrophobicContact CZ-CG1 3.88Å; F470-V472 VanDerWaalsContact C-N 3.29Å; F470-V472 HydrophobicContact CB-CG2 4.14Å; F470-V472 PolarHBondContact O-N 3.49Å; V472-R474 PolarHBondContact O-N 3.23Å
473	E	59.3	Low	62.1	Low	8 Å²	8	61.6 Å²	61.6	4%	0.037	29%	0.289	C	S	.	.	H	α-helix	trans	-87.3	-2.6	-160.5	-51.8	-167.1	126.2	0	0	113.9	N471 V475 G476 Q477 K480	N471-E473 PolarHBondContact O-N 3.26Å; N471-E473 VanDerWaalsContact O-N 3.12Å; N471-E473 WeakPolarHBondContact OD1-CB 3.29Å; E473-V475 VanDerWaalsContact C-N 3.32Å; E473-V475 PolarHBondContact O-N 2.7Å; E473-G476 CarbonylContact O-C 3.54Å; E473-G476 PolarHBondContact O-N 3.19Å; E473-G476 VanDerWaalsContact O-N 3.16Å; E473-Q477 WeakPolarHBondContact O-CB 3.48Å; E473-Q477 VanDerWaalsContact O-CG 3.23Å; E473-Q477 WeakPolarHBondContact O-CG 3.48Å; E473-Q477 PolarHBondContact O-N 3.44Å; E473-K480 VanDerWaalsContact CD-NZ 3.31Å; E473-K480 IonicContact OE1-NZ 3.83Å; E473-K480 PolarHBondContact OE1-NZ 2.93Å; E473-K480 IonicContact OE2-NZ 2.73Å
474	R	72.8	Confident	63.4	Low	83 Å²	83	60 Å²	60	31%	0.313	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-34.6	-176.4	-87	-167.9	175.9	177	9.2	114.6	V406 E454 V472 Q477 Y478 S488	V406-R474 HydrophobicContact CG1-CB 4.17Å; E454-R474 IonicContact OE1-CZ 3.87Å; E454-R474 VanDerWaalsContact OE1-CZ 3.24Å; E454-R474 IonicContact OE1-NH1 3.22Å; E454-R474 PolarHBondContact OE1-NH1 3.37Å; E454-R474 IonicContact OE1-NH2 3.24Å; E454-R474 PolarHBondContact OE1-NH2 3.21Å; E454-R474 IonicContact OE2-CZ 2.73Å; E454-R474 IonicContact OE2-NH1 3.02Å; E454-R474 PolarHBondContact OE2-NH1 2.95Å; V472-R474 PolarHBondContact O-N 3.23Å; R474-Q477 WeakPolarHBondContact O-CG 3.5Å; R474-Q477 PolarHBondContact O-NE2 3.36Å; R474-Q477 VanDerWaalsContact O-NE2 3.08Å; R474-Y478 WeakPolarHBondContact O-CD2 3.19Å; R474-Y478 VanDerWaalsContact O-CE2 3.26Å; R474-Y478 WeakPolarHBondContact O-CE2 3.34Å; R474-S488 WeakPolarHBondContact CG-OG 3.37Å
475	V	79.1	Confident	65.3	Low	1 Å²	1	56.8 Å²	56.8	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-84.2	-39.8	171.8	175.3	0	0	0	0	109.2	Y341 L403 V406 I407 E473 Q477 Y478 L479	Y341-V475 HydrophobicContact CE1-CG2 3.95Å; L403-V475 HydrophobicContact CD1-CG1 4.25Å; V406-V475 HydrophobicContact CG1-CG2 3.95Å; I407-V475 HydrophobicContact CG1-CG1 4.17Å; I407-V475 HydrophobicContact CG1-CG2 4.17Å; E473-V475 VanDerWaalsContact C-N 3.32Å; E473-V475 PolarHBondContact O-N 2.7Å; V475-Q477 PolarHBondContact O-N 3.27Å; V475-Y478 PolarHBondContact O-N 2.79Å; V475-L479 HydrophobicContact CG1-CD1 4.13Å; V475-L479 PolarHBondContact O-N 3.48Å
476	G	78.7	Confident	67.1	Low	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.6	-37.2	179.1	0	0	0	0	0	114.7	E473 Y478 L479 K480	E473-G476 CarbonylContact O-C 3.54Å; E473-G476 PolarHBondContact O-N 3.19Å; E473-G476 VanDerWaalsContact O-N 3.16Å; G476-Y478 PolarHBondContact O-N 3Å; G476-L479 CarbonylContact O-C 3.57Å; G476-L479 PolarHBondContact O-N 3.21Å; G476-K480 WeakPolarHBondContact O-CB 3.06Å; G476-K480 WeakPolarHBondContact O-CG 3.47Å; G476-K480 PolarHBondContact O-N 2.86Å
477	Q	80.8	Confident	68.5	Low	12 Å²	12	45.9 Å²	45.9	6%	0.056	24%	0.24	C	C	.	.	H	α-helix	trans	-62.8	-22.8	179.1	61.4	-179.2	-5.3	0	0	113.1	E473 R474 V475 L486 S488 S521	E473-Q477 WeakPolarHBondContact O-CB 3.48Å; E473-Q477 VanDerWaalsContact O-CG 3.23Å; E473-Q477 WeakPolarHBondContact O-CG 3.48Å; E473-Q477 PolarHBondContact O-N 3.44Å; R474-Q477 WeakPolarHBondContact O-CG 3.5Å; R474-Q477 PolarHBondContact O-NE2 3.36Å; R474-Q477 VanDerWaalsContact O-NE2 3.08Å; V475-Q477 PolarHBondContact O-N 3.27Å; Q477-L486 HydrophobicContact CB-CD2 3.8Å; Q477-L486 HydrophobicContact CG-CD2 3.74Å; Q477-L486 VanDerWaalsContact O-CD2 3.24Å; Q477-L486 WeakPolarHBondContact O-CD2 3.19Å; Q477-S488 PolarHBondContact NE2-O 2.76Å; Q477-S488 PolarHBondContact NE2-OG 3.42Å; Q477-S488 PolarHBondContact OE1-O 3.45Å; Q477-S488 PolarHBondContact OE1-OG 3.48Å; Q477-S521 WeakPolarHBondContact O-CB 3.47Å
478	Y	85.6	Confident	69.9	Low	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-82.1	-36.9	172.1	-67.3	-92.4	0	0	0	111.8	K399 E402 L403 V406 R474 V475 G476 L486 P490 L522 H523	K399-Y478 HydrophobicContact CD-CD1 3.89Å; K399-Y478 HydrophobicContact CD-CE1 3.67Å; E402-Y478 HydrophobicContact CG-CE1 4.41Å; E402-Y478 WeakPolarHBondContact OE1-CE1 3.1Å; E402-Y478 PolarHBondContact OE1-OH 2.8Å; L403-Y478 HydrophobicContact CD1-CD2 4.05Å; L403-Y478 HydrophobicContact CD1-CG 3.99Å; V406-Y478 HydrophobicContact CB-CE2 4.43Å; V406-Y478 HydrophobicContact CG1-CE2 4.28Å; V406-Y478 HydrophobicContact CG2-CE2 4Å; R474-Y478 WeakPolarHBondContact O-CD2 3.19Å; R474-Y478 VanDerWaalsContact O-CE2 3.26Å; R474-Y478 WeakPolarHBondContact O-CE2 3.34Å; V475-Y478 PolarHBondContact O-N 2.79Å; G476-Y478 PolarHBondContact O-N 3Å; Y478-L486 HydrophobicContact CE1-CD1 3.97Å; Y478-P490 VanDerWaalsContact OH-CD 3.29Å; Y478-P490 WeakPolarHBondContact OH-CD 3.3Å; Y478-L522 WeakPolarHBondContact O-CB 3.42Å; Y478-L522 PolarHBondContact O-N 3.32Å; Y478-H523 PolarHBondContact O-ND1 2.9Å
479	L	85.9	Confident	71.4	Confident	5 Å²	5	44 Å²	44	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-91.2	-15.3	-174.1	-58.8	-179.4	0	0	0	114	L269 M272 W276 L403 V475 G476 D481 L522 H523	L269-L479 HydrophobicContact CD1-CD2 4.01Å; M272-L479 HydrophobicContact CE-CD2 3.92Å; W276-L479 HydrophobicContact CB-CD1 3.59Å; W276-L479 HydrophobicContact CD2-CD1 4.43Å; W276-L479 HydrophobicContact CG-CD1 3.78Å; L403-L479 HydrophobicContact CD2-CD2 4.07Å; V475-L479 HydrophobicContact CG1-CD1 4.13Å; V475-L479 PolarHBondContact O-N 3.48Å; G476-L479 CarbonylContact O-C 3.57Å; G476-L479 PolarHBondContact O-N 3.21Å; L479-D481 PolarHBondContact O-N 3.28Å; L479-L522 HydrophobicContact CD2-CD2 4.44Å; L479-H523 PolarHBondContact O-CE1 3.11Å; L479-H523 PolarHBondContact O-ND1 2.88Å
480	K	80.9	Confident	72.9	Confident	38 Å²	38	42.4 Å²	42.4	17%	0.165	23%	0.226	C	C	.	.	S	Bend	trans	-67.6	127.7	172.5	-77.9	170.1	-176.3	-179.9	0	108.8	W276 E473 G476 E482	W276-K480 HydrophobicContact CH2-CG 4Å; W276-K480 HydrophobicContact CZ3-CG 4.45Å; E473-K480 VanDerWaalsContact CD-NZ 3.31Å; E473-K480 IonicContact OE1-NZ 3.83Å; E473-K480 PolarHBondContact OE1-NZ 2.93Å; E473-K480 IonicContact OE2-NZ 2.73Å; G476-K480 WeakPolarHBondContact O-CB 3.06Å; G476-K480 WeakPolarHBondContact O-CG 3.47Å; G476-K480 PolarHBondContact O-N 2.86Å; K480-E482 HydrophobicContact CB-CG 4.48Å; K480-E482 PolarHBondContact O-N 3.49Å
481	D	78.4	Confident	73.9	Confident	102 Å²	102	47.9 Å²	47.9	55%	0.545	26%	0.256	S	S	.	.			trans	-79.9	50.9	176.5	-163.1	32.2	0	0	0	111.3	L479 H523 R527	L479-D481 PolarHBondContact O-N 3.28Å; D481-H523 IonicContact OD1-CD2 2.62Å; D481-H523 PolarHBondContact OD1-CD2 2.85Å; D481-H523 IonicContact OD1-CG 2.67Å; D481-R527 IonicContact OD1-CZ 2.73Å; D481-R527 VanDerWaalsContact OD1-CZ 3.28Å; D481-R527 IonicContact OD1-NE 3.04Å; D481-R527 PolarHBondContact OD1-NE 3.25Å; D481-R527 IonicContact OD1-NH2 3.03Å; D481-R527 PolarHBondContact OD1-NH2 3.02Å; D481-R527 IonicContact OD2-NH2 2.58Å
482	E	74.4	Confident	75.1	Confident	72 Å²	72	49.2 Å²	49.2	34%	0.336	27%	0.265	S	S	.	.			trans	-112.2	144.1	177.7	-61.3	-173.2	157.3	0	0	109.6	K466 K480 D484	K466-E482 IonicContact NZ-OE1 3.6Å; K466-E482 PolarHBondContact NZ-OE1 2.88Å; K466-E482 IonicContact NZ-OE2 3.86Å; K466-E482 PolarHBondContact NZ-OE2 2.96Å; K480-E482 HydrophobicContact CB-CG 4.48Å; K480-E482 PolarHBondContact O-N 3.49Å; E482-D484 PolarHBondContact O-N 3.28Å
483	D	68.9	Low	75.9	Confident	107 Å²	107	56.2 Å²	56.2	57%	0.572	30%	0.296	S	S	*	.			trans	-80.2	-1.6	177.1	-80	-22.2	0	0	0	113.4	R527	D483-R527 IonicContact OD1-CZ 3.78Å; D483-R527 IonicContact OD1-NH1 3.78Å; D483-R527 PolarHBondContact OD1-NH1 3.48Å; D483-R527 IonicContact OD1-NH2 2.97Å
484	D	69.7	Low	76.8	Confident	108 Å²	108	58.9 Å²	58.9	58%	0.578	33%	0.326	S	S	*	.	S	Bend	trans	-65.6	150.1	177.8	-69.3	-26.8	0	0	0	111.2	E482	E482-D484 PolarHBondContact O-N 3.28Å
485	D	79.4	Confident	77.5	Confident	81 Å²	81	58.4 Å²	58.4	43%	0.433	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-65.8	151.7	173	-76.1	-17.4	0	0	0	110.6	V487 R519 K520	D485-V487 PolarHBondContact O-N 2.91Å; D485-R519 CarbonylContact C-O 3.54Å; D485-R519 VanDerWaalsContact CA-O 3.31Å; D485-R519 WeakPolarHBondContact CA-O 3.47Å; D485-R519 HydrophobicContact CB-CB 4.44Å; D485-K520 WeakPolarHBondContact OD1-CD 3.14Å; D485-K520 VanDerWaalsContact OD1-CE 3.29Å; D485-K520 WeakPolarHBondContact OD1-CE 3.34Å; D485-K520 IonicContact OD1-NZ 2.69Å; D485-K520 PolarHBondContact OD1-NZ 3.05Å
486	L	78.4	Confident	78.1	Confident	12 Å²	12	66.4 Å²	66.4	6%	0.063	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-54.1	126.7	173.7	-62.9	-179.5	0	0	0	109.8	Q477 Y478 S488 P489 P518 R519	Q477-L486 HydrophobicContact CB-CD2 3.8Å; Q477-L486 HydrophobicContact CG-CD2 3.74Å; Q477-L486 VanDerWaalsContact O-CD2 3.24Å; Q477-L486 WeakPolarHBondContact O-CD2 3.19Å; Y478-L486 HydrophobicContact CE1-CD1 3.97Å; L486-S488 VanDerWaalsContact C-N 3.27Å; L486-S488 PolarHBondContact O-N 3.21Å; L486-P489 HydrophobicContact CB-CB 4.34Å; L486-P489 HydrophobicContact CD1-CB 4.38Å; L486-P518 WeakPolarHBondContact CD1-O 3.14Å; L486-R519 WeakPolarHBondContact CG-O 3.25Å; L486-R519 PolarHBondContact N-O 2.89Å
487	V	72.6	Confident	78.7	Confident	93 Å²	93	72.4 Å²	72.4	56%	0.564	39%	0.39	S	S	*	.	S	Bend	trans	-63.8	-36.3	178.6	-179.5	0	0	0	0	110.8	D485	D485-V487 PolarHBondContact O-N 2.91Å
488	S	72	Confident	79	Confident	24 Å²	24	74 Å²	74	17%	0.168	40%	0.396	C	S	.	.	S	Bend	trans	-138	79.9	179	55.8	0	0	0	0	110.8	R474 Q477 L486	R474-S488 WeakPolarHBondContact CG-OG 3.37Å; Q477-S488 PolarHBondContact NE2-O 2.76Å; Q477-S488 PolarHBondContact NE2-OG 3.42Å; Q477-S488 PolarHBondContact OE1-O 3.45Å; Q477-S488 PolarHBondContact OE1-OG 3.48Å; L486-S488 VanDerWaalsContact C-N 3.27Å; L486-S488 PolarHBondContact O-N 3.21Å
489	P	77.8	Confident	79.2	Confident	52 Å²	52	77.7 Å²	77.7	34%	0.338	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-63.9	151.6	176.8	29	-34.6	0	0	0	110.4	L486 R519	L486-P489 HydrophobicContact CB-CB 4.34Å; L486-P489 HydrophobicContact CD1-CB 4.38Å; P489-R519 HydrophobicContact CB-CG 4.44Å; P489-R519 HydrophobicContact CG-CG 4.4Å
490	P	77.4	Confident	79.4	Confident	42 Å²	42	83.2 Å²	83.2	27%	0.273	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-63.2	143.7	176.8	26	-30.3	0	0	0	109.9	E402 Y478 T492	E402-P490 HydrophobicContact CG-CG 3.93Å; E402-P490 VanDerWaalsContact OE1-CG 3.32Å; E402-P490 WeakPolarHBondContact OE1-CG 3.34Å; Y478-P490 VanDerWaalsContact OH-CD 3.29Å; Y478-P490 WeakPolarHBondContact OH-CD 3.3Å; P490-T492 PolarHBondContact O-N 2.85Å; P490-T492 VanDerWaalsContact O-N 3.17Å
491	N	74.6	Confident	79.9	Confident	128 Å²	128	82.7 Å²	82.7	68%	0.684	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-68.6	118.2	179.2	-166.6	3.5	0	0	0	109.7	E493	N491-E493 VanDerWaalsContact OD1-CB 3.26Å; N491-E493 WeakPolarHBondContact OD1-CB 3.26Å; N491-E493 WeakPolarHBondContact OD1-CG 3.5Å; N491-E493 PolarHBondContact OD1-N 3.01Å
492	T	76.3	Confident	80.3	Confident	52 Å²	52	83.2 Å²	83.2	32%	0.319	44%	0.438	S	S	.	.			trans	-94.6	-12	177.3	48.5	0	0	0	0	112	P490 G494 N495 Y516	P490-T492 PolarHBondContact O-N 2.85Å; P490-T492 VanDerWaalsContact O-N 3.17Å; T492-G494 PolarHBondContact O-N 2.75Å; T492-N495 PolarHBondContact O-N 2.97Å; T492-Y516 HydrophobicContact CG2-CE1 3.99Å
493	E	71.4	Confident	81	Confident	160 Å²	160	86.6 Å²	86.6	75%	0.748	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	127.1	178.1	-59.9	-175	168.8	0	0	110.4	N491	N491-E493 VanDerWaalsContact OD1-CB 3.26Å; N491-E493 WeakPolarHBondContact OD1-CB 3.26Å; N491-E493 WeakPolarHBondContact OD1-CG 3.5Å; N491-E493 PolarHBondContact OD1-N 3.01Å
494	G	77.9	Confident	82.1	Confident	64 Å²	64	82.8 Å²	82.8	66%	0.66	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	96	-2.7	-177.7	0	0	0	0	0	114.7	T492 Q496	T492-G494 PolarHBondContact O-N 2.75Å; G494-Q496 PolarHBondContact O-N 2.86Å
495	N	87.4	Confident	83	Confident	73 Å²	73	80.9 Å²	80.9	39%	0.39	44%	0.435	S	S	.	.			trans	-81.8	108.4	169.5	-174.7	-41.2	0	0	0	110.4	T492 W497 Y498 D499	T492-N495 PolarHBondContact O-N 2.97Å; N495-W497 PolarHBondContact O-N 2.67Å; N495-W497 VanDerWaalsContact O-N 3.09Å; N495-W497 WeakPolarHBondContact OD1-CB 3.34Å; N495-W497 PolarHBondContact OD1-N 2.89Å; N495-Y498 HydrophobicContact CB-CD2 3.75Å; N495-Y498 VanDerWaalsContact CG-CD2 3.49Å; N495-Y498 PolarHBondContact O-N 2.82Å; N495-Y498 PolarHBondContact OD1-N 2.72Å; N495-D499 PolarHBondContact O-N 3.24Å
496	Q	91.5	Very high	83.5	Confident	170 Å²	170	84 Å²	84	79%	0.794	45%	0.447	S	S	*	.	H	α-helix	trans	-53.8	-33.2	-177.3	-64.8	177.8	-16.5	0	0	113.8	G494 F500	G494-Q496 PolarHBondContact O-N 2.86Å; Q496-F500 WeakPolarHBondContact O-CB 3.35Å; Q496-F500 PolarHBondContact O-N 3.38Å
497	W	90.6	Very high	84	Confident	125 Å²	125	85.8 Å²	85.8	47%	0.473	46%	0.456	S	S	.	.	H	α-helix	trans	-69.5	-43.9	177.8	174.1	-107.6	0	0	0	111.7	N495 F500 L501 L513	N495-W497 PolarHBondContact O-N 2.67Å; N495-W497 VanDerWaalsContact O-N 3.09Å; N495-W497 WeakPolarHBondContact OD1-CB 3.34Å; N495-W497 PolarHBondContact OD1-N 2.89Å; W497-F500 HydrophobicContact CZ3-CD1 4.41Å; W497-F500 PolarHBondContact O-N 3.43Å; W497-L501 VanDerWaalsContact O-CB 3.29Å; W497-L501 WeakPolarHBondContact O-CB 3.39Å; W497-L501 PolarHBondContact O-N 2.83Å; W497-L513 HydrophobicContact CZ2-CD1 4.26Å; W497-L513 HydrophobicContact CZ2-CD2 4.24Å
498	Y	88.3	Confident	84.7	Confident	47 Å²	47	86.5 Å²	86.5	18%	0.184	45%	0.451	C	S	.	.	H	α-helix	trans	-66.5	-41.7	177.3	-77.9	-67.7	0	0	0	111.7	N495 F500 L501 Q502 Y516	N495-Y498 HydrophobicContact CB-CD2 3.75Å; N495-Y498 VanDerWaalsContact CG-CD2 3.49Å; N495-Y498 PolarHBondContact O-N 2.82Å; N495-Y498 PolarHBondContact OD1-N 2.72Å; Y498-F500 VanDerWaalsContact C-N 3.29Å; Y498-F500 PolarHBondContact O-N 3.11Å; Y498-L501 PolarHBondContact O-N 2.96Å; Y498-Q502 WeakPolarHBondContact O-CB 3.28Å; Y498-Q502 WeakPolarHBondContact O-CG 3.4Å; Y498-Q502 PolarHBondContact O-N 2.93Å; Y498-Y516 HydrophobicContact CD1-CD1 4.22Å; Y498-Y516 AromaticContact CE1-CD1 3.26Å; Y498-Y516 HydrophobicContact CE1-CD1 3.26Å; Y498-Y516 HydrophobicContact CE1-CD2 4.35Å; Y498-Y516 AromaticContact CE1-CE1 3.64Å; Y498-Y516 HydrophobicContact CE1-CE1 3.64Å; Y498-Y516 AromaticContact CE1-CG 3.66Å; Y498-Y516 HydrophobicContact CE1-CG 3.66Å; Y498-Y516 HydrophobicContact CE2-CE1 4.36Å; Y498-Y516 AromaticContact CZ-CD1 3.6Å; Y498-Y516 AromaticContact CZ-CE1 3.53Å; Y498-Y516 AromaticContact CZ-CG 3.9Å; Y498-Y516 AromaticContact CZ-CZ 3.84Å; Y498-Y516 WeakPolarHBondContact OH-CD1 3.39Å; Y498-Y516 WeakPolarHBondContact OH-CD2 3.49Å; Y498-Y516 WeakPolarHBondContact OH-CE1 3.21Å; Y498-Y516 WeakPolarHBondContact OH-CE2 3.4Å
499	D	88.8	Confident	85.4	Confident	77 Å²	77	92.8 Å²	92.8	41%	0.412	48%	0.478	S	S	.	.	H	α-helix	trans	-60.5	-42.2	176.3	-65.2	-26.5	0	0	0	111	N495 N503	N495-D499 PolarHBondContact O-N 3.24Å; D499-N503 WeakPolarHBondContact O-CB 3.49Å; D499-N503 VanDerWaalsContact O-CG 3.31Å; D499-N503 PolarHBondContact O-N 3.08Å; D499-N503 PolarHBondContact O-ND2 2.81Å
500	F	91.6	Very high	86.1	Confident	121 Å²	121	91.9 Å²	91.9	53%	0.531	47%	0.473	S	S	.	.	H	α-helix	trans	-67.1	-44.4	176.3	-174.7	-110.9	0	0	0	112.5	Q496 W497 Y498 Q502 N503 S504 L507	Q496-F500 WeakPolarHBondContact O-CB 3.35Å; Q496-F500 PolarHBondContact O-N 3.38Å; W497-F500 HydrophobicContact CZ3-CD1 4.41Å; W497-F500 PolarHBondContact O-N 3.43Å; Y498-F500 VanDerWaalsContact C-N 3.29Å; Y498-F500 PolarHBondContact O-N 3.11Å; F500-Q502 VanDerWaalsContact C-N 3.33Å; F500-Q502 PolarHBondContact O-N 3.42Å; F500-N503 PolarHBondContact O-N 3.41Å; F500-S504 PolarHBondContact O-N 3.13Å; F500-S504 VanDerWaalsContact O-N 3.13Å; F500-L507 HydrophobicContact CD1-CD1 3.78Å; F500-L507 HydrophobicContact CE1-CD1 3.34Å; F500-L507 HydrophobicContact CZ-CD1 4.21Å
501	L	89.6	Confident	86.5	Confident	26 Å²	26	93.8 Å²	93.8	14%	0.136	49%	0.485	C	S	.	.	H	α-helix	trans	-62.8	-39.4	177.8	-177.2	62.3	0	0	0	111.5	W497 Y498 N503 L507 K508 L513	W497-L501 VanDerWaalsContact O-CB 3.29Å; W497-L501 WeakPolarHBondContact O-CB 3.39Å; W497-L501 PolarHBondContact O-N 2.83Å; Y498-L501 PolarHBondContact O-N 2.96Å; L501-N503 VanDerWaalsContact C-N 3.3Å; L501-N503 PolarHBondContact O-N 3.1Å; L501-L507 HydrophobicContact CD1-CB 3.66Å; L501-K508 WeakPolarHBondContact O-CE 3.3Å; L501-K508 WeakPolarHBondContact O-CG 3.48Å; L501-L513 HydrophobicContact CD1-CD1 3.91Å
502	Q	87	Confident	87.2	Confident	114 Å²	114	94.1 Å²	94.1	53%	0.533	49%	0.486	S	S	.	.	H	α-helix	trans	-70.8	-24.2	178.8	-71.2	-57.8	-20.4	0	0	113.6	Y498 F500 K508	Y498-Q502 WeakPolarHBondContact O-CB 3.28Å; Y498-Q502 WeakPolarHBondContact O-CG 3.4Å; Y498-Q502 PolarHBondContact O-N 2.93Å; F500-Q502 VanDerWaalsContact C-N 3.33Å; F500-Q502 PolarHBondContact O-N 3.42Å; Q502-K508 WeakPolarHBondContact O-CE 3.44Å; Q502-K508 PolarHBondContact O-NZ 2.85Å
503	N	89.8	Confident	87.9	Confident	142 Å²	142	94.3 Å²	94.3	76%	0.759	49%	0.485	S	S	*	.	H	α-helix	trans	-94	-13.2	179.6	-69.1	-42	0	0	0	113.7	D499 F500 L501	D499-N503 WeakPolarHBondContact O-CB 3.49Å; D499-N503 VanDerWaalsContact O-CG 3.31Å; D499-N503 PolarHBondContact O-N 3.08Å; D499-N503 PolarHBondContact O-ND2 2.81Å; F500-N503 PolarHBondContact O-N 3.41Å; L501-N503 VanDerWaalsContact C-N 3.3Å; L501-N503 PolarHBondContact O-N 3.1Å
504	S	92.7	Very high	88.9	Confident	27 Å²	27	90.7 Å²	90.7	19%	0.189	47%	0.467	C	S	.	.			trans	-92.8	134.4	178.6	-179.3	0	0	0	0	112.2	F500 L507 K508	F500-S504 PolarHBondContact O-N 3.13Å; F500-S504 VanDerWaalsContact O-N 3.13Å; S504-L507 WeakPolarHBondContact OG-CG 3.49Å; S504-L507 PolarHBondContact OG-N 2.63Å; S504-K508 WeakPolarHBondContact O-CD 3.44Å; S504-K508 VanDerWaalsContact O-CG 3.32Å; S504-K508 WeakPolarHBondContact O-CG 3.36Å
505	S	87.8	Confident	89.5	Confident	68 Å²	68	90.2 Å²	90.2	48%	0.476	45%	0.452	S	S	.	.	H	α-helix	trans	-76.7	-51	173.7	49.1	0	0	0	0	111.8	L507 K508 E509	S505-L507 PolarHBondContact O-N 2.72Å; S505-K508 PolarHBondContact O-N 3.44Å; S505-E509 PolarHBondContact O-N 3.47Å
506	H	89.6	Confident	89.6	Confident	148 Å²	148	89.4 Å²	89.4	69%	0.685	44%	0.444	S	S	*	.	H	α-helix	trans	-69.4	-30.7	-173.8	-58.2	-60.1	0	0	0	113.9	S510	H506-S510 PolarHBondContact O-N 3.13Å; H506-S510 VanDerWaalsContact O-N 3.13Å
507	L	90	Very high	89.5	Confident	49 Å²	49	83.7 Å²	83.7	26%	0.257	42%	0.416	S	S	.	.	H	α-helix	trans	-73.2	-34.7	178.9	-67.3	174.6	0	0	0	111.8	F500 L501 S504 S505 E509 S510 L513	F500-L507 HydrophobicContact CD1-CD1 3.78Å; F500-L507 HydrophobicContact CE1-CD1 3.34Å; F500-L507 HydrophobicContact CZ-CD1 4.21Å; L501-L507 HydrophobicContact CD1-CB 3.66Å; S504-L507 WeakPolarHBondContact OG-CG 3.49Å; S504-L507 PolarHBondContact OG-N 2.63Å; S505-L507 PolarHBondContact O-N 2.72Å; L507-E509 VanDerWaalsContact C-N 3.27Å; L507-E509 PolarHBondContact O-N 3.15Å; L507-S510 WeakPolarHBondContact O-CB 3.27Å; L507-S510 PolarHBondContact O-N 2.88Å; L507-L513 HydrophobicContact CB-CD1 4.19Å; L507-L513 HydrophobicContact CD2-CD1 4.31Å; L507-L513 WeakPolarHBondContact O-CD1 3.26Å
508	K	86	Confident	89.3	Confident	108 Å²	108	80.1 Å²	80.1	47%	0.47	41%	0.408	S	S	.	.	H	α-helix	trans	-64.3	-34.8	176.1	-70.5	-178.5	-172.5	-163	0	112.8	L501 Q502 S504 S505	L501-K508 WeakPolarHBondContact O-CE 3.3Å; L501-K508 WeakPolarHBondContact O-CG 3.48Å; Q502-K508 WeakPolarHBondContact O-CE 3.44Å; Q502-K508 PolarHBondContact O-NZ 2.85Å; S504-K508 WeakPolarHBondContact O-CD 3.44Å; S504-K508 VanDerWaalsContact O-CG 3.32Å; S504-K508 WeakPolarHBondContact O-CG 3.36Å; S505-K508 PolarHBondContact O-N 3.44Å
509	E	88.4	Confident	89.2	Confident	156 Å²	156	85.5 Å²	85.5	73%	0.729	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-1.1	-178.9	-64.8	175	-176	0	0	112.8	S505 L507	S505-E509 PolarHBondContact O-N 3.47Å; L507-E509 VanDerWaalsContact C-N 3.27Å; L507-E509 PolarHBondContact O-N 3.15Å
510	S	90.8	Very high	89.3	Confident	33 Å²	33	84.4 Å²	84.4	23%	0.231	42%	0.42	C	S	.	.			trans	-68.3	126.3	-177.7	179.8	0	0	0	0	110.9	H506 L507 L512 L513	H506-S510 PolarHBondContact O-N 3.13Å; H506-S510 VanDerWaalsContact O-N 3.13Å; L507-S510 WeakPolarHBondContact O-CB 3.27Å; L507-S510 PolarHBondContact O-N 2.88Å; S510-L512 PolarHBondContact O-N 2.81Å; S510-L512 VanDerWaalsContact O-N 3.15Å; S510-L512 PolarHBondContact OG-N 3.38Å; S510-L513 PolarHBondContact O-N 2.78Å
511	P	85.9	Confident	89.3	Confident	82 Å²	82	78.8 Å²	78.8	53%	0.532	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-7.8	177.9	30.9	-36.1	0	0	0	113
512	L	89.3	Confident	89.3	Confident	134 Å²	134	77.5 Å²	77.5	70%	0.702	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-15.8	-177.7	-59.5	177.9	0	0	0	113.4	S510	S510-L512 PolarHBondContact O-N 2.81Å; S510-L512 VanDerWaalsContact O-N 3.15Å; S510-L512 PolarHBondContact OG-N 3.38Å
513	L	92.3	Very high	89.5	Confident	57 Å²	57	72.8 Å²	72.8	30%	0.298	37%	0.367	S	S	.	.	S	Bend	trans	-96.9	143.9	-179.1	-67.9	-178.6	0	0	0	110.7	W497 L501 L507 S510	W497-L513 HydrophobicContact CZ2-CD1 4.26Å; W497-L513 HydrophobicContact CZ2-CD2 4.24Å; L501-L513 HydrophobicContact CD1-CD1 3.91Å; L507-L513 HydrophobicContact CB-CD1 4.19Å; L507-L513 HydrophobicContact CD2-CD1 4.31Å; L507-L513 WeakPolarHBondContact O-CD1 3.26Å; S510-L513 PolarHBondContact O-N 2.78Å
514	F	92.6	Very high	89.6	Confident	83 Å²	83	68.6 Å²	68.6	36%	0.364	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-80.8	131.3	178.9	-50.1	-39.3	0	0	0	110.4	L398 Y516	L398-F514 HydrophobicContact CD1-CB 3.86Å; L398-F514 HydrophobicContact CD1-CD2 3.99Å; L398-F514 HydrophobicContact CD1-CG 4.45Å; L398-F514 HydrophobicContact CG-CD2 4.38Å; F514-Y516 PolarHBondContact O-N 3.07Å
515	P	90.4	Very high	89.7	Confident	55 Å²	55	67.4 Å²	67.4	36%	0.357	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-57.1	133.6	172.5	-25.4	33.8	0	0	0	111.5	S395 Y517	S395-P515 WeakPolarHBondContact CB-O 3.33Å; S395-P515 WeakPolarHBondContact OG-CD 3.49Å; S395-P515 PolarHBondContact OG-O 2.9Å; P515-Y517 HydrophobicContact CB-CE2 4.12Å
516	Y	88.3	Confident	90	Very high	55 Å²	55	65.6 Å²	65.6	22%	0.216	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-99.7	129.9	177.5	-176	-120.7	0	0	0	111.3	E402 T492 Y498 F514 P518	E402-Y516 WeakPolarHBondContact OE2-CE2 3.44Å; E402-Y516 PolarHBondContact OE2-OH 3.49Å; T492-Y516 HydrophobicContact CG2-CE1 3.99Å; Y498-Y516 HydrophobicContact CD1-CD1 4.22Å; Y498-Y516 AromaticContact CE1-CD1 3.26Å; Y498-Y516 HydrophobicContact CE1-CD1 3.26Å; Y498-Y516 HydrophobicContact CE1-CD2 4.35Å; Y498-Y516 AromaticContact CE1-CE1 3.64Å; Y498-Y516 HydrophobicContact CE1-CE1 3.64Å; Y498-Y516 AromaticContact CE1-CG 3.66Å; Y498-Y516 HydrophobicContact CE1-CG 3.66Å; Y498-Y516 HydrophobicContact CE2-CE1 4.36Å; Y498-Y516 AromaticContact CZ-CD1 3.6Å; Y498-Y516 AromaticContact CZ-CE1 3.53Å; Y498-Y516 AromaticContact CZ-CG 3.9Å; Y498-Y516 AromaticContact CZ-CZ 3.84Å; Y498-Y516 WeakPolarHBondContact OH-CD1 3.39Å; Y498-Y516 WeakPolarHBondContact OH-CD2 3.49Å; Y498-Y516 WeakPolarHBondContact OH-CE1 3.21Å; Y498-Y516 WeakPolarHBondContact OH-CE2 3.4Å; F514-Y516 PolarHBondContact O-N 3.07Å; Y516-P518 HydrophobicContact CD1-CB 4.1Å; Y516-P518 HydrophobicContact CD1-CG 4.24Å; Y516-P518 HydrophobicContact CE1-CB 3.55Å; Y516-P518 HydrophobicContact CE1-CG 4.18Å; Y516-P518 VanDerWaalsContact O-CD 3.23Å; Y516-P518 WeakPolarHBondContact O-CD 3.27Å
517	Y	90.1	Very high	90.2	Very high	51 Å²	51	61.7 Å²	61.7	20%	0.2	30%	0.296	C	S	.	.			trans	-113.1	81.7	179.6	-59.4	-73.8	0	0	0	110.7	K399 P515 R519 F524 V525 R528	K399-Y517 WeakPolarHBondContact CE-O 3.46Å; K399-Y517 PolarHBondContact NZ-O 2.88Å; P515-Y517 HydrophobicContact CB-CE2 4.12Å; Y517-R519 PolarHBondContact O-N 2.94Å; Y517-F524 HydrophobicContact CD1-CE1 4.43Å; Y517-V525 HydrophobicContact CD2-CG1 4.49Å; Y517-V525 HydrophobicContact CD2-CG2 3.94Å; Y517-V525 HydrophobicContact CG-CG2 4.34Å; Y517-R528 PolarHBondContact OH-NE 3.29Å; Y517-R528 VanDerWaalsContact OH-NE 3.14Å
518	P	86.1	Confident	90.4	Very high	49 Å²	49	64.9 Å²	64.9	32%	0.318	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-37.5	-170.2	19.8	-30.5	0	0	0	114	L486 Y516	L486-P518 WeakPolarHBondContact CD1-O 3.14Å; Y516-P518 HydrophobicContact CD1-CB 4.1Å; Y516-P518 HydrophobicContact CD1-CG 4.24Å; Y516-P518 HydrophobicContact CE1-CB 3.55Å; Y516-P518 HydrophobicContact CE1-CG 4.18Å; Y516-P518 VanDerWaalsContact O-CD 3.23Å; Y516-P518 WeakPolarHBondContact O-CD 3.27Å
519	R	87.3	Confident	90.8	Very high	160 Å²	160	59.8 Å²	59.8	60%	0.604	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	7.8	-172.2	-60.6	-175.1	-178.3	-179.5	-0.7	113.8	D485 L486 P489 Y517	D485-R519 CarbonylContact C-O 3.54Å; D485-R519 VanDerWaalsContact CA-O 3.31Å; D485-R519 WeakPolarHBondContact CA-O 3.47Å; D485-R519 HydrophobicContact CB-CB 4.44Å; L486-R519 WeakPolarHBondContact CG-O 3.25Å; L486-R519 PolarHBondContact N-O 2.89Å; P489-R519 HydrophobicContact CB-CG 4.44Å; P489-R519 HydrophobicContact CG-CG 4.4Å; Y517-R519 PolarHBondContact O-N 2.94Å
520	K	90	Very high	91.1	Very high	55 Å²	55	53.8 Å²	53.8	24%	0.239	26%	0.255	C	S	.	.			trans	-106.1	147.7	-176	-63.3	-60.6	-170.3	-173	0	111.8	D485 F524	D485-K520 WeakPolarHBondContact OD1-CD 3.14Å; D485-K520 VanDerWaalsContact OD1-CE 3.29Å; D485-K520 WeakPolarHBondContact OD1-CE 3.34Å; D485-K520 IonicContact OD1-NZ 2.69Å; D485-K520 PolarHBondContact OD1-NZ 3.05Å; K520-F524 HydrophobicContact CB-CB 4.27Å; K520-F524 HydrophobicContact CB-CD1 3.55Å; K520-F524 HydrophobicContact CB-CE1 4.18Å; K520-F524 HydrophobicContact CB-CG 4.07Å; K520-F524 HydrophobicContact CD-CD1 4.06Å; K520-F524 HydrophobicContact CD-CD2 4.43Å; K520-F524 HydrophobicContact CD-CE1 4.23Å; K520-F524 HydrophobicContact CD-CG 4.16Å; K520-F524 HydrophobicContact CD-CZ 4.48Å; K520-F524 HydrophobicContact CG-CD1 3.66Å; K520-F524 HydrophobicContact CG-CE1 3.8Å; K520-F524 HydrophobicContact CG-CG 4.24Å; K520-F524 HydrophobicContact CG-CZ 4.48Å
521	S	90.6	Very high	91.4	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.014	27%	0.268	C	S	.	.			trans	-68.2	165	176.7	68	0	0	0	0	112.3	Q477 H523 F524 V525	Q477-S521 WeakPolarHBondContact O-CB 3.47Å; S521-H523 VanDerWaalsContact C-N 3.31Å; S521-F524 PolarHBondContact O-N 3.45Å; S521-F524 PolarHBondContact OG-N 2.97Å; S521-V525 PolarHBondContact O-N 3.39Å
522	L	91.2	Very high	91.8	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-38.7	174.8	-174.9	67.1	0	0	0	110.6	L269 L352 F396 K399 L403 Y478 L479 F524 V525 K526	L269-L522 HydrophobicContact CD1-CD2 3.64Å; L352-L522 HydrophobicContact CD2-CD2 4.32Å; F396-L522 HydrophobicContact CD2-CD1 3.89Å; F396-L522 HydrophobicContact CE2-CD1 3.47Å; F396-L522 VanDerWaalsContact CE2-CD1 3.47Å; F396-L522 HydrophobicContact CE2-CG 3.9Å; F396-L522 HydrophobicContact CZ-CD1 4.17Å; K399-L522 HydrophobicContact CB-CD1 4.05Å; K399-L522 HydrophobicContact CG-CB 4.43Å; K399-L522 HydrophobicContact CG-CD1 3.7Å; L403-L522 HydrophobicContact CD2-CD2 3.82Å; Y478-L522 WeakPolarHBondContact O-CB 3.42Å; Y478-L522 PolarHBondContact O-N 3.32Å; L479-L522 HydrophobicContact CD2-CD2 4.44Å; L522-F524 PolarHBondContact O-N 2.83Å; L522-V525 PolarHBondContact O-N 3.15Å; L522-K526 WeakPolarHBondContact O-CB 3.41Å; L522-K526 PolarHBondContact O-N 3.25Å
523	H	91.3	Very high	92.1	Very high	15 Å²	15	47.7 Å²	47.7	7%	0.069	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-42.2	176.7	-75.5	82.3	0	0	0	112.7	C273 Y478 L479 D481 S521 V525 K526 R527	C273-H523 VanDerWaalsContact SG-CE1 3.6Å; Y478-H523 PolarHBondContact O-ND1 2.9Å; L479-H523 PolarHBondContact O-CE1 3.11Å; L479-H523 PolarHBondContact O-ND1 2.88Å; D481-H523 IonicContact OD1-CD2 2.62Å; D481-H523 PolarHBondContact OD1-CD2 2.85Å; D481-H523 IonicContact OD1-CG 2.67Å; S521-H523 VanDerWaalsContact C-N 3.31Å; H523-V525 PolarHBondContact O-N 2.93Å; H523-K526 WeakPolarHBondContact O-CB 3.41Å; H523-K526 PolarHBondContact O-N 2.87Å; H523-R527 WeakPolarHBondContact O-CG 3.49Å; H523-R527 PolarHBondContact O-N 2.9Å
524	F	92.1	Very high	92.1	Very high	53 Å²	53	48 Å²	48	23%	0.232	22%	0.217	C	C	.	.	H	α-helix	trans	-58.3	-48.7	175.6	173.6	-92.5	0	0	0	111.8	Y517 K520 S521 L522 K526 R527 R528	Y517-F524 HydrophobicContact CD1-CE1 4.43Å; K520-F524 HydrophobicContact CB-CB 4.27Å; K520-F524 HydrophobicContact CB-CD1 3.55Å; K520-F524 HydrophobicContact CB-CE1 4.18Å; K520-F524 HydrophobicContact CB-CG 4.07Å; K520-F524 HydrophobicContact CD-CD1 4.06Å; K520-F524 HydrophobicContact CD-CD2 4.43Å; K520-F524 HydrophobicContact CD-CE1 4.23Å; K520-F524 HydrophobicContact CD-CG 4.16Å; K520-F524 HydrophobicContact CD-CZ 4.48Å; K520-F524 HydrophobicContact CG-CD1 3.66Å; K520-F524 HydrophobicContact CG-CE1 3.8Å; K520-F524 HydrophobicContact CG-CG 4.24Å; K520-F524 HydrophobicContact CG-CZ 4.48Å; S521-F524 PolarHBondContact O-N 3.45Å; S521-F524 PolarHBondContact OG-N 2.97Å; L522-F524 PolarHBondContact O-N 2.83Å; F524-K526 VanDerWaalsContact C-N 3.32Å; F524-K526 PolarHBondContact O-N 2.94Å; F524-R527 PolarHBondContact O-N 2.8Å; F524-R528 WeakPolarHBondContact O-CB 3.42Å; F524-R528 PolarHBondContact O-N 2.9Å
525	V	93.3	Very high	92	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-66.3	-38.4	179.9	-176.3	0	0	0	0	110.6	F396 K399 Y517 S521 L522 H523 R528 M529	F396-V525 HydrophobicContact CB-CG1 4Å; F396-V525 HydrophobicContact CD2-CB 4.46Å; F396-V525 HydrophobicContact CD2-CG1 4.22Å; K399-V525 HydrophobicContact CG-CG2 4.39Å; Y517-V525 HydrophobicContact CD2-CG1 4.49Å; Y517-V525 HydrophobicContact CD2-CG2 3.94Å; Y517-V525 HydrophobicContact CG-CG2 4.34Å; S521-V525 PolarHBondContact O-N 3.39Å; L522-V525 PolarHBondContact O-N 3.15Å; H523-V525 PolarHBondContact O-N 2.93Å; V525-R528 PolarHBondContact O-N 3.44Å; V525-M529 WeakPolarHBondContact O-CB 3.37Å; V525-M529 PolarHBondContact O-N 2.97Å
526	K	94.2	Very high	92.1	Very high	30 Å²	30	48.3 Å²	48.3	13%	0.13	22%	0.217	C	C	.	.	H	α-helix	trans	-58.8	-54.1	174.7	-163	-148.5	88.1	160.8	0	111.9	N266 L269 F396 L522 H523 F524 R528 M529 E530	N266-K526 VanDerWaalsContact OD1-CD 3.32Å; N266-K526 WeakPolarHBondContact OD1-CD 3.43Å; N266-K526 WeakPolarHBondContact OD1-CE 3.21Å; N266-K526 PolarHBondContact OD1-NZ 3.4Å; L269-K526 HydrophobicContact CD2-CD 3.49Å; L269-K526 VanDerWaalsContact CD2-CD 3.49Å; L269-K526 HydrophobicContact CD2-CG 4.34Å; F396-K526 HydrophobicContact CD2-CB 4.31Å; F396-K526 HydrophobicContact CE2-CB 3.82Å; F396-K526 HydrophobicContact CE2-CG 4.02Å; F396-K526 HydrophobicContact CZ-CG 4.38Å; L522-K526 WeakPolarHBondContact O-CB 3.41Å; L522-K526 PolarHBondContact O-N 3.25Å; H523-K526 WeakPolarHBondContact O-CB 3.41Å; H523-K526 PolarHBondContact O-N 2.87Å; F524-K526 VanDerWaalsContact C-N 3.32Å; F524-K526 PolarHBondContact O-N 2.94Å; K526-R528 VanDerWaalsContact C-N 3.29Å; K526-R528 PolarHBondContact O-N 2.77Å; K526-M529 HydrophobicContact CG-CE 4.42Å; K526-M529 WeakPolarHBondContact O-CB 3.44Å; K526-M529 PolarHBondContact O-N 2.84Å; K526-M529 VanDerWaalsContact O-N 3.13Å; K526-E530 WeakPolarHBondContact CE-OE1 3.46Å; K526-E530 WeakPolarHBondContact CE-OE2 3.04Å; K526-E530 IonicContact NZ-OE1 2.65Å; K526-E530 PolarHBondContact NZ-OE1 2.59Å; K526-E530 IonicContact NZ-OE2 3.52Å; K526-E530 PolarHBondContact NZ-OE2 2.93Å; K526-E530 WeakPolarHBondContact O-CG 3.39Å; K526-E530 PolarHBondContact O-N 2.69Å
527	R	93.7	Very high	92.1	Very high	65 Å²	65	46.3 Å²	46.3	25%	0.245	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-37.8	-180	-67.3	-167.3	-129.1	110.6	-14.5	111.5	D481 D483 H523 F524 N531	D481-R527 IonicContact OD1-CZ 2.73Å; D481-R527 VanDerWaalsContact OD1-CZ 3.28Å; D481-R527 IonicContact OD1-NE 3.04Å; D481-R527 PolarHBondContact OD1-NE 3.25Å; D481-R527 IonicContact OD1-NH2 3.03Å; D481-R527 PolarHBondContact OD1-NH2 3.02Å; D481-R527 IonicContact OD2-NH2 2.58Å; D483-R527 IonicContact OD1-CZ 3.78Å; D483-R527 IonicContact OD1-NH1 3.78Å; D483-R527 PolarHBondContact OD1-NH1 3.48Å; D483-R527 IonicContact OD1-NH2 2.97Å; H523-R527 WeakPolarHBondContact O-CG 3.49Å; H523-R527 PolarHBondContact O-N 2.9Å; F524-R527 PolarHBondContact O-N 2.8Å; R527-N531 WeakPolarHBondContact O-CB 3.41Å; R527-N531 PolarHBondContact O-N 3.46Å; R527-N531 PolarHBondContact O-ND2 3.16Å
528	R	93.9	Very high	92.2	Very high	117 Å²	117	49.5 Å²	49.5	44%	0.442	23%	0.227	S	C	.	.	H	α-helix	trans	-63.2	-46	174.1	-176.8	176.1	179.2	82.4	2.5	111.7	Y517 F524 V525 K526 N531 I532	Y517-R528 PolarHBondContact OH-NE 3.29Å; Y517-R528 VanDerWaalsContact OH-NE 3.14Å; F524-R528 WeakPolarHBondContact O-CB 3.42Å; F524-R528 PolarHBondContact O-N 2.9Å; V525-R528 PolarHBondContact O-N 3.44Å; K526-R528 VanDerWaalsContact C-N 3.29Å; K526-R528 PolarHBondContact O-N 2.77Å; R528-N531 PolarHBondContact O-N 3.5Å; R528-I532 HydrophobicContact CG-CD1 3.98Å; R528-I532 WeakPolarHBondContact O-CD1 3.36Å; R528-I532 VanDerWaalsContact O-CG1 3.3Å; R528-I532 WeakPolarHBondContact O-CG1 3.38Å; R528-I532 PolarHBondContact O-N 3.18Å
529	M	95.7	Very high	92.5	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-59.8	-49.5	177	176.1	-168	74.2	0	0	111.3	L262 L359 A392 V393 F396 V525 K526 N531 I532 I533	L262-M529 HydrophobicContact CD2-CE 3.91Å; L359-M529 HydrophobicContact CD2-SD 4.29Å; A392-M529 HydrophobicContact CB-CB 4.29Å; A392-M529 HydrophobicContact CB-CG 4.49Å; V393-M529 HydrophobicContact CB-SD 4.35Å; V393-M529 HydrophobicContact CG2-CG 3.79Å; V393-M529 HydrophobicContact CG2-SD 3.73Å; F396-M529 HydrophobicContact CB-SD 3.83Å; F396-M529 HydrophobicContact CD1-CE 4.35Å; F396-M529 HydrophobicContact CD1-SD 4Å; F396-M529 HydrophobicContact CG-CE 4.42Å; F396-M529 HydrophobicContact CG-SD 3.9Å; V525-M529 WeakPolarHBondContact O-CB 3.37Å; V525-M529 PolarHBondContact O-N 2.97Å; K526-M529 HydrophobicContact CG-CE 4.42Å; K526-M529 WeakPolarHBondContact O-CB 3.44Å; K526-M529 PolarHBondContact O-N 2.84Å; K526-M529 VanDerWaalsContact O-N 3.13Å; M529-N531 PolarHBondContact O-N 3.02Å; M529-I532 PolarHBondContact O-N 3.45Å; M529-I533 HydrophobicContact CG-CD1 3.78Å; M529-I533 WeakPolarHBondContact O-CG1 3.31Å; M529-I533 PolarHBondContact O-N 2.77Å
530	E	95	Very high	92.9	Very high	30 Å²	30	43.7 Å²	43.7	14%	0.14	20%	0.201	C	C	.	.	H	α-helix	trans	-57.1	-49.8	177	-72	175.4	147.6	0	0	111.8	L262 N266 K526 I532 I533 D534	L262-E530 HydrophobicContact CD2-CG 4.37Å; N266-E530 PolarHBondContact ND2-OE1 3.1Å; N266-E530 PolarHBondContact OD1-OE1 3.07Å; K526-E530 WeakPolarHBondContact CE-OE1 3.46Å; K526-E530 WeakPolarHBondContact CE-OE2 3.04Å; K526-E530 IonicContact NZ-OE1 2.65Å; K526-E530 PolarHBondContact NZ-OE1 2.59Å; K526-E530 IonicContact NZ-OE2 3.52Å; K526-E530 PolarHBondContact NZ-OE2 2.93Å; K526-E530 WeakPolarHBondContact O-CG 3.39Å; K526-E530 PolarHBondContact O-N 2.69Å; E530-I532 VanDerWaalsContact C-N 3.31Å; E530-I532 PolarHBondContact O-N 2.83Å; E530-I533 PolarHBondContact O-N 2.81Å; E530-I533 VanDerWaalsContact O-N 3.15Å; E530-D534 WeakPolarHBondContact O-CB 3.06Å; E530-D534 VanDerWaalsContact O-CG 3.29Å; E530-D534 PolarHBondContact O-N 2.97Å
531	N	95.3	Very high	93.1	Very high	93 Å²	93	41.1 Å²	41.1	50%	0.497	19%	0.19	S	C	.	.	H	α-helix	trans	-59.1	-40.2	-179.2	-76.1	-37.6	0	0	0	112.9	R527 R528 M529 Q535	R527-N531 WeakPolarHBondContact O-CB 3.41Å; R527-N531 PolarHBondContact O-N 3.46Å; R527-N531 PolarHBondContact O-ND2 3.16Å; R528-N531 PolarHBondContact O-N 3.5Å; M529-N531 PolarHBondContact O-N 3.02Å; N531-Q535 WeakPolarHBondContact O-CG 3.32Å; N531-Q535 PolarHBondContact O-N 3.19Å; N531-Q535 VanDerWaalsContact O-N 3.11Å
532	I	95.6	Very high	93.2	Very high	25 Å²	25	44.2 Å²	44.2	13%	0.128	21%	0.206	C	C	.	.	H	α-helix	trans	-69.6	-41.7	178.8	-64.5	165.5	0	0	0	110.2	D388 A389 A392 R528 M529 E530 Q535 C536	D388-I532 HydrophobicContact CB-CG2 4.07Å; A389-I532 HydrophobicContact CB-CG2 3.99Å; A392-I532 HydrophobicContact CB-CD1 3.88Å; R528-I532 HydrophobicContact CG-CD1 3.98Å; R528-I532 WeakPolarHBondContact O-CD1 3.36Å; R528-I532 VanDerWaalsContact O-CG1 3.3Å; R528-I532 WeakPolarHBondContact O-CG1 3.38Å; R528-I532 PolarHBondContact O-N 3.18Å; M529-I532 PolarHBondContact O-N 3.45Å; E530-I532 VanDerWaalsContact C-N 3.31Å; E530-I532 PolarHBondContact O-N 2.83Å; I532-Q535 PolarHBondContact O-N 2.89Å; I532-C536 PolarHBondContact O-N 2.95Å; I532-C536 PolarHBondContact O-SG 2.7Å
533	I	95.1	Very high	93.4	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-64.7	-46.9	176.7	-66.9	166.4	0	0	0	110	I258 L262 L359 L363 A389 V393 M529 E530 Q535 C536 L537	I258-I533 HydrophobicContact CG2-CG2 3.71Å; L262-I533 HydrophobicContact CD1-CB 4.3Å; L262-I533 HydrophobicContact CD1-CD1 4.38Å; L262-I533 HydrophobicContact CD1-CG2 3.77Å; L262-I533 HydrophobicContact CD2-CD1 3.89Å; L359-I533 HydrophobicContact CD1-CD1 4.48Å; L359-I533 HydrophobicContact CD2-CD1 4.06Å; L363-I533 HydrophobicContact CD1-CD1 4.45Å; A389-I533 HydrophobicContact CB-CG1 3.92Å; V393-I533 HydrophobicContact CG2-CD1 4.06Å; M529-I533 HydrophobicContact CG-CD1 3.78Å; M529-I533 WeakPolarHBondContact O-CG1 3.31Å; M529-I533 PolarHBondContact O-N 2.77Å; E530-I533 PolarHBondContact O-N 2.81Å; E530-I533 VanDerWaalsContact O-N 3.15Å; I533-Q535 VanDerWaalsContact C-N 3.28Å; I533-Q535 PolarHBondContact O-N 3.17Å; I533-C536 CarbonylContact O-C 3.58Å; I533-C536 WeakPolarHBondContact O-CA 3.35Å; I533-C536 VanDerWaalsContact O-CB 3.3Å; I533-C536 WeakPolarHBondContact O-CB 3.49Å; I533-C536 PolarHBondContact O-N 3.09Å; I533-L537 HydrophobicContact CG2-CD1 3.84Å; I533-L537 HydrophobicContact CG2-CG 3.96Å; I533-L537 VanDerWaalsContact O-CG 3.3Å; I533-L537 WeakPolarHBondContact O-CG 3.33Å; I533-L537 PolarHBondContact O-N 3.47Å
534	D	91.9	Very high	93.7	Very high	63 Å²	63	45.9 Å²	45.9	34%	0.337	22%	0.217	S	C	.	.	H	α-helix	trans	-59.3	-37.6	179.8	-75.2	-19.9	0	0	0	112.3	E530 C536 L537 Q538	E530-D534 WeakPolarHBondContact O-CB 3.06Å; E530-D534 VanDerWaalsContact O-CG 3.29Å; E530-D534 PolarHBondContact O-N 2.97Å; D534-C536 VanDerWaalsContact C-N 3.33Å; D534-C536 PolarHBondContact O-N 3.26Å; D534-L537 PolarHBondContact O-N 2.9Å; D534-Q538 WeakPolarHBondContact O-CB 3.43Å; D534-Q538 VanDerWaalsContact O-CG 3.26Å; D534-Q538 WeakPolarHBondContact O-CG 3.46Å; D534-Q538 PolarHBondContact O-N 3.12Å
535	Q	91.8	Very high	93.8	Very high	131 Å²	131	43.5 Å²	43.5	61%	0.612	21%	0.208	S	C	*	.	H	α-helix	trans	-61.3	-41.8	172.6	-73.9	168.2	18.1	0	0	112	N531 I532 I533 L537 K539	N531-Q535 WeakPolarHBondContact O-CG 3.32Å; N531-Q535 PolarHBondContact O-N 3.19Å; N531-Q535 VanDerWaalsContact O-N 3.11Å; I532-Q535 PolarHBondContact O-N 2.89Å; I533-Q535 VanDerWaalsContact C-N 3.28Å; I533-Q535 PolarHBondContact O-N 3.17Å; Q535-L537 VanDerWaalsContact C-N 3.32Å; Q535-K539 PolarHBondContact O-N 2.75Å
536	C	91.9	Very high	93.8	Very high	14 Å²	14	53.1 Å²	53.1	10%	0.095	24%	0.244	C	C	.	.	H	α-helix	trans	-67.2	-35.2	175.7	-61.4	0	0	0	0	112.1	G385 I532 I533 D534 P540	G385-C536 PolarHBondContact O-SG 3.01Å; G385-C536 VanDerWaalsContact O-SG 3.36Å; I532-C536 PolarHBondContact O-N 2.95Å; I532-C536 PolarHBondContact O-SG 2.7Å; I533-C536 CarbonylContact O-C 3.58Å; I533-C536 WeakPolarHBondContact O-CA 3.35Å; I533-C536 VanDerWaalsContact O-CB 3.3Å; I533-C536 WeakPolarHBondContact O-CB 3.49Å; I533-C536 PolarHBondContact O-N 3.09Å; D534-C536 VanDerWaalsContact C-N 3.33Å; D534-C536 PolarHBondContact O-N 3.26Å; C536-P540 WeakPolarHBondContact O-CD 3.35Å
537	L	89	Confident	93.8	Very high	14 Å²	14	53.8 Å²	53.8	7%	0.073	25%	0.252	C	S	.	.	H	α-helix	trans	-72	-35.9	178.6	-71	-173.9	0	0	0	112.6	F193 F255 I258 I533 D534 Q535	F193-L537 HydrophobicContact CD2-CD2 4.5Å; F193-L537 HydrophobicContact CE2-CB 3.84Å; F193-L537 HydrophobicContact CE2-CD1 4.43Å; F193-L537 HydrophobicContact CE2-CD2 3.68Å; F193-L537 HydrophobicContact CE2-CG 4.16Å; F193-L537 HydrophobicContact CZ-CB 4.33Å; F193-L537 HydrophobicContact CZ-CD2 4.17Å; F193-L537 VanDerWaalsContact CZ-O 3.28Å; F193-L537 WeakPolarHBondContact CZ-O 3.41Å; F255-L537 HydrophobicContact CB-CD2 3.99Å; F255-L537 HydrophobicContact CD1-CD2 3.07Å; F255-L537 HydrophobicContact CE1-CD2 3.46Å; F255-L537 VanDerWaalsContact CE1-CD2 3.46Å; F255-L537 HydrophobicContact CG-CD2 3.67Å; F255-L537 HydrophobicContact CZ-CD2 4.34Å; I258-L537 HydrophobicContact CG2-CD2 4.49Å; I533-L537 HydrophobicContact CG2-CD1 3.84Å; I533-L537 HydrophobicContact CG2-CG 3.96Å; I533-L537 VanDerWaalsContact O-CG 3.3Å; I533-L537 WeakPolarHBondContact O-CG 3.33Å; I533-L537 PolarHBondContact O-N 3.47Å; D534-L537 PolarHBondContact O-N 2.9Å; Q535-L537 VanDerWaalsContact C-N 3.32Å
538	Q	90.8	Very high	93.8	Very high	118 Å²	118	51.1 Å²	51.1	55%	0.551	24%	0.243	S	C	*	.	H	α-helix	trans	-78.9	-33.7	-177.1	-72.9	176.1	7.5	0	0	113.3	D534 A541 D542	D534-Q538 WeakPolarHBondContact O-CB 3.43Å; D534-Q538 VanDerWaalsContact O-CG 3.26Å; D534-Q538 WeakPolarHBondContact O-CG 3.46Å; D534-Q538 PolarHBondContact O-N 3.12Å; Q538-A541 WeakPolarHBondContact O-CB 3.38Å; Q538-A541 PolarHBondContact O-N 2.85Å; Q538-D542 PolarHBondContact O-N 2.87Å
539	K	93.3	Very high	93.3	Very high	86 Å²	86	49.4 Å²	49.4	37%	0.374	24%	0.242	S	C	.	.	H	α-helix	trans	-57.1	-44.3	-173.9	-172.3	179.7	-174.4	-175.7	0	113.8	G380 D382 Q535 A541 D542 V543	G380-K539 WeakPolarHBondContact O-CD 3.4Å; G380-K539 WeakPolarHBondContact O-CG 3.3Å; D382-K539 HydrophobicContact CB-CD 4.13Å; D382-K539 VanDerWaalsContact CG-NZ 3.3Å; D382-K539 IonicContact OD2-NZ 2.68Å; D382-K539 PolarHBondContact OD2-NZ 3.36Å; Q535-K539 PolarHBondContact O-N 2.75Å; K539-A541 VanDerWaalsContact C-N 3.3Å; K539-A541 PolarHBondContact O-N 2.81Å; K539-D542 PolarHBondContact O-N 3.26Å; K539-V543 HydrophobicContact CG-CG2 4.48Å; K539-V543 WeakPolarHBondContact O-CG2 3.28Å; K539-V543 PolarHBondContact O-N 3.31Å; K539-V543 VanDerWaalsContact O-N 3.11Å
540	P	94.8	Very high	92.7	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.8	-37.7	174.7	-26.8	36.6	0	0	0	113.6	M251 F255 L379 C536 D542 V543 I544	M251-P540 HydrophobicContact CE-CB 4.12Å; M251-P540 HydrophobicContact SD-CB 4.44Å; M251-P540 HydrophobicContact SD-CG 4.46Å; F255-P540 HydrophobicContact CE2-CB 4.47Å; F255-P540 HydrophobicContact CE2-CG 3.87Å; F255-P540 HydrophobicContact CZ-CG 4.01Å; L379-P540 WeakPolarHBondContact O-CA 3Å; L379-P540 WeakPolarHBondContact O-CB 2.8Å; C536-P540 WeakPolarHBondContact O-CD 3.35Å; P540-D542 VanDerWaalsContact C-N 3.31Å; P540-D542 PolarHBondContact O-N 3.16Å; P540-V543 PolarHBondContact O-N 3.01Å; P540-I544 VanDerWaalsContact O-CB 3.3Å; P540-I544 WeakPolarHBondContact O-CB 2.96Å; P540-I544 VanDerWaalsContact O-CG1 3.24Å; P540-I544 WeakPolarHBondContact O-CG1 3.44Å; P540-I544 PolarHBondContact O-N 3.3Å
541	A	94.7	Very high	92.1	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-41.8	-178.5	0	0	0	0	0	112.1	K194 I195 A196 R197 Q538 K539 G545	K194-A541 HydrophobicContact CG-CB 4.15Å; I195-A541 WeakPolarHBondContact O-CA 3.29Å; A196-A541 CarbonylContact C-O 3.57Å; A196-A541 WeakPolarHBondContact CA-O 3.5Å; R197-A541 PolarHBondContact N-O 3.06Å; Q538-A541 WeakPolarHBondContact O-CB 3.38Å; Q538-A541 PolarHBondContact O-N 2.85Å; K539-A541 VanDerWaalsContact C-N 3.3Å; K539-A541 PolarHBondContact O-N 2.81Å; A541-G545 WeakPolarHBondContact O-CA 3.42Å; A541-G545 PolarHBondContact O-N 2.77Å
542	D	93.6	Very high	92	Very high	67 Å²	67	51.2 Å²	51.2	36%	0.358	26%	0.256	S	S	.	.	H	α-helix	trans	-73.9	-41	178.1	-71.6	-17.5	0	0	0	112.2	Q538 K539 P540 G545 R546	Q538-D542 PolarHBondContact O-N 2.87Å; K539-D542 PolarHBondContact O-N 3.26Å; P540-D542 VanDerWaalsContact C-N 3.31Å; P540-D542 PolarHBondContact O-N 3.16Å; D542-G545 PolarHBondContact O-N 3.13Å; D542-R546 WeakPolarHBondContact O-CB 3.45Å; D542-R546 VanDerWaalsContact O-CG 3.27Å; D542-R546 WeakPolarHBondContact O-CG 3.45Å; D542-R546 PolarHBondContact O-N 3.12Å
543	V	95.4	Very high	91.9	Very high	50 Å²	50	52.8 Å²	52.8	30%	0.303	27%	0.268	S	S	.	.	H	α-helix	trans	-65.8	-49.1	180	172.5	0	0	0	0	110.9	P378 K539 P540 G545 R546 S547	P378-V543 VanDerWaalsContact O-CG1 3.31Å; P378-V543 WeakPolarHBondContact O-CG1 3.22Å; K539-V543 HydrophobicContact CG-CG2 4.48Å; K539-V543 WeakPolarHBondContact O-CG2 3.28Å; K539-V543 PolarHBondContact O-N 3.31Å; K539-V543 VanDerWaalsContact O-N 3.11Å; P540-V543 PolarHBondContact O-N 3.01Å; V543-G545 VanDerWaalsContact C-N 3.33Å; V543-G545 PolarHBondContact O-N 3.07Å; V543-R546 PolarHBondContact O-N 3.32Å; V543-S547 PolarHBondContact O-N 2.86Å
544	I	95.8	Very high	92	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.8	-41.3	177	-62.2	177	0	0	0	109.7	I195 A196 L240 L241 M251 L379 P540 R546 S547 M548	I195-I544 WeakPolarHBondContact O-CD1 3.44Å; A196-I544 HydrophobicContact CB-CB 4.24Å; A196-I544 HydrophobicContact CB-CG2 3.79Å; L240-I544 HydrophobicContact CD2-CB 4.31Å; L240-I544 HydrophobicContact CD2-CG1 3.83Å; L240-I544 HydrophobicContact CD2-CG2 4.44Å; L241-I544 HydrophobicContact CD2-CG2 3.93Å; L241-I544 HydrophobicContact CG-CG2 4.3Å; M251-I544 HydrophobicContact CE-CD1 4.05Å; L379-I544 HydrophobicContact CD2-CD1 4.16Å; L379-I544 HydrophobicContact CD2-CG1 4.38Å; P540-I544 VanDerWaalsContact O-CB 3.3Å; P540-I544 WeakPolarHBondContact O-CB 2.96Å; P540-I544 VanDerWaalsContact O-CG1 3.24Å; P540-I544 WeakPolarHBondContact O-CG1 3.44Å; P540-I544 PolarHBondContact O-N 3.3Å; I544-R546 PolarHBondContact O-N 2.78Å; I544-S547 WeakPolarHBondContact O-CB 3.43Å; I544-S547 PolarHBondContact O-N 2.86Å; I544-S547 VanDerWaalsContact O-N 3.11Å; I544-S547 PolarHBondContact O-OG 2.96Å; I544-M548 HydrophobicContact CG2-CE 3.94Å
545	G	94.2	Very high	92.2	Very high	3 Å²	3	50.7 Å²	50.7	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-58.2	-43.3	176.2	0	0	0	0	0	114	R197 A541 D542 V543 S547 M548	R197-G545 VanDerWaalsContact O-CA 3.26Å; R197-G545 WeakPolarHBondContact O-CA 3.27Å; A541-G545 WeakPolarHBondContact O-CA 3.42Å; A541-G545 PolarHBondContact O-N 2.77Å; D542-G545 PolarHBondContact O-N 3.13Å; V543-G545 VanDerWaalsContact C-N 3.33Å; V543-G545 PolarHBondContact O-N 3.07Å; G545-S547 VanDerWaalsContact C-N 3.27Å; G545-S547 PolarHBondContact O-N 2.83Å; G545-M548 PolarHBondContact O-N 2.81Å
546	R	93.6	Very high	92.4	Very high	205 Å²	205	44.4 Å²	44.4	77%	0.774	23%	0.229	S	C	*	.	H	α-helix	trans	-68.7	-23.3	175.9	-72.4	175.9	-166.1	-179.1	6.7	113.6	D542 V543 I544 M548	D542-R546 WeakPolarHBondContact O-CB 3.45Å; D542-R546 VanDerWaalsContact O-CG 3.27Å; D542-R546 WeakPolarHBondContact O-CG 3.45Å; D542-R546 PolarHBondContact O-N 3.12Å; V543-R546 PolarHBondContact O-N 3.32Å; I544-R546 PolarHBondContact O-N 2.78Å; R546-M548 VanDerWaalsContact C-N 3.25Å; R546-M548 PolarHBondContact O-N 2.95Å
547	S	94.1	Very high	92.5	Very high	44 Å²	44	43.9 Å²	43.9	31%	0.308	23%	0.225	S	C	.	.	H	α-helix	trans	-72.8	-19.8	176	79.6	0	0	0	0	113	V543 I544 G545 N549	V543-S547 PolarHBondContact O-N 2.86Å; I544-S547 WeakPolarHBondContact O-CB 3.43Å; I544-S547 PolarHBondContact O-N 2.86Å; I544-S547 VanDerWaalsContact O-N 3.11Å; I544-S547 PolarHBondContact O-OG 2.96Å; G545-S547 VanDerWaalsContact C-N 3.27Å; G545-S547 PolarHBondContact O-N 2.83Å; S547-N549 PolarHBondContact O-N 3.35Å
548	M	93.6	Very high	92.7	Very high	10 Å²	10	47.5 Å²	47.5	5%	0.049	24%	0.237	C	C	.	.			trans	-85.2	93.3	179.7	-60	-174	-173.9	0	0	110.4	L187 A196 V198 E237 T238 L241 I544 G545 R546	L187-M548 HydrophobicContact CD2-CE 4.01Å; A196-M548 HydrophobicContact CB-CE 3.86Å; V198-M548 HydrophobicContact CG1-CB 4.35Å; V198-M548 HydrophobicContact CG2-CB 3.92Å; V198-M548 HydrophobicContact CG2-CG 4.14Å; V198-M548 HydrophobicContact CG2-SD 3.32Å; V198-M548 WeakPolarHBondContact CG2-SD 3.37Å; E237-M548 WeakPolarHBondContact O-CA 3.42Å; T238-M548 HydrophobicContact CG2-CE 3.87Å; T238-M548 HydrophobicContact CG2-CG 4.17Å; T238-M548 HydrophobicContact CG2-SD 3.76Å; L241-M548 HydrophobicContact CD1-CE 3.39Å; L241-M548 HydrophobicContact CG-CE 3.87Å; I544-M548 HydrophobicContact CG2-CE 3.94Å; G545-M548 PolarHBondContact O-N 2.81Å; R546-M548 VanDerWaalsContact C-N 3.25Å; R546-M548 PolarHBondContact O-N 2.95Å
549	N	83.9	Confident	92.7	Very high	81 Å²	81	43 Å²	43	43%	0.433	22%	0.217	S	C	.	.			trans	-81.5	141.3	172.6	55.2	-46.8	0	0	0	111	E237 S547 A551	E237-N549 PolarHBondContact N-O 3.35Å; E237-N549 VanDerWaalsContact N-O 3.13Å; S547-N549 PolarHBondContact O-N 3.35Å; N549-A551 PolarHBondContact O-N 2.76Å; N549-A551 VanDerWaalsContact O-N 3.16Å
550	Q	84.3	Confident	92.2	Very high	97 Å²	97	41.4 Å²	41.4	45%	0.453	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	110.5	167	-175.7	-172.9	-51.3	0	0	108.8	F234	F234-Q550 HydrophobicContact CD1-CG 3.92Å
551	A	81.5	Confident	91.6	Very high	44 Å²	44	43.1 Å²	43.1	36%	0.364	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-37	-179.3	0	0	0	0	0	111.9	Q235 N549 I607	Q235-A551 PolarHBondContact O-N 3.02Å; Q235-A551 VanDerWaalsContact O-N 3.09Å; N549-A551 PolarHBondContact O-N 2.76Å; N549-A551 VanDerWaalsContact O-N 3.16Å; A551-I607 HydrophobicContact CB-CD1 3.76Å; A551-I607 HydrophobicContact CB-CG1 4.45Å; A551-I607 HydrophobicContact CB-CG2 4.04Å
552	I	92.3	Very high	90.4	Very high	21 Å²	21	44.7 Å²	44.7	11%	0.108	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	140.8	-172.1	-65.5	139.1	0	0	0	110.3	F234 Q235 I554 R603 I607	F234-I552 WeakPolarHBondContact CA-O 3.35Å; Q235-I552 HydrophobicContact CB-CB 4.04Å; Q235-I552 HydrophobicContact CB-CD1 3.86Å; Q235-I552 HydrophobicContact CG-CD1 4.27Å; Q235-I552 PolarHBondContact N-O 2.98Å; Q235-I552 VanDerWaalsContact N-O 3.12Å; Q235-I552 PolarHBondContact O-N 2.8Å; Q235-I552 VanDerWaalsContact O-N 3.16Å; I552-I554 HydrophobicContact CG2-CD1 4.11Å; I552-I554 HydrophobicContact CG2-CG1 3.8Å; I552-R603 VanDerWaalsContact CD1-CZ 3.49Å; I552-I607 HydrophobicContact CD1-CG1 4.23Å; I552-I607 HydrophobicContact CD1-CG2 3.88Å
553	C	94.8	Very high	88.9	Confident	58 Å²	58	46.6 Å²	46.6	39%	0.392	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.5	167.6	178.1	0	0	0	0	108.8	Y233 F234	Y233-C553 CarbonylContact O-C 3.5Å; Y233-C553 WeakPolarHBondContact O-CA 3.34Å; F234-C553 HydrophobicContact CD1-CB 3.88Å; F234-C553 HydrophobicContact CE1-CB 3.77Å; F234-C553 WeakPolarHBondContact CE1-SG 3.31Å
554	I	96.3	Very high	87.4	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	105.9	176.4	-51.1	176.4	0	0	0	107.5	Y233 I552 L556 L601 Y695 L699	Y233-I554 HydrophobicContact CD1-CB 4.26Å; Y233-I554 HydrophobicContact CD1-CD1 3.85Å; Y233-I554 HydrophobicContact CD1-CG1 4.1Å; Y233-I554 HydrophobicContact CE1-CD1 4.26Å; Y233-I554 PolarHBondContact N-O 3.11Å; Y233-I554 PolarHBondContact O-N 2.82Å; I552-I554 HydrophobicContact CG2-CD1 4.11Å; I552-I554 HydrophobicContact CG2-CG1 3.8Å; I554-L556 HydrophobicContact CG2-CD2 4.26Å; I554-L556 PolarHBondContact O-N 3.46Å; I554-L601 HydrophobicContact CD1-CD1 4.49Å; I554-L601 HydrophobicContact CD1-CD2 4.14Å; I554-Y695 HydrophobicContact CD1-CD1 4.04Å; I554-Y695 HydrophobicContact CD1-CG 4.41Å; I554-Y695 HydrophobicContact CG2-CD1 4.24Å; I554-L699 HydrophobicContact CG2-CD1 4.22Å; I554-L699 HydrophobicContact CG2-CG 4.35Å
555	P	96	Very high	85.1	Confident	19 Å²	19	56 Å²	56	12%	0.123	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	125.6	174	29	-31.4	0	0	0	109.2	R698 L699	P555-R698 HydrophobicContact CB-CB 4.41Å; P555-R698 HydrophobicContact CB-CG 4.08Å; P555-R698 HydrophobicContact CG-CB 4.43Å; P555-R698 WeakPolarHBondContact O-CA 3.46Å; P555-L699 PolarHBondContact O-N 2.76Å
556	L	96.1	Very high	83.3	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-62.6	-172.4	-54	178.8	0	0	0	111.1	V231 I554 L586 F588 L699 D700	V231-L556 HydrophobicContact CG1-CD1 4.06Å; V231-L556 WeakPolarHBondContact O-CB 3.27Å; V231-L556 PolarHBondContact O-N 3.42Å; I554-L556 HydrophobicContact CG2-CD2 4.26Å; I554-L556 PolarHBondContact O-N 3.46Å; L556-L586 HydrophobicContact CD1-CD2 3.74Å; L556-L586 HydrophobicContact CD2-CD2 4.14Å; L556-F588 HydrophobicContact CB-CD2 4.33Å; L556-F588 HydrophobicContact CB-CE2 4.26Å; L556-F588 HydrophobicContact CD1-CD2 4.38Å; L556-F588 HydrophobicContact CD1-CG 4.4Å; L556-F588 HydrophobicContact CD2-CE2 4.45Å; L556-F588 HydrophobicContact CD2-CZ 4.43Å; L556-L699 HydrophobicContact CD2-CD1 3.87Å; L556-L699 WeakPolarHBondContact O-CA 3.32Å; L556-L699 WeakPolarHBondContact O-CB 3.35Å; L556-L699 PolarHBondContact O-N 2.81Å; L556-L699 VanDerWaalsContact O-N 3.09Å; L556-D700 PolarHBondContact O-N 2.79Å; L556-D700 VanDerWaalsContact O-N 3.12Å
557	Y	94.8	Very high	81.9	Confident	3 Å²	3	56.7 Å²	56.7	1%	0.012	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	159.3	-177.8	58.4	-93.3	0	0	0	111.1	E230 V231 F588 D700	E230-Y557 WeakPolarHBondContact CA-O 3.34Å; V231-Y557 HydrophobicContact CB-CE1 4.09Å; V231-Y557 HydrophobicContact CB-CE2 4.07Å; V231-Y557 HydrophobicContact CG1-CE1 4.41Å; V231-Y557 HydrophobicContact CG2-CD2 4.42Å; V231-Y557 HydrophobicContact CG2-CE1 4.41Å; V231-Y557 HydrophobicContact CG2-CE2 3.66Å; V231-Y557 PolarHBondContact N-O 3.47Å; V231-Y557 PolarHBondContact O-N 2.73Å; Y557-F588 HydrophobicContact CD1-CD2 4.1Å; Y557-F588 HydrophobicContact CE1-CD2 4.17Å; Y557-D700 WeakPolarHBondContact CA-OD2 3.35Å
558	R	93.7	Very high	80.5	Confident	90 Å²	90	58.1 Å²	58.1	34%	0.34	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	119.2	170.1	-176.8	-174.1	-64.7	165.4	0.2	109.5	E228 A229 E230 D700	E228-R558 HydrophobicContact CB-CG 3.87Å; E228-R558 WeakPolarHBondContact OE2-CD 3.34Å; E228-R558 WeakPolarHBondContact OE2-CG 3.4Å; A229-R558 WeakPolarHBondContact O-CA 3.25Å; E230-R558 HydrophobicContact CB-CB 4.16Å; E230-R558 HydrophobicContact CB-CG 4.13Å; E230-R558 HydrophobicContact CG-CB 4.4Å; E230-R558 IonicContact OE1-NH2 2.78Å; E230-R558 IonicContact OE2-CZ 3.16Å; E230-R558 IonicContact OE2-NE 3.67Å; E230-R558 PolarHBondContact OE2-NE 3.13Å; E230-R558 IonicContact OE2-NH2 2.94Å; E230-R558 PolarHBondContact OE2-NH2 3.05Å; R558-D700 PolarHBondContact N-OD2 3.01Å
559	D	89.2	Confident	79.5	Confident	23 Å²	23	57.9 Å²	57.9	12%	0.123	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	-179.5	175.6	60.9	37.6	0	0	0	112.6	A229 R561	A229-D559 PolarHBondContact N-O 2.85Å; A229-D559 PolarHBondContact O-N 3.29Å; D559-R561 VanDerWaalsContact CG-NE 3.27Å; D559-R561 VanDerWaalsContact OD1-CB 3.28Å; D559-R561 WeakPolarHBondContact OD1-CB 3.29Å; D559-R561 WeakPolarHBondContact OD1-CG 3.39Å; D559-R561 PolarHBondContact OD1-N 3.46Å; D559-R561 IonicContact OD1-NE 3.43Å; D559-R561 PolarHBondContact OD1-NE 2.62Å; D559-R561 IonicContact OD2-CZ 2.84Å; D559-R561 IonicContact OD2-NE 3.49Å; D559-R561 PolarHBondContact OD2-NE 2.67Å; D559-R561 IonicContact OD2-NH2 2.68Å; D559-R561 PolarHBondContact OD2-NH2 2.92Å
560	A	84.5	Confident	78.8	Confident	52 Å²	52	56.8 Å²	56.8	43%	0.43	31%	0.313	S	S	.	.	S	Bend	trans	-90.9	9.5	-179.1	0	0	0	0	0	113.7	S562 M563	A560-S562 PolarHBondContact O-N 2.81Å; A560-S562 VanDerWaalsContact O-N 3.14Å; A560-M563 WeakPolarHBondContact O-CB 3.07Å; A560-M563 PolarHBondContact O-N 2.88Å
561	R	82.2	Confident	78.5	Confident	37 Å²	37	53 Å²	53	14%	0.14	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-63.9	-25.1	-172.7	83	-179.6	64.9	178.6	4.3	113.5	D559 M563 T589 Y596	D559-R561 VanDerWaalsContact CG-NE 3.27Å; D559-R561 VanDerWaalsContact OD1-CB 3.28Å; D559-R561 WeakPolarHBondContact OD1-CB 3.29Å; D559-R561 WeakPolarHBondContact OD1-CG 3.39Å; D559-R561 PolarHBondContact OD1-N 3.46Å; D559-R561 IonicContact OD1-NE 3.43Å; D559-R561 PolarHBondContact OD1-NE 2.62Å; D559-R561 IonicContact OD2-CZ 2.84Å; D559-R561 IonicContact OD2-NE 3.49Å; D559-R561 PolarHBondContact OD2-NE 2.67Å; D559-R561 IonicContact OD2-NH2 2.68Å; D559-R561 PolarHBondContact OD2-NH2 2.92Å; R561-M563 VanDerWaalsContact C-N 3.29Å; R561-T589 PolarHBondContact NH1-O 2.8Å; R561-T589 PolarHBondContact NH1-OG1 3.19Å; R561-T589 PolarHBondContact NH2-O 2.84Å; R561-T589 VanDerWaalsContact NH2-O 3.09Å; R561-Y596 VanDerWaalsContact CZ-CE1 3.48Å
562	S	68.4	Low	78.9	Confident	33 Å²	33	52 Å²	52	23%	0.231	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-79.9	-11.1	178	57.7	0	0	0	0	113.4	E222 A229 A560	E222-S562 VanDerWaalsContact OE1-CB 3.23Å; E222-S562 WeakPolarHBondContact OE1-CB 3.28Å; A229-S562 WeakPolarHBondContact CB-OG 3.26Å; A560-S562 PolarHBondContact O-N 2.81Å; A560-S562 VanDerWaalsContact O-N 3.14Å
563	M	62.4	Low	79	Confident	107 Å²	107	51.1 Å²	51.1	53%	0.527	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-89.2	-8.3	178.9	-63.2	-63.2	-165.2	0	0	113.2	A560 R561 S565	A560-M563 WeakPolarHBondContact O-CB 3.07Å; A560-M563 PolarHBondContact O-N 2.88Å; R561-M563 VanDerWaalsContact C-N 3.29Å; M563-S565 PolarHBondContact O-N 3.47Å
564	D	63.5	Low	79.1	Confident	114 Å²	114	50 Å²	50	61%	0.61	27%	0.267	S	S	*	.	S	Bend	trans	-58.8	125.4	174.7	-82.6	-20.7	0	0	0	109.7	A566	D564-A566 PolarHBondContact O-N 2.92Å
565	S	47.7	Very low	79.1	Confident	133 Å²	133	50.6 Å²	50.6	93%	0.93	27%	0.27	S	S	*	.	S	Bend	trans	-64	0.5	-173.6	43.8	0	0	0	0	115.3	M563	M563-S565 PolarHBondContact O-N 3.47Å
566	A	57.5	Low	79.2	Confident	75 Å²	75	53.1 Å²	53.1	62%	0.62	28%	0.277	S	S	*	.	S	Bend	trans	-78.5	130.1	172.1	0	0	0	0	0	109.5	D564 R568	D564-A566 PolarHBondContact O-N 2.92Å; A566-R568 PolarHBondContact O-N 2.65Å
567	R	62.5	Low	79.2	Confident	148 Å²	148	53.7 Å²	53.7	56%	0.558	28%	0.28	S	S	*	.			trans	-53.6	113.7	176	-81.1	178	169.4	157.8	-8.9	110.2	E22 L744	E22-R567 IonicContact OE2-NH1 2.67Å; E22-R567 PolarHBondContact OE2-NH1 2.72Å; R567-L744 HydrophobicContact CB-CD1 3.98Å
568	R	65.6	Low	79.2	Confident	75 Å²	75	53.9 Å²	53.9	28%	0.283	28%	0.281	S	S	.	.			trans	-79.7	121.8	176.8	-175.8	177	176.1	-170.4	1.6	109.3	E222 A566 L570 F572	E222-R568 IonicContact OE1-NH1 2.78Å; E222-R568 PolarHBondContact OE1-NH1 3.5Å; E222-R568 IonicContact OE2-NH1 2.94Å; A566-R568 PolarHBondContact O-N 2.65Å; R568-L570 PolarHBondContact O-N 3.05Å; R568-F572 PolarHBondContact NH2-O 3.06Å
569	L	72.5	Confident	79.1	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.026	29%	0.286	C	S	.	.			trans	-68.3	125.9	160.9	-84.8	118	0	0	0	108.1	V24 L26 K571 Y727 L740 L744	V24-L569 WeakPolarHBondContact O-CD2 3.44Å; V24-L569 WeakPolarHBondContact O-CG 3.23Å; L26-L569 HydrophobicContact CD2-CD2 4.39Å; L569-K571 PolarHBondContact O-N 2.86Å; L569-Y727 HydrophobicContact CB-CD1 4.25Å; L569-Y727 HydrophobicContact CB-CE1 3.97Å; L569-Y727 HydrophobicContact CD1-CD1 4.32Å; L569-Y727 HydrophobicContact CD1-CD2 3.48Å; L569-Y727 VanDerWaalsContact CD1-CD2 3.48Å; L569-Y727 HydrophobicContact CD1-CE1 4.2Å; L569-Y727 HydrophobicContact CD1-CE2 3.34Å; L569-Y727 HydrophobicContact CD1-CG 3.96Å; L569-L740 HydrophobicContact CD1-CD2 3.72Å; L569-L744 HydrophobicContact CD1-CD2 3.65Å
570	L	69.2	Low	79.1	Confident	58 Å²	58	58.7 Å²	58.7	30%	0.304	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	49	174.6	-63	172.1	0	0	0	111.4	S111 L206 R568	S111-L570 WeakPolarHBondContact O-CD1 3.07Å; L206-L570 HydrophobicContact CD2-CD2 3.65Å; R568-L570 PolarHBondContact O-N 3.05Å
571	K	77.9	Confident	79.4	Confident	18 Å²	18	58.4 Å²	58.4	8%	0.078	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-22.6	178.1	-90.3	-163.7	155.7	-146	0	113.8	F25 L26 L569 V728 A729	F25-K571 HydrophobicContact CE2-CG 4.31Å; L26-K571 WeakPolarHBondContact O-CE 3.33Å; L26-K571 PolarHBondContact O-NZ 3.42Å; L569-K571 PolarHBondContact O-N 2.86Å; K571-V728 PolarHBondContact NZ-O 3.05Å; K571-A729 VanDerWaalsContact NZ-CB 3.3Å
572	F	89.3	Confident	80	Confident	23 Å²	23	59.3 Å²	59.3	10%	0.101	32%	0.316	C	S	.	.			trans	-134.9	132.3	-173	-162	-100.5	0	0	0	111.2	R568 F574 L587 T589 D646 A647	R568-F572 PolarHBondContact NH2-O 3.06Å; F572-F574 HydrophobicContact CD2-CB 4.37Å; F572-L587 HydrophobicContact CE2-CB 4Å; F572-T589 HydrophobicContact CE1-CG2 3.74Å; F572-T589 HydrophobicContact CZ-CG2 3.84Å; F572-D646 WeakPolarHBondContact CD2-OD1 3.42Å; F572-A647 HydrophobicContact CE2-CB 4.03Å
573	P	94.6	Very high	81.4	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.013	31%	0.308	C	S	.	.	S	Bend	cis	-60.2	155.1	2.6	-25.3	36.7	0	0	0	115.4	V220 V231 L586 L587 F588	V220-P573 HydrophobicContact CG1-CB 4.48Å; V220-P573 HydrophobicContact CG1-CG 4.42Å; V231-P573 HydrophobicContact CG1-CG 4.3Å; P573-L586 HydrophobicContact CB-CD1 3.96Å; P573-L587 WeakPolarHBondContact CA-O 3.49Å; P573-L587 WeakPolarHBondContact CB-O 3.36Å; P573-F588 HydrophobicContact CB-CB 3.99Å; P573-F588 HydrophobicContact CG-CB 4.12Å
574	F	96.6	Very high	83	Confident	35 Å²	35	53.4 Å²	53.4	15%	0.154	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	130.1	-173.2	-176.9	-96	0	0	0	111.9	F572 W576 L586 L587 Q648 F649	F572-F574 HydrophobicContact CD2-CB 4.37Å; F574-W576 HydrophobicContact CE1-CB 4.05Å; F574-W576 HydrophobicContact CE1-CE3 4.1Å; F574-W576 HydrophobicContact CZ-CE3 4.19Å; F574-L586 WeakPolarHBondContact O-CA 3.37Å; F574-L587 HydrophobicContact CB-CB 4.38Å; F574-L587 HydrophobicContact CD1-CD1 4.24Å; F574-L587 PolarHBondContact N-O 2.78Å; F574-L587 PolarHBondContact O-N 3.09Å; F574-Q648 HydrophobicContact CD1-CG 4.21Å; F574-Q648 HydrophobicContact CD2-CG 4.03Å; F574-Q648 HydrophobicContact CE1-CG 3.88Å; F574-Q648 HydrophobicContact CE2-CG 3.7Å; F574-Q648 HydrophobicContact CG-CG 4.27Å; F574-Q648 HydrophobicContact CZ-CG 3.63Å; F574-F649 AromaticContact CD1-CD2 3.98Å; F574-F649 HydrophobicContact CD1-CD2 3.98Å; F574-F649 HydrophobicContact CE1-CB 3.97Å; F574-F649 AromaticContact CE1-CD2 3.89Å; F574-F649 HydrophobicContact CE1-CD2 3.89Å; F574-F649 HydrophobicContact CE1-CG 4.36Å
575	L	97.6	Very high	84.7	Confident	12 Å²	12	48.6 Å²	48.6	6%	0.063	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	143.5	175.1	-75	172.2	0	0	0	111.5	A207 C209 V220 Y233 Y585 L586	A207-L575 HydrophobicContact CB-CB 4.33Å; A207-L575 HydrophobicContact CB-CD1 3.86Å; A207-L575 HydrophobicContact CB-CG 3.98Å; C209-L575 HydrophobicContact CB-CB 3.62Å; C209-L575 HydrophobicContact CB-CD1 4.05Å; C209-L575 HydrophobicContact CB-CG 4.41Å; V220-L575 HydrophobicContact CG2-CD1 4.02Å; V220-L575 HydrophobicContact CG2-CD2 4.22Å; V220-L575 HydrophobicContact CG2-CG 4.03Å; Y233-L575 HydrophobicContact CD2-CD2 4.31Å; Y233-L575 HydrophobicContact CE2-CD2 4.01Å; L575-Y585 CarbonylContact C-O 3.55Å; L575-Y585 WeakPolarHBondContact CA-O 3.34Å; L575-L586 HydrophobicContact CD2-CB 3.87Å; L575-L586 HydrophobicContact CD2-CD1 3.76Å; L575-L586 HydrophobicContact CD2-CG 4.35Å; L575-L586 HydrophobicContact CG-CD1 4.18Å
576	W	96.9	Very high	87.1	Confident	73 Å²	73	42.3 Å²	42.3	28%	0.277	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	137.8	176.1	-178.4	-102.1	0	0	0	111.1	F574 Y585 F649 D652	F574-W576 HydrophobicContact CE1-CB 4.05Å; F574-W576 HydrophobicContact CE1-CE3 4.1Å; F574-W576 HydrophobicContact CZ-CE3 4.19Å; W576-Y585 PolarHBondContact N-O 3.14Å; W576-Y585 PolarHBondContact O-N 2.84Å; W576-F649 HydrophobicContact CB-CB 4.32Å; W576-F649 HydrophobicContact CB-CD1 4.15Å; W576-F649 HydrophobicContact CB-CD2 3.4Å; W576-F649 VanDerWaalsContact CB-CD2 3.4Å; W576-F649 HydrophobicContact CB-CE1 4.38Å; W576-F649 HydrophobicContact CB-CE2 3.66Å; W576-F649 HydrophobicContact CB-CG 3.69Å; W576-F649 HydrophobicContact CB-CZ 4.18Å; W576-F649 AromaticContact CD1-CD1 3.42Å; W576-F649 VanDerWaalsContact CD1-CD1 3.42Å; W576-F649 AromaticContact CD1-CE1 3.6Å; W576-F649 AromaticContact CD1-CG 3.81Å; W576-F649 HydrophobicContact CD2-CB 3.68Å; W576-F649 HydrophobicContact CD2-CD1 4.03Å; W576-F649 HydrophobicContact CD2-CD2 4.42Å; W576-F649 AromaticContact CD2-CG 3.79Å; W576-F649 HydrophobicContact CD2-CG 3.79Å; W576-F649 HydrophobicContact CE3-CB 3.78Å; W576-F649 HydrophobicContact CE3-CG 4.34Å; W576-F649 HydrophobicContact CG-CB 3.94Å; W576-F649 AromaticContact CG-CD1 3.62Å; W576-F649 HydrophobicContact CG-CD1 3.62Å; W576-F649 AromaticContact CG-CD2 3.77Å; W576-F649 HydrophobicContact CG-CD2 3.77Å; W576-F649 HydrophobicContact CG-CE1 4.06Å; W576-F649 HydrophobicContact CG-CE2 4.19Å; W576-F649 AromaticContact CG-CG 3.48Å; W576-F649 HydrophobicContact CG-CG 3.48Å; W576-F649 VanDerWaalsContact CG-CG 3.48Å; W576-F649 HydrophobicContact CG-CZ 4.35Å; W576-F649 HydrophobicContact CZ3-CB 4.31Å; W576-F649 AromaticContact NE1-CD1 3.73Å; W576-D652 PolarHBondContact NE1-OD1 2.77Å
577	N	96.8	Very high	89	Confident	11 Å²	11	38.7 Å²	38.7	6%	0.059	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	110.1	168.4	175.3	-120.3	0	0	0	109.1	C209 S212 K579 L583	C209-N577 WeakPolarHBondContact SG-CB 3.36Å; C209-N577 PolarHBondContact SG-N 3.28Å; C209-N577 VanDerWaalsContact SG-N 3.39Å; S212-N577 PolarHBondContact N-OD1 3.2Å; S212-N577 PolarHBondContact OG-OD1 3.41Å; N577-K579 PolarHBondContact O-N 3.39Å; N577-L583 PolarHBondContact ND2-O 3.26Å
578	N	95.1	Very high	90.6	Very high	8 Å²	8	31.7 Å²	31.7	4%	0.043	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	108.5	171.4	178.9	-47.7	0	0	0	107.9	T580 S581 N582 L583 Y585 D652	N578-T580 VanDerWaalsContact C-N 3.33Å; N578-T580 PolarHBondContact O-N 3.39Å; N578-T580 PolarHBondContact OD1-N 2.89Å; N578-T580 PolarHBondContact OD1-OG1 3.22Å; N578-S581 PolarHBondContact ND2-OG 2.83Å; N578-S581 PolarHBondContact OD1-N 3.09Å; N578-S581 PolarHBondContact OD1-OG 2.87Å; N578-N582 WeakPolarHBondContact O-CA 3.31Å; N578-N582 PolarHBondContact O-N 3.43Å; N578-L583 PolarHBondContact N-O 3Å; N578-L583 PolarHBondContact O-N 3.11Å; N578-Y585 HydrophobicContact CB-CD2 3.92Å; N578-Y585 HydrophobicContact CB-CE2 3.78Å; N578-D652 WeakPolarHBondContact ND2-CB 3.45Å; N578-D652 PolarHBondContact ND2-O 3.42Å; N578-D652 VanDerWaalsContact ND2-O 3.13Å
579	K	90.4	Very high	92.1	Very high	101 Å²	101	28.3 Å²	28.3	44%	0.439	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-24.8	-170.9	-54.9	-177.1	-175.6	179.8	0	112.8	T119 N577	T119-K579 HydrophobicContact CG2-CD 4.04Å; N577-K579 PolarHBondContact O-N 3.39Å
580	T	90.1	Very high	93.1	Very high	112 Å²	112	28.3 Å²	28.3	69%	0.687	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-40.3	-177.2	53.4	0	0	0	0	111.5	N578 D652	N578-T580 VanDerWaalsContact C-N 3.33Å; N578-T580 PolarHBondContact O-N 3.39Å; N578-T580 PolarHBondContact OD1-N 2.89Å; N578-T580 PolarHBondContact OD1-OG1 3.22Å; T580-D652 PolarHBondContact OG1-OD2 3.1Å
581	S	91.8	Very high	94.1	Very high	46 Å²	46	29.3 Å²	29.3	32%	0.322	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-5.4	179.8	61.1	0	0	0	0	114.5	N578	N578-S581 PolarHBondContact ND2-OG 2.83Å; N578-S581 PolarHBondContact OD1-N 3.09Å; N578-S581 PolarHBondContact OD1-OG 2.87Å
582	N	94.5	Very high	94.5	Very high	57 Å²	57	31.3 Å²	31.3	31%	0.305	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	49.8	-175.4	-61.5	-49.7	0	0	0	112.5	N578 T605	N578-N582 WeakPolarHBondContact O-CA 3.31Å; N578-N582 PolarHBondContact O-N 3.43Å; N582-T605 VanDerWaalsContact C-CG2 3.48Å; N582-T605 HydrophobicContact CB-CG2 4.36Å; N582-T605 VanDerWaalsContact O-CG2 3.29Å; N582-T605 WeakPolarHBondContact O-CG2 3.41Å; N582-T605 PolarHBondContact O-N 2.88Å; N582-T605 PolarHBondContact O-OG1 3.19Å
583	L	96.2	Very high	94.2	Very high	14 Å²	14	37.4 Å²	37.4	7%	0.073	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140.7	179	-61.1	179.4	0	0	0	111.1	N577 N578 Y585 R603 H604 V611	N577-L583 PolarHBondContact ND2-O 3.26Å; N578-L583 PolarHBondContact N-O 3Å; N578-L583 PolarHBondContact O-N 3.11Å; L583-Y585 HydrophobicContact CB-CD2 4.09Å; L583-Y585 HydrophobicContact CB-CE2 3.66Å; L583-Y585 HydrophobicContact CD1-CE2 3.98Å; L583-Y585 WeakPolarHBondContact CD1-OH 3.48Å; L583-Y585 HydrophobicContact CG-CE2 4.46Å; L583-R603 CarbonylContact C-O 3.6Å; L583-R603 WeakPolarHBondContact CA-O 3.41Å; L583-H604 HydrophobicContact CD2-CB 4.3Å; L583-V611 HydrophobicContact CD2-CG1 4.35Å; L583-V611 HydrophobicContact CD2-CG2 3.47Å; L583-V611 VanDerWaalsContact CD2-CG2 3.47Å
584	H	97.6	Very high	93.7	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.009	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	126.7	161.2	-71.9	-63.1	0	0	0	108.8	C209 S216 S218 R602 R603	C209-H584 PolarHBondContact O-CE1 2.88Å; S216-H584 PolarHBondContact O-NE2 3.39Å; S216-H584 PolarHBondContact OG-CD2 3.2Å; S216-H584 PolarHBondContact OG-NE2 3.43Å; S218-H584 PolarHBondContact OG-ND1 2.86Å; H584-R602 CarbonylContact O-C 3.58Å; H584-R602 WeakPolarHBondContact O-CA 3.39Å; H584-R603 PolarHBondContact N-O 3.25Å; H584-R603 PolarHBondContact O-N 3.35Å
585	Y	97.9	Very high	93.4	Very high	12 Å²	12	42.4 Å²	42.4	5%	0.047	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	140.6	171.3	-75.7	-90.1	0	0	0	110	L575 W576 N578 L583 I600 L601 R602 F649 Y681	L575-Y585 CarbonylContact C-O 3.55Å; L575-Y585 WeakPolarHBondContact CA-O 3.34Å; W576-Y585 PolarHBondContact N-O 3.14Å; W576-Y585 PolarHBondContact O-N 2.84Å; N578-Y585 HydrophobicContact CB-CD2 3.92Å; N578-Y585 HydrophobicContact CB-CE2 3.78Å; L583-Y585 HydrophobicContact CB-CD2 4.09Å; L583-Y585 HydrophobicContact CB-CE2 3.66Å; L583-Y585 HydrophobicContact CD1-CE2 3.98Å; L583-Y585 WeakPolarHBondContact CD1-OH 3.48Å; L583-Y585 HydrophobicContact CG-CE2 4.46Å; Y585-I600 HydrophobicContact CD1-CG2 3.91Å; Y585-I600 HydrophobicContact CE1-CG2 4.47Å; Y585-L601 CarbonylContact C-O 3.46Å; Y585-L601 WeakPolarHBondContact CA-O 3.4Å; Y585-R602 HydrophobicContact CD1-CB 3.63Å; Y585-R602 HydrophobicContact CE1-CB 3.55Å; Y585-R602 HydrophobicContact CE1-CG 4.21Å; Y585-R602 HydrophobicContact CG-CB 4.25Å; Y585-R602 PolarHBondContact OH-NH1 3.49Å; Y585-F649 AromaticContact CD1-CZ 3.89Å; Y585-F649 HydrophobicContact CD1-CZ 3.89Å; Y585-F649 HydrophobicContact CD2-CE1 4.41Å; Y585-F649 HydrophobicContact CD2-CZ 4.15Å; Y585-F649 HydrophobicContact CG-CE1 4.22Å; Y585-F649 HydrophobicContact CG-CE2 4.35Å; Y585-F649 AromaticContact CG-CZ 3.54Å; Y585-F649 HydrophobicContact CG-CZ 3.54Å; Y585-Y681 AromaticContact CE1-CE2 3.87Å; Y585-Y681 HydrophobicContact CE1-CE2 3.87Å
586	L	98.3	Very high	93.2	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124	174.5	169.5	67.3	0	0	0	108.7	V220 Y233 L556 P573 F574 L575 F588 I600 L601	V220-L586 HydrophobicContact CG2-CD1 3.7Å; V220-L586 HydrophobicContact CG2-CD2 4.45Å; Y233-L586 HydrophobicContact CD2-CD2 3.9Å; Y233-L586 HydrophobicContact CG-CD2 4.32Å; L556-L586 HydrophobicContact CD1-CD2 3.74Å; L556-L586 HydrophobicContact CD2-CD2 4.14Å; P573-L586 HydrophobicContact CB-CD1 3.96Å; F574-L586 WeakPolarHBondContact O-CA 3.37Å; L575-L586 HydrophobicContact CD2-CB 3.87Å; L575-L586 HydrophobicContact CD2-CD1 3.76Å; L575-L586 HydrophobicContact CD2-CG 4.35Å; L575-L586 HydrophobicContact CG-CD1 4.18Å; L586-F588 HydrophobicContact CD2-CD1 4.1Å; L586-F588 HydrophobicContact CG-CD1 4.03Å; L586-I600 WeakPolarHBondContact O-CA 2.91Å; L586-L601 HydrophobicContact CB-CB 4.17Å; L586-L601 HydrophobicContact CB-CD2 4.47Å; L586-L601 HydrophobicContact CD2-CB 4.37Å; L586-L601 HydrophobicContact CD2-CD2 3.89Å; L586-L601 PolarHBondContact N-O 3.25Å; L586-L601 PolarHBondContact O-N 3.13Å
587	L	97.9	Very high	93	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124.9	169.8	-52.1	179.7	0	0	0	108.7	F572 P573 F574 M598 I600 A647 F649 V655	F572-L587 HydrophobicContact CE2-CB 4Å; P573-L587 WeakPolarHBondContact CA-O 3.49Å; P573-L587 WeakPolarHBondContact CB-O 3.36Å; F574-L587 HydrophobicContact CB-CB 4.38Å; F574-L587 HydrophobicContact CD1-CD1 4.24Å; F574-L587 PolarHBondContact N-O 2.78Å; F574-L587 PolarHBondContact O-N 3.09Å; L587-M598 HydrophobicContact CD2-CE 3.86Å; L587-I600 HydrophobicContact CD2-CB 4.47Å; L587-I600 HydrophobicContact CD2-CD1 4.35Å; L587-I600 HydrophobicContact CD2-CG1 3.87Å; L587-I600 HydrophobicContact CD2-CG2 4.16Å; L587-A647 HydrophobicContact CD1-CB 4.01Å; L587-F649 HydrophobicContact CD1-CD2 3.67Å; L587-F649 HydrophobicContact CD1-CE2 3.79Å; L587-F649 HydrophobicContact CD2-CD2 4.46Å; L587-F649 HydrophobicContact CD2-CE2 3.72Å; L587-F649 HydrophobicContact CD2-CZ 4.39Å; L587-F649 HydrophobicContact CG-CD2 4.03Å; L587-F649 HydrophobicContact CG-CE2 3.66Å; L587-V655 HydrophobicContact CD1-CG1 3.52Å; L587-V655 HydrophobicContact CD1-CG2 4.41Å; L587-V655 HydrophobicContact CD2-CG1 4.43Å; L587-V655 HydrophobicContact CD2-CG2 4.45Å
588	F	96.8	Very high	93	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	168	176.7	71.5	-73	0	0	0	110.2	L556 Y557 P573 L586 I590 C599 L601 L615 L699	L556-F588 HydrophobicContact CB-CD2 4.33Å; L556-F588 HydrophobicContact CB-CE2 4.26Å; L556-F588 HydrophobicContact CD1-CD2 4.38Å; L556-F588 HydrophobicContact CD1-CG 4.4Å; L556-F588 HydrophobicContact CD2-CE2 4.45Å; L556-F588 HydrophobicContact CD2-CZ 4.43Å; Y557-F588 HydrophobicContact CD1-CD2 4.1Å; Y557-F588 HydrophobicContact CE1-CD2 4.17Å; P573-F588 HydrophobicContact CB-CB 3.99Å; P573-F588 HydrophobicContact CG-CB 4.12Å; L586-F588 HydrophobicContact CD2-CD1 4.1Å; L586-F588 HydrophobicContact CG-CD1 4.03Å; F588-I590 HydrophobicContact CD2-CG1 4.02Å; F588-I590 HydrophobicContact CE2-CD1 3.68Å; F588-I590 HydrophobicContact CE2-CG1 3.55Å; F588-I590 HydrophobicContact CZ-CD1 4.25Å; F588-I590 HydrophobicContact CZ-CG1 4.49Å; F588-C599 HydrophobicContact CD1-CB 4.01Å; F588-C599 WeakPolarHBondContact CD1-O 3.44Å; F588-C599 HydrophobicContact CD2-CB 4.41Å; F588-C599 HydrophobicContact CE1-CB 3.49Å; F588-C599 VanDerWaalsContact CE1-CB 3.49Å; F588-C599 HydrophobicContact CE2-CB 3.97Å; F588-C599 HydrophobicContact CG-CB 4.44Å; F588-C599 HydrophobicContact CZ-CB 3.47Å; F588-C599 VanDerWaalsContact CZ-CB 3.47Å; F588-C599 PolarHBondContact N-O 3.03Å; F588-C599 VanDerWaalsContact N-O 3.14Å; F588-C599 PolarHBondContact O-N 2.93Å; F588-C599 VanDerWaalsContact O-O 3.12Å; F588-L601 HydrophobicContact CE1-CB 4.06Å; F588-L615 HydrophobicContact CE1-CD1 3.99Å; F588-L615 HydrophobicContact CZ-CD1 3.93Å; F588-L699 HydrophobicContact CE2-CD1 4.23Å; F588-L699 HydrophobicContact CZ-CD1 3.72Å
589	T	95.3	Very high	93.1	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	142.1	176.2	53	0	0	0	0	111.1	R561 F572 K597 C644	R561-T589 PolarHBondContact NH1-O 2.8Å; R561-T589 PolarHBondContact NH1-OG1 3.19Å; R561-T589 PolarHBondContact NH2-O 2.84Å; R561-T589 VanDerWaalsContact NH2-O 3.09Å; F572-T589 HydrophobicContact CE1-CG2 3.74Å; F572-T589 HydrophobicContact CZ-CG2 3.84Å; T589-K597 CarbonylContact C-O 3.59Å; T589-K597 VanDerWaalsContact CA-O 3.23Å; T589-K597 WeakPolarHBondContact CA-O 3.35Å; T589-C644 HydrophobicContact CG2-CB 3.76Å
590	I	93.5	Very high	93.4	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.8	172.3	-57.2	177.4	0	0	0	107.3	F588 K597 L699 D700 I706	F588-I590 HydrophobicContact CD2-CG1 4.02Å; F588-I590 HydrophobicContact CE2-CD1 3.68Å; F588-I590 HydrophobicContact CE2-CG1 3.55Å; F588-I590 HydrophobicContact CZ-CD1 4.25Å; F588-I590 HydrophobicContact CZ-CG1 4.49Å; I590-K597 PolarHBondContact N-O 2.94Å; I590-K597 PolarHBondContact O-N 2.97Å; I590-L699 HydrophobicContact CD1-CB 4.12Å; I590-D700 HydrophobicContact CG2-CB 3.84Å; I590-I706 HydrophobicContact CD1-CD1 3.53Å
591	L	90.8	Very high	93.8	Very high	80 Å²	80	32.1 Å²	32.1	42%	0.419	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.9	175.1	-175.1	64	0	0	0	108.9	Y596	L591-Y596 HydrophobicContact CB-CD1 4.12Å; L591-Y596 HydrophobicContact CB-CE1 3.93Å; L591-Y596 HydrophobicContact CD1-CD1 3.97Å; L591-Y596 HydrophobicContact CD1-CE1 3.8Å; L591-Y596 HydrophobicContact CD1-CE2 4.38Å; L591-Y596 HydrophobicContact CD1-CG 4.33Å; L591-Y596 HydrophobicContact CG-CE1 4.32Å
592	E	85.9	Confident	94	Very high	59 Å²	59	31.5 Å²	31.5	28%	0.276	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	128.4	177.6	-170.6	173.3	-156.9	0	0	107.6	S594 V595 K597	E592-S594 VanDerWaalsContact C-N 3.26Å; E592-S594 PolarHBondContact O-N 3.38Å; E592-S594 VanDerWaalsContact O-N 3.16Å; E592-V595 PolarHBondContact N-O 2.95Å; E592-V595 PolarHBondContact O-N 2.92Å; E592-K597 WeakPolarHBondContact OE2-CD 3.49Å; E592-K597 IonicContact OE2-NZ 3.3Å; E592-K597 PolarHBondContact OE2-NZ 3.29Å
593	D	83.3	Confident	94	Very high	151 Å²	151	31.5 Å²	31.5	81%	0.807	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	38	-178.2	-60.2	-35.6	0	0	0	115	V595	D593-V595 PolarHBondContact O-N 2.79Å
594	S	85.1	Confident	94	Very high	115 Å²	115	32.1 Å²	32.1	80%	0.804	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.7	16.6	-174.7	-48.4	0	0	0	0	115.3	E592	E592-S594 VanDerWaalsContact C-N 3.26Å; E592-S594 PolarHBondContact O-N 3.38Å; E592-S594 VanDerWaalsContact O-N 3.16Å
595	V	89.4	Confident	93.9	Very high	28 Å²	28	32 Å²	32	17%	0.17	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.2	177.8	-179.8	0	0	0	0	109.4	E592 D593 K597 T641 Y642	E592-V595 PolarHBondContact N-O 2.95Å; E592-V595 PolarHBondContact O-N 2.92Å; D593-V595 PolarHBondContact O-N 2.79Å; V595-K597 PolarHBondContact O-N 3.37Å; V595-T641 HydrophobicContact CG1-CG2 4.17Å; V595-T641 HydrophobicContact CG2-CG2 3.78Å; V595-Y642 VanDerWaalsContact CG1-O 3.27Å; V595-Y642 WeakPolarHBondContact CG1-O 3.47Å
596	Y	92.8	Very high	93.7	Very high	61 Å²	61	33.1 Å²	33.1	24%	0.239	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	104.8	174.5	-68.9	-69.9	0	0	0	110.2	R561 L591 S643 C644	R561-Y596 VanDerWaalsContact CZ-CE1 3.48Å; L591-Y596 HydrophobicContact CB-CD1 4.12Å; L591-Y596 HydrophobicContact CB-CE1 3.93Å; L591-Y596 HydrophobicContact CD1-CD1 3.97Å; L591-Y596 HydrophobicContact CD1-CE1 3.8Å; L591-Y596 HydrophobicContact CD1-CE2 4.38Å; L591-Y596 HydrophobicContact CD1-CG 4.33Å; L591-Y596 HydrophobicContact CG-CE1 4.32Å; Y596-S643 WeakPolarHBondContact CB-OG 3.49Å; Y596-S643 PolarHBondContact N-OG 3.01Å; Y596-C644 VanDerWaalsContact CB-O 3.29Å; Y596-C644 WeakPolarHBondContact CB-O 3.39Å; Y596-C644 WeakPolarHBondContact O-CB 3.43Å; Y596-C644 PolarHBondContact O-N 3.14Å
597	K	94.2	Very high	93.4	Very high	35 Å²	35	35 Å²	35	15%	0.152	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	126.3	175.4	-176.5	-179.9	-179	-176.9	0	109.9	T589 I590 E592 V595 T708	T589-K597 CarbonylContact C-O 3.59Å; T589-K597 VanDerWaalsContact CA-O 3.23Å; T589-K597 WeakPolarHBondContact CA-O 3.35Å; I590-K597 PolarHBondContact N-O 2.94Å; I590-K597 PolarHBondContact O-N 2.97Å; E592-K597 WeakPolarHBondContact OE2-CD 3.49Å; E592-K597 IonicContact OE2-NZ 3.3Å; E592-K597 PolarHBondContact OE2-NZ 3.29Å; V595-K597 PolarHBondContact O-N 3.37Å; K597-T708 WeakPolarHBondContact CE-OG1 3.47Å; K597-T708 PolarHBondContact NZ-OG1 2.83Å
598	M	96.1	Very high	93.1	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	132.9	177.4	-179	-177.7	177.1	0	0	110.4	L587 I600 I618 F620 C644 A647 V655 V657 L675	L587-M598 HydrophobicContact CD2-CE 3.86Å; M598-I600 HydrophobicContact CE-CD1 4.18Å; M598-I600 HydrophobicContact CE-CG1 4.11Å; M598-I618 HydrophobicContact CB-CB 4.33Å; M598-I618 PolarHBondContact O-N 2.88Å; M598-F620 HydrophobicContact CB-CE2 4.42Å; M598-F620 HydrophobicContact SD-CE2 4.46Å; M598-F620 HydrophobicContact SD-CZ 4.11Å; M598-C644 HydrophobicContact CB-CB 4Å; M598-A647 HydrophobicContact CE-CB 3.91Å; M598-A647 HydrophobicContact SD-CB 4.37Å; M598-V655 HydrophobicContact CE-CG1 3.92Å; M598-V657 HydrophobicContact CE-CG2 3.94Å; M598-V657 HydrophobicContact SD-CG1 4.11Å; M598-V657 HydrophobicContact SD-CG2 3.77Å; M598-L675 HydrophobicContact CE-CD2 4.03Å; M598-L675 HydrophobicContact SD-CD2 4.27Å
599	C	96.9	Very high	92.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.8	174.4	-64	0	0	0	0	109.9	F588 L615 I616	F588-C599 HydrophobicContact CD1-CB 4.01Å; F588-C599 WeakPolarHBondContact CD1-O 3.44Å; F588-C599 HydrophobicContact CD2-CB 4.41Å; F588-C599 HydrophobicContact CE1-CB 3.49Å; F588-C599 VanDerWaalsContact CE1-CB 3.49Å; F588-C599 HydrophobicContact CE2-CB 3.97Å; F588-C599 HydrophobicContact CG-CB 4.44Å; F588-C599 HydrophobicContact CZ-CB 3.47Å; F588-C599 VanDerWaalsContact CZ-CB 3.47Å; F588-C599 PolarHBondContact N-O 3.03Å; F588-C599 VanDerWaalsContact N-O 3.14Å; F588-C599 PolarHBondContact O-N 2.93Å; F588-C599 VanDerWaalsContact O-O 3.12Å; C599-L615 HydrophobicContact CB-CD1 4.49Å; C599-I616 CarbonylContact C-O 3.47Å; C599-I616 WeakPolarHBondContact CA-O 3.19Å
600	I	97.6	Very high	92.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.3	175.7	-52	177.9	0	0	0	107.2	Y585 L586 L587 M598 L615 I616 I618 L675 L677 Y681	Y585-I600 HydrophobicContact CD1-CG2 3.91Å; Y585-I600 HydrophobicContact CE1-CG2 4.47Å; L586-I600 WeakPolarHBondContact O-CA 2.91Å; L587-I600 HydrophobicContact CD2-CB 4.47Å; L587-I600 HydrophobicContact CD2-CD1 4.35Å; L587-I600 HydrophobicContact CD2-CG1 3.87Å; L587-I600 HydrophobicContact CD2-CG2 4.16Å; M598-I600 HydrophobicContact CE-CD1 4.18Å; M598-I600 HydrophobicContact CE-CG1 4.11Å; I600-L615 WeakPolarHBondContact O-CA 3.37Å; I600-I616 HydrophobicContact CB-CG2 3.93Å; I600-I616 PolarHBondContact N-O 2.98Å; I600-I616 PolarHBondContact O-N 3.25Å; I600-I618 HydrophobicContact CD1-CG1 4.22Å; I600-I618 HydrophobicContact CG1-CG1 4.44Å; I600-L675 HydrophobicContact CD1-CD2 4.22Å; I600-L677 HydrophobicContact CD1-CD2 4.03Å; I600-Y681 WeakPolarHBondContact CG2-OH 3.4Å
601	L	97.4	Very high	92.4	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.016	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.3	170.1	175.9	84	0	0	0	108	Y233 I554 Y585 L586 F588 G614 L615 Y695	Y233-L601 HydrophobicContact CD1-CD2 4.2Å; Y233-L601 HydrophobicContact CD2-CD2 4.44Å; Y233-L601 HydrophobicContact CE1-CD2 4.45Å; Y233-L601 HydrophobicContact CG-CD2 4.19Å; I554-L601 HydrophobicContact CD1-CD1 4.49Å; I554-L601 HydrophobicContact CD1-CD2 4.14Å; Y585-L601 CarbonylContact C-O 3.46Å; Y585-L601 WeakPolarHBondContact CA-O 3.4Å; L586-L601 HydrophobicContact CB-CB 4.17Å; L586-L601 HydrophobicContact CB-CD2 4.47Å; L586-L601 HydrophobicContact CD2-CB 4.37Å; L586-L601 HydrophobicContact CD2-CD2 3.89Å; L586-L601 PolarHBondContact N-O 3.25Å; L586-L601 PolarHBondContact O-N 3.13Å; F588-L601 HydrophobicContact CE1-CB 4.06Å; L601-G614 CarbonylContact C-O 3.52Å; L601-G614 VanDerWaalsContact CA-O 3.27Å; L601-G614 WeakPolarHBondContact CA-O 3.38Å; L601-G614 WeakPolarHBondContact CD1-O 3.14Å; L601-L615 HydrophobicContact CB-CD1 4.1Å; L601-L615 HydrophobicContact CD1-CB 4.26Å; L601-L615 HydrophobicContact CD1-CD1 4.16Å; L601-Y695 HydrophobicContact CD1-CE1 3.89Å
602	R	95.9	Very high	92.2	Very high	33 Å²	33	53.3 Å²	53.3	13%	0.125	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	139.1	172.1	71	177.1	-176.6	-177.7	-0.9	112	H584 Y585 V611 N612 N613 G614 Y681	H584-R602 CarbonylContact O-C 3.58Å; H584-R602 WeakPolarHBondContact O-CA 3.39Å; Y585-R602 HydrophobicContact CD1-CB 3.63Å; Y585-R602 HydrophobicContact CE1-CB 3.55Å; Y585-R602 HydrophobicContact CE1-CG 4.21Å; Y585-R602 HydrophobicContact CG-CB 4.25Å; Y585-R602 PolarHBondContact OH-NH1 3.49Å; R602-V611 HydrophobicContact CG-CG1 3.86Å; R602-N612 VanDerWaalsContact CZ-O 3.3Å; R602-N612 PolarHBondContact NE-O 3.31Å; R602-N612 PolarHBondContact NH2-O 2.8Å; R602-N613 PolarHBondContact NE-O 3.3Å; R602-G614 PolarHBondContact N-O 2.98Å; R602-G614 WeakPolarHBondContact O-CA 3.25Å; R602-Y681 VanDerWaalsContact NH1-CG 3.31Å
603	R	95.8	Very high	92.2	Very high	57 Å²	57	51.3 Å²	51.3	22%	0.215	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	152.6	176.7	-66.5	-171.3	65.3	112.9	11.2	110.2	I552 L583 H584	I552-R603 VanDerWaalsContact CD1-CZ 3.49Å; L583-R603 CarbonylContact C-O 3.6Å; L583-R603 WeakPolarHBondContact CA-O 3.41Å; H584-R603 PolarHBondContact N-O 3.25Å; H584-R603 PolarHBondContact O-N 3.35Å
604	H	96.6	Very high	92.5	Very high	28 Å²	28	44.5 Å²	44.5	13%	0.13	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	147.3	174.5	-160.6	-95.8	0	0	0	110.9	Q235 L583 D606 Q609 V611	Q235-H604 PolarHBondContact NE2-O 3.31Å; L583-H604 HydrophobicContact CD2-CB 4.3Å; H604-D606 VanDerWaalsContact C-N 3.28Å; H604-D606 VanDerWaalsContact CE1-CB 3.48Å; H604-D606 WeakPolarHBondContact CE1-CB 3.43Å; H604-D606 WeakPolarHBondContact ND1-CA 3.49Å; H604-D606 WeakPolarHBondContact ND1-CB 3.29Å; H604-D606 PolarHBondContact ND1-N 3.48Å; H604-D606 PolarHBondContact ND1-O 3.15Å; H604-Q609 HydrophobicContact CB-CB 4.06Å; H604-Q609 WeakPolarHBondContact CB-O 3.38Å; H604-Q609 PolarHBondContact CE1-OE1 3.31Å; H604-Q609 PolarHBondContact NE2-OE1 3.01Å; H604-V611 HydrophobicContact CB-CG2 3.69Å
605	T	94.8	Very high	93.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-66	-34.5	175.1	56.7	0	0	0	0	111.5	D213 K215 S216 N582	D213-T605 WeakPolarHBondContact OD2-CB 3.36Å; D213-T605 PolarHBondContact OD2-OG1 3.43Å; K215-T605 WeakPolarHBondContact CB-O 3.43Å; S216-T605 VanDerWaalsContact CB-O 3.24Å; S216-T605 WeakPolarHBondContact CB-O 3.16Å; S216-T605 PolarHBondContact OG-O 2.82Å; N582-T605 VanDerWaalsContact C-CG2 3.48Å; N582-T605 HydrophobicContact CB-CG2 4.36Å; N582-T605 VanDerWaalsContact O-CG2 3.29Å; N582-T605 WeakPolarHBondContact O-CG2 3.41Å; N582-T605 PolarHBondContact O-N 2.88Å; N582-T605 PolarHBondContact O-OG1 3.19Å
606	D	94.2	Very high	93.3	Very high	35 Å²	35	37.8 Å²	37.8	19%	0.187	21%	0.205	C	C	.	.	S	Bend	trans	-80.1	117.7	168	-161.8	-41.1	0	0	0	110.5	K215 H604 S608 Q609	K215-D606 HydrophobicContact CD-CB 3.76Å; K215-D606 IonicContact NZ-OD2 3.06Å; K215-D606 PolarHBondContact NZ-OD2 3.26Å; H604-D606 VanDerWaalsContact C-N 3.28Å; H604-D606 VanDerWaalsContact CE1-CB 3.48Å; H604-D606 WeakPolarHBondContact CE1-CB 3.43Å; H604-D606 WeakPolarHBondContact ND1-CA 3.49Å; H604-D606 WeakPolarHBondContact ND1-CB 3.29Å; H604-D606 PolarHBondContact ND1-N 3.48Å; H604-D606 PolarHBondContact ND1-O 3.15Å; D606-S608 PolarHBondContact O-N 2.77Å; D606-S608 WeakPolarHBondContact OD1-CB 3.5Å; D606-S608 PolarHBondContact OD1-N 3.1Å; D606-S608 VanDerWaalsContact OD1-N 3.08Å; D606-S608 PolarHBondContact OD1-OG 2.88Å; D606-Q609 HydrophobicContact CB-CG 4.23Å; D606-Q609 PolarHBondContact O-N 2.72Å; D606-Q609 VanDerWaalsContact O-N 3.15Å
607	I	91.9	Very high	93.5	Very high	41 Å²	41	34.9 Å²	34.9	21%	0.21	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.4	-175.4	-67.1	155.8	0	0	0	112.1	Q235 E237 A551 I552 Q609	Q235-I607 HydrophobicContact CG-CG1 4.39Å; E237-I607 HydrophobicContact CB-CD1 3.38Å; E237-I607 HydrophobicContact CG-CD1 3.63Å; A551-I607 HydrophobicContact CB-CD1 3.76Å; A551-I607 HydrophobicContact CB-CG1 4.45Å; A551-I607 HydrophobicContact CB-CG2 4.04Å; I552-I607 HydrophobicContact CD1-CG1 4.23Å; I552-I607 HydrophobicContact CD1-CG2 3.88Å; I607-Q609 PolarHBondContact O-N 3.47Å
608	S	90.4	Very high	93.5	Very high	101 Å²	101	33.3 Å²	33.3	71%	0.706	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-15.9	178.8	68.5	0	0	0	0	113.6	D606	D606-S608 PolarHBondContact O-N 2.77Å; D606-S608 WeakPolarHBondContact OD1-CB 3.5Å; D606-S608 PolarHBondContact OD1-N 3.1Å; D606-S608 VanDerWaalsContact OD1-N 3.08Å; D606-S608 PolarHBondContact OD1-OG 2.88Å
609	Q	92.9	Very high	93.4	Very high	97 Å²	97	39.3 Å²	39.3	45%	0.453	21%	0.213	S	C	.	.			trans	-102.9	134.1	-176.9	-59.4	-169.9	25.2	0	0	111.5	H604 D606 I607	H604-Q609 HydrophobicContact CB-CB 4.06Å; H604-Q609 WeakPolarHBondContact CB-O 3.38Å; H604-Q609 PolarHBondContact CE1-OE1 3.31Å; H604-Q609 PolarHBondContact NE2-OE1 3.01Å; D606-Q609 HydrophobicContact CB-CG 4.23Å; D606-Q609 PolarHBondContact O-N 2.72Å; D606-Q609 VanDerWaalsContact O-N 3.15Å; I607-Q609 PolarHBondContact O-N 3.47Å
610	S	87.6	Confident	93.1	Very high	113 Å²	113	39.9 Å²	39.9	79%	0.79	22%	0.215	S	C	*	.			trans	-90.8	153	171.6	58	0	0	0	0	111.2
611	V	90.5	Very high	92.6	Very high	38 Å²	38	40.4 Å²	40.4	23%	0.23	22%	0.221	C	C	.	.			trans	-122	137.3	177	167	0	0	0	0	109.6	L583 R602 H604	L583-V611 HydrophobicContact CD2-CG1 4.35Å; L583-V611 HydrophobicContact CD2-CG2 3.47Å; L583-V611 VanDerWaalsContact CD2-CG2 3.47Å; R602-V611 HydrophobicContact CG-CG1 3.86Å; H604-V611 HydrophobicContact CB-CG2 3.69Å
612	N	85.9	Confident	92.1	Very high	123 Å²	123	41.8 Å²	41.8	66%	0.658	23%	0.23	S	C	*	.	S	Bend	trans	-68	150.2	174.4	-66.7	-12.9	0	0	0	110.6	R602 G614	R602-N612 VanDerWaalsContact CZ-O 3.3Å; R602-N612 PolarHBondContact NE-O 3.31Å; R602-N612 PolarHBondContact NH2-O 2.8Å; N612-G614 VanDerWaalsContact C-N 3.28Å; N612-G614 PolarHBondContact O-N 3.04Å
613	N	86.8	Confident	91.7	Very high	18 Å²	18	40.2 Å²	40.2	10%	0.096	23%	0.225	C	C	.	.	S	Bend	trans	52.5	48.8	-178.7	-43.7	92.1	0	0	0	111.4	R602 L615 Y681 A686 Y689	R602-N613 PolarHBondContact NE-O 3.3Å; N613-L615 PolarHBondContact O-N 3.14Å; N613-Y681 HydrophobicContact CB-CD1 3.91Å; N613-Y681 HydrophobicContact CB-CE1 3.89Å; N613-A686 PolarHBondContact ND2-O 2.94Å; N613-Y689 PolarHBondContact ND2-O 2.96Å
614	G	90.7	Very high	91.1	Very high	8 Å²	8	38.8 Å²	38.8	8%	0.082	22%	0.222	C	C	.	.			trans	-61.9	-28.6	-177.1	0	0	0	0	0	113.4	L601 R602 N612	L601-G614 CarbonylContact C-O 3.52Å; L601-G614 VanDerWaalsContact CA-O 3.27Å; L601-G614 WeakPolarHBondContact CA-O 3.38Å; L601-G614 WeakPolarHBondContact CD1-O 3.14Å; R602-G614 PolarHBondContact N-O 2.98Å; R602-G614 WeakPolarHBondContact O-CA 3.25Å; N612-G614 VanDerWaalsContact C-N 3.28Å; N612-G614 PolarHBondContact O-N 3.04Å
615	L	95.7	Very high	90.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	129.8	177	-178.7	66.9	0	0	0	109.9	F588 C599 I600 L601 N613 F691 Y695 L699 I706 P707	F588-L615 HydrophobicContact CE1-CD1 3.99Å; F588-L615 HydrophobicContact CZ-CD1 3.93Å; C599-L615 HydrophobicContact CB-CD1 4.49Å; I600-L615 WeakPolarHBondContact O-CA 3.37Å; L601-L615 HydrophobicContact CB-CD1 4.1Å; L601-L615 HydrophobicContact CD1-CB 4.26Å; L601-L615 HydrophobicContact CD1-CD1 4.16Å; N613-L615 PolarHBondContact O-N 3.14Å; L615-F691 HydrophobicContact CB-CB 4.3Å; L615-F691 HydrophobicContact CB-CG 4.35Å; L615-F691 HydrophobicContact CD2-CD1 4.4Å; L615-F691 HydrophobicContact CD2-CD2 4Å; L615-F691 HydrophobicContact CD2-CE1 4.39Å; L615-F691 HydrophobicContact CD2-CE2 3.99Å; L615-F691 HydrophobicContact CD2-CG 4.2Å; L615-F691 HydrophobicContact CD2-CZ 4.18Å; L615-Y695 HydrophobicContact CB-CE1 4.27Å; L615-L699 HydrophobicContact CD1-CD1 4.25Å; L615-L699 HydrophobicContact CD2-CD1 3.97Å; L615-L699 HydrophobicContact CD2-CD2 3.9Å; L615-L699 HydrophobicContact CD2-CG 4.49Å; L615-I706 HydrophobicContact CD2-CD1 4.22Å; L615-I706 HydrophobicContact CD2-CG1 4.03Å; L615-I706 HydrophobicContact CD2-CG2 4.32Å; L615-I706 HydrophobicContact CG-CG2 4.24Å; L615-P707 WeakPolarHBondContact O-CG 3.48Å
616	I	95.6	Very high	89.1	Confident	1 Å²	1	41 Å²	41	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	132.9	177.2	-167.9	161.7	0	0	0	111	C599 I600 I618 V680 Y681 R709	C599-I616 CarbonylContact C-O 3.47Å; C599-I616 WeakPolarHBondContact CA-O 3.19Å; I600-I616 HydrophobicContact CB-CG2 3.93Å; I600-I616 PolarHBondContact N-O 2.98Å; I600-I616 PolarHBondContact O-N 3.25Å; I616-I618 HydrophobicContact CG1-CD1 4.47Å; I616-V680 HydrophobicContact CD1-CG1 3.95Å; I616-V680 HydrophobicContact CG2-CG1 3.97Å; I616-Y681 HydrophobicContact CG2-CE1 4.17Å; I616-R709 HydrophobicContact CD1-CB 4.05Å; I616-R709 HydrophobicContact CG1-CB 4.42Å
617	G	95.1	Very high	87.6	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	146.4	170.8	0	0	0	0	0	110.8	P707 T708 R709	G617-P707 PolarHBondContact N-O 3Å; G617-T708 CarbonylContact O-C 3.58Å; G617-T708 VanDerWaalsContact O-CA 3.27Å; G617-T708 WeakPolarHBondContact O-CA 3.29Å; G617-R709 PolarHBondContact O-N 2.85Å
618	I	95.2	Very high	85.8	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.015	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.5	-178.1	-59.1	-56.5	0	0	0	110.2	M598 I600 I616 F620 L675 V680 M711	M598-I618 HydrophobicContact CB-CB 4.33Å; M598-I618 PolarHBondContact O-N 2.88Å; I600-I618 HydrophobicContact CD1-CG1 4.22Å; I600-I618 HydrophobicContact CG1-CG1 4.44Å; I616-I618 HydrophobicContact CG1-CD1 4.47Å; I618-F620 HydrophobicContact CB-CE2 4.49Å; I618-F620 HydrophobicContact CG2-CD2 4.2Å; I618-F620 HydrophobicContact CG2-CE1 4.09Å; I618-F620 HydrophobicContact CG2-CE2 3.68Å; I618-F620 HydrophobicContact CG2-CZ 3.61Å; I618-L675 HydrophobicContact CG1-CD2 4.46Å; I618-V680 HydrophobicContact CD1-CG1 3.94Å; I618-V680 HydrophobicContact CD1-CG2 4.16Å; I618-M711 HydrophobicContact CB-CE 4.38Å; I618-M711 HydrophobicContact CD1-CE 3.9Å; I618-M711 HydrophobicContact CG1-CE 4.39Å; I618-M711 HydrophobicContact CG2-CE 3.25Å
619	K	93.5	Very high	83.9	Confident	126 Å²	126	43.9 Å²	43.9	55%	0.548	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.2	169.6	-176.2	174.7	-178.5	175.7	0	109.7	T708 R709 T710 M711	K619-T708 HydrophobicContact CB-CG2 3.79Å; K619-R709 PolarHBondContact N-O 2.97Å; K619-T710 HydrophobicContact CG-CG2 4.43Å; K619-T710 CarbonylContact O-C 3.59Å; K619-T710 VanDerWaalsContact O-CA 3.29Å; K619-T710 WeakPolarHBondContact O-CA 3.09Å; K619-M711 PolarHBondContact O-N 2.88Å
620	F	92.1	Very high	81.5	Confident	13 Å²	13	48.1 Å²	48.1	6%	0.057	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	116.7	175.8	-61	-88.4	0	0	0	108.7	M598 I618 F623 Y642 V657 L659 V673 F713	M598-F620 HydrophobicContact CB-CE2 4.42Å; M598-F620 HydrophobicContact SD-CE2 4.46Å; M598-F620 HydrophobicContact SD-CZ 4.11Å; I618-F620 HydrophobicContact CB-CE2 4.49Å; I618-F620 HydrophobicContact CG2-CD2 4.2Å; I618-F620 HydrophobicContact CG2-CE1 4.09Å; I618-F620 HydrophobicContact CG2-CE2 3.68Å; I618-F620 HydrophobicContact CG2-CZ 3.61Å; F620-F623 HydrophobicContact CB-CE2 4.14Å; F620-F623 HydrophobicContact CB-CZ 4.02Å; F620-F623 HydrophobicContact CD1-CZ 4.01Å; F620-F623 HydrophobicContact CG-CZ 4.36Å; F620-Y642 HydrophobicContact CB-CD2 3.92Å; F620-Y642 HydrophobicContact CB-CG 4.4Å; F620-V657 HydrophobicContact CZ-CG1 4.2Å; F620-L659 HydrophobicContact CB-CD1 4.04Å; F620-L659 HydrophobicContact CD1-CD1 3.59Å; F620-L659 HydrophobicContact CD2-CD1 3.89Å; F620-L659 HydrophobicContact CD2-CD2 3.69Å; F620-L659 HydrophobicContact CD2-CG 4.47Å; F620-L659 HydrophobicContact CE1-CD1 4Å; F620-L659 HydrophobicContact CE1-CD2 4.47Å; F620-L659 HydrophobicContact CE2-CD1 4.26Å; F620-L659 HydrophobicContact CE2-CD2 3.54Å; F620-L659 HydrophobicContact CG-CD1 3.55Å; F620-L659 HydrophobicContact CG-CD2 4.25Å; F620-L659 HydrophobicContact CZ-CD1 4.32Å; F620-L659 HydrophobicContact CZ-CD2 3.97Å; F620-V673 HydrophobicContact CE1-CG1 4.07Å; F620-F713 HydrophobicContact CD1-CD2 4.34Å; F620-F713 AromaticContact CD1-CE2 3.45Å; F620-F713 HydrophobicContact CD1-CE2 3.45Å; F620-F713 VanDerWaalsContact CD1-CE2 3.45Å; F620-F713 AromaticContact CD1-CZ 3.88Å; F620-F713 HydrophobicContact CD1-CZ 3.88Å; F620-F713 AromaticContact CE1-CE2 3.92Å; F620-F713 HydrophobicContact CE1-CE2 3.92Å; F620-F713 AromaticContact CE1-CZ 3.83Å; F620-F713 HydrophobicContact CE1-CZ 3.83Å
621	G	86.9	Confident	79.3	Confident	11 Å²	11	45.6 Å²	45.6	11%	0.113	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-74.4	-172	0	0	0	0	0	113.1	M711	G621-M711 WeakPolarHBondContact CA-O 3.33Å; G621-M711 PolarHBondContact N-O 2.94Å
622	S	86.5	Confident	76.7	Confident	31 Å²	31	54.5 Å²	54.5	22%	0.217	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	151.9	178.3	65.5	0	0	0	0	111.9	H712 F713	S622-H712 PolarHBondContact N-ND1 2.89Å; S622-H712 WeakPolarHBondContact O-CA 3.23Å; S622-H712 PolarHBondContact OG-ND1 2.97Å; S622-F713 PolarHBondContact O-N 2.97Å
623	F	86.8	Confident	74.3	Confident	1 Å²	1	61.4 Å²	61.4	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	119.1	175.6	-66.2	-84.8	0	0	0	108.7	F620 Y642 L659 I671 V673 F713 W717	F620-F623 HydrophobicContact CB-CE2 4.14Å; F620-F623 HydrophobicContact CB-CZ 4.02Å; F620-F623 HydrophobicContact CD1-CZ 4.01Å; F620-F623 HydrophobicContact CG-CZ 4.36Å; F623-Y642 HydrophobicContact CD2-CE1 4.23Å; F623-Y642 AromaticContact CD2-CE2 3.76Å; F623-Y642 HydrophobicContact CD2-CE2 3.76Å; F623-Y642 AromaticContact CD2-CZ 3.54Å; F623-Y642 WeakPolarHBondContact CD2-OH 3.45Å; F623-Y642 HydrophobicContact CE2-CD1 4.33Å; F623-Y642 AromaticContact CE2-CD2 3.84Å; F623-Y642 HydrophobicContact CE2-CD2 3.84Å; F623-Y642 HydrophobicContact CE2-CE1 4.02Å; F623-Y642 AromaticContact CE2-CE2 3.47Å; F623-Y642 HydrophobicContact CE2-CE2 3.47Å; F623-Y642 VanDerWaalsContact CE2-CE2 3.47Å; F623-Y642 HydrophobicContact CE2-CG 4.24Å; F623-Y642 AromaticContact CE2-CZ 3.55Å; F623-L659 HydrophobicContact CE1-CD1 4.41Å; F623-L659 HydrophobicContact CE2-CD1 4.1Å; F623-L659 HydrophobicContact CZ-CD1 3.47Å; F623-L659 VanDerWaalsContact CZ-CD1 3.47Å; F623-I671 HydrophobicContact CD1-CG2 4.46Å; F623-I671 HydrophobicContact CD2-CD1 4.13Å; F623-I671 HydrophobicContact CE1-CG2 4.29Å; F623-I671 HydrophobicContact CE2-CD1 4.23Å; F623-V673 HydrophobicContact CE1-CB 4.13Å; F623-V673 HydrophobicContact CE1-CG2 3.91Å; F623-F713 HydrophobicContact CD1-CB 3.74Å; F623-F713 HydrophobicContact CD1-CD2 4.19Å; F623-F713 HydrophobicContact CD1-CG 4.19Å; F623-F713 HydrophobicContact CE1-CB 3.95Å; F623-F713 AromaticContact CE1-CD2 3.64Å; F623-F713 HydrophobicContact CE1-CD2 3.64Å; F623-F713 HydrophobicContact CE1-CE2 4.38Å; F623-F713 AromaticContact CE1-CG 3.87Å; F623-F713 HydrophobicContact CE1-CG 3.87Å; F623-F713 HydrophobicContact CZ-CD2 4.09Å; F623-W717 HydrophobicContact CB-CD2 4.01Å; F623-W717 HydrophobicContact CB-CE3 4.16Å; F623-W717 HydrophobicContact CB-CH2 3.86Å; F623-W717 HydrophobicContact CB-CZ2 3.69Å; F623-W717 HydrophobicContact CB-CZ3 4.08Å; F623-W717 HydrophobicContact CD1-CB 4.22Å; F623-W717 AromaticContact CD1-CD2 3.83Å; F623-W717 HydrophobicContact CD1-CD2 3.83Å; F623-W717 HydrophobicContact CD1-CE3 4.17Å; F623-W717 AromaticContact CD1-CG 3.83Å; F623-W717 HydrophobicContact CD1-CG 3.83Å; F623-W717 HydrophobicContact CG-CD2 4.34Å; F623-W717 HydrophobicContact CG-CE3 4.44Å
624	T	84.1	Confident	71.8	Confident	27 Å²	27	65.3 Å²	65.3	17%	0.166	32%	0.323	C	S	.	.			trans	-137.7	162.3	-179.9	56.9	0	0	0	0	110	F713 E714 W717	T624-F713 PolarHBondContact N-O 2.9Å; T624-E714 CarbonylContact O-C 3.54Å; T624-E714 WeakPolarHBondContact O-CA 3.32Å; T624-W717 PolarHBondContact O-NE1 2.86Å
625	Y	78.1	Confident	69.3	Low	16 Å²	16	73.3 Å²	73.3	6%	0.063	35%	0.351	C	S	.	.			trans	-115.5	135.5	166.4	-69.1	-76.4	0	0	0	108.9	T627 A628 W717 L760	Y625-T627 PolarHBondContact O-N 2.94Å; Y625-T627 VanDerWaalsContact O-N 3.09Å; Y625-A628 WeakPolarHBondContact O-CB 3.37Å; Y625-A628 PolarHBondContact O-N 3.1Å; Y625-W717 HydrophobicContact CD2-CH2 4.15Å; Y625-W717 AromaticContact CD2-CZ2 3.62Å; Y625-W717 HydrophobicContact CD2-CZ2 3.62Å; Y625-W717 HydrophobicContact CE1-CZ2 4.38Å; Y625-W717 AromaticContact CE2-CE2 3.86Å; Y625-W717 AromaticContact CE2-CH2 3.56Å; Y625-W717 HydrophobicContact CE2-CH2 3.56Å; Y625-W717 AromaticContact CE2-CZ2 3.34Å; Y625-W717 HydrophobicContact CE2-CZ2 3.34Å; Y625-W717 HydrophobicContact CE2-CZ3 4.23Å; Y625-W717 HydrophobicContact CG-CZ2 4.26Å; Y625-W717 AromaticContact CZ-CE2 3.78Å; Y625-W717 AromaticContact CZ-CZ2 3.77Å; Y625-W717 PolarHBondContact OH-O 2.89Å; Y625-L760 HydrophobicContact CD2-CD1 4.14Å; Y625-L760 HydrophobicContact CE2-CD1 3.62Å
626	A	70.1	Confident	66.6	Low	59 Å²	59	78.3 Å²	78.3	49%	0.488	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.7	178	0	0	0	0	0	113.5
627	T	63	Low	64.3	Low	69 Å²	69	82.6 Å²	82.6	42%	0.423	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-28.1	175.3	42.5	0	0	0	0	113.4	C7 Y625	C7-T627 PolarHBondContact SG-OG1 3.22Å; Y625-T627 PolarHBondContact O-N 2.94Å; Y625-T627 VanDerWaalsContact O-N 3.09Å
628	A	54.3	Low	61.9	Low	24 Å²	24	86.7 Å²	86.7	20%	0.198	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-76	-26.9	-176.9	0	0	0	0	0	112.9	Y625 K630 V631	Y625-A628 WeakPolarHBondContact O-CB 3.37Å; Y625-A628 PolarHBondContact O-N 3.1Å; A628-K630 PolarHBondContact O-N 2.69Å; A628-K630 VanDerWaalsContact O-N 3.1Å; A628-V631 PolarHBondContact O-N 3.24Å
629	E	49.7	Very low	60	Low	144 Å²	144	91.4 Å²	91.4	67%	0.673	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-65.5	-17.2	-177.3	-73.4	-170.3	150.7	0	0	115.1	V631	E629-V631 VanDerWaalsContact C-N 3.32Å
630	K	43	Very low	58.8	Low	185 Å²	185	86.4 Å²	86.4	80%	0.804	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-80.8	-11.2	172.9	-78.4	-177	-179.4	172.7	0	113.4	P5 A628	P5-K630 HydrophobicContact CG-CB 3.81Å; A628-K630 PolarHBondContact O-N 2.69Å; A628-K630 VanDerWaalsContact O-N 3.1Å
631	V	41.8	Very low	58.4	Low	61 Å²	61	89.8 Å²	89.8	37%	0.37	47%	0.465	S	S	.	.	S	Bend	trans	-104.8	84.4	175.9	-172.4	0	0	0	0	108.8	P5 A628 E629	P5-V631 HydrophobicContact CB-CG2 4.07Å; P5-V631 HydrophobicContact CG-CG2 3.54Å; A628-V631 PolarHBondContact O-N 3.24Å; E629-V631 VanDerWaalsContact C-N 3.32Å
632	R	36.8	Very low	58.6	Low	225 Å²	225	90 Å²	90	85%	0.849	46%	0.462	S	S	*	.			trans	54.2	115.5	162.2	-75.7	-178.5	169.4	154.6	-3.2	119.2	S634	R632-S634 PolarHBondContact O-N 2.85Å
633	R	35.1	Very low	59	Low	268 Å²	268	89.1 Å²	89.1	100%	1.011	46%	0.456	S	S	*	.	S	Bend	trans	-16.8	26.4	139.3	-92.7	179.8	173.5	153.3	-0.3	122.2
634	S	34.1	Very low	59.3	Low	100 Å²	100	89.1 Å²	89.1	70%	0.699	46%	0.456	S	S	*	.	S	Bend	trans	-140.5	105.9	175.7	-168.8	0	0	0	0	110.1	R632	R632-S634 PolarHBondContact O-N 2.85Å
635	R	38.9	Very low	59.8	Low	176 Å²	176	89.4 Å²	89.4	66%	0.664	46%	0.456	S	S	*	.			trans	71.7	73.7	-174.7	-64.4	-179.7	177.8	140	6.1	115.2	D765	R635-D765 IonicContact CZ-OD2 3.55Å; R635-D765 IonicContact NE-OD2 3.48Å; R635-D765 VanDerWaalsContact NH1-CG 3.29Å; R635-D765 IonicContact NH1-OD2 2.69Å; R635-D765 PolarHBondContact NH1-OD2 3.26Å
636	T	38.2	Very low	60.6	Low	104 Å²	104	88.7 Å²	88.7	64%	0.638	45%	0.454	S	S	*	.			trans	-47.4	143.5	138.6	39.7	0	0	0	0	108.5	S638	T636-S638 PolarHBondContact O-N 2.96Å
637	F	47.8	Very low	61.8	Low	92 Å²	92	85.9 Å²	85.9	40%	0.404	43%	0.431	S	S	.	.			trans	-56.8	90.7	161.1	-86.9	-92.4	0	0	0	106.8	S639 L719	F637-S639 PolarHBondContact O-N 3.42Å; F637-L719 HydrophobicContact CZ-CD2 4.2Å
638	S	44.7	Very low	63.4	Low	85 Å²	85	84.1 Å²	84.1	59%	0.594	42%	0.417	S	S	*	.			trans	-77.6	114.2	-165.8	68.4	0	0	0	0	108.9	T636 S640	T636-S638 PolarHBondContact O-N 2.96Å; S638-S640 VanDerWaalsContact C-N 3.27Å; S638-S640 PolarHBondContact O-N 2.85Å
639	S	54.6	Low	65.4	Low	103 Å²	103	83 Å²	83	72%	0.72	41%	0.408	S	S	*	.			trans	18.1	61.1	164.7	74.5	0	0	0	0	115.7	F637	F637-S639 PolarHBondContact O-N 3.42Å
640	S	67.6	Low	67.6	Low	21 Å²	21	77.4 Å²	77.4	15%	0.147	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-83	159.8	173	62.4	0	0	0	0	109.5	S638 Y642 D661	S638-S640 VanDerWaalsContact C-N 3.27Å; S638-S640 PolarHBondContact O-N 2.85Å; S640-Y642 WeakPolarHBondContact O-CD2 3.44Å; S640-Y642 WeakPolarHBondContact O-CE2 3.45Å; S640-Y642 WeakPolarHBondContact OG-CE1 3.39Å; S640-Y642 PolarHBondContact OG-OH 3.09Å; S640-D661 VanDerWaalsContact CB-OD1 3.27Å; S640-D661 WeakPolarHBondContact CB-OD1 3.4Å; S640-D661 WeakPolarHBondContact CB-OD2 3.09Å; S640-D661 PolarHBondContact OG-OD1 3.14Å; S640-D661 PolarHBondContact OG-OD2 2.8Å
641	T	84.6	Confident	70.1	Confident	84 Å²	84	71 Å²	71	52%	0.515	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-92.9	117.1	179.4	-55.3	0	0	0	0	108.5	V595 S662	V595-T641 HydrophobicContact CG1-CG2 4.17Å; V595-T641 HydrophobicContact CG2-CG2 3.78Å; T641-S662 VanDerWaalsContact O-CB 3.31Å; T641-S662 WeakPolarHBondContact O-CB 3.36Å; T641-S662 PolarHBondContact O-N 3.24Å; T641-S662 VanDerWaalsContact O-N 3.1Å; T641-S662 PolarHBondContact O-OG 3.33Å
642	Y	91.3	Very high	72.5	Confident	16 Å²	16	70.1 Å²	70.1	6%	0.063	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133.8	-176.5	-58.3	-76	0	0	0	111.7	V595 F620 F623 S640 K660 D661 I671	V595-Y642 VanDerWaalsContact CG1-O 3.27Å; V595-Y642 WeakPolarHBondContact CG1-O 3.47Å; F620-Y642 HydrophobicContact CB-CD2 3.92Å; F620-Y642 HydrophobicContact CB-CG 4.4Å; F623-Y642 HydrophobicContact CD2-CE1 4.23Å; F623-Y642 AromaticContact CD2-CE2 3.76Å; F623-Y642 HydrophobicContact CD2-CE2 3.76Å; F623-Y642 AromaticContact CD2-CZ 3.54Å; F623-Y642 WeakPolarHBondContact CD2-OH 3.45Å; F623-Y642 HydrophobicContact CE2-CD1 4.33Å; F623-Y642 AromaticContact CE2-CD2 3.84Å; F623-Y642 HydrophobicContact CE2-CD2 3.84Å; F623-Y642 HydrophobicContact CE2-CE1 4.02Å; F623-Y642 AromaticContact CE2-CE2 3.47Å; F623-Y642 HydrophobicContact CE2-CE2 3.47Å; F623-Y642 VanDerWaalsContact CE2-CE2 3.47Å; F623-Y642 HydrophobicContact CE2-CG 4.24Å; F623-Y642 AromaticContact CE2-CZ 3.55Å; S640-Y642 WeakPolarHBondContact O-CD2 3.44Å; S640-Y642 WeakPolarHBondContact O-CE2 3.45Å; S640-Y642 WeakPolarHBondContact OG-CE1 3.39Å; S640-Y642 PolarHBondContact OG-OH 3.09Å; Y642-K660 CarbonylContact C-O 3.21Å; Y642-K660 WeakPolarHBondContact CA-O 3.36Å; Y642-D661 HydrophobicContact CD1-CB 4.11Å; Y642-D661 HydrophobicContact CE1-CB 3.95Å; Y642-I671 HydrophobicContact CD1-CD1 4.06Å; Y642-I671 HydrophobicContact CE1-CD1 3.45Å; Y642-I671 VanDerWaalsContact CE1-CD1 3.45Å
643	S	93.6	Very high	75.2	Confident	11 Å²	11	65.7 Å²	65.7	8%	0.077	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	131	172	-173.8	0	0	0	0	110.2	Y596 L659 K660	Y596-S643 WeakPolarHBondContact CB-OG 3.49Å; Y596-S643 PolarHBondContact N-OG 3.01Å; S643-L659 CarbonylContact O-C 3.54Å; S643-L659 WeakPolarHBondContact O-CA 3.06Å; S643-K660 PolarHBondContact N-O 2.99Å; S643-K660 PolarHBondContact O-N 2.48Å
644	C	94.9	Very high	78.2	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.014	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	124.6	175.2	-177.7	0	0	0	0	110.7	T589 Y596 M598 L659	T589-C644 HydrophobicContact CG2-CB 3.76Å; Y596-C644 VanDerWaalsContact CB-O 3.29Å; Y596-C644 WeakPolarHBondContact CB-O 3.39Å; Y596-C644 WeakPolarHBondContact O-CB 3.43Å; Y596-C644 PolarHBondContact O-N 3.14Å; M598-C644 HydrophobicContact CB-CB 4Å; C644-L659 HydrophobicContact CB-CD2 4.17Å
645	L	92.9	Very high	81.2	Confident	32 Å²	32	49.5 Å²	49.5	17%	0.168	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-46.2	178.9	-57.5	-177.7	0	0	0	112.2	I658 K660 R670	L645-I658 HydrophobicContact CB-CG2 4.28Å; L645-I658 HydrophobicContact CD1-CG2 4.04Å; L645-I658 HydrophobicContact CG-CG2 4.48Å; L645-I658 PolarHBondContact N-O 2.86Å; L645-K660 HydrophobicContact CD1-CB 4.07Å; L645-K660 HydrophobicContact CD2-CB 4.01Å; L645-K660 HydrophobicContact CD2-CD 4.49Å; L645-K660 HydrophobicContact CG-CB 4.06Å; L645-R670 VanDerWaalsContact CD1-NE 3.27Å
646	D	95.3	Very high	84	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.011	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	151	-179.1	-168.2	19.5	0	0	0	109.7	F572 I658 Q726 Y727 V728	F572-D646 WeakPolarHBondContact CD2-OD1 3.42Å; D646-I658 PolarHBondContact O-N 2.87Å; D646-Q726 WeakPolarHBondContact CB-O 3.27Å; D646-Y727 VanDerWaalsContact OD2-CA 3.22Å; D646-Y727 WeakPolarHBondContact OD2-CA 3.34Å; D646-V728 PolarHBondContact OD2-N 2.82Å
647	A	96.2	Very high	86.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	136.9	177.5	0	0	0	0	0	110.7	F572 L587 M598 V655 T656 V657	F572-A647 HydrophobicContact CE2-CB 4.03Å; L587-A647 HydrophobicContact CD1-CB 4.01Å; M598-A647 HydrophobicContact CE-CB 3.91Å; M598-A647 HydrophobicContact SD-CB 4.37Å; A647-V655 HydrophobicContact CB-CG1 4.27Å; A647-T656 WeakPolarHBondContact CA-O 3.22Å; A647-V657 HydrophobicContact CB-CB 4.43Å; A647-V657 HydrophobicContact CB-CG1 4.22Å; A647-V657 HydrophobicContact CB-CG2 4Å
648	Q	96.4	Very high	89.1	Confident	31 Å²	31	31.8 Å²	31.8	15%	0.145	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	144.2	178.1	-169.7	175.7	-6.9	0	0	110.4	F574 Y650 T656 V728 A729	F574-Q648 HydrophobicContact CD1-CG 4.21Å; F574-Q648 HydrophobicContact CD2-CG 4.03Å; F574-Q648 HydrophobicContact CE1-CG 3.88Å; F574-Q648 HydrophobicContact CE2-CG 3.7Å; F574-Q648 HydrophobicContact CG-CG 4.27Å; F574-Q648 HydrophobicContact CZ-CG 3.63Å; Q648-Y650 PolarHBondContact O-N 3.22Å; Q648-T656 PolarHBondContact N-O 2.95Å; Q648-T656 PolarHBondContact O-N 2.84Å; Q648-V728 HydrophobicContact CB-CG1 4.04Å; Q648-V728 PolarHBondContact OE1-O 2.9Å; Q648-A729 VanDerWaalsContact OE1-CA 3.3Å
649	F	96.6	Very high	91.5	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.009	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	132	170.7	-84.7	-103.2	0	0	0	110.9	F574 W576 Y585 L587 D651 V655 L677	F574-F649 AromaticContact CD1-CD2 3.98Å; F574-F649 HydrophobicContact CD1-CD2 3.98Å; F574-F649 HydrophobicContact CE1-CB 3.97Å; F574-F649 AromaticContact CE1-CD2 3.89Å; F574-F649 HydrophobicContact CE1-CD2 3.89Å; F574-F649 HydrophobicContact CE1-CG 4.36Å; W576-F649 HydrophobicContact CB-CB 4.32Å; W576-F649 HydrophobicContact CB-CD1 4.15Å; W576-F649 HydrophobicContact CB-CD2 3.4Å; W576-F649 VanDerWaalsContact CB-CD2 3.4Å; W576-F649 HydrophobicContact CB-CE1 4.38Å; W576-F649 HydrophobicContact CB-CE2 3.66Å; W576-F649 HydrophobicContact CB-CG 3.69Å; W576-F649 HydrophobicContact CB-CZ 4.18Å; W576-F649 AromaticContact CD1-CD1 3.42Å; W576-F649 VanDerWaalsContact CD1-CD1 3.42Å; W576-F649 AromaticContact CD1-CE1 3.6Å; W576-F649 AromaticContact CD1-CG 3.81Å; W576-F649 HydrophobicContact CD2-CB 3.68Å; W576-F649 HydrophobicContact CD2-CD1 4.03Å; W576-F649 HydrophobicContact CD2-CD2 4.42Å; W576-F649 AromaticContact CD2-CG 3.79Å; W576-F649 HydrophobicContact CD2-CG 3.79Å; W576-F649 HydrophobicContact CE3-CB 3.78Å; W576-F649 HydrophobicContact CE3-CG 4.34Å; W576-F649 HydrophobicContact CG-CB 3.94Å; W576-F649 AromaticContact CG-CD1 3.62Å; W576-F649 HydrophobicContact CG-CD1 3.62Å; W576-F649 AromaticContact CG-CD2 3.77Å; W576-F649 HydrophobicContact CG-CD2 3.77Å; W576-F649 HydrophobicContact CG-CE1 4.06Å; W576-F649 HydrophobicContact CG-CE2 4.19Å; W576-F649 AromaticContact CG-CG 3.48Å; W576-F649 HydrophobicContact CG-CG 3.48Å; W576-F649 VanDerWaalsContact CG-CG 3.48Å; W576-F649 HydrophobicContact CG-CZ 4.35Å; W576-F649 HydrophobicContact CZ3-CB 4.31Å; W576-F649 AromaticContact NE1-CD1 3.73Å; Y585-F649 AromaticContact CD1-CZ 3.89Å; Y585-F649 HydrophobicContact CD1-CZ 3.89Å; Y585-F649 HydrophobicContact CD2-CE1 4.41Å; Y585-F649 HydrophobicContact CD2-CZ 4.15Å; Y585-F649 HydrophobicContact CG-CE1 4.22Å; Y585-F649 HydrophobicContact CG-CE2 4.35Å; Y585-F649 AromaticContact CG-CZ 3.54Å; Y585-F649 HydrophobicContact CG-CZ 3.54Å; L587-F649 HydrophobicContact CD1-CD2 3.67Å; L587-F649 HydrophobicContact CD1-CE2 3.79Å; L587-F649 HydrophobicContact CD2-CD2 4.46Å; L587-F649 HydrophobicContact CD2-CE2 3.72Å; L587-F649 HydrophobicContact CD2-CZ 4.39Å; L587-F649 HydrophobicContact CG-CD2 4.03Å; L587-F649 HydrophobicContact CG-CE2 3.66Å; F649-D651 WeakPolarHBondContact CD1-O 3.36Å; F649-V655 HydrophobicContact CD1-CG2 4.18Å; F649-V655 HydrophobicContact CD2-CG2 4.32Å; F649-V655 HydrophobicContact CE1-CG2 4.07Å; F649-V655 HydrophobicContact CE2-CG2 4.23Å; F649-V655 HydrophobicContact CG-CG2 4.29Å; F649-V655 HydrophobicContact CZ-CG2 4.07Å; F649-L677 HydrophobicContact CE1-CD1 3.67Å; F649-L677 HydrophobicContact CZ-CD1 4.19Å
650	Y	95.2	Very high	93.4	Very high	26 Å²	26	26.8 Å²	26.8	10%	0.102	14%	0.138	C	C	.	.	S	Bend	trans	-90.9	-51.3	171.5	178.1	-105.4	0	0	0	109.4	Q648 T654 G732 K735 M752	Q648-Y650 PolarHBondContact O-N 3.22Å; Y650-T654 WeakPolarHBondContact CB-O 3.16Å; Y650-T654 PolarHBondContact N-O 3.39Å; Y650-G732 WeakPolarHBondContact O-CA 3.27Å; Y650-G732 PolarHBondContact O-N 2.93Å; Y650-K735 WeakPolarHBondContact OH-CA 3.41Å; Y650-K735 VanDerWaalsContact OH-CB 3.29Å; Y650-K735 WeakPolarHBondContact OH-CB 3.41Å; Y650-M752 HydrophobicContact CE2-CB 4.15Å; Y650-M752 HydrophobicContact CE2-CG 4Å; Y650-M752 WeakPolarHBondContact OH-CB 3.31Å
651	D	94.5	Very high	94.5	Very high	51 Å²	51	26.6 Å²	26.6	27%	0.273	14%	0.135	S	C	.	.	S	Bend	trans	-145.9	-173.4	171.6	56.9	41.2	0	0	0	110.1	F649 E653 T654	F649-D651 WeakPolarHBondContact CD1-O 3.36Å; D651-E653 PolarHBondContact O-N 2.83Å; D651-E653 VanDerWaalsContact O-N 3.15Å; D651-E653 WeakPolarHBondContact OD1-CA 3.24Å; D651-E653 PolarHBondContact OD1-N 2.92Å; D651-T654 PolarHBondContact N-O 2.84Å; D651-T654 PolarHBondContact O-N 2.83Å; D651-T654 VanDerWaalsContact OD1-CB 3.29Å; D651-T654 WeakPolarHBondContact OD1-CB 3.37Å; D651-T654 PolarHBondContact OD1-N 2.85Å; D651-T654 PolarHBondContact OD1-OG1 2.76Å
652	D	93.4	Very high	94.5	Very high	41 Å²	41	25.6 Å²	25.6	22%	0.219	13%	0.132	C	C	.	.	S	Bend	trans	-62.7	-17.8	-177.9	-85	-9.4	0	0	0	114.2	W576 N578 T580	W576-D652 PolarHBondContact NE1-OD1 2.77Å; N578-D652 WeakPolarHBondContact ND2-CB 3.45Å; N578-D652 PolarHBondContact ND2-O 3.42Å; N578-D652 VanDerWaalsContact ND2-O 3.13Å; T580-D652 PolarHBondContact OG1-OD2 3.1Å
653	E	94.3	Very high	94.1	Very high	133 Å²	133	32.4 Å²	32.4	62%	0.621	17%	0.166	S	C	*	.	S	Bend	trans	-117.1	-9.1	-175.1	-63	-171.5	178.4	0	0	113.6	D651 L677	D651-E653 PolarHBondContact O-N 2.83Å; D651-E653 VanDerWaalsContact O-N 3.15Å; D651-E653 WeakPolarHBondContact OD1-CA 3.24Å; D651-E653 PolarHBondContact OD1-N 2.92Å; E653-L677 VanDerWaalsContact O-CB 3.25Å; E653-L677 WeakPolarHBondContact O-CB 3.36Å; E653-L677 WeakPolarHBondContact O-CG 3.43Å; E653-L677 PolarHBondContact O-N 3.49Å
654	T	96.1	Very high	93.2	Very high	28 Å²	28	33.1 Å²	33.1	17%	0.172	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	137.3	-170.8	-36.1	0	0	0	0	112.1	Y650 D651 Q674 L675	Y650-T654 WeakPolarHBondContact CB-O 3.16Å; Y650-T654 PolarHBondContact N-O 3.39Å; D651-T654 PolarHBondContact N-O 2.84Å; D651-T654 PolarHBondContact O-N 2.83Å; D651-T654 VanDerWaalsContact OD1-CB 3.29Å; D651-T654 WeakPolarHBondContact OD1-CB 3.37Å; D651-T654 PolarHBondContact OD1-N 2.85Å; D651-T654 PolarHBondContact OD1-OG1 2.76Å; T654-Q674 HydrophobicContact CG2-CB 3.92Å; T654-Q674 HydrophobicContact CG2-CG 4.45Å; T654-L675 WeakPolarHBondContact CA-O 3.29Å
655	V	97.6	Very high	92.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.9	177.3	178.8	0	0	0	0	110.1	L587 M598 A647 F649 V657 L675 L677	L587-V655 HydrophobicContact CD1-CG1 3.52Å; L587-V655 HydrophobicContact CD1-CG2 4.41Å; L587-V655 HydrophobicContact CD2-CG1 4.43Å; L587-V655 HydrophobicContact CD2-CG2 4.45Å; M598-V655 HydrophobicContact CE-CG1 3.92Å; A647-V655 HydrophobicContact CB-CG1 4.27Å; F649-V655 HydrophobicContact CD1-CG2 4.18Å; F649-V655 HydrophobicContact CD2-CG2 4.32Å; F649-V655 HydrophobicContact CE1-CG2 4.07Å; F649-V655 HydrophobicContact CE2-CG2 4.23Å; F649-V655 HydrophobicContact CG-CG2 4.29Å; F649-V655 HydrophobicContact CZ-CG2 4.07Å; V655-V657 HydrophobicContact CG1-CG2 3.9Å; V655-L675 HydrophobicContact CB-CB 4.22Å; V655-L675 PolarHBondContact N-O 3.03Å; V655-L675 WeakPolarHBondContact O-CB 3.38Å; V655-L675 PolarHBondContact O-N 2.75Å; V655-L677 HydrophobicContact CG2-CD1 4.22Å; V655-L677 HydrophobicContact CG2-CD2 3.9Å; V655-L677 HydrophobicContact CG2-CG 4.19Å
656	T	97.5	Very high	91.2	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	128.3	171.8	-46.8	0	0	0	0	109.6	A647 Q648 L672 Q674 V728	A647-T656 WeakPolarHBondContact CA-O 3.22Å; Q648-T656 PolarHBondContact N-O 2.95Å; Q648-T656 PolarHBondContact O-N 2.84Å; T656-L672 HydrophobicContact CG2-CD1 3.51Å; T656-L672 HydrophobicContact CG2-CG 4.34Å; T656-Q674 PolarHBondContact OG1-NE2 2.76Å; T656-V728 HydrophobicContact CG2-CG2 3.65Å
657	V	97.1	Very high	90.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.7	-177.5	-171.8	0	0	0	0	110.8	M598 F620 A647 V655 L659 V673 L675	M598-V657 HydrophobicContact CE-CG2 3.94Å; M598-V657 HydrophobicContact SD-CG1 4.11Å; M598-V657 HydrophobicContact SD-CG2 3.77Å; F620-V657 HydrophobicContact CZ-CG1 4.2Å; A647-V657 HydrophobicContact CB-CB 4.43Å; A647-V657 HydrophobicContact CB-CG1 4.22Å; A647-V657 HydrophobicContact CB-CG2 4Å; V655-V657 HydrophobicContact CG1-CG2 3.9Å; V657-L659 HydrophobicContact CG1-CD2 3.69Å; V657-L659 HydrophobicContact CG1-CG 4.24Å; V657-V673 HydrophobicContact CB-CG1 3.74Å; V657-V673 PolarHBondContact N-O 3.02Å; V657-V673 PolarHBondContact O-N 2.86Å; V657-L675 HydrophobicContact CG2-CB 4.31Å
658	I	96.6	Very high	89.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.9	168	-64.1	175.8	0	0	0	109.4	L645 D646 I671 L672 A725 Y727 V728 V739	L645-I658 HydrophobicContact CB-CG2 4.28Å; L645-I658 HydrophobicContact CD1-CG2 4.04Å; L645-I658 HydrophobicContact CG-CG2 4.48Å; L645-I658 PolarHBondContact N-O 2.86Å; D646-I658 PolarHBondContact O-N 2.87Å; I658-I671 WeakPolarHBondContact CA-O 3.49Å; I658-L672 HydrophobicContact CG1-CD1 4.09Å; I658-A725 HydrophobicContact CD1-CB 4.47Å; I658-A725 HydrophobicContact CG2-CB 4.35Å; I658-Y727 WeakPolarHBondContact CD1-O 3.46Å; I658-V728 HydrophobicContact CD1-CB 3.71Å; I658-V728 HydrophobicContact CG1-CB 4.02Å; I658-V739 HydrophobicContact CD1-CG1 3.91Å; I658-V739 HydrophobicContact CD1-CG2 4.47Å
659	L	95.3	Very high	89.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	146.6	178	-56.3	176.1	0	0	0	111	F620 F623 S643 C644 V657 R670 I671 V673	F620-L659 HydrophobicContact CB-CD1 4.04Å; F620-L659 HydrophobicContact CD1-CD1 3.59Å; F620-L659 HydrophobicContact CD2-CD1 3.89Å; F620-L659 HydrophobicContact CD2-CD2 3.69Å; F620-L659 HydrophobicContact CD2-CG 4.47Å; F620-L659 HydrophobicContact CE1-CD1 4Å; F620-L659 HydrophobicContact CE1-CD2 4.47Å; F620-L659 HydrophobicContact CE2-CD1 4.26Å; F620-L659 HydrophobicContact CE2-CD2 3.54Å; F620-L659 HydrophobicContact CG-CD1 3.55Å; F620-L659 HydrophobicContact CG-CD2 4.25Å; F620-L659 HydrophobicContact CZ-CD1 4.32Å; F620-L659 HydrophobicContact CZ-CD2 3.97Å; F623-L659 HydrophobicContact CE1-CD1 4.41Å; F623-L659 HydrophobicContact CE2-CD1 4.1Å; F623-L659 HydrophobicContact CZ-CD1 3.47Å; F623-L659 VanDerWaalsContact CZ-CD1 3.47Å; S643-L659 CarbonylContact O-C 3.54Å; S643-L659 WeakPolarHBondContact O-CA 3.06Å; C644-L659 HydrophobicContact CB-CD2 4.17Å; V657-L659 HydrophobicContact CG1-CD2 3.69Å; V657-L659 HydrophobicContact CG1-CG 4.24Å; L659-R670 WeakPolarHBondContact O-CA 3.32Å; L659-I671 HydrophobicContact CB-CB 4.34Å; L659-I671 PolarHBondContact N-O 2.78Å; L659-I671 PolarHBondContact O-N 3.18Å; L659-V673 HydrophobicContact CD1-CG1 3.94Å; L659-V673 HydrophobicContact CG-CG1 4.24Å
660	K	93.4	Very high	89.1	Confident	83 Å²	83	54 Å²	54	36%	0.361	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.1	167.2	167.3	167.1	-170	-168.5	0	109.5	Y642 S643 L645 D669	Y642-K660 CarbonylContact C-O 3.21Å; Y642-K660 WeakPolarHBondContact CA-O 3.36Å; S643-K660 PolarHBondContact N-O 2.99Å; S643-K660 PolarHBondContact O-N 2.48Å; L645-K660 HydrophobicContact CD1-CB 4.07Å; L645-K660 HydrophobicContact CD2-CB 4.01Å; L645-K660 HydrophobicContact CD2-CD 4.49Å; L645-K660 HydrophobicContact CG-CB 4.06Å; K660-D669 VanDerWaalsContact CA-O 3.32Å; K660-D669 WeakPolarHBondContact CA-O 3.36Å
661	D	91.1	Very high	89	Confident	16 Å²	16	52.9 Å²	52.9	9%	0.086	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	123.4	166.7	-166.6	-30.2	0	0	0	109.2	S640 Y642 M663 G664 D669	S640-D661 VanDerWaalsContact CB-OD1 3.27Å; S640-D661 WeakPolarHBondContact CB-OD1 3.4Å; S640-D661 WeakPolarHBondContact CB-OD2 3.09Å; S640-D661 PolarHBondContact OG-OD1 3.14Å; S640-D661 PolarHBondContact OG-OD2 2.8Å; Y642-D661 HydrophobicContact CD1-CB 4.11Å; Y642-D661 HydrophobicContact CE1-CB 3.95Å; D661-M663 PolarHBondContact O-N 2.98Å; D661-M663 PolarHBondContact OD1-N 3.32Å; D661-G664 PolarHBondContact O-N 2.9Å; D661-G664 PolarHBondContact OD1-N 3.45Å; D661-D669 PolarHBondContact N-O 2.66Å
662	S	85.3	Confident	89.1	Confident	64 Å²	64	50.4 Å²	50.4	45%	0.448	25%	0.245	S	C	.	.	S	Bend	trans	-69.3	-23.8	179.6	-53.5	0	0	0	0	113	T641	T641-S662 VanDerWaalsContact O-CB 3.31Å; T641-S662 WeakPolarHBondContact O-CB 3.36Å; T641-S662 PolarHBondContact O-N 3.24Å; T641-S662 VanDerWaalsContact O-N 3.1Å; T641-S662 PolarHBondContact O-OG 3.33Å
663	M	81.9	Confident	89.2	Confident	159 Å²	159	48.5 Å²	48.5	78%	0.783	24%	0.235	S	C	*	.	S	Bend	trans	-108	0.8	-178.5	-59.3	-60	-68.8	0	0	112.6	D661	D661-M663 PolarHBondContact O-N 2.98Å; D661-M663 PolarHBondContact OD1-N 3.32Å
664	G	76.2	Confident	89.3	Confident	25 Å²	25	42.8 Å²	42.8	26%	0.258	21%	0.209	S	C	.	.	P	Polyproline II helix	trans	-68	141.3	-178.9	0	0	0	0	0	112.8	D661	D661-G664 PolarHBondContact O-N 2.9Å; D661-G664 PolarHBondContact OD1-N 3.45Å
665	R	74.3	Confident	89.3	Confident	190 Å²	190	41.5 Å²	41.5	72%	0.717	20%	0.2	S	C	*	.	P	Polyproline II helix	trans	-67.6	148.9	171	-66.9	-175.9	-176.4	173.8	3.9	110.2	G667 R668 D669	R665-G667 PolarHBondContact O-N 3.42Å; R665-R668 CarbonylContact O-C 3.6Å; R665-R668 PolarHBondContact O-N 3.2Å; R665-D669 PolarHBondContact O-N 2.91Å
666	E	71.7	Confident	89.3	Confident	156 Å²	156	43.2 Å²	43.2	73%	0.729	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	121.1	-179.7	-165.1	172	-171.3	0	0	110.6	K724	E666-K724 WeakPolarHBondContact OE1-CE 3.39Å; E666-K724 IonicContact OE1-NZ 2.59Å; E666-K724 PolarHBondContact OE1-NZ 3.46Å
667	G	74.2	Confident	89.1	Confident	17 Å²	17	43.6 Å²	43.6	18%	0.175	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.3	-6.9	-176.7	0	0	0	0	0	115.5	R665 S722	R665-G667 PolarHBondContact O-N 3.42Å; G667-S722 PolarHBondContact O-N 2.73Å
668	R	82.6	Confident	88.9	Confident	107 Å²	107	47.1 Å²	47.1	40%	0.404	24%	0.238	S	C	.	.	S	Bend	trans	-133.5	31.7	169.6	-70.5	-172.9	179.8	173.5	1	111.4	R665 L719 S763	R665-R668 CarbonylContact O-C 3.6Å; R665-R668 PolarHBondContact O-N 3.2Å; R668-L719 HydrophobicContact CB-CD2 4.25Å; R668-L719 HydrophobicContact CG-CD2 4.37Å; R668-S763 PolarHBondContact NH2-OG 3.36Å; R668-S763 VanDerWaalsContact NH2-OG 3.08Å
669	D	88.9	Confident	88.6	Confident	19 Å²	19	51.9 Å²	51.9	10%	0.102	26%	0.263	C	S	.	.			trans	-108.4	10.4	-174	66.4	-33.8	0	0	0	113.2	K660 D661 R665	K660-D669 VanDerWaalsContact CA-O 3.32Å; K660-D669 WeakPolarHBondContact CA-O 3.36Å; D661-D669 PolarHBondContact N-O 2.66Å; R665-D669 PolarHBondContact O-N 2.91Å
670	R	93.5	Very high	88.5	Confident	20 Å²	20	52 Å²	52	8%	0.075	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	132.6	-178.2	-66.2	-66.5	-179.2	-78.4	-10.3	111.4	L645 L659 L720 A725	L645-R670 VanDerWaalsContact CD1-NE 3.27Å; L659-R670 WeakPolarHBondContact O-CA 3.32Å; R670-L720 HydrophobicContact CB-CB 4.09Å; R670-L720 HydrophobicContact CB-CD1 4.34Å; R670-L720 WeakPolarHBondContact O-CB 3.28Å; R670-L720 PolarHBondContact O-N 2.76Å; R670-A725 HydrophobicContact CB-CB 4.13Å; R670-A725 WeakPolarHBondContact CD-O 3.25Å; R670-A725 HydrophobicContact CG-CB 4.19Å; R670-A725 PolarHBondContact NE-O 2.92Å
671	I	93.9	Very high	88.4	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.5	-179.5	-59.1	170.1	0	0	0	109	F623 Y642 I658 L659 W717 L719	F623-I671 HydrophobicContact CD1-CG2 4.46Å; F623-I671 HydrophobicContact CD2-CD1 4.13Å; F623-I671 HydrophobicContact CE1-CG2 4.29Å; F623-I671 HydrophobicContact CE2-CD1 4.23Å; Y642-I671 HydrophobicContact CD1-CD1 4.06Å; Y642-I671 HydrophobicContact CE1-CD1 3.45Å; Y642-I671 VanDerWaalsContact CE1-CD1 3.45Å; I658-I671 WeakPolarHBondContact CA-O 3.49Å; L659-I671 HydrophobicContact CB-CB 4.34Å; L659-I671 PolarHBondContact N-O 2.78Å; L659-I671 PolarHBondContact O-N 3.18Å; I671-W717 HydrophobicContact CG2-CE3 4.13Å; I671-L719 HydrophobicContact CD1-CD1 4.46Å; I671-L719 HydrophobicContact CG1-CD1 3.7Å
672	L	96.1	Very high	88.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	126	168	-175	64.6	0	0	0	108.5	F11 T656 I658 W717 R718 L720 V728 V739 F750 M752	F11-L672 HydrophobicContact CD2-CD2 3.83Å; F11-L672 HydrophobicContact CD2-CG 4.25Å; F11-L672 HydrophobicContact CE2-CB 4.34Å; F11-L672 HydrophobicContact CE2-CD2 4.04Å; F11-L672 HydrophobicContact CE2-CG 3.98Å; T656-L672 HydrophobicContact CG2-CD1 3.51Å; T656-L672 HydrophobicContact CG2-CG 4.34Å; I658-L672 HydrophobicContact CG1-CD1 4.09Å; L672-W717 CarbonylContact O-C 3.47Å; L672-W717 VanDerWaalsContact O-CA 3.28Å; L672-W717 WeakPolarHBondContact O-CA 3.45Å; L672-R718 PolarHBondContact N-O 2.86Å; L672-R718 PolarHBondContact O-N 2.81Å; L672-L720 HydrophobicContact CB-CD1 4.22Å; L672-L720 HydrophobicContact CB-CD2 4.14Å; L672-L720 HydrophobicContact CB-CG 4.2Å; L672-V728 HydrophobicContact CD1-CG2 4.2Å; L672-V739 HydrophobicContact CD1-CG2 4.2Å; L672-V739 HydrophobicContact CD2-CG2 4.21Å; L672-F750 HydrophobicContact CD2-CD2 4.15Å; L672-F750 HydrophobicContact CD2-CE2 4.23Å; L672-F750 HydrophobicContact CD2-CG 4.46Å; L672-M752 HydrophobicContact CD2-CE 4.04Å; L672-M752 HydrophobicContact CD2-SD 4.46Å
673	V	96.1	Very high	88.1	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	140.6	-178.6	61.6	0	0	0	0	111.4	F620 F623 V657 L659 F713 W717	F620-V673 HydrophobicContact CE1-CG1 4.07Å; F623-V673 HydrophobicContact CE1-CB 4.13Å; F623-V673 HydrophobicContact CE1-CG2 3.91Å; V657-V673 HydrophobicContact CB-CG1 3.74Å; V657-V673 PolarHBondContact N-O 3.02Å; V657-V673 PolarHBondContact O-N 2.86Å; L659-V673 HydrophobicContact CD1-CG1 3.94Å; L659-V673 HydrophobicContact CG-CG1 4.24Å; V673-F713 HydrophobicContact CG2-CD1 3.41Å; V673-F713 VanDerWaalsContact CG2-CD1 3.41Å; V673-F713 HydrophobicContact CG2-CD2 4.36Å; V673-F713 HydrophobicContact CG2-CE1 3.45Å; V673-F713 VanDerWaalsContact CG2-CE1 3.45Å; V673-F713 HydrophobicContact CG2-CE2 4.42Å; V673-F713 HydrophobicContact CG2-CG 3.89Å; V673-F713 HydrophobicContact CG2-CZ 3.98Å; V673-W717 HydrophobicContact CB-CB 4.18Å; V673-W717 HydrophobicContact CG2-CB 4.09Å
674	Q	96.6	Very high	88.2	Confident	14 Å²	14	53.4 Å²	53.4	7%	0.065	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	117.8	165.5	-73.2	-66.4	-12.6	0	0	109.4	F11 T654 T656 P676 H716 M752	F11-Q674 HydrophobicContact CE1-CG 3.99Å; F11-Q674 HydrophobicContact CZ-CB 4.44Å; F11-Q674 HydrophobicContact CZ-CG 3.73Å; T654-Q674 HydrophobicContact CG2-CB 3.92Å; T654-Q674 HydrophobicContact CG2-CG 4.45Å; T656-Q674 PolarHBondContact OG1-NE2 2.76Å; Q674-P676 VanDerWaalsContact O-CD 3.27Å; Q674-P676 WeakPolarHBondContact O-CD 3.37Å; Q674-H716 HydrophobicContact CB-CB 4.01Å; Q674-H716 HydrophobicContact CG-CB 4.48Å; Q674-H716 PolarHBondContact N-O 2.96Å; Q674-M752 HydrophobicContact CG-CE 3.99Å
675	L	96.4	Very high	88.6	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	107.2	179.5	170.7	57.1	0	0	0	110.4	M598 I600 I618 T654 V655 V657 L677 V680 M711 F713	M598-L675 HydrophobicContact CE-CD2 4.03Å; M598-L675 HydrophobicContact SD-CD2 4.27Å; I600-L675 HydrophobicContact CD1-CD2 4.22Å; I618-L675 HydrophobicContact CG1-CD2 4.46Å; T654-L675 WeakPolarHBondContact CA-O 3.29Å; V655-L675 HydrophobicContact CB-CB 4.22Å; V655-L675 PolarHBondContact N-O 3.03Å; V655-L675 WeakPolarHBondContact O-CB 3.38Å; V655-L675 PolarHBondContact O-N 2.75Å; V657-L675 HydrophobicContact CG2-CB 4.31Å; L675-L677 PolarHBondContact O-N 3.46Å; L675-V680 HydrophobicContact CD1-CG2 3.62Å; L675-V680 HydrophobicContact CD2-CG2 4.29Å; L675-V680 HydrophobicContact CG-CG2 4.09Å; L675-M711 HydrophobicContact CD1-CE 3.11Å; L675-M711 HydrophobicContact CD1-SD 3.4Å; L675-M711 WeakPolarHBondContact CD1-SD 3.44Å; L675-M711 HydrophobicContact CD2-CE 4.28Å; L675-M711 HydrophobicContact CG-CE 4.32Å; L675-F713 HydrophobicContact CD1-CE1 4.27Å; L675-F713 HydrophobicContact CD1-CZ 3.98Å
676	P	95.7	Very high	88.5	Confident	36 Å²	36	46 Å²	46	23%	0.234	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	118.5	175.6	30	-34.9	0	0	0	111.4	Q674 S678 L679 V680	Q674-P676 VanDerWaalsContact O-CD 3.27Å; Q674-P676 WeakPolarHBondContact O-CD 3.37Å; P676-S678 PolarHBondContact O-N 3.23Å; P676-L679 HydrophobicContact CB-CG 4.32Å; P676-L679 HydrophobicContact CG-CB 4.13Å; P676-L679 HydrophobicContact CG-CD1 3.59Å; P676-L679 HydrophobicContact CG-CG 3.81Å; P676-L679 PolarHBondContact O-N 3.35Å; P676-V680 PolarHBondContact O-N 2.94Å
677	L	94.1	Very high	88.8	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-67.8	-24.2	178.4	-63.1	-179.7	0	0	0	112.8	I600 F649 E653 V655 L675 L679 V680 Y681	I600-L677 HydrophobicContact CD1-CD2 4.03Å; F649-L677 HydrophobicContact CE1-CD1 3.67Å; F649-L677 HydrophobicContact CZ-CD1 4.19Å; E653-L677 VanDerWaalsContact O-CB 3.25Å; E653-L677 WeakPolarHBondContact O-CB 3.36Å; E653-L677 WeakPolarHBondContact O-CG 3.43Å; E653-L677 PolarHBondContact O-N 3.49Å; V655-L677 HydrophobicContact CG2-CD1 4.22Å; V655-L677 HydrophobicContact CG2-CD2 3.9Å; V655-L677 HydrophobicContact CG2-CG 4.19Å; L675-L677 PolarHBondContact O-N 3.46Å; L677-L679 VanDerWaalsContact C-N 3.27Å; L677-L679 PolarHBondContact O-N 3.03Å; L677-V680 HydrophobicContact CD2-CG2 4.42Å; L677-V680 PolarHBondContact O-N 3.16Å; L677-Y681 HydrophobicContact CB-CD2 4.29Å; L677-Y681 HydrophobicContact CD2-CE2 4.29Å; L677-Y681 WeakPolarHBondContact O-CD2 3.06Å; L677-Y681 PolarHBondContact O-N 3.07Å
678	S	92.3	Very high	89.2	Confident	75 Å²	75	52.9 Å²	52.9	52%	0.524	27%	0.273	S	S	.	.	H	α-helix	trans	-61.5	-35.1	172.6	54.6	0	0	0	0	112.5	P676 Y681 N682	P676-S678 PolarHBondContact O-N 3.23Å; S678-Y681 CarbonylContact O-C 3.58Å; S678-N682 PolarHBondContact O-N 3.32Å
679	L	91.6	Very high	89.4	Confident	100 Å²	100	49.9 Å²	49.9	52%	0.524	26%	0.262	S	S	.	.	H	α-helix	trans	-79.8	-30.3	173.5	-59.8	-174.5	0	0	0	112.1	P676 L677 R709	P676-L679 HydrophobicContact CB-CG 4.32Å; P676-L679 HydrophobicContact CG-CB 4.13Å; P676-L679 HydrophobicContact CG-CD1 3.59Å; P676-L679 HydrophobicContact CG-CG 3.81Å; P676-L679 PolarHBondContact O-N 3.35Å; L677-L679 VanDerWaalsContact C-N 3.27Å; L677-L679 PolarHBondContact O-N 3.03Å; L679-R709 PolarHBondContact O-NE 2.88Å; L679-R709 PolarHBondContact O-NH1 2.7Å; L679-R709 PolarHBondContact O-NH2 3.46Å; L679-R709 VanDerWaalsContact O-NH2 3.14Å
680	V	92	Very high	89.3	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-66.9	-44.8	175.7	176.5	0	0	0	0	111.1	I616 I618 L675 P676 L677 R709 M711	I616-V680 HydrophobicContact CD1-CG1 3.95Å; I616-V680 HydrophobicContact CG2-CG1 3.97Å; I618-V680 HydrophobicContact CD1-CG1 3.94Å; I618-V680 HydrophobicContact CD1-CG2 4.16Å; L675-V680 HydrophobicContact CD1-CG2 3.62Å; L675-V680 HydrophobicContact CD2-CG2 4.29Å; L675-V680 HydrophobicContact CG-CG2 4.09Å; P676-V680 PolarHBondContact O-N 2.94Å; L677-V680 HydrophobicContact CD2-CG2 4.42Å; L677-V680 PolarHBondContact O-N 3.16Å; V680-R709 WeakPolarHBondContact O-CD 3.47Å; V680-R709 PolarHBondContact O-NH1 2.88Å; V680-M711 HydrophobicContact CG2-CE 4.15Å; V680-M711 HydrophobicContact CG2-SD 3.72Å
681	Y	90.9	Very high	89.2	Confident	36 Å²	36	54.6 Å²	54.6	14%	0.141	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	40.1	-179.2	-59.6	-69.4	0	0	0	111.6	Y585 I600 R602 N613 I616 L677 S678 S683	Y585-Y681 AromaticContact CE1-CE2 3.87Å; Y585-Y681 HydrophobicContact CE1-CE2 3.87Å; I600-Y681 WeakPolarHBondContact CG2-OH 3.4Å; R602-Y681 VanDerWaalsContact NH1-CG 3.31Å; N613-Y681 HydrophobicContact CB-CD1 3.91Å; N613-Y681 HydrophobicContact CB-CE1 3.89Å; I616-Y681 HydrophobicContact CG2-CE1 4.17Å; L677-Y681 HydrophobicContact CB-CD2 4.29Å; L677-Y681 HydrophobicContact CD2-CE2 4.29Å; L677-Y681 WeakPolarHBondContact O-CD2 3.06Å; L677-Y681 PolarHBondContact O-N 3.07Å; S678-Y681 CarbonylContact O-C 3.58Å; Y681-S683 PolarHBondContact O-N 3.21Å
682	N	88.5	Confident	89	Confident	41 Å²	41	60.1 Å²	60.1	22%	0.219	32%	0.318	C	S	.	.			trans	-58.4	129.9	173.9	-177.5	11.1	0	0	0	109.5	S678 E684 D685 A686	S678-N682 PolarHBondContact O-N 3.32Å; N682-E684 PolarHBondContact ND2-OE2 2.87Å; N682-E684 PolarHBondContact O-N 3.39Å; N682-E684 PolarHBondContact OD1-N 3Å; N682-D685 WeakPolarHBondContact CB-OD1 3.29Å; N682-A686 WeakPolarHBondContact O-CB 3.43Å; N682-A686 PolarHBondContact O-N 2.79Å
683	S	82.1	Confident	88.6	Confident	104 Å²	104	61 Å²	61	73%	0.727	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-24.3	-177.6	49.1	0	0	0	0	113.4	Y681 D685	Y681-S683 PolarHBondContact O-N 3.21Å; S683-D685 PolarHBondContact O-N 2.93Å
684	E	83.8	Confident	88.5	Confident	172 Å²	172	64.9 Å²	64.9	80%	0.804	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-33.7	-174.7	-63.2	176.3	157.5	0	0	112.9	N682	N682-E684 PolarHBondContact ND2-OE2 2.87Å; N682-E684 PolarHBondContact O-N 3.39Å; N682-E684 PolarHBondContact OD1-N 3Å
685	D	84.6	Confident	88.3	Confident	38 Å²	38	67.8 Å²	67.8	20%	0.203	36%	0.362	C	S	.	.	S	Bend	trans	-120.5	11.7	-177.7	60.5	-8.4	0	0	0	113.1	N682 S683 E687 E688 Y689 R709	N682-D685 WeakPolarHBondContact CB-OD1 3.29Å; S683-D685 PolarHBondContact O-N 2.93Å; D685-E687 PolarHBondContact O-N 3Å; D685-E687 VanDerWaalsContact O-N 3.13Å; D685-E688 WeakPolarHBondContact O-CB 3.49Å; D685-E688 PolarHBondContact O-N 2.94Å; D685-Y689 HydrophobicContact CB-CD2 4.49Å; D685-Y689 HydrophobicContact CB-CE2 4.13Å; D685-Y689 VanDerWaalsContact O-CD2 3.32Å; D685-Y689 WeakPolarHBondContact O-CD2 3.27Å; D685-Y689 WeakPolarHBondContact OD2-CE2 3.41Å; D685-R709 IonicContact OD1-CZ 3.68Å; D685-R709 VanDerWaalsContact OD1-CZ 3.25Å; D685-R709 IonicContact OD1-NH1 3.1Å; D685-R709 PolarHBondContact OD1-NH1 2.87Å; D685-R709 IonicContact OD1-NH2 3.21Å; D685-R709 PolarHBondContact OD1-NH2 2.96Å; D685-R709 IonicContact OD2-CZ 3.69Å; D685-R709 IonicContact OD2-NH1 2.69Å; D685-R709 PolarHBondContact OD2-NH1 2.82Å; D685-R709 IonicContact OD2-NH2 2.84Å; D685-R709 PolarHBondContact OD2-NH2 2.8Å
686	A	72.9	Confident	88	Confident	22 Å²	22	72.1 Å²	72.1	18%	0.182	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.4	-179.6	0	0	0	0	0	113.7	N613 N682 E688	N613-A686 PolarHBondContact ND2-O 2.94Å; N682-A686 WeakPolarHBondContact O-CB 3.43Å; N682-A686 PolarHBondContact O-N 2.79Å; A686-E688 VanDerWaalsContact C-N 3.35Å
687	E	77.8	Confident	87.9	Confident	169 Å²	169	73.2 Å²	73.2	79%	0.79	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-24.7	177.4	-66.4	-169.8	169.9	0	0	113.3	D685	D685-E687 PolarHBondContact O-N 3Å; D685-E687 VanDerWaalsContact O-N 3.13Å
688	E	83.4	Confident	88	Confident	147 Å²	147	75 Å²	75	69%	0.687	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-31.9	179.9	-169	175.5	-176.7	0	0	111.7	D685 A686 Q690	D685-E688 WeakPolarHBondContact O-CB 3.49Å; D685-E688 PolarHBondContact O-N 2.94Å; A686-E688 VanDerWaalsContact C-N 3.35Å; E688-Q690 PolarHBondContact O-N 2.79Å
689	Y	85.7	Confident	88.1	Confident	44 Å²	44	71.4 Å²	71.4	17%	0.173	38%	0.379	C	S	.	.	S	Bend	trans	-100.4	58.5	-176.5	-59.3	-78.9	0	0	0	112.3	N613 D685 P707 T708 R709	N613-Y689 PolarHBondContact ND2-O 2.96Å; D685-Y689 HydrophobicContact CB-CD2 4.49Å; D685-Y689 HydrophobicContact CB-CE2 4.13Å; D685-Y689 VanDerWaalsContact O-CD2 3.32Å; D685-Y689 WeakPolarHBondContact O-CD2 3.27Å; D685-Y689 WeakPolarHBondContact OD2-CE2 3.41Å; Y689-P707 HydrophobicContact CD1-CB 4.21Å; Y689-T708 WeakPolarHBondContact CE1-O 3.02Å; Y689-R709 HydrophobicContact CD1-CB 4.33Å; Y689-R709 HydrophobicContact CE1-CB 4.09Å; Y689-R709 HydrophobicContact CE1-CG 4.35Å; Y689-R709 HydrophobicContact CE2-CG 4.43Å
690	Q	87.1	Confident	88.2	Confident	110 Å²	110	68.5 Å²	68.5	51%	0.514	36%	0.364	S	S	.	.			trans	-100.7	133.3	174.5	-67.5	-174.3	3.3	0	0	111.6	E688 T692	E688-Q690 PolarHBondContact O-N 2.79Å; Q690-T692 PolarHBondContact O-N 2.93Å
691	F	92.3	Very high	88.2	Confident	28 Å²	28	74.3 Å²	74.3	12%	0.123	39%	0.392	C	S	.	.			trans	-74.9	115.8	174.5	179.1	-119	0	0	0	110	L615 G693 Y695 L699 I705 I706 P707	L615-F691 HydrophobicContact CB-CB 4.3Å; L615-F691 HydrophobicContact CB-CG 4.35Å; L615-F691 HydrophobicContact CD2-CD1 4.4Å; L615-F691 HydrophobicContact CD2-CD2 4Å; L615-F691 HydrophobicContact CD2-CE1 4.39Å; L615-F691 HydrophobicContact CD2-CE2 3.99Å; L615-F691 HydrophobicContact CD2-CG 4.2Å; L615-F691 HydrophobicContact CD2-CZ 4.18Å; F691-G693 WeakPolarHBondContact CE1-O 3.43Å; F691-G693 VanDerWaalsContact CZ-CA 3.42Å; F691-Y695 AromaticContact CD1-CE1 3.94Å; F691-Y695 HydrophobicContact CD1-CE1 3.94Å; F691-Y695 HydrophobicContact CD1-CE2 4.14Å; F691-Y695 AromaticContact CD1-CZ 3.71Å; F691-Y695 HydrophobicContact CE1-CD1 4.19Å; F691-Y695 HydrophobicContact CE1-CE1 4.02Å; F691-Y695 HydrophobicContact CE1-CE2 4.45Å; F691-Y695 HydrophobicContact CE1-CG 4.48Å; F691-L699 HydrophobicContact CZ-CD2 4.14Å; F691-I705 HydrophobicContact CE2-CG2 4.28Å; F691-I706 HydrophobicContact CD2-CG1 4.5Å; F691-I706 HydrophobicContact CE2-CG1 4.13Å; F691-P707 HydrophobicContact CB-CG 4.36Å
692	T	88.4	Confident	88.2	Confident	118 Å²	118	73.5 Å²	73.5	72%	0.724	39%	0.389	S	S	*	.			trans	-96.5	-4	-178.9	52.4	0	0	0	0	113.4	Q690 I705	Q690-T692 PolarHBondContact O-N 2.93Å; T692-I705 VanDerWaalsContact OG1-CG2 3.29Å; T692-I705 WeakPolarHBondContact OG1-CG2 3.29Å
693	G	89.4	Confident	88	Confident	19 Å²	19	72 Å²	72	20%	0.196	38%	0.384	C	S	.	.	S	Bend	trans	-80.8	-167.2	176.2	0	0	0	0	0	113.4	F691	F691-G693 WeakPolarHBondContact CE1-O 3.43Å; F691-G693 VanDerWaalsContact CZ-CA 3.42Å
694	T	92.3	Very high	88.1	Confident	80 Å²	80	72.4 Å²	72.4	49%	0.491	39%	0.386	S	S	.	.			trans	-120.3	138.2	-179.6	-47.4	0	0	0	0	111.4	S696 T697 Q702	T694-S696 VanDerWaalsContact C-N 3.28Å; T694-S696 WeakPolarHBondContact CG2-OG 3.38Å; T694-S696 PolarHBondContact O-N 2.89Å; T694-T697 PolarHBondContact O-OG1 2.89Å; T694-Q702 PolarHBondContact O-NE2 2.9Å; T694-Q702 VanDerWaalsContact O-NE2 3.11Å
695	Y	92.8	Very high	88.5	Confident	75 Å²	75	67.4 Å²	67.4	29%	0.294	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-8.3	177.8	-64.1	-72.5	0	0	0	114.4	I554 L601 L615 F691	I554-Y695 HydrophobicContact CD1-CD1 4.04Å; I554-Y695 HydrophobicContact CD1-CG 4.41Å; I554-Y695 HydrophobicContact CG2-CD1 4.24Å; L601-Y695 HydrophobicContact CD1-CE1 3.89Å; L615-Y695 HydrophobicContact CB-CE1 4.27Å; F691-Y695 AromaticContact CD1-CE1 3.94Å; F691-Y695 HydrophobicContact CD1-CE1 3.94Å; F691-Y695 HydrophobicContact CD1-CE2 4.14Å; F691-Y695 AromaticContact CD1-CZ 3.71Å; F691-Y695 HydrophobicContact CE1-CD1 4.19Å; F691-Y695 HydrophobicContact CE1-CE1 4.02Å; F691-Y695 HydrophobicContact CE1-CE2 4.45Å; F691-Y695 HydrophobicContact CE1-CG 4.48Å
696	S	91.4	Very high	88.9	Confident	91 Å²	91	65.9 Å²	65.9	64%	0.636	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-21.5	178.7	60.6	0	0	0	0	113.3	T694	T694-S696 VanDerWaalsContact C-N 3.28Å; T694-S696 WeakPolarHBondContact CG2-OG 3.38Å; T694-S696 PolarHBondContact O-N 2.89Å
697	T	93.5	Very high	89.9	Confident	60 Å²	60	65.6 Å²	65.6	37%	0.368	35%	0.352	S	S	.	.	S	Bend	trans	-100.6	158.6	176.1	43.3	0	0	0	0	109.7	T694 Q702	T694-T697 PolarHBondContact O-OG1 2.89Å; T697-Q702 PolarHBondContact O-NE2 2.89Å; T697-Q702 PolarHBondContact OG1-NE2 2.98Å
698	R	94.7	Very high	90.6	Very high	44 Å²	44	59.7 Å²	59.7	17%	0.166	33%	0.328	C	S	.	.			trans	-64.6	141.5	-176.3	-151.8	165.7	62.2	-99.3	-5.3	110.6	P555 D700 E701 Q702	P555-R698 HydrophobicContact CB-CB 4.41Å; P555-R698 HydrophobicContact CB-CG 4.08Å; P555-R698 HydrophobicContact CG-CB 4.43Å; P555-R698 WeakPolarHBondContact O-CA 3.46Å; R698-D700 VanDerWaalsContact CB-OD1 3.31Å; R698-D700 WeakPolarHBondContact CB-OD1 3.43Å; R698-D700 WeakPolarHBondContact CD-OD1 3.27Å; R698-D700 WeakPolarHBondContact CG-OD1 3.46Å; R698-D700 IonicContact CZ-OD1 3.79Å; R698-D700 IonicContact CZ-OD2 3.94Å; R698-D700 VanDerWaalsContact NE-CG 3.29Å; R698-D700 IonicContact NE-OD1 3.81Å; R698-D700 PolarHBondContact NE-OD1 3.4Å; R698-D700 IonicContact NE-OD2 3.76Å; R698-D700 PolarHBondContact NE-OD2 2.81Å; R698-D700 IonicContact NH2-OD1 3.03Å; R698-D700 IonicContact NH2-OD2 2.68Å; R698-E701 HydrophobicContact CB-CG 4.33Å; R698-E701 IonicContact CZ-OE1 2.8Å; R698-E701 IonicContact NH1-OE1 3.97Å; R698-E701 PolarHBondContact NH1-OE1 3.1Å; R698-E701 VanDerWaalsContact NH2-CG 3.33Å; R698-E701 IonicContact NH2-OE1 3.45Å; R698-E701 PolarHBondContact NH2-OE1 3.12Å; R698-Q702 PolarHBondContact O-NE2 2.84Å
699	L	94.8	Very high	91.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.299	C	S	.	.	S	Bend	trans	-76.4	-31.1	-174.2	-60.4	-179.6	0	0	0	112.6	I554 P555 L556 F588 I590 L615 F691 E701 Q702 G703 I706	I554-L699 HydrophobicContact CG2-CD1 4.22Å; I554-L699 HydrophobicContact CG2-CG 4.35Å; P555-L699 PolarHBondContact O-N 2.76Å; L556-L699 HydrophobicContact CD2-CD1 3.87Å; L556-L699 WeakPolarHBondContact O-CA 3.32Å; L556-L699 WeakPolarHBondContact O-CB 3.35Å; L556-L699 PolarHBondContact O-N 2.81Å; L556-L699 VanDerWaalsContact O-N 3.09Å; F588-L699 HydrophobicContact CE2-CD1 4.23Å; F588-L699 HydrophobicContact CZ-CD1 3.72Å; I590-L699 HydrophobicContact CD1-CB 4.12Å; L615-L699 HydrophobicContact CD1-CD1 4.25Å; L615-L699 HydrophobicContact CD2-CD1 3.97Å; L615-L699 HydrophobicContact CD2-CD2 3.9Å; L615-L699 HydrophobicContact CD2-CG 4.49Å; F691-L699 HydrophobicContact CZ-CD2 4.14Å; L699-E701 VanDerWaalsContact C-N 3.34Å; L699-E701 PolarHBondContact O-N 2.92Å; L699-Q702 CarbonylContact O-C 3.57Å; L699-Q702 PolarHBondContact O-N 3.43Å; L699-Q702 VanDerWaalsContact O-N 3.1Å; L699-G703 PolarHBondContact O-N 2.77Å; L699-I706 HydrophobicContact CB-CD1 4.45Å
700	D	93.4	Very high	91.4	Very high	39 Å²	39	54.9 Å²	54.9	21%	0.209	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-61.3	-37.2	174.6	63.2	-11.4	0	0	0	113.5	L556 Y557 R558 I590 R698 Q702 G703	L556-D700 PolarHBondContact O-N 2.79Å; L556-D700 VanDerWaalsContact O-N 3.12Å; Y557-D700 WeakPolarHBondContact CA-OD2 3.35Å; R558-D700 PolarHBondContact N-OD2 3.01Å; I590-D700 HydrophobicContact CG2-CB 3.84Å; R698-D700 VanDerWaalsContact CB-OD1 3.31Å; R698-D700 WeakPolarHBondContact CB-OD1 3.43Å; R698-D700 WeakPolarHBondContact CD-OD1 3.27Å; R698-D700 WeakPolarHBondContact CG-OD1 3.46Å; R698-D700 IonicContact CZ-OD1 3.79Å; R698-D700 IonicContact CZ-OD2 3.94Å; R698-D700 VanDerWaalsContact NE-CG 3.29Å; R698-D700 IonicContact NE-OD1 3.81Å; R698-D700 PolarHBondContact NE-OD1 3.4Å; R698-D700 IonicContact NE-OD2 3.76Å; R698-D700 PolarHBondContact NE-OD2 2.81Å; R698-D700 IonicContact NH2-OD1 3.03Å; R698-D700 IonicContact NH2-OD2 2.68Å; D700-Q702 PolarHBondContact O-N 3.35Å; D700-G703 PolarHBondContact O-N 3.33Å
701	E	92.1	Very high	91.6	Very high	124 Å²	124	50.4 Å²	50.4	58%	0.579	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-65.5	-18.7	174.7	-67.3	176.5	175.4	0	0	112.7	R698 L699	R698-E701 HydrophobicContact CB-CG 4.33Å; R698-E701 IonicContact CZ-OE1 2.8Å; R698-E701 IonicContact NH1-OE1 3.97Å; R698-E701 PolarHBondContact NH1-OE1 3.1Å; R698-E701 VanDerWaalsContact NH2-CG 3.33Å; R698-E701 IonicContact NH2-OE1 3.45Å; R698-E701 PolarHBondContact NH2-OE1 3.12Å; L699-E701 VanDerWaalsContact C-N 3.34Å; L699-E701 PolarHBondContact O-N 2.92Å
702	Q	91.5	Very high	91.5	Very high	19 Å²	19	54.6 Å²	54.6	9%	0.089	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-112.8	21.5	-175.9	-63.3	172.3	80.9	0	0	112.4	T694 T697 R698 L699 D700 S704 I705 I706	T694-Q702 PolarHBondContact O-NE2 2.9Å; T694-Q702 VanDerWaalsContact O-NE2 3.11Å; T697-Q702 PolarHBondContact O-NE2 2.89Å; T697-Q702 PolarHBondContact OG1-NE2 2.98Å; R698-Q702 PolarHBondContact O-NE2 2.84Å; L699-Q702 CarbonylContact O-C 3.57Å; L699-Q702 PolarHBondContact O-N 3.43Å; L699-Q702 VanDerWaalsContact O-N 3.1Å; D700-Q702 PolarHBondContact O-N 3.35Å; Q702-S704 PolarHBondContact O-N 3.17Å; Q702-S704 VanDerWaalsContact O-N 3.09Å; Q702-I705 HydrophobicContact CB-CB 4.48Å; Q702-I705 HydrophobicContact CB-CD1 4.29Å; Q702-I705 HydrophobicContact CG-CD1 4.37Å; Q702-I705 WeakPolarHBondContact O-CB 3.37Å; Q702-I705 PolarHBondContact O-N 3.33Å; Q702-I706 PolarHBondContact O-N 2.96Å
703	G	83.8	Confident	91.5	Very high	10 Å²	10	49.4 Å²	49.4	10%	0.103	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-50.6	-38	-173.4	0	0	0	0	0	115.1	L699 D700 I705 I706	L699-G703 PolarHBondContact O-N 2.77Å; D700-G703 PolarHBondContact O-N 3.33Å; G703-I705 VanDerWaalsContact C-N 3.32Å; G703-I705 PolarHBondContact O-N 3.07Å; G703-I706 PolarHBondContact O-N 3.09Å
704	S	85.3	Confident	91.4	Very high	111 Å²	111	54.1 Å²	54.1	78%	0.776	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-72.2	-20.7	178.7	60	0	0	0	0	114.6	Q702	Q702-S704 PolarHBondContact O-N 3.17Å; Q702-S704 VanDerWaalsContact O-N 3.09Å
705	I	91.7	Very high	91	Very high	68 Å²	68	56.8 Å²	56.8	35%	0.349	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-88.6	-19.8	-179.7	-53.9	175.4	0	0	0	110.6	F691 T692 Q702 G703 P707	F691-I705 HydrophobicContact CE2-CG2 4.28Å; T692-I705 VanDerWaalsContact OG1-CG2 3.29Å; T692-I705 WeakPolarHBondContact OG1-CG2 3.29Å; Q702-I705 HydrophobicContact CB-CB 4.48Å; Q702-I705 HydrophobicContact CB-CD1 4.29Å; Q702-I705 HydrophobicContact CG-CD1 4.37Å; Q702-I705 WeakPolarHBondContact O-CB 3.37Å; Q702-I705 PolarHBondContact O-N 3.33Å; G703-I705 VanDerWaalsContact C-N 3.32Å; G703-I705 PolarHBondContact O-N 3.07Å; I705-P707 WeakPolarHBondContact O-CD 3.22Å
706	I	92.9	Very high	90.8	Very high	6 Å²	6	58 Å²	58	3%	0.031	31%	0.307	C	S	.	.	S	Bend	trans	-68	117.9	-179.6	-61.2	175.5	0	0	0	109.4	I590 L615 F691 L699 Q702 G703 T708	I590-I706 HydrophobicContact CD1-CD1 3.53Å; L615-I706 HydrophobicContact CD2-CD1 4.22Å; L615-I706 HydrophobicContact CD2-CG1 4.03Å; L615-I706 HydrophobicContact CD2-CG2 4.32Å; L615-I706 HydrophobicContact CG-CG2 4.24Å; F691-I706 HydrophobicContact CD2-CG1 4.5Å; F691-I706 HydrophobicContact CE2-CG1 4.13Å; L699-I706 HydrophobicContact CB-CD1 4.45Å; Q702-I706 PolarHBondContact O-N 2.96Å; G703-I706 PolarHBondContact O-N 3.09Å; I706-T708 PolarHBondContact O-N 2.86Å; I706-T708 PolarHBondContact O-OG1 3.1Å
707	P	93.7	Very high	90.9	Very high	16 Å²	16	54 Å²	54	10%	0.104	28%	0.278	C	S	.	.			trans	-61.6	125.5	-179.5	27	-35.1	0	0	0	108.9	L615 G617 Y689 F691 I705	L615-P707 WeakPolarHBondContact O-CG 3.48Å; G617-P707 PolarHBondContact N-O 3Å; Y689-P707 HydrophobicContact CD1-CB 4.21Å; F691-P707 HydrophobicContact CB-CG 4.36Å; I705-P707 WeakPolarHBondContact O-CD 3.22Å
708	T	92.6	Very high	90.9	Very high	45 Å²	45	52.8 Å²	52.8	28%	0.276	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	116.1	-171.7	-57.9	0	0	0	0	110.6	K597 G617 K619 Y689 I706	K597-T708 WeakPolarHBondContact CE-OG1 3.47Å; K597-T708 PolarHBondContact NZ-OG1 2.83Å; G617-T708 CarbonylContact O-C 3.58Å; G617-T708 VanDerWaalsContact O-CA 3.27Å; G617-T708 WeakPolarHBondContact O-CA 3.29Å; K619-T708 HydrophobicContact CB-CG2 3.79Å; Y689-T708 WeakPolarHBondContact CE1-O 3.02Å; I706-T708 PolarHBondContact O-N 2.86Å; I706-T708 PolarHBondContact O-OG1 3.1Å
709	R	92.9	Very high	90.7	Very high	23 Å²	23	51.5 Å²	51.5	9%	0.087	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	127.1	178.3	-167.1	170.2	-177.7	132.5	15.3	110.2	I616 G617 K619 L679 V680 D685 Y689	I616-R709 HydrophobicContact CD1-CB 4.05Å; I616-R709 HydrophobicContact CG1-CB 4.42Å; G617-R709 PolarHBondContact O-N 2.85Å; K619-R709 PolarHBondContact N-O 2.97Å; L679-R709 PolarHBondContact O-NE 2.88Å; L679-R709 PolarHBondContact O-NH1 2.7Å; L679-R709 PolarHBondContact O-NH2 3.46Å; L679-R709 VanDerWaalsContact O-NH2 3.14Å; V680-R709 WeakPolarHBondContact O-CD 3.47Å; V680-R709 PolarHBondContact O-NH1 2.88Å; D685-R709 IonicContact OD1-CZ 3.68Å; D685-R709 VanDerWaalsContact OD1-CZ 3.25Å; D685-R709 IonicContact OD1-NH1 3.1Å; D685-R709 PolarHBondContact OD1-NH1 2.87Å; D685-R709 IonicContact OD1-NH2 3.21Å; D685-R709 PolarHBondContact OD1-NH2 2.96Å; D685-R709 IonicContact OD2-CZ 3.69Å; D685-R709 IonicContact OD2-NH1 2.69Å; D685-R709 PolarHBondContact OD2-NH1 2.82Å; D685-R709 IonicContact OD2-NH2 2.84Å; D685-R709 PolarHBondContact OD2-NH2 2.8Å; Y689-R709 HydrophobicContact CD1-CB 4.33Å; Y689-R709 HydrophobicContact CE1-CB 4.09Å; Y689-R709 HydrophobicContact CE1-CG 4.35Å; Y689-R709 HydrophobicContact CE2-CG 4.43Å
710	T	92.5	Very high	90.5	Very high	67 Å²	67	51.5 Å²	51.5	41%	0.411	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	126.5	175.9	-56.3	0	0	0	0	109.5	K619	K619-T710 HydrophobicContact CG-CG2 4.43Å; K619-T710 CarbonylContact O-C 3.59Å; K619-T710 VanDerWaalsContact O-CA 3.29Å; K619-T710 WeakPolarHBondContact O-CA 3.09Å
711	M	90.8	Very high	90.1	Very high	15 Å²	15	53 Å²	53	7%	0.074	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	142.6	-178.7	-71.5	179.9	-61.9	0	0	112.5	I618 K619 G621 L675 V680 F713	I618-M711 HydrophobicContact CB-CE 4.38Å; I618-M711 HydrophobicContact CD1-CE 3.9Å; I618-M711 HydrophobicContact CG1-CE 4.39Å; I618-M711 HydrophobicContact CG2-CE 3.25Å; K619-M711 PolarHBondContact O-N 2.88Å; G621-M711 WeakPolarHBondContact CA-O 3.33Å; G621-M711 PolarHBondContact N-O 2.94Å; L675-M711 HydrophobicContact CD1-CE 3.11Å; L675-M711 HydrophobicContact CD1-SD 3.4Å; L675-M711 WeakPolarHBondContact CD1-SD 3.44Å; L675-M711 HydrophobicContact CD2-CE 4.28Å; L675-M711 HydrophobicContact CG-CE 4.32Å; V680-M711 HydrophobicContact CG2-CE 4.15Å; V680-M711 HydrophobicContact CG2-SD 3.72Å; M711-F713 HydrophobicContact CB-CD2 4.48Å; M711-F713 HydrophobicContact CB-CE2 3.65Å; M711-F713 HydrophobicContact CB-CZ 3.94Å; M711-F713 HydrophobicContact CE-CZ 4.04Å; M711-F713 HydrophobicContact SD-CZ 4.41Å
712	H	91	Very high	89.9	Confident	116 Å²	116	51.8 Å²	51.8	54%	0.537	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132.7	176.6	-58.8	-86.2	0	0	0	108.4	S622	S622-H712 PolarHBondContact N-ND1 2.89Å; S622-H712 WeakPolarHBondContact O-CA 3.23Å; S622-H712 PolarHBondContact OG-ND1 2.97Å
713	F	89.1	Confident	89.6	Confident	10 Å²	10	50.9 Å²	50.9	4%	0.044	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	113.6	-171.5	-66.5	-95	0	0	0	109.9	F620 S622 F623 T624 V673 L675 M711 W717	F620-F713 HydrophobicContact CD1-CD2 4.34Å; F620-F713 AromaticContact CD1-CE2 3.45Å; F620-F713 HydrophobicContact CD1-CE2 3.45Å; F620-F713 VanDerWaalsContact CD1-CE2 3.45Å; F620-F713 AromaticContact CD1-CZ 3.88Å; F620-F713 HydrophobicContact CD1-CZ 3.88Å; F620-F713 AromaticContact CE1-CE2 3.92Å; F620-F713 HydrophobicContact CE1-CE2 3.92Å; F620-F713 AromaticContact CE1-CZ 3.83Å; F620-F713 HydrophobicContact CE1-CZ 3.83Å; S622-F713 PolarHBondContact O-N 2.97Å; F623-F713 HydrophobicContact CD1-CB 3.74Å; F623-F713 HydrophobicContact CD1-CD2 4.19Å; F623-F713 HydrophobicContact CD1-CG 4.19Å; F623-F713 HydrophobicContact CE1-CB 3.95Å; F623-F713 AromaticContact CE1-CD2 3.64Å; F623-F713 HydrophobicContact CE1-CD2 3.64Å; F623-F713 HydrophobicContact CE1-CE2 4.38Å; F623-F713 AromaticContact CE1-CG 3.87Å; F623-F713 HydrophobicContact CE1-CG 3.87Å; F623-F713 HydrophobicContact CZ-CD2 4.09Å; T624-F713 PolarHBondContact N-O 2.9Å; V673-F713 HydrophobicContact CG2-CD1 3.41Å; V673-F713 VanDerWaalsContact CG2-CD1 3.41Å; V673-F713 HydrophobicContact CG2-CD2 4.36Å; V673-F713 HydrophobicContact CG2-CE1 3.45Å; V673-F713 VanDerWaalsContact CG2-CE1 3.45Å; V673-F713 HydrophobicContact CG2-CE2 4.42Å; V673-F713 HydrophobicContact CG2-CG 3.89Å; V673-F713 HydrophobicContact CG2-CZ 3.98Å; L675-F713 HydrophobicContact CD1-CE1 4.27Å; L675-F713 HydrophobicContact CD1-CZ 3.98Å; M711-F713 HydrophobicContact CB-CD2 4.48Å; M711-F713 HydrophobicContact CB-CE2 3.65Å; M711-F713 HydrophobicContact CB-CZ 3.94Å; M711-F713 HydrophobicContact CE-CZ 4.04Å; M711-F713 HydrophobicContact SD-CZ 4.41Å; F713-W717 PolarHBondContact O-NE1 2.9Å
714	E	85.8	Confident	90	Very high	118 Å²	118	55 Å²	55	55%	0.551	29%	0.285	S	S	*	.	S	Bend	trans	-99.3	-13.5	178.8	-64	176.9	-174.8	0	0	113.1	T624	T624-E714 CarbonylContact O-C 3.54Å; T624-E714 WeakPolarHBondContact O-CA 3.32Å
715	K	84.1	Confident	90.3	Very high	135 Å²	135	49.8 Å²	49.8	59%	0.587	25%	0.248	S	C	*	.	S	Bend	trans	-149.5	162	-173.5	-64.3	-172.8	179.7	-178.8	0	110.9	W717	K715-W717 PolarHBondContact O-N 2.82Å
716	H	89.7	Confident	90.3	Very high	102 Å²	102	48.8 Å²	48.8	47%	0.472	24%	0.242	S	C	.	.	S	Bend	trans	55.9	49.6	172.4	-48.8	110.2	0	0	0	113.2	S10 F11 Q674	S10-H716 PolarHBondContact OG-N 3.3Å; F11-H716 HydrophobicContact CE1-CB 4.27Å; F11-H716 HydrophobicContact CZ-CB 4.39Å; F11-H716 WeakPolarHBondContact CZ-O 3.22Å; Q674-H716 HydrophobicContact CB-CB 4.01Å; Q674-H716 HydrophobicContact CG-CB 4.48Å; Q674-H716 PolarHBondContact N-O 2.96Å
717	W	93.3	Very high	90.4	Very high	6 Å²	6	49.9 Å²	49.9	2%	0.023	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	162.1	167.3	66.7	-88.6	0	0	0	109.1	F623 T624 Y625 I671 L672 V673 F713 K715 L719	F623-W717 HydrophobicContact CB-CD2 4.01Å; F623-W717 HydrophobicContact CB-CE3 4.16Å; F623-W717 HydrophobicContact CB-CH2 3.86Å; F623-W717 HydrophobicContact CB-CZ2 3.69Å; F623-W717 HydrophobicContact CB-CZ3 4.08Å; F623-W717 HydrophobicContact CD1-CB 4.22Å; F623-W717 AromaticContact CD1-CD2 3.83Å; F623-W717 HydrophobicContact CD1-CD2 3.83Å; F623-W717 HydrophobicContact CD1-CE3 4.17Å; F623-W717 AromaticContact CD1-CG 3.83Å; F623-W717 HydrophobicContact CD1-CG 3.83Å; F623-W717 HydrophobicContact CG-CD2 4.34Å; F623-W717 HydrophobicContact CG-CE3 4.44Å; T624-W717 PolarHBondContact O-NE1 2.86Å; Y625-W717 HydrophobicContact CD2-CH2 4.15Å; Y625-W717 AromaticContact CD2-CZ2 3.62Å; Y625-W717 HydrophobicContact CD2-CZ2 3.62Å; Y625-W717 HydrophobicContact CE1-CZ2 4.38Å; Y625-W717 AromaticContact CE2-CE2 3.86Å; Y625-W717 AromaticContact CE2-CH2 3.56Å; Y625-W717 HydrophobicContact CE2-CH2 3.56Å; Y625-W717 AromaticContact CE2-CZ2 3.34Å; Y625-W717 HydrophobicContact CE2-CZ2 3.34Å; Y625-W717 HydrophobicContact CE2-CZ3 4.23Å; Y625-W717 HydrophobicContact CG-CZ2 4.26Å; Y625-W717 AromaticContact CZ-CE2 3.78Å; Y625-W717 AromaticContact CZ-CZ2 3.77Å; Y625-W717 PolarHBondContact OH-O 2.89Å; I671-W717 HydrophobicContact CG2-CE3 4.13Å; L672-W717 CarbonylContact O-C 3.47Å; L672-W717 VanDerWaalsContact O-CA 3.28Å; L672-W717 WeakPolarHBondContact O-CA 3.45Å; V673-W717 HydrophobicContact CB-CB 4.18Å; V673-W717 HydrophobicContact CG2-CB 4.09Å; F713-W717 PolarHBondContact O-NE1 2.9Å; K715-W717 PolarHBondContact O-N 2.82Å; W717-L719 HydrophobicContact CZ3-CB 4.37Å
718	R	92.6	Very high	90.5	Very high	34 Å²	34	49.2 Å²	49.2	13%	0.128	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	133.8	175.7	179.5	173	177.7	149.6	7.1	110.3	P9 F11 L672 D756	P9-R718 HydrophobicContact CB-CG 4.05Å; F11-R718 HydrophobicContact CD2-CB 3.51Å; F11-R718 HydrophobicContact CE2-CB 4.07Å; F11-R718 HydrophobicContact CG-CB 4.38Å; F11-R718 PolarHBondContact O-NH1 2.9Å; L672-R718 PolarHBondContact N-O 2.86Å; L672-R718 PolarHBondContact O-N 2.81Å; R718-D756 IonicContact CZ-OD2 3.07Å; R718-D756 IonicContact NH1-OD2 3.19Å; R718-D756 PolarHBondContact NH1-OD2 2.8Å; R718-D756 IonicContact NH2-OD2 2.68Å; R718-D756 PolarHBondContact NH2-OD2 2.95Å; R718-D756 VanDerWaalsContact NH2-OD2 3.07Å
719	L	90.9	Very high	90.6	Very high	18 Å²	18	47.1 Å²	47.1	9%	0.094	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	129.5	166.2	-174.2	70.1	0	0	0	109.3	F637 R668 I671 W717 E721	F637-L719 HydrophobicContact CZ-CD2 4.2Å; R668-L719 HydrophobicContact CB-CD2 4.25Å; R668-L719 HydrophobicContact CG-CD2 4.37Å; I671-L719 HydrophobicContact CD1-CD1 4.46Å; I671-L719 HydrophobicContact CG1-CD1 3.7Å; W717-L719 HydrophobicContact CZ3-CB 4.37Å; L719-E721 PolarHBondContact O-N 2.84Å
720	L	91	Very high	90.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.229	C	C	.	.			trans	-90.6	98	-179.3	-61.6	-179.3	0	0	0	109.9	R670 L672 M723 A725 V739 F750	R670-L720 HydrophobicContact CB-CB 4.09Å; R670-L720 HydrophobicContact CB-CD1 4.34Å; R670-L720 WeakPolarHBondContact O-CB 3.28Å; R670-L720 PolarHBondContact O-N 2.76Å; L672-L720 HydrophobicContact CB-CD1 4.22Å; L672-L720 HydrophobicContact CB-CD2 4.14Å; L672-L720 HydrophobicContact CB-CG 4.2Å; L720-M723 HydrophobicContact CB-CB 4.47Å; L720-A725 HydrophobicContact CD1-CB 3.37Å; L720-V739 HydrophobicContact CD1-CG1 4.27Å; L720-F750 HydrophobicContact CD2-CE1 4.22Å; L720-F750 HydrophobicContact CD2-CE2 4.39Å; L720-F750 HydrophobicContact CD2-CZ 3.6Å
721	E	85.8	Confident	90.6	Very high	71 Å²	71	44 Å²	44	33%	0.332	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	139.2	176.5	-62.1	179.2	-178.8	0	0	111.2	L719 M723 R748	L719-E721 PolarHBondContact O-N 2.84Å; E721-M723 PolarHBondContact O-N 2.79Å; E721-R748 PolarHBondContact O-NH1 3.19Å; E721-R748 PolarHBondContact O-NH2 2.9Å
722	S	86	Confident	90.5	Very high	97 Å²	97	43.9 Å²	43.9	68%	0.678	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	22.3	174.9	64.7	0	0	0	0	115.3	G667	G667-S722 PolarHBondContact O-N 2.73Å
723	M	86.3	Confident	90.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.222	C	C	.	.			trans	-126.2	119.4	-178.1	-173.1	-179.3	-163.9	0	0	111.3	L720 E721 A725 V739 R748	L720-M723 HydrophobicContact CB-CB 4.47Å; E721-M723 PolarHBondContact O-N 2.79Å; M723-A725 HydrophobicContact CG-CB 4.24Å; M723-A725 PolarHBondContact O-N 3.06Å; M723-A725 HydrophobicContact SD-CB 4.35Å; M723-V739 HydrophobicContact CE-CB 3.97Å; M723-V739 HydrophobicContact CE-CG1 3.64Å; M723-V739 WeakPolarHBondContact CE-O 3.22Å; M723-V739 HydrophobicContact SD-CB 4.4Å; M723-V739 HydrophobicContact SD-CG1 3.97Å; M723-R748 HydrophobicContact CE-CB 3.62Å; M723-R748 HydrophobicContact SD-CB 3.72Å
724	K	91.4	Very high	90.5	Very high	98 Å²	98	49.7 Å²	49.7	43%	0.426	24%	0.241	S	C	.	.			trans	-78.6	58.2	171.5	-66	-173.9	175.9	-175.3	0	110.8	E666 S741 S742	E666-K724 WeakPolarHBondContact OE1-CE 3.39Å; E666-K724 IonicContact OE1-NZ 2.59Å; E666-K724 PolarHBondContact OE1-NZ 3.46Å; K724-S741 CarbonylContact O-C 3.53Å; K724-S741 WeakPolarHBondContact O-CA 3.29Å; K724-S741 VanDerWaalsContact O-CB 3.29Å; K724-S741 WeakPolarHBondContact O-CB 3.2Å; K724-S742 PolarHBondContact O-N 2.95Å
725	A	92.3	Very high	90.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	138.2	-178.6	0	0	0	0	0	111.9	I658 R670 L720 M723 V739	I658-A725 HydrophobicContact CD1-CB 4.47Å; I658-A725 HydrophobicContact CG2-CB 4.35Å; R670-A725 HydrophobicContact CB-CB 4.13Å; R670-A725 WeakPolarHBondContact CD-O 3.25Å; R670-A725 HydrophobicContact CG-CB 4.19Å; R670-A725 PolarHBondContact NE-O 2.92Å; L720-A725 HydrophobicContact CD1-CB 3.37Å; M723-A725 HydrophobicContact CG-CB 4.24Å; M723-A725 PolarHBondContact O-N 3.06Å; M723-A725 HydrophobicContact SD-CB 4.35Å; A725-V739 HydrophobicContact CB-CG1 3.48Å; A725-V739 VanDerWaalsContact CB-CG1 3.48Å
726	Q	92.6	Very high	91.3	Very high	48 Å²	48	42.1 Å²	42.1	22%	0.224	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	-43.9	-177.7	-173	67.1	27.3	0	0	112.3	D646 L740	D646-Q726 WeakPolarHBondContact CB-O 3.27Å; Q726-L740 PolarHBondContact N-O 2.91Å
727	Y	94.9	Very high	91.6	Very high	29 Å²	29	37.2 Å²	37.2	11%	0.114	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	151.3	-174.5	-52.8	-81.1	0	0	0	112.1	L569 D646 I658 V739 L740 L744	L569-Y727 HydrophobicContact CB-CD1 4.25Å; L569-Y727 HydrophobicContact CB-CE1 3.97Å; L569-Y727 HydrophobicContact CD1-CD1 4.32Å; L569-Y727 HydrophobicContact CD1-CD2 3.48Å; L569-Y727 VanDerWaalsContact CD1-CD2 3.48Å; L569-Y727 HydrophobicContact CD1-CE1 4.2Å; L569-Y727 HydrophobicContact CD1-CE2 3.34Å; L569-Y727 HydrophobicContact CD1-CG 3.96Å; D646-Y727 VanDerWaalsContact OD2-CA 3.22Å; D646-Y727 WeakPolarHBondContact OD2-CA 3.34Å; I658-Y727 WeakPolarHBondContact CD1-O 3.46Å; Y727-V739 WeakPolarHBondContact O-CA 3.28Å; Y727-L740 HydrophobicContact CD2-CD2 4.14Å; Y727-L740 PolarHBondContact N-O 2.82Å; Y727-L740 PolarHBondContact O-N 3.12Å; Y727-L744 HydrophobicContact CD2-CD2 4.22Å; Y727-L744 HydrophobicContact CE2-CD2 3.65Å
728	V	95.6	Very high	91.7	Very high	1 Å²	1	37 Å²	37	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	153.1	179.5	71.1	0	0	0	0	112.2	K571 D646 Q648 T656 I658 L672 C738 V739	K571-V728 PolarHBondContact NZ-O 3.05Å; D646-V728 PolarHBondContact OD2-N 2.82Å; Q648-V728 HydrophobicContact CB-CG1 4.04Å; Q648-V728 PolarHBondContact OE1-O 2.9Å; T656-V728 HydrophobicContact CG2-CG2 3.65Å; I658-V728 HydrophobicContact CD1-CB 3.71Å; I658-V728 HydrophobicContact CG1-CB 4.02Å; L672-V728 HydrophobicContact CD1-CG2 4.2Å; V728-C738 CarbonylContact C-O 3.51Å; V728-C738 WeakPolarHBondContact CA-O 3.37Å; V728-V739 HydrophobicContact CG2-CG2 4.38Å
729	A	94.5	Very high	91.8	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.008	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	111	169.4	0	0	0	0	0	109.7	L26 W28 K571 Q648 S737 C738	L26-A729 HydrophobicContact CD1-CB 3.42Å; L26-A729 VanDerWaalsContact CD1-CB 3.42Å; W28-A729 PolarHBondContact NE1-O 3.47Å; K571-A729 VanDerWaalsContact NZ-CB 3.3Å; Q648-A729 VanDerWaalsContact OE1-CA 3.3Å; A729-S737 CarbonylContact O-C 3.53Å; A729-S737 VanDerWaalsContact O-CA 3.28Å; A729-S737 WeakPolarHBondContact O-CA 3.42Å; A729-C738 HydrophobicContact CB-CB 4.28Å; A729-C738 PolarHBondContact N-O 2.88Å; A729-C738 PolarHBondContact O-N 3.47Å
730	G	92	Very high	92	Very high	9 Å²	9	34.6 Å²	34.6	9%	0.093	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	154.2	179	0	0	0	0	0	113.3
731	N	93.3	Very high	92.2	Very high	15 Å²	15	34.7 Å²	34.7	8%	0.08	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	109.8	160.9	178.3	-24.3	0	0	0	109.2	W28 S29 P30 L733 R734 K735 V736	W28-N731 HydrophobicContact CB-CB 3.95Å; W28-N731 HydrophobicContact CG-CB 4.05Å; S29-N731 PolarHBondContact O-ND2 2.68Å; P30-N731 PolarHBondContact O-ND2 2.86Å; N731-L733 WeakPolarHBondContact OD1-CA 3.38Å; N731-L733 WeakPolarHBondContact OD1-CB 3.35Å; N731-L733 PolarHBondContact OD1-N 3.41Å; N731-R734 PolarHBondContact OD1-N 3.26Å; N731-R734 VanDerWaalsContact OD1-N 3.1Å; N731-K735 WeakPolarHBondContact O-CA 3.36Å; N731-K735 PolarHBondContact O-N 3.05Å; N731-V736 HydrophobicContact CB-CG2 4.06Å; N731-V736 PolarHBondContact N-O 3.46Å; N731-V736 PolarHBondContact O-N 3.32Å
732	G	87.9	Confident	92.4	Very high	13 Å²	13	34.2 Å²	34.2	13%	0.134	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-27.1	-179.7	0	0	0	0	0	115	Y650 R734 K735	Y650-G732 WeakPolarHBondContact O-CA 3.27Å; Y650-G732 PolarHBondContact O-N 2.93Å; G732-R734 PolarHBondContact O-N 3.37Å; G732-K735 WeakPolarHBondContact O-CG 3.49Å; G732-K735 PolarHBondContact O-N 2.96Å
733	L	89.9	Confident	92.7	Very high	126 Å²	126	32.9 Å²	32.9	66%	0.66	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-39.9	177	-175	70.1	0	0	0	111.6	P30 K31 N731	P30-L733 WeakPolarHBondContact O-CD2 3.33Å; K31-L733 HydrophobicContact CG-CD2 4.42Å; N731-L733 WeakPolarHBondContact OD1-CA 3.38Å; N731-L733 WeakPolarHBondContact OD1-CB 3.35Å; N731-L733 PolarHBondContact OD1-N 3.41Å
734	R	90.7	Very high	93	Very high	122 Å²	122	33.5 Å²	33.5	46%	0.46	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-4.1	177	-68.1	-56.5	-56	-175.9	-0.7	113.6	N731 G732 V736	N731-R734 PolarHBondContact OD1-N 3.26Å; N731-R734 VanDerWaalsContact OD1-N 3.1Å; G732-R734 PolarHBondContact O-N 3.37Å; R734-V736 VanDerWaalsContact C-N 3.34Å; R734-V736 HydrophobicContact CB-CG2 3.99Å; R734-V736 PolarHBondContact O-N 3.5Å
735	K	93.9	Very high	93.1	Very high	94 Å²	94	33 Å²	33	41%	0.409	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	39.5	-179.7	-52.9	178.5	176.1	-170.6	0	115.7	Y650 N731 G732 M752 D753	Y650-K735 WeakPolarHBondContact OH-CA 3.41Å; Y650-K735 VanDerWaalsContact OH-CB 3.29Å; Y650-K735 WeakPolarHBondContact OH-CB 3.41Å; N731-K735 WeakPolarHBondContact O-CA 3.36Å; N731-K735 PolarHBondContact O-N 3.05Å; G732-K735 WeakPolarHBondContact O-CG 3.49Å; G732-K735 PolarHBondContact O-N 2.96Å; K735-M752 PolarHBondContact O-N 3.23Å; K735-D753 HydrophobicContact CB-CB 4.48Å; K735-D753 HydrophobicContact CD-CB 3.72Å; K735-D753 VanDerWaalsContact CD-CG 3.46Å; K735-D753 WeakPolarHBondContact CD-OD2 3.49Å; K735-D753 IonicContact NZ-OD2 3.96Å; K735-D753 PolarHBondContact NZ-OD2 3.08Å
736	V	93.9	Very high	93.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	150.5	-176.3	-66.7	0	0	0	0	111.1	W28 L49 N731 R734 F750	W28-V736 HydrophobicContact CD2-CG2 4.04Å; W28-V736 HydrophobicContact CE3-CG2 3.98Å; W28-V736 HydrophobicContact CH2-CB 4.27Å; W28-V736 HydrophobicContact CH2-CG2 3.91Å; W28-V736 HydrophobicContact CZ2-CB 4.19Å; W28-V736 HydrophobicContact CZ2-CG2 3.89Å; W28-V736 HydrophobicContact CZ3-CG2 3.95Å; L49-V736 HydrophobicContact CD1-CB 4.07Å; L49-V736 HydrophobicContact CD1-CG1 3.55Å; L49-V736 HydrophobicContact CD2-CG1 3.45Å; L49-V736 VanDerWaalsContact CD2-CG1 3.45Å; L49-V736 HydrophobicContact CG-CG1 4.11Å; N731-V736 HydrophobicContact CB-CG2 4.06Å; N731-V736 PolarHBondContact N-O 3.46Å; N731-V736 PolarHBondContact O-N 3.32Å; R734-V736 VanDerWaalsContact C-N 3.34Å; R734-V736 HydrophobicContact CB-CG2 3.99Å; R734-V736 PolarHBondContact O-N 3.5Å; V736-F750 WeakPolarHBondContact CA-O 3.15Å
737	S	94.8	Very high	93.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	148	170.2	-70	0	0	0	0	111	A729 V749 F750	A729-S737 CarbonylContact O-C 3.53Å; A729-S737 VanDerWaalsContact O-CA 3.28Å; A729-S737 WeakPolarHBondContact O-CA 3.42Å; S737-V749 CarbonylContact O-C 3.56Å; S737-V749 WeakPolarHBondContact O-CA 3.43Å; S737-V749 WeakPolarHBondContact O-CG1 3.28Å; S737-F750 PolarHBondContact N-O 2.79Å; S737-F750 PolarHBondContact O-N 3.31Å
738	C	95.3	Very high	93.4	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	132.7	177.7	170.7	0	0	0	0	108.1	W28 I35 V728 A729 V747 V749	W28-C738 HydrophobicContact CZ2-CB 3.73Å; I35-C738 HydrophobicContact CD1-CB 3.84Å; V728-C738 CarbonylContact C-O 3.51Å; V728-C738 WeakPolarHBondContact CA-O 3.37Å; A729-C738 HydrophobicContact CB-CB 4.28Å; A729-C738 PolarHBondContact N-O 2.88Å; A729-C738 PolarHBondContact O-N 3.47Å; C738-V747 WeakPolarHBondContact SG-CG1 3.44Å; C738-V749 HydrophobicContact CB-CG2 4.17Å
739	V	95.8	Very high	93.3	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	131.8	178	178.1	0	0	0	0	108.5	I658 L672 L720 M723 A725 Y727 V728 V747 R748 F750	I658-V739 HydrophobicContact CD1-CG1 3.91Å; I658-V739 HydrophobicContact CD1-CG2 4.47Å; L672-V739 HydrophobicContact CD1-CG2 4.2Å; L672-V739 HydrophobicContact CD2-CG2 4.21Å; L720-V739 HydrophobicContact CD1-CG1 4.27Å; M723-V739 HydrophobicContact CE-CB 3.97Å; M723-V739 HydrophobicContact CE-CG1 3.64Å; M723-V739 WeakPolarHBondContact CE-O 3.22Å; M723-V739 HydrophobicContact SD-CB 4.4Å; M723-V739 HydrophobicContact SD-CG1 3.97Å; A725-V739 HydrophobicContact CB-CG1 3.48Å; A725-V739 VanDerWaalsContact CB-CG1 3.48Å; Y727-V739 WeakPolarHBondContact O-CA 3.28Å; V728-V739 HydrophobicContact CG2-CG2 4.38Å; V739-V747 WeakPolarHBondContact O-CA 3.17Å; V739-R748 PolarHBondContact N-O 2.69Å; V739-R748 PolarHBondContact O-N 3.37Å; V739-F750 HydrophobicContact CB-CE2 4Å; V739-F750 HydrophobicContact CG2-CD2 4.08Å; V739-F750 HydrophobicContact CG2-CE2 3.6Å
740	L	95.1	Very high	93.4	Very high	1 Å²	1	31 Å²	31	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	132.1	175.3	-179.4	71.2	0	0	0	109.1	I23 L26 L569 Q726 Y727 L744 V747	I23-L740 HydrophobicContact CB-CD1 4.42Å; I23-L740 HydrophobicContact CB-CD2 4.26Å; I23-L740 HydrophobicContact CG2-CD2 4.37Å; L26-L740 HydrophobicContact CD2-CB 4.21Å; L26-L740 HydrophobicContact CD2-CD2 3.71Å; L26-L740 HydrophobicContact CD2-CG 4.45Å; L569-L740 HydrophobicContact CD1-CD2 3.72Å; Q726-L740 PolarHBondContact N-O 2.91Å; Y727-L740 HydrophobicContact CD2-CD2 4.14Å; Y727-L740 PolarHBondContact N-O 2.82Å; Y727-L740 PolarHBondContact O-N 3.12Å; L740-L744 HydrophobicContact CD2-CD2 4.05Å; L740-V747 HydrophobicContact CD1-CG2 3.65Å
741	S	94.1	Very high	93.5	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.021	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	168	177.6	92.3	0	0	0	0	113	K724 N743 L744 H746	K724-S741 CarbonylContact O-C 3.53Å; K724-S741 WeakPolarHBondContact O-CA 3.29Å; K724-S741 VanDerWaalsContact O-CB 3.29Å; K724-S741 WeakPolarHBondContact O-CB 3.2Å; S741-N743 PolarHBondContact O-N 3.38Å; S741-N743 VanDerWaalsContact O-N 3.17Å; S741-N743 PolarHBondContact OG-N 3.37Å; S741-N743 PolarHBondContact OG-OD1 2.69Å; S741-L744 PolarHBondContact O-N 2.8Å; S741-H746 PolarHBondContact N-O 2.91Å; S741-H746 WeakPolarHBondContact OG-CB 3.39Å
742	S	91	Very high	93.4	Very high	61 Å²	61	32.9 Å²	32.9	43%	0.427	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.8	178.4	60.6	0	0	0	0	114.8	K724 L744	K724-S742 PolarHBondContact O-N 2.95Å; S742-L744 PolarHBondContact O-N 2.88Å
743	N	90.8	Very high	93.6	Very high	69 Å²	69	36 Å²	36	37%	0.369	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-2	174.1	73.4	14	0	0	0	113.5	Q18 S741 R745 H746	Q18-N743 PolarHBondContact NE2-ND2 3.3Å; S741-N743 PolarHBondContact O-N 3.38Å; S741-N743 VanDerWaalsContact O-N 3.17Å; S741-N743 PolarHBondContact OG-N 3.37Å; S741-N743 PolarHBondContact OG-OD1 2.69Å; N743-R745 WeakPolarHBondContact O-CG 3.27Å; N743-R745 PolarHBondContact O-N 2.78Å; N743-R745 WeakPolarHBondContact OD1-CA 3.44Å; N743-R745 PolarHBondContact OD1-N 3.18Å; N743-H746 PolarHBondContact OD1-N 3.35Å
744	L	93.1	Very high	93.6	Very high	13 Å²	13	32.9 Å²	32.9	7%	0.068	16%	0.156	C	C	.	.	S	Bend	trans	58.5	15.7	-179	-48.5	-177.4	0	0	0	115.1	E22 I23 R567 L569 Y727 L740 S741 S742	E22-L744 CarbonylContact C-O 3.53Å; E22-L744 WeakPolarHBondContact CA-O 3.32Å; E22-L744 HydrophobicContact CB-CB 4.07Å; E22-L744 HydrophobicContact CG-CB 4.17Å; I23-L744 PolarHBondContact N-O 3.27Å; R567-L744 HydrophobicContact CB-CD1 3.98Å; L569-L744 HydrophobicContact CD1-CD2 3.65Å; Y727-L744 HydrophobicContact CD2-CD2 4.22Å; Y727-L744 HydrophobicContact CE2-CD2 3.65Å; L740-L744 HydrophobicContact CD2-CD2 4.05Å; S741-L744 PolarHBondContact O-N 2.8Å; S742-L744 PolarHBondContact O-N 2.88Å
745	R	93.8	Very high	93.5	Very high	88 Å²	88	31.1 Å²	31.1	33%	0.332	16%	0.156	S	C	.	.	S	Bend	trans	-125.4	-34.4	-176.2	-68.6	-178.3	-161.8	-155	4.6	113	L19 P20 E22 N743	L19-R745 WeakPolarHBondContact CB-O 3.33Å; L19-R745 PolarHBondContact N-O 2.87Å; L19-R745 WeakPolarHBondContact O-CB 3.31Å; P20-R745 PolarHBondContact O-NH1 2.85Å; P20-R745 VanDerWaalsContact O-NH1 3.09Å; E22-R745 HydrophobicContact CG-CG 4.05Å; E22-R745 IonicContact OE1-CZ 3.18Å; E22-R745 IonicContact OE1-NE 2.69Å; E22-R745 IonicContact OE1-NH2 3.35Å; E22-R745 PolarHBondContact OE1-NH2 3.13Å; N743-R745 WeakPolarHBondContact O-CG 3.27Å; N743-R745 PolarHBondContact O-N 2.78Å; N743-R745 WeakPolarHBondContact OD1-CA 3.44Å; N743-R745 PolarHBondContact OD1-N 3.18Å
746	H	94.9	Very high	93.1	Very high	24 Å²	24	27.4 Å²	27.4	11%	0.111	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	118.6	179.5	-173.6	-150	0	0	0	110.7	E16 Q18 S741 N743	E16-H746 WeakPolarHBondContact CG-NE2 3.44Å; E16-H746 IonicContact OE1-CD2 3.33Å; E16-H746 IonicContact OE1-CE1 2.77Å; E16-H746 PolarHBondContact OE1-CE1 3.07Å; E16-H746 IonicContact OE1-NE2 3.04Å; E16-H746 PolarHBondContact OE1-NE2 2.68Å; Q18-H746 VanDerWaalsContact OE1-CA 3.26Å; S741-H746 PolarHBondContact N-O 2.91Å; S741-H746 WeakPolarHBondContact OG-CB 3.39Å; N743-H746 PolarHBondContact OD1-N 3.35Å
747	V	95	Very high	92.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.4	179.3	178.3	0	0	0	0	109.7	E16 K17 L19 F52 C738 V739 L740 V749	E16-V747 WeakPolarHBondContact CA-O 3.19Å; K17-V747 PolarHBondContact N-O 2.93Å; K17-V747 PolarHBondContact O-N 2.64Å; L19-V747 HydrophobicContact CD1-CG2 3.9Å; F52-V747 HydrophobicContact CE1-CB 4.42Å; F52-V747 HydrophobicContact CE1-CG1 4.23Å; F52-V747 HydrophobicContact CE2-CG1 3.94Å; F52-V747 HydrophobicContact CZ-CB 4.37Å; F52-V747 HydrophobicContact CZ-CG1 3.76Å; C738-V747 WeakPolarHBondContact SG-CG1 3.44Å; V739-V747 WeakPolarHBondContact O-CA 3.17Å; L740-V747 HydrophobicContact CD1-CG2 3.65Å; V747-V749 HydrophobicContact CG1-CG2 3.99Å
748	R	95.3	Very high	91.9	Very high	12 Å²	12	43.1 Å²	43.1	5%	0.045	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	131.3	172	-167.2	179.2	-74.8	159	3.3	109.4	V13 E16 E721 M723 V739 F750	V13-R748 HydrophobicContact CG1-CG 3.91Å; V13-R748 HydrophobicContact CG2-CG 4.31Å; E16-R748 HydrophobicContact CB-CG 4.4Å; E16-R748 HydrophobicContact CG-CG 4.41Å; E16-R748 IonicContact OE1-CZ 3.64Å; E16-R748 IonicContact OE1-NE 2.8Å; E16-R748 PolarHBondContact OE1-NE 2.81Å; E16-R748 IonicContact OE1-NH2 3.45Å; E16-R748 PolarHBondContact OE1-NH2 2.97Å; E16-R748 IonicContact OE2-CZ 3.47Å; E16-R748 IonicContact OE2-NE 3.59Å; E16-R748 PolarHBondContact OE2-NE 2.8Å; E16-R748 IonicContact OE2-NH2 2.7Å; E16-R748 PolarHBondContact OE2-NH2 3.18Å; E721-R748 PolarHBondContact O-NH1 3.19Å; E721-R748 PolarHBondContact O-NH2 2.9Å; M723-R748 HydrophobicContact CE-CB 3.62Å; M723-R748 HydrophobicContact SD-CB 3.72Å; V739-R748 PolarHBondContact N-O 2.69Å; V739-R748 PolarHBondContact O-N 3.37Å; R748-F750 HydrophobicContact CB-CE2 4.05Å; R748-F750 HydrophobicContact CB-CZ 4.2Å; R748-F750 HydrophobicContact CG-CE1 4.21Å; R748-F750 HydrophobicContact CG-CE2 3.88Å; R748-F750 HydrophobicContact CG-CZ 3.63Å
749	V	95.3	Very high	91.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.5	-174.7	-172.4	0	0	0	0	110.2	V14 G15 W28 L49 F52 S737 C738 V747	V14-V749 PolarHBondContact N-O 2.83Å; G15-V749 PolarHBondContact N-O 2.96Å; G15-V749 PolarHBondContact O-N 2.68Å; W28-V749 HydrophobicContact CH2-CG1 4Å; W28-V749 HydrophobicContact CZ2-CG1 3.94Å; L49-V749 HydrophobicContact CD1-CG1 3.41Å; L49-V749 VanDerWaalsContact CD1-CG1 3.41Å; F52-V749 HydrophobicContact CD2-CG2 3.47Å; F52-V749 VanDerWaalsContact CD2-CG2 3.47Å; F52-V749 HydrophobicContact CE2-CG2 3.72Å; F52-V749 HydrophobicContact CG-CG2 4.37Å; S737-V749 CarbonylContact O-C 3.56Å; S737-V749 WeakPolarHBondContact O-CA 3.43Å; S737-V749 WeakPolarHBondContact O-CG1 3.28Å; C738-V749 HydrophobicContact CB-CG2 4.17Å; V747-V749 HydrophobicContact CG1-CG2 3.99Å
750	F	94.6	Very high	89.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141.8	-171.4	-57.5	-90	0	0	0	111.4	F11 R12 V13 L672 L720 V736 S737 V739 R748 M752	F11-F750 HydrophobicContact CB-CB 4.42Å; F11-F750 HydrophobicContact CB-CD1 4.16Å; R12-F750 CarbonylContact O-C 3.55Å; R12-F750 WeakPolarHBondContact O-CA 3.48Å; V13-F750 HydrophobicContact CG2-CD1 3.85Å; V13-F750 HydrophobicContact CG2-CE1 3.55Å; V13-F750 HydrophobicContact CG2-CZ 4.46Å; L672-F750 HydrophobicContact CD2-CD2 4.15Å; L672-F750 HydrophobicContact CD2-CE2 4.23Å; L672-F750 HydrophobicContact CD2-CG 4.46Å; L720-F750 HydrophobicContact CD2-CE1 4.22Å; L720-F750 HydrophobicContact CD2-CE2 4.39Å; L720-F750 HydrophobicContact CD2-CZ 3.6Å; V736-F750 WeakPolarHBondContact CA-O 3.15Å; S737-F750 PolarHBondContact N-O 2.79Å; S737-F750 PolarHBondContact O-N 3.31Å; V739-F750 HydrophobicContact CB-CE2 4Å; V739-F750 HydrophobicContact CG2-CD2 4.08Å; V739-F750 HydrophobicContact CG2-CE2 3.6Å; R748-F750 HydrophobicContact CB-CE2 4.05Å; R748-F750 HydrophobicContact CB-CZ 4.2Å; R748-F750 HydrophobicContact CG-CE1 4.21Å; R748-F750 HydrophobicContact CG-CE2 3.88Å; R748-F750 HydrophobicContact CG-CZ 3.63Å; F750-M752 HydrophobicContact CB-SD 3.64Å
751	E	94.3	Very high	88.5	Confident	55 Å²	55	55.6 Å²	55.6	26%	0.257	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	124.4	160.6	-173.7	167.8	-145.8	0	0	107.4	R12 V14 D753 I754	R12-E751 HydrophobicContact CB-CB 4.49Å; R12-E751 PolarHBondContact N-O 3.43Å; R12-E751 PolarHBondContact O-N 3.09Å; V14-E751 HydrophobicContact CG2-CB 3.62Å; E751-D753 VanDerWaalsContact CG-OD1 3.22Å; E751-D753 WeakPolarHBondContact CG-OD1 3.45Å; E751-I754 HydrophobicContact CG-CD1 4.46Å; E751-I754 HydrophobicContact CG-CG1 4.38Å
752	M	92.9	Very high	86.6	Confident	9 Å²	9	62 Å²	62	4%	0.044	30%	0.298	C	S	.	.	S	Bend	trans	-97.9	-4.4	-163.7	-58.6	-60.9	-78.5	0	0	113.5	F11 Y650 L672 Q674 K735 F750	F11-M752 HydrophobicContact CB-SD 4.03Å; F11-M752 HydrophobicContact CD1-CB 4.28Å; F11-M752 HydrophobicContact CD1-CE 3.5Å; F11-M752 HydrophobicContact CD1-SD 3.68Å; F11-M752 HydrophobicContact CD2-CE 3.75Å; F11-M752 HydrophobicContact CD2-SD 4.18Å; F11-M752 HydrophobicContact CE1-CE 3.37Å; F11-M752 HydrophobicContact CE1-SD 4.18Å; F11-M752 HydrophobicContact CE2-CE 3.61Å; F11-M752 HydrophobicContact CG-CE 3.71Å; F11-M752 HydrophobicContact CG-SD 3.7Å; F11-M752 HydrophobicContact CZ-CE 3.42Å; F11-M752 VanDerWaalsContact CZ-CE 3.42Å; Y650-M752 HydrophobicContact CE2-CB 4.15Å; Y650-M752 HydrophobicContact CE2-CG 4Å; Y650-M752 WeakPolarHBondContact OH-CB 3.31Å; L672-M752 HydrophobicContact CD2-CE 4.04Å; L672-M752 HydrophobicContact CD2-SD 4.46Å; Q674-M752 HydrophobicContact CG-CE 3.99Å; K735-M752 PolarHBondContact O-N 3.23Å; F750-M752 HydrophobicContact CB-SD 3.64Å
753	D	90.6	Very high	84.4	Confident	78 Å²	78	62 Å²	62	42%	0.417	30%	0.299	S	S	.	.	S	Bend	trans	-107.8	-1	-179.2	64.2	-26	0	0	0	115	K735 E751	K735-D753 HydrophobicContact CB-CB 4.48Å; K735-D753 HydrophobicContact CD-CB 3.72Å; K735-D753 VanDerWaalsContact CD-CG 3.46Å; K735-D753 WeakPolarHBondContact CD-OD2 3.49Å; K735-D753 IonicContact NZ-OD2 3.96Å; K735-D753 PolarHBondContact NZ-OD2 3.08Å; E751-D753 VanDerWaalsContact CG-OD1 3.22Å; E751-D753 WeakPolarHBondContact CG-OD1 3.45Å
754	I	89.6	Confident	81.8	Confident	61 Å²	61	62.7 Å²	62.7	31%	0.313	31%	0.309	S	S	.	.	S	Bend	trans	-125.9	132.2	176.8	-44.7	-179.9	0	0	0	108.9	R12 E751	R12-I754 WeakPolarHBondContact CB-O 3.23Å; R12-I754 PolarHBondContact N-O 3.24Å; R12-I754 VanDerWaalsContact N-O 3.12Å; E751-I754 HydrophobicContact CG-CD1 4.46Å; E751-I754 HydrophobicContact CG-CG1 4.38Å
755	D	88.5	Confident	79.3	Confident	84 Å²	84	66 Å²	66	45%	0.449	33%	0.327	S	S	.	.			trans	-63.1	153.8	170.8	-62.1	-24.7	0	0	0	110.3	F8 P9 S10 R12	F8-D755 HydrophobicContact CB-CB 4.09Å; P9-D755 WeakPolarHBondContact O-CA 3.39Å; S10-D755 VanDerWaalsContact CA-OD1 3.31Å; S10-D755 WeakPolarHBondContact CA-OD1 3.48Å; R12-D755 PolarHBondContact NE-O 3.36Å
756	D	87	Confident	76.5	Confident	17 Å²	17	68.3 Å²	68.3	9%	0.091	35%	0.346	C	S	.	.			trans	-67.5	154.7	176.2	-153.2	-5.1	0	0	0	111.2	F8 P9 R718 W758	F8-D756 VanDerWaalsContact CD1-O 3.24Å; F8-D756 WeakPolarHBondContact CD1-O 3.49Å; P9-D756 HydrophobicContact CG-CB 3.58Å; P9-D756 PolarHBondContact O-N 3.13Å; R718-D756 IonicContact CZ-OD2 3.07Å; R718-D756 IonicContact NH1-OD2 3.19Å; R718-D756 PolarHBondContact NH1-OD2 2.8Å; R718-D756 IonicContact NH2-OD2 2.68Å; R718-D756 PolarHBondContact NH2-OD2 2.95Å; R718-D756 VanDerWaalsContact NH2-OD2 3.07Å; D756-W758 VanDerWaalsContact C-N 3.32Å
757	E	84.3	Confident	73.6	Confident	132 Å²	132	75.5 Å²	75.5	62%	0.617	38%	0.379	S	S	*	.	S	Bend	trans	-82.6	-18.2	179.2	-60.4	-177.6	174.1	0	0	111.8	F8 R12	F8-E757 WeakPolarHBondContact CE1-O 3.24Å; R12-E757 IonicContact CZ-OE1 2.8Å; R12-E757 IonicContact NH1-OE1 3.89Å; R12-E757 PolarHBondContact NH1-OE1 3.15Å; R12-E757 IonicContact NH2-OE1 3.19Å; R12-E757 PolarHBondContact NH2-OE1 2.97Å
758	W	78.9	Confident	70.7	Confident	198 Å²	198	85 Å²	85	75%	0.75	42%	0.424	S	S	*	.	S	Bend	trans	-90.5	128	178.3	-57.7	101	0	0	0	110.8	P9 D756	P9-W758 VanDerWaalsContact CD-O 3.23Å; P9-W758 WeakPolarHBondContact CD-O 3.5Å; D756-W758 VanDerWaalsContact C-N 3.32Å
759	E	79.1	Confident	67.8	Low	98 Å²	98	93.7 Å²	93.7	46%	0.458	47%	0.465	S	S	.	.			trans	-65.1	144.8	175	-166.8	167.9	-170.3	0	0	110.1	T6 C7 F8 D761	T6-E759 VanDerWaalsContact CA-OE1 3.25Å; T6-E759 WeakPolarHBondContact CA-OE1 3.25Å; C7-E759 WeakPolarHBondContact O-CG 3Å; F8-E759 HydrophobicContact CE1-CB 4.22Å; E759-D761 PolarHBondContact O-N 3.1Å; E759-D761 VanDerWaalsContact O-N 3.15Å
760	L	70.6	Confident	65	Low	40 Å²	40	98.6 Å²	98.6	21%	0.209	51%	0.505	C	S	.	.			trans	-65.5	112.3	175.6	-87.5	146.5	0	0	0	109.9	C7 P9 Y625 E762	C7-L760 HydrophobicContact CB-CD1 4.48Å; C7-L760 PolarHBondContact O-N 2.96Å; P9-L760 HydrophobicContact CB-CD1 4Å; P9-L760 HydrophobicContact CB-CD2 4.28Å; P9-L760 HydrophobicContact CB-CG 4.07Å; P9-L760 HydrophobicContact CG-CD1 4.42Å; P9-L760 HydrophobicContact CG-CG 4.1Å; Y625-L760 HydrophobicContact CD2-CD1 4.14Å; Y625-L760 HydrophobicContact CE2-CD1 3.62Å; L760-E762 VanDerWaalsContact C-N 3.34Å; L760-E762 PolarHBondContact O-N 2.99Å
761	D	64.1	Low	61.8	Low	126 Å²	126	102.3 Å²	102.3	67%	0.674	54%	0.543	S	S	*	.			trans	-73.1	87.7	171.6	-82.6	-21.8	0	0	0	110	E759 S763	E759-D761 PolarHBondContact O-N 3.1Å; E759-D761 VanDerWaalsContact O-N 3.15Å; D761-S763 PolarHBondContact O-N 3.23Å; D761-S763 PolarHBondContact O-OG 2.69Å
762	E	54.7	Low	59.1	Low	136 Å²	136	103.8 Å²	103.8	64%	0.636	57%	0.573	S	S	*	*			trans	-70.8	66.1	162.9	-67.8	-170.7	-179.9	0	0	109.7	L760 S764	L760-E762 VanDerWaalsContact C-N 3.34Å; L760-E762 PolarHBondContact O-N 2.99Å; E762-S764 PolarHBondContact O-N 2.7Å; E762-S764 VanDerWaalsContact O-N 3.13Å
763	S	44.7	Very low	56.1	Low	63 Å²	63	112.7 Å²	112.7	44%	0.441	61%	0.612	S	S	.	*			trans	-66.3	111.2	176.3	27.8	0	0	0	0	109.8	R668 D761	R668-S763 PolarHBondContact NH2-OG 3.36Å; R668-S763 VanDerWaalsContact NH2-OG 3.08Å; D761-S763 PolarHBondContact O-N 3.23Å; D761-S763 PolarHBondContact O-OG 2.69Å
764	S	36	Very low	53.4	Low	82 Å²	82	115 Å²	115	57%	0.573	63%	0.631	S	S	*	*			trans	-29.5	121.7	171.9	50.7	0	0	0	0	115.3	E762 D766	E762-S764 PolarHBondContact O-N 2.7Å; E762-S764 VanDerWaalsContact O-N 3.13Å; S764-D766 PolarHBondContact O-N 3.13Å
765	D	41.2	Very low	50.4	Low	84 Å²	84	121 Å²	121	45%	0.449	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.4	5	172.8	-81.2	-44.4	0	0	0	115.6	R635	R635-D765 IonicContact CZ-OD2 3.55Å; R635-D765 IonicContact NE-OD2 3.48Å; R635-D765 VanDerWaalsContact NH1-CG 3.29Å; R635-D765 IonicContact NH1-OD2 2.69Å; R635-D765 PolarHBondContact NH1-OD2 3.26Å
766	D	35.4	Very low	47.5	Very low	136 Å²	136	126.2 Å²	126.2	73%	0.727	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	6	-162.3	-70	-25.9	0	0	0	117.3	S764	S764-D766 PolarHBondContact O-N 3.13Å
767	E	34	Very low	44.8	Very low	174 Å²	174	133.2 Å²	133.2	81%	0.813	71%	0.714	S	S	*	*	S	Bend	trans	-115.1	18.2	-175.7	-74.1	-162.9	175.5	0	0	117.6
768	E	33.1	Very low	42	Very low	200 Å²	200	135.7 Å²	135.7	94%	0.935	72%	0.723	S	S	*	*	S	Bend	trans	-111.3	14.8	170.5	-77.2	-164.1	163.4	0	0	115.3
769	E	35	Very low	39.5	Very low	195 Å²	195	134.8 Å²	134.8	91%	0.911	73%	0.727	S	S	*	*	S	Bend	trans	-114.2	44.8	170.7	-81.8	-161.6	162	0	0	113.5
770	A	36.7	Very low	37.1	Very low	103 Å²	103	138.5 Å²	138.5	85%	0.851	75%	0.745	S	S	*	*	S	Bend	trans	-168.5	88.4	157.8	0	0	0	0	0	112.8
771	G	28.3	Very low	35	Very low	77 Å²	77	142.9 Å²	142.9	79%	0.794	77%	0.773	S	S	*	*			trans	168.1	59.9	168.1	0	0	0	0	0	117.2	K773	G771-K773 PolarHBondContact O-N 3.04Å
772	G	36.9	Very low	33.3	Very low	86 Å²	86	145 Å²	145	89%	0.887	78%	0.783	S	S	*	*			trans	-66.1	102.3	167.9	0	0	0	0	0	112.1
773	K	30.3	Very low	32	Very low	196 Å²	196	144.2 Å²	144.2	85%	0.852	79%	0.792	S	S	*	*			trans	-149.7	143.3	152.7	-86.3	-169.1	-178.8	171.1	0	110.7	G771	G771-K773 PolarHBondContact O-N 3.04Å
774	P	32.3	Very low	31.2	Very low	126 Å²	126	150 Å²	150	82%	0.818	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-77.6	131.1	-172.9	31.4	-32.8	0	0	0	111.4
775	M	27.5	Very low	30.8	Very low	187 Å²	187	152 Å²	152	92%	0.921	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-84.4	120.7	174.9	-163.1	170.2	169.5	0	0	109.7
776	K	27.1	Very low	30.1	Very low	194 Å²	194	157.1 Å²	157.1	84%	0.843	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-69.4	129.6	170.9	-78	177.7	173	-179.8	0	109.3	K778	K776-K778 PolarHBondContact O-N 3.39Å
777	I	30.3	Very low	29.7	Very low	164 Å²	164	156.1 Å²	156.1	84%	0.841	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-63.3	123.1	167.3	-61.8	167.9	0	0	0	107.9
778	K	25.6	Very low	29.4	Very low	185 Å²	185	156.8 Å²	156.8	80%	0.804	86%	0.855	S	S	*	*			trans	-112.9	113.3	163	-99.7	-173	169.4	-168.4	0	107.1	K776	K776-K778 PolarHBondContact O-N 3.39Å
779	E	27.6	Very low	29.1	Very low	178 Å²	178	153.2 Å²	153.2	83%	0.832	85%	0.852	S	S	*	*			trans	-69.7	131.7	161.1	-70.8	169.9	140.9	0	0	109
780	E	27.3	Very low	28.8	Very low	177 Å²	177	153.4 Å²	153.4	83%	0.827	85%	0.853	S	S	*	*			trans	-128	94.9	157.9	-79.4	-175.4	172.2	0	0	105.6
781	V	28	Very low	28.2	Very low	131 Å²	131	154.7 Å²	154.7	79%	0.794	85%	0.85	S	S	*	*				64.9	94.9	95.3	-177.3	0	0	0	0	112.6
782	L	27.9	Very low	28.2	Very low	171 Å²	171	159.7 Å²	159.7	90%	0.895	85%	0.853	S	S	*	*			trans	-66.6	127.6	155.8	-76.9	153.8	0	0	0	108.9
783	S	26.6	Very low	27.7	Very low	119 Å²	119	160.8 Å²	160.8	83%	0.832	84%	0.842	S	S	*	*			trans	-89.2	101.6	167.1	57.1	0	0	0	0	109.5
784	E	27.9	Very low	27.5	Very low	185 Å²	185	159.8 Å²	159.8	86%	0.864	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-95.7	131.8	158.3	-77.8	-177.2	160.5	0	0	108.5
785	S	27.2	Very low	27.2	Very low	123 Å²	123	159.2 Å²	159.2	86%	0.86	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-80.2	123.9	174.8	50.3	0	0	0	0	110.6
786	E	27.1	Very low	27.2	Very low	192 Å²	192	159 Å²	159	90%	0.897	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-66	148	173.3	-66.2	175	146.8	0	0	113
787	S	27	Very low	27.2	Very low	116 Å²	116	153.9 Å²	153.9	81%	0.811	83%	0.826	S	S	*	*			trans	-152.1	101.7	134.8	64.8	0	0	0	0	110.8
788	E	28.2	Very low	27	Very low	188 Å²	188	154 Å²	154	88%	0.879	82%	0.823	S	S	*	*			trans	24.9	123	140.8	-63.5	176	164.1	0	0	120
789	S	26.3	Very low	27.1	Very low	125 Å²	125	152.5 Å²	152.5	87%	0.874	82%	0.818	S	S	*	*				-158.8	130.1	125.7	43.7	0	0	0	0	111.2
790	E	28	Very low	27	Very low	199 Å²	199	151 Å²	151	93%	0.93	82%	0.816	S	S	*	*			trans	-71.1	148.5	-177.3	-66.2	171.9	141.4	0	0	112.5
791	T	25.4	Very low	27.1	Very low	130 Å²	130	146.9 Å²	146.9	80%	0.798	81%	0.812	S	S	*	*			trans	-73.5	142.2	167.1	45.2	0	0	0	0	111.7
792	E	27.1	Very low	27	Very low	181 Å²	181	145.1 Å²	145.1	85%	0.846	81%	0.812	S	S	*	*			trans	-164.9	113.2	134.4	-107.4	173.2	-160.5	0	0	112.4
793	T	26.3	Very low	27	Very low	109 Å²	109	141 Å²	141	67%	0.669	80%	0.802	S	S	*	*			trans	40	132.6	134.2	51	0	0	0	0	124.2
794	E	26.5	Very low	27.1	Very low	175 Å²	175	143.4 Å²	143.4	82%	0.818	81%	0.805	S	S	*	*			trans	68.7	141.5	140	-68.1	178.9	-173.8	0	0	117
795	T	27	Very low	27.2	Very low	115 Å²	115	141.5 Å²	141.5	71%	0.706	80%	0.801	S	S	*	*			cis	-168.9	157.8	12.4	15.7	0	0	0	0	108.3
796	E	27.2	Very low	28.2	Very low	182 Å²	182	140.6 Å²	140.6	85%	0.85	79%	0.792	S	S	*	*			trans	47.1	125.2	145.4	-64.2	-173.1	164.6	0	0	124.5
797	A	27	Very low	28.2	Very low	86 Å²	86	137.8 Å²	137.8	71%	0.711	78%	0.783	S	S	*	*				81.8	126	126.7	0	0	0	0	0	123.6
798	H	26.5	Very low	28.5	Very low	168 Å²	168	138.8 Å²	138.8	78%	0.778	78%	0.778	S	S	*	*			trans	75.8	123.8	137.4	-82.7	-52.8	0	0	0	123.4
799	Q	27.3	Very low	28.5	Very low	153 Å²	153	136.9 Å²	136.9	72%	0.715	78%	0.779	S	S	*	*				83.1	119	128.7	-83.7	176.9	-22.4	0	0	122.1
800	D	26.2	Very low	28.7	Very low	145 Å²	145	137.5 Å²	137.5	78%	0.775	77%	0.771	S	S	*	*				66.4	137.6	124.9	-73.8	-29.1	0	0	0	123
801	A	27.6	Very low	28.6	Very low	91 Å²	91	137.2 Å²	137.2	75%	0.752	77%	0.766	S	S	*	*			trans	83.6	103.6	141.9	0	0	0	0	0	119.6
802	A	27.7	Very low	28.8	Very low	95 Å²	95	136.3 Å²	136.3	79%	0.785	76%	0.76	S	S	*	*				70.2	126.9	112	0	0	0	0	0	120.3
803	A	27.9	Very low	28.8	Very low	85 Å²	85	135.1 Å²	135.1	70%	0.702	76%	0.755	S	S	*	*				112.6	137	123.7	0	0	0	0	0	117.8
804	L	28	Very low	29	Very low	168 Å²	168	139.8 Å²	139.8	88%	0.88	77%	0.766	S	S	*	*			trans	93.6	96.4	147.4	-65.6	144.9	0	0	0	118.8
805	D	30.5	Very low	29.2	Very low	146 Å²	146	137.9 Å²	137.9	78%	0.781	76%	0.761	S	S	*	*				-42.9	161.8	128.4	-86.4	-30.2	0	0	0	111.9
806	P	47.7	Very low	29.6	Very low	104 Å²	104	138.9 Å²	138.9	68%	0.675	76%	0.762	S	S	*	*			cis	-150.8	-167.6	37.1	37	-12.2	0	0	0	116.8
807	D	27.9	Very low	30.9	Very low	133 Å²	133	134.7 Å²	134.7	71%	0.711	75%	0.75	S	S	*	*			trans	112	90	149.2	-68.1	-19.7	0	0	0	119.6
808	I	31.8	Very low	31.6	Very low	137 Å²	137	140.2 Å²	140.2	70%	0.703	76%	0.762	S	S	*	*				32.1	116.7	112.5	-54.4	168.3	0	0	0	116.8
809	V	29.5	Very low	32.4	Very low	147 Å²	147	139.8 Å²	139.8	89%	0.891	76%	0.764	S	S	*	*				-151.7	135.8	129.4	177	0	0	0	0	110.8
810	I	29.6	Very low	33	Very low	138 Å²	138	140.3 Å²	140.3	71%	0.708	77%	0.772	S	S	*	*			trans	-81.8	154.8	-178.3	-61.8	154.5	0	0	0	112.1
811	K	27.1	Very low	33.7	Very low	193 Å²	193	142.6 Å²	142.6	84%	0.839	80%	0.799	S	S	*	*			trans	138.7	146.8	138.5	-78.9	-168.9	171.5	173.5	0	111.7
812	V	28.6	Very low	34	Very low	111 Å²	111	145.2 Å²	145.2	67%	0.673	80%	0.802	S	S	*	*			cis	-167.7	155.2	-5.4	135	0	0	0	0	107
813	E	28.1	Very low	34.4	Very low	157 Å²	157	147.8 Å²	147.8	73%	0.734	80%	0.802	S	S	*	*			trans	-24.8	151.1	167.5	-59.3	160	138.6	0	0	119.9
814	K	28.8	Very low	34.7	Very low	206 Å²	206	151.3 Å²	151.3	90%	0.896	81%	0.808	S	S	*	*				-161.1	124.7	116.1	-109.3	173.9	-179.5	-177.6	0	112.8
815	L	31.6	Very low	35.1	Very low	135 Å²	135	150.4 Å²	150.4	71%	0.707	80%	0.804	S	S	*	*			trans	-65.5	158.4	155.3	-71.4	90.7	0	0	0	109.5
816	D	35.2	Very low	35.4	Very low	136 Å²	136	150.6 Å²	150.6	73%	0.727	81%	0.805	S	S	*	*				161.4	-177.7	71.7	-116.8	-16.1	0	0	0	105.4
817	P	55.1	Low	34.6	Very low	95 Å²	95	153.7 Å²	153.7	62%	0.617	81%	0.814	S	S	*	*				-134.2	-177.8	-57.7	34.7	-14.6	0	0	0	110.9
818	E	40.1	Very low	35.1	Very low	202 Å²	202	155.2 Å²	155.2	94%	0.944	82%	0.821	S	S	*	*			trans	-145.6	134.3	147.4	-115	174	-162.1	0	0	111
819	L	44.6	Very low	35.3	Very low	159 Å²	159	156.6 Å²	156.6	83%	0.832	83%	0.83	S	S	*	*			trans	-95.5	141.2	-171.4	-89.1	123	0	0	0	110.9
820	D	40.1	Very low	35.8	Very low	164 Å²	164	157.4 Å²	157.4	88%	0.877	83%	0.825	S	S	*	*			trans	-83.8	137.1	155.8	-87.4	-32.8	0	0	0	110.8
821	S	40.8	Very low	36.4	Very low	193 Å²	193	159.2 Å²	159.2	100%	1.35	84%	0.836	S	S	*	*			trans	-150.8	0	146.4	66.8	0	0	0	0	109.9

Retrieved 821 of 821 residues in 1028.4 ms (Link to these results)

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