A0A077ZA59_TRITR Loading...

Dynamin

AlphaFold DB , UniProt , Accession A0A077ZA59, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 875 aa.

						>A0A077ZA59_TRITR|A0A077ZA59
MAWMNQGMQQLIPLVNQLQDAFTHLGVSLALDLPQIAVVGGQSAGKSSVLEAFVGKDFLPRGSGIVTRRPLILQLIHDNSVEYGEFLHKKGQKYGDFDLIRQEIEAETDRAVGSNKGISSLPINLRVYSPNVLNLTLIDLPGLTKVPVGDQPPDIEQQIRDMILTYITRENCLILAVTAANTDLATSDALKMAKEVDPAGQRTIGVITKLDLMDEGTDAREILENRLLPLRRGYIGIVNRSQKDIDGKKDIRAALEAERRFFLSHPSYRHMADRMGTPFLQKVLNQQLTNHIRDTLPALRDRLQKQMLLLEKDVAEYKNYRPDDPARKTKAMLQMVQQFCADFEKSIEGSSGKDVSVNELSGGARINRLFHERFPFEIVKMEINEKELRKEIAYAIRNIHGIRVGLFTPDMAFEAIVKKQISRLKEPALKCVDLVVTELGTVINSCAENMSRYPRLREDVERIVNSQLRDREQRCKDQLILLVEYELAYMNTNHEDFIGFANAEAKASATQRQKNLGNQVIRKGWLTIHNISFMKGGSRDFWFVLSSDNLSWYKDDEEKEKKYMLPLDGLKLRDVEAGFMSRTHKFALFYPDNKNVYKDYKQLELSALTLDDVEAWKASFLRAGVYPEKQPRQDEEVAEESSSMDPQLERQVETIRNLVDSYMRIVTKTIRDLVPKAIMHLMIHSTNEFIHSELLAHLYQCGDQDSLMEESAAATQRREEMLRMYHACKEALRIIGDVSMSTASAIVSAPPMQIDIAPSKPWAKPENVIPPRPIAANGPSSPSLPRVASNPGAVRATAAAGNWPAQLYPTAPTSAAASSVPANPIPKIPSRPAPTLNQSLPPPLIPQKVIHPPNYAYNKPAPKIPDRPAVTQRPY
					

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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	29	Very low	49.8	Very low	210 Å²	210	91 Å²	91	100%	1.034	45%	0.454	S	S	*	.				0	-63.9	0	-65	-169.3	-171.7	0	0	112.5	W3 M4	M1-W3 VanDerWaalsContact C-N 3.33Å; M1-W3 PolarHBondContact O-N 3.13Å; M1-W3 VanDerWaalsContact O-N 3.07Å; M1-M4 PolarHBondContact O-N 3.42Å
2	A	29.7	Very low	52.1	Low	77 Å²	77	83.6 Å²	83.6	64%	0.636	42%	0.417	S	S	*	.	H	α-helix	trans	-45	-46.3	-170.4	0	0	0	0	0	116.2	M4 N5	A2-M4 VanDerWaalsContact C-N 3.3Å; A2-M4 PolarHBondContact O-N 2.87Å; A2-N5 WeakPolarHBondContact O-CB 3.38Å; A2-N5 PolarHBondContact O-N 2.92Å
3	W	30.8	Very low	54.1	Low	216 Å²	216	79.5 Å²	79.5	82%	0.818	40%	0.4	S	S	*	.	H	α-helix	trans	-56.7	-34.5	179.2	-69.3	92.8	0	0	0	114.8	M1 N5 Q6	M1-W3 VanDerWaalsContact C-N 3.33Å; M1-W3 PolarHBondContact O-N 3.13Å; M1-W3 VanDerWaalsContact O-N 3.07Å; W3-N5 PolarHBondContact O-N 3.25Å; W3-Q6 PolarHBondContact O-N 3.35Å
4	M	37	Very low	55.8	Low	70 Å²	70	73.9 Å²	73.9	35%	0.345	37%	0.372	S	S	.	.	H	α-helix	trans	-68.4	-20.9	177.1	-71.8	162.7	65.3	0	0	112.8	M1 A2 V747 A749	M1-M4 PolarHBondContact O-N 3.42Å; A2-M4 VanDerWaalsContact C-N 3.3Å; A2-M4 PolarHBondContact O-N 2.87Å; M4-V747 WeakPolarHBondContact CE-O 3.42Å; M4-A749 HydrophobicContact CE-CB 4.12Å
5	N	47	Very low	57.2	Low	74 Å²	74	69.5 Å²	69.5	40%	0.396	35%	0.35	S	S	.	.	H	α-helix	trans	-80.5	-21.9	-179	-73.7	1.3	0	0	0	113.3	A2 W3 G7 M8 Q9	A2-N5 WeakPolarHBondContact O-CB 3.38Å; A2-N5 PolarHBondContact O-N 2.92Å; W3-N5 PolarHBondContact O-N 3.25Å; N5-G7 PolarHBondContact O-N 3.05Å; N5-M8 CarbonylContact O-C 3.57Å; N5-M8 PolarHBondContact O-N 2.92Å; N5-M8 VanDerWaalsContact O-N 3.08Å; N5-M8 VanDerWaalsContact OD1-CE 3.25Å; N5-M8 WeakPolarHBondContact OD1-CE 3.39Å; N5-Q9 WeakPolarHBondContact O-CB 3.43Å; N5-Q9 WeakPolarHBondContact O-CG 3.22Å; N5-Q9 PolarHBondContact O-N 3.3Å
6	Q	49.7	Very low	58.3	Low	113 Å²	113	65.6 Å²	65.6	53%	0.528	33%	0.331	S	S	.	.	H	α-helix	trans	-60.7	-47.3	-171.5	-77.4	-175.2	-31.3	0	0	113	W3 M8 Q9	W3-Q6 PolarHBondContact O-N 3.35Å; Q6-M8 VanDerWaalsContact C-N 3.33Å; Q6-M8 PolarHBondContact O-N 2.81Å; Q6-Q9 PolarHBondContact O-N 3.49Å
7	G	56.1	Low	59.4	Low	16 Å²	16	67.5 Å²	67.5	17%	0.165	34%	0.338	C	S	.	.	H	α-helix	trans	-62.9	-40.2	174	0	0	0	0	0	112.2	N5 Q9 Q10 T742	N5-G7 PolarHBondContact O-N 3.05Å; G7-Q9 VanDerWaalsContact C-N 3.32Å; G7-Q9 PolarHBondContact O-N 3.4Å; G7-Q10 WeakPolarHBondContact O-CB 3.12Å; G7-Q10 PolarHBondContact O-N 2.97Å; G7-T742 VanDerWaalsContact O-CG2 3.31Å; G7-T742 WeakPolarHBondContact O-CG2 3.45Å
8	M	56.5	Low	60.4	Low	47 Å²	47	63.8 Å²	63.8	23%	0.232	32%	0.32	C	S	.	.	H	α-helix	trans	-67.3	-31.6	179.2	-56.5	-163.6	-68.8	0	0	112.5	N5 Q6 Q10 L11 T289 R293	N5-M8 CarbonylContact O-C 3.57Å; N5-M8 PolarHBondContact O-N 2.92Å; N5-M8 VanDerWaalsContact O-N 3.08Å; N5-M8 VanDerWaalsContact OD1-CE 3.25Å; N5-M8 WeakPolarHBondContact OD1-CE 3.39Å; Q6-M8 VanDerWaalsContact C-N 3.33Å; Q6-M8 PolarHBondContact O-N 2.81Å; M8-Q10 PolarHBondContact O-N 3.06Å; M8-L11 VanDerWaalsContact O-CB 3.3Å; M8-L11 WeakPolarHBondContact O-CB 3.42Å; M8-L11 WeakPolarHBondContact O-CG 3.46Å; M8-L11 PolarHBondContact O-N 3.21Å; M8-L11 VanDerWaalsContact O-N 3.13Å; M8-T289 HydrophobicContact CB-CG2 3.7Å; M8-T289 WeakPolarHBondContact O-CG2 3.38Å; M8-R293 PolarHBondContact SD-NH2 2.88Å
9	Q	64	Low	61.2	Low	66 Å²	66	61.7 Å²	61.7	31%	0.308	31%	0.309	S	S	.	.	H	α-helix	trans	-68.3	-16	175.4	-76.4	171.5	-35.2	0	0	113.7	N5 Q6 G7 L11 P13 N134	N5-Q9 WeakPolarHBondContact O-CB 3.43Å; N5-Q9 WeakPolarHBondContact O-CG 3.22Å; N5-Q9 PolarHBondContact O-N 3.3Å; Q6-Q9 PolarHBondContact O-N 3.49Å; G7-Q9 VanDerWaalsContact C-N 3.32Å; G7-Q9 PolarHBondContact O-N 3.4Å; Q9-L11 VanDerWaalsContact C-N 3.35Å; Q9-P13 WeakPolarHBondContact O-CD 3.34Å; Q9-N134 PolarHBondContact O-ND2 3.45Å
10	Q	71.5	Confident	61.7	Low	102 Å²	102	59.8 Å²	59.8	48%	0.477	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-14.5	172.2	-59.2	-61.5	-14.6	0	0	113.3	G7 M8 I12 P13 L14 V738	G7-Q10 WeakPolarHBondContact O-CB 3.12Å; G7-Q10 PolarHBondContact O-N 2.97Å; M8-Q10 PolarHBondContact O-N 3.06Å; Q10-I12 VanDerWaalsContact C-N 3.27Å; Q10-I12 PolarHBondContact O-N 3.2Å; Q10-P13 WeakPolarHBondContact O-CD 3.45Å; Q10-L14 WeakPolarHBondContact O-CB 3.26Å; Q10-L14 PolarHBondContact O-N 3.37Å; Q10-V738 HydrophobicContact CB-CG1 4.39Å
11	L	77	Confident	62.1	Low	10 Å²	10	57.6 Å²	57.6	5%	0.052	29%	0.291	C	S	.	.	H	α-helix	trans	-66.7	-26.2	179.1	-64.4	177.4	0	0	0	113.2	M8 Q9 L14 V15 T289 I292 R293 L296 V738 T742	M8-L11 VanDerWaalsContact O-CB 3.3Å; M8-L11 WeakPolarHBondContact O-CB 3.42Å; M8-L11 WeakPolarHBondContact O-CG 3.46Å; M8-L11 PolarHBondContact O-N 3.21Å; M8-L11 VanDerWaalsContact O-N 3.13Å; Q9-L11 VanDerWaalsContact C-N 3.35Å; L11-L14 HydrophobicContact CD2-CD2 4.14Å; L11-L14 WeakPolarHBondContact O-CB 3.42Å; L11-V15 PolarHBondContact O-N 3.34Å; L11-T289 HydrophobicContact CD1-CG2 4.36Å; L11-I292 HydrophobicContact CB-CB 4.38Å; L11-I292 HydrophobicContact CB-CG2 3.88Å; L11-R293 HydrophobicContact CD1-CB 4.17Å; L11-L296 HydrophobicContact CD2-CD2 4.24Å; L11-V738 HydrophobicContact CD2-CG1 4.07Å; L11-T742 HydrophobicContact CD2-CG2 4.5Å
12	I	77.2	Confident	64.1	Low	2 Å²	2	48.3 Å²	48.3	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-77.9	-49.5	176.7	-66	169.6	0	0	0	111	Q10 L14 V15 N16 N134 L288 I292	Q10-I12 VanDerWaalsContact C-N 3.27Å; Q10-I12 PolarHBondContact O-N 3.2Å; I12-L14 PolarHBondContact O-N 3.1Å; I12-V15 PolarHBondContact O-N 3.18Å; I12-N16 PolarHBondContact O-N 3.12Å; I12-N16 VanDerWaalsContact O-N 3.1Å; I12-N134 HydrophobicContact CB-CB 4.38Å; I12-N134 HydrophobicContact CD1-CB 4.46Å; I12-N134 WeakPolarHBondContact CD1-O 3.21Å; I12-N134 HydrophobicContact CG2-CB 4.38Å; I12-L288 HydrophobicContact CD1-CB 4.42Å; I12-L288 HydrophobicContact CD1-CD2 3.9Å; I12-L288 HydrophobicContact CD1-CG 4.16Å; I12-L288 HydrophobicContact CG1-CD2 3.97Å; I12-L288 HydrophobicContact CG1-CG 4.14Å; I12-L288 HydrophobicContact CG2-CD2 4.44Å; I12-I292 HydrophobicContact CB-CD1 4.48Å; I12-I292 HydrophobicContact CG1-CD1 3.67Å
13	P	77.8	Confident	66	Low	30 Å²	30	48.3 Å²	48.3	20%	0.195	24%	0.237	C	C	.	.	H	α-helix	trans	-50	-40.2	165.5	-30.6	35.7	0	0	0	114.3	Q9 Q10 N16 Q17	Q9-P13 WeakPolarHBondContact O-CD 3.34Å; Q10-P13 WeakPolarHBondContact O-CD 3.45Å; P13-N16 PolarHBondContact O-N 3.08Å; P13-Q17 WeakPolarHBondContact O-CG 3.42Å; P13-Q17 PolarHBondContact O-N 2.88Å
14	L	77.3	Confident	67.6	Low	1 Å²	1	43.1 Å²	43.1	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-56.2	-50.5	175	172	67.7	0	0	0	112.4	Q10 L11 I12 N16 Q17 L18 L296 I734 V738	Q10-L14 WeakPolarHBondContact O-CB 3.26Å; Q10-L14 PolarHBondContact O-N 3.37Å; L11-L14 HydrophobicContact CD2-CD2 4.14Å; L11-L14 WeakPolarHBondContact O-CB 3.42Å; I12-L14 PolarHBondContact O-N 3.1Å; L14-N16 VanDerWaalsContact C-N 3.29Å; L14-N16 PolarHBondContact O-N 3.28Å; L14-Q17 PolarHBondContact O-N 3.15Å; L14-L18 WeakPolarHBondContact O-CG 3.49Å; L14-L18 PolarHBondContact O-N 3.08Å; L14-L296 HydrophobicContact CD2-CD1 4.1Å; L14-L296 HydrophobicContact CD2-CD2 3.58Å; L14-I734 HydrophobicContact CD1-CG2 3.45Å; L14-I734 VanDerWaalsContact CD1-CG2 3.45Å; L14-I734 WeakPolarHBondContact CD1-O 3.33Å; L14-V738 HydrophobicContact CB-CG1 4.42Å; L14-V738 HydrophobicContact CB-CG2 4.17Å; L14-V738 HydrophobicContact CD1-CB 4.02Å; L14-V738 HydrophobicContact CD1-CG2 3.79Å; L14-V738 HydrophobicContact CD2-CB 4.07Å; L14-V738 HydrophobicContact CD2-CG1 4.04Å; L14-V738 HydrophobicContact CG-CB 4.43Å; L14-V738 HydrophobicContact CG-CG2 4.38Å
15	V	77.1	Confident	68.9	Low	9 Å²	9	42.7 Å²	42.7	6%	0.055	22%	0.22	C	C	.	.	H	α-helix	trans	-65.5	-34.9	179.3	173.3	0	0	0	0	111.4	L11 I12 L18 Q19 L33 I292	L11-V15 PolarHBondContact O-N 3.34Å; I12-V15 PolarHBondContact O-N 3.18Å; V15-L18 PolarHBondContact O-N 3.17Å; V15-Q19 WeakPolarHBondContact O-CB 3.35Å; V15-Q19 PolarHBondContact O-N 3.21Å; V15-L33 HydrophobicContact CG1-CB 4.15Å; V15-L33 HydrophobicContact CG1-CD1 4.47Å; V15-I292 HydrophobicContact CB-CD1 4.48Å; V15-I292 HydrophobicContact CG2-CD1 3.85Å; V15-I292 HydrophobicContact CG2-CG1 3.92Å; V15-I292 HydrophobicContact CG2-CG2 3.82Å
16	N	75.1	Confident	69.3	Low	6 Å²	6	42.4 Å²	42.4	3%	0.032	24%	0.235	C	C	.	.	H	α-helix	trans	-66.7	-38	175	-65.5	-13.2	0	0	0	112.1	I12 P13 L14 Q19 D20 T136	I12-N16 PolarHBondContact O-N 3.12Å; I12-N16 VanDerWaalsContact O-N 3.1Å; P13-N16 PolarHBondContact O-N 3.08Å; L14-N16 VanDerWaalsContact C-N 3.29Å; L14-N16 PolarHBondContact O-N 3.28Å; N16-Q19 PolarHBondContact O-N 2.94Å; N16-D20 PolarHBondContact O-N 3.47Å; N16-T136 PolarHBondContact ND2-OG1 3.21Å; N16-T136 VanDerWaalsContact ND2-OG1 3.1Å; N16-T136 PolarHBondContact OD1-OG1 3.46Å
17	Q	76.8	Confident	69.6	Low	99 Å²	99	38 Å²	38	46%	0.463	22%	0.215	S	C	.	.	H	α-helix	trans	-65.1	-39.8	172.7	-74.3	177.3	-12.5	0	0	112.3	P13 L14 A21 I734	P13-Q17 WeakPolarHBondContact O-CG 3.42Å; P13-Q17 PolarHBondContact O-N 2.88Å; L14-Q17 PolarHBondContact O-N 3.15Å; Q17-A21 WeakPolarHBondContact O-CB 3.21Å; Q17-A21 PolarHBondContact O-N 2.63Å; Q17-I734 HydrophobicContact CB-CD1 4.44Å; Q17-I734 HydrophobicContact CB-CG2 3.92Å
18	L	77.1	Confident	69.3	Low	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-47.4	172.7	-67.8	173.3	0	0	0	111.1	L14 V15 D20 A21 F22 L33 L299 A731 I734 I735	L14-L18 WeakPolarHBondContact O-CG 3.49Å; L14-L18 PolarHBondContact O-N 3.08Å; V15-L18 PolarHBondContact O-N 3.17Å; L18-D20 VanDerWaalsContact C-N 3.35Å; L18-D20 PolarHBondContact O-N 2.73Å; L18-A21 PolarHBondContact O-N 2.72Å; L18-A21 VanDerWaalsContact O-N 3.15Å; L18-F22 HydrophobicContact CD2-CE2 4.5Å; L18-F22 WeakPolarHBondContact O-CD2 3.28Å; L18-F22 PolarHBondContact O-N 2.9Å; L18-F22 VanDerWaalsContact O-N 3.09Å; L18-L33 HydrophobicContact CB-CD1 4.35Å; L18-L33 HydrophobicContact CB-CD2 4.24Å; L18-L33 HydrophobicContact CD1-CD2 4.26Å; L18-L299 HydrophobicContact CD1-CD2 4.31Å; L18-A731 HydrophobicContact CD2-CB 3.62Å; L18-I734 HydrophobicContact CD2-CB 4.03Å; L18-I734 HydrophobicContact CD2-CG2 3.69Å; L18-I734 HydrophobicContact CG-CG2 3.88Å; L18-I735 HydrophobicContact CD1-CD1 4.19Å; L18-I735 HydrophobicContact CD1-CG1 4.01Å; L18-I735 HydrophobicContact CD2-CD1 4.41Å; L18-I735 HydrophobicContact CD2-CG1 4.15Å
19	Q	75.9	Confident	69	Low	25 Å²	25	42.1 Å²	42.1	12%	0.117	24%	0.244	C	C	.	.	H	α-helix	trans	-58.6	-44.1	178.7	-172.3	170.8	46.5	0	0	112	V15 N16 T23 L33	V15-Q19 WeakPolarHBondContact O-CB 3.35Å; V15-Q19 PolarHBondContact O-N 3.21Å; N16-Q19 PolarHBondContact O-N 2.94Å; Q19-T23 WeakPolarHBondContact O-CB 3.49Å; Q19-T23 PolarHBondContact O-N 3.04Å; Q19-T23 VanDerWaalsContact O-N 3.11Å; Q19-T23 PolarHBondContact O-OG1 3.23Å; Q19-L33 HydrophobicContact CB-CD1 3.9Å; Q19-L33 HydrophobicContact CG-CD1 4.5Å
20	D	71.7	Confident	68.6	Low	23 Å²	23	42.4 Å²	42.4	12%	0.123	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-48.8	172.4	-84	27.6	0	0	0	111.5	N16 L18 F22 T23 H24 R126	N16-D20 PolarHBondContact O-N 3.47Å; L18-D20 VanDerWaalsContact C-N 3.35Å; L18-D20 PolarHBondContact O-N 2.73Å; D20-F22 PolarHBondContact O-N 3.05Å; D20-T23 PolarHBondContact O-N 2.97Å; D20-H24 WeakPolarHBondContact O-CB 3.26Å; D20-H24 PolarHBondContact O-CD2 3.01Å; D20-H24 PolarHBondContact O-N 3.18Å; D20-R126 IonicContact OD1-CZ 3.91Å; D20-R126 IonicContact OD1-NH1 3.05Å; D20-R126 IonicContact OD1-NH2 2.88Å; D20-R126 PolarHBondContact OD1-NH2 3.26Å; D20-R126 IonicContact OD2-CZ 3.34Å; D20-R126 IonicContact OD2-NH1 2.68Å; D20-R126 PolarHBondContact OD2-NH1 2.95Å; D20-R126 IonicContact OD2-NH2 2.92Å; D20-R126 PolarHBondContact OD2-NH2 2.87Å
21	A	70.6	Confident	68.1	Low	14 Å²	14	38 Å²	38	12%	0.116	24%	0.237	C	C	.	.	H	α-helix	trans	-60.4	-45.4	-175.7	0	0	0	0	0	112.7	Q17 L18 H24 L25 E730 I734	Q17-A21 WeakPolarHBondContact O-CB 3.21Å; Q17-A21 PolarHBondContact O-N 2.63Å; L18-A21 PolarHBondContact O-N 2.72Å; L18-A21 VanDerWaalsContact O-N 3.15Å; A21-H24 PolarHBondContact O-N 2.91Å; A21-L25 WeakPolarHBondContact O-CG 3.39Å; A21-L25 PolarHBondContact O-N 3.05Å; A21-E730 HydrophobicContact CB-CG 4.47Å; A21-I734 HydrophobicContact CB-CD1 4.07Å
22	F	70.2	Confident	67.7	Low	15 Å²	15	39.4 Å²	39.4	7%	0.066	25%	0.245	C	C	.	.	H	α-helix	trans	-69.1	-39.5	176.9	-71.2	-69.9	0	0	0	112.5	L18 D20 H24 L25 G26 V27 L29 L31 L303 A727 A731	L18-F22 HydrophobicContact CD2-CE2 4.5Å; L18-F22 WeakPolarHBondContact O-CD2 3.28Å; L18-F22 PolarHBondContact O-N 2.9Å; L18-F22 VanDerWaalsContact O-N 3.09Å; D20-F22 PolarHBondContact O-N 3.05Å; F22-H24 VanDerWaalsContact C-N 3.33Å; F22-H24 PolarHBondContact O-N 3.42Å; F22-L25 PolarHBondContact O-N 2.86Å; F22-G26 PolarHBondContact O-N 3.07Å; F22-V27 PolarHBondContact O-N 2.87Å; F22-L29 HydrophobicContact CD1-CB 4.05Å; F22-L29 HydrophobicContact CD1-CD2 4.2Å; F22-L29 HydrophobicContact CE1-CB 4.2Å; F22-L29 HydrophobicContact CE1-CD2 3.49Å; F22-L29 VanDerWaalsContact CE1-CD2 3.49Å; F22-L29 HydrophobicContact CE1-CG 4.43Å; F22-L29 HydrophobicContact CZ-CD2 3.98Å; F22-L31 HydrophobicContact CD2-CD1 3.75Å; F22-L31 HydrophobicContact CE1-CD1 4.24Å; F22-L31 HydrophobicContact CE2-CD1 3.19Å; F22-L31 HydrophobicContact CE2-CG 4.36Å; F22-L31 HydrophobicContact CZ-CD1 3.48Å; F22-L31 VanDerWaalsContact CZ-CD1 3.48Å; F22-L31 HydrophobicContact CZ-CG 4.44Å; F22-L303 HydrophobicContact CZ-CD2 4.04Å; F22-A727 HydrophobicContact CD1-CB 3.98Å; F22-A727 HydrophobicContact CE1-CB 3.66Å; F22-A731 HydrophobicContact CE2-CB 3.63Å; F22-A731 HydrophobicContact CZ-CB 3.42Å; F22-A731 VanDerWaalsContact CZ-CB 3.42Å
23	T	68.7	Low	67.6	Low	76 Å²	76	40 Å²	40	47%	0.466	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-41	175.8	-54.6	0	0	0	0	111.3	Q19 D20 G26 L87	Q19-T23 WeakPolarHBondContact O-CB 3.49Å; Q19-T23 PolarHBondContact O-N 3.04Å; Q19-T23 VanDerWaalsContact O-N 3.11Å; Q19-T23 PolarHBondContact O-OG1 3.23Å; D20-T23 PolarHBondContact O-N 2.97Å; T23-G26 PolarHBondContact O-N 3.42Å; T23-L87 HydrophobicContact CG2-CD2 4.04Å
24	H	65.8	Low	67.7	Low	107 Å²	107	38.9 Å²	38.9	50%	0.495	24%	0.24	S	C	.	.	H	α-helix	trans	-70.6	-32.6	-179.8	-87.1	-55.9	0	0	0	114.8	D20 A21 F22 G26 K90	D20-H24 WeakPolarHBondContact O-CB 3.26Å; D20-H24 PolarHBondContact O-CD2 3.01Å; D20-H24 PolarHBondContact O-N 3.18Å; A21-H24 PolarHBondContact O-N 2.91Å; F22-H24 VanDerWaalsContact C-N 3.33Å; F22-H24 PolarHBondContact O-N 3.42Å; H24-G26 PolarHBondContact O-N 3.33Å; H24-K90 PolarHBondContact CE1-NZ 2.73Å; H24-K90 VanDerWaalsContact NE2-CE 3.28Å; H24-K90 WeakPolarHBondContact NE2-CE 3.32Å; H24-K90 PolarHBondContact NE2-NZ 3.23Å
25	L	64.1	Low	68.2	Low	62 Å²	62	39.5 Å²	39.5	33%	0.325	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-3	179.7	-65.2	168.1	0	0	0	112.4	A21 F22 V27 A727	A21-L25 WeakPolarHBondContact O-CG 3.39Å; A21-L25 PolarHBondContact O-N 3.05Å; F22-L25 PolarHBondContact O-N 2.86Å; L25-V27 HydrophobicContact CB-CG2 3.8Å; L25-V27 WeakPolarHBondContact O-CG2 3.38Å; L25-V27 PolarHBondContact O-N 3.43Å; L25-A727 HydrophobicContact CB-CB 4.42Å; L25-A727 HydrophobicContact CD1-CB 3.47Å; L25-A727 VanDerWaalsContact CD1-CB 3.47Å
26	G	55.6	Low	69	Low	68 Å²	68	39.1 Å²	39.1	70%	0.701	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.6	16.7	-178.8	0	0	0	0	0	113.3	F22 T23 H24	F22-G26 PolarHBondContact O-N 3.07Å; T23-G26 PolarHBondContact O-N 3.42Å; H24-G26 PolarHBondContact O-N 3.33Å
27	V	55.4	Low	70	Confident	20 Å²	20	38.8 Å²	38.8	12%	0.121	24%	0.239	C	C	.	.			trans	-91.5	113.8	-172.5	-174.2	0	0	0	0	108.8	F22 L25 L29 R723 M724 A727	F22-V27 PolarHBondContact O-N 2.87Å; L25-V27 HydrophobicContact CB-CG2 3.8Å; L25-V27 WeakPolarHBondContact O-CG2 3.38Å; L25-V27 PolarHBondContact O-N 3.43Å; V27-L29 HydrophobicContact CG1-CB 3.9Å; V27-L29 PolarHBondContact O-N 2.99Å; V27-R723 HydrophobicContact CG2-CB 4.28Å; V27-M724 HydrophobicContact CG1-CE 3.43Å; V27-M724 VanDerWaalsContact CG1-CE 3.43Å; V27-M724 HydrophobicContact CG1-SD 3.46Å; V27-M724 WeakPolarHBondContact CG1-SD 3.4Å; V27-A727 HydrophobicContact CG2-CB 4.13Å
28	S	49.6	Very low	70.9	Confident	118 Å²	118	34.1 Å²	34.1	83%	0.825	22%	0.218	S	C	*	.			trans	-72.6	41.3	171.8	53.9	0	0	0	0	112.5	A30	S28-A30 PolarHBondContact O-N 2.86Å; S28-A30 VanDerWaalsContact O-N 3.07Å
29	L	51.4	Low	71.8	Confident	31 Å²	31	34.2 Å²	34.2	16%	0.162	22%	0.218	C	C	.	.			trans	-63.4	117.4	175.3	-173.5	58	0	0	0	107.7	F22 V27 L31 L303 Q306 M724	F22-L29 HydrophobicContact CD1-CB 4.05Å; F22-L29 HydrophobicContact CD1-CD2 4.2Å; F22-L29 HydrophobicContact CE1-CB 4.2Å; F22-L29 HydrophobicContact CE1-CD2 3.49Å; F22-L29 VanDerWaalsContact CE1-CD2 3.49Å; F22-L29 HydrophobicContact CE1-CG 4.43Å; F22-L29 HydrophobicContact CZ-CD2 3.98Å; V27-L29 HydrophobicContact CG1-CB 3.9Å; V27-L29 PolarHBondContact O-N 2.99Å; L29-L31 HydrophobicContact CB-CG 4.46Å; L29-L31 HydrophobicContact CD2-CD1 4.23Å; L29-L31 HydrophobicContact CD2-CD2 3.65Å; L29-L31 HydrophobicContact CD2-CG 3.81Å; L29-L31 HydrophobicContact CG-CD2 3.74Å; L29-L31 HydrophobicContact CG-CG 3.82Å; L29-L31 PolarHBondContact O-N 3.33Å; L29-L303 HydrophobicContact CD2-CD2 3.91Å; L29-Q306 VanDerWaalsContact CD1-NE2 3.31Å; L29-M724 HydrophobicContact CB-SD 4.38Å; L29-M724 HydrophobicContact CD1-CE 4.46Å; L29-M724 HydrophobicContact CD1-SD 3.97Å; L29-M724 HydrophobicContact CD2-SD 4.38Å; L29-M724 HydrophobicContact CG-SD 4.47Å
30	A	54.5	Low	72.7	Confident	73 Å²	73	33 Å²	33	60%	0.603	21%	0.213	S	C	*	.			trans	-71.8	64.4	177.7	0	0	0	0	0	110.7	S28	S28-A30 PolarHBondContact O-N 2.86Å; S28-A30 VanDerWaalsContact O-N 3.07Å
31	L	61.4	Low	73.7	Confident	10 Å²	10	32.8 Å²	32.8	5%	0.052	22%	0.215	C	C	.	.			trans	-79.5	117.4	164.2	-61.7	-165	0	0	0	108.2	F22 L29 L33 L299 L303	F22-L31 HydrophobicContact CD2-CD1 3.75Å; F22-L31 HydrophobicContact CE1-CD1 4.24Å; F22-L31 HydrophobicContact CE2-CD1 3.19Å; F22-L31 HydrophobicContact CE2-CG 4.36Å; F22-L31 HydrophobicContact CZ-CD1 3.48Å; F22-L31 VanDerWaalsContact CZ-CD1 3.48Å; F22-L31 HydrophobicContact CZ-CG 4.44Å; L29-L31 HydrophobicContact CB-CG 4.46Å; L29-L31 HydrophobicContact CD2-CD1 4.23Å; L29-L31 HydrophobicContact CD2-CD2 3.65Å; L29-L31 HydrophobicContact CD2-CG 3.81Å; L29-L31 HydrophobicContact CG-CD2 3.74Å; L29-L31 HydrophobicContact CG-CG 3.82Å; L29-L31 PolarHBondContact O-N 3.33Å; L31-L33 HydrophobicContact CB-CD2 4.14Å; L31-L33 HydrophobicContact CB-CG 4.07Å; L31-L33 HydrophobicContact CD1-CD2 4.2Å; L31-L33 PolarHBondContact O-N 3.36Å; L31-L299 HydrophobicContact CB-CD1 4.27Å; L31-L299 HydrophobicContact CD1-CD1 4.15Å; L31-L299 HydrophobicContact CD2-CD1 3.85Å; L31-L299 HydrophobicContact CG-CD1 4.31Å; L31-L303 HydrophobicContact CD1-CD1 4.3Å; L31-L303 HydrophobicContact CD1-CD2 4.2Å; L31-L303 HydrophobicContact CD2-CD2 4.18Å; L31-L303 HydrophobicContact CD2-CG 4.44Å
32	D	68.3	Low	74.5	Confident	38 Å²	38	35.5 Å²	35.5	20%	0.203	23%	0.226	C	C	.	.			trans	-72.9	69.6	166.1	-48.4	-70.6	0	0	0	108.2	R169 N171 R302	D32-R169 HydrophobicContact CB-CB 4.49Å; D32-N171 HydrophobicContact CB-CB 3.89Å; D32-N171 WeakPolarHBondContact O-CB 3.48Å; D32-N171 PolarHBondContact O-ND2 3.44Å; D32-R302 IonicContact OD2-CZ 3.57Å; D32-R302 IonicContact OD2-NH1 2.66Å; D32-R302 PolarHBondContact OD2-NH1 3.47Å; D32-R302 IonicContact OD2-NH2 2.65Å
33	L	75.8	Confident	75.3	Confident	16 Å²	16	39.1 Å²	39.1	8%	0.084	25%	0.253	C	S	.	.			trans	-62.2	138	177.2	-70.3	-176.7	0	0	0	109.5	V15 L18 Q19 L31 Q35 L299	V15-L33 HydrophobicContact CG1-CB 4.15Å; V15-L33 HydrophobicContact CG1-CD1 4.47Å; L18-L33 HydrophobicContact CB-CD1 4.35Å; L18-L33 HydrophobicContact CB-CD2 4.24Å; L18-L33 HydrophobicContact CD1-CD2 4.26Å; Q19-L33 HydrophobicContact CB-CD1 3.9Å; Q19-L33 HydrophobicContact CG-CD1 4.5Å; L31-L33 HydrophobicContact CB-CD2 4.14Å; L31-L33 HydrophobicContact CB-CG 4.07Å; L31-L33 HydrophobicContact CD1-CD2 4.2Å; L31-L33 PolarHBondContact O-N 3.36Å; L33-Q35 PolarHBondContact O-N 2.67Å; L33-L299 HydrophobicContact CD2-CD2 3.79Å
34	P	79.4	Confident	76.3	Confident	5 Å²	5	36 Å²	36	3%	0.032	23%	0.234	C	C	.	.			trans	-72.4	120.1	-175.5	-13.9	30.2	0	0	0	110.1	N171 I292 T295	P34-N171 WeakPolarHBondContact CA-O 3.44Å; P34-I292 HydrophobicContact CB-CG1 3.69Å; P34-I292 HydrophobicContact CG-CB 4.5Å; P34-I292 HydrophobicContact CG-CG1 4.02Å; P34-T295 WeakPolarHBondContact CG-OG1 3.41Å
35	Q	87.4	Confident	77.5	Confident	14 Å²	14	31.5 Å²	31.5	7%	0.065	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	158.5	-168.4	65.5	-170.5	10.3	0	0	111	L33 I138 C172 L173	L33-Q35 PolarHBondContact O-N 2.67Å; Q35-I138 HydrophobicContact CB-CD1 4.35Å; Q35-I138 HydrophobicContact CG-CD1 4.2Å; Q35-C172 HydrophobicContact CG-CB 4.36Å; Q35-L173 PolarHBondContact O-N 3.14Å
36	I	93.9	Very high	78.9	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.3	171.6	-63.5	157.6	0	0	0	109.4	L135 L137 I138 L173 L175 L284 L288	I36-L135 HydrophobicContact CD1-CD1 3.83Å; I36-L137 HydrophobicContact CB-CD2 3.71Å; I36-L137 HydrophobicContact CD1-CD2 3.72Å; I36-L137 HydrophobicContact CG1-CD2 4.33Å; I36-L137 HydrophobicContact CG2-CD2 3.74Å; I36-L137 CarbonylContact O-C 3.54Å; I36-I138 PolarHBondContact O-N 2.75Å; I36-L173 WeakPolarHBondContact CA-O 3.44Å; I36-L173 HydrophobicContact CB-CB 4.5Å; I36-L173 HydrophobicContact CG1-CB 3.84Å; I36-L173 HydrophobicContact CG1-CD1 3.94Å; I36-L173 HydrophobicContact CG1-CG 4.46Å; I36-L175 HydrophobicContact CG2-CB 3.82Å; I36-L175 HydrophobicContact CG2-CD2 4.49Å; I36-L284 HydrophobicContact CD1-CB 4.03Å; I36-L284 HydrophobicContact CD1-CD2 4.17Å; I36-L288 HydrophobicContact CD1-CB 3.99Å; I36-L288 HydrophobicContact CD1-CD2 4.3Å
37	A	95.4	Very high	80.7	Confident	0 Å²	0	27 Å²	27	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	129.9	170.7	0	0	0	0	0	110.7	L140 I167 C172 L173 L175	A37-L140 HydrophobicContact CB-CD1 3.93Å; A37-I167 HydrophobicContact CB-CG2 3.88Å; A37-C172 VanDerWaalsContact CB-SG 3.52Å; A37-L173 PolarHBondContact N-O 3.4Å; A37-L175 PolarHBondContact O-N 3.13Å
38	V	96.7	Very high	82.4	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	112.6	178.9	-165.8	0	0	0	0	109.3	K46 L50 L137 I138 L175 V177	V38-K46 HydrophobicContact CB-CD 4.39Å; V38-K46 HydrophobicContact CG1-CB 4.03Å; V38-K46 HydrophobicContact CG1-CD 3.85Å; V38-K46 HydrophobicContact CG1-CG 3.9Å; V38-K46 WeakPolarHBondContact O-CD 3.39Å; V38-L50 HydrophobicContact CG2-CD2 4.29Å; V38-L137 HydrophobicContact CG2-CB 4.48Å; V38-I138 PolarHBondContact N-O 3.06Å; V38-L175 HydrophobicContact CG1-CD2 4.33Å; V38-L175 HydrophobicContact CG2-CB 4.44Å; V38-L175 HydrophobicContact CG2-CD2 4.15Å; V38-V177 HydrophobicContact CG1-CG2 3.56Å
39	V	96.1	Very high	84.5	Confident	1 Å²	1	22 Å²	22	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.3	-175.9	-176.8	0	0	0	0	109	L140 I163 I167 I174 L175 A176 V177 A189 M192	V39-L140 HydrophobicContact CG2-CD1 4.29Å; V39-I163 HydrophobicContact CG1-CG2 4.2Å; V39-I163 HydrophobicContact CG2-CG2 3.84Å; V39-I167 HydrophobicContact CG2-CG2 3.78Å; V39-I174 HydrophobicContact CB-CG2 4.38Å; V39-I174 HydrophobicContact CG2-CG2 4.11Å; V39-L175 PolarHBondContact N-O 2.79Å; V39-L175 VanDerWaalsContact O-O 3.09Å; V39-A176 CarbonylContact O-C 3.5Å; V39-A176 WeakPolarHBondContact O-CA 3.31Å; V39-V177 PolarHBondContact O-N 3.41Å; V39-A189 HydrophobicContact CB-CB 4.48Å; V39-A189 HydrophobicContact CG1-CB 3.92Å; V39-M192 HydrophobicContact CG1-CE 3.5Å; V39-M192 VanDerWaalsContact CG1-CE 3.5Å
40	G	94.3	Very high	86.5	Confident	1 Å²	1	20.6 Å²	20.6	1%	0.01	14%	0.138	C	C	.	.			trans	174.7	142.8	-168.2	0	0	0	0	0	110.4	K46 V177	G40-K46 PolarHBondContact O-NZ 2.85Å; G40-V177 WeakPolarHBondContact CA-O 3.41Å
41	G	92	Very high	88.3	Confident	17 Å²	17	17.3 Å²	17.3	18%	0.175	11%	0.11	C	C	.	.	B	Isolated β-bridge	trans	-56.8	167.3	174.5	0	0	0	0	0	113.1	S43 A44	G41-S43 PolarHBondContact O-N 3.32Å; G41-A44 VanDerWaalsContact O-CB 3.3Å; G41-A44 WeakPolarHBondContact O-CB 3.41Å; G41-A44 PolarHBondContact O-N 2.76Å
42	Q	87.8	Confident	89.7	Confident	71 Å²	71	17.6 Å²	17.6	33%	0.332	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	138.6	164.7	-165.4	-171.8	6.7	0	0	109.7	A44 G64 L143	Q42-A44 PolarHBondContact O-N 2.83Å; Q42-G64 PolarHBondContact NE2-O 2.78Å; Q42-L143 PolarHBondContact N-O 2.65Å
43	S	87.4	Confident	90.9	Very high	92 Å²	92	16 Å²	16	64%	0.643	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	13.3	179.8	-54.3	0	0	0	0	116.5	G41 G45 K209	G41-S43 PolarHBondContact O-N 3.32Å; S43-G45 PolarHBondContact O-N 2.84Å; S43-K209 VanDerWaalsContact O-CE 3.26Å; S43-K209 WeakPolarHBondContact O-CE 3.35Å; S43-K209 PolarHBondContact O-NZ 2.84Å
44	A	90.8	Very high	91.6	Very high	9 Å²	9	15.4 Å²	15.4	7%	0.074	10%	0.102	C	C	.	.	S	Bend	trans	-70.4	-8.9	172.3	0	0	0	0	0	113.7	G41 Q42 V177 T208	G41-A44 VanDerWaalsContact O-CB 3.3Å; G41-A44 WeakPolarHBondContact O-CB 3.41Å; G41-A44 PolarHBondContact O-N 2.76Å; Q42-A44 PolarHBondContact O-N 2.83Å; A44-V177 HydrophobicContact CB-CG1 4.49Å; A44-V177 WeakPolarHBondContact O-CG1 3.23Å; A44-T208 PolarHBondContact O-OG1 3.34Å
45	G	91.1	Very high	92.1	Very high	14 Å²	14	15.9 Å²	15.9	14%	0.144	11%	0.108	C	C	.	.	S	Bend	trans	95.3	9.3	175.3	0	0	0	0	0	115.8	S43 S47 S48 V49	S43-G45 PolarHBondContact O-N 2.84Å; G45-S47 PolarHBondContact O-N 2.96Å; G45-S48 WeakPolarHBondContact O-CA 3.26Å; G45-S48 VanDerWaalsContact O-CB 3.27Å; G45-S48 WeakPolarHBondContact O-CB 3.42Å; G45-S48 PolarHBondContact O-N 3.48Å; G45-V49 VanDerWaalsContact O-CG2 3.27Å; G45-V49 WeakPolarHBondContact O-CG2 3.27Å; G45-V49 PolarHBondContact O-N 3.12Å
46	K	93.4	Very high	92.1	Very high	11 Å²	11	18.6 Å²	18.6	5%	0.048	12%	0.12	C	C	.	.	H	α-helix	trans	-43.8	-60.2	-179.8	-65.1	-162.9	-59.3	-65.6	0	113.4	V38 G40 S48 V49 L50 D139 L140 V177	V38-K46 HydrophobicContact CB-CD 4.39Å; V38-K46 HydrophobicContact CG1-CB 4.03Å; V38-K46 HydrophobicContact CG1-CD 3.85Å; V38-K46 HydrophobicContact CG1-CG 3.9Å; V38-K46 WeakPolarHBondContact O-CD 3.39Å; G40-K46 PolarHBondContact O-NZ 2.85Å; K46-S48 VanDerWaalsContact C-N 3.26Å; K46-S48 PolarHBondContact O-N 2.94Å; K46-V49 WeakPolarHBondContact O-CA 3.46Å; K46-V49 VanDerWaalsContact O-CB 3.29Å; K46-V49 WeakPolarHBondContact O-CB 3.48Å; K46-V49 PolarHBondContact O-N 3.48Å; K46-L50 PolarHBondContact O-N 3.38Å; K46-D139 WeakPolarHBondContact CB-OD1 3.47Å; K46-D139 VanDerWaalsContact CE-OD1 3.31Å; K46-D139 WeakPolarHBondContact CE-OD1 3.3Å; K46-L140 WeakPolarHBondContact CE-O 3.32Å; K46-V177 HydrophobicContact CG-CB 4.11Å; K46-V177 HydrophobicContact CG-CG1 4.47Å; K46-V177 HydrophobicContact CG-CG2 4.17Å
47	S	92	Very high	91.9	Very high	24 Å²	24	20.2 Å²	20.2	17%	0.168	13%	0.128	C	C	.	.	H	α-helix	trans	-59.5	-38.1	-178.9	-42.5	0	0	0	0	111.4	G45 V49 L50 E51 D139	G45-S47 PolarHBondContact O-N 2.96Å; S47-V49 VanDerWaalsContact C-N 3.32Å; S47-V49 PolarHBondContact O-N 3.12Å; S47-L50 WeakPolarHBondContact O-CB 3.45Å; S47-L50 PolarHBondContact O-N 3.39Å; S47-L50 VanDerWaalsContact O-N 3.15Å; S47-E51 WeakPolarHBondContact O-CG 3.22Å; S47-E51 PolarHBondContact O-N 2.88Å; S47-D139 PolarHBondContact OG-OD2 2.86Å
48	S	92.6	Very high	91.8	Very high	34 Å²	34	20.2 Å²	20.2	24%	0.238	13%	0.128	C	C	.	.	H	α-helix	trans	-63.8	-32.1	173.9	-45.2	0	0	0	0	113.3	G45 K46 A52	G45-S48 WeakPolarHBondContact O-CA 3.26Å; G45-S48 VanDerWaalsContact O-CB 3.27Å; G45-S48 WeakPolarHBondContact O-CB 3.42Å; G45-S48 PolarHBondContact O-N 3.48Å; K46-S48 VanDerWaalsContact C-N 3.26Å; K46-S48 PolarHBondContact O-N 2.94Å; S48-A52 VanDerWaalsContact O-CB 3.25Å; S48-A52 WeakPolarHBondContact O-CB 3.36Å; S48-A52 PolarHBondContact O-N 3.37Å
49	V	93.5	Very high	91.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.7	-42.4	172.5	-166.4	0	0	0	0	110.7	G45 K46 S47 A52 F53 V177 T208 I237 L280	G45-V49 VanDerWaalsContact O-CG2 3.27Å; G45-V49 WeakPolarHBondContact O-CG2 3.27Å; G45-V49 PolarHBondContact O-N 3.12Å; K46-V49 WeakPolarHBondContact O-CA 3.46Å; K46-V49 VanDerWaalsContact O-CB 3.29Å; K46-V49 WeakPolarHBondContact O-CB 3.48Å; K46-V49 PolarHBondContact O-N 3.48Å; S47-V49 VanDerWaalsContact C-N 3.32Å; S47-V49 PolarHBondContact O-N 3.12Å; V49-A52 PolarHBondContact O-N 2.89Å; V49-F53 HydrophobicContact CG1-CE1 4.02Å; V49-F53 HydrophobicContact CG1-CE2 3.79Å; V49-F53 HydrophobicContact CG1-CZ 3.5Å; V49-F53 VanDerWaalsContact CG1-CZ 3.5Å; V49-F53 WeakPolarHBondContact O-CG 3.47Å; V49-F53 PolarHBondContact O-N 3.29Å; V49-V177 HydrophobicContact CG2-CG1 4.32Å; V49-T208 HydrophobicContact CG2-CG2 4.33Å; V49-I237 HydrophobicContact CB-CD1 4.18Å; V49-I237 HydrophobicContact CG1-CD1 3.7Å; V49-I237 HydrophobicContact CG2-CD1 3.64Å; V49-L280 HydrophobicContact CG1-CD2 3.87Å
50	L	92.8	Very high	91.2	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-67	-42.5	179.8	-59.1	175.6	0	0	0	111.6	V38 K46 S47 A52 F53 V54 L59 L73 L137 D139	V38-L50 HydrophobicContact CG2-CD2 4.29Å; K46-L50 PolarHBondContact O-N 3.38Å; S47-L50 WeakPolarHBondContact O-CB 3.45Å; S47-L50 PolarHBondContact O-N 3.39Å; S47-L50 VanDerWaalsContact O-N 3.15Å; L50-A52 VanDerWaalsContact C-N 3.32Å; L50-F53 HydrophobicContact CD2-CD2 4.39Å; L50-F53 PolarHBondContact O-N 3.02Å; L50-V54 WeakPolarHBondContact O-CG2 3.28Å; L50-V54 PolarHBondContact O-N 2.72Å; L50-V54 VanDerWaalsContact O-N 3.09Å; L50-L59 HydrophobicContact CB-CD1 3.98Å; L50-L59 HydrophobicContact CD1-CD1 4.08Å; L50-L73 HydrophobicContact CB-CD2 4.11Å; L50-L73 HydrophobicContact CD2-CD2 4.18Å; L50-L137 HydrophobicContact CD2-CB 4.01Å; L50-L137 HydrophobicContact CD2-CD1 3.33Å; L50-L137 HydrophobicContact CD2-CG 4.3Å; L50-D139 HydrophobicContact CD1-CB 3.51Å
51	E	92.6	Very high	90.7	Very high	3 Å²	3	25 Å²	25	1%	0.014	15%	0.149	C	C	.	.	H	α-helix	trans	-66.5	-32.5	173.4	-68.8	177.3	124.1	0	0	112.4	S47 V54 G55 K56 D57 F58 L59 R61	S47-E51 WeakPolarHBondContact O-CG 3.22Å; S47-E51 PolarHBondContact O-N 2.88Å; E51-V54 PolarHBondContact O-N 3.03Å; E51-G55 WeakPolarHBondContact O-CA 3.49Å; E51-G55 PolarHBondContact O-N 3.35Å; E51-K56 WeakPolarHBondContact CB-O 3.34Å; E51-K56 PolarHBondContact O-N 3.25Å; E51-D57 WeakPolarHBondContact OE1-CA 3.42Å; E51-F58 HydrophobicContact CG-CD1 3.81Å; E51-F58 HydrophobicContact CG-CE1 3.84Å; E51-F58 PolarHBondContact OE1-N 2.94Å; E51-L59 HydrophobicContact CG-CB 4.21Å; E51-L59 HydrophobicContact CG-CD1 4.08Å; E51-L59 HydrophobicContact CG-CG 4.01Å; E51-L59 PolarHBondContact OE1-N 3.45Å; E51-R61 IonicContact OE1-CZ 3.15Å; E51-R61 IonicContact OE1-NH1 3.36Å; E51-R61 IonicContact OE1-NH2 2.7Å; E51-R61 PolarHBondContact OE1-NH2 2.82Å; E51-R61 IonicContact OE2-CZ 2.7Å; E51-R61 IonicContact OE2-NH1 2.71Å; E51-R61 PolarHBondContact OE2-NH1 3.22Å; E51-R61 IonicContact OE2-NH2 3.93Å; E51-R61 PolarHBondContact OE2-NH2 3.09Å
52	A	91.5	Very high	90.2	Very high	16 Å²	16	27.1 Å²	27.1	13%	0.132	17%	0.17	C	C	.	.	H	α-helix	trans	-69.8	-31.9	172.8	0	0	0	0	0	112.7	S48 V49 L50 T277	S48-A52 VanDerWaalsContact O-CB 3.25Å; S48-A52 WeakPolarHBondContact O-CB 3.36Å; S48-A52 PolarHBondContact O-N 3.37Å; V49-A52 PolarHBondContact O-N 2.89Å; L50-A52 VanDerWaalsContact C-N 3.32Å; A52-T277 HydrophobicContact CB-CG2 3.79Å
53	F	92.1	Very high	89.6	Confident	4 Å²	4	29 Å²	29	2%	0.018	19%	0.191	C	C	.	.	H	α-helix	trans	-72	-33.1	171.9	-63.4	-28.9	0	0	0	113.7	V49 L50 L75 L137 T277 L280 Q281 L284	V49-F53 HydrophobicContact CG1-CE1 4.02Å; V49-F53 HydrophobicContact CG1-CE2 3.79Å; V49-F53 HydrophobicContact CG1-CZ 3.5Å; V49-F53 VanDerWaalsContact CG1-CZ 3.5Å; V49-F53 WeakPolarHBondContact O-CG 3.47Å; V49-F53 PolarHBondContact O-N 3.29Å; L50-F53 HydrophobicContact CD2-CD2 4.39Å; L50-F53 PolarHBondContact O-N 3.02Å; F53-L75 HydrophobicContact CB-CD1 4.02Å; F53-L137 HydrophobicContact CD2-CD1 3.52Å; F53-L137 HydrophobicContact CE2-CD1 3.57Å; F53-T277 HydrophobicContact CD1-CG2 3.73Å; F53-T277 HydrophobicContact CE1-CG2 3.98Å; F53-L280 HydrophobicContact CE1-CB 4.26Å; F53-L280 HydrophobicContact CE1-CD2 3.96Å; F53-L280 HydrophobicContact CE1-CG 3.98Å; F53-L280 HydrophobicContact CZ-CD2 3.65Å; F53-L280 HydrophobicContact CZ-CG 3.74Å; F53-Q281 HydrophobicContact CD1-CB 3.8Å; F53-Q281 HydrophobicContact CD1-CG 3.98Å; F53-Q281 HydrophobicContact CE1-CB 3.89Å; F53-Q281 HydrophobicContact CE1-CG 4.43Å; F53-Q281 HydrophobicContact CG-CG 4.3Å; F53-Q281 PolarHBondContact O-NE2 2.84Å; F53-Q281 VanDerWaalsContact O-NE2 3.13Å; F53-L284 HydrophobicContact CE2-CD1 3.74Å; F53-L284 HydrophobicContact CZ-CD1 3.56Å
54	V	90.9	Very high	89.1	Confident	4 Å²	4	25 Å²	25	2%	0.024	17%	0.166	C	C	.	.	H	α-helix	trans	-83.1	-28.6	177.3	173.2	0	0	0	0	111.8	L50 E51 K56 F58 L73 L75 F97 V127	L50-V54 WeakPolarHBondContact O-CG2 3.28Å; L50-V54 PolarHBondContact O-N 2.72Å; L50-V54 VanDerWaalsContact O-N 3.09Å; E51-V54 PolarHBondContact O-N 3.03Å; V54-K56 VanDerWaalsContact C-N 3.31Å; V54-K56 HydrophobicContact CG1-CB 3.94Å; V54-K56 HydrophobicContact CG1-CG 3.89Å; V54-F58 HydrophobicContact CB-CD1 4.22Å; V54-F58 HydrophobicContact CB-CE1 3.88Å; V54-F58 HydrophobicContact CG1-CD1 4.1Å; V54-F58 HydrophobicContact CG1-CE1 4.18Å; V54-F58 HydrophobicContact CG2-CD1 4.36Å; V54-F58 HydrophobicContact CG2-CE1 3.62Å; V54-F58 HydrophobicContact CG2-CZ 4.14Å; V54-L73 HydrophobicContact CG2-CD2 4.49Å; V54-L75 HydrophobicContact CG2-CD1 4.41Å; V54-L75 HydrophobicContact CG2-CD2 3.52Å; V54-F97 HydrophobicContact CG1-CD1 4.29Å; V54-F97 HydrophobicContact CG1-CE1 3.73Å; V54-F97 HydrophobicContact CG1-CZ 4.49Å; V54-V127 HydrophobicContact CG1-CG1 4.17Å
55	G	88.9	Confident	88.6	Confident	16 Å²	16	25.1 Å²	25.1	17%	0.165	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	19.6	-174.4	0	0	0	0	0	114.7	E51	E51-G55 WeakPolarHBondContact O-CA 3.49Å; E51-G55 PolarHBondContact O-N 3.35Å
56	K	89	Confident	88.3	Confident	70 Å²	70	26.7 Å²	26.7	30%	0.304	17%	0.171	S	C	.	.	S	Bend	trans	-136.2	149.1	179.2	-50.7	-70.8	176.3	170.2	0	109.8	E51 V54 E82 F97	E51-K56 WeakPolarHBondContact CB-O 3.34Å; E51-K56 PolarHBondContact O-N 3.25Å; V54-K56 VanDerWaalsContact C-N 3.31Å; V54-K56 HydrophobicContact CG1-CB 3.94Å; V54-K56 HydrophobicContact CG1-CG 3.89Å; K56-E82 WeakPolarHBondContact CE-OE2 3.25Å; K56-E82 IonicContact NZ-OE2 2.7Å; K56-E82 PolarHBondContact NZ-OE2 3.5Å; K56-F97 HydrophobicContact CB-CB 4.14Å; K56-F97 HydrophobicContact CB-CD1 3.73Å; K56-F97 HydrophobicContact CB-CD2 4.37Å; K56-F97 HydrophobicContact CB-CE1 4.22Å; K56-F97 HydrophobicContact CB-CG 3.82Å; K56-F97 HydrophobicContact CD-CD2 4.28Å; K56-F97 HydrophobicContact CD-CE2 4.42Å; K56-F97 HydrophobicContact CG-CD1 3.87Å; K56-F97 HydrophobicContact CG-CD2 3.96Å; K56-F97 HydrophobicContact CG-CE1 3.94Å; K56-F97 HydrophobicContact CG-CE2 4.03Å; K56-F97 HydrophobicContact CG-CG 3.89Å; K56-F97 HydrophobicContact CG-CZ 4.01Å
57	D	89.1	Confident	88.2	Confident	35 Å²	35	27.3 Å²	27.3	19%	0.187	18%	0.176	C	C	.	.			trans	-79.8	114	165.9	-62.7	-84.2	0	0	0	108.5	E51 R61 R101 R240	E51-D57 WeakPolarHBondContact OE1-CA 3.42Å; D57-R61 IonicContact OD1-CZ 3.73Å; D57-R61 IonicContact OD1-NE 2.7Å; D57-R61 IonicContact OD1-NH2 3.71Å; D57-R61 PolarHBondContact OD1-NH2 2.88Å; D57-R101 VanDerWaalsContact C-NH2 3.34Å; D57-R101 PolarHBondContact O-NH2 3.33Å; D57-R240 IonicContact OD1-CZ 2.86Å; D57-R240 IonicContact OD1-NH2 2.73Å; D57-R240 PolarHBondContact OD1-NH2 3.45Å; D57-R240 IonicContact OD2-CZ 2.96Å; D57-R240 VanDerWaalsContact OD2-CZ 3.28Å; D57-R240 IonicContact OD2-NH1 3.78Å; D57-R240 PolarHBondContact OD2-NH1 3.05Å; D57-R240 IonicContact OD2-NH2 3.15Å; D57-R240 PolarHBondContact OD2-NH2 3.24Å
58	F	92.6	Very high	88.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.174	C	C	.	.			trans	-146.6	-11.3	-174.8	81.6	-87.9	0	0	0	113.8	E51 V54 L71 L73 F97 I100 R101 I104 L125	E51-F58 HydrophobicContact CG-CD1 3.81Å; E51-F58 HydrophobicContact CG-CE1 3.84Å; E51-F58 PolarHBondContact OE1-N 2.94Å; V54-F58 HydrophobicContact CB-CD1 4.22Å; V54-F58 HydrophobicContact CB-CE1 3.88Å; V54-F58 HydrophobicContact CG1-CD1 4.1Å; V54-F58 HydrophobicContact CG1-CE1 4.18Å; V54-F58 HydrophobicContact CG2-CD1 4.36Å; V54-F58 HydrophobicContact CG2-CE1 3.62Å; V54-F58 HydrophobicContact CG2-CZ 4.14Å; F58-L71 HydrophobicContact CE2-CD2 4.44Å; F58-L73 HydrophobicContact CE2-CD1 4Å; F58-L73 HydrophobicContact CZ-CD1 3.85Å; F58-L73 HydrophobicContact CZ-CD2 3.85Å; F58-F97 HydrophobicContact CB-CB 3.98Å; F58-F97 HydrophobicContact CB-CD1 3.79Å; F58-F97 HydrophobicContact CB-CG 4.39Å; F58-F97 HydrophobicContact CG-CD1 4.32Å; F58-I100 HydrophobicContact CB-CG2 4.39Å; F58-I100 HydrophobicContact CD2-CG2 3.95Å; F58-R101 VanDerWaalsContact O-CA 3.28Å; F58-R101 WeakPolarHBondContact O-CA 3.29Å; F58-R101 WeakPolarHBondContact O-CB 3.3Å; F58-I104 HydrophobicContact CD2-CD1 4.29Å; F58-L125 HydrophobicContact CD2-CD2 4.02Å; F58-L125 HydrophobicContact CE2-CD2 3.75Å
59	L	92.1	Very high	88.2	Confident	5 Å²	5	26.8 Å²	26.8	3%	0.026	17%	0.165	C	C	.	.	S	Bend	trans	-90.8	149.5	174.1	-63.3	178.6	0	0	0	109.5	L50 E51 L71 R101 I104	L50-L59 HydrophobicContact CB-CD1 3.98Å; L50-L59 HydrophobicContact CD1-CD1 4.08Å; E51-L59 HydrophobicContact CG-CB 4.21Å; E51-L59 HydrophobicContact CG-CD1 4.08Å; E51-L59 HydrophobicContact CG-CG 4.01Å; E51-L59 PolarHBondContact OE1-N 3.45Å; L59-L71 HydrophobicContact CD2-CD2 3.34Å; L59-R101 WeakPolarHBondContact O-CD 3.12Å; L59-R101 PolarHBondContact O-NE 3.3Å; L59-I104 HydrophobicContact CD2-CD1 3.98Å
60	P	89.1	Confident	88.2	Confident	20 Å²	20	26.8 Å²	26.8	13%	0.13	17%	0.165	C	C	.	.			trans	-56.8	154.3	174.2	-29.9	40.9	0	0	0	111.8	V66 R101 I104 E105	P60-V66 HydrophobicContact CB-CG1 3.59Å; P60-V66 VanDerWaalsContact O-CG1 3.26Å; P60-V66 WeakPolarHBondContact O-CG1 3.5Å; P60-R101 HydrophobicContact CB-CG 4.46Å; P60-R101 HydrophobicContact CG-CG 4.08Å; P60-I104 HydrophobicContact CG-CB 4.32Å; P60-I104 HydrophobicContact CG-CG2 3.88Å; P60-E105 HydrophobicContact CB-CG 3.94Å; P60-E105 VanDerWaalsContact CB-OE1 3.27Å; P60-E105 WeakPolarHBondContact CB-OE1 3.22Å; P60-E105 HydrophobicContact CG-CG 3.58Å
61	R	84	Confident	88.3	Confident	79 Å²	79	27 Å²	27	30%	0.298	17%	0.167	S	C	.	.			trans	-133.8	135.7	175.2	-60.7	-164.4	-170.1	-61.5	4.5	109.9	E51 D57	E51-R61 IonicContact OE1-CZ 3.15Å; E51-R61 IonicContact OE1-NH1 3.36Å; E51-R61 IonicContact OE1-NH2 2.7Å; E51-R61 PolarHBondContact OE1-NH2 2.82Å; E51-R61 IonicContact OE2-CZ 2.7Å; E51-R61 IonicContact OE2-NH1 2.71Å; E51-R61 PolarHBondContact OE2-NH1 3.22Å; E51-R61 IonicContact OE2-NH2 3.93Å; E51-R61 PolarHBondContact OE2-NH2 3.09Å; D57-R61 IonicContact OD1-CZ 3.73Å; D57-R61 IonicContact OD1-NE 2.7Å; D57-R61 IonicContact OD1-NH2 3.71Å; D57-R61 PolarHBondContact OD1-NH2 2.88Å
62	G	80.7	Confident	88.3	Confident	61 Å²	61	27.3 Å²	27.3	63%	0.629	17%	0.168	S	C	*	.			trans	175.2	-175.6	-178.8	0	0	0	0	0	113.1	V66	G62-V66 WeakPolarHBondContact O-CG2 3.27Å
63	S	76.1	Confident	88.4	Confident	110 Å²	110	26.6 Å²	26.6	77%	0.769	16%	0.162	S	C	*	.	S	Bend	trans	-96.8	141.8	175.9	58.3	0	0	0	0	111.9
64	G	77.3	Confident	88.4	Confident	10 Å²	10	26.6 Å²	26.6	10%	0.103	16%	0.162	C	C	.	.	S	Bend	trans	94.3	-156.6	-172.4	0	0	0	0	0	113.1	Q42 V66	Q42-G64 PolarHBondContact NE2-O 2.78Å; G64-V66 PolarHBondContact O-N 3.31Å
65	I	78.9	Confident	88.4	Confident	11 Å²	11	26.4 Å²	26.4	6%	0.056	16%	0.161	C	C	.	.			trans	-80.7	109.7	174.9	-59.4	-178.4	0	0	0	108.4	T67 R68 I118 P141 T144 I155 I159	I65-T67 VanDerWaalsContact CG2-O 3.25Å; I65-T67 WeakPolarHBondContact CG2-O 3.16Å; I65-R68 HydrophobicContact CG2-CG 4.14Å; I65-I118 HydrophobicContact CG2-CG2 4.47Å; I65-P141 HydrophobicContact CG2-CB 4.36Å; I65-T144 HydrophobicContact CD1-CG2 4.01Å; I65-T144 HydrophobicContact CG1-CG2 4.49Å; I65-I155 HydrophobicContact CD1-CD1 4.44Å; I65-I155 HydrophobicContact CD1-CG1 3.99Å; I65-I159 HydrophobicContact CD1-CD1 3.47Å; I65-I159 VanDerWaalsContact CD1-CD1 3.47Å; I65-I159 HydrophobicContact CD1-CG1 4.33Å
66	V	85.7	Confident	88.4	Confident	47 Å²	47	27.3 Å²	27.3	29%	0.285	16%	0.161	S	C	.	.	S	Bend	trans	-85.1	-55.9	-179.9	-178.9	0	0	0	0	110.1	P60 G62 G64 R68	P60-V66 HydrophobicContact CB-CG1 3.59Å; P60-V66 VanDerWaalsContact O-CG1 3.26Å; P60-V66 WeakPolarHBondContact O-CG1 3.5Å; G62-V66 WeakPolarHBondContact O-CG2 3.27Å; G64-V66 PolarHBondContact O-N 3.31Å; V66-R68 PolarHBondContact O-N 2.84Å
67	T	91.1	Very high	88.4	Confident	24 Å²	24	28.1 Å²	28.1	15%	0.147	17%	0.166	C	C	.	.			trans	-70.8	89.7	169.4	-47.8	0	0	0	0	109.9	I65 R69 D139 P141	I65-T67 VanDerWaalsContact CG2-O 3.25Å; I65-T67 WeakPolarHBondContact CG2-O 3.16Å; T67-R69 WeakPolarHBondContact CG2-O 3.37Å; T67-D139 HydrophobicContact CG2-CB 4.24Å; T67-D139 WeakPolarHBondContact CG2-OD2 3.49Å; T67-D139 PolarHBondContact OG1-OD2 2.88Å; T67-P141 VanDerWaalsContact O-CA 3.24Å; T67-P141 WeakPolarHBondContact O-CA 3.43Å; T67-P141 VanDerWaalsContact O-CB 3.24Å; T67-P141 WeakPolarHBondContact O-CB 3.35Å; T67-P141 WeakPolarHBondContact O-CG 3.45Å
68	R	90.7	Very high	88.3	Confident	32 Å²	32	28.8 Å²	28.8	12%	0.121	17%	0.17	C	C	.	.			trans	-88.9	-12	178	-71.8	-177.9	-74.6	155	1.1	114.7	I65 V66 T108 D109 G113 N115 G117 I118 S119	I65-R68 HydrophobicContact CG2-CG 4.14Å; V66-R68 PolarHBondContact O-N 2.84Å; R68-T108 HydrophobicContact CB-CG2 3.72Å; R68-D109 IonicContact CZ-OD1 2.69Å; R68-D109 IonicContact NH1-OD1 2.69Å; R68-D109 PolarHBondContact NH1-OD1 2.84Å; R68-D109 IonicContact NH2-OD1 2.7Å; R68-D109 PolarHBondContact NH2-OD1 3.5Å; R68-D109 IonicContact NH2-OD2 2.69Å; R68-G113 PolarHBondContact NH1-O 3.37Å; R68-G113 VanDerWaalsContact NH1-O 3.11Å; R68-N115 PolarHBondContact NH1-O 3.16Å; R68-G117 WeakPolarHBondContact CD-O 3.48Å; R68-G117 WeakPolarHBondContact CG-O 3.14Å; R68-I118 HydrophobicContact CB-CG2 4.4Å; R68-I118 VanDerWaalsContact O-CA 3.23Å; R68-I118 WeakPolarHBondContact O-CA 3.43Å; R68-I118 VanDerWaalsContact O-CB 3.28Å; R68-I118 WeakPolarHBondContact O-CB 3.31Å; R68-S119 PolarHBondContact O-N 2.93Å; R68-S119 VanDerWaalsContact O-N 3.1Å
69	R	92.7	Very high	88	Confident	14 Å²	14	35.3 Å²	35.3	5%	0.053	21%	0.205	C	C	.	.	S	Bend	trans	-131.8	148.6	176	-74.1	172.7	65.9	178.2	-6.2	109.4	T67 L71 E107 T108 A111 V112 L121 P122 I123	T67-R69 WeakPolarHBondContact CG2-O 3.37Å; R69-L71 PolarHBondContact O-N 2.85Å; R69-E107 IonicContact CZ-OE1 3.38Å; R69-E107 VanDerWaalsContact NH1-CD 3.34Å; R69-E107 PolarHBondContact NH1-O 3.28Å; R69-E107 IonicContact NH1-OE1 3.76Å; R69-E107 PolarHBondContact NH1-OE1 3.26Å; R69-E107 IonicContact NH2-OE1 2.75Å; R69-E107 PolarHBondContact NH2-OE1 3.33Å; R69-E107 VanDerWaalsContact NH2-OE1 3.13Å; R69-T108 HydrophobicContact CG-CG2 4.43Å; R69-A111 VanDerWaalsContact NH1-CB 3.25Å; R69-V112 HydrophobicContact CG-CG2 4.4Å; R69-L121 PolarHBondContact NE-O 3.04Å; R69-L121 PolarHBondContact NH2-O 3.25Å; R69-P122 PolarHBondContact NH2-O 3.38Å; R69-I123 HydrophobicContact CB-CD1 4.45Å; R69-I123 HydrophobicContact CB-CG1 4.41Å
70	P	94.2	Very high	87.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.222	C	C	.	.			trans	-57.1	127.9	170	-25.3	35.3	0	0	0	111.2	S119 P122 I123 I138 D139 L140 M162 Y166	P70-S119 WeakPolarHBondContact CD-O 3.28Å; P70-P122 HydrophobicContact CB-CB 4.24Å; P70-P122 CarbonylContact O-C 3.56Å; P70-P122 WeakPolarHBondContact O-CA 3.3Å; P70-I123 PolarHBondContact O-N 3.35Å; P70-I138 HydrophobicContact CB-CG2 4.26Å; P70-D139 CarbonylContact C-O 3.58Å; P70-D139 WeakPolarHBondContact CA-O 3.43Å; P70-L140 HydrophobicContact CB-CD2 3.89Å; P70-L140 HydrophobicContact CG-CD2 4.12Å; P70-M162 HydrophobicContact CG-CG 4.39Å; P70-M162 HydrophobicContact CG-SD 3.77Å; P70-Y166 HydrophobicContact CB-CE2 4.23Å; P70-Y166 WeakPolarHBondContact CB-OH 3.18Å; P70-Y166 HydrophobicContact CG-CE2 3.92Å; P70-Y166 WeakPolarHBondContact CG-OH 3.39Å
71	L	94.4	Very high	87.5	Confident	7 Å²	7	42.3 Å²	42.3	4%	0.037	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	107.5	175.8	179.2	67	0	0	0	109.9	F58 L59 R69 L73 I104 I123 L125 I138 D139	F58-L71 HydrophobicContact CE2-CD2 4.44Å; L59-L71 HydrophobicContact CD2-CD2 3.34Å; R69-L71 PolarHBondContact O-N 2.85Å; L71-L73 PolarHBondContact O-N 3.01Å; L71-I104 HydrophobicContact CD2-CD1 4.22Å; L71-I123 HydrophobicContact CD1-CB 3.83Å; L71-I123 HydrophobicContact CD1-CG2 3.73Å; L71-L125 HydrophobicContact CD1-CB 4.08Å; L71-I138 CarbonylContact O-C 3.19Å; L71-I138 VanDerWaalsContact O-CA 3.3Å; L71-I138 WeakPolarHBondContact O-CA 3.41Å; L71-D139 HydrophobicContact CB-CB 4.2Å; L71-D139 PolarHBondContact N-O 2.99Å; L71-D139 PolarHBondContact O-N 2.84Å
72	I	93.1	Very high	87.8	Confident	9 Å²	9	40.3 Å²	40.3	5%	0.046	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	100.8	172.4	-59.7	168.7	0	0	0	107.3	Q74 P122 I123 N124 L125 T136 I138	I72-Q74 HydrophobicContact CG2-CG 4.38Å; I72-P122 HydrophobicContact CD1-CB 3.61Å; I72-P122 HydrophobicContact CD1-CG 3.93Å; I72-P122 HydrophobicContact CG1-CB 4.07Å; I72-I123 PolarHBondContact N-O 3.1Å; I72-N124 WeakPolarHBondContact CB-OD1 3.33Å; I72-N124 WeakPolarHBondContact CD1-OD1 3.35Å; I72-L125 PolarHBondContact O-N 3.48Å; I72-T136 HydrophobicContact CG2-CG2 4.26Å; I72-I138 HydrophobicContact CG1-CD1 4.37Å; I72-I138 HydrophobicContact CG1-CG1 4.2Å; I72-I138 HydrophobicContact CG1-CG2 4.29Å
73	L	93.4	Very high	88.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	108.6	-179.4	-179.4	67.7	0	0	0	109.5	L50 V54 F58 L71 L75 L125 V127 T136 L137	L50-L73 HydrophobicContact CB-CD2 4.11Å; L50-L73 HydrophobicContact CD2-CD2 4.18Å; V54-L73 HydrophobicContact CG2-CD2 4.49Å; F58-L73 HydrophobicContact CE2-CD1 4Å; F58-L73 HydrophobicContact CZ-CD1 3.85Å; F58-L73 HydrophobicContact CZ-CD2 3.85Å; L71-L73 PolarHBondContact O-N 3.01Å; L73-L75 HydrophobicContact CD1-CD2 3.95Å; L73-L75 HydrophobicContact CD2-CD2 3.94Å; L73-L75 HydrophobicContact CD2-CG 4.45Å; L73-L75 HydrophobicContact CG-CD2 3.74Å; L73-L75 HydrophobicContact CG-CG 4.3Å; L73-L125 HydrophobicContact CD1-CD2 4.01Å; L73-L125 HydrophobicContact CD1-CG 4.21Å; L73-V127 HydrophobicContact CD1-CG2 3.87Å; L73-T136 WeakPolarHBondContact O-CA 3.33Å; L73-L137 PolarHBondContact N-O 3.37Å; L73-L137 PolarHBondContact O-N 3.02Å
74	Q	91.6	Very high	89.3	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.019	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	99.6	175.9	-67.8	-179.6	5.8	0	0	109.3	I72 L125 R126 V127 T136	I72-Q74 HydrophobicContact CG2-CG 4.38Å; Q74-L125 PolarHBondContact N-O 3.26Å; Q74-R126 HydrophobicContact CB-CG 4.07Å; Q74-R126 WeakPolarHBondContact O-CA 3.47Å; Q74-R126 VanDerWaalsContact OE1-CZ 3.26Å; Q74-V127 PolarHBondContact O-N 3.22Å; Q74-T136 HydrophobicContact CG-CG2 3.84Å
75	L	91.7	Very high	90.1	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	129.4	172.2	-54.1	-172.6	0	0	0	109.6	F53 V54 L73 V127 V132 N134 L135	F53-L75 HydrophobicContact CB-CD1 4.02Å; V54-L75 HydrophobicContact CG2-CD1 4.41Å; V54-L75 HydrophobicContact CG2-CD2 3.52Å; L73-L75 HydrophobicContact CD1-CD2 3.95Å; L73-L75 HydrophobicContact CD2-CD2 3.94Å; L73-L75 HydrophobicContact CD2-CG 4.45Å; L73-L75 HydrophobicContact CG-CD2 3.74Å; L73-L75 HydrophobicContact CG-CG 4.3Å; L75-V127 HydrophobicContact CD2-CB 3.98Å; L75-V127 HydrophobicContact CD2-CG2 4.43Å; L75-V132 HydrophobicContact CB-CB 4.24Å; L75-V132 HydrophobicContact CB-CG2 4.09Å; L75-V132 HydrophobicContact CD1-CB 4.42Å; L75-V132 HydrophobicContact CD1-CG1 4.44Å; L75-N134 WeakPolarHBondContact O-CA 3.46Å; L75-L135 HydrophobicContact CB-CB 4.34Å; L75-L135 WeakPolarHBondContact CB-O 3.42Å; L75-L135 PolarHBondContact N-O 3.02Å; L75-L135 PolarHBondContact O-N 3.23Å
76	I	89.8	Confident	90.8	Very high	34 Å²	34	34 Å²	34	17%	0.174	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	122.3	-177.4	-59.2	174.3	0	0	0	108.3	D78 R126 V127 Y128 S129 V132	I76-D78 PolarHBondContact O-N 2.98Å; I76-R126 HydrophobicContact CD1-CB 4.42Å; I76-R126 HydrophobicContact CD1-CG 4.22Å; I76-V127 PolarHBondContact N-O 2.95Å; I76-Y128 HydrophobicContact CB-CD1 3.99Å; I76-Y128 HydrophobicContact CB-CE1 4.36Å; I76-Y128 HydrophobicContact CD1-CD1 4.16Å; I76-Y128 HydrophobicContact CD1-CE1 3.67Å; I76-Y128 HydrophobicContact CG2-CD1 3.85Å; I76-Y128 HydrophobicContact CG2-CE1 4.15Å; I76-Y128 WeakPolarHBondContact O-CA 3.35Å; I76-S129 PolarHBondContact O-N 3.14Å; I76-S129 VanDerWaalsContact O-N 3.08Å; I76-V132 WeakPolarHBondContact O-CG2 3.39Å
77	H	88.7	Confident	90.8	Very high	88 Å²	88	33.4 Å²	33.4	41%	0.407	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	115.7	173.7	-176	75.3	0	0	0	109.8	S129 P130 V132 N134	H77-S129 WeakPolarHBondContact CA-O 3.22Å; H77-P130 PolarHBondContact CE1-O 2.97Å; H77-P130 VanDerWaalsContact CE1-O 3.25Å; H77-P130 PolarHBondContact ND1-O 2.99Å; H77-V132 WeakPolarHBondContact CB-O 3.37Å; H77-V132 PolarHBondContact ND1-O 3.17Å; H77-N134 WeakPolarHBondContact CB-OD1 3.24Å; H77-N134 PolarHBondContact N-OD1 3.32Å
78	D	87.5	Confident	90.6	Very high	48 Å²	48	35.6 Å²	35.6	26%	0.257	19%	0.185	S	C	.	.			trans	-138	138.4	178.1	-175.9	7.1	0	0	0	109.7	I76 S80 Y128 S129 P130	I76-D78 PolarHBondContact O-N 2.98Å; D78-S80 PolarHBondContact O-N 2.66Å; D78-S80 PolarHBondContact OD1-N 2.69Å; D78-S80 VanDerWaalsContact OD2-CB 3.31Å; D78-S80 WeakPolarHBondContact OD2-CB 3.23Å; D78-S80 PolarHBondContact OD2-OG 3.21Å; D78-Y128 HydrophobicContact CB-CD1 4.48Å; D78-S129 PolarHBondContact N-O 3.43Å; D78-S129 VanDerWaalsContact N-O 3.11Å; D78-S129 CarbonylContact O-C 3.15Å; D78-P130 WeakPolarHBondContact O-CA 3.48Å; D78-P130 WeakPolarHBondContact O-CB 3.38Å; D78-P130 WeakPolarHBondContact O-CD 3.4Å
79	N	86.3	Confident	90.5	Very high	138 Å²	138	37 Å²	37	74%	0.738	19%	0.192	S	C	*	.	S	Bend	trans	-82.1	-0.4	175.9	-66.7	-67.1	0	0	0	112.9
80	S	83.2	Confident	90	Very high	55 Å²	55	41.8 Å²	41.8	39%	0.385	21%	0.213	S	C	.	.	S	Bend	trans	-79	-170.3	174.4	92.5	0	0	0	0	113	D78	D78-S80 PolarHBondContact O-N 2.66Å; D78-S80 PolarHBondContact OD1-N 2.69Å; D78-S80 VanDerWaalsContact OD2-CB 3.31Å; D78-S80 WeakPolarHBondContact OD2-CB 3.23Å; D78-S80 PolarHBondContact OD2-OG 3.21Å
81	V	86.5	Confident	89.5	Confident	117 Å²	117	44.7 Å²	44.7	71%	0.709	24%	0.243	S	C	*	.			trans	-67.8	144.2	179.2	-179.8	0	0	0	0	109.9	Y83	V81-Y83 VanDerWaalsContact O-CD1 3.31Å; V81-Y83 WeakPolarHBondContact O-CD1 3.5Å; V81-Y83 PolarHBondContact O-N 3.35Å
82	E	91	Very high	89.4	Confident	36 Å²	36	48.9 Å²	48.9	17%	0.168	26%	0.263	C	S	.	.			trans	-66.6	125.7	177.5	-59.2	-172.2	123.3	0	0	111.5	K56 F97 Y128 S129 N131	K56-E82 WeakPolarHBondContact CE-OE2 3.25Å; K56-E82 IonicContact NZ-OE2 2.7Å; K56-E82 PolarHBondContact NZ-OE2 3.5Å; E82-F97 HydrophobicContact CB-CE2 4.27Å; E82-F97 HydrophobicContact CB-CZ 4.48Å; E82-Y128 WeakPolarHBondContact CA-O 3.3Å; E82-S129 WeakPolarHBondContact OE1-CB 3.41Å; E82-S129 PolarHBondContact OE1-OG 3.01Å; E82-N131 PolarHBondContact OE1-ND2 2.65Å
83	Y	94.1	Very high	89.4	Confident	24 Å²	24	54.3 Å²	54.3	9%	0.094	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	153.4	172.7	70.3	-89.3	0	0	0	113.1	V81 E85 K93 Y94 Y128	V81-Y83 VanDerWaalsContact O-CD1 3.31Å; V81-Y83 WeakPolarHBondContact O-CD1 3.5Å; V81-Y83 PolarHBondContact O-N 3.35Å; Y83-E85 HydrophobicContact CE2-CB 4.4Å; Y83-K93 HydrophobicContact CD1-CD 4.16Å; Y83-K93 HydrophobicContact CD2-CB 3.77Å; Y83-K93 HydrophobicContact CD2-CD 3.69Å; Y83-K93 HydrophobicContact CD2-CG 3.64Å; Y83-K93 HydrophobicContact CE1-CD 4.01Å; Y83-K93 HydrophobicContact CE2-CB 4.34Å; Y83-K93 HydrophobicContact CE2-CD 3.52Å; Y83-K93 HydrophobicContact CE2-CG 3.68Å; Y83-K93 HydrophobicContact CG-CB 4.16Å; Y83-K93 HydrophobicContact CG-CD 4.04Å; Y83-K93 HydrophobicContact CG-CG 4.31Å; Y83-K93 VanDerWaalsContact CZ-CE 3.47Å; Y83-K93 WeakPolarHBondContact OH-CE 3.18Å; Y83-K93 PolarHBondContact OH-NZ 2.65Å; Y83-Y94 CarbonylContact C-O 3.56Å; Y83-Y94 WeakPolarHBondContact CA-O 3.43Å; Y83-Y128 HydrophobicContact CD1-CD2 4.48Å; Y83-Y128 AromaticContact CD2-CD2 3.73Å; Y83-Y128 HydrophobicContact CD2-CD2 3.73Å; Y83-Y128 HydrophobicContact CD2-CE2 4.19Å; Y83-Y128 HydrophobicContact CE1-CD2 4Å; Y83-Y128 AromaticContact CE1-CG 3.96Å; Y83-Y128 HydrophobicContact CE1-CG 3.96Å; Y83-Y128 AromaticContact CE2-CD2 3.13Å; Y83-Y128 HydrophobicContact CE2-CD2 3.13Å; Y83-Y128 AromaticContact CE2-CE2 3.3Å; Y83-Y128 HydrophobicContact CE2-CE2 3.3Å; Y83-Y128 AromaticContact CE2-CG 3.94Å; Y83-Y128 HydrophobicContact CE2-CG 3.94Å; Y83-Y128 HydrophobicContact CG-CD2 4.35Å; Y83-Y128 AromaticContact CZ-CD2 3.27Å; Y83-Y128 AromaticContact CZ-CE2 3.59Å; Y83-Y128 AromaticContact CZ-CG 3.57Å; Y83-Y128 PolarHBondContact N-O 3.4Å; Y83-Y128 VanDerWaalsContact N-O 3.17Å; Y83-Y128 PolarHBondContact O-N 3.36Å
84	G	93.9	Very high	89.4	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	152.7	165.8	0	0	0	0	0	113.1	Y94 R126	G84-Y94 PolarHBondContact N-O 2.85Å; G84-Y94 PolarHBondContact O-N 2.84Å; G84-R126 CarbonylContact C-O 3.17Å; G84-R126 WeakPolarHBondContact CA-O 3.44Å
85	E	93.8	Very high	89.4	Confident	35 Å²	35	57.2 Å²	57.2	16%	0.164	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	131.9	169.9	-178.1	-179.7	-165.8	0	0	109.8	Y83 G91 R126 Y128	Y83-E85 HydrophobicContact CE2-CB 4.4Å; E85-G91 PolarHBondContact OE1-N 3.48Å; E85-R126 HydrophobicContact CB-CB 4.49Å; E85-R126 PolarHBondContact N-O 3.36Å; E85-R126 PolarHBondContact O-N 3.39Å; E85-Y128 HydrophobicContact CB-CE2 4.28Å; E85-Y128 PolarHBondContact OE2-OH 2.94Å
86	F	93	Very high	89.4	Confident	1 Å²	1	60.9 Å²	60.9	0%	0.004	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	139.5	177.8	-69.2	-86.9	0	0	0	111.8	H88 K89 K90 Y94 I100 E103 I104 I123 N124 L125	F86-H88 AromaticContact CD1-CE1 3.56Å; F86-H88 AromaticContact CG-CE1 3.63Å; F86-H88 PolarHBondContact O-N 3.13Å; F86-K89 HydrophobicContact CB-CB 4.39Å; F86-K89 CarbonylContact O-C 3.45Å; F86-K89 PolarHBondContact O-N 2.91Å; F86-K90 PolarHBondContact O-N 2.68Å; F86-Y94 HydrophobicContact CD2-CD2 4.05Å; F86-Y94 AromaticContact CD2-CE2 3.71Å; F86-Y94 HydrophobicContact CD2-CE2 3.71Å; F86-Y94 AromaticContact CD2-CZ 4Å; F86-Y94 HydrophobicContact CE2-CD1 4.42Å; F86-Y94 HydrophobicContact CE2-CD2 4.27Å; F86-Y94 HydrophobicContact CE2-CE1 4.24Å; F86-Y94 HydrophobicContact CE2-CE2 4.12Å; F86-Y94 HydrophobicContact CE2-CG 4.44Å; F86-I100 HydrophobicContact CE2-CB 4.48Å; F86-I100 HydrophobicContact CE2-CG1 4.45Å; F86-I100 HydrophobicContact CE2-CG2 4.19Å; F86-I100 HydrophobicContact CZ-CB 4.41Å; F86-I100 HydrophobicContact CZ-CG2 3.73Å; F86-E103 HydrophobicContact CD2-CB 4.34Å; F86-E103 HydrophobicContact CD2-CG 3.84Å; F86-E103 HydrophobicContact CE1-CG 4.34Å; F86-E103 HydrophobicContact CE2-CB 3.61Å; F86-E103 HydrophobicContact CE2-CG 3.61Å; F86-E103 HydrophobicContact CG-CG 4.31Å; F86-E103 HydrophobicContact CZ-CB 3.74Å; F86-E103 HydrophobicContact CZ-CG 3.86Å; F86-I104 HydrophobicContact CE1-CG1 3.82Å; F86-I104 HydrophobicContact CZ-CG1 3.91Å; F86-I123 HydrophobicContact CD1-CG2 3.97Å; F86-I123 HydrophobicContact CE1-CG2 4Å; F86-N124 WeakPolarHBondContact CA-O 3.48Å; F86-L125 HydrophobicContact CD1-CB 4.16Å; F86-L125 HydrophobicContact CD1-CD1 4.04Å; F86-L125 HydrophobicContact CD2-CD1 4.3Å; F86-L125 HydrophobicContact CE1-CB 4.1Å; F86-L125 HydrophobicContact CE1-CD1 3.88Å; F86-L125 HydrophobicContact CE1-CD2 4.34Å; F86-L125 HydrophobicContact CE1-CG 4.32Å; F86-L125 HydrophobicContact CE2-CD1 4.12Å; F86-L125 HydrophobicContact CG-CD1 4.27Å; F86-L125 HydrophobicContact CZ-CD1 3.92Å; F86-L125 HydrophobicContact CZ-CD2 4.49Å
87	L	87.1	Confident	89.5	Confident	34 Å²	34	59.9 Å²	59.9	18%	0.178	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-63.1	-29	178.9	-166.6	69.9	0	0	0	112.8	T23 K89 K90 N124	T23-L87 HydrophobicContact CG2-CD2 4.04Å; L87-K89 VanDerWaalsContact C-N 3.31Å; L87-K90 WeakPolarHBondContact O-CG 3.21Å; L87-N124 HydrophobicContact CB-CB 3.61Å; L87-N124 HydrophobicContact CD2-CB 3.99Å; L87-N124 HydrophobicContact CG-CB 4.44Å; L87-N124 PolarHBondContact N-O 3.44Å
88	H	87.1	Confident	89.7	Confident	70 Å²	70	58.8 Å²	58.8	32%	0.324	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-80.4	-7.3	175.2	69.6	-82	0	0	0	113.9	F86 E103 E107	F86-H88 AromaticContact CD1-CE1 3.56Å; F86-H88 AromaticContact CG-CE1 3.63Å; F86-H88 PolarHBondContact O-N 3.13Å; H88-E103 IonicContact CD2-OE1 3Å; H88-E103 IonicContact CE1-OE1 3.26Å; H88-E103 IonicContact NE2-OE1 2.78Å; H88-E103 PolarHBondContact NE2-OE1 3.04Å; H88-E107 IonicContact CD2-OE2 3.3Å; H88-E107 IonicContact NE2-OE2 3.5Å
89	K	87.7	Confident	90	Very high	62 Å²	62	60.2 Å²	60.2	27%	0.27	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-136.9	54.6	177.9	-75.5	-179.2	164	-166.9	0	111.5	F86 L87 G91 Q92 Y94 E103	F86-K89 HydrophobicContact CB-CB 4.39Å; F86-K89 CarbonylContact O-C 3.45Å; F86-K89 PolarHBondContact O-N 2.91Å; L87-K89 VanDerWaalsContact C-N 3.31Å; K89-G91 PolarHBondContact O-N 3.4Å; K89-Q92 HydrophobicContact CB-CB 4.3Å; K89-Q92 WeakPolarHBondContact O-CB 3.25Å; K89-Q92 PolarHBondContact O-N 3.37Å; K89-Q92 VanDerWaalsContact O-N 3.1Å; K89-Y94 VanDerWaalsContact CD-OH 3.23Å; K89-Y94 WeakPolarHBondContact CD-OH 3.49Å; K89-Y94 PolarHBondContact NZ-OH 2.7Å; K89-E103 HydrophobicContact CD-CG 4.48Å; K89-E103 WeakPolarHBondContact CD-OE1 3.43Å; K89-E103 VanDerWaalsContact CE-OE1 3.22Å; K89-E103 WeakPolarHBondContact CE-OE1 3.24Å; K89-E103 WeakPolarHBondContact CE-OE2 3.34Å; K89-E103 VanDerWaalsContact NZ-CD 3.31Å; K89-E103 IonicContact NZ-OE1 3.7Å; K89-E103 PolarHBondContact NZ-OE1 3.11Å; K89-E103 IonicContact NZ-OE2 2.91Å; K89-E103 PolarHBondContact NZ-OE2 2.94Å
90	K	82.2	Confident	90.5	Very high	115 Å²	115	53.6 Å²	53.6	50%	0.5	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	138.1	179.9	-68.2	-157.9	169.5	-160.2	0	112.8	H24 F86 L87 Q92	H24-K90 PolarHBondContact CE1-NZ 2.73Å; H24-K90 VanDerWaalsContact NE2-CE 3.28Å; H24-K90 WeakPolarHBondContact NE2-CE 3.32Å; H24-K90 PolarHBondContact NE2-NZ 3.23Å; F86-K90 PolarHBondContact O-N 2.68Å; L87-K90 WeakPolarHBondContact O-CG 3.21Å; K90-Q92 PolarHBondContact O-N 3.24Å
91	G	84.5	Confident	91	Very high	61 Å²	61	53.3 Å²	53.3	63%	0.629	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-17.1	-178.7	0	0	0	0	0	114.7	E85 K89 K93	E85-G91 PolarHBondContact OE1-N 3.48Å; K89-G91 PolarHBondContact O-N 3.4Å; G91-K93 PolarHBondContact O-N 2.84Å
92	Q	92.1	Very high	91.4	Very high	95 Å²	95	52.9 Å²	52.9	44%	0.444	28%	0.277	S	S	.	.			trans	-79.7	103.9	172.7	-170	173.3	-5.2	0	0	109.6	K89 K90 Y94	K89-Q92 HydrophobicContact CB-CB 4.3Å; K89-Q92 WeakPolarHBondContact O-CB 3.25Å; K89-Q92 PolarHBondContact O-N 3.37Å; K89-Q92 VanDerWaalsContact O-N 3.1Å; K90-Q92 PolarHBondContact O-N 3.24Å; Q92-Y94 HydrophobicContact CB-CE2 4.08Å; Q92-Y94 HydrophobicContact CG-CD2 4.14Å; Q92-Y94 HydrophobicContact CG-CE2 3.62Å; Q92-Y94 WeakPolarHBondContact O-CD2 3.08Å
93	K	92.4	Very high	91.6	Very high	123 Å²	123	52 Å²	52	54%	0.535	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.8	175.5	-62.5	-168.1	175.3	-161.3	0	110.9	Y83 G91	Y83-K93 HydrophobicContact CD1-CD 4.16Å; Y83-K93 HydrophobicContact CD2-CB 3.77Å; Y83-K93 HydrophobicContact CD2-CD 3.69Å; Y83-K93 HydrophobicContact CD2-CG 3.64Å; Y83-K93 HydrophobicContact CE1-CD 4.01Å; Y83-K93 HydrophobicContact CE2-CB 4.34Å; Y83-K93 HydrophobicContact CE2-CD 3.52Å; Y83-K93 HydrophobicContact CE2-CG 3.68Å; Y83-K93 HydrophobicContact CG-CB 4.16Å; Y83-K93 HydrophobicContact CG-CD 4.04Å; Y83-K93 HydrophobicContact CG-CG 4.31Å; Y83-K93 VanDerWaalsContact CZ-CE 3.47Å; Y83-K93 WeakPolarHBondContact OH-CE 3.18Å; Y83-K93 PolarHBondContact OH-NZ 2.65Å; G91-K93 PolarHBondContact O-N 2.84Å
94	Y	94	Very high	91.6	Very high	13 Å²	13	51.4 Å²	51.4	5%	0.051	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	94.7	178.7	-70.3	-113.1	0	0	0	109.2	Y83 G84 F86 K89 Q92 D96 L99 I100 E103	Y83-Y94 CarbonylContact C-O 3.56Å; Y83-Y94 WeakPolarHBondContact CA-O 3.43Å; G84-Y94 PolarHBondContact N-O 2.85Å; G84-Y94 PolarHBondContact O-N 2.84Å; F86-Y94 HydrophobicContact CD2-CD2 4.05Å; F86-Y94 AromaticContact CD2-CE2 3.71Å; F86-Y94 HydrophobicContact CD2-CE2 3.71Å; F86-Y94 AromaticContact CD2-CZ 4Å; F86-Y94 HydrophobicContact CE2-CD1 4.42Å; F86-Y94 HydrophobicContact CE2-CD2 4.27Å; F86-Y94 HydrophobicContact CE2-CE1 4.24Å; F86-Y94 HydrophobicContact CE2-CE2 4.12Å; F86-Y94 HydrophobicContact CE2-CG 4.44Å; K89-Y94 VanDerWaalsContact CD-OH 3.23Å; K89-Y94 WeakPolarHBondContact CD-OH 3.49Å; K89-Y94 PolarHBondContact NZ-OH 2.7Å; Q92-Y94 HydrophobicContact CB-CE2 4.08Å; Q92-Y94 HydrophobicContact CG-CD2 4.14Å; Q92-Y94 HydrophobicContact CG-CE2 3.62Å; Q92-Y94 WeakPolarHBondContact O-CD2 3.08Å; Y94-D96 VanDerWaalsContact C-N 3.31Å; Y94-L99 HydrophobicContact CD1-CB 3.79Å; Y94-L99 HydrophobicContact CE1-CB 4.27Å; Y94-I100 HydrophobicContact CD1-CG1 4.18Å; Y94-I100 HydrophobicContact CG-CG1 4.1Å; Y94-E103 HydrophobicContact CE1-CB 4.06Å; Y94-E103 HydrophobicContact CE1-CG 4.5Å; Y94-E103 PolarHBondContact OH-OE2 2.78Å
95	G	91	Very high	91.5	Very high	52 Å²	52	54.9 Å²	54.9	54%	0.536	29%	0.287	S	S	.	.			trans	-74.8	-20.9	174	0	0	0	0	0	113.7
96	D	91.8	Very high	91.4	Very high	77 Å²	77	55.3 Å²	55.3	41%	0.412	30%	0.296	S	S	.	.			trans	-97.2	124.5	173.1	-176.8	4.6	0	0	0	110.5	Y94 D98 L99 I100	Y94-D96 VanDerWaalsContact C-N 3.31Å; D96-D98 WeakPolarHBondContact OD1-CB 3.45Å; D96-D98 PolarHBondContact OD1-N 2.77Å; D96-L99 HydrophobicContact CB-CB 4.41Å; D96-L99 HydrophobicContact CB-CD1 4.08Å; D96-L99 HydrophobicContact CB-CG 4.05Å; D96-L99 PolarHBondContact O-N 2.66Å; D96-I100 PolarHBondContact O-N 3.03Å
97	F	92.4	Very high	91.4	Very high	14 Å²	14	56.5 Å²	56.5	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-80.5	-18.2	-179.6	-72.3	-104.6	0	0	0	112.6	V54 K56 F58 E82 L99 I100 R101 V127	V54-F97 HydrophobicContact CG1-CD1 4.29Å; V54-F97 HydrophobicContact CG1-CE1 3.73Å; V54-F97 HydrophobicContact CG1-CZ 4.49Å; K56-F97 HydrophobicContact CB-CB 4.14Å; K56-F97 HydrophobicContact CB-CD1 3.73Å; K56-F97 HydrophobicContact CB-CD2 4.37Å; K56-F97 HydrophobicContact CB-CE1 4.22Å; K56-F97 HydrophobicContact CB-CG 3.82Å; K56-F97 HydrophobicContact CD-CD2 4.28Å; K56-F97 HydrophobicContact CD-CE2 4.42Å; K56-F97 HydrophobicContact CG-CD1 3.87Å; K56-F97 HydrophobicContact CG-CD2 3.96Å; K56-F97 HydrophobicContact CG-CE1 3.94Å; K56-F97 HydrophobicContact CG-CE2 4.03Å; K56-F97 HydrophobicContact CG-CG 3.89Å; K56-F97 HydrophobicContact CG-CZ 4.01Å; F58-F97 HydrophobicContact CB-CB 3.98Å; F58-F97 HydrophobicContact CB-CD1 3.79Å; F58-F97 HydrophobicContact CB-CG 4.39Å; F58-F97 HydrophobicContact CG-CD1 4.32Å; E82-F97 HydrophobicContact CB-CE2 4.27Å; E82-F97 HydrophobicContact CB-CZ 4.48Å; F97-L99 VanDerWaalsContact C-N 3.32Å; F97-I100 HydrophobicContact CB-CD1 4.48Å; F97-I100 HydrophobicContact CD1-CD1 3.68Å; F97-I100 HydrophobicContact CE1-CD1 3.96Å; F97-I100 HydrophobicContact CG-CD1 3.99Å; F97-I100 PolarHBondContact O-N 3.48Å; F97-R101 PolarHBondContact O-N 3.34Å; F97-R101 VanDerWaalsContact O-N 3.1Å; F97-V127 HydrophobicContact CE1-CG1 3.85Å; F97-V127 HydrophobicContact CZ-CG1 4Å
98	D	92.3	Very high	91.6	Very high	64 Å²	64	55.2 Å²	55.2	34%	0.342	30%	0.296	S	S	.	.	H	α-helix	trans	-67.7	-33.6	168.1	-75.8	-31.8	0	0	0	110.8	D96 R101 Q102	D96-D98 WeakPolarHBondContact OD1-CB 3.45Å; D96-D98 PolarHBondContact OD1-N 2.77Å; D98-R101 WeakPolarHBondContact O-CB 3.49Å; D98-R101 PolarHBondContact O-N 3.49Å; D98-R101 IonicContact OD1-CZ 3.95Å; D98-R101 IonicContact OD1-NH1 3.71Å; D98-R101 PolarHBondContact OD1-NH1 3.19Å; D98-R101 IonicContact OD1-NH2 2.86Å; D98-R101 PolarHBondContact OD1-NH2 2.91Å; D98-Q102 WeakPolarHBondContact O-CG 3.45Å; D98-Q102 PolarHBondContact O-N 3.46Å
99	L	94.3	Very high	91.8	Very high	78 Å²	78	55 Å²	55	41%	0.408	30%	0.297	S	S	.	.	H	α-helix	trans	-72.7	-30.5	172.1	-63	-179.3	0	0	0	112.9	Y94 D96 F97 R101 Q102 E103	Y94-L99 HydrophobicContact CD1-CB 3.79Å; Y94-L99 HydrophobicContact CE1-CB 4.27Å; D96-L99 HydrophobicContact CB-CB 4.41Å; D96-L99 HydrophobicContact CB-CD1 4.08Å; D96-L99 HydrophobicContact CB-CG 4.05Å; D96-L99 PolarHBondContact O-N 2.66Å; F97-L99 VanDerWaalsContact C-N 3.32Å; L99-R101 VanDerWaalsContact C-N 3.34Å; L99-Q102 PolarHBondContact O-N 2.98Å; L99-E103 PolarHBondContact O-N 3.42Å
100	I	95.5	Very high	91.9	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.2	-43.1	171.5	-64.4	175.5	0	0	0	109.8	F58 F86 Y94 D96 F97 E103 I104 L125	F58-I100 HydrophobicContact CB-CG2 4.39Å; F58-I100 HydrophobicContact CD2-CG2 3.95Å; F86-I100 HydrophobicContact CE2-CB 4.48Å; F86-I100 HydrophobicContact CE2-CG1 4.45Å; F86-I100 HydrophobicContact CE2-CG2 4.19Å; F86-I100 HydrophobicContact CZ-CB 4.41Å; F86-I100 HydrophobicContact CZ-CG2 3.73Å; Y94-I100 HydrophobicContact CD1-CG1 4.18Å; Y94-I100 HydrophobicContact CG-CG1 4.1Å; D96-I100 PolarHBondContact O-N 3.03Å; F97-I100 HydrophobicContact CB-CD1 4.48Å; F97-I100 HydrophobicContact CD1-CD1 3.68Å; F97-I100 HydrophobicContact CE1-CD1 3.96Å; F97-I100 HydrophobicContact CG-CD1 3.99Å; F97-I100 PolarHBondContact O-N 3.48Å; I100-E103 PolarHBondContact O-N 2.85Å; I100-I104 HydrophobicContact CG2-CD1 4.11Å; I100-I104 WeakPolarHBondContact O-CG1 3.29Å; I100-I104 PolarHBondContact O-N 3.28Å; I100-L125 HydrophobicContact CG2-CD1 4.16Å; I100-L125 HydrophobicContact CG2-CD2 3.65Å
101	R	94.3	Very high	92.1	Very high	49 Å²	49	55.7 Å²	55.7	19%	0.185	31%	0.305	C	S	.	.	H	α-helix	trans	-58.6	-49.5	175.9	-165.3	-175.7	-51.5	109	13.4	111.9	D57 F58 L59 P60 F97 D98 L99 E103 I104 E105	D57-R101 VanDerWaalsContact C-NH2 3.34Å; D57-R101 PolarHBondContact O-NH2 3.33Å; F58-R101 VanDerWaalsContact O-CA 3.28Å; F58-R101 WeakPolarHBondContact O-CA 3.29Å; F58-R101 WeakPolarHBondContact O-CB 3.3Å; L59-R101 WeakPolarHBondContact O-CD 3.12Å; L59-R101 PolarHBondContact O-NE 3.3Å; P60-R101 HydrophobicContact CB-CG 4.46Å; P60-R101 HydrophobicContact CG-CG 4.08Å; F97-R101 PolarHBondContact O-N 3.34Å; F97-R101 VanDerWaalsContact O-N 3.1Å; D98-R101 WeakPolarHBondContact O-CB 3.49Å; D98-R101 PolarHBondContact O-N 3.49Å; D98-R101 IonicContact OD1-CZ 3.95Å; D98-R101 IonicContact OD1-NH1 3.71Å; D98-R101 PolarHBondContact OD1-NH1 3.19Å; D98-R101 IonicContact OD1-NH2 2.86Å; D98-R101 PolarHBondContact OD1-NH2 2.91Å; L99-R101 VanDerWaalsContact C-N 3.34Å; R101-E103 VanDerWaalsContact C-N 3.32Å; R101-E103 PolarHBondContact O-N 3.47Å; R101-I104 PolarHBondContact O-N 2.92Å; R101-E105 PolarHBondContact O-N 2.85Å
102	Q	94.2	Very high	92.1	Very high	108 Å²	108	54.2 Å²	54.2	51%	0.505	28%	0.284	S	S	.	.	H	α-helix	trans	-61.4	-37.2	178.6	-68.8	168.9	34.1	0	0	112.5	D98 L99 E105 A106	D98-Q102 WeakPolarHBondContact O-CG 3.45Å; D98-Q102 PolarHBondContact O-N 3.46Å; L99-Q102 PolarHBondContact O-N 2.98Å; Q102-E105 PolarHBondContact O-N 2.7Å; Q102-A106 VanDerWaalsContact O-CB 3.27Å; Q102-A106 WeakPolarHBondContact O-CB 3.49Å; Q102-A106 PolarHBondContact O-N 3Å
103	E	95.2	Very high	91.7	Very high	16 Å²	16	51.2 Å²	51.2	8%	0.075	28%	0.278	C	S	.	.	H	α-helix	trans	-69.3	-37.8	175.1	-172.3	67.8	-148.2	0	0	112.2	F86 H88 K89 Y94 L99 I100 R101 E105 A106 E107 R110	F86-E103 HydrophobicContact CD2-CB 4.34Å; F86-E103 HydrophobicContact CD2-CG 3.84Å; F86-E103 HydrophobicContact CE1-CG 4.34Å; F86-E103 HydrophobicContact CE2-CB 3.61Å; F86-E103 HydrophobicContact CE2-CG 3.61Å; F86-E103 HydrophobicContact CG-CG 4.31Å; F86-E103 HydrophobicContact CZ-CB 3.74Å; F86-E103 HydrophobicContact CZ-CG 3.86Å; H88-E103 IonicContact CD2-OE1 3Å; H88-E103 IonicContact CE1-OE1 3.26Å; H88-E103 IonicContact NE2-OE1 2.78Å; H88-E103 PolarHBondContact NE2-OE1 3.04Å; K89-E103 HydrophobicContact CD-CG 4.48Å; K89-E103 WeakPolarHBondContact CD-OE1 3.43Å; K89-E103 VanDerWaalsContact CE-OE1 3.22Å; K89-E103 WeakPolarHBondContact CE-OE1 3.24Å; K89-E103 WeakPolarHBondContact CE-OE2 3.34Å; K89-E103 VanDerWaalsContact NZ-CD 3.31Å; K89-E103 IonicContact NZ-OE1 3.7Å; K89-E103 PolarHBondContact NZ-OE1 3.11Å; K89-E103 IonicContact NZ-OE2 2.91Å; K89-E103 PolarHBondContact NZ-OE2 2.94Å; Y94-E103 HydrophobicContact CE1-CB 4.06Å; Y94-E103 HydrophobicContact CE1-CG 4.5Å; Y94-E103 PolarHBondContact OH-OE2 2.78Å; L99-E103 PolarHBondContact O-N 3.42Å; I100-E103 PolarHBondContact O-N 2.85Å; R101-E103 VanDerWaalsContact C-N 3.32Å; R101-E103 PolarHBondContact O-N 3.47Å; E103-E105 VanDerWaalsContact C-N 3.32Å; E103-E105 PolarHBondContact O-N 2.85Å; E103-A106 PolarHBondContact O-N 2.94Å; E103-E107 WeakPolarHBondContact O-CB 3.38Å; E103-E107 PolarHBondContact O-N 3.31Å; E103-R110 IonicContact OE1-NH1 2.92Å
104	I	94.3	Very high	90.9	Very high	13 Å²	13	50.3 Å²	50.3	7%	0.067	29%	0.287	C	S	.	.	H	α-helix	trans	-61.8	-42.5	174.8	-68	166.7	0	0	0	110.4	F58 L59 P60 L71 F86 I100 R101 T108 I123 L125	F58-I104 HydrophobicContact CD2-CD1 4.29Å; L59-I104 HydrophobicContact CD2-CD1 3.98Å; P60-I104 HydrophobicContact CG-CB 4.32Å; P60-I104 HydrophobicContact CG-CG2 3.88Å; L71-I104 HydrophobicContact CD2-CD1 4.22Å; F86-I104 HydrophobicContact CE1-CG1 3.82Å; F86-I104 HydrophobicContact CZ-CG1 3.91Å; I100-I104 HydrophobicContact CG2-CD1 4.11Å; I100-I104 WeakPolarHBondContact O-CG1 3.29Å; I100-I104 PolarHBondContact O-N 3.28Å; R101-I104 PolarHBondContact O-N 2.92Å; I104-T108 VanDerWaalsContact O-CB 3.26Å; I104-T108 WeakPolarHBondContact O-CB 3.23Å; I104-T108 PolarHBondContact O-N 3.25Å; I104-T108 PolarHBondContact O-OG1 3.37Å; I104-I123 HydrophobicContact CG2-CD1 4.33Å; I104-L125 HydrophobicContact CD1-CD2 4.27Å
105	E	92.4	Very high	90	Very high	72 Å²	72	54.4 Å²	54.4	34%	0.336	31%	0.31	S	S	.	.	H	α-helix	trans	-62.8	-56	175.2	-71.1	162.3	-176.4	0	0	110.6	P60 R101 Q102 E103 E107 T108 D109	P60-E105 HydrophobicContact CB-CG 3.94Å; P60-E105 VanDerWaalsContact CB-OE1 3.27Å; P60-E105 WeakPolarHBondContact CB-OE1 3.22Å; P60-E105 HydrophobicContact CG-CG 3.58Å; R101-E105 PolarHBondContact O-N 2.85Å; Q102-E105 PolarHBondContact O-N 2.7Å; E103-E105 VanDerWaalsContact C-N 3.32Å; E103-E105 PolarHBondContact O-N 2.85Å; E105-E107 PolarHBondContact O-N 3.33Å; E105-T108 WeakPolarHBondContact O-CA 3.39Å; E105-T108 WeakPolarHBondContact O-CB 3.29Å; E105-T108 PolarHBondContact O-N 3.02Å; E105-D109 PolarHBondContact O-N 3.44Å
106	A	92.2	Very high	89.1	Confident	44 Å²	44	55.4 Å²	55.4	36%	0.364	30%	0.3	S	S	.	.	H	α-helix	trans	-64.8	-35.8	-176.4	0	0	0	0	0	114.2	Q102 E103 R110	Q102-A106 VanDerWaalsContact O-CB 3.27Å; Q102-A106 WeakPolarHBondContact O-CB 3.49Å; Q102-A106 PolarHBondContact O-N 3Å; E103-A106 PolarHBondContact O-N 2.94Å; A106-R110 WeakPolarHBondContact O-CB 3.37Å; A106-R110 PolarHBondContact O-N 2.83Å
107	E	92.6	Very high	88.7	Confident	26 Å²	26	52.4 Å²	52.4	12%	0.121	29%	0.287	C	S	.	.	H	α-helix	trans	-72.8	-30.5	173.2	172.8	54.7	-154.5	0	0	111.5	R69 H88 E103 E105 R110 A111 I123	R69-E107 IonicContact CZ-OE1 3.38Å; R69-E107 VanDerWaalsContact NH1-CD 3.34Å; R69-E107 PolarHBondContact NH1-O 3.28Å; R69-E107 IonicContact NH1-OE1 3.76Å; R69-E107 PolarHBondContact NH1-OE1 3.26Å; R69-E107 IonicContact NH2-OE1 2.75Å; R69-E107 PolarHBondContact NH2-OE1 3.33Å; R69-E107 VanDerWaalsContact NH2-OE1 3.13Å; H88-E107 IonicContact CD2-OE2 3.3Å; H88-E107 IonicContact NE2-OE2 3.5Å; E103-E107 WeakPolarHBondContact O-CB 3.38Å; E103-E107 PolarHBondContact O-N 3.31Å; E105-E107 PolarHBondContact O-N 3.33Å; E107-R110 WeakPolarHBondContact OE2-CD 3.06Å; E107-R110 IonicContact OE2-CZ 3.12Å; E107-R110 IonicContact OE2-NE 2.73Å; E107-R110 IonicContact OE2-NH1 2.67Å; E107-R110 PolarHBondContact OE2-NH1 3.2Å; E107-A111 PolarHBondContact O-N 3.35Å; E107-I123 HydrophobicContact CB-CD1 4.35Å; E107-I123 HydrophobicContact CG-CD1 3.97Å; E107-I123 HydrophobicContact CG-CG1 4.04Å
108	T	91.9	Very high	88.5	Confident	8 Å²	8	53 Å²	53	5%	0.049	29%	0.29	C	S	.	.	H	α-helix	trans	-67.5	-49.9	171.6	-61.4	0	0	0	0	110.9	R68 R69 I104 E105 R110 A111 V112	R68-T108 HydrophobicContact CB-CG2 3.72Å; R69-T108 HydrophobicContact CG-CG2 4.43Å; I104-T108 VanDerWaalsContact O-CB 3.26Å; I104-T108 WeakPolarHBondContact O-CB 3.23Å; I104-T108 PolarHBondContact O-N 3.25Å; I104-T108 PolarHBondContact O-OG1 3.37Å; E105-T108 WeakPolarHBondContact O-CA 3.39Å; E105-T108 WeakPolarHBondContact O-CB 3.29Å; E105-T108 PolarHBondContact O-N 3.02Å; T108-R110 VanDerWaalsContact C-N 3.29Å; T108-R110 PolarHBondContact O-N 3.01Å; T108-A111 PolarHBondContact O-N 3.3Å; T108-A111 VanDerWaalsContact O-N 3.1Å; T108-V112 HydrophobicContact CG2-CG2 4.42Å; T108-V112 PolarHBondContact O-N 2.84Å
109	D	90.7	Very high	88.4	Confident	66 Å²	66	51 Å²	51	35%	0.353	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-31.3	178.2	-70.4	-35.4	0	0	0	112.6	R68 E105 A111 G113	R68-D109 IonicContact CZ-OD1 2.69Å; R68-D109 IonicContact NH1-OD1 2.69Å; R68-D109 PolarHBondContact NH1-OD1 2.84Å; R68-D109 IonicContact NH2-OD1 2.7Å; R68-D109 PolarHBondContact NH2-OD1 3.5Å; R68-D109 IonicContact NH2-OD2 2.69Å; E105-D109 PolarHBondContact O-N 3.44Å; D109-A111 PolarHBondContact O-N 2.88Å; D109-G113 WeakPolarHBondContact O-CA 3.17Å; D109-G113 PolarHBondContact O-N 3.28Å
110	R	90.2	Very high	88.2	Confident	144 Å²	144	51.1 Å²	51.1	54%	0.543	29%	0.289	S	S	.	.	H	α-helix	trans	-60.8	-30.4	172.5	-175.7	-179.6	-60.3	131	6.8	113.4	E103 A106 E107 T108	E103-R110 IonicContact OE1-NH1 2.92Å; A106-R110 WeakPolarHBondContact O-CB 3.37Å; A106-R110 PolarHBondContact O-N 2.83Å; E107-R110 WeakPolarHBondContact OE2-CD 3.06Å; E107-R110 IonicContact OE2-CZ 3.12Å; E107-R110 IonicContact OE2-NE 2.73Å; E107-R110 IonicContact OE2-NH1 2.67Å; E107-R110 PolarHBondContact OE2-NH1 3.2Å; T108-R110 VanDerWaalsContact C-N 3.29Å; T108-R110 PolarHBondContact O-N 3.01Å
111	A	86.2	Confident	87.9	Confident	47 Å²	47	56.3 Å²	56.3	39%	0.388	32%	0.316	S	S	.	.	H	α-helix	trans	-104.2	-24.9	-175.2	0	0	0	0	0	114.6	R69 E107 T108 D109	R69-A111 VanDerWaalsContact NH1-CB 3.25Å; E107-A111 PolarHBondContact O-N 3.35Å; T108-A111 PolarHBondContact O-N 3.3Å; T108-A111 VanDerWaalsContact O-N 3.1Å; D109-A111 PolarHBondContact O-N 2.88Å
112	V	85.2	Confident	87.7	Confident	30 Å²	30	56 Å²	56	18%	0.182	32%	0.321	C	S	.	.	H	α-helix	trans	-113.3	-14.5	-176.6	-172.4	0	0	0	0	112	R69 T108	R69-V112 HydrophobicContact CG-CG2 4.4Å; T108-V112 HydrophobicContact CG2-CG2 4.42Å; T108-V112 PolarHBondContact O-N 2.84Å
113	G	82.3	Confident	87.6	Confident	32 Å²	32	51 Å²	51	33%	0.33	30%	0.298	S	S	.	.			trans	74.1	-176.3	-164.2	0	0	0	0	0	112	R68 D109 N115	R68-G113 PolarHBondContact NH1-O 3.37Å; R68-G113 VanDerWaalsContact NH1-O 3.11Å; D109-G113 WeakPolarHBondContact O-CA 3.17Å; D109-G113 PolarHBondContact O-N 3.28Å; G113-N115 PolarHBondContact O-N 3.46Å; G113-N115 VanDerWaalsContact O-N 3.08Å
114	S	75.9	Confident	87.5	Confident	104 Å²	104	51.3 Å²	51.3	73%	0.727	30%	0.3	S	S	*	.	S	Bend	trans	-64.6	-5.6	173.5	50.5	0	0	0	0	114.4
115	N	74.4	Confident	87.4	Confident	98 Å²	98	50.7 Å²	50.7	52%	0.524	30%	0.297	S	S	.	.	S	Bend	trans	-79.5	148.9	-175.8	-62.8	10.4	0	0	0	110.8	R68 G113 G117 D150	R68-N115 PolarHBondContact NH1-O 3.16Å; G113-N115 PolarHBondContact O-N 3.46Å; G113-N115 VanDerWaalsContact O-N 3.08Å; N115-G117 PolarHBondContact O-N 3.1Å; N115-G117 VanDerWaalsContact O-N 3.08Å; N115-D150 WeakPolarHBondContact CA-OD2 3.19Å; N115-D150 WeakPolarHBondContact CB-OD2 3.31Å
116	K	72.2	Confident	87.4	Confident	73 Å²	73	49.4 Å²	49.4	32%	0.317	29%	0.288	S	S	.	.	S	Bend	trans	-78.9	18.4	-178.6	-67.4	-176.3	-173.3	-170.3	0	114.6	V148 D150 Q151	K116-V148 WeakPolarHBondContact CD-O 3.43Å; K116-D150 WeakPolarHBondContact CB-OD1 3.4Å; K116-D150 VanDerWaalsContact CD-OD1 3.32Å; K116-D150 WeakPolarHBondContact CD-OD1 3.36Å; K116-D150 WeakPolarHBondContact CG-OD1 3.42Å; K116-D150 PolarHBondContact N-OD2 3.36Å; K116-Q151 HydrophobicContact CB-CG 3.51Å; K116-Q151 WeakPolarHBondContact O-CG 3.48Å; K116-Q151 PolarHBondContact O-NE2 3.4Å
117	G	83.2	Confident	87.5	Confident	15 Å²	15	47.3 Å²	47.3	16%	0.155	27%	0.271	C	S	.	.			trans	-65.1	-174.4	169.9	0	0	0	0	0	112.6	R68 N115	R68-G117 WeakPolarHBondContact CD-O 3.48Å; R68-G117 WeakPolarHBondContact CG-O 3.14Å; N115-G117 PolarHBondContact O-N 3.1Å; N115-G117 VanDerWaalsContact O-N 3.08Å
118	I	88.8	Confident	87.5	Confident	25 Å²	25	47.8 Å²	47.8	13%	0.128	27%	0.272	C	S	.	.			trans	-132.1	160.5	179.4	63.3	-179.3	0	0	0	110.8	I65 R68 I155 Q158 I159 M162	I65-I118 HydrophobicContact CG2-CG2 4.47Å; R68-I118 HydrophobicContact CB-CG2 4.4Å; R68-I118 VanDerWaalsContact O-CA 3.23Å; R68-I118 WeakPolarHBondContact O-CA 3.43Å; R68-I118 VanDerWaalsContact O-CB 3.28Å; R68-I118 WeakPolarHBondContact O-CB 3.31Å; I118-I155 HydrophobicContact CD1-CD1 4.06Å; I118-I155 HydrophobicContact CG1-CD1 4.15Å; I118-I155 HydrophobicContact CG2-CD1 4.14Å; I118-Q158 HydrophobicContact CD1-CB 3.83Å; I118-Q158 HydrophobicContact CG1-CB 4.45Å; I118-I159 HydrophobicContact CD1-CB 4.44Å; I118-I159 HydrophobicContact CD1-CG1 3.72Å; I118-M162 HydrophobicContact CB-CE 3.98Å; I118-M162 HydrophobicContact CD1-CE 3.6Å; I118-M162 HydrophobicContact CG1-CE 3.71Å
119	S	90.8	Very high	87.5	Confident	22 Å²	22	47.5 Å²	47.5	15%	0.154	27%	0.27	C	S	.	.			trans	-136.3	140.2	173.2	172.5	0	0	0	0	111.2	R68 P70 L121 M162	R68-S119 PolarHBondContact O-N 2.93Å; R68-S119 VanDerWaalsContact O-N 3.1Å; P70-S119 WeakPolarHBondContact CD-O 3.28Å; S119-L121 PolarHBondContact O-N 2.83Å; S119-L121 PolarHBondContact OG-N 3.25Å; S119-M162 VanDerWaalsContact C-CE 3.42Å; S119-M162 WeakPolarHBondContact O-CE 3.26Å
120	S	89.1	Confident	87.3	Confident	82 Å²	82	46.8 Å²	46.8	57%	0.573	27%	0.27	S	S	*	.	S	Bend	trans	-76	-9.2	178.2	52.4	0	0	0	0	113.5	P122	S120-P122 WeakPolarHBondContact O-CD 3.36Å
121	L	89	Confident	87.2	Confident	108 Å²	108	44.1 Å²	44.1	57%	0.565	27%	0.266	S	S	*	.	S	Bend	trans	-70.8	115.7	174.7	-63.5	178	0	0	0	109.6	R69 S119	R69-L121 PolarHBondContact NE-O 3.04Å; R69-L121 PolarHBondContact NH2-O 3.25Å; S119-L121 PolarHBondContact O-N 2.83Å; S119-L121 PolarHBondContact OG-N 3.25Å
122	P	90.9	Very high	87.2	Confident	43 Å²	43	42 Å²	42	28%	0.279	25%	0.248	S	C	.	.			trans	-70.1	159.6	-177.7	29.3	-35.3	0	0	0	112.1	R69 P70 I72 S120	R69-P122 PolarHBondContact NH2-O 3.38Å; P70-P122 HydrophobicContact CB-CB 4.24Å; P70-P122 CarbonylContact O-C 3.56Å; P70-P122 WeakPolarHBondContact O-CA 3.3Å; I72-P122 HydrophobicContact CD1-CB 3.61Å; I72-P122 HydrophobicContact CD1-CG 3.93Å; I72-P122 HydrophobicContact CG1-CB 4.07Å; S120-P122 WeakPolarHBondContact O-CD 3.36Å
123	I	92.7	Very high	87.3	Confident	4 Å²	4	43 Å²	43	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	135.7	159	-60.4	177.1	0	0	0	106.7	R69 P70 L71 I72 F86 I104 E107	R69-I123 HydrophobicContact CB-CD1 4.45Å; R69-I123 HydrophobicContact CB-CG1 4.41Å; P70-I123 PolarHBondContact O-N 3.35Å; L71-I123 HydrophobicContact CD1-CB 3.83Å; L71-I123 HydrophobicContact CD1-CG2 3.73Å; I72-I123 PolarHBondContact N-O 3.1Å; F86-I123 HydrophobicContact CD1-CG2 3.97Å; F86-I123 HydrophobicContact CE1-CG2 4Å; I104-I123 HydrophobicContact CG2-CD1 4.33Å; E107-I123 HydrophobicContact CB-CD1 4.35Å; E107-I123 HydrophobicContact CG-CD1 3.97Å; E107-I123 HydrophobicContact CG-CG1 4.04Å
124	N	91.9	Very high	87.5	Confident	21 Å²	21	42.5 Å²	42.5	11%	0.112	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116.3	179	-72.9	-90.6	0	0	0	109.2	I72 F86 L87	I72-N124 WeakPolarHBondContact CB-OD1 3.33Å; I72-N124 WeakPolarHBondContact CD1-OD1 3.35Å; F86-N124 WeakPolarHBondContact CA-O 3.48Å; L87-N124 HydrophobicContact CB-CB 3.61Å; L87-N124 HydrophobicContact CD2-CB 3.99Å; L87-N124 HydrophobicContact CG-CB 4.44Å; L87-N124 PolarHBondContact N-O 3.44Å
125	L	93.8	Very high	88.1	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	122.6	-177.1	172	61.9	0	0	0	110	F58 L71 I72 L73 Q74 F86 I100 I104 V127	F58-L125 HydrophobicContact CD2-CD2 4.02Å; F58-L125 HydrophobicContact CE2-CD2 3.75Å; L71-L125 HydrophobicContact CD1-CB 4.08Å; I72-L125 PolarHBondContact O-N 3.48Å; L73-L125 HydrophobicContact CD1-CD2 4.01Å; L73-L125 HydrophobicContact CD1-CG 4.21Å; Q74-L125 PolarHBondContact N-O 3.26Å; F86-L125 HydrophobicContact CD1-CB 4.16Å; F86-L125 HydrophobicContact CD1-CD1 4.04Å; F86-L125 HydrophobicContact CD2-CD1 4.3Å; F86-L125 HydrophobicContact CE1-CB 4.1Å; F86-L125 HydrophobicContact CE1-CD1 3.88Å; F86-L125 HydrophobicContact CE1-CD2 4.34Å; F86-L125 HydrophobicContact CE1-CG 4.32Å; F86-L125 HydrophobicContact CE2-CD1 4.12Å; F86-L125 HydrophobicContact CG-CD1 4.27Å; F86-L125 HydrophobicContact CZ-CD1 3.92Å; F86-L125 HydrophobicContact CZ-CD2 4.49Å; I100-L125 HydrophobicContact CG2-CD1 4.16Å; I100-L125 HydrophobicContact CG2-CD2 3.65Å; I104-L125 HydrophobicContact CD1-CD2 4.27Å; L125-V127 HydrophobicContact CD1-CG2 4.47Å; L125-V127 HydrophobicContact CD2-CG2 4.28Å; L125-V127 HydrophobicContact CG-CG2 4.1Å
126	R	92.1	Very high	88.8	Confident	44 Å²	44	33.2 Å²	33.2	17%	0.166	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	139	165.8	-71.3	-177.7	166.2	127.3	18.3	109.6	D20 Q74 I76 G84 E85 Y128	D20-R126 IonicContact OD1-CZ 3.91Å; D20-R126 IonicContact OD1-NH1 3.05Å; D20-R126 IonicContact OD1-NH2 2.88Å; D20-R126 PolarHBondContact OD1-NH2 3.26Å; D20-R126 IonicContact OD2-CZ 3.34Å; D20-R126 IonicContact OD2-NH1 2.68Å; D20-R126 PolarHBondContact OD2-NH1 2.95Å; D20-R126 IonicContact OD2-NH2 2.92Å; D20-R126 PolarHBondContact OD2-NH2 2.87Å; Q74-R126 HydrophobicContact CB-CG 4.07Å; Q74-R126 WeakPolarHBondContact O-CA 3.47Å; Q74-R126 VanDerWaalsContact OE1-CZ 3.26Å; I76-R126 HydrophobicContact CD1-CB 4.42Å; I76-R126 HydrophobicContact CD1-CG 4.22Å; G84-R126 CarbonylContact C-O 3.17Å; G84-R126 WeakPolarHBondContact CA-O 3.44Å; E85-R126 HydrophobicContact CB-CB 4.49Å; E85-R126 PolarHBondContact N-O 3.36Å; E85-R126 PolarHBondContact O-N 3.39Å; R126-Y128 HydrophobicContact CB-CD2 4.4Å; R126-Y128 HydrophobicContact CB-CE2 3.76Å
127	V	93.7	Very high	89.8	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	117.6	169.6	179.1	0	0	0	0	108.4	V54 L73 Q74 L75 I76 F97 L125	V54-V127 HydrophobicContact CG1-CG1 4.17Å; L73-V127 HydrophobicContact CD1-CG2 3.87Å; Q74-V127 PolarHBondContact O-N 3.22Å; L75-V127 HydrophobicContact CD2-CB 3.98Å; L75-V127 HydrophobicContact CD2-CG2 4.43Å; I76-V127 PolarHBondContact N-O 2.95Å; F97-V127 HydrophobicContact CE1-CG1 3.85Å; F97-V127 HydrophobicContact CZ-CG1 4Å; L125-V127 HydrophobicContact CD1-CG2 4.47Å; L125-V127 HydrophobicContact CD2-CG2 4.28Å; L125-V127 HydrophobicContact CG-CG2 4.1Å
128	Y	92.5	Very high	90.3	Very high	37 Å²	37	29 Å²	29	15%	0.145	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.3	175.9	-56.9	-99.3	0	0	0	108.2	I76 D78 E82 Y83 E85 R126	I76-Y128 HydrophobicContact CB-CD1 3.99Å; I76-Y128 HydrophobicContact CB-CE1 4.36Å; I76-Y128 HydrophobicContact CD1-CD1 4.16Å; I76-Y128 HydrophobicContact CD1-CE1 3.67Å; I76-Y128 HydrophobicContact CG2-CD1 3.85Å; I76-Y128 HydrophobicContact CG2-CE1 4.15Å; I76-Y128 WeakPolarHBondContact O-CA 3.35Å; D78-Y128 HydrophobicContact CB-CD1 4.48Å; E82-Y128 WeakPolarHBondContact CA-O 3.3Å; Y83-Y128 HydrophobicContact CD1-CD2 4.48Å; Y83-Y128 AromaticContact CD2-CD2 3.73Å; Y83-Y128 HydrophobicContact CD2-CD2 3.73Å; Y83-Y128 HydrophobicContact CD2-CE2 4.19Å; Y83-Y128 HydrophobicContact CE1-CD2 4Å; Y83-Y128 AromaticContact CE1-CG 3.96Å; Y83-Y128 HydrophobicContact CE1-CG 3.96Å; Y83-Y128 AromaticContact CE2-CD2 3.13Å; Y83-Y128 HydrophobicContact CE2-CD2 3.13Å; Y83-Y128 AromaticContact CE2-CE2 3.3Å; Y83-Y128 HydrophobicContact CE2-CE2 3.3Å; Y83-Y128 AromaticContact CE2-CG 3.94Å; Y83-Y128 HydrophobicContact CE2-CG 3.94Å; Y83-Y128 HydrophobicContact CG-CD2 4.35Å; Y83-Y128 AromaticContact CZ-CD2 3.27Å; Y83-Y128 AromaticContact CZ-CE2 3.59Å; Y83-Y128 AromaticContact CZ-CG 3.57Å; Y83-Y128 PolarHBondContact N-O 3.4Å; Y83-Y128 VanDerWaalsContact N-O 3.17Å; Y83-Y128 PolarHBondContact O-N 3.36Å; E85-Y128 HydrophobicContact CB-CE2 4.28Å; E85-Y128 PolarHBondContact OE2-OH 2.94Å; R126-Y128 HydrophobicContact CB-CD2 4.4Å; R126-Y128 HydrophobicContact CB-CE2 3.76Å
129	S	91.5	Very high	90.6	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.007	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	148.3	-180	164.8	0	0	0	0	112.1	I76 H77 D78 E82 N131	I76-S129 PolarHBondContact O-N 3.14Å; I76-S129 VanDerWaalsContact O-N 3.08Å; H77-S129 WeakPolarHBondContact CA-O 3.22Å; D78-S129 PolarHBondContact N-O 3.43Å; D78-S129 VanDerWaalsContact N-O 3.11Å; D78-S129 CarbonylContact O-C 3.15Å; E82-S129 WeakPolarHBondContact OE1-CB 3.41Å; E82-S129 PolarHBondContact OE1-OG 3.01Å; S129-N131 PolarHBondContact O-N 3.12Å; S129-N131 PolarHBondContact OG-N 3.45Å
130	P	87.8	Confident	90.8	Very high	52 Å²	52	26.9 Å²	26.9	34%	0.338	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-14.7	172.6	30.4	-34.1	0	0	0	112.3	H77 D78	H77-P130 PolarHBondContact CE1-O 2.97Å; H77-P130 VanDerWaalsContact CE1-O 3.25Å; H77-P130 PolarHBondContact ND1-O 2.99Å; D78-P130 WeakPolarHBondContact O-CA 3.48Å; D78-P130 WeakPolarHBondContact O-CB 3.38Å; D78-P130 WeakPolarHBondContact O-CD 3.4Å
131	N	86.3	Confident	91	Very high	87 Å²	87	23 Å²	23	47%	0.465	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-10.2	-176.6	-59.2	-70.6	0	0	0	113.2	E82 S129	E82-N131 PolarHBondContact OE1-ND2 2.65Å; S129-N131 PolarHBondContact O-N 3.12Å; S129-N131 PolarHBondContact OG-N 3.45Å
132	V	88.3	Confident	91.1	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.012	10%	0.098	C	C	.	.	S	Bend	trans	-102.3	157.3	-178.9	-53.4	0	0	0	0	112.7	L75 I76 H77	L75-V132 HydrophobicContact CB-CB 4.24Å; L75-V132 HydrophobicContact CB-CG2 4.09Å; L75-V132 HydrophobicContact CD1-CB 4.42Å; L75-V132 HydrophobicContact CD1-CG1 4.44Å; I76-V132 WeakPolarHBondContact O-CG2 3.39Å; H77-V132 WeakPolarHBondContact CB-O 3.37Å; H77-V132 PolarHBondContact ND1-O 3.17Å
133	L	86.9	Confident	91.1	Very high	51 Å²	51	16.8 Å²	16.8	27%	0.267	9%	0.088	S	C	.	.			trans	-92.6	149.8	162.1	-61.9	-179.9	0	0	0	110.2	L135 Q281 N285	L133-L135 PolarHBondContact O-N 2.84Å; L133-Q281 HydrophobicContact CB-CG 4.46Å; L133-Q281 HydrophobicContact CD1-CG 4.3Å; L133-Q281 HydrophobicContact CG-CG 4.47Å; L133-N285 HydrophobicContact CB-CB 4.28Å; L133-N285 HydrophobicContact CD1-CB 3.95Å
134	N	85.9	Confident	90.8	Very high	22 Å²	22	17 Å²	17	12%	0.118	9%	0.09	C	C	.	.	S	Bend	trans	-53	114.6	169	-73.2	-0.7	0	0	0	109.8	Q9 I12 L75 H77 N285	Q9-N134 PolarHBondContact O-ND2 3.45Å; I12-N134 HydrophobicContact CB-CB 4.38Å; I12-N134 HydrophobicContact CD1-CB 4.46Å; I12-N134 WeakPolarHBondContact CD1-O 3.21Å; I12-N134 HydrophobicContact CG2-CB 4.38Å; L75-N134 WeakPolarHBondContact O-CA 3.46Å; H77-N134 WeakPolarHBondContact CB-OD1 3.24Å; H77-N134 PolarHBondContact N-OD1 3.32Å; N134-N285 PolarHBondContact O-ND2 2.93Å
135	L	89	Confident	90.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	128.5	-174.1	-172.7	60.6	0	0	0	111.2	I36 L75 L133 L137 Q281 L284 L288	I36-L135 HydrophobicContact CD1-CD1 3.83Å; L75-L135 HydrophobicContact CB-CB 4.34Å; L75-L135 WeakPolarHBondContact CB-O 3.42Å; L75-L135 PolarHBondContact N-O 3.02Å; L75-L135 PolarHBondContact O-N 3.23Å; L133-L135 PolarHBondContact O-N 2.84Å; L135-L137 HydrophobicContact CD1-CD2 4.12Å; L135-L137 HydrophobicContact CD2-CD1 3.92Å; L135-L137 HydrophobicContact CD2-CD2 3.97Å; L135-L137 HydrophobicContact CD2-CG 4.06Å; L135-L137 HydrophobicContact CG-CD1 4.31Å; L135-L137 HydrophobicContact CG-CD2 3.81Å; L135-L137 HydrophobicContact CG-CG 3.91Å; L135-Q281 HydrophobicContact CD2-CG 4.31Å; L135-L284 HydrophobicContact CD1-CB 3.94Å; L135-L284 HydrophobicContact CD2-CB 3.97Å; L135-L284 HydrophobicContact CD2-CD1 4.42Å; L135-L288 HydrophobicContact CD1-CB 4.48Å; L135-L288 HydrophobicContact CD1-CD2 3.96Å
136	T	89.2	Confident	90.1	Very high	7 Å²	7	26 Å²	26	4%	0.043	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	119.5	175.2	-56.5	0	0	0	0	110	N16 I72 L73 Q74	N16-T136 PolarHBondContact ND2-OG1 3.21Å; N16-T136 VanDerWaalsContact ND2-OG1 3.1Å; N16-T136 PolarHBondContact OD1-OG1 3.46Å; I72-T136 HydrophobicContact CG2-CG2 4.26Å; L73-T136 WeakPolarHBondContact O-CA 3.33Å; Q74-T136 HydrophobicContact CG-CG2 3.84Å
137	L	92.7	Very high	89.7	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	150.8	-178	-56.3	178.6	0	0	0	109.9	I36 V38 L50 F53 L73 L135 L284	I36-L137 HydrophobicContact CB-CD2 3.71Å; I36-L137 HydrophobicContact CD1-CD2 3.72Å; I36-L137 HydrophobicContact CG1-CD2 4.33Å; I36-L137 HydrophobicContact CG2-CD2 3.74Å; I36-L137 CarbonylContact O-C 3.54Å; V38-L137 HydrophobicContact CG2-CB 4.48Å; L50-L137 HydrophobicContact CD2-CB 4.01Å; L50-L137 HydrophobicContact CD2-CD1 3.33Å; L50-L137 HydrophobicContact CD2-CG 4.3Å; F53-L137 HydrophobicContact CD2-CD1 3.52Å; F53-L137 HydrophobicContact CE2-CD1 3.57Å; L73-L137 PolarHBondContact N-O 3.37Å; L73-L137 PolarHBondContact O-N 3.02Å; L135-L137 HydrophobicContact CD1-CD2 4.12Å; L135-L137 HydrophobicContact CD2-CD1 3.92Å; L135-L137 HydrophobicContact CD2-CD2 3.97Å; L135-L137 HydrophobicContact CD2-CG 4.06Å; L135-L137 HydrophobicContact CG-CD1 4.31Å; L135-L137 HydrophobicContact CG-CD2 3.81Å; L135-L137 HydrophobicContact CG-CG 3.91Å; L137-L284 HydrophobicContact CD2-CD1 4.44Å
138	I	93.7	Very high	89.2	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	108.5	174.1	-48.8	-178.4	0	0	0	108.5	Q35 I36 V38 P70 L71 I72 L140 Y166	Q35-I138 HydrophobicContact CB-CD1 4.35Å; Q35-I138 HydrophobicContact CG-CD1 4.2Å; I36-I138 PolarHBondContact O-N 2.75Å; V38-I138 PolarHBondContact N-O 3.06Å; P70-I138 HydrophobicContact CB-CG2 4.26Å; L71-I138 CarbonylContact O-C 3.19Å; L71-I138 VanDerWaalsContact O-CA 3.3Å; L71-I138 WeakPolarHBondContact O-CA 3.41Å; I72-I138 HydrophobicContact CG1-CD1 4.37Å; I72-I138 HydrophobicContact CG1-CG1 4.2Å; I72-I138 HydrophobicContact CG1-CG2 4.29Å; I138-L140 HydrophobicContact CG2-CD2 3.75Å; I138-L140 HydrophobicContact CG2-CG 4.21Å; I138-Y166 HydrophobicContact CD1-CD1 3.75Å; I138-Y166 HydrophobicContact CD1-CE1 3.87Å; I138-Y166 HydrophobicContact CG2-CD1 4.45Å; I138-Y166 HydrophobicContact CG2-CE1 4.24Å
139	D	95	Very high	88.6	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	132	165.5	-158.2	25.7	0	0	0	108.2	K46 S47 L50 T67 P70 L71	K46-D139 WeakPolarHBondContact CB-OD1 3.47Å; K46-D139 VanDerWaalsContact CE-OD1 3.31Å; K46-D139 WeakPolarHBondContact CE-OD1 3.3Å; S47-D139 PolarHBondContact OG-OD2 2.86Å; L50-D139 HydrophobicContact CD1-CB 3.51Å; T67-D139 HydrophobicContact CG2-CB 4.24Å; T67-D139 WeakPolarHBondContact CG2-OD2 3.49Å; T67-D139 PolarHBondContact OG1-OD2 2.88Å; P70-D139 CarbonylContact C-O 3.58Å; P70-D139 WeakPolarHBondContact CA-O 3.43Å; L71-D139 HydrophobicContact CB-CB 4.2Å; L71-D139 PolarHBondContact N-O 2.99Å; L71-D139 PolarHBondContact O-N 2.84Å
140	L	94.5	Very high	88.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.21	C	C	.	.			trans	-115.3	155.2	177	-64.2	174.1	0	0	0	109.8	A37 V39 K46 P70 I138 G142 I163 Y166	A37-L140 HydrophobicContact CB-CD1 3.93Å; V39-L140 HydrophobicContact CG2-CD1 4.29Å; K46-L140 WeakPolarHBondContact CE-O 3.32Å; P70-L140 HydrophobicContact CB-CD2 3.89Å; P70-L140 HydrophobicContact CG-CD2 4.12Å; I138-L140 HydrophobicContact CG2-CD2 3.75Å; I138-L140 HydrophobicContact CG2-CG 4.21Å; L140-G142 PolarHBondContact O-N 2.83Å; L140-I163 HydrophobicContact CB-CG1 4.02Å; L140-I163 HydrophobicContact CD1-CB 4.35Å; L140-I163 HydrophobicContact CD1-CG1 4.07Å; L140-I163 HydrophobicContact CD1-CG2 4.08Å; L140-Y166 HydrophobicContact CD1-CD2 4.37Å; L140-Y166 HydrophobicContact CD1-CG 4.43Å; L140-Y166 HydrophobicContact CD2-CD2 3.68Å; L140-Y166 HydrophobicContact CD2-CE2 3.79Å; L140-Y166 HydrophobicContact CD2-CG 4.17Å
141	P	93	Very high	88.1	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-51	140.3	176.2	-28.3	35.9	0	0	0	112.8	I65 T67 L143 I159 M162	I65-P141 HydrophobicContact CG2-CB 4.36Å; T67-P141 VanDerWaalsContact O-CA 3.24Å; T67-P141 WeakPolarHBondContact O-CA 3.43Å; T67-P141 VanDerWaalsContact O-CB 3.24Å; T67-P141 WeakPolarHBondContact O-CB 3.35Å; T67-P141 WeakPolarHBondContact O-CG 3.45Å; P141-L143 PolarHBondContact O-N 2.84Å; P141-I159 HydrophobicContact CB-CG1 4.34Å; P141-I159 HydrophobicContact CB-CG2 4.14Å; P141-M162 HydrophobicContact CG-SD 3.72Å
142	G	92	Very high	88	Confident	6 Å²	6	30.5 Å²	30.5	6%	0.062	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-72.8	126.7	177.8	0	0	0	0	0	111.5	L140 T144	L140-G142 PolarHBondContact O-N 2.83Å; G142-T144 PolarHBondContact O-N 2.71Å
143	L	90.4	Very high	88	Confident	16 Å²	16	36.2 Å²	36.2	8%	0.084	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-54.4	124.6	174.5	-62	151.5	0	0	0	109.4	Q42 P141 I159 I163 D188 M192	Q42-L143 PolarHBondContact N-O 2.65Å; P141-L143 PolarHBondContact O-N 2.84Å; L143-I159 HydrophobicContact CD2-CG2 3.97Å; L143-I159 HydrophobicContact CG-CG2 4.41Å; L143-I163 HydrophobicContact CD2-CD1 3.9Å; L143-I163 HydrophobicContact CG-CD1 4.02Å; L143-D188 HydrophobicContact CD1-CB 3.72Å; L143-M192 HydrophobicContact CD1-CE 3.6Å; L143-M192 HydrophobicContact CD1-SD 4.3Å; L143-M192 HydrophobicContact CD2-CE 3.87Å; L143-M192 HydrophobicContact CD2-SD 3.84Å; L143-M192 HydrophobicContact CG-CE 4.2Å
144	T	87.2	Confident	88.2	Confident	9 Å²	9	37.5 Å²	37.5	6%	0.055	23%	0.231	C	C	.	.			trans	-117	148.2	166.2	-174.3	0	0	0	0	108.9	I65 G142 V146 I155 E156 I159	I65-T144 HydrophobicContact CD1-CG2 4.01Å; I65-T144 HydrophobicContact CG1-CG2 4.49Å; G142-T144 PolarHBondContact O-N 2.71Å; T144-V146 PolarHBondContact OG1-N 3.23Å; T144-V146 PolarHBondContact OG1-O 2.77Å; T144-I155 HydrophobicContact CG2-CG2 4.05Å; T144-E156 VanDerWaalsContact O-CB 3.29Å; T144-E156 WeakPolarHBondContact O-CB 3.34Å; T144-E156 WeakPolarHBondContact O-CG 3.29Å; T144-I159 HydrophobicContact CG2-CD1 3.95Å
145	K	85	Confident	88.3	Confident	115 Å²	115	36.5 Å²	36.5	50%	0.5	23%	0.226	S	C	.	.	S	Bend	trans	-102.1	-2.3	175.1	-72.2	166.4	170.4	156.7	0	112.9	D188	K145-D188 WeakPolarHBondContact CE-OD1 3.18Å; K145-D188 VanDerWaalsContact CE-OD2 3.25Å; K145-D188 WeakPolarHBondContact CE-OD2 3.12Å; K145-D188 IonicContact NZ-OD1 3.88Å; K145-D188 PolarHBondContact NZ-OD1 3.33Å; K145-D188 IonicContact NZ-OD2 3.93Å; K145-D188 PolarHBondContact NZ-OD2 3.26Å
146	V	86.1	Confident	88.5	Confident	94 Å²	94	40.7 Å²	40.7	57%	0.57	25%	0.245	S	C	*	.	S	Bend	trans	-143.1	127	-178.4	-173.8	0	0	0	0	108.5	T144	T144-V146 PolarHBondContact OG1-N 3.23Å; T144-V146 PolarHBondContact OG1-O 2.77Å
147	P	83.8	Confident	88.6	Confident	57 Å²	57	44.3 Å²	44.3	37%	0.37	26%	0.262	S	S	.	.			trans	-65.8	136	171.6	26.8	-33.3	0	0	0	110.6	Q151 I155	P147-Q151 HydrophobicContact CB-CB 3.76Å; P147-I155 HydrophobicContact CB-CG2 3.79Å
148	V	81.8	Confident	88.6	Confident	53 Å²	53	47.4 Å²	47.4	32%	0.321	28%	0.276	S	S	.	.			trans	-122.4	117.9	-178.4	-69.8	0	0	0	0	113.1	K116 Q151	K116-V148 WeakPolarHBondContact CD-O 3.43Å; V148-Q151 WeakPolarHBondContact O-CG 3.42Å
149	G	81.2	Confident	88.6	Confident	74 Å²	74	47.4 Å²	47.4	76%	0.763	28%	0.276	S	S	*	.	S	Bend	trans	82.2	-125	-173.8	0	0	0	0	0	111.2	Q151	G149-Q151 VanDerWaalsContact C-N 3.31Å; G149-Q151 PolarHBondContact O-N 3.07Å
150	D	83.1	Confident	88.6	Confident	81 Å²	81	50.8 Å²	50.8	43%	0.433	29%	0.289	S	S	.	.	S	Bend	trans	-89.1	15.4	-176.7	61.2	-63.6	0	0	0	114	N115 K116	N115-D150 WeakPolarHBondContact CA-OD2 3.19Å; N115-D150 WeakPolarHBondContact CB-OD2 3.31Å; K116-D150 WeakPolarHBondContact CB-OD1 3.4Å; K116-D150 VanDerWaalsContact CD-OD1 3.32Å; K116-D150 WeakPolarHBondContact CD-OD1 3.36Å; K116-D150 WeakPolarHBondContact CG-OD1 3.42Å; K116-D150 PolarHBondContact N-OD2 3.36Å
151	Q	84.2	Confident	88.6	Confident	13 Å²	13	54.3 Å²	54.3	6%	0.061	31%	0.308	C	S	.	.			trans	-70.4	142.8	-179.1	-68.3	-170.6	-38.3	0	0	112.2	K116 P147 V148 G149 I155	K116-Q151 HydrophobicContact CB-CG 3.51Å; K116-Q151 WeakPolarHBondContact O-CG 3.48Å; K116-Q151 PolarHBondContact O-NE2 3.4Å; P147-Q151 HydrophobicContact CB-CB 3.76Å; V148-Q151 WeakPolarHBondContact O-CG 3.42Å; G149-Q151 VanDerWaalsContact C-N 3.31Å; G149-Q151 PolarHBondContact O-N 3.07Å; Q151-I155 HydrophobicContact CB-CB 4.48Å; Q151-I155 HydrophobicContact CB-CG1 4.45Å; Q151-I155 HydrophobicContact CB-CG2 4.37Å
152	P	85.3	Confident	88.6	Confident	38 Å²	38	55.1 Å²	55.1	25%	0.247	31%	0.311	C	S	.	.			trans	-67.5	152.1	179.1	31.5	-36.6	0	0	0	110.8	D154 I155	P152-D154 WeakPolarHBondContact CB-OD1 3.49Å; P152-D154 PolarHBondContact O-N 2.77Å; P152-I155 HydrophobicContact CG-CB 4.16Å; P152-I155 HydrophobicContact CG-CD1 4.21Å; P152-I155 VanDerWaalsContact O-CB 3.26Å; P152-I155 WeakPolarHBondContact O-CB 3.37Å; P152-I155 WeakPolarHBondContact O-CG2 3.13Å; P152-I155 PolarHBondContact O-N 3.21Å; P152-I155 VanDerWaalsContact O-N 3.12Å
153	P	88.1	Confident	88.7	Confident	123 Å²	123	54.8 Å²	54.8	80%	0.799	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.5	-172.7	26.9	-35.3	0	0	0	113.7
154	D	90.9	Very high	88.9	Confident	78 Å²	78	55.4 Å²	55.4	42%	0.417	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	11.3	178.5	63.9	-50.3	0	0	0	113.7	P152 E156 Q157 Q158	P152-D154 WeakPolarHBondContact CB-OD1 3.49Å; P152-D154 PolarHBondContact O-N 2.77Å; D154-E156 VanDerWaalsContact C-N 3.26Å; D154-E156 PolarHBondContact O-N 3Å; D154-E156 VanDerWaalsContact O-N 3.12Å; D154-Q157 WeakPolarHBondContact O-CA 3.26Å; D154-Q157 WeakPolarHBondContact O-CB 3.38Å; D154-Q157 PolarHBondContact O-N 3.08Å; D154-Q158 VanDerWaalsContact CG-NE2 3.29Å; D154-Q158 PolarHBondContact O-N 2.94Å; D154-Q158 PolarHBondContact OD1-NE2 3.43Å; D154-Q158 WeakPolarHBondContact OD2-CG 3.43Å; D154-Q158 PolarHBondContact OD2-NE2 2.91Å
155	I	89.2	Confident	89.1	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-54.6	-34.5	-174.2	-169.4	58.5	0	0	0	114.2	I65 I118 T144 P147 Q151 P152 Q157 Q158 I159	I65-I155 HydrophobicContact CD1-CD1 4.44Å; I65-I155 HydrophobicContact CD1-CG1 3.99Å; I118-I155 HydrophobicContact CD1-CD1 4.06Å; I118-I155 HydrophobicContact CG1-CD1 4.15Å; I118-I155 HydrophobicContact CG2-CD1 4.14Å; T144-I155 HydrophobicContact CG2-CG2 4.05Å; P147-I155 HydrophobicContact CB-CG2 3.79Å; Q151-I155 HydrophobicContact CB-CB 4.48Å; Q151-I155 HydrophobicContact CB-CG1 4.45Å; Q151-I155 HydrophobicContact CB-CG2 4.37Å; P152-I155 HydrophobicContact CG-CB 4.16Å; P152-I155 HydrophobicContact CG-CD1 4.21Å; P152-I155 VanDerWaalsContact O-CB 3.26Å; P152-I155 WeakPolarHBondContact O-CB 3.37Å; P152-I155 WeakPolarHBondContact O-CG2 3.13Å; P152-I155 PolarHBondContact O-N 3.21Å; P152-I155 VanDerWaalsContact O-N 3.12Å; I155-Q157 VanDerWaalsContact C-N 3.34Å; I155-Q157 PolarHBondContact O-N 2.71Å; I155-Q158 PolarHBondContact O-N 3.1Å; I155-I159 HydrophobicContact CD1-CG1 4.39Å; I155-I159 HydrophobicContact CG1-CD1 4.07Å; I155-I159 HydrophobicContact CG1-CG1 4.45Å; I155-I159 WeakPolarHBondContact O-CD1 3.18Å; I155-I159 WeakPolarHBondContact O-CG1 3.23Å; I155-I159 PolarHBondContact O-N 2.76Å
156	E	91.4	Very high	89.5	Confident	87 Å²	87	54.2 Å²	54.2	41%	0.407	31%	0.312	S	S	.	.	H	α-helix	trans	-59	-45.7	174.2	-179.9	171.8	-178.4	0	0	111.3	T144 D154 I159 R160	T144-E156 VanDerWaalsContact O-CB 3.29Å; T144-E156 WeakPolarHBondContact O-CB 3.34Å; T144-E156 WeakPolarHBondContact O-CG 3.29Å; D154-E156 VanDerWaalsContact C-N 3.26Å; D154-E156 PolarHBondContact O-N 3Å; D154-E156 VanDerWaalsContact O-N 3.12Å; E156-I159 PolarHBondContact O-N 3Å; E156-R160 WeakPolarHBondContact O-CB 3.06Å; E156-R160 PolarHBondContact O-N 3.16Å
157	Q	92.7	Very high	89.8	Confident	84 Å²	84	49.7 Å²	49.7	39%	0.393	28%	0.284	S	S	.	.	H	α-helix	trans	-70.4	-40.2	-179.8	-178.7	58.2	22	0	0	111.2	D154 I155 I159 R160 D161	D154-Q157 WeakPolarHBondContact O-CA 3.26Å; D154-Q157 WeakPolarHBondContact O-CB 3.38Å; D154-Q157 PolarHBondContact O-N 3.08Å; I155-Q157 VanDerWaalsContact C-N 3.34Å; I155-Q157 PolarHBondContact O-N 2.71Å; Q157-I159 VanDerWaalsContact C-N 3.35Å; Q157-I159 PolarHBondContact O-N 3.07Å; Q157-R160 PolarHBondContact O-N 3.25Å; Q157-D161 PolarHBondContact NE2-OD1 3.14Å; Q157-D161 PolarHBondContact NE2-OD2 3.47Å; Q157-D161 WeakPolarHBondContact O-CB 3.47Å; Q157-D161 PolarHBondContact O-N 3.43Å
158	Q	92.8	Very high	90.3	Very high	65 Å²	65	51 Å²	51	30%	0.304	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-42.1	174.6	-61.5	-175.4	9.5	0	0	112.2	I118 D154 I155 M162	I118-Q158 HydrophobicContact CD1-CB 3.83Å; I118-Q158 HydrophobicContact CG1-CB 4.45Å; D154-Q158 VanDerWaalsContact CG-NE2 3.29Å; D154-Q158 PolarHBondContact O-N 2.94Å; D154-Q158 PolarHBondContact OD1-NE2 3.43Å; D154-Q158 WeakPolarHBondContact OD2-CG 3.43Å; D154-Q158 PolarHBondContact OD2-NE2 2.91Å; I155-Q158 PolarHBondContact O-N 3.1Å; Q158-M162 VanDerWaalsContact O-CB 3.28Å; Q158-M162 WeakPolarHBondContact O-CB 3.44Å; Q158-M162 PolarHBondContact O-N 3.28Å
159	I	93	Very high	90.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-66	-45.9	175.1	-63.3	159.8	0	0	0	110.5	I65 I118 P141 L143 T144 I155 E156 Q157 M162 I163	I65-I159 HydrophobicContact CD1-CD1 3.47Å; I65-I159 VanDerWaalsContact CD1-CD1 3.47Å; I65-I159 HydrophobicContact CD1-CG1 4.33Å; I118-I159 HydrophobicContact CD1-CB 4.44Å; I118-I159 HydrophobicContact CD1-CG1 3.72Å; P141-I159 HydrophobicContact CB-CG1 4.34Å; P141-I159 HydrophobicContact CB-CG2 4.14Å; L143-I159 HydrophobicContact CD2-CG2 3.97Å; L143-I159 HydrophobicContact CG-CG2 4.41Å; T144-I159 HydrophobicContact CG2-CD1 3.95Å; I155-I159 HydrophobicContact CD1-CG1 4.39Å; I155-I159 HydrophobicContact CG1-CD1 4.07Å; I155-I159 HydrophobicContact CG1-CG1 4.45Å; I155-I159 WeakPolarHBondContact O-CD1 3.18Å; I155-I159 WeakPolarHBondContact O-CG1 3.23Å; I155-I159 PolarHBondContact O-N 2.76Å; E156-I159 PolarHBondContact O-N 3Å; Q157-I159 VanDerWaalsContact C-N 3.35Å; Q157-I159 PolarHBondContact O-N 3.07Å; I159-M162 PolarHBondContact O-N 2.97Å; I159-I163 HydrophobicContact CG2-CD1 3.6Å; I159-I163 HydrophobicContact CG2-CG1 4.29Å; I159-I163 VanDerWaalsContact O-CG1 3.3Å; I159-I163 WeakPolarHBondContact O-CG1 3.36Å; I159-I163 PolarHBondContact O-N 2.98Å
160	R	94.4	Very high	91	Very high	73 Å²	73	56.4 Å²	56.4	28%	0.275	29%	0.29	S	S	.	.	H	α-helix	trans	-59.8	-48.6	-179.4	177.3	164.5	177.8	-82.5	-7.3	111.2	E156 Q157 I163 L164 M192 E195	E156-R160 WeakPolarHBondContact O-CB 3.06Å; E156-R160 PolarHBondContact O-N 3.16Å; Q157-R160 PolarHBondContact O-N 3.25Å; R160-I163 PolarHBondContact O-N 2.91Å; R160-L164 HydrophobicContact CG-CD1 3.95Å; R160-L164 HydrophobicContact CG-CG 4.49Å; R160-L164 WeakPolarHBondContact O-CB 3.32Å; R160-L164 VanDerWaalsContact O-CG 3.26Å; R160-L164 WeakPolarHBondContact O-CG 3.5Å; R160-L164 PolarHBondContact O-N 2.89Å; R160-M192 HydrophobicContact CB-SD 4.42Å; R160-M192 HydrophobicContact CG-SD 3.87Å; R160-E195 IonicContact CZ-OE2 3.18Å; R160-E195 IonicContact NE-OE2 2.7Å; R160-E195 IonicContact NH2-OE2 2.74Å; R160-E195 PolarHBondContact NH2-OE2 3.18Å
161	D	94.4	Very high	91.2	Very high	74 Å²	74	54.1 Å²	54.1	40%	0.396	28%	0.277	S	S	.	.	H	α-helix	trans	-64.6	-42.5	178.1	-70.3	-19.8	0	0	0	111.4	Q157 I163 L164 T165	Q157-D161 PolarHBondContact NE2-OD1 3.14Å; Q157-D161 PolarHBondContact NE2-OD2 3.47Å; Q157-D161 WeakPolarHBondContact O-CB 3.47Å; Q157-D161 PolarHBondContact O-N 3.43Å; D161-I163 PolarHBondContact O-N 3.43Å; D161-L164 PolarHBondContact O-N 3.4Å; D161-T165 VanDerWaalsContact O-CG2 3.27Å; D161-T165 WeakPolarHBondContact O-CG2 3.37Å; D161-T165 PolarHBondContact O-N 2.74Å
162	M	93.1	Very high	91.6	Very high	16 Å²	16	53.5 Å²	53.5	8%	0.079	27%	0.274	C	S	.	.	H	α-helix	trans	-56.1	-49.1	173.3	-175.6	-176.4	-62.7	0	0	111.5	P70 I118 S119 P141 Q158 I159 L164 T165 Y166	P70-M162 HydrophobicContact CG-CG 4.39Å; P70-M162 HydrophobicContact CG-SD 3.77Å; I118-M162 HydrophobicContact CB-CE 3.98Å; I118-M162 HydrophobicContact CD1-CE 3.6Å; I118-M162 HydrophobicContact CG1-CE 3.71Å; S119-M162 VanDerWaalsContact C-CE 3.42Å; S119-M162 WeakPolarHBondContact O-CE 3.26Å; P141-M162 HydrophobicContact CG-SD 3.72Å; Q158-M162 VanDerWaalsContact O-CB 3.28Å; Q158-M162 WeakPolarHBondContact O-CB 3.44Å; Q158-M162 PolarHBondContact O-N 3.28Å; I159-M162 PolarHBondContact O-N 2.97Å; M162-L164 VanDerWaalsContact C-N 3.35Å; M162-L164 PolarHBondContact O-N 3.11Å; M162-T165 PolarHBondContact O-N 3.21Å; M162-T165 PolarHBondContact O-OG1 3.21Å; M162-Y166 WeakPolarHBondContact O-CD2 3.17Å
163	I	94.8	Very high	92	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.4	-43	178.3	-67.9	167	0	0	0	110.8	V39 L140 L143 I159 R160 D161 T165 Y166 I167 M192	V39-I163 HydrophobicContact CG1-CG2 4.2Å; V39-I163 HydrophobicContact CG2-CG2 3.84Å; L140-I163 HydrophobicContact CB-CG1 4.02Å; L140-I163 HydrophobicContact CD1-CB 4.35Å; L140-I163 HydrophobicContact CD1-CG1 4.07Å; L140-I163 HydrophobicContact CD1-CG2 4.08Å; L143-I163 HydrophobicContact CD2-CD1 3.9Å; L143-I163 HydrophobicContact CG-CD1 4.02Å; I159-I163 HydrophobicContact CG2-CD1 3.6Å; I159-I163 HydrophobicContact CG2-CG1 4.29Å; I159-I163 VanDerWaalsContact O-CG1 3.3Å; I159-I163 WeakPolarHBondContact O-CG1 3.36Å; I159-I163 PolarHBondContact O-N 2.98Å; R160-I163 PolarHBondContact O-N 2.91Å; D161-I163 PolarHBondContact O-N 3.43Å; I163-T165 VanDerWaalsContact C-N 3.26Å; I163-T165 PolarHBondContact O-N 3.12Å; I163-Y166 PolarHBondContact O-N 3.35Å; I163-I167 HydrophobicContact CG2-CD1 3.83Å; I163-I167 HydrophobicContact CG2-CG1 4.03Å; I163-I167 HydrophobicContact CG2-CG2 4.14Å; I163-I167 PolarHBondContact O-N 2.84Å; I163-M192 HydrophobicContact CB-CE 4.19Å; I163-M192 HydrophobicContact CD1-CE 3.88Å; I163-M192 HydrophobicContact CG2-CE 3.61Å
164	L	94.7	Very high	92.5	Very high	28 Å²	28	45.8 Å²	45.8	15%	0.147	23%	0.225	C	C	.	.	H	α-helix	trans	-59.4	-32.8	177	-73.2	170.2	0	0	0	112.4	R160 D161 M162 Y166 I167 T168 V196	R160-L164 HydrophobicContact CG-CD1 3.95Å; R160-L164 HydrophobicContact CG-CG 4.49Å; R160-L164 WeakPolarHBondContact O-CB 3.32Å; R160-L164 VanDerWaalsContact O-CG 3.26Å; R160-L164 WeakPolarHBondContact O-CG 3.5Å; R160-L164 PolarHBondContact O-N 2.89Å; D161-L164 PolarHBondContact O-N 3.4Å; M162-L164 VanDerWaalsContact C-N 3.35Å; M162-L164 PolarHBondContact O-N 3.11Å; L164-Y166 PolarHBondContact O-N 2.73Å; L164-Y166 VanDerWaalsContact O-N 3.14Å; L164-I167 HydrophobicContact CD2-CD1 4.38Å; L164-I167 HydrophobicContact CD2-CG1 4.24Å; L164-I167 PolarHBondContact O-N 3.27Å; L164-T168 WeakPolarHBondContact O-CB 3.46Å; L164-T168 PolarHBondContact O-N 3.08Å; L164-T168 PolarHBondContact O-OG1 3.21Å; L164-V196 HydrophobicContact CD2-CG1 3.73Å
165	T	91.5	Very high	92.8	Very high	77 Å²	77	42.1 Å²	42.1	47%	0.472	21%	0.205	S	C	.	.	H	α-helix	trans	-61.5	-20.8	174	74.6	0	0	0	0	114.1	D161 M162 I163 R169	D161-T165 VanDerWaalsContact O-CG2 3.27Å; D161-T165 WeakPolarHBondContact O-CG2 3.37Å; D161-T165 PolarHBondContact O-N 2.74Å; M162-T165 PolarHBondContact O-N 3.21Å; M162-T165 PolarHBondContact O-OG1 3.21Å; I163-T165 VanDerWaalsContact C-N 3.26Å; I163-T165 PolarHBondContact O-N 3.12Å; T165-R169 PolarHBondContact O-NE 3.5Å; T165-R169 PolarHBondContact O-NH2 3.03Å
166	Y	92.2	Very high	93.2	Very high	22 Å²	22	42.1 Å²	42.1	9%	0.086	21%	0.205	C	C	.	.	H	α-helix	trans	-96.4	-53.5	173.4	-67.4	-91.6	0	0	0	111.4	P70 I138 L140 M162 I163 L164 R169 C172	P70-Y166 HydrophobicContact CB-CE2 4.23Å; P70-Y166 WeakPolarHBondContact CB-OH 3.18Å; P70-Y166 HydrophobicContact CG-CE2 3.92Å; P70-Y166 WeakPolarHBondContact CG-OH 3.39Å; I138-Y166 HydrophobicContact CD1-CD1 3.75Å; I138-Y166 HydrophobicContact CD1-CE1 3.87Å; I138-Y166 HydrophobicContact CG2-CD1 4.45Å; I138-Y166 HydrophobicContact CG2-CE1 4.24Å; L140-Y166 HydrophobicContact CD1-CD2 4.37Å; L140-Y166 HydrophobicContact CD1-CG 4.43Å; L140-Y166 HydrophobicContact CD2-CD2 3.68Å; L140-Y166 HydrophobicContact CD2-CE2 3.79Å; L140-Y166 HydrophobicContact CD2-CG 4.17Å; M162-Y166 WeakPolarHBondContact O-CD2 3.17Å; I163-Y166 PolarHBondContact O-N 3.35Å; L164-Y166 PolarHBondContact O-N 2.73Å; L164-Y166 VanDerWaalsContact O-N 3.14Å; Y166-R169 PolarHBondContact O-N 3.06Å; Y166-C172 WeakPolarHBondContact O-CB 3.49Å
167	I	94.3	Very high	93.4	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-80.6	-17.1	-168.4	68.6	169.2	0	0	0	115.1	A37 V39 I163 L164 R169 I174 M192 V196 R202	A37-I167 HydrophobicContact CB-CG2 3.88Å; V39-I167 HydrophobicContact CG2-CG2 3.78Å; I163-I167 HydrophobicContact CG2-CD1 3.83Å; I163-I167 HydrophobicContact CG2-CG1 4.03Å; I163-I167 HydrophobicContact CG2-CG2 4.14Å; I163-I167 PolarHBondContact O-N 2.84Å; L164-I167 HydrophobicContact CD2-CD1 4.38Å; L164-I167 HydrophobicContact CD2-CG1 4.24Å; L164-I167 PolarHBondContact O-N 3.27Å; I167-R169 PolarHBondContact O-N 3.38Å; I167-I174 HydrophobicContact CB-CD1 3.95Å; I167-I174 HydrophobicContact CB-CG1 4.09Å; I167-I174 HydrophobicContact CD1-CD1 4.48Å; I167-I174 HydrophobicContact CG2-CD1 4.39Å; I167-I174 HydrophobicContact CG2-CG1 4.07Å; I167-I174 HydrophobicContact CG2-CG2 4.49Å; I167-M192 HydrophobicContact CD1-CB 4.14Å; I167-V196 HydrophobicContact CB-CG2 4.17Å; I167-V196 HydrophobicContact CD1-CG2 3.85Å; I167-V196 HydrophobicContact CG1-CG1 4.41Å; I167-V196 HydrophobicContact CG1-CG2 3.91Å; I167-V196 WeakPolarHBondContact O-CG2 3.43Å; I167-R202 VanDerWaalsContact O-CZ 3.29Å; I167-R202 PolarHBondContact O-NH1 2.81Å; I167-R202 PolarHBondContact O-NH2 2.93Å
168	T	93.6	Very high	93.6	Very high	83 Å²	83	34.3 Å²	34.3	51%	0.509	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-25.4	175.1	-52.7	0	0	0	0	111.8	L164 E170	L164-T168 WeakPolarHBondContact O-CB 3.46Å; L164-T168 PolarHBondContact O-N 3.08Å; L164-T168 PolarHBondContact O-OG1 3.21Å; T168-E170 PolarHBondContact O-N 3.19Å
169	R	90.4	Very high	93.7	Very high	82 Å²	82	31.6 Å²	31.6	31%	0.309	16%	0.158	S	C	.	.	S	Bend	trans	-67.5	126.1	178.6	-51.8	-178	-155.6	-160.6	2.4	110.2	D32 T165 Y166 I167 N171 C172 R202	D32-R169 HydrophobicContact CB-CB 4.49Å; T165-R169 PolarHBondContact O-NE 3.5Å; T165-R169 PolarHBondContact O-NH2 3.03Å; Y166-R169 PolarHBondContact O-N 3.06Å; I167-R169 PolarHBondContact O-N 3.38Å; R169-N171 PolarHBondContact O-N 2.96Å; R169-C172 HydrophobicContact CB-CB 4.34Å; R169-C172 VanDerWaalsContact O-CB 3.29Å; R169-C172 WeakPolarHBondContact O-CB 3.45Å; R169-C172 PolarHBondContact O-N 2.88Å; R169-R202 PolarHBondContact O-NH1 3.15Å
170	E	88	Confident	93.7	Very high	159 Å²	159	32 Å²	32	74%	0.743	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-33.5	-177.6	-60.8	-174.3	149.7	0	0	112.7	T168 C172 R202	T168-E170 PolarHBondContact O-N 3.19Å; E170-C172 PolarHBondContact O-N 2.91Å; E170-R202 WeakPolarHBondContact O-CD 3.34Å
171	N	87.2	Confident	93.5	Very high	33 Å²	33	32.5 Å²	32.5	18%	0.176	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	2.2	176.3	-64.6	-11.5	0	0	0	113.9	D32 P34 R169 H291 T295	D32-N171 HydrophobicContact CB-CB 3.89Å; D32-N171 WeakPolarHBondContact O-CB 3.48Å; D32-N171 PolarHBondContact O-ND2 3.44Å; P34-N171 WeakPolarHBondContact CA-O 3.44Å; R169-N171 PolarHBondContact O-N 2.96Å; N171-H291 VanDerWaalsContact C-NE2 3.31Å; N171-H291 WeakPolarHBondContact CA-NE2 3.41Å; N171-H291 PolarHBondContact O-NE2 3.03Å; N171-T295 WeakPolarHBondContact OD1-CG2 3.19Å
172	C	91.9	Very high	93.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	118.9	172.4	-169.5	0	0	0	0	110.9	Q35 A37 Y166 R169 E170 R202	Q35-C172 HydrophobicContact CG-CB 4.36Å; A37-C172 VanDerWaalsContact CB-SG 3.52Å; Y166-C172 WeakPolarHBondContact O-CB 3.49Å; R169-C172 HydrophobicContact CB-CB 4.34Å; R169-C172 VanDerWaalsContact O-CB 3.29Å; R169-C172 WeakPolarHBondContact O-CB 3.45Å; R169-C172 PolarHBondContact O-N 2.88Å; E170-C172 PolarHBondContact O-N 2.91Å; C172-R202 WeakPolarHBondContact O-CD 3.2Å; C172-R202 PolarHBondContact O-NH1 2.77Å
173	L	94.5	Very high	92.9	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	137.8	164.4	-63	179.5	0	0	0	108.9	Q35 I36 A37 R202 Q287 H291	Q35-L173 PolarHBondContact O-N 3.14Å; I36-L173 WeakPolarHBondContact CA-O 3.44Å; I36-L173 HydrophobicContact CB-CB 4.5Å; I36-L173 HydrophobicContact CG1-CB 3.84Å; I36-L173 HydrophobicContact CG1-CD1 3.94Å; I36-L173 HydrophobicContact CG1-CG 4.46Å; A37-L173 PolarHBondContact N-O 3.4Å; L173-R202 WeakPolarHBondContact CA-O 3.35Å; L173-R202 HydrophobicContact CD2-CB 4.01Å; L173-Q287 HydrophobicContact CD1-CB 4.37Å; L173-H291 HydrophobicContact CD1-CB 4.15Å
174	I	96.8	Very high	92.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	118.4	-176.5	-53.6	173.9	0	0	0	108.7	V39 I167 A193 V196 D197 R202 T203 I204	V39-I174 HydrophobicContact CB-CG2 4.38Å; V39-I174 HydrophobicContact CG2-CG2 4.11Å; I167-I174 HydrophobicContact CB-CD1 3.95Å; I167-I174 HydrophobicContact CB-CG1 4.09Å; I167-I174 HydrophobicContact CD1-CD1 4.48Å; I167-I174 HydrophobicContact CG2-CD1 4.39Å; I167-I174 HydrophobicContact CG2-CG1 4.07Å; I167-I174 HydrophobicContact CG2-CG2 4.49Å; I174-A193 HydrophobicContact CD1-CB 4.32Å; I174-A193 HydrophobicContact CG2-CB 4.12Å; I174-V196 HydrophobicContact CD1-CG2 3.55Å; I174-D197 HydrophobicContact CD1-CB 4.46Å; I174-R202 PolarHBondContact N-O 2.82Å; I174-T203 HydrophobicContact CB-CG2 4.4Å; I174-T203 HydrophobicContact CG2-CG2 4.46Å; I174-T203 CarbonylContact O-C 3.6Å; I174-T203 WeakPolarHBondContact O-CA 3.33Å; I174-I204 PolarHBondContact O-N 3.32Å
175	L	97.4	Very high	92.2	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	95	172.7	-166.8	62.8	0	0	0	109.1	I36 A37 V38 V39 V177 I204 V206 L280 L284	I36-L175 HydrophobicContact CG2-CB 3.82Å; I36-L175 HydrophobicContact CG2-CD2 4.49Å; A37-L175 PolarHBondContact O-N 3.13Å; V38-L175 HydrophobicContact CG1-CD2 4.33Å; V38-L175 HydrophobicContact CG2-CB 4.44Å; V38-L175 HydrophobicContact CG2-CD2 4.15Å; V39-L175 PolarHBondContact N-O 2.79Å; V39-L175 VanDerWaalsContact O-O 3.09Å; L175-V177 HydrophobicContact CG-CG2 4.43Å; L175-V177 PolarHBondContact O-N 2.77Å; L175-I204 HydrophobicContact CD1-CB 3.89Å; L175-I204 HydrophobicContact CD1-CG2 3.85Å; L175-V206 HydrophobicContact CD1-CG2 3.41Å; L175-V206 VanDerWaalsContact CD1-CG2 3.41Å; L175-V206 HydrophobicContact CD2-CG2 4.44Å; L175-V206 HydrophobicContact CG-CG2 3.94Å; L175-L280 HydrophobicContact CD1-CD1 4.45Å; L175-L284 HydrophobicContact CD1-CD1 4.44Å; L175-L284 HydrophobicContact CD1-CD2 3.74Å; L175-L284 HydrophobicContact CD2-CD1 3.77Å; L175-L284 HydrophobicContact CD2-CD2 4.37Å
176	A	97.1	Very high	92.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	96.6	-175.5	0	0	0	0	0	110.7	V39 A189 L190 T203 I204 V206	V39-A176 CarbonylContact O-C 3.5Å; V39-A176 WeakPolarHBondContact O-CA 3.31Å; A176-A189 HydrophobicContact CB-CB 4.36Å; A176-L190 HydrophobicContact CB-CD2 3.68Å; A176-L190 HydrophobicContact CB-CG 4.24Å; A176-T203 HydrophobicContact CB-CG2 3.95Å; A176-I204 PolarHBondContact N-O 2.88Å; A176-V206 PolarHBondContact O-N 3.05Å
177	V	97	Very high	92.1	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	117.3	-178.2	-171.5	0	0	0	0	110.1	V38 V39 G40 A44 K46 V49 L175 V206 T208	V38-V177 HydrophobicContact CG1-CG2 3.56Å; V39-V177 PolarHBondContact O-N 3.41Å; G40-V177 WeakPolarHBondContact CA-O 3.41Å; A44-V177 HydrophobicContact CB-CG1 4.49Å; A44-V177 WeakPolarHBondContact O-CG1 3.23Å; K46-V177 HydrophobicContact CG-CB 4.11Å; K46-V177 HydrophobicContact CG-CG1 4.47Å; K46-V177 HydrophobicContact CG-CG2 4.17Å; V49-V177 HydrophobicContact CG2-CG1 4.32Å; L175-V177 HydrophobicContact CG-CG2 4.43Å; L175-V177 PolarHBondContact O-N 2.77Å; V177-V206 WeakPolarHBondContact CA-O 3.27Å; V177-V206 HydrophobicContact CG1-CG1 4.45Å; V177-V206 HydrophobicContact CG2-CB 4.31Å; V177-T208 HydrophobicContact CG1-CG2 3.58Å
178	T	95.7	Very high	92	Very high	6 Å²	6	41.1 Å²	41.1	4%	0.037	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	149	178.2	-51.2	0	0	0	0	109.7	L184 S187 V206 I207 T208	T178-L184 HydrophobicContact CG2-CD1 4.27Å; T178-S187 PolarHBondContact OG1-OG 3.44Å; T178-V206 PolarHBondContact N-O 3.18Å; T178-I207 WeakPolarHBondContact O-CA 3.42Å; T178-T208 PolarHBondContact O-N 3.48Å; T178-T208 PolarHBondContact O-OG1 3.3Å
179	A	95.4	Very high	92	Very high	8 Å²	8	37.2 Å²	37.2	7%	0.066	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	140	174.2	0	0	0	0	0	111	N181 T182 K209	A179-N181 VanDerWaalsContact C-N 3.29Å; A179-N181 PolarHBondContact O-N 2.6Å; A179-T182 PolarHBondContact O-N 2.88Å; A179-T182 PolarHBondContact O-OG1 3.38Å; A179-K209 HydrophobicContact CB-CD 3.99Å; A179-K209 HydrophobicContact CB-CG 4.44Å
180	A	93.6	Very high	92.2	Very high	10 Å²	10	33.7 Å²	33.7	8%	0.083	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-29.1	-179.5	0	0	0	0	0	113.1	T182 I207 T208 L210 M213 A219	A180-T182 PolarHBondContact O-N 3.02Å; A180-I207 HydrophobicContact CB-CG2 3.64Å; A180-T208 VanDerWaalsContact CB-O 3.3Å; A180-T208 WeakPolarHBondContact CB-O 3.41Å; A180-T208 PolarHBondContact N-O 2.99Å; A180-L210 HydrophobicContact CB-CD2 3.66Å; A180-L210 HydrophobicContact CB-CG 3.99Å; A180-M213 HydrophobicContact CB-CE 4.4Å; A180-M213 HydrophobicContact CB-CG 3.8Å; A180-M213 HydrophobicContact CB-SD 3.67Å; A180-A219 HydrophobicContact CB-CB 4.48Å
181	N	90.2	Very high	92.5	Very high	82 Å²	82	32.1 Å²	32.1	44%	0.439	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	21.5	177.3	79.3	-39.5	0	0	0	113.5	A179 L212	A179-N181 VanDerWaalsContact C-N 3.29Å; A179-N181 PolarHBondContact O-N 2.6Å; N181-L212 VanDerWaalsContact CB-O 3.24Å; N181-L212 WeakPolarHBondContact CB-O 3.37Å
182	T	87.5	Confident	92.8	Very high	66 Å²	66	30.8 Å²	30.8	41%	0.405	18%	0.181	S	C	.	.	S	Bend	trans	-135.6	138.7	171.3	52.4	0	0	0	0	108.7	A179 A180 L184	A179-T182 PolarHBondContact O-N 2.88Å; A179-T182 PolarHBondContact O-OG1 3.38Å; A180-T182 PolarHBondContact O-N 3.02Å; T182-L184 PolarHBondContact O-N 3.33Å
183	D	87.6	Confident	92.9	Very high	99 Å²	99	30.9 Å²	30.9	53%	0.529	18%	0.181	S	C	.	.			trans	-57.1	127.5	177.5	171.5	19.2	0	0	0	110.8	A185 T186	D183-A185 PolarHBondContact O-N 3.1Å; D183-A185 VanDerWaalsContact O-N 3.15Å; D183-A185 PolarHBondContact OD1-N 3.02Å; D183-T186 HydrophobicContact CB-CG2 4.2Å; D183-T186 WeakPolarHBondContact O-CB 3.31Å; D183-T186 PolarHBondContact O-N 3.29Å; D183-T186 PolarHBondContact O-OG1 3Å
184	L	88.2	Confident	92.9	Very high	8 Å²	8	36.1 Å²	36.1	4%	0.042	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-54.4	-33.8	-179.8	-166.2	74.3	0	0	0	112.3	T178 T182 T186 S187 L190 I207 I222 L227 L228 Y234	T178-L184 HydrophobicContact CG2-CD1 4.27Å; T182-L184 PolarHBondContact O-N 3.33Å; L184-T186 PolarHBondContact O-N 3.41Å; L184-S187 VanDerWaalsContact O-CB 3.26Å; L184-S187 WeakPolarHBondContact O-CB 3.08Å; L184-S187 PolarHBondContact O-N 2.96Å; L184-S187 VanDerWaalsContact O-N 3.11Å; L184-L190 HydrophobicContact CD1-CD1 3.39Å; L184-L190 HydrophobicContact CD2-CD1 4.46Å; L184-L190 HydrophobicContact CG-CD1 3.78Å; L184-I207 HydrophobicContact CD1-CD1 4.04Å; L184-I222 HydrophobicContact CB-CD1 4.08Å; L184-I222 HydrophobicContact CD1-CD1 4.3Å; L184-I222 HydrophobicContact CD1-CG2 3.9Å; L184-I222 HydrophobicContact CD2-CD1 4.41Å; L184-I222 HydrophobicContact CD2-CG1 4.15Å; L184-I222 HydrophobicContact CD2-CG2 3.87Å; L184-I222 HydrophobicContact CG-CG2 4.49Å; L184-L227 HydrophobicContact CB-CD2 4.06Å; L184-L227 HydrophobicContact CD2-CB 4.35Å; L184-L227 HydrophobicContact CD2-CD2 3.91Å; L184-L227 HydrophobicContact CD2-CG 4.22Å; L184-L228 HydrophobicContact CD2-CB 3.9Å; L184-Y234 HydrophobicContact CD1-CE1 4.18Å
185	A	87.1	Confident	92.8	Very high	90 Å²	90	40 Å²	40	74%	0.744	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-66	-18.1	178.3	0	0	0	0	0	113.3	D183	D183-A185 PolarHBondContact O-N 3.1Å; D183-A185 VanDerWaalsContact O-N 3.15Å; D183-A185 PolarHBondContact OD1-N 3.02Å
186	T	88.9	Confident	92.8	Very high	81 Å²	81	41.4 Å²	41.4	50%	0.497	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-89.7	-1.3	175.5	71.1	0	0	0	0	113.8	D183 L184 D188	D183-T186 HydrophobicContact CB-CG2 4.2Å; D183-T186 WeakPolarHBondContact O-CB 3.31Å; D183-T186 PolarHBondContact O-N 3.29Å; D183-T186 PolarHBondContact O-OG1 3Å; L184-T186 PolarHBondContact O-N 3.41Å; T186-D188 PolarHBondContact O-N 3.47Å; T186-D188 VanDerWaalsContact O-N 3.11Å
187	S	92.1	Very high	92.7	Very high	14 Å²	14	41.9 Å²	41.9	10%	0.098	23%	0.233	C	C	.	.			trans	-71.7	103.8	-175.6	-177.9	0	0	0	0	113	T178 L184 A189 L190 K191	T178-S187 PolarHBondContact OG1-OG 3.44Å; L184-S187 VanDerWaalsContact O-CB 3.26Å; L184-S187 WeakPolarHBondContact O-CB 3.08Å; L184-S187 PolarHBondContact O-N 2.96Å; L184-S187 VanDerWaalsContact O-N 3.11Å; S187-A189 PolarHBondContact O-N 2.91Å; S187-L190 PolarHBondContact O-N 3.5Å; S187-L190 VanDerWaalsContact O-N 3.11Å; S187-L190 PolarHBondContact OG-N 2.87Å; S187-K191 PolarHBondContact O-N 3.09Å
188	D	91.3	Very high	92.6	Very high	41 Å²	41	46 Å²	46	22%	0.219	26%	0.26	C	S	.	.	H	α-helix	trans	-59.4	-29	175.5	-55.9	-58.4	0	0	0	112.8	L143 K145 T186 K191 M192	L143-D188 HydrophobicContact CD1-CB 3.72Å; K145-D188 WeakPolarHBondContact CE-OD1 3.18Å; K145-D188 VanDerWaalsContact CE-OD2 3.25Å; K145-D188 WeakPolarHBondContact CE-OD2 3.12Å; K145-D188 IonicContact NZ-OD1 3.88Å; K145-D188 PolarHBondContact NZ-OD1 3.33Å; K145-D188 IonicContact NZ-OD2 3.93Å; K145-D188 PolarHBondContact NZ-OD2 3.26Å; T186-D188 PolarHBondContact O-N 3.47Å; T186-D188 VanDerWaalsContact O-N 3.11Å; D188-K191 PolarHBondContact O-N 3.2Å; D188-M192 WeakPolarHBondContact O-CG 3.27Å; D188-M192 PolarHBondContact O-N 2.93Å
189	A	93.9	Very high	92.4	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-67.9	-43.2	176	0	0	0	0	0	112.1	V39 A176 S187 A193	V39-A189 HydrophobicContact CB-CB 4.48Å; V39-A189 HydrophobicContact CG1-CB 3.92Å; A176-A189 HydrophobicContact CB-CB 4.36Å; S187-A189 PolarHBondContact O-N 2.91Å; A189-A193 WeakPolarHBondContact O-CB 3.48Å; A189-A193 PolarHBondContact O-N 3.22Å
190	L	94.5	Very high	92.3	Very high	8 Å²	8	47.9 Å²	47.9	4%	0.042	28%	0.277	C	S	.	.	H	α-helix	trans	-72.5	-33	175.5	-69	168.2	0	0	0	111.5	A176 L184 S187 K194 L228 L230 Y234	A176-L190 HydrophobicContact CB-CD2 3.68Å; A176-L190 HydrophobicContact CB-CG 4.24Å; L184-L190 HydrophobicContact CD1-CD1 3.39Å; L184-L190 HydrophobicContact CD2-CD1 4.46Å; L184-L190 HydrophobicContact CG-CD1 3.78Å; S187-L190 PolarHBondContact O-N 3.5Å; S187-L190 VanDerWaalsContact O-N 3.11Å; S187-L190 PolarHBondContact OG-N 2.87Å; L190-K194 VanDerWaalsContact O-CB 3.29Å; L190-K194 WeakPolarHBondContact O-CB 3.36Å; L190-K194 PolarHBondContact O-N 3.21Å; L190-L228 HydrophobicContact CB-CD2 4.24Å; L190-L228 HydrophobicContact CD1-CD2 4.22Å; L190-L230 HydrophobicContact CD2-CD1 4.16Å; L190-Y234 HydrophobicContact CD1-CE1 4.14Å; L190-Y234 HydrophobicContact CD2-CE1 4.35Å
191	K	94.4	Very high	92.2	Very high	125 Å²	125	53.3 Å²	53.3	54%	0.543	30%	0.3	S	S	.	.	H	α-helix	trans	-58.2	-57	170.9	-178.4	-171	169.6	-169.1	0	111.4	S187 D188 A193 K194 E195	S187-K191 PolarHBondContact O-N 3.09Å; D188-K191 PolarHBondContact O-N 3.2Å; K191-A193 VanDerWaalsContact C-N 3.33Å; K191-A193 PolarHBondContact O-N 2.88Å; K191-K194 WeakPolarHBondContact O-CA 3.37Å; K191-K194 WeakPolarHBondContact O-CB 3.38Å; K191-K194 PolarHBondContact O-N 3.39Å; K191-E195 VanDerWaalsContact CE-OE1 3.29Å; K191-E195 WeakPolarHBondContact CE-OE1 3.42Å; K191-E195 PolarHBondContact O-N 3.1Å
192	M	93.3	Very high	92.4	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.03	28%	0.283	C	S	.	.	H	α-helix	trans	-65.5	-35.9	179.3	-65.6	-168.4	-41.1	0	0	112.6	V39 L143 R160 I163 I167 D188 K194 E195 V196	V39-M192 HydrophobicContact CG1-CE 3.5Å; V39-M192 VanDerWaalsContact CG1-CE 3.5Å; L143-M192 HydrophobicContact CD1-CE 3.6Å; L143-M192 HydrophobicContact CD1-SD 4.3Å; L143-M192 HydrophobicContact CD2-CE 3.87Å; L143-M192 HydrophobicContact CD2-SD 3.84Å; L143-M192 HydrophobicContact CG-CE 4.2Å; R160-M192 HydrophobicContact CB-SD 4.42Å; R160-M192 HydrophobicContact CG-SD 3.87Å; I163-M192 HydrophobicContact CB-CE 4.19Å; I163-M192 HydrophobicContact CD1-CE 3.88Å; I163-M192 HydrophobicContact CG2-CE 3.61Å; I167-M192 HydrophobicContact CD1-CB 4.14Å; D188-M192 WeakPolarHBondContact O-CG 3.27Å; D188-M192 PolarHBondContact O-N 2.93Å; M192-K194 VanDerWaalsContact C-N 3.27Å; M192-K194 PolarHBondContact O-N 3.28Å; M192-E195 WeakPolarHBondContact O-CB 3.23Å; M192-E195 PolarHBondContact O-N 2.88Å; M192-V196 PolarHBondContact O-N 3.39Å
193	A	95.4	Very high	92.8	Very high	2 Å²	2	47.3 Å²	47.3	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-59.7	-39.6	171.8	0	0	0	0	0	111.3	I174 A189 K191 E195 V196 D197 T203	I174-A193 HydrophobicContact CD1-CB 4.32Å; I174-A193 HydrophobicContact CG2-CB 4.12Å; A189-A193 WeakPolarHBondContact O-CB 3.48Å; A189-A193 PolarHBondContact O-N 3.22Å; K191-A193 VanDerWaalsContact C-N 3.33Å; K191-A193 PolarHBondContact O-N 2.88Å; A193-E195 VanDerWaalsContact C-N 3.34Å; A193-E195 PolarHBondContact O-N 3.42Å; A193-V196 PolarHBondContact O-N 3.42Å; A193-D197 CarbonylContact O-C 3.57Å; A193-D197 WeakPolarHBondContact O-CA 3.44Å; A193-D197 WeakPolarHBondContact O-CB 3.31Å; A193-D197 PolarHBondContact O-N 3.22Å; A193-T203 HydrophobicContact CB-CG2 3.79Å
194	K	94.1	Very high	93.3	Very high	109 Å²	109	42.7 Å²	42.7	47%	0.474	24%	0.239	S	C	.	.	H	α-helix	trans	-68.7	-29.1	175.9	-162.6	67.7	169.7	178.4	0	113.3	L190 K191 M192 P198	L190-K194 VanDerWaalsContact O-CB 3.29Å; L190-K194 WeakPolarHBondContact O-CB 3.36Å; L190-K194 PolarHBondContact O-N 3.21Å; K191-K194 WeakPolarHBondContact O-CA 3.37Å; K191-K194 WeakPolarHBondContact O-CB 3.38Å; K191-K194 PolarHBondContact O-N 3.39Å; M192-K194 VanDerWaalsContact C-N 3.27Å; M192-K194 PolarHBondContact O-N 3.28Å; K194-P198 WeakPolarHBondContact CE-O 3.38Å; K194-P198 PolarHBondContact NZ-O 2.89Å; K194-P198 WeakPolarHBondContact O-CA 3.34Å
195	E	95.1	Very high	93.7	Very high	81 Å²	81	42.3 Å²	42.3	38%	0.379	24%	0.237	S	C	.	.	H	α-helix	trans	-66.3	-35.9	174.7	-70.1	169.1	-161.1	0	0	112	R160 K191 M192 A193	R160-E195 IonicContact CZ-OE2 3.18Å; R160-E195 IonicContact NE-OE2 2.7Å; R160-E195 IonicContact NH2-OE2 2.74Å; R160-E195 PolarHBondContact NH2-OE2 3.18Å; K191-E195 VanDerWaalsContact CE-OE1 3.29Å; K191-E195 WeakPolarHBondContact CE-OE1 3.42Å; K191-E195 PolarHBondContact O-N 3.1Å; M192-E195 WeakPolarHBondContact O-CB 3.23Å; M192-E195 PolarHBondContact O-N 2.88Å; A193-E195 VanDerWaalsContact C-N 3.34Å; A193-E195 PolarHBondContact O-N 3.42Å
196	V	95.7	Very high	94.2	Very high	31 Å²	31	38 Å²	38	19%	0.188	20%	0.202	C	C	.	.	H	α-helix	trans	-109.6	-13.3	-177	-56.7	0	0	0	0	115.4	L164 I167 I174 M192 A193 R202	L164-V196 HydrophobicContact CD2-CG1 3.73Å; I167-V196 HydrophobicContact CB-CG2 4.17Å; I167-V196 HydrophobicContact CD1-CG2 3.85Å; I167-V196 HydrophobicContact CG1-CG1 4.41Å; I167-V196 HydrophobicContact CG1-CG2 3.91Å; I167-V196 WeakPolarHBondContact O-CG2 3.43Å; I174-V196 HydrophobicContact CD1-CG2 3.55Å; M192-V196 PolarHBondContact O-N 3.39Å; A193-V196 PolarHBondContact O-N 3.42Å; V196-R202 PolarHBondContact O-NH2 3.31Å
197	D	95.7	Very high	94.6	Very high	11 Å²	11	34.2 Å²	34.2	6%	0.059	18%	0.178	C	C	.	.			trans	-136.4	69.8	174	177.5	19.7	0	0	0	109.7	I174 A193 A199 G200 Q201 R202 T203	I174-D197 HydrophobicContact CD1-CB 4.46Å; A193-D197 CarbonylContact O-C 3.57Å; A193-D197 WeakPolarHBondContact O-CA 3.44Å; A193-D197 WeakPolarHBondContact O-CB 3.31Å; A193-D197 PolarHBondContact O-N 3.22Å; D197-A199 PolarHBondContact O-N 2.92Å; D197-G200 PolarHBondContact O-N 2.69Å; D197-G200 WeakPolarHBondContact OD1-CA 3.46Å; D197-G200 PolarHBondContact OD1-N 2.82Å; D197-G200 VanDerWaalsContact OD2-CA 3.28Å; D197-G200 WeakPolarHBondContact OD2-CA 3.33Å; D197-Q201 VanDerWaalsContact CG-N 3.29Å; D197-Q201 PolarHBondContact OD1-N 3.33Å; D197-Q201 PolarHBondContact OD2-N 3.1Å; D197-R202 HydrophobicContact CB-CG 3.97Å; D197-R202 WeakPolarHBondContact OD2-CG 3.41Å; D197-R202 PolarHBondContact OD2-N 2.63Å; D197-T203 PolarHBondContact OD2-N 3.5Å; D197-T203 PolarHBondContact OD2-OG1 2.82Å
198	P	94.7	Very high	94.8	Very high	88 Å²	88	33.6 Å²	33.6	57%	0.571	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.5	-175.9	-25.2	35	0	0	0	114.1	K194	K194-P198 WeakPolarHBondContact CE-O 3.38Å; K194-P198 PolarHBondContact NZ-O 2.89Å; K194-P198 WeakPolarHBondContact O-CA 3.34Å
199	A	92	Very high	95	Very high	51 Å²	51	34.6 Å²	34.6	42%	0.421	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-2.4	179.8	0	0	0	0	0	114.1	D197 Q201	D197-A199 PolarHBondContact O-N 2.92Å; A199-Q201 VanDerWaalsContact C-N 3.27Å; A199-Q201 HydrophobicContact CB-CG 3.78Å; A199-Q201 PolarHBondContact O-N 2.83Å
200	G	92.8	Very high	95	Very high	2 Å²	2	34.8 Å²	34.8	2%	0.021	18%	0.177	C	C	.	.			trans	59.8	32.2	179.8	0	0	0	0	0	113.9	D197 R231	D197-G200 PolarHBondContact O-N 2.69Å; D197-G200 WeakPolarHBondContact OD1-CA 3.46Å; D197-G200 PolarHBondContact OD1-N 2.82Å; D197-G200 VanDerWaalsContact OD2-CA 3.28Å; D197-G200 WeakPolarHBondContact OD2-CA 3.33Å; G200-R231 VanDerWaalsContact O-CB 3.23Å; G200-R231 WeakPolarHBondContact O-CB 3.17Å; G200-R231 PolarHBondContact O-N 3.31Å
201	Q	92.6	Very high	94.9	Very high	123 Å²	123	37.5 Å²	37.5	58%	0.575	19%	0.192	S	C	*	.	S	Bend	trans	-81.6	-28.2	-174.5	-65.2	-175.5	28	0	0	113.8	D197 A199 R231 R232	D197-Q201 VanDerWaalsContact CG-N 3.29Å; D197-Q201 PolarHBondContact OD1-N 3.33Å; D197-Q201 PolarHBondContact OD2-N 3.1Å; A199-Q201 VanDerWaalsContact C-N 3.27Å; A199-Q201 HydrophobicContact CB-CG 3.78Å; A199-Q201 PolarHBondContact O-N 2.83Å; Q201-R231 HydrophobicContact CG-CG 4.34Å; Q201-R232 PolarHBondContact O-NE 3.17Å; Q201-R232 PolarHBondContact O-NH2 2.92Å
202	R	93.8	Very high	94.8	Very high	22 Å²	22	36.2 Å²	36.2	8%	0.083	19%	0.19	C	C	.	.	S	Bend	trans	-119.7	-5.3	-178.1	56.6	-173.2	-176	97.6	-1	113.2	I167 R169 E170 C172 L173 I174 V196 D197	I167-R202 VanDerWaalsContact O-CZ 3.29Å; I167-R202 PolarHBondContact O-NH1 2.81Å; I167-R202 PolarHBondContact O-NH2 2.93Å; R169-R202 PolarHBondContact O-NH1 3.15Å; E170-R202 WeakPolarHBondContact O-CD 3.34Å; C172-R202 WeakPolarHBondContact O-CD 3.2Å; C172-R202 PolarHBondContact O-NH1 2.77Å; L173-R202 WeakPolarHBondContact CA-O 3.35Å; L173-R202 HydrophobicContact CD2-CB 4.01Å; I174-R202 PolarHBondContact N-O 2.82Å; V196-R202 PolarHBondContact O-NH2 3.31Å; D197-R202 HydrophobicContact CB-CG 3.97Å; D197-R202 WeakPolarHBondContact OD2-CG 3.41Å; D197-R202 PolarHBondContact OD2-N 2.63Å
203	T	96.3	Very high	94.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	136.1	171.6	-51.7	0	0	0	0	112.3	I174 A176 A193 D197 L230	I174-T203 HydrophobicContact CB-CG2 4.4Å; I174-T203 HydrophobicContact CG2-CG2 4.46Å; I174-T203 CarbonylContact O-C 3.6Å; I174-T203 WeakPolarHBondContact O-CA 3.33Å; A176-T203 HydrophobicContact CB-CG2 3.95Å; A193-T203 HydrophobicContact CB-CG2 3.79Å; D197-T203 PolarHBondContact OD2-N 3.5Å; D197-T203 PolarHBondContact OD2-OG1 2.82Å; T203-L230 HydrophobicContact CG2-CD1 3.99Å; T203-L230 HydrophobicContact CG2-CD2 4.2Å
204	I	96.6	Very high	94.5	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.1	171.9	-56.7	173.6	0	0	0	106.9	I174 L175 A176 R232 L284 Q287	I174-I204 PolarHBondContact O-N 3.32Å; L175-I204 HydrophobicContact CD1-CB 3.89Å; L175-I204 HydrophobicContact CD1-CG2 3.85Å; A176-I204 PolarHBondContact N-O 2.88Å; I204-R232 HydrophobicContact CG1-CB 3.79Å; I204-R232 HydrophobicContact CG1-CG 4.27Å; I204-L284 HydrophobicContact CD1-CD2 3.63Å; I204-Q287 HydrophobicContact CD1-CG 4.49Å
205	G	96.9	Very high	94.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	135.7	175.8	0	0	0	0	0	111.9	G233 Y234 I235	G205-G233 PolarHBondContact N-O 3.24Å; G205-Y234 CarbonylContact O-C 3.58Å; G205-Y234 WeakPolarHBondContact O-CA 3.48Å; G205-I235 PolarHBondContact O-N 3.39Å
206	V	97.8	Very high	93.7	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.4	170	173.1	0	0	0	0	109.2	L175 A176 V177 T178 T208 I235 I237 L280	L175-V206 HydrophobicContact CD1-CG2 3.41Å; L175-V206 VanDerWaalsContact CD1-CG2 3.41Å; L175-V206 HydrophobicContact CD2-CG2 4.44Å; L175-V206 HydrophobicContact CG-CG2 3.94Å; A176-V206 PolarHBondContact O-N 3.05Å; V177-V206 WeakPolarHBondContact CA-O 3.27Å; V177-V206 HydrophobicContact CG1-CG1 4.45Å; V177-V206 HydrophobicContact CG2-CB 4.31Å; T178-V206 PolarHBondContact N-O 3.18Å; V206-T208 HydrophobicContact CG1-CG2 4.14Å; V206-I235 WeakPolarHBondContact CA-O 3.45Å; V206-I237 HydrophobicContact CG1-CD1 3.7Å; V206-I237 HydrophobicContact CG1-CG1 3.99Å; V206-L280 HydrophobicContact CG1-CD2 4.06Å; V206-L280 HydrophobicContact CG2-CD1 3.71Å; V206-L280 HydrophobicContact CG2-CD2 3.73Å; V206-L280 HydrophobicContact CG2-CG 4.4Å
207	I	97.3	Very high	93.5	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	114.6	-179.7	-55.3	-57.2	0	0	0	108.9	T178 A180 L184 L210 A219 I222 L223 Y234 I235 G236 I237	T178-I207 WeakPolarHBondContact O-CA 3.42Å; A180-I207 HydrophobicContact CB-CG2 3.64Å; L184-I207 HydrophobicContact CD1-CD1 4.04Å; I207-L210 HydrophobicContact CG2-CD1 4.36Å; I207-L210 HydrophobicContact CG2-CD2 3.81Å; I207-L210 HydrophobicContact CG2-CG 4.03Å; I207-A219 HydrophobicContact CG2-CB 4.47Å; I207-I222 HydrophobicContact CD1-CG2 3.74Å; I207-I222 HydrophobicContact CG1-CG2 3.87Å; I207-L223 HydrophobicContact CB-CD2 4.09Å; I207-L223 HydrophobicContact CG1-CD2 3.97Å; I207-Y234 HydrophobicContact CD1-CD1 3.79Å; I207-Y234 HydrophobicContact CD1-CE1 4.26Å; I207-Y234 HydrophobicContact CG1-CD1 3.95Å; I207-I235 PolarHBondContact N-O 3.28Å; I207-G236 WeakPolarHBondContact O-CA 3.19Å; I207-I237 PolarHBondContact O-N 3.29Å
208	T	96.5	Very high	93.4	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	169.3	-180	69.7	0	0	0	0	110.9	A44 V49 V177 T178 A180 V206 L210 I237	A44-T208 PolarHBondContact O-OG1 3.34Å; V49-T208 HydrophobicContact CG2-CG2 4.33Å; V177-T208 HydrophobicContact CG1-CG2 3.58Å; T178-T208 PolarHBondContact O-N 3.48Å; T178-T208 PolarHBondContact O-OG1 3.3Å; A180-T208 VanDerWaalsContact CB-O 3.3Å; A180-T208 WeakPolarHBondContact CB-O 3.41Å; A180-T208 PolarHBondContact N-O 2.99Å; V206-T208 HydrophobicContact CG1-CG2 4.14Å; T208-L210 VanDerWaalsContact C-N 3.28Å; T208-L210 PolarHBondContact O-N 3.49Å; T208-I237 HydrophobicContact CG2-CD1 4.09Å; T208-I237 HydrophobicContact CG2-CG1 4.05Å
209	K	94.9	Very high	93.3	Very high	63 Å²	63	49.2 Å²	49.2	27%	0.274	28%	0.278	S	S	.	.			trans	59.7	31.6	174.4	-50.3	-175.5	-163.2	169.6	0	114.8	S43 A179 D211 L212	S43-K209 VanDerWaalsContact O-CE 3.26Å; S43-K209 WeakPolarHBondContact O-CE 3.35Å; S43-K209 PolarHBondContact O-NZ 2.84Å; A179-K209 HydrophobicContact CB-CD 3.99Å; A179-K209 HydrophobicContact CB-CG 4.44Å; K209-D211 VanDerWaalsContact C-OD1 3.29Å; K209-D211 VanDerWaalsContact CA-OD1 3.24Å; K209-D211 WeakPolarHBondContact CA-OD1 3.07Å; K209-D211 PolarHBondContact O-N 3.35Å; K209-L212 HydrophobicContact CB-CB 4.27Å; K209-L212 HydrophobicContact CB-CD1 4.25Å; K209-L212 HydrophobicContact CB-CG 4.48Å; K209-L212 HydrophobicContact CD-CD1 4.28Å; K209-L212 HydrophobicContact CG-CD1 4.33Å; K209-L212 PolarHBondContact O-N 3.08Å
210	L	94.3	Very high	93.4	Very high	5 Å²	5	51.4 Å²	51.4	3%	0.026	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-63.7	-20.6	175.3	-72.3	159	0	0	0	112.6	A180 I207 T208 L212 M213 A219 L223 G236 V238 F261 F262 Y268	A180-L210 HydrophobicContact CB-CD2 3.66Å; A180-L210 HydrophobicContact CB-CG 3.99Å; I207-L210 HydrophobicContact CG2-CD1 4.36Å; I207-L210 HydrophobicContact CG2-CD2 3.81Å; I207-L210 HydrophobicContact CG2-CG 4.03Å; T208-L210 VanDerWaalsContact C-N 3.28Å; T208-L210 PolarHBondContact O-N 3.49Å; L210-L212 VanDerWaalsContact C-N 3.34Å; L210-M213 HydrophobicContact CD2-SD 4.06Å; L210-A219 HydrophobicContact CD2-CB 3.51Å; L210-L223 HydrophobicContact CD1-CD1 4.3Å; L210-L223 HydrophobicContact CD2-CD1 4.26Å; L210-G236 VanDerWaalsContact CD1-CA 3.44Å; L210-V238 HydrophobicContact CB-CG2 4.37Å; L210-F261 HydrophobicContact CB-CE1 3.86Å; L210-F261 HydrophobicContact CB-CZ 3.91Å; L210-F261 WeakPolarHBondContact O-CZ 3.33Å; L210-F262 HydrophobicContact CD1-CE1 3.9Å; L210-F262 HydrophobicContact CD1-CZ 3.78Å; L210-Y268 HydrophobicContact CD2-CE2 4.33Å
211	D	92.6	Very high	93.4	Very high	64 Å²	64	55.8 Å²	55.8	34%	0.342	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-78.1	-10.6	172.3	58.5	-57.3	0	0	0	114.3	K209 V238 F261	K209-D211 VanDerWaalsContact C-OD1 3.29Å; K209-D211 VanDerWaalsContact CA-OD1 3.24Å; K209-D211 WeakPolarHBondContact CA-OD1 3.07Å; K209-D211 PolarHBondContact O-N 3.35Å; D211-V238 HydrophobicContact CB-CG1 3.99Å; D211-F261 HydrophobicContact CB-CE2 4.39Å
212	L	92	Very high	93.5	Very high	99 Å²	99	50.8 Å²	50.8	52%	0.518	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-118.9	29.4	-178	-54.4	177.1	0	0	0	112.2	N181 K209 L210	N181-L212 VanDerWaalsContact CB-O 3.24Å; N181-L212 WeakPolarHBondContact CB-O 3.37Å; K209-L212 HydrophobicContact CB-CB 4.27Å; K209-L212 HydrophobicContact CB-CD1 4.25Å; K209-L212 HydrophobicContact CB-CG 4.48Å; K209-L212 HydrophobicContact CD-CD1 4.28Å; K209-L212 HydrophobicContact CG-CD1 4.33Å; K209-L212 PolarHBondContact O-N 3.08Å; L210-L212 VanDerWaalsContact C-N 3.34Å
213	M	92.2	Very high	93.6	Very high	41 Å²	41	50.3 Å²	50.3	20%	0.202	27%	0.272	C	S	.	.	S	Bend	trans	-85.6	151.7	171.9	-61.1	-167.3	70.9	0	0	111	A180 L210 D218 A219 Y268	A180-M213 HydrophobicContact CB-CE 4.4Å; A180-M213 HydrophobicContact CB-CG 3.8Å; A180-M213 HydrophobicContact CB-SD 3.67Å; L210-M213 HydrophobicContact CD2-SD 4.06Å; M213-D218 VanDerWaalsContact CE-C 3.41Å; M213-A219 HydrophobicContact CE-CB 4.19Å; M213-A219 HydrophobicContact SD-CB 3.93Å; M213-Y268 PolarHBondContact SD-OH 2.93Å
214	D	89.9	Confident	93.5	Very high	130 Å²	130	52.8 Å²	52.8	70%	0.695	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-67	142.5	178	-63.5	-48.5	0	0	0	111.4	G216 T217	D214-G216 PolarHBondContact O-N 3.26Å; D214-T217 HydrophobicContact CB-CG2 4.12Å; D214-T217 PolarHBondContact N-OG1 2.87Å; D214-T217 WeakPolarHBondContact O-CB 3.22Å; D214-T217 PolarHBondContact O-N 3.35Å; D214-T217 PolarHBondContact O-OG1 2.69Å
215	E	87	Confident	93.5	Very high	205 Å²	205	54.1 Å²	54.1	96%	0.958	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	128.3	-178.2	-67.2	-168.2	163.5	0	0	111.8
216	G	87.4	Confident	93.3	Very high	91 Å²	91	60 Å²	60	94%	0.938	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	-4.6	-174.8	0	0	0	0	0	114.9	D214	D214-G216 PolarHBondContact O-N 3.26Å
217	T	90.4	Very high	92.9	Very high	68 Å²	68	64.3 Å²	64.3	42%	0.417	34%	0.335	S	S	.	.			trans	-98.8	156	169.1	72.8	0	0	0	0	111.5	D214	D214-T217 HydrophobicContact CB-CG2 4.12Å; D214-T217 PolarHBondContact N-OG1 2.87Å; D214-T217 WeakPolarHBondContact O-CB 3.22Å; D214-T217 PolarHBondContact O-N 3.35Å; D214-T217 PolarHBondContact O-OG1 2.69Å
218	D	92.8	Very high	92.7	Very high	63 Å²	63	67.3 Å²	67.3	34%	0.337	35%	0.351	S	S	.	.			trans	-149.5	163.9	169.5	72.7	47.5	0	0	0	112	M213 R220 S267 Y268	M213-D218 VanDerWaalsContact CE-C 3.41Å; D218-R220 WeakPolarHBondContact OD1-CA 3.14Å; D218-R220 WeakPolarHBondContact OD1-CB 3.27Å; D218-R220 PolarHBondContact OD1-N 3.07Å; D218-S267 WeakPolarHBondContact OD2-CB 3.39Å; D218-S267 PolarHBondContact OD2-OG 2.81Å; D218-Y268 HydrophobicContact CB-CE1 4.13Å
219	A	94.3	Very high	92.5	Very high	2 Å²	2	70.5 Å²	70.5	2%	0.017	37%	0.372	C	S	.	.			trans	-95.8	19.6	176.7	0	0	0	0	0	112.5	A180 I207 L210 M213 E221 I222 L223 Y268	A180-A219 HydrophobicContact CB-CB 4.48Å; I207-A219 HydrophobicContact CG2-CB 4.47Å; L210-A219 HydrophobicContact CD2-CB 3.51Å; M213-A219 HydrophobicContact CE-CB 4.19Å; M213-A219 HydrophobicContact SD-CB 3.93Å; A219-E221 VanDerWaalsContact C-N 3.34Å; A219-E221 PolarHBondContact O-N 2.96Å; A219-I222 HydrophobicContact CB-CD1 4.17Å; A219-I222 WeakPolarHBondContact O-CA 3.14Å; A219-I222 VanDerWaalsContact O-CB 3.3Å; A219-I222 WeakPolarHBondContact O-CB 3.45Å; A219-I222 PolarHBondContact O-N 3.27Å; A219-L223 PolarHBondContact O-N 3.31Å; A219-Y268 PolarHBondContact N-OH 2.87Å
220	R	93.8	Very high	92.6	Very high	97 Å²	97	68.2 Å²	68.2	37%	0.366	36%	0.362	S	S	.	.	H	α-helix	trans	-62	-39.7	-169	-176.4	-174	167.5	177.4	2.3	112.4	D218 I222 L223 E224 Y268 M271	D218-R220 WeakPolarHBondContact OD1-CA 3.14Å; D218-R220 WeakPolarHBondContact OD1-CB 3.27Å; D218-R220 PolarHBondContact OD1-N 3.07Å; R220-I222 PolarHBondContact O-N 3.35Å; R220-L223 PolarHBondContact O-N 2.81Å; R220-E224 HydrophobicContact CG-CG 4.06Å; R220-E224 WeakPolarHBondContact CG-OE2 3.25Å; R220-E224 IonicContact CZ-OE1 2.85Å; R220-E224 IonicContact CZ-OE2 2.66Å; R220-E224 IonicContact NE-OE1 2.79Å; R220-E224 PolarHBondContact NE-OE1 3.44Å; R220-E224 IonicContact NE-OE2 3.75Å; R220-E224 PolarHBondContact NE-OE2 2.94Å; R220-E224 IonicContact NH2-OE1 3.2Å; R220-E224 PolarHBondContact NH2-OE1 2.85Å; R220-E224 IonicContact NH2-OE2 2.7Å; R220-E224 VanDerWaalsContact O-CB 3.26Å; R220-E224 WeakPolarHBondContact O-CB 3.43Å; R220-E224 WeakPolarHBondContact O-CG 3.45Å; R220-E224 PolarHBondContact O-N 3.36Å; R220-Y268 HydrophobicContact CB-CE1 4.46Å; R220-M271 HydrophobicContact CG-CE 3.98Å
221	E	92.9	Very high	92.5	Very high	94 Å²	94	75.5 Å²	75.5	44%	0.439	39%	0.389	S	S	.	.	H	α-helix	trans	-58.8	-29.9	175.2	-65.7	-97.4	98.5	0	0	112.8	A219 R226 L227	A219-E221 VanDerWaalsContact C-N 3.34Å; A219-E221 PolarHBondContact O-N 2.96Å; E221-R226 PolarHBondContact O-N 2.96Å; E221-R226 IonicContact OE1-CZ 3.22Å; E221-R226 IonicContact OE1-NE 3.84Å; E221-R226 PolarHBondContact OE1-NE 3.13Å; E221-R226 IonicContact OE1-NH2 3.63Å; E221-R226 PolarHBondContact OE1-NH2 3.08Å; E221-L227 HydrophobicContact CB-CB 4.44Å; E221-L227 PolarHBondContact O-N 2.73Å; E221-L227 VanDerWaalsContact O-N 3.17Å
222	I	94.5	Very high	92.6	Very high	18 Å²	18	74.8 Å²	74.8	9%	0.092	38%	0.382	C	S	.	.	H	α-helix	trans	-81.5	-50	179.6	-49.3	175.3	0	0	0	109.5	L184 I207 A219 R220 E224 N225 L227 Y234	L184-I222 HydrophobicContact CB-CD1 4.08Å; L184-I222 HydrophobicContact CD1-CD1 4.3Å; L184-I222 HydrophobicContact CD1-CG2 3.9Å; L184-I222 HydrophobicContact CD2-CD1 4.41Å; L184-I222 HydrophobicContact CD2-CG1 4.15Å; L184-I222 HydrophobicContact CD2-CG2 3.87Å; L184-I222 HydrophobicContact CG-CG2 4.49Å; I207-I222 HydrophobicContact CD1-CG2 3.74Å; I207-I222 HydrophobicContact CG1-CG2 3.87Å; A219-I222 HydrophobicContact CB-CD1 4.17Å; A219-I222 WeakPolarHBondContact O-CA 3.14Å; A219-I222 VanDerWaalsContact O-CB 3.3Å; A219-I222 WeakPolarHBondContact O-CB 3.45Å; A219-I222 PolarHBondContact O-N 3.27Å; R220-I222 PolarHBondContact O-N 3.35Å; I222-E224 PolarHBondContact O-N 2.87Å; I222-N225 WeakPolarHBondContact O-CA 3.41Å; I222-N225 PolarHBondContact O-N 3.21Å; I222-L227 HydrophobicContact CG1-CD2 4.04Å; I222-Y234 HydrophobicContact CG2-CD1 3.76Å; I222-Y234 HydrophobicContact CG2-CD2 4.32Å; I222-Y234 HydrophobicContact CG2-CE1 4.02Å; I222-Y234 HydrophobicContact CG2-CG 3.94Å; I222-Y234 VanDerWaalsContact O-CD2 3.23Å; I222-Y234 WeakPolarHBondContact O-CD2 3.21Å
223	L	95.5	Very high	92.7	Very high	13 Å²	13	70.7 Å²	70.7	7%	0.068	36%	0.363	C	S	.	.	H	α-helix	trans	-69.5	-29.8	-179.6	-61.2	-178.9	0	0	0	113.2	I207 L210 A219 R220 N225 Y268 M271 M275	I207-L223 HydrophobicContact CB-CD2 4.09Å; I207-L223 HydrophobicContact CG1-CD2 3.97Å; L210-L223 HydrophobicContact CD1-CD1 4.3Å; L210-L223 HydrophobicContact CD2-CD1 4.26Å; A219-L223 PolarHBondContact O-N 3.31Å; R220-L223 PolarHBondContact O-N 2.81Å; L223-N225 PolarHBondContact O-N 3.08Å; L223-Y268 HydrophobicContact CD1-CD1 3.92Å; L223-Y268 HydrophobicContact CD1-CE1 3.9Å; L223-M271 HydrophobicContact CB-CE 4.25Å; L223-M271 HydrophobicContact CB-SD 3.56Å; L223-M271 VanDerWaalsContact CB-SD 3.56Å; L223-M271 HydrophobicContact CD1-SD 3.97Å; L223-M271 HydrophobicContact CG-SD 4.43Å; L223-M275 HydrophobicContact CB-CE 4.06Å; L223-M275 HydrophobicContact CD1-SD 4.12Å; L223-M275 HydrophobicContact CD2-CE 4.33Å; L223-M275 HydrophobicContact CD2-SD 4.03Å; L223-M275 HydrophobicContact CG-SD 4.47Å
224	E	95.1	Very high	93	Very high	52 Å²	52	69.1 Å²	69.1	24%	0.243	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	7.5	168.2	-64.8	180	150	0	0	112.6	R220 I222 R226 H270 M271	R220-E224 HydrophobicContact CG-CG 4.06Å; R220-E224 WeakPolarHBondContact CG-OE2 3.25Å; R220-E224 IonicContact CZ-OE1 2.85Å; R220-E224 IonicContact CZ-OE2 2.66Å; R220-E224 IonicContact NE-OE1 2.79Å; R220-E224 PolarHBondContact NE-OE1 3.44Å; R220-E224 IonicContact NE-OE2 3.75Å; R220-E224 PolarHBondContact NE-OE2 2.94Å; R220-E224 IonicContact NH2-OE1 3.2Å; R220-E224 PolarHBondContact NH2-OE1 2.85Å; R220-E224 IonicContact NH2-OE2 2.7Å; R220-E224 VanDerWaalsContact O-CB 3.26Å; R220-E224 WeakPolarHBondContact O-CB 3.43Å; R220-E224 WeakPolarHBondContact O-CG 3.45Å; R220-E224 PolarHBondContact O-N 3.36Å; I222-E224 PolarHBondContact O-N 2.87Å; E224-R226 PolarHBondContact O-N 3.17Å; E224-R226 IonicContact OE2-CZ 3.15Å; E224-R226 IonicContact OE2-NH1 2.78Å; E224-R226 PolarHBondContact OE2-NH1 2.88Å; E224-R226 IonicContact OE2-NH2 3.28Å; E224-R226 PolarHBondContact OE2-NH2 3.31Å; E224-H270 IonicContact OE1-CD2 2.68Å; E224-H270 IonicContact OE1-CE1 2.91Å; E224-H270 IonicContact OE1-NE2 3.23Å; E224-H270 PolarHBondContact OE1-NE2 3.02Å; E224-M271 HydrophobicContact CG-CE 3.58Å
225	N	94.9	Very high	93.3	Very high	30 Å²	30	63.3 Å²	63.3	16%	0.16	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	28.8	173.7	-161.6	41.2	0	0	0	114.1	I222 L223 P229 L230 Y234	I222-N225 WeakPolarHBondContact O-CA 3.41Å; I222-N225 PolarHBondContact O-N 3.21Å; L223-N225 PolarHBondContact O-N 3.08Å; N225-P229 WeakPolarHBondContact OD1-CA 3.2Å; N225-L230 PolarHBondContact ND2-O 3.41Å; N225-L230 PolarHBondContact OD1-N 3.07Å; N225-Y234 WeakPolarHBondContact OD1-CD2 3.35Å; N225-Y234 WeakPolarHBondContact OD1-CE2 3.49Å
226	R	93.3	Very high	93.8	Very high	123 Å²	123	53.5 Å²	53.5	46%	0.464	28%	0.278	S	S	.	.			trans	-86	-45.6	178.9	-75.9	-159.6	-68.6	-78.1	-4.2	113.1	E221 E224	E221-R226 PolarHBondContact O-N 2.96Å; E221-R226 IonicContact OE1-CZ 3.22Å; E221-R226 IonicContact OE1-NE 3.84Å; E221-R226 PolarHBondContact OE1-NE 3.13Å; E221-R226 IonicContact OE1-NH2 3.63Å; E221-R226 PolarHBondContact OE1-NH2 3.08Å; E224-R226 PolarHBondContact O-N 3.17Å; E224-R226 IonicContact OE2-CZ 3.15Å; E224-R226 IonicContact OE2-NH1 2.78Å; E224-R226 PolarHBondContact OE2-NH1 2.88Å; E224-R226 IonicContact OE2-NH2 3.28Å; E224-R226 PolarHBondContact OE2-NH2 3.31Å
227	L	89.9	Confident	94.3	Very high	91 Å²	91	49.2 Å²	49.2	48%	0.476	23%	0.234	S	C	.	.	S	Bend	trans	-67	-48.5	-166.7	-174.3	60.9	0	0	0	113.3	L184 E221 I222	L184-L227 HydrophobicContact CB-CD2 4.06Å; L184-L227 HydrophobicContact CD2-CB 4.35Å; L184-L227 HydrophobicContact CD2-CD2 3.91Å; L184-L227 HydrophobicContact CD2-CG 4.22Å; E221-L227 HydrophobicContact CB-CB 4.44Å; E221-L227 PolarHBondContact O-N 2.73Å; E221-L227 VanDerWaalsContact O-N 3.17Å; I222-L227 HydrophobicContact CG1-CD2 4.04Å
228	L	91.8	Very high	94.6	Very high	64 Å²	64	47 Å²	47	34%	0.335	22%	0.22	S	C	.	.	S	Bend	trans	-137.1	84.1	175	-176.9	69.6	0	0	0	109.8	L184 L190 L230 Y234	L184-L228 HydrophobicContact CD2-CB 3.9Å; L190-L228 HydrophobicContact CB-CD2 4.24Å; L190-L228 HydrophobicContact CD1-CD2 4.22Å; L228-L230 PolarHBondContact O-N 3.45Å; L228-Y234 VanDerWaalsContact O-CE2 3.26Å; L228-Y234 WeakPolarHBondContact O-CE2 3.45Å; L228-Y234 PolarHBondContact O-OH 3.12Å
229	P	94	Very high	94.6	Very high	67 Å²	67	45.2 Å²	45.2	44%	0.435	21%	0.211	S	C	.	.			trans	-62	121.2	-167.8	-25.4	34.3	0	0	0	114.4	N225	N225-P229 WeakPolarHBondContact OD1-CA 3.2Å
230	L	95.5	Very high	94.6	Very high	15 Å²	15	46.7 Å²	46.7	8%	0.079	22%	0.216	C	C	.	.			trans	-102.8	147.1	169.2	-61.7	179.2	0	0	0	110.2	L190 T203 N225 L228 R232 G233 Y234	L190-L230 HydrophobicContact CD2-CD1 4.16Å; T203-L230 HydrophobicContact CG2-CD1 3.99Å; T203-L230 HydrophobicContact CG2-CD2 4.2Å; N225-L230 PolarHBondContact ND2-O 3.41Å; N225-L230 PolarHBondContact OD1-N 3.07Å; L228-L230 PolarHBondContact O-N 3.45Å; L230-R232 PolarHBondContact O-N 2.98Å; L230-G233 PolarHBondContact O-N 3.48Å; L230-Y234 HydrophobicContact CB-CE2 4.37Å; L230-Y234 HydrophobicContact CD1-CD2 4.47Å; L230-Y234 HydrophobicContact CD1-CE1 3.97Å; L230-Y234 HydrophobicContact CD1-CE2 3.85Å; L230-Y234 HydrophobicContact CG-CE2 3.83Å
231	R	93.5	Very high	94.4	Very high	158 Å²	158	44.2 Å²	44.2	60%	0.596	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-25.7	178.3	-69.4	-67.7	-169	168.8	1.2	113.2	G200 Q201	G200-R231 VanDerWaalsContact O-CB 3.23Å; G200-R231 WeakPolarHBondContact O-CB 3.17Å; G200-R231 PolarHBondContact O-N 3.31Å; Q201-R231 HydrophobicContact CG-CG 4.34Å
232	R	93.7	Very high	94.1	Very high	50 Å²	50	44.5 Å²	44.5	19%	0.189	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	1.7	178.3	-54.1	-177.5	-174.8	-113.7	0.9	113.2	Q201 I204 L230	Q201-R232 PolarHBondContact O-NE 3.17Å; Q201-R232 PolarHBondContact O-NH2 2.92Å; I204-R232 HydrophobicContact CG1-CB 3.79Å; I204-R232 HydrophobicContact CG1-CG 4.27Å; L230-R232 PolarHBondContact O-N 2.98Å
233	G	94.9	Very high	93.9	Very high	12 Å²	12	52 Å²	52	12%	0.124	25%	0.247	C	C	.	.			trans	70	-166.2	178.1	0	0	0	0	0	115	G205 L230	G205-G233 PolarHBondContact N-O 3.24Å; L230-G233 PolarHBondContact O-N 3.48Å
234	Y	97.3	Very high	93.7	Very high	9 Å²	9	53.3 Å²	53.3	4%	0.035	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144.6	175.3	-68.6	-96.6	0	0	0	110.1	L184 L190 G205 I207 I222 N225 L228 L230	L184-Y234 HydrophobicContact CD1-CE1 4.18Å; L190-Y234 HydrophobicContact CD1-CE1 4.14Å; L190-Y234 HydrophobicContact CD2-CE1 4.35Å; G205-Y234 CarbonylContact O-C 3.58Å; G205-Y234 WeakPolarHBondContact O-CA 3.48Å; I207-Y234 HydrophobicContact CD1-CD1 3.79Å; I207-Y234 HydrophobicContact CD1-CE1 4.26Å; I207-Y234 HydrophobicContact CG1-CD1 3.95Å; I222-Y234 HydrophobicContact CG2-CD1 3.76Å; I222-Y234 HydrophobicContact CG2-CD2 4.32Å; I222-Y234 HydrophobicContact CG2-CE1 4.02Å; I222-Y234 HydrophobicContact CG2-CG 3.94Å; I222-Y234 VanDerWaalsContact O-CD2 3.23Å; I222-Y234 WeakPolarHBondContact O-CD2 3.21Å; N225-Y234 WeakPolarHBondContact OD1-CD2 3.35Å; N225-Y234 WeakPolarHBondContact OD1-CE2 3.49Å; L228-Y234 VanDerWaalsContact O-CE2 3.26Å; L228-Y234 WeakPolarHBondContact O-CE2 3.45Å; L228-Y234 PolarHBondContact O-OH 3.12Å; L230-Y234 HydrophobicContact CB-CE2 4.37Å; L230-Y234 HydrophobicContact CD1-CD2 4.47Å; L230-Y234 HydrophobicContact CD1-CE1 3.97Å; L230-Y234 HydrophobicContact CD1-CE2 3.85Å; L230-Y234 HydrophobicContact CG-CE2 3.83Å
235	I	97.9	Very high	93.3	Very high	7 Å²	7	52 Å²	52	4%	0.036	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122	173.9	-58.6	171.8	0	0	0	108.4	G205 V206 I207 I237 F279 L280 V283	G205-I235 PolarHBondContact O-N 3.39Å; V206-I235 WeakPolarHBondContact CA-O 3.45Å; I207-I235 PolarHBondContact N-O 3.28Å; I235-I237 HydrophobicContact CG2-CG2 4.44Å; I235-F279 HydrophobicContact CD1-CD1 3.9Å; I235-F279 HydrophobicContact CD1-CE1 3.79Å; I235-F279 HydrophobicContact CG1-CD1 4.24Å; I235-F279 HydrophobicContact CG1-CE1 4.1Å; I235-F279 HydrophobicContact CG2-CD1 4.05Å; I235-L280 HydrophobicContact CB-CD1 4.18Å; I235-L280 HydrophobicContact CD1-CD1 3.76Å; I235-L280 HydrophobicContact CG2-CB 3.99Å; I235-L280 HydrophobicContact CG2-CD1 4.34Å; I235-V283 HydrophobicContact CD1-CB 4Å; I235-V283 HydrophobicContact CD1-CG1 4Å; I235-V283 HydrophobicContact CD1-CG2 4.04Å
236	G	97.4	Very high	92.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	139.9	174.1	0	0	0	0	0	111.4	I207 L210 F262 M275 G276	I207-G236 WeakPolarHBondContact O-CA 3.19Å; L210-G236 VanDerWaalsContact CD1-CA 3.44Å; G236-F262 WeakPolarHBondContact O-CZ 3.4Å; G236-M275 PolarHBondContact N-SD 3.09Å; G236-G276 PolarHBondContact O-N 2.99Å
237	I	97.1	Very high	92.7	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.277	C	S	.	.			trans	-137.7	154.4	175.7	64.5	176.1	0	0	0	111.3	V49 V206 I207 T208 I235 E258 L280	V49-I237 HydrophobicContact CB-CD1 4.18Å; V49-I237 HydrophobicContact CG1-CD1 3.7Å; V49-I237 HydrophobicContact CG2-CD1 3.64Å; V206-I237 HydrophobicContact CG1-CD1 3.7Å; V206-I237 HydrophobicContact CG1-CG1 3.99Å; I207-I237 PolarHBondContact O-N 3.29Å; T208-I237 HydrophobicContact CG2-CD1 4.09Å; T208-I237 HydrophobicContact CG2-CG1 4.05Å; I235-I237 HydrophobicContact CG2-CG2 4.44Å; I237-E258 WeakPolarHBondContact CA-OE1 3.4Å; I237-E258 WeakPolarHBondContact CB-OE1 3.34Å; I237-L280 HydrophobicContact CD1-CD2 4.18Å; I237-L280 HydrophobicContact CG2-CB 4.26Å; I237-L280 HydrophobicContact CG2-CD2 3.87Å
238	V	95.8	Very high	92.5	Very high	22 Å²	22	56.9 Å²	56.9	13%	0.133	29%	0.29	C	S	.	.			trans	-124.2	102	175.3	-179.1	0	0	0	0	108.6	L210 D211 E258 F261 F262	L210-V238 HydrophobicContact CB-CG2 4.37Å; D211-V238 HydrophobicContact CB-CG1 3.99Å; V238-E258 HydrophobicContact CB-CB 4.17Å; V238-E258 HydrophobicContact CB-CG 3.99Å; V238-E258 PolarHBondContact N-OE1 2.92Å; V238-F261 HydrophobicContact CG2-CD1 3.6Å; V238-F261 HydrophobicContact CG2-CE1 3.83Å; V238-F261 HydrophobicContact CG2-CG 4.13Å; V238-F262 HydrophobicContact CG2-CE2 4.23Å; V238-F262 HydrophobicContact CG2-CZ 4.25Å
239	N	93.9	Very high	92.4	Very high	25 Å²	25	56.8 Å²	56.8	13%	0.134	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-77.9	164.4	178.7	-68.3	-34.4	0	0	0	111.2	S241	N239-S241 PolarHBondContact O-N 3.12Å
240	R	93	Very high	92.2	Very high	34 Å²	34	57.8 Å²	57.8	13%	0.128	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-59.2	131.4	167.6	-72	-175.7	-65.6	152	12.5	110.2	D57 D244 I245 K249 A254	D57-R240 IonicContact OD1-CZ 2.86Å; D57-R240 IonicContact OD1-NH2 2.73Å; D57-R240 PolarHBondContact OD1-NH2 3.45Å; D57-R240 IonicContact OD2-CZ 2.96Å; D57-R240 VanDerWaalsContact OD2-CZ 3.28Å; D57-R240 IonicContact OD2-NH1 3.78Å; D57-R240 PolarHBondContact OD2-NH1 3.05Å; D57-R240 IonicContact OD2-NH2 3.15Å; D57-R240 PolarHBondContact OD2-NH2 3.24Å; R240-D244 HydrophobicContact CB-CB 3.86Å; R240-D244 HydrophobicContact CG-CB 4.22Å; R240-I245 HydrophobicContact CB-CD1 4.45Å; R240-I245 HydrophobicContact CB-CG1 3.98Å; R240-K249 WeakPolarHBondContact CD-O 3.21Å; R240-K249 PolarHBondContact NH1-O 2.88Å; R240-K249 VanDerWaalsContact NH1-O 3.11Å; R240-A254 HydrophobicContact CG-CB 3.44Å; R240-A254 VanDerWaalsContact CG-CB 3.44Å
241	S	90	Very high	91.8	Very high	44 Å²	44	58.4 Å²	58.4	31%	0.308	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-69.4	165	171.4	67.3	0	0	0	0	111.2	N239 K243 D244 I245	N239-S241 PolarHBondContact O-N 3.12Å; S241-K243 PolarHBondContact O-N 3.47Å; S241-D244 WeakPolarHBondContact CB-OD2 3.36Å; S241-D244 PolarHBondContact N-OD2 2.91Å; S241-D244 WeakPolarHBondContact O-CA 3.31Å; S241-D244 WeakPolarHBondContact O-CB 3.37Å; S241-D244 PolarHBondContact O-N 3.11Å; S241-D244 PolarHBondContact OG-N 3.14Å; S241-D244 PolarHBondContact OG-OD2 3.02Å; S241-I245 WeakPolarHBondContact O-CG1 3.44Å; S241-I245 PolarHBondContact O-N 2.95Å
242	Q	87.1	Confident	91.6	Very high	100 Å²	100	58.4 Å²	58.4	47%	0.467	29%	0.292	S	S	.	.	H	α-helix	trans	-57.6	-40.4	176.3	-170.4	60.4	50.4	0	0	111.5	D244 I245 D246	Q242-D244 VanDerWaalsContact C-N 3.31Å; Q242-D244 PolarHBondContact O-N 2.85Å; Q242-I245 WeakPolarHBondContact O-CB 3.49Å; Q242-I245 PolarHBondContact O-N 2.98Å; Q242-I245 VanDerWaalsContact O-N 3.1Å; Q242-D246 PolarHBondContact NE2-OD1 3.17Å; Q242-D246 PolarHBondContact O-N 3.25Å
243	K	90.2	Very high	91.5	Very high	177 Å²	177	58 Å²	58	77%	0.77	30%	0.299	S	S	*	.	H	α-helix	trans	-61.2	-36.3	174.3	-177.1	179.1	177.9	-178.8	0	113.1	S241 G247	S241-K243 PolarHBondContact O-N 3.47Å; K243-G247 PolarHBondContact O-N 3.27Å
244	D	91	Very high	91.4	Very high	40 Å²	40	58 Å²	58	21%	0.214	30%	0.298	C	S	.	.	H	α-helix	trans	-68.4	-37	174.4	-66.2	-48.8	0	0	0	111.8	R240 S241 Q242 K248 K249	R240-D244 HydrophobicContact CB-CB 3.86Å; R240-D244 HydrophobicContact CG-CB 4.22Å; S241-D244 WeakPolarHBondContact CB-OD2 3.36Å; S241-D244 PolarHBondContact N-OD2 2.91Å; S241-D244 WeakPolarHBondContact O-CA 3.31Å; S241-D244 WeakPolarHBondContact O-CB 3.37Å; S241-D244 PolarHBondContact O-N 3.11Å; S241-D244 PolarHBondContact OG-N 3.14Å; S241-D244 PolarHBondContact OG-OD2 3.02Å; Q242-D244 VanDerWaalsContact C-N 3.31Å; Q242-D244 PolarHBondContact O-N 2.85Å; D244-K248 PolarHBondContact O-N 2.9Å; D244-K249 HydrophobicContact CB-CB 3.98Å; D244-K249 HydrophobicContact CB-CD 3.58Å; D244-K249 HydrophobicContact CB-CG 4.49Å; D244-K249 VanDerWaalsContact CG-CD 3.41Å; D244-K249 WeakPolarHBondContact O-CB 3.39Å; D244-K249 PolarHBondContact O-N 3.14Å; D244-K249 WeakPolarHBondContact OD1-CD 3.37Å; D244-K249 WeakPolarHBondContact OD1-CE 3.42Å; D244-K249 IonicContact OD1-NZ 2.74Å; D244-K249 PolarHBondContact OD1-NZ 3.07Å; D244-K249 IonicContact OD2-NZ 3.25Å; D244-K249 PolarHBondContact OD2-NZ 3.26Å
245	I	86.8	Confident	91.1	Very high	23 Å²	23	59.9 Å²	59.9	12%	0.118	31%	0.308	C	S	.	.	H	α-helix	trans	-69.8	-49.8	178	-68	157.2	0	0	0	110.4	R240 S241 Q242 G247 K248	R240-I245 HydrophobicContact CB-CD1 4.45Å; R240-I245 HydrophobicContact CB-CG1 3.98Å; S241-I245 WeakPolarHBondContact O-CG1 3.44Å; S241-I245 PolarHBondContact O-N 2.95Å; Q242-I245 WeakPolarHBondContact O-CB 3.49Å; Q242-I245 PolarHBondContact O-N 2.98Å; Q242-I245 VanDerWaalsContact O-N 3.1Å; I245-G247 VanDerWaalsContact C-N 3.27Å; I245-G247 PolarHBondContact O-N 3.06Å; I245-K248 WeakPolarHBondContact O-CA 3.14Å; I245-K248 PolarHBondContact O-N 3.4Å
246	D	87.5	Confident	90.9	Very high	113 Å²	113	66.2 Å²	66.2	60%	0.604	34%	0.338	S	S	*	.	H	α-helix	trans	-60.5	-39.5	177.8	-58.5	-24.1	0	0	0	111.1	Q242 K248	Q242-D246 PolarHBondContact NE2-OD1 3.17Å; Q242-D246 PolarHBondContact O-N 3.25Å; D246-K248 PolarHBondContact O-N 3.34Å
247	G	88.8	Confident	90.8	Very high	62 Å²	62	68.2 Å²	68.2	64%	0.639	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	5.6	172.9	0	0	0	0	0	115.2	K243 I245 K249	K243-G247 PolarHBondContact O-N 3.27Å; I245-G247 VanDerWaalsContact C-N 3.27Å; I245-G247 PolarHBondContact O-N 3.06Å; G247-K249 VanDerWaalsContact C-N 3.25Å; G247-K249 PolarHBondContact O-N 3.16Å
248	K	86.2	Confident	90.7	Very high	172 Å²	172	68.3 Å²	68.3	75%	0.748	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	40.9	-178.2	-60	-163.5	176.6	-163.6	0	114.4	D244 I245 D246 D250	D244-K248 PolarHBondContact O-N 2.9Å; I245-K248 WeakPolarHBondContact O-CA 3.14Å; I245-K248 PolarHBondContact O-N 3.4Å; D246-K248 PolarHBondContact O-N 3.34Å; K248-D250 PolarHBondContact O-N 2.85Å
249	K	89.4	Confident	90.7	Very high	63 Å²	63	72.2 Å²	72.2	27%	0.274	37%	0.367	S	S	.	.			trans	-57.9	125.3	175.1	-176.1	-178.1	-171.4	176.1	0	110.2	R240 D244 G247 A253	R240-K249 WeakPolarHBondContact CD-O 3.21Å; R240-K249 PolarHBondContact NH1-O 2.88Å; R240-K249 VanDerWaalsContact NH1-O 3.11Å; D244-K249 HydrophobicContact CB-CB 3.98Å; D244-K249 HydrophobicContact CB-CD 3.58Å; D244-K249 HydrophobicContact CB-CG 4.49Å; D244-K249 VanDerWaalsContact CG-CD 3.41Å; D244-K249 WeakPolarHBondContact O-CB 3.39Å; D244-K249 PolarHBondContact O-N 3.14Å; D244-K249 WeakPolarHBondContact OD1-CD 3.37Å; D244-K249 WeakPolarHBondContact OD1-CE 3.42Å; D244-K249 IonicContact OD1-NZ 2.74Å; D244-K249 PolarHBondContact OD1-NZ 3.07Å; D244-K249 IonicContact OD2-NZ 3.25Å; D244-K249 PolarHBondContact OD2-NZ 3.26Å; G247-K249 VanDerWaalsContact C-N 3.25Å; G247-K249 PolarHBondContact O-N 3.16Å; K249-A253 HydrophobicContact CG-CB 4.47Å
250	D	89	Confident	90.8	Very high	87 Å²	87	80.2 Å²	80.2	47%	0.465	40%	0.395	S	S	.	.			trans	-57.5	145.4	176.8	174.3	48.5	0	0	0	111.8	K248 R252 A253 A254	K248-D250 PolarHBondContact O-N 2.85Å; D250-R252 VanDerWaalsContact C-N 3.31Å; D250-R252 PolarHBondContact O-N 2.91Å; D250-R252 WeakPolarHBondContact OD2-CB 3.49Å; D250-R252 PolarHBondContact OD2-N 3.44Å; D250-A253 HydrophobicContact CB-CB 4.42Å; D250-A253 PolarHBondContact O-N 2.81Å; D250-A253 PolarHBondContact OD2-N 3.06Å; D250-A254 PolarHBondContact O-N 3.41Å
251	I	87.4	Confident	91	Very high	29 Å²	29	80.4 Å²	80.4	15%	0.149	40%	0.397	C	S	.	.	H	α-helix	trans	-64.4	-35.1	-179.7	-172.7	68.9	0	0	0	111.7	A254 L255	I251-A254 WeakPolarHBondContact O-CB 3.39Å; I251-A254 PolarHBondContact O-N 3Å; I251-A254 VanDerWaalsContact O-N 3.14Å; I251-L255 HydrophobicContact CG1-CD1 4.16Å; I251-L255 HydrophobicContact CG1-CG 4.28Å; I251-L255 WeakPolarHBondContact O-CG 3.46Å; I251-L255 PolarHBondContact O-N 3.34Å
252	R	89.3	Confident	91.3	Very high	158 Å²	158	78.4 Å²	78.4	60%	0.596	38%	0.383	S	S	*	.	H	α-helix	trans	-67.6	-44.8	179.9	-52.9	177	171.5	169.4	-2.2	110.2	D250 A254 L255 E256	D250-R252 VanDerWaalsContact C-N 3.31Å; D250-R252 PolarHBondContact O-N 2.91Å; D250-R252 WeakPolarHBondContact OD2-CB 3.49Å; D250-R252 PolarHBondContact OD2-N 3.44Å; R252-A254 PolarHBondContact O-N 3.05Å; R252-L255 PolarHBondContact O-N 2.93Å; R252-E256 WeakPolarHBondContact O-CB 3.41Å; R252-E256 WeakPolarHBondContact O-CG 3.43Å; R252-E256 PolarHBondContact O-N 3.17Å
253	A	92.3	Very high	91.7	Very high	42 Å²	42	77.2 Å²	77.2	35%	0.347	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-29.2	171.9	0	0	0	0	0	113.3	K249 D250 A257	K249-A253 HydrophobicContact CG-CB 4.47Å; D250-A253 HydrophobicContact CB-CB 4.42Å; D250-A253 PolarHBondContact O-N 2.81Å; D250-A253 PolarHBondContact OD2-N 3.06Å; A253-A257 WeakPolarHBondContact O-CB 3.35Å; A253-A257 PolarHBondContact O-N 3.01Å; A253-A257 VanDerWaalsContact O-N 3.13Å
254	A	91.4	Very high	91.9	Very high	10 Å²	10	72.5 Å²	72.5	8%	0.083	37%	0.369	C	S	.	.	H	α-helix	trans	-73.7	-44.1	172.7	0	0	0	0	0	112.8	R240 D250 I251 R252 A257 E258	R240-A254 HydrophobicContact CG-CB 3.44Å; R240-A254 VanDerWaalsContact CG-CB 3.44Å; D250-A254 PolarHBondContact O-N 3.41Å; I251-A254 WeakPolarHBondContact O-CB 3.39Å; I251-A254 PolarHBondContact O-N 3Å; I251-A254 VanDerWaalsContact O-N 3.14Å; R252-A254 PolarHBondContact O-N 3.05Å; A254-A257 WeakPolarHBondContact O-CB 3.45Å; A254-A257 PolarHBondContact O-N 3.12Å; A254-E258 PolarHBondContact O-N 2.94Å
255	L	92.7	Very high	92.1	Very high	50 Å²	50	72.9 Å²	72.9	26%	0.262	37%	0.369	S	S	.	.	H	α-helix	trans	-66	-36.2	176.1	-66.2	173.3	0	0	0	112	I251 R252 R259 T277 P278	I251-L255 HydrophobicContact CG1-CD1 4.16Å; I251-L255 HydrophobicContact CG1-CG 4.28Å; I251-L255 WeakPolarHBondContact O-CG 3.46Å; I251-L255 PolarHBondContact O-N 3.34Å; R252-L255 PolarHBondContact O-N 2.93Å; L255-R259 VanDerWaalsContact O-CB 3.26Å; L255-R259 WeakPolarHBondContact O-CB 3.24Å; L255-R259 PolarHBondContact O-N 3.36Å; L255-T277 HydrophobicContact CD2-CG2 4.21Å; L255-P278 HydrophobicContact CD2-CG 4Å
256	E	93.7	Very high	92.3	Very high	139 Å²	139	77.1 Å²	77.1	65%	0.65	40%	0.398	S	S	*	.	H	α-helix	trans	-65.2	-39.5	171	-74.5	174.5	-163.2	0	0	111.9	R252 R260	R252-E256 WeakPolarHBondContact O-CB 3.41Å; R252-E256 WeakPolarHBondContact O-CG 3.43Å; R252-E256 PolarHBondContact O-N 3.17Å; E256-R260 VanDerWaalsContact O-CB 3.22Å; E256-R260 WeakPolarHBondContact O-CB 3.46Å; E256-R260 PolarHBondContact O-N 3.45Å
257	A	94.3	Very high	92.6	Very high	42 Å²	42	72.8 Å²	72.8	35%	0.347	38%	0.377	S	S	.	.	H	α-helix	trans	-66.9	-42.7	174.8	0	0	0	0	0	112.4	A253 A254 R260 F261	A253-A257 WeakPolarHBondContact O-CB 3.35Å; A253-A257 PolarHBondContact O-N 3.01Å; A253-A257 VanDerWaalsContact O-N 3.13Å; A254-A257 WeakPolarHBondContact O-CB 3.45Å; A254-A257 PolarHBondContact O-N 3.12Å; A257-R260 PolarHBondContact O-N 2.83Å; A257-F261 WeakPolarHBondContact O-CB 3.22Å; A257-F261 PolarHBondContact O-N 3.49Å
258	E	96.1	Very high	92.9	Very high	3 Å²	3	69.9 Å²	69.9	1%	0.014	35%	0.346	C	S	.	.	H	α-helix	trans	-58.8	-49.7	172.5	177	-175.2	-120.8	0	0	111.1	I237 V238 A254 R260 F261 F262 G276 T277 P278	I237-E258 WeakPolarHBondContact CA-OE1 3.4Å; I237-E258 WeakPolarHBondContact CB-OE1 3.34Å; V238-E258 HydrophobicContact CB-CB 4.17Å; V238-E258 HydrophobicContact CB-CG 3.99Å; V238-E258 PolarHBondContact N-OE1 2.92Å; A254-E258 PolarHBondContact O-N 2.94Å; E258-R260 VanDerWaalsContact C-N 3.31Å; E258-R260 PolarHBondContact O-N 2.89Å; E258-F261 WeakPolarHBondContact O-CB 3.47Å; E258-F261 PolarHBondContact O-N 3.32Å; E258-F262 HydrophobicContact CG-CD2 3.98Å; E258-F262 HydrophobicContact CG-CE2 3.71Å; E258-F262 VanDerWaalsContact O-CD2 3.24Å; E258-F262 WeakPolarHBondContact O-CD2 3.31Å; E258-F262 PolarHBondContact O-N 2.92Å; E258-F262 VanDerWaalsContact O-N 3.11Å; E258-G276 WeakPolarHBondContact OE1-CA 3.4Å; E258-G276 VanDerWaalsContact OE2-CA 3.3Å; E258-G276 WeakPolarHBondContact OE2-CA 3.41Å; E258-T277 PolarHBondContact OE1-N 2.65Å; E258-T277 PolarHBondContact OE1-OG1 3.29Å; E258-T277 PolarHBondContact OE2-N 2.87Å; E258-P278 WeakPolarHBondContact OE2-CD 3.27Å
259	R	95.4	Very high	93.3	Very high	104 Å²	104	70 Å²	70	39%	0.392	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-39.6	177.8	-177.9	58.5	172.4	169.1	2.8	111.8	L255 L263 A272 D273	L255-R259 VanDerWaalsContact O-CB 3.26Å; L255-R259 WeakPolarHBondContact O-CB 3.24Å; L255-R259 PolarHBondContact O-N 3.36Å; R259-L263 HydrophobicContact CG-CD1 4.08Å; R259-L263 WeakPolarHBondContact O-CB 3.31Å; R259-L263 VanDerWaalsContact O-CG 3.28Å; R259-L263 WeakPolarHBondContact O-CG 3.44Å; R259-L263 PolarHBondContact O-N 3.37Å; R259-L263 VanDerWaalsContact O-N 3.16Å; R259-A272 VanDerWaalsContact NH1-C 3.34Å; R259-A272 PolarHBondContact NH1-O 2.76Å; R259-D273 IonicContact CZ-OD1 2.74Å; R259-D273 IonicContact NH1-OD1 3.83Å; R259-D273 PolarHBondContact NH1-OD1 3.48Å; R259-D273 IonicContact NH2-OD1 2.99Å; R259-D273 PolarHBondContact NH2-OD1 3.2Å
260	R	96.1	Very high	93.6	Very high	192 Å²	192	71.8 Å²	71.8	73%	0.725	35%	0.351	S	S	*	.	H	α-helix	trans	-65.1	-44.9	174.9	-176.1	173.9	179.8	161.9	-0.4	111.6	E256 A257 E258 F262 L263 S264	E256-R260 VanDerWaalsContact O-CB 3.22Å; E256-R260 WeakPolarHBondContact O-CB 3.46Å; E256-R260 PolarHBondContact O-N 3.45Å; A257-R260 PolarHBondContact O-N 2.83Å; E258-R260 VanDerWaalsContact C-N 3.31Å; E258-R260 PolarHBondContact O-N 2.89Å; R260-F262 PolarHBondContact O-N 3.23Å; R260-L263 PolarHBondContact O-N 3.39Å; R260-S264 WeakPolarHBondContact O-CB 3.31Å; R260-S264 PolarHBondContact O-N 3.11Å; R260-S264 PolarHBondContact O-OG 2.81Å
261	F	96.1	Very high	93.8	Very high	39 Å²	39	67.8 Å²	67.8	17%	0.171	33%	0.33	C	S	.	.	H	α-helix	trans	-53	-55.8	176.3	170	-93.6	0	0	0	110.9	L210 D211 V238 A257 E258 L263 S264 H265 Y268	L210-F261 HydrophobicContact CB-CE1 3.86Å; L210-F261 HydrophobicContact CB-CZ 3.91Å; L210-F261 WeakPolarHBondContact O-CZ 3.33Å; D211-F261 HydrophobicContact CB-CE2 4.39Å; V238-F261 HydrophobicContact CG2-CD1 3.6Å; V238-F261 HydrophobicContact CG2-CE1 3.83Å; V238-F261 HydrophobicContact CG2-CG 4.13Å; A257-F261 WeakPolarHBondContact O-CB 3.22Å; A257-F261 PolarHBondContact O-N 3.49Å; E258-F261 WeakPolarHBondContact O-CB 3.47Å; E258-F261 PolarHBondContact O-N 3.32Å; F261-L263 VanDerWaalsContact C-N 3.32Å; F261-L263 PolarHBondContact O-N 3.41Å; F261-S264 PolarHBondContact O-N 2.9Å; F261-S264 VanDerWaalsContact O-N 3.15Å; F261-S264 PolarHBondContact O-OG 2.65Å; F261-S264 VanDerWaalsContact O-OG 3.08Å; F261-H265 WeakPolarHBondContact O-CB 3.2Å; F261-H265 PolarHBondContact O-N 3.43Å; F261-Y268 AromaticContact CE1-CD2 3.83Å; F261-Y268 HydrophobicContact CE1-CD2 3.83Å; F261-Y268 AromaticContact CE1-CE2 3.91Å; F261-Y268 HydrophobicContact CE1-CE2 3.91Å; F261-Y268 HydrophobicContact CZ-CD2 4.12Å; F261-Y268 AromaticContact CZ-CE2 3.85Å; F261-Y268 HydrophobicContact CZ-CE2 3.85Å
262	F	96.7	Very high	94.1	Very high	2 Å²	2	66.5 Å²	66.5	1%	0.009	32%	0.324	C	S	.	.	H	α-helix	trans	-62.7	-35	-179.4	-73.3	-63.8	0	0	0	113.5	L210 G236 V238 E258 R260 Y268 R269 A272 M275	L210-F262 HydrophobicContact CD1-CE1 3.9Å; L210-F262 HydrophobicContact CD1-CZ 3.78Å; G236-F262 WeakPolarHBondContact O-CZ 3.4Å; V238-F262 HydrophobicContact CG2-CE2 4.23Å; V238-F262 HydrophobicContact CG2-CZ 4.25Å; E258-F262 HydrophobicContact CG-CD2 3.98Å; E258-F262 HydrophobicContact CG-CE2 3.71Å; E258-F262 VanDerWaalsContact O-CD2 3.24Å; E258-F262 WeakPolarHBondContact O-CD2 3.31Å; E258-F262 PolarHBondContact O-N 2.92Å; E258-F262 VanDerWaalsContact O-N 3.11Å; R260-F262 PolarHBondContact O-N 3.23Å; F262-Y268 HydrophobicContact CD1-CD2 4.22Å; F262-Y268 HydrophobicContact CD1-CG 4.35Å; F262-Y268 HydrophobicContact CE1-CD2 4.34Å; F262-Y268 CarbonylContact O-C 3.6Å; F262-R269 VanDerWaalsContact O-CA 3.3Å; F262-R269 WeakPolarHBondContact O-CA 3.48Å; F262-R269 PolarHBondContact O-N 2.93Å; F262-A272 HydrophobicContact CB-CB 3.78Å; F262-M275 HydrophobicContact CD1-CB 3.81Å; F262-M275 HydrophobicContact CD1-CG 4.16Å; F262-M275 HydrophobicContact CD2-CB 3.96Å; F262-M275 HydrophobicContact CE1-CB 3.81Å; F262-M275 HydrophobicContact CE1-CG 4.11Å; F262-M275 HydrophobicContact CE2-CB 3.96Å; F262-M275 HydrophobicContact CG-CB 3.91Å; F262-M275 HydrophobicContact CZ-CB 3.9Å
263	L	95.8	Very high	94.4	Very high	74 Å²	74	64.5 Å²	64.5	39%	0.387	33%	0.325	S	S	.	.	H	α-helix	trans	-75.2	-26.7	176.5	-71.3	171.1	0	0	0	113.6	R259 R260 F261 R269 A272	R259-L263 HydrophobicContact CG-CD1 4.08Å; R259-L263 WeakPolarHBondContact O-CB 3.31Å; R259-L263 VanDerWaalsContact O-CG 3.28Å; R259-L263 WeakPolarHBondContact O-CG 3.44Å; R259-L263 PolarHBondContact O-N 3.37Å; R259-L263 VanDerWaalsContact O-N 3.16Å; R260-L263 PolarHBondContact O-N 3.39Å; F261-L263 VanDerWaalsContact C-N 3.32Å; F261-L263 PolarHBondContact O-N 3.41Å; L263-R269 WeakPolarHBondContact O-CD 3.21Å; L263-R269 WeakPolarHBondContact O-CG 3.46Å; L263-A272 HydrophobicContact CD2-CB 3.81Å; L263-A272 HydrophobicContact CG-CB 4.23Å
264	S	94.4	Very high	94.4	Very high	78 Å²	78	68.8 Å²	68.8	55%	0.545	33%	0.332	S	S	.	.	H	α-helix	trans	-89.6	-30.4	178.5	60.1	0	0	0	0	114.2	R260 F261	R260-S264 WeakPolarHBondContact O-CB 3.31Å; R260-S264 PolarHBondContact O-N 3.11Å; R260-S264 PolarHBondContact O-OG 2.81Å; F261-S264 PolarHBondContact O-N 2.9Å; F261-S264 VanDerWaalsContact O-N 3.15Å; F261-S264 PolarHBondContact O-OG 2.65Å; F261-S264 VanDerWaalsContact O-OG 3.08Å
265	H	93.9	Very high	94.7	Very high	48 Å²	48	69.1 Å²	69.1	22%	0.222	33%	0.332	C	S	.	.			trans	-72.4	121.7	-172	-165.2	-89.9	0	0	0	111.8	F261 S267 Y268 R269	F261-H265 WeakPolarHBondContact O-CB 3.2Å; F261-H265 PolarHBondContact O-N 3.43Å; H265-S267 VanDerWaalsContact C-N 3.3Å; H265-S267 PolarHBondContact ND1-N 3.38Å; H265-S267 PolarHBondContact O-N 2.93Å; H265-Y268 HydrophobicContact CB-CD2 3.7Å; H265-Y268 HydrophobicContact CB-CE2 4.43Å; H265-Y268 HydrophobicContact CB-CG 4.34Å; H265-Y268 AromaticContact CE1-CD2 3.9Å; H265-Y268 AromaticContact CE1-CE2 3.54Å; H265-Y268 AromaticContact CE1-CZ 3.89Å; H265-Y268 AromaticContact CG-CD2 3.44Å; H265-Y268 VanDerWaalsContact CG-CD2 3.44Å; H265-Y268 AromaticContact CG-CE2 3.72Å; H265-Y268 AromaticContact ND1-CD2 3.15Å; H265-Y268 WeakPolarHBondContact ND1-CD2 3.39Å; H265-Y268 AromaticContact ND1-CE2 3.29Å; H265-Y268 VanDerWaalsContact ND1-CE2 3.29Å; H265-Y268 WeakPolarHBondContact ND1-CE2 3.47Å; H265-Y268 AromaticContact ND1-CG 3.64Å; H265-Y268 AromaticContact ND1-CZ 3.9Å; H265-Y268 PolarHBondContact O-N 2.85Å; H265-Y268 VanDerWaalsContact O-N 3.08Å; H265-R269 PolarHBondContact O-N 2.93Å
266	P	92.8	Very high	94.8	Very high	112 Å²	112	66.9 Å²	66.9	73%	0.727	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-43.5	-174	-29.1	35.8	0	0	0	114	Y268	P266-Y268 VanDerWaalsContact C-N 3.35Å; P266-Y268 PolarHBondContact O-N 3.25Å
267	S	93.5	Very high	94.9	Very high	23 Å²	23	60.4 Å²	60.4	16%	0.161	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-10.8	-176.6	-48.7	0	0	0	0	115.4	D218 H265 H270	D218-S267 WeakPolarHBondContact OD2-CB 3.39Å; D218-S267 PolarHBondContact OD2-OG 2.81Å; H265-S267 VanDerWaalsContact C-N 3.3Å; H265-S267 PolarHBondContact ND1-N 3.38Å; H265-S267 PolarHBondContact O-N 2.93Å; S267-H270 PolarHBondContact O-CE1 2.9Å; S267-H270 VanDerWaalsContact O-CE1 3.26Å
268	Y	95.4	Very high	94.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	-11.6	-175	-47.8	-41	0	0	0	114	L210 M213 D218 A219 R220 L223 F261 F262 H265 P266 H270 M271 A272	L210-Y268 HydrophobicContact CD2-CE2 4.33Å; M213-Y268 PolarHBondContact SD-OH 2.93Å; D218-Y268 HydrophobicContact CB-CE1 4.13Å; A219-Y268 PolarHBondContact N-OH 2.87Å; R220-Y268 HydrophobicContact CB-CE1 4.46Å; L223-Y268 HydrophobicContact CD1-CD1 3.92Å; L223-Y268 HydrophobicContact CD1-CE1 3.9Å; F261-Y268 AromaticContact CE1-CD2 3.83Å; F261-Y268 HydrophobicContact CE1-CD2 3.83Å; F261-Y268 AromaticContact CE1-CE2 3.91Å; F261-Y268 HydrophobicContact CE1-CE2 3.91Å; F261-Y268 HydrophobicContact CZ-CD2 4.12Å; F261-Y268 AromaticContact CZ-CE2 3.85Å; F261-Y268 HydrophobicContact CZ-CE2 3.85Å; F262-Y268 HydrophobicContact CD1-CD2 4.22Å; F262-Y268 HydrophobicContact CD1-CG 4.35Å; F262-Y268 HydrophobicContact CE1-CD2 4.34Å; F262-Y268 CarbonylContact O-C 3.6Å; H265-Y268 HydrophobicContact CB-CD2 3.7Å; H265-Y268 HydrophobicContact CB-CE2 4.43Å; H265-Y268 HydrophobicContact CB-CG 4.34Å; H265-Y268 AromaticContact CE1-CD2 3.9Å; H265-Y268 AromaticContact CE1-CE2 3.54Å; H265-Y268 AromaticContact CE1-CZ 3.89Å; H265-Y268 AromaticContact CG-CD2 3.44Å; H265-Y268 VanDerWaalsContact CG-CD2 3.44Å; H265-Y268 AromaticContact CG-CE2 3.72Å; H265-Y268 AromaticContact ND1-CD2 3.15Å; H265-Y268 WeakPolarHBondContact ND1-CD2 3.39Å; H265-Y268 AromaticContact ND1-CE2 3.29Å; H265-Y268 VanDerWaalsContact ND1-CE2 3.29Å; H265-Y268 WeakPolarHBondContact ND1-CE2 3.47Å; H265-Y268 AromaticContact ND1-CG 3.64Å; H265-Y268 AromaticContact ND1-CZ 3.9Å; H265-Y268 PolarHBondContact O-N 2.85Å; H265-Y268 VanDerWaalsContact O-N 3.08Å; P266-Y268 VanDerWaalsContact C-N 3.35Å; P266-Y268 PolarHBondContact O-N 3.25Å; Y268-H270 VanDerWaalsContact C-N 3.27Å; Y268-H270 PolarHBondContact O-N 2.92Å; Y268-H270 VanDerWaalsContact O-N 3.17Å; Y268-M271 HydrophobicContact CD1-SD 4.35Å; Y268-M271 CarbonylContact O-C 3.57Å; Y268-M271 WeakPolarHBondContact O-CG 3.41Å; Y268-M271 PolarHBondContact O-N 3.15Å; Y268-A272 PolarHBondContact O-N 2.9Å; Y268-A272 VanDerWaalsContact O-N 3.11Å
269	R	94.3	Very high	94.8	Very high	175 Å²	175	64.3 Å²	64.3	66%	0.66	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-56.1	-35.5	-174.8	-178.5	172.3	176	158.4	-1.6	114.3	F262 L263 H265 M271	F262-R269 VanDerWaalsContact O-CA 3.3Å; F262-R269 WeakPolarHBondContact O-CA 3.48Å; F262-R269 PolarHBondContact O-N 2.93Å; L263-R269 WeakPolarHBondContact O-CD 3.21Å; L263-R269 WeakPolarHBondContact O-CG 3.46Å; H265-R269 PolarHBondContact O-N 2.93Å; R269-M271 VanDerWaalsContact C-N 3.27Å; R269-M271 PolarHBondContact O-N 3.45Å
270	H	94.5	Very high	94.8	Very high	100 Å²	100	59.4 Å²	59.4	46%	0.463	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-78.3	-5.8	178.2	66.5	-65.9	0	0	0	114.3	E224 S267 Y268	E224-H270 IonicContact OE1-CD2 2.68Å; E224-H270 IonicContact OE1-CE1 2.91Å; E224-H270 IonicContact OE1-NE2 3.23Å; E224-H270 PolarHBondContact OE1-NE2 3.02Å; S267-H270 PolarHBondContact O-CE1 2.9Å; S267-H270 VanDerWaalsContact O-CE1 3.26Å; Y268-H270 VanDerWaalsContact C-N 3.27Å; Y268-H270 PolarHBondContact O-N 2.92Å; Y268-H270 VanDerWaalsContact O-N 3.17Å
271	M	94.9	Very high	94.6	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.02	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-120.3	2.2	176.5	64.1	176.6	83.2	0	0	113.5	R220 L223 E224 Y268 R269 D273 R274 M275	R220-M271 HydrophobicContact CG-CE 3.98Å; L223-M271 HydrophobicContact CB-CE 4.25Å; L223-M271 HydrophobicContact CB-SD 3.56Å; L223-M271 VanDerWaalsContact CB-SD 3.56Å; L223-M271 HydrophobicContact CD1-SD 3.97Å; L223-M271 HydrophobicContact CG-SD 4.43Å; E224-M271 HydrophobicContact CG-CE 3.58Å; Y268-M271 HydrophobicContact CD1-SD 4.35Å; Y268-M271 CarbonylContact O-C 3.57Å; Y268-M271 WeakPolarHBondContact O-CG 3.41Å; Y268-M271 PolarHBondContact O-N 3.15Å; R269-M271 VanDerWaalsContact C-N 3.27Å; R269-M271 PolarHBondContact O-N 3.45Å; M271-D273 PolarHBondContact O-N 3.11Å; M271-R274 WeakPolarHBondContact O-CA 3.03Å; M271-R274 PolarHBondContact O-N 3.05Å; M271-M275 HydrophobicContact CB-CE 4.43Å; M271-M275 HydrophobicContact CG-CE 4.32Å; M271-M275 HydrophobicContact CG-CG 4.09Å; M271-M275 WeakPolarHBondContact O-CG 3.45Å; M271-M275 HydrophobicContact SD-CE 3.79Å; M271-M275 HydrophobicContact SD-CG 4.38Å; M271-M275 HydrophobicContact SD-SD 4.43Å
272	A	93.6	Very high	94.4	Very high	2 Å²	2	55.3 Å²	55.3	2%	0.017	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-56.1	-24.5	-171.5	0	0	0	0	0	115.5	R259 F262 L263 Y268 R274	R259-A272 VanDerWaalsContact NH1-C 3.34Å; R259-A272 PolarHBondContact NH1-O 2.76Å; F262-A272 HydrophobicContact CB-CB 3.78Å; L263-A272 HydrophobicContact CD2-CB 3.81Å; L263-A272 HydrophobicContact CG-CB 4.23Å; Y268-A272 PolarHBondContact O-N 2.9Å; Y268-A272 VanDerWaalsContact O-N 3.11Å; A272-R274 VanDerWaalsContact C-N 3.31Å
273	D	93.6	Very high	94.2	Very high	115 Å²	115	56.1 Å²	56.1	62%	0.615	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-81	-7.2	175.8	-62	-37.9	0	0	0	114.3	R259 M271 F279	R259-D273 IonicContact CZ-OD1 2.74Å; R259-D273 IonicContact NH1-OD1 3.83Å; R259-D273 PolarHBondContact NH1-OD1 3.48Å; R259-D273 IonicContact NH2-OD1 2.99Å; R259-D273 PolarHBondContact NH2-OD1 3.2Å; M271-D273 PolarHBondContact O-N 3.11Å; D273-F279 WeakPolarHBondContact O-CD2 3.46Å
274	R	94	Very high	94	Very high	133 Å²	133	52.6 Å²	52.6	50%	0.502	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-114.3	17.9	175.9	-61.1	-177.5	-67.8	172.9	-0.8	112.2	M271 A272 F279	M271-R274 WeakPolarHBondContact O-CA 3.03Å; M271-R274 PolarHBondContact O-N 3.05Å; A272-R274 VanDerWaalsContact C-N 3.31Å; R274-F279 HydrophobicContact CB-CE1 4.05Å; R274-F279 HydrophobicContact CB-CE2 4.32Å; R274-F279 HydrophobicContact CB-CZ 3.9Å; R274-F279 HydrophobicContact CG-CE2 4.32Å; R274-F279 HydrophobicContact CG-CZ 4.13Å; R274-F279 WeakPolarHBondContact O-CD1 3.24Å; R274-F279 WeakPolarHBondContact O-CE1 3.38Å
275	M	96.5	Very high	93.7	Very high	16 Å²	16	49.7 Å²	49.7	8%	0.079	24%	0.242	C	C	.	.			trans	-131.2	165.3	-175.8	-61.7	-64.2	145.2	0	0	110.2	L223 G236 F262 M271 F279	L223-M275 HydrophobicContact CB-CE 4.06Å; L223-M275 HydrophobicContact CD1-SD 4.12Å; L223-M275 HydrophobicContact CD2-CE 4.33Å; L223-M275 HydrophobicContact CD2-SD 4.03Å; L223-M275 HydrophobicContact CG-SD 4.47Å; G236-M275 PolarHBondContact N-SD 3.09Å; F262-M275 HydrophobicContact CD1-CB 3.81Å; F262-M275 HydrophobicContact CD1-CG 4.16Å; F262-M275 HydrophobicContact CD2-CB 3.96Å; F262-M275 HydrophobicContact CE1-CB 3.81Å; F262-M275 HydrophobicContact CE1-CG 4.11Å; F262-M275 HydrophobicContact CE2-CB 3.96Å; F262-M275 HydrophobicContact CG-CB 3.91Å; F262-M275 HydrophobicContact CZ-CB 3.9Å; M271-M275 HydrophobicContact CB-CE 4.43Å; M271-M275 HydrophobicContact CG-CE 4.32Å; M271-M275 HydrophobicContact CG-CG 4.09Å; M271-M275 WeakPolarHBondContact O-CG 3.45Å; M271-M275 HydrophobicContact SD-CE 3.79Å; M271-M275 HydrophobicContact SD-CG 4.38Å; M271-M275 HydrophobicContact SD-SD 4.43Å; M275-F279 WeakPolarHBondContact O-CB 3.37Å
276	G	96.3	Very high	93.5	Very high	3 Å²	3	50.7 Å²	50.7	3%	0.031	25%	0.246	C	C	.	.	S	Bend	trans	89.9	159.5	179	0	0	0	0	0	114.7	G236 E258 P278 F279 L280	G236-G276 PolarHBondContact O-N 2.99Å; E258-G276 WeakPolarHBondContact OE1-CA 3.4Å; E258-G276 VanDerWaalsContact OE2-CA 3.3Å; E258-G276 WeakPolarHBondContact OE2-CA 3.41Å; G276-P278 VanDerWaalsContact C-CD 3.48Å; G276-F279 PolarHBondContact O-N 3.39Å; G276-F279 VanDerWaalsContact O-N 3.13Å; G276-L280 PolarHBondContact O-N 3.41Å
277	T	95	Very high	93.4	Very high	4 Å²	4	47.2 Å²	47.2	3%	0.025	22%	0.22	C	C	.	.	H	α-helix	trans	-54.7	-42.3	-176.2	-60.7	0	0	0	0	113.3	A52 F53 L255 E258 F279 L280 Q281	A52-T277 HydrophobicContact CB-CG2 3.79Å; F53-T277 HydrophobicContact CD1-CG2 3.73Å; F53-T277 HydrophobicContact CE1-CG2 3.98Å; L255-T277 HydrophobicContact CD2-CG2 4.21Å; E258-T277 PolarHBondContact OE1-N 2.65Å; E258-T277 PolarHBondContact OE1-OG1 3.29Å; E258-T277 PolarHBondContact OE2-N 2.87Å; T277-F279 PolarHBondContact O-N 2.89Å; T277-L280 PolarHBondContact O-N 3.01Å; T277-Q281 WeakPolarHBondContact O-CB 3.49Å; T277-Q281 PolarHBondContact O-N 3.32Å
278	P	93	Very high	93	Very high	70 Å²	70	46.2 Å²	46.2	46%	0.455	21%	0.213	S	C	.	.	H	α-helix	trans	-68.5	-33.5	178.3	-19.9	34.3	0	0	0	112.9	L255 E258 G276 K282	L255-P278 HydrophobicContact CD2-CG 4Å; E258-P278 WeakPolarHBondContact OE2-CD 3.27Å; G276-P278 VanDerWaalsContact C-CD 3.48Å; P278-K282 VanDerWaalsContact O-CB 3.31Å; P278-K282 WeakPolarHBondContact O-CB 3.49Å; P278-K282 PolarHBondContact O-N 2.75Å; P278-K282 VanDerWaalsContact O-N 3.16Å
279	F	95.1	Very high	92.5	Very high	57 Å²	57	46.6 Å²	46.6	25%	0.25	22%	0.215	C	C	.	.	H	α-helix	trans	-69.4	-44	173.7	-177.5	-96.5	0	0	0	110.5	I235 D273 R274 M275 G276 T277 K282 V283	I235-F279 HydrophobicContact CD1-CD1 3.9Å; I235-F279 HydrophobicContact CD1-CE1 3.79Å; I235-F279 HydrophobicContact CG1-CD1 4.24Å; I235-F279 HydrophobicContact CG1-CE1 4.1Å; I235-F279 HydrophobicContact CG2-CD1 4.05Å; D273-F279 WeakPolarHBondContact O-CD2 3.46Å; R274-F279 HydrophobicContact CB-CE1 4.05Å; R274-F279 HydrophobicContact CB-CE2 4.32Å; R274-F279 HydrophobicContact CB-CZ 3.9Å; R274-F279 HydrophobicContact CG-CE2 4.32Å; R274-F279 HydrophobicContact CG-CZ 4.13Å; R274-F279 WeakPolarHBondContact O-CD1 3.24Å; R274-F279 WeakPolarHBondContact O-CE1 3.38Å; M275-F279 WeakPolarHBondContact O-CB 3.37Å; G276-F279 PolarHBondContact O-N 3.39Å; G276-F279 VanDerWaalsContact O-N 3.13Å; T277-F279 PolarHBondContact O-N 2.89Å; F279-K282 PolarHBondContact O-N 2.73Å; F279-V283 HydrophobicContact CD1-CG2 4.01Å; F279-V283 HydrophobicContact CE1-CG2 3.58Å; F279-V283 HydrophobicContact CE2-CG2 4.25Å; F279-V283 HydrophobicContact CZ-CG2 3.71Å; F279-V283 WeakPolarHBondContact O-CG2 3.36Å; F279-V283 PolarHBondContact O-N 3.23Å
280	L	95.5	Very high	92.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.1	-51.6	175.4	-179	58.9	0	0	0	111.7	V49 F53 L175 V206 I235 I237 G276 T277 K282 V283 L284	V49-L280 HydrophobicContact CG1-CD2 3.87Å; F53-L280 HydrophobicContact CE1-CB 4.26Å; F53-L280 HydrophobicContact CE1-CD2 3.96Å; F53-L280 HydrophobicContact CE1-CG 3.98Å; F53-L280 HydrophobicContact CZ-CD2 3.65Å; F53-L280 HydrophobicContact CZ-CG 3.74Å; L175-L280 HydrophobicContact CD1-CD1 4.45Å; V206-L280 HydrophobicContact CG1-CD2 4.06Å; V206-L280 HydrophobicContact CG2-CD1 3.71Å; V206-L280 HydrophobicContact CG2-CD2 3.73Å; V206-L280 HydrophobicContact CG2-CG 4.4Å; I235-L280 HydrophobicContact CB-CD1 4.18Å; I235-L280 HydrophobicContact CD1-CD1 3.76Å; I235-L280 HydrophobicContact CG2-CB 3.99Å; I235-L280 HydrophobicContact CG2-CD1 4.34Å; I237-L280 HydrophobicContact CD1-CD2 4.18Å; I237-L280 HydrophobicContact CG2-CB 4.26Å; I237-L280 HydrophobicContact CG2-CD2 3.87Å; G276-L280 PolarHBondContact O-N 3.41Å; T277-L280 PolarHBondContact O-N 3.01Å; L280-K282 VanDerWaalsContact C-N 3.31Å; L280-K282 PolarHBondContact O-N 2.86Å; L280-V283 PolarHBondContact O-N 3.47Å; L280-V283 VanDerWaalsContact O-N 3.14Å; L280-L284 HydrophobicContact CD1-CD1 4.06Å; L280-L284 HydrophobicContact CD1-CD2 4.33Å; L280-L284 HydrophobicContact CD1-CG 3.99Å; L280-L284 HydrophobicContact CG-CD1 4.03Å; L280-L284 HydrophobicContact CG-CG 4.34Å; L280-L284 WeakPolarHBondContact O-CG 3.47Å; L280-L284 PolarHBondContact O-N 3.25Å
281	Q	92	Very high	91.5	Very high	22 Å²	22	36.7 Å²	36.7	10%	0.103	18%	0.178	C	C	.	.	H	α-helix	trans	-59.1	-41.9	179.9	-163.5	-173.1	34.5	0	0	111.8	F53 L133 L135 T277 L284 N285	F53-Q281 HydrophobicContact CD1-CB 3.8Å; F53-Q281 HydrophobicContact CD1-CG 3.98Å; F53-Q281 HydrophobicContact CE1-CB 3.89Å; F53-Q281 HydrophobicContact CE1-CG 4.43Å; F53-Q281 HydrophobicContact CG-CG 4.3Å; F53-Q281 PolarHBondContact O-NE2 2.84Å; F53-Q281 VanDerWaalsContact O-NE2 3.13Å; L133-Q281 HydrophobicContact CB-CG 4.46Å; L133-Q281 HydrophobicContact CD1-CG 4.3Å; L133-Q281 HydrophobicContact CG-CG 4.47Å; L135-Q281 HydrophobicContact CD2-CG 4.31Å; T277-Q281 WeakPolarHBondContact O-CB 3.49Å; T277-Q281 PolarHBondContact O-N 3.32Å; Q281-L284 PolarHBondContact O-N 3.15Å; Q281-N285 WeakPolarHBondContact O-CB 3.25Å; Q281-N285 PolarHBondContact O-N 3.44Å
282	K	91.7	Very high	90.9	Very high	124 Å²	124	36.6 Å²	36.6	54%	0.539	18%	0.178	S	C	.	.	H	α-helix	trans	-62.2	-44.6	174.4	-179.8	-176.5	176.4	-174.9	0	112.3	P278 F279 L280 Q286	P278-K282 VanDerWaalsContact O-CB 3.31Å; P278-K282 WeakPolarHBondContact O-CB 3.49Å; P278-K282 PolarHBondContact O-N 2.75Å; P278-K282 VanDerWaalsContact O-N 3.16Å; F279-K282 PolarHBondContact O-N 2.73Å; L280-K282 VanDerWaalsContact C-N 3.31Å; L280-K282 PolarHBondContact O-N 2.86Å; K282-Q286 WeakPolarHBondContact O-CB 3.45Å; K282-Q286 PolarHBondContact O-N 3.33Å
283	V	92.1	Very high	90.4	Very high	18 Å²	18	40.9 Å²	40.9	11%	0.109	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-45.6	176.4	169.9	0	0	0	0	110.5	I235 F279 L280 N285 Q286 Q287	I235-V283 HydrophobicContact CD1-CB 4Å; I235-V283 HydrophobicContact CD1-CG1 4Å; I235-V283 HydrophobicContact CD1-CG2 4.04Å; F279-V283 HydrophobicContact CD1-CG2 4.01Å; F279-V283 HydrophobicContact CE1-CG2 3.58Å; F279-V283 HydrophobicContact CE2-CG2 4.25Å; F279-V283 HydrophobicContact CZ-CG2 3.71Å; F279-V283 WeakPolarHBondContact O-CG2 3.36Å; F279-V283 PolarHBondContact O-N 3.23Å; L280-V283 PolarHBondContact O-N 3.47Å; L280-V283 VanDerWaalsContact O-N 3.14Å; V283-N285 PolarHBondContact O-N 2.71Å; V283-Q286 PolarHBondContact O-N 3.21Å; V283-Q287 HydrophobicContact CG1-CG 3.82Å; V283-Q287 VanDerWaalsContact O-CB 3.3Å; V283-Q287 WeakPolarHBondContact O-CB 3.18Å; V283-Q287 WeakPolarHBondContact O-CG 3.31Å; V283-Q287 PolarHBondContact O-N 2.87Å
284	L	92.4	Very high	89.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-43.7	179.1	-64.9	178.5	0	0	0	112.1	I36 F53 L135 L137 L175 I204 L280 Q281 Q287 L288	I36-L284 HydrophobicContact CD1-CB 4.03Å; I36-L284 HydrophobicContact CD1-CD2 4.17Å; F53-L284 HydrophobicContact CE2-CD1 3.74Å; F53-L284 HydrophobicContact CZ-CD1 3.56Å; L135-L284 HydrophobicContact CD1-CB 3.94Å; L135-L284 HydrophobicContact CD2-CB 3.97Å; L135-L284 HydrophobicContact CD2-CD1 4.42Å; L137-L284 HydrophobicContact CD2-CD1 4.44Å; L175-L284 HydrophobicContact CD1-CD1 4.44Å; L175-L284 HydrophobicContact CD1-CD2 3.74Å; L175-L284 HydrophobicContact CD2-CD1 3.77Å; L175-L284 HydrophobicContact CD2-CD2 4.37Å; I204-L284 HydrophobicContact CD1-CD2 3.63Å; L280-L284 HydrophobicContact CD1-CD1 4.06Å; L280-L284 HydrophobicContact CD1-CD2 4.33Å; L280-L284 HydrophobicContact CD1-CG 3.99Å; L280-L284 HydrophobicContact CG-CD1 4.03Å; L280-L284 HydrophobicContact CG-CG 4.34Å; L280-L284 WeakPolarHBondContact O-CG 3.47Å; L280-L284 PolarHBondContact O-N 3.25Å; Q281-L284 PolarHBondContact O-N 3.15Å; L284-Q287 PolarHBondContact O-N 3.07Å; L284-L288 VanDerWaalsContact O-CB 3.25Å; L284-L288 WeakPolarHBondContact O-CB 3.46Å; L284-L288 PolarHBondContact O-N 3.49Å
285	N	88.8	Confident	89.1	Confident	18 Å²	18	35.3 Å²	35.3	10%	0.096	18%	0.175	C	C	.	.	H	α-helix	trans	-59	-48.2	173	169.9	-97.9	0	0	0	111.8	L133 N134 Q281 V283 T289	L133-N285 HydrophobicContact CB-CB 4.28Å; L133-N285 HydrophobicContact CD1-CB 3.95Å; N134-N285 PolarHBondContact O-ND2 2.93Å; Q281-N285 WeakPolarHBondContact O-CB 3.25Å; Q281-N285 PolarHBondContact O-N 3.44Å; V283-N285 PolarHBondContact O-N 2.71Å; N285-T289 VanDerWaalsContact O-CB 3.23Å; N285-T289 WeakPolarHBondContact O-CB 3.3Å; N285-T289 PolarHBondContact O-N 3.27Å; N285-T289 PolarHBondContact O-OG1 2.81Å
286	Q	89.3	Confident	88.5	Confident	68 Å²	68	35.7 Å²	35.7	32%	0.318	18%	0.177	S	C	.	.	H	α-helix	trans	-64.5	-43.8	179.6	-174.8	177.4	13.7	0	0	112.2	K282 V283 T289 N290	K282-Q286 WeakPolarHBondContact O-CB 3.45Å; K282-Q286 PolarHBondContact O-N 3.33Å; V283-Q286 PolarHBondContact O-N 3.21Å; Q286-T289 PolarHBondContact O-N 2.84Å; Q286-N290 WeakPolarHBondContact O-CB 3.17Å; Q286-N290 VanDerWaalsContact O-CG 3.3Å; Q286-N290 PolarHBondContact O-N 3.41Å; Q286-N290 PolarHBondContact O-ND2 3.03Å
287	Q	89.2	Confident	87.9	Confident	40 Å²	40	39.6 Å²	39.6	19%	0.187	20%	0.202	C	C	.	.	H	α-helix	trans	-70.2	-41	-178.1	-65.6	-69.6	12.2	0	0	111.6	L173 I204 V283 L284 H291	L173-Q287 HydrophobicContact CD1-CB 4.37Å; I204-Q287 HydrophobicContact CD1-CG 4.49Å; V283-Q287 HydrophobicContact CG1-CG 3.82Å; V283-Q287 VanDerWaalsContact O-CB 3.3Å; V283-Q287 WeakPolarHBondContact O-CB 3.18Å; V283-Q287 WeakPolarHBondContact O-CG 3.31Å; V283-Q287 PolarHBondContact O-N 2.87Å; L284-Q287 PolarHBondContact O-N 3.07Å; Q287-H291 WeakPolarHBondContact O-CB 3.49Å; Q287-H291 PolarHBondContact O-N 2.65Å
288	L	86.2	Confident	87.3	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-64	-45.8	172.9	-177.7	59.6	0	0	0	111	I12 I36 L135 L284 N290 H291 I292	I12-L288 HydrophobicContact CD1-CB 4.42Å; I12-L288 HydrophobicContact CD1-CD2 3.9Å; I12-L288 HydrophobicContact CD1-CG 4.16Å; I12-L288 HydrophobicContact CG1-CD2 3.97Å; I12-L288 HydrophobicContact CG1-CG 4.14Å; I12-L288 HydrophobicContact CG2-CD2 4.44Å; I36-L288 HydrophobicContact CD1-CB 3.99Å; I36-L288 HydrophobicContact CD1-CD2 4.3Å; L135-L288 HydrophobicContact CD1-CB 4.48Å; L135-L288 HydrophobicContact CD1-CD2 3.96Å; L284-L288 VanDerWaalsContact O-CB 3.25Å; L284-L288 WeakPolarHBondContact O-CB 3.46Å; L284-L288 PolarHBondContact O-N 3.49Å; L288-N290 VanDerWaalsContact C-N 3.34Å; L288-N290 PolarHBondContact O-N 2.76Å; L288-H291 PolarHBondContact O-N 2.66Å; L288-I292 HydrophobicContact CD1-CD1 3.97Å; L288-I292 HydrophobicContact CD1-CG1 4.12Å; L288-I292 HydrophobicContact CG-CD1 3.8Å; L288-I292 HydrophobicContact CG-CG1 4.39Å; L288-I292 VanDerWaalsContact O-CG1 3.22Å; L288-I292 WeakPolarHBondContact O-CG1 3.33Å; L288-I292 PolarHBondContact O-N 3.19Å
289	T	85.1	Confident	86.8	Confident	8 Å²	8	39.6 Å²	39.6	5%	0.049	21%	0.206	C	C	.	.	H	α-helix	trans	-59	-43.3	178	-60.5	0	0	0	0	112.3	M8 L11 N285 Q286 R293	M8-T289 HydrophobicContact CB-CG2 3.7Å; M8-T289 WeakPolarHBondContact O-CG2 3.38Å; L11-T289 HydrophobicContact CD1-CG2 4.36Å; N285-T289 VanDerWaalsContact O-CB 3.23Å; N285-T289 WeakPolarHBondContact O-CB 3.3Å; N285-T289 PolarHBondContact O-N 3.27Å; N285-T289 PolarHBondContact O-OG1 2.81Å; Q286-T289 PolarHBondContact O-N 2.84Å; T289-R293 PolarHBondContact O-N 3.2Å
290	N	85.1	Confident	86.3	Confident	45 Å²	45	41.1 Å²	41.1	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-65.2	-50.2	175	-74.5	-21.9	0	0	0	111.5	Q286 L288 I292 R293 D294	Q286-N290 WeakPolarHBondContact O-CB 3.17Å; Q286-N290 VanDerWaalsContact O-CG 3.3Å; Q286-N290 PolarHBondContact O-N 3.41Å; Q286-N290 PolarHBondContact O-ND2 3.03Å; L288-N290 VanDerWaalsContact C-N 3.34Å; L288-N290 PolarHBondContact O-N 2.76Å; N290-I292 VanDerWaalsContact C-N 3.27Å; N290-I292 PolarHBondContact O-N 3.39Å; N290-R293 WeakPolarHBondContact O-CA 3.27Å; N290-R293 WeakPolarHBondContact O-CB 3.45Å; N290-R293 PolarHBondContact O-N 3.45Å; N290-R293 PolarHBondContact OD1-NH1 3.47Å; N290-R293 PolarHBondContact OD1-NH2 3.05Å; N290-D294 PolarHBondContact O-N 2.8Å
291	H	82.5	Confident	85.9	Confident	23 Å²	23	44.7 Å²	44.7	11%	0.106	23%	0.23	C	C	.	.	H	α-helix	trans	-60.8	-35.1	-178.3	-172.9	61.3	0	0	0	112.6	N171 L173 Q287 L288 T295	N171-H291 VanDerWaalsContact C-NE2 3.31Å; N171-H291 WeakPolarHBondContact CA-NE2 3.41Å; N171-H291 PolarHBondContact O-NE2 3.03Å; L173-H291 HydrophobicContact CD1-CB 4.15Å; Q287-H291 WeakPolarHBondContact O-CB 3.49Å; Q287-H291 PolarHBondContact O-N 2.65Å; L288-H291 PolarHBondContact O-N 2.66Å; H291-T295 WeakPolarHBondContact O-CB 3.46Å; H291-T295 VanDerWaalsContact O-CG2 3.31Å; H291-T295 WeakPolarHBondContact O-CG2 3.26Å; H291-T295 PolarHBondContact O-N 2.86Å; H291-T295 PolarHBondContact O-OG1 3.35Å
292	I	82.2	Confident	85.6	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-48.3	170.2	-64.8	163.7	0	0	0	110.9	L11 I12 V15 P34 L288 N290 D294 T295 L296	L11-I292 HydrophobicContact CB-CB 4.38Å; L11-I292 HydrophobicContact CB-CG2 3.88Å; I12-I292 HydrophobicContact CB-CD1 4.48Å; I12-I292 HydrophobicContact CG1-CD1 3.67Å; V15-I292 HydrophobicContact CB-CD1 4.48Å; V15-I292 HydrophobicContact CG2-CD1 3.85Å; V15-I292 HydrophobicContact CG2-CG1 3.92Å; V15-I292 HydrophobicContact CG2-CG2 3.82Å; P34-I292 HydrophobicContact CB-CG1 3.69Å; P34-I292 HydrophobicContact CG-CB 4.5Å; P34-I292 HydrophobicContact CG-CG1 4.02Å; L288-I292 HydrophobicContact CD1-CD1 3.97Å; L288-I292 HydrophobicContact CD1-CG1 4.12Å; L288-I292 HydrophobicContact CG-CD1 3.8Å; L288-I292 HydrophobicContact CG-CG1 4.39Å; L288-I292 VanDerWaalsContact O-CG1 3.22Å; L288-I292 WeakPolarHBondContact O-CG1 3.33Å; L288-I292 PolarHBondContact O-N 3.19Å; N290-I292 VanDerWaalsContact C-N 3.27Å; N290-I292 PolarHBondContact O-N 3.39Å; I292-D294 PolarHBondContact O-N 3.3Å; I292-T295 PolarHBondContact O-N 3.45Å; I292-T295 PolarHBondContact O-OG1 3.39Å; I292-L296 WeakPolarHBondContact O-CB 3.33Å; I292-L296 PolarHBondContact O-N 3.48Å
293	R	82.7	Confident	85.3	Confident	92 Å²	92	43.3 Å²	43.3	35%	0.347	22%	0.22	S	C	.	.	H	α-helix	trans	-56.2	-40.9	179.6	-165.7	-161.6	-53.4	100.9	2.6	112.1	M8 L11 T289 N290 P297	M8-R293 PolarHBondContact SD-NH2 2.88Å; L11-R293 HydrophobicContact CD1-CB 4.17Å; T289-R293 PolarHBondContact O-N 3.2Å; N290-R293 WeakPolarHBondContact O-CA 3.27Å; N290-R293 WeakPolarHBondContact O-CB 3.45Å; N290-R293 PolarHBondContact O-N 3.45Å; N290-R293 PolarHBondContact OD1-NH1 3.47Å; N290-R293 PolarHBondContact OD1-NH2 3.05Å; R293-P297 VanDerWaalsContact O-CD 3.26Å; R293-P297 WeakPolarHBondContact O-CD 3.24Å
294	D	82.5	Confident	85.2	Confident	114 Å²	114	47 Å²	47	61%	0.61	24%	0.236	S	C	*	.	H	α-helix	trans	-79.3	-27.4	-172.8	-55.2	-17.5	0	0	0	112.1	N290 I292	N290-D294 PolarHBondContact O-N 2.8Å; I292-D294 PolarHBondContact O-N 3.3Å
295	T	79.3	Confident	85	Confident	18 Å²	18	52.8 Å²	52.8	11%	0.11	26%	0.261	C	S	.	.	H	α-helix	trans	-96.5	-29.3	-178.5	53.8	0	0	0	0	114.4	P34 N171 H291 I292 P297 A298 L299	P34-T295 WeakPolarHBondContact CG-OG1 3.41Å; N171-T295 WeakPolarHBondContact OD1-CG2 3.19Å; H291-T295 WeakPolarHBondContact O-CB 3.46Å; H291-T295 VanDerWaalsContact O-CG2 3.31Å; H291-T295 WeakPolarHBondContact O-CG2 3.26Å; H291-T295 PolarHBondContact O-N 2.86Å; H291-T295 PolarHBondContact O-OG1 3.35Å; I292-T295 PolarHBondContact O-N 3.45Å; I292-T295 PolarHBondContact O-OG1 3.39Å; T295-P297 VanDerWaalsContact C-CD 3.43Å; T295-A298 PolarHBondContact O-N 3.3Å; T295-L299 PolarHBondContact O-N 3.43Å
296	L	82.3	Confident	84.9	Confident	24 Å²	24	54.2 Å²	54.2	13%	0.126	27%	0.267	C	S	.	.	H	α-helix	trans	-55.5	-37.3	-177.3	-176.6	66.4	0	0	0	114.7	L11 L14 I292 L299 R300 I735	L11-L296 HydrophobicContact CD2-CD2 4.24Å; L14-L296 HydrophobicContact CD2-CD1 4.1Å; L14-L296 HydrophobicContact CD2-CD2 3.58Å; I292-L296 WeakPolarHBondContact O-CB 3.33Å; I292-L296 PolarHBondContact O-N 3.48Å; L296-L299 HydrophobicContact CD1-CD2 4.36Å; L296-L299 PolarHBondContact O-N 2.97Å; L296-R300 WeakPolarHBondContact O-CB 3.49Å; L296-R300 PolarHBondContact O-N 3.25Å; L296-I735 HydrophobicContact CD1-CD1 4.05Å; L296-I735 HydrophobicContact CD1-CG1 3.98Å; L296-I735 HydrophobicContact CD1-CG2 4.15Å; L296-I735 HydrophobicContact CG-CG2 4.4Å
297	P	83.4	Confident	84.7	Confident	85 Å²	85	52.8 Å²	52.8	55%	0.552	26%	0.261	S	S	*	.	H	α-helix	trans	-63.2	-41.6	176.5	-23.7	35.2	0	0	0	113.1	R293 T295 R300 D301	R293-P297 VanDerWaalsContact O-CD 3.26Å; R293-P297 WeakPolarHBondContact O-CD 3.24Å; T295-P297 VanDerWaalsContact C-CD 3.43Å; P297-R300 PolarHBondContact O-N 2.94Å; P297-D301 PolarHBondContact O-N 3.33Å; P297-D301 VanDerWaalsContact O-N 3.07Å
298	A	83.6	Confident	84.6	Confident	65 Å²	65	56.7 Å²	56.7	54%	0.537	28%	0.283	S	S	.	.	H	α-helix	trans	-70.6	-36	177.3	0	0	0	0	0	111.8	T295 D301 R302	T295-A298 PolarHBondContact O-N 3.3Å; A298-D301 PolarHBondContact O-N 3.34Å; A298-R302 WeakPolarHBondContact O-CB 3.36Å; A298-R302 PolarHBondContact O-N 2.81Å
299	L	82.2	Confident	84.6	Confident	8 Å²	8	62.9 Å²	62.9	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-61.7	-44.1	172.6	-173.9	65.2	0	0	0	111.6	L18 L31 L33 T295 L296 R302 L303	L18-L299 HydrophobicContact CD1-CD2 4.31Å; L31-L299 HydrophobicContact CB-CD1 4.27Å; L31-L299 HydrophobicContact CD1-CD1 4.15Å; L31-L299 HydrophobicContact CD2-CD1 3.85Å; L31-L299 HydrophobicContact CG-CD1 4.31Å; L33-L299 HydrophobicContact CD2-CD2 3.79Å; T295-L299 PolarHBondContact O-N 3.43Å; L296-L299 HydrophobicContact CD1-CD2 4.36Å; L296-L299 PolarHBondContact O-N 2.97Å; L299-R302 PolarHBondContact O-N 2.95Å; L299-L303 HydrophobicContact CG-CD1 4.23Å; L299-L303 WeakPolarHBondContact O-CB 3.41Å; L299-L303 WeakPolarHBondContact O-CG 3.19Å; L299-L303 PolarHBondContact O-N 3.14Å
300	R	85.3	Confident	84.6	Confident	90 Å²	90	63.6 Å²	63.6	34%	0.34	32%	0.318	S	S	.	.	H	α-helix	trans	-61.4	-47.1	176.4	-176.4	-171.9	167.3	91.5	8.6	111.9	L296 P297 L303 Q304 L732 I735	L296-R300 WeakPolarHBondContact O-CB 3.49Å; L296-R300 PolarHBondContact O-N 3.25Å; P297-R300 PolarHBondContact O-N 2.94Å; R300-L303 PolarHBondContact O-N 2.95Å; R300-Q304 VanDerWaalsContact O-CB 3.3Å; R300-Q304 WeakPolarHBondContact O-CB 3.36Å; R300-Q304 PolarHBondContact O-N 3.34Å; R300-L732 HydrophobicContact CG-CD2 3.96Å; R300-I735 HydrophobicContact CB-CG2 4.25Å; R300-I735 HydrophobicContact CG-CG2 4.18Å
301	D	86.5	Confident	84.5	Confident	75 Å²	75	64.2 Å²	64.2	40%	0.401	32%	0.32	S	S	.	.	H	α-helix	trans	-61.5	-44.4	177.8	171.8	72.1	0	0	0	112	P297 A298 L303 Q304 K305	P297-D301 PolarHBondContact O-N 3.33Å; P297-D301 VanDerWaalsContact O-N 3.07Å; A298-D301 PolarHBondContact O-N 3.34Å; D301-L303 PolarHBondContact O-N 2.9Å; D301-Q304 PolarHBondContact O-N 3.16Å; D301-K305 WeakPolarHBondContact O-CB 3.44Å; D301-K305 WeakPolarHBondContact O-CG 3.08Å; D301-K305 PolarHBondContact O-N 3.21Å; D301-K305 WeakPolarHBondContact OD1-CE 3.35Å; D301-K305 IonicContact OD1-NZ 2.97Å; D301-K305 PolarHBondContact OD1-NZ 3.33Å; D301-K305 WeakPolarHBondContact OD2-CE 3.32Å; D301-K305 IonicContact OD2-NZ 3.67Å; D301-K305 PolarHBondContact OD2-NZ 3.11Å
302	R	85.3	Confident	84.2	Confident	116 Å²	116	70 Å²	70	44%	0.438	35%	0.345	S	S	.	.	H	α-helix	trans	-56.7	-50.4	174.3	-167.4	-170.6	-67	-175.1	2	111.1	D32 A298 L299 Q306	D32-R302 IonicContact OD2-CZ 3.57Å; D32-R302 IonicContact OD2-NH1 2.66Å; D32-R302 PolarHBondContact OD2-NH1 3.47Å; D32-R302 IonicContact OD2-NH2 2.65Å; A298-R302 WeakPolarHBondContact O-CB 3.36Å; A298-R302 PolarHBondContact O-N 2.81Å; L299-R302 PolarHBondContact O-N 2.95Å; R302-Q306 WeakPolarHBondContact O-CB 3.48Å; R302-Q306 PolarHBondContact O-N 3.13Å
303	L	85.8	Confident	83.9	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-63.2	-40.9	177.9	-78	167.8	0	0	0	113	F22 L29 L31 L299 R300 D301 Q306 M307 C728 A731 L732 I735	F22-L303 HydrophobicContact CZ-CD2 4.04Å; L29-L303 HydrophobicContact CD2-CD2 3.91Å; L31-L303 HydrophobicContact CD1-CD1 4.3Å; L31-L303 HydrophobicContact CD1-CD2 4.2Å; L31-L303 HydrophobicContact CD2-CD2 4.18Å; L31-L303 HydrophobicContact CD2-CG 4.44Å; L299-L303 HydrophobicContact CG-CD1 4.23Å; L299-L303 WeakPolarHBondContact O-CB 3.41Å; L299-L303 WeakPolarHBondContact O-CG 3.19Å; L299-L303 PolarHBondContact O-N 3.14Å; R300-L303 PolarHBondContact O-N 2.95Å; D301-L303 PolarHBondContact O-N 2.9Å; L303-Q306 PolarHBondContact O-N 3.37Å; L303-M307 WeakPolarHBondContact O-CB 3.49Å; L303-M307 PolarHBondContact O-N 3.21Å; L303-C728 HydrophobicContact CD2-CB 4.41Å; L303-A731 HydrophobicContact CD1-CB 3.94Å; L303-A731 HydrophobicContact CD2-CB 4.38Å; L303-L732 HydrophobicContact CB-CD1 4.37Å; L303-L732 HydrophobicContact CB-CD2 3.85Å; L303-L732 HydrophobicContact CB-CG 4.01Å; L303-I735 HydrophobicContact CD1-CD1 3.77Å
304	Q	89.3	Confident	83.7	Confident	97 Å²	97	68.5 Å²	68.5	45%	0.453	34%	0.344	S	S	.	.	H	α-helix	trans	-68.5	-40	-179	-173	171.8	-30.3	0	0	111.8	R300 D301 L308 L732	R300-Q304 VanDerWaalsContact O-CB 3.3Å; R300-Q304 WeakPolarHBondContact O-CB 3.36Å; R300-Q304 PolarHBondContact O-N 3.34Å; D301-Q304 PolarHBondContact O-N 3.16Å; Q304-L308 WeakPolarHBondContact O-CB 3.18Å; Q304-L308 PolarHBondContact O-N 3.45Å; Q304-L732 HydrophobicContact CB-CD1 4.34Å; Q304-L732 HydrophobicContact CB-CD2 4.14Å
305	K	89.1	Confident	83.2	Confident	121 Å²	121	65.5 Å²	65.5	53%	0.526	33%	0.334	S	S	.	.	H	α-helix	trans	-63.5	-45.2	172.8	-75.3	166.5	175.9	162.2	0	111.7	D301 L308 L309	D301-K305 WeakPolarHBondContact O-CB 3.44Å; D301-K305 WeakPolarHBondContact O-CG 3.08Å; D301-K305 PolarHBondContact O-N 3.21Å; D301-K305 WeakPolarHBondContact OD1-CE 3.35Å; D301-K305 IonicContact OD1-NZ 2.97Å; D301-K305 PolarHBondContact OD1-NZ 3.33Å; D301-K305 WeakPolarHBondContact OD2-CE 3.32Å; D301-K305 IonicContact OD2-NZ 3.67Å; D301-K305 PolarHBondContact OD2-NZ 3.11Å; K305-L308 PolarHBondContact O-N 2.97Å; K305-L309 WeakPolarHBondContact O-CG 3.34Å; K305-L309 PolarHBondContact O-N 3.34Å; K305-L309 VanDerWaalsContact O-N 3.08Å
306	Q	85.5	Confident	82.7	Confident	48 Å²	48	70.5 Å²	70.5	22%	0.224	36%	0.357	C	S	.	.	H	α-helix	trans	-65.3	-42.9	178.3	-174.8	169.6	-8.8	0	0	112.2	L29 R302 L303 L308 L309 L310 M724	L29-Q306 VanDerWaalsContact CD1-NE2 3.31Å; R302-Q306 WeakPolarHBondContact O-CB 3.48Å; R302-Q306 PolarHBondContact O-N 3.13Å; L303-Q306 PolarHBondContact O-N 3.37Å; Q306-L308 VanDerWaalsContact C-N 3.33Å; Q306-L308 PolarHBondContact O-N 2.97Å; Q306-L309 PolarHBondContact O-N 3.01Å; Q306-L310 HydrophobicContact CG-CD1 3.9Å; Q306-L310 WeakPolarHBondContact O-CB 3.33Å; Q306-L310 WeakPolarHBondContact O-CD1 3.45Å; Q306-L310 VanDerWaalsContact O-CG 3.25Å; Q306-L310 WeakPolarHBondContact O-CG 3.28Å; Q306-L310 PolarHBondContact O-N 3.43Å; Q306-M724 PolarHBondContact NE2-SD 2.93Å
307	M	86.3	Confident	82	Confident	37 Å²	37	71.7 Å²	71.7	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-59.6	-42.3	174	-170.4	-165.1	73.5	0	0	111.7	L303 L310 E311 Y725 C728 K729 L732	L303-M307 WeakPolarHBondContact O-CB 3.49Å; L303-M307 PolarHBondContact O-N 3.21Å; M307-L310 PolarHBondContact O-N 3.44Å; M307-E311 VanDerWaalsContact O-CB 3.31Å; M307-E311 WeakPolarHBondContact O-CB 3.41Å; M307-E311 PolarHBondContact O-N 2.94Å; M307-Y725 HydrophobicContact CG-CD2 4.18Å; M307-Y725 HydrophobicContact CG-CE2 4.11Å; M307-C728 HydrophobicContact CB-CB 3.95Å; M307-C728 HydrophobicContact CG-CB 4.35Å; M307-K729 HydrophobicContact SD-CB 4.18Å; M307-K729 HydrophobicContact SD-CG 4.4Å; M307-L732 HydrophobicContact CB-CD1 3.92Å; M307-L732 HydrophobicContact CE-CD1 4.28Å; M307-L732 HydrophobicContact CG-CD1 4.31Å; M307-L732 HydrophobicContact SD-CD1 3.61Å
308	L	87.2	Confident	80.8	Confident	122 Å²	122	72.8 Å²	72.8	64%	0.639	36%	0.356	S	S	*	.	H	α-helix	trans	-66.3	-40.7	-179.2	-176.9	66	0	0	0	112.7	Q304 K305 Q306 E311	Q304-L308 WeakPolarHBondContact O-CB 3.18Å; Q304-L308 PolarHBondContact O-N 3.45Å; K305-L308 PolarHBondContact O-N 2.97Å; Q306-L308 VanDerWaalsContact C-N 3.33Å; Q306-L308 PolarHBondContact O-N 2.97Å; L308-E311 PolarHBondContact O-N 2.94Å
309	L	85.9	Confident	79.6	Confident	131 Å²	131	75.9 Å²	75.9	69%	0.686	36%	0.363	S	S	*	.	H	α-helix	trans	-61.2	-50.4	173.7	-70.6	169.5	0	0	0	110.6	K305 Q306 E311 K312	K305-L309 WeakPolarHBondContact O-CG 3.34Å; K305-L309 PolarHBondContact O-N 3.34Å; K305-L309 VanDerWaalsContact O-N 3.08Å; Q306-L309 PolarHBondContact O-N 3.01Å; L309-E311 VanDerWaalsContact C-N 3.29Å; L309-E311 PolarHBondContact O-N 2.84Å; L309-K312 PolarHBondContact O-N 2.89Å
310	L	83.9	Confident	78.4	Confident	23 Å²	23	77.6 Å²	77.6	12%	0.12	37%	0.37	C	S	.	.	H	α-helix	trans	-63.9	-31.7	178.1	-66.6	164.5	0	0	0	112.7	Q306 M307 K312 D313 V314 M721 M724 Y725	Q306-L310 HydrophobicContact CG-CD1 3.9Å; Q306-L310 WeakPolarHBondContact O-CB 3.33Å; Q306-L310 WeakPolarHBondContact O-CD1 3.45Å; Q306-L310 VanDerWaalsContact O-CG 3.25Å; Q306-L310 WeakPolarHBondContact O-CG 3.28Å; Q306-L310 PolarHBondContact O-N 3.43Å; M307-L310 PolarHBondContact O-N 3.44Å; L310-K312 VanDerWaalsContact C-N 3.29Å; L310-K312 PolarHBondContact O-N 2.91Å; L310-D313 PolarHBondContact O-N 2.94Å; L310-V314 WeakPolarHBondContact O-CB 3.45Å; L310-V314 VanDerWaalsContact O-CG2 3.25Å; L310-V314 WeakPolarHBondContact O-CG2 3.49Å; L310-V314 PolarHBondContact O-N 3.27Å; L310-M721 HydrophobicContact CD2-CG 3.48Å; L310-M721 VanDerWaalsContact CD2-CG 3.48Å; L310-M721 HydrophobicContact CD2-SD 4.38Å; L310-M724 HydrophobicContact CD1-CB 4.19Å; L310-M724 HydrophobicContact CD1-CG 3.5Å; L310-M724 VanDerWaalsContact CD1-CG 3.5Å; L310-M724 HydrophobicContact CD2-CG 4.4Å; L310-Y725 HydrophobicContact CB-CD2 4.23Å
311	E	83.1	Confident	77.1	Confident	59 Å²	59	82.4 Å²	82.4	28%	0.276	39%	0.388	S	S	.	.	H	α-helix	trans	-64.3	-33.1	-178.1	-177.9	132.6	-113.8	0	0	112.7	M307 L308 L309 A315 K318 Y725	M307-E311 VanDerWaalsContact O-CB 3.31Å; M307-E311 WeakPolarHBondContact O-CB 3.41Å; M307-E311 PolarHBondContact O-N 2.94Å; L308-E311 PolarHBondContact O-N 2.94Å; L309-E311 VanDerWaalsContact C-N 3.29Å; L309-E311 PolarHBondContact O-N 2.84Å; E311-A315 VanDerWaalsContact O-CB 3.3Å; E311-A315 WeakPolarHBondContact O-CB 3.43Å; E311-A315 PolarHBondContact O-N 3.45Å; E311-K318 IonicContact OE1-NZ 2.69Å; E311-K318 PolarHBondContact OE1-NZ 2.8Å; E311-Y725 HydrophobicContact CB-CD2 4.44Å; E311-Y725 HydrophobicContact CB-CE2 3.88Å; E311-Y725 HydrophobicContact CG-CE2 4.2Å; E311-Y725 PolarHBondContact OE1-OH 2.8Å
312	K	77.8	Confident	75.8	Confident	144 Å²	144	81.6 Å²	81.6	63%	0.626	39%	0.387	S	S	*	.	H	α-helix	trans	-59.6	-54.8	174.3	-177.7	-160.7	162.2	-124.3	0	110.3	L309 L310 A315	L309-K312 PolarHBondContact O-N 2.89Å; L310-K312 VanDerWaalsContact C-N 3.29Å; L310-K312 PolarHBondContact O-N 2.91Å; K312-A315 WeakPolarHBondContact O-CB 3.35Å; K312-A315 PolarHBondContact O-N 3.34Å
313	D	75.7	Confident	74.7	Confident	60 Å²	60	82.2 Å²	82.2	32%	0.321	40%	0.399	S	S	.	.	H	α-helix	trans	-74.2	-37.6	-173.9	-53.6	-24.9	0	0	0	110.3	L310 A315 E316 Y317 M721	L310-D313 PolarHBondContact O-N 2.94Å; D313-A315 VanDerWaalsContact C-N 3.26Å; D313-A315 PolarHBondContact O-N 3.39Å; D313-E316 WeakPolarHBondContact O-CB 3.44Å; D313-E316 PolarHBondContact O-N 3.08Å; D313-Y317 WeakPolarHBondContact O-CD2 3.24Å; D313-M721 HydrophobicContact CB-CE 3.64Å; D313-M721 HydrophobicContact CB-SD 3.69Å
314	V	78.3	Confident	74.2	Confident	2 Å²	2	84.6 Å²	84.6	1%	0.012	41%	0.412	C	S	.	.	H	α-helix	trans	-63.6	-26.1	171	171.2	0	0	0	0	112.3	L310 E316 Y317 K318 M721 L722 Y725	L310-V314 WeakPolarHBondContact O-CB 3.45Å; L310-V314 VanDerWaalsContact O-CG2 3.25Å; L310-V314 WeakPolarHBondContact O-CG2 3.49Å; L310-V314 PolarHBondContact O-N 3.27Å; V314-E316 VanDerWaalsContact C-N 3.27Å; V314-E316 PolarHBondContact O-N 3.18Å; V314-Y317 CarbonylContact O-C 3.59Å; V314-Y317 WeakPolarHBondContact O-CA 3.5Å; V314-Y317 PolarHBondContact O-N 2.81Å; V314-K318 HydrophobicContact CG1-CG 4.12Å; V314-K318 WeakPolarHBondContact O-CG 3.32Å; V314-K318 PolarHBondContact O-N 2.78Å; V314-M721 HydrophobicContact CG2-CE 3.76Å; V314-L722 HydrophobicContact CG1-CD2 3.84Å; V314-L722 HydrophobicContact CG2-CD2 4.13Å; V314-Y725 HydrophobicContact CB-CD2 4.41Å; V314-Y725 HydrophobicContact CB-CG 4.3Å; V314-Y725 HydrophobicContact CG1-CD1 3.89Å; V314-Y725 HydrophobicContact CG1-CD2 4.48Å; V314-Y725 HydrophobicContact CG1-CE1 4.06Å; V314-Y725 HydrophobicContact CG1-CG 4.12Å; V314-Y725 HydrophobicContact CG2-CD1 4.43Å; V314-Y725 HydrophobicContact CG2-CD2 4.34Å; V314-Y725 HydrophobicContact CG2-CG 3.94Å
315	A	72.6	Confident	73.8	Confident	50 Å²	50	83.3 Å²	83.3	41%	0.413	41%	0.412	S	S	.	.	H	α-helix	trans	-63.5	-33.6	174.7	0	0	0	0	0	112.6	E311 K312 D313 Y317 K318	E311-A315 VanDerWaalsContact O-CB 3.3Å; E311-A315 WeakPolarHBondContact O-CB 3.43Å; E311-A315 PolarHBondContact O-N 3.45Å; K312-A315 WeakPolarHBondContact O-CB 3.35Å; K312-A315 PolarHBondContact O-N 3.34Å; D313-A315 VanDerWaalsContact C-N 3.26Å; D313-A315 PolarHBondContact O-N 3.39Å; A315-Y317 VanDerWaalsContact C-N 3.25Å; A315-Y317 PolarHBondContact O-N 3.24Å; A315-K318 PolarHBondContact O-N 2.59Å
316	E	68.2	Low	73.4	Confident	123 Å²	123	80.9 Å²	80.9	58%	0.575	41%	0.414	S	S	*	.	H	α-helix	trans	-65.8	-32.3	172.6	-53.8	-171.4	180	0	0	111.6	D313 V314	D313-E316 WeakPolarHBondContact O-CB 3.44Å; D313-E316 PolarHBondContact O-N 3.08Å; V314-E316 VanDerWaalsContact C-N 3.27Å; V314-E316 PolarHBondContact O-N 3.18Å
317	Y	68.2	Low	73.1	Confident	49 Å²	49	82.8 Å²	82.8	19%	0.192	42%	0.419	C	S	.	.	H	α-helix	trans	-87.9	-19.5	178	-61.9	-67.3	0	0	0	115.3	D313 V314 A315 N319 Y320 R718 M721	D313-Y317 WeakPolarHBondContact O-CD2 3.24Å; V314-Y317 CarbonylContact O-C 3.59Å; V314-Y317 WeakPolarHBondContact O-CA 3.5Å; V314-Y317 PolarHBondContact O-N 2.81Å; A315-Y317 VanDerWaalsContact C-N 3.25Å; A315-Y317 PolarHBondContact O-N 3.24Å; Y317-N319 PolarHBondContact O-N 2.81Å; Y317-Y320 HydrophobicContact CD1-CD2 4.47Å; Y317-Y320 HydrophobicContact CD1-CG 4.2Å; Y317-Y320 WeakPolarHBondContact O-CB 3.49Å; Y317-Y320 PolarHBondContact O-N 2.97Å; Y317-R718 VanDerWaalsContact CD1-CD 3.46Å; Y317-R718 HydrophobicContact CD1-CG 3.69Å; Y317-R718 HydrophobicContact CE1-CB 4.12Å; Y317-R718 VanDerWaalsContact CE1-CD 3.46Å; Y317-R718 HydrophobicContact CE1-CG 3.66Å; Y317-R718 HydrophobicContact CG-CG 4.22Å; Y317-M721 HydrophobicContact CD2-CE 3.37Å; Y317-M721 HydrophobicContact CE2-CE 3.34Å
318	K	58.2	Low	73	Confident	109 Å²	109	82.5 Å²	82.5	47%	0.474	42%	0.417	S	S	.	.	H	α-helix	trans	-59.4	-30	177.6	-82.4	170.9	-173.2	158.6	0	112.7	E311 V314 A315	E311-K318 IonicContact OE1-NZ 2.69Å; E311-K318 PolarHBondContact OE1-NZ 2.8Å; V314-K318 HydrophobicContact CG1-CG 4.12Å; V314-K318 WeakPolarHBondContact O-CG 3.32Å; V314-K318 PolarHBondContact O-N 2.78Å; A315-K318 PolarHBondContact O-N 2.59Å
319	N	57.8	Low	73	Confident	129 Å²	129	78.6 Å²	78.6	69%	0.69	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	12.7	175.1	-67.8	-25.9	0	0	0	113	Y317 R321 R327	Y317-N319 PolarHBondContact O-N 2.81Å; N319-R321 PolarHBondContact O-N 3.1Å; N319-R327 VanDerWaalsContact C-NH2 3.27Å; N319-R327 PolarHBondContact O-NH2 2.8Å
320	Y	57.4	Low	73	Confident	45 Å²	45	78.6 Å²	78.6	18%	0.176	39%	0.392	C	S	.	.			trans	-83.5	100.8	-176.6	-174.6	-100.5	0	0	0	111.3	Y317 P322 E710	Y317-Y320 HydrophobicContact CD1-CD2 4.47Å; Y317-Y320 HydrophobicContact CD1-CG 4.2Å; Y317-Y320 WeakPolarHBondContact O-CB 3.49Å; Y317-Y320 PolarHBondContact O-N 2.97Å; Y320-P322 HydrophobicContact CE1-CB 3.88Å; Y320-P322 HydrophobicContact CE1-CG 4.45Å; Y320-E710 PolarHBondContact OH-OE1 2.98Å; Y320-E710 PolarHBondContact OH-OE2 3.39Å
321	R	57.9	Low	73.2	Confident	190 Å²	190	78.4 Å²	78.4	72%	0.717	39%	0.394	S	S	*	.			trans	-91.2	123.7	154.5	-66.6	178.4	-179.1	-174.7	-0.6	106.9	N319 D323 D324	N319-R321 PolarHBondContact O-N 3.1Å; R321-D323 PolarHBondContact O-N 2.93Å; R321-D324 HydrophobicContact CB-CB 4Å
322	P	57.5	Low	73.5	Confident	59 Å²	59	75.6 Å²	75.6	38%	0.383	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-31.6	172.9	25.2	-30.5	0	0	0	111	Y320 D324 K328	Y320-P322 HydrophobicContact CE1-CB 3.88Å; Y320-P322 HydrophobicContact CE1-CG 4.45Å; P322-D324 VanDerWaalsContact C-N 3.32Å; P322-D324 PolarHBondContact O-N 3.25Å; P322-K328 VanDerWaalsContact O-CE 3.22Å; P322-K328 WeakPolarHBondContact O-CE 3.29Å
323	D	63.6	Low	74.1	Confident	129 Å²	129	71.5 Å²	71.5	69%	0.69	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	26.8	-176.2	-33.3	-65.1	0	0	0	113.2	R321 P325	R321-D323 PolarHBondContact O-N 2.93Å; D323-P325 VanDerWaalsContact O-CD 3.3Å; D323-P325 WeakPolarHBondContact O-CD 3.24Å
324	D	75.9	Confident	74.9	Confident	50 Å²	50	73.5 Å²	73.5	27%	0.267	37%	0.373	S	S	.	.			trans	-90.5	105.8	173.2	173.9	-5.1	0	0	0	109.8	R321 P322 A326 R327 K328	R321-D324 HydrophobicContact CB-CB 4Å; P322-D324 VanDerWaalsContact C-N 3.32Å; P322-D324 PolarHBondContact O-N 3.25Å; D324-A326 VanDerWaalsContact C-N 3.28Å; D324-A326 PolarHBondContact O-N 2.67Å; D324-A326 WeakPolarHBondContact OD1-CB 3.35Å; D324-A326 PolarHBondContact OD1-N 2.92Å; D324-R327 HydrophobicContact CB-CB 3.87Å; D324-R327 VanDerWaalsContact CG-CB 3.46Å; D324-R327 PolarHBondContact O-N 3.46Å; D324-R327 PolarHBondContact OD1-N 2.88Å; D324-R327 WeakPolarHBondContact OD2-CB 3.44Å; D324-K328 PolarHBondContact O-N 3.35Å
325	P	78.8	Confident	75.5	Confident	70 Å²	70	76 Å²	76	46%	0.455	39%	0.385	S	S	.	.	H	α-helix	trans	-67	-31.8	-175	-19.5	34.1	0	0	0	111.9	D323 K328 T329 Q704	D323-P325 VanDerWaalsContact O-CD 3.3Å; D323-P325 WeakPolarHBondContact O-CD 3.24Å; P325-K328 PolarHBondContact O-N 3.24Å; P325-T329 PolarHBondContact O-N 3.01Å; P325-T329 PolarHBondContact O-OG1 3.42Å; P325-Q704 PolarHBondContact O-NE2 2.83Å
326	A	82.6	Confident	76.5	Confident	69 Å²	69	74 Å²	74	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-71.8	-36.5	179.8	0	0	0	0	0	111.4	D324 K330	D324-A326 VanDerWaalsContact C-N 3.28Å; D324-A326 PolarHBondContact O-N 2.67Å; D324-A326 WeakPolarHBondContact OD1-CB 3.35Å; D324-A326 PolarHBondContact OD1-N 2.92Å; A326-K330 WeakPolarHBondContact O-CB 3.48Å; A326-K330 PolarHBondContact O-N 3.37Å
327	R	78.4	Confident	77.7	Confident	88 Å²	88	74.4 Å²	74.4	33%	0.332	37%	0.37	S	S	.	.	H	α-helix	trans	-63.5	-44.5	168.9	179.9	-177.1	-77.4	-112.2	8.2	111.1	N319 D324 K330 A331	N319-R327 VanDerWaalsContact C-NH2 3.27Å; N319-R327 PolarHBondContact O-NH2 2.8Å; D324-R327 HydrophobicContact CB-CB 3.87Å; D324-R327 VanDerWaalsContact CG-CB 3.46Å; D324-R327 PolarHBondContact O-N 3.46Å; D324-R327 PolarHBondContact OD1-N 2.88Å; D324-R327 WeakPolarHBondContact OD2-CB 3.44Å; R327-K330 PolarHBondContact O-N 2.91Å; R327-A331 VanDerWaalsContact O-CB 3.32Å; R327-A331 WeakPolarHBondContact O-CB 3.34Å; R327-A331 PolarHBondContact O-N 3.32Å
328	K	83.7	Confident	78.9	Confident	32 Å²	32	76.3 Å²	76.3	14%	0.139	38%	0.381	C	S	.	.	H	α-helix	trans	-60.1	-48.5	175.4	-79.1	-178.9	171.6	-179.5	0	112	P322 D324 P325 K330 A331 M332 D705 M708	P322-K328 VanDerWaalsContact O-CE 3.22Å; P322-K328 WeakPolarHBondContact O-CE 3.29Å; D324-K328 PolarHBondContact O-N 3.35Å; P325-K328 PolarHBondContact O-N 3.24Å; K328-K330 PolarHBondContact O-N 3.14Å; K328-A331 PolarHBondContact O-N 3.15Å; K328-M332 WeakPolarHBondContact O-CB 3.47Å; K328-M332 PolarHBondContact O-N 2.92Å; K328-D705 WeakPolarHBondContact CD-OD1 3.26Å; K328-D705 WeakPolarHBondContact CE-OD1 3.43Å; K328-D705 PolarHBondContact NZ-O 3.43Å; K328-D705 IonicContact NZ-OD1 3.72Å; K328-D705 PolarHBondContact NZ-OD1 3.23Å; K328-M708 HydrophobicContact CB-CB 4.09Å; K328-M708 HydrophobicContact CB-CG 4.09Å; K328-M708 HydrophobicContact CD-CB 3.89Å; K328-M708 HydrophobicContact CG-CB 3.77Å; K328-M708 HydrophobicContact CG-CG 4.34Å
329	T	86.7	Confident	80.7	Confident	39 Å²	39	71.2 Å²	71.2	24%	0.239	36%	0.358	C	S	.	.	H	α-helix	trans	-57.7	-49	175.9	-55.3	0	0	0	0	111.3	P325 A331 M332 L333 Q704	P325-T329 PolarHBondContact O-N 3.01Å; P325-T329 PolarHBondContact O-OG1 3.42Å; T329-A331 PolarHBondContact O-N 2.92Å; T329-M332 PolarHBondContact O-N 3.39Å; T329-L333 HydrophobicContact CG2-CD1 4.01Å; T329-L333 HydrophobicContact CG2-CG 4.46Å; T329-L333 VanDerWaalsContact O-CG 3.29Å; T329-L333 WeakPolarHBondContact O-CG 2.95Å; T329-L333 PolarHBondContact O-N 3.42Å; T329-Q704 VanDerWaalsContact OG1-CD 3.24Å; T329-Q704 PolarHBondContact OG1-NE2 2.95Å; T329-Q704 PolarHBondContact OG1-OE1 3.25Å
330	K	87.6	Confident	82.4	Confident	131 Å²	131	65.7 Å²	65.7	57%	0.57	33%	0.33	S	S	*	.	H	α-helix	trans	-61.6	-44.7	179	-175.9	179.6	176.2	-179	0	111.9	A326 R327 K328 L333 Q334	A326-K330 WeakPolarHBondContact O-CB 3.48Å; A326-K330 PolarHBondContact O-N 3.37Å; R327-K330 PolarHBondContact O-N 2.91Å; K328-K330 PolarHBondContact O-N 3.14Å; K330-L333 PolarHBondContact O-N 3.32Å; K330-Q334 HydrophobicContact CG-CG 4.5Å; K330-Q334 WeakPolarHBondContact O-CG 3.35Å; K330-Q334 PolarHBondContact O-N 3.4Å
331	A	86.7	Confident	84	Confident	20 Å²	20	65.7 Å²	65.7	17%	0.165	34%	0.339	C	S	.	.	H	α-helix	trans	-63	-43.4	177.8	0	0	0	0	0	111.5	R327 K328 T329 Q334 M335 M708	R327-A331 VanDerWaalsContact O-CB 3.32Å; R327-A331 WeakPolarHBondContact O-CB 3.34Å; R327-A331 PolarHBondContact O-N 3.32Å; K328-A331 PolarHBondContact O-N 3.15Å; T329-A331 PolarHBondContact O-N 2.92Å; A331-Q334 PolarHBondContact O-N 3.25Å; A331-M335 WeakPolarHBondContact O-CB 3.3Å; A331-M335 WeakPolarHBondContact O-CG 3.25Å; A331-M335 PolarHBondContact O-N 2.99Å; A331-M708 HydrophobicContact CB-CE 3.7Å
332	M	90	Very high	85.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.3	-48.6	175.6	-166.8	176.9	73.2	0	0	111.5	K328 T329 Q334 M335 V336 L456 L695 Y699 Q704 M708	K328-M332 WeakPolarHBondContact O-CB 3.47Å; K328-M332 PolarHBondContact O-N 2.92Å; T329-M332 PolarHBondContact O-N 3.39Å; M332-Q334 VanDerWaalsContact C-N 3.35Å; M332-Q334 PolarHBondContact O-N 2.82Å; M332-M335 PolarHBondContact O-N 3.33Å; M332-V336 WeakPolarHBondContact O-CG2 3.34Å; M332-V336 PolarHBondContact O-N 3.4Å; M332-L456 HydrophobicContact CG-CD1 4Å; M332-L456 HydrophobicContact CG-CD2 4.37Å; M332-L456 HydrophobicContact SD-CD1 4.48Å; M332-L695 HydrophobicContact CE-CD1 4.07Å; M332-Y699 HydrophobicContact CE-CD1 4.19Å; M332-Y699 HydrophobicContact CE-CE1 3.58Å; M332-Y699 HydrophobicContact CE-CE2 4.01Å; M332-Y699 VanDerWaalsContact CE-CZ 3.47Å; M332-Q704 HydrophobicContact CE-CG 4.35Å; M332-Q704 HydrophobicContact SD-CG 4.13Å; M332-M708 HydrophobicContact CB-CE 4.19Å; M332-M708 HydrophobicContact CB-CG 4.33Å; M332-M708 HydrophobicContact CB-SD 3.64Å; M332-M708 HydrophobicContact CG-SD 3.91Å
333	L	90.7	Very high	87.4	Confident	57 Å²	57	54.8 Å²	54.8	30%	0.298	29%	0.292	S	S	.	.	H	α-helix	trans	-58.5	-44.7	176.9	-70.6	169.9	0	0	0	112	T329 K330 V336 Q337 L695	T329-L333 HydrophobicContact CG2-CD1 4.01Å; T329-L333 HydrophobicContact CG2-CG 4.46Å; T329-L333 VanDerWaalsContact O-CG 3.29Å; T329-L333 WeakPolarHBondContact O-CG 2.95Å; T329-L333 PolarHBondContact O-N 3.42Å; K330-L333 PolarHBondContact O-N 3.32Å; L333-V336 PolarHBondContact O-N 3.38Å; L333-Q337 WeakPolarHBondContact O-CB 3.09Å; L333-Q337 VanDerWaalsContact O-CG 3.24Å; L333-Q337 WeakPolarHBondContact O-CG 3.36Å; L333-Q337 PolarHBondContact O-N 2.95Å; L333-L695 HydrophobicContact CD2-CD1 3.9Å; L333-L695 HydrophobicContact CD2-CD2 3.5Å; L333-L695 VanDerWaalsContact CD2-CD2 3.5Å; L333-L695 HydrophobicContact CD2-CG 4.36Å
334	Q	91.5	Very high	88.8	Confident	103 Å²	103	52.5 Å²	52.5	48%	0.481	28%	0.277	S	S	.	.	H	α-helix	trans	-67.6	-37.7	178.3	-70	-174	-84.9	0	0	112.6	K330 A331 M332 Q338	K330-Q334 HydrophobicContact CG-CG 4.5Å; K330-Q334 WeakPolarHBondContact O-CG 3.35Å; K330-Q334 PolarHBondContact O-N 3.4Å; A331-Q334 PolarHBondContact O-N 3.25Å; M332-Q334 VanDerWaalsContact C-N 3.35Å; M332-Q334 PolarHBondContact O-N 2.82Å; Q334-Q338 VanDerWaalsContact O-CB 3.29Å; Q334-Q338 WeakPolarHBondContact O-CB 3.19Å; Q334-Q338 PolarHBondContact O-N 3.36Å
335	M	92.3	Very high	89.4	Confident	54 Å²	54	55.1 Å²	55.1	27%	0.266	29%	0.286	S	S	.	.	H	α-helix	trans	-65	-45.4	174.6	-69.1	-70.7	95.5	0	0	111.5	A331 M332 Q338 F339 M450 Y453 L456	A331-M335 WeakPolarHBondContact O-CB 3.3Å; A331-M335 WeakPolarHBondContact O-CG 3.25Å; A331-M335 PolarHBondContact O-N 2.99Å; M332-M335 PolarHBondContact O-N 3.33Å; M335-Q338 PolarHBondContact O-N 3.03Å; M335-F339 PolarHBondContact O-N 3.01Å; M335-M450 VanDerWaalsContact C-CE 3.47Å; M335-M450 HydrophobicContact CB-CE 3.96Å; M335-M450 HydrophobicContact CB-CG 4.34Å; M335-M450 VanDerWaalsContact O-CE 3.24Å; M335-M450 WeakPolarHBondContact O-CE 3.48Å; M335-Y453 HydrophobicContact CG-CD2 4.42Å; M335-L456 HydrophobicContact CB-CD2 3.9Å; M335-L456 HydrophobicContact CG-CD2 4.27Å
336	V	93.3	Very high	90	Very high	9 Å²	9	53.3 Å²	53.3	6%	0.055	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-47.1	177.3	174.3	0	0	0	0	110.7	M332 L333 Q338 F339 C340 M450 L694 L698	M332-V336 WeakPolarHBondContact O-CG2 3.34Å; M332-V336 PolarHBondContact O-N 3.4Å; L333-V336 PolarHBondContact O-N 3.38Å; V336-Q338 VanDerWaalsContact C-N 3.3Å; V336-Q338 PolarHBondContact O-N 3.18Å; V336-F339 PolarHBondContact O-N 2.89Å; V336-F339 VanDerWaalsContact O-N 3.14Å; V336-C340 PolarHBondContact O-N 3.27Å; V336-C340 PolarHBondContact O-SG 3.48Å; V336-M450 HydrophobicContact CG2-CE 4.36Å; V336-L694 HydrophobicContact CG1-CD2 4.36Å; V336-L698 HydrophobicContact CG2-CD1 3.5Å
337	Q	93.5	Very high	90.5	Very high	131 Å²	131	51 Å²	51	61%	0.612	25%	0.253	S	S	*	.	H	α-helix	trans	-58.4	-39.7	175.7	-75.1	173	-17	0	0	112.8	L333 C340 A341	L333-Q337 WeakPolarHBondContact O-CB 3.09Å; L333-Q337 VanDerWaalsContact O-CG 3.24Å; L333-Q337 WeakPolarHBondContact O-CG 3.36Å; L333-Q337 PolarHBondContact O-N 2.95Å; Q337-C340 PolarHBondContact O-N 2.93Å; Q337-A341 PolarHBondContact O-N 2.96Å; Q337-A341 VanDerWaalsContact O-N 3.11Å
338	Q	93	Very high	91	Very high	88 Å²	88	53.9 Å²	53.9	41%	0.411	27%	0.27	S	S	.	.	H	α-helix	trans	-65.4	-42.8	175.4	-175.2	60.2	51.8	0	0	111.7	Q334 M335 V336 A341 D342	Q334-Q338 VanDerWaalsContact O-CB 3.29Å; Q334-Q338 WeakPolarHBondContact O-CB 3.19Å; Q334-Q338 PolarHBondContact O-N 3.36Å; M335-Q338 PolarHBondContact O-N 3.03Å; V336-Q338 VanDerWaalsContact C-N 3.3Å; V336-Q338 PolarHBondContact O-N 3.18Å; Q338-A341 PolarHBondContact O-N 2.87Å; Q338-D342 PolarHBondContact NE2-OD1 3.42Å; Q338-D342 PolarHBondContact NE2-OD2 2.87Å; Q338-D342 WeakPolarHBondContact O-CB 3.33Å; Q338-D342 PolarHBondContact O-N 3.21Å
339	F	95.4	Very high	90.9	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.009	29%	0.287	C	S	.	.	H	α-helix	trans	-61.7	-42.5	175.5	175.4	-86.2	0	0	0	112.3	M335 V336 D342 F343 I443 C446 A447 M450 V460 V464 I690 L694	M335-F339 PolarHBondContact O-N 3.01Å; V336-F339 PolarHBondContact O-N 2.89Å; V336-F339 VanDerWaalsContact O-N 3.14Å; F339-D342 PolarHBondContact O-N 3.31Å; F339-F343 WeakPolarHBondContact O-CB 3.48Å; F339-F343 PolarHBondContact O-N 3.3Å; F339-I443 HydrophobicContact CZ-CG2 4.31Å; F339-C446 HydrophobicContact CD2-CB 3.62Å; F339-C446 HydrophobicContact CE2-CB 3.62Å; F339-C446 HydrophobicContact CG-CB 4.47Å; F339-C446 HydrophobicContact CZ-CB 4.47Å; F339-A447 HydrophobicContact CD2-CB 4.48Å; F339-A447 HydrophobicContact CE2-CB 4.1Å; F339-M450 HydrophobicContact CB-CE 3.61Å; F339-M450 HydrophobicContact CD2-CE 4.5Å; F339-M450 HydrophobicContact CG-CE 4.2Å; F339-V460 HydrophobicContact CD1-CG1 4.13Å; F339-V460 HydrophobicContact CD2-CG1 3.95Å; F339-V460 HydrophobicContact CE1-CG1 3.9Å; F339-V460 HydrophobicContact CE2-CG1 3.71Å; F339-V460 HydrophobicContact CG-CG1 4.16Å; F339-V460 HydrophobicContact CZ-CG1 3.69Å; F339-V464 HydrophobicContact CE1-CG2 4.08Å; F339-V464 HydrophobicContact CZ-CG2 4.23Å; F339-I690 HydrophobicContact CD1-CG2 3.95Å; F339-I690 HydrophobicContact CE1-CD1 4.13Å; F339-I690 HydrophobicContact CE1-CG1 4.2Å; F339-I690 HydrophobicContact CE1-CG2 3.9Å; F339-L694 HydrophobicContact CD1-CD2 4.03Å; F339-L694 HydrophobicContact CE1-CD2 4.08Å
340	C	93.5	Very high	90.1	Very high	13 Å²	13	55.5 Å²	55.5	9%	0.088	30%	0.295	C	S	.	.	H	α-helix	trans	-57.9	-51.1	174.4	-56.4	0	0	0	0	111.1	V336 Q337 D342 F343 E344 I690	V336-C340 PolarHBondContact O-N 3.27Å; V336-C340 PolarHBondContact O-SG 3.48Å; Q337-C340 PolarHBondContact O-N 2.93Å; C340-D342 PolarHBondContact O-N 2.98Å; C340-F343 PolarHBondContact O-N 2.89Å; C340-E344 WeakPolarHBondContact O-CB 3.16Å; C340-E344 PolarHBondContact O-N 3.46Å; C340-I690 HydrophobicContact CB-CG2 4Å; C340-I690 VanDerWaalsContact SG-CG2 3.5Å; C340-I690 PolarHBondContact SG-O 3.42Å; C340-I690 VanDerWaalsContact SG-O 3.37Å
341	A	92.2	Very high	88.6	Confident	45 Å²	45	55.7 Å²	55.7	37%	0.372	31%	0.313	S	S	.	.	H	α-helix	trans	-65.9	-36.8	-178.6	0	0	0	0	0	113.1	Q337 Q338 K345	Q337-A341 PolarHBondContact O-N 2.96Å; Q337-A341 VanDerWaalsContact O-N 3.11Å; Q338-A341 PolarHBondContact O-N 2.87Å; A341-K345 WeakPolarHBondContact O-CB 3.32Å; A341-K345 PolarHBondContact O-N 3.42Å
342	D	92.4	Very high	87.1	Confident	20 Å²	20	56.5 Å²	56.5	11%	0.107	32%	0.323	C	S	.	.	H	α-helix	trans	-71.3	-35.2	175.6	-77.8	-38.8	0	0	0	112.2	Q338 F339 C340 K345 S346 C446 N449	Q338-D342 PolarHBondContact NE2-OD1 3.42Å; Q338-D342 PolarHBondContact NE2-OD2 2.87Å; Q338-D342 WeakPolarHBondContact O-CB 3.33Å; Q338-D342 PolarHBondContact O-N 3.21Å; F339-D342 PolarHBondContact O-N 3.31Å; C340-D342 PolarHBondContact O-N 2.98Å; D342-K345 IonicContact OD1-NZ 3.83Å; D342-K345 PolarHBondContact OD1-NZ 3.19Å; D342-S346 VanDerWaalsContact O-CB 3.24Å; D342-S346 WeakPolarHBondContact O-CB 3.32Å; D342-S346 PolarHBondContact O-N 3.46Å; D342-C446 VanDerWaalsContact C-SG 3.58Å; D342-C446 HydrophobicContact CB-CB 4.31Å; D342-N449 PolarHBondContact OD2-ND2 3.33Å
343	F	93.9	Very high	85.4	Confident	1 Å²	1	66.2 Å²	66.2	0%	0.004	37%	0.365	C	S	.	.	H	α-helix	trans	-65.3	-53.3	174.5	-177.6	-93.6	0	0	0	111	F339 C340 K345 S346 I347 L439 V442 I443 T686 N687 I690	F339-F343 WeakPolarHBondContact O-CB 3.48Å; F339-F343 PolarHBondContact O-N 3.3Å; C340-F343 PolarHBondContact O-N 2.89Å; F343-K345 PolarHBondContact O-N 2.96Å; F343-S346 WeakPolarHBondContact O-CB 3.34Å; F343-S346 PolarHBondContact O-N 3.37Å; F343-I347 HydrophobicContact CD1-CG1 4.35Å; F343-I347 HydrophobicContact CE1-CG1 4.01Å; F343-I347 HydrophobicContact CE2-CG1 4.36Å; F343-I347 HydrophobicContact CZ-CD1 4.49Å; F343-I347 HydrophobicContact CZ-CG1 4.01Å; F343-I347 WeakPolarHBondContact O-CG1 3.16Å; F343-I347 PolarHBondContact O-N 3.13Å; F343-L439 HydrophobicContact CZ-CD2 4.25Å; F343-V442 HydrophobicContact CD2-CG1 3.75Å; F343-V442 HydrophobicContact CE2-CG1 3.98Å; F343-I443 HydrophobicContact CD2-CG1 4.33Å; F343-I443 HydrophobicContact CE2-CG1 3.94Å; F343-T686 HydrophobicContact CZ-CG2 4.09Å; F343-N687 HydrophobicContact CD1-CB 4.44Å; F343-N687 HydrophobicContact CE1-CB 4.07Å; F343-I690 HydrophobicContact CD1-CD1 3.64Å; F343-I690 HydrophobicContact CD2-CD1 3.97Å; F343-I690 HydrophobicContact CE1-CD1 3.73Å; F343-I690 HydrophobicContact CE2-CD1 4.06Å; F343-I690 HydrophobicContact CG-CD1 3.77Å; F343-I690 HydrophobicContact CZ-CD1 3.94Å
344	E	92	Very high	83.9	Confident	81 Å²	81	71.2 Å²	71.2	38%	0.379	39%	0.392	S	S	.	.	H	α-helix	trans	-52.2	-53	176.2	-174.8	-179.5	-175	0	0	111.2	C340 S346 I347 E348	C340-E344 WeakPolarHBondContact O-CB 3.16Å; C340-E344 PolarHBondContact O-N 3.46Å; E344-S346 VanDerWaalsContact C-N 3.28Å; E344-S346 PolarHBondContact O-N 2.99Å; E344-I347 PolarHBondContact O-N 3.15Å; E344-I347 VanDerWaalsContact O-N 3.14Å; E344-E348 PolarHBondContact O-N 2.88Å
345	K	90.1	Very high	82.9	Confident	105 Å²	105	70.9 Å²	70.9	46%	0.457	40%	0.397	S	S	.	.	H	α-helix	trans	-59.5	-29.5	176.1	175.9	-172.8	162.1	-156.6	0	114.4	A341 D342 F343 G349	A341-K345 WeakPolarHBondContact O-CB 3.32Å; A341-K345 PolarHBondContact O-N 3.42Å; D342-K345 IonicContact OD1-NZ 3.83Å; D342-K345 PolarHBondContact OD1-NZ 3.19Å; F343-K345 PolarHBondContact O-N 2.96Å; K345-G349 CarbonylContact O-C 3.41Å; K345-G349 WeakPolarHBondContact O-CA 3.39Å; K345-G349 PolarHBondContact O-N 2.97Å; K345-G349 VanDerWaalsContact O-N 3.14Å
346	S	91	Very high	81.6	Confident	32 Å²	32	71.2 Å²	71.2	22%	0.224	41%	0.405	C	S	.	.	H	α-helix	trans	-80.5	-28.4	177.9	-168.5	0	0	0	0	112.5	D342 F343 E344 G363 V442	D342-S346 VanDerWaalsContact O-CB 3.24Å; D342-S346 WeakPolarHBondContact O-CB 3.32Å; D342-S346 PolarHBondContact O-N 3.46Å; F343-S346 WeakPolarHBondContact O-CB 3.34Å; F343-S346 PolarHBondContact O-N 3.37Å; E344-S346 VanDerWaalsContact C-N 3.28Å; E344-S346 PolarHBondContact O-N 2.99Å; S346-G363 PolarHBondContact O-N 3.2Å; S346-V442 WeakPolarHBondContact OG-CG1 3.29Å
347	I	91.6	Very high	80.8	Confident	21 Å²	21	77.3 Å²	77.3	11%	0.108	44%	0.441	C	S	.	.	H	α-helix	trans	-89.3	-41.7	179.7	-62.3	-54.8	0	0	0	112.4	F343 E344 G363 I366 L439 V442 I683	F343-I347 HydrophobicContact CD1-CG1 4.35Å; F343-I347 HydrophobicContact CE1-CG1 4.01Å; F343-I347 HydrophobicContact CE2-CG1 4.36Å; F343-I347 HydrophobicContact CZ-CD1 4.49Å; F343-I347 HydrophobicContact CZ-CG1 4.01Å; F343-I347 WeakPolarHBondContact O-CG1 3.16Å; F343-I347 PolarHBondContact O-N 3.13Å; E344-I347 PolarHBondContact O-N 3.15Å; E344-I347 VanDerWaalsContact O-N 3.14Å; I347-G363 WeakPolarHBondContact O-CA 3.32Å; I347-I366 HydrophobicContact CD1-CD1 3.96Å; I347-L439 HydrophobicContact CD1-CD2 3.51Å; I347-L439 HydrophobicContact CG1-CD2 4.43Å; I347-V442 HydrophobicContact CD1-CB 4.47Å; I347-V442 HydrophobicContact CD1-CG1 4.11Å; I347-V442 HydrophobicContact CD1-CG2 4.15Å; I347-V442 HydrophobicContact CG1-CG1 4.49Å; I347-I683 HydrophobicContact CG2-CG2 3.51Å
348	E	89.2	Confident	79.9	Confident	147 Å²	147	78.4 Å²	78.4	69%	0.687	45%	0.451	S	S	*	.	H	α-helix	trans	-90.3	-17.3	-179.5	-56.5	-162.2	175.3	0	0	112.7	E344	E344-E348 PolarHBondContact O-N 2.88Å
349	G	82.7	Confident	79.2	Confident	48 Å²	48	79.8 Å²	79.8	50%	0.495	46%	0.458	S	S	.	.			trans	90.9	173.4	-173.2	0	0	0	0	0	112.3	K345	K345-G349 CarbonylContact O-C 3.41Å; K345-G349 WeakPolarHBondContact O-CA 3.39Å; K345-G349 PolarHBondContact O-N 2.97Å; K345-G349 VanDerWaalsContact O-N 3.14Å
350	S	69.3	Low	78.5	Confident	58 Å²	58	84 Å²	84	41%	0.406	48%	0.48	S	S	.	.			trans	-126	138.2	-174.6	-159.8	0	0	0	0	113.1	G352	S350-G352 PolarHBondContact OG-N 3.42Å; S350-G352 VanDerWaalsContact OG-N 3.11Å
351	S	55.8	Low	78.1	Confident	135 Å²	135	86.4 Å²	86.4	94%	0.944	50%	0.497	S	S	*	.			trans	-83.4	6.6	162.6	53.3	0	0	0	0	113.1
352	G	56.4	Low	77.9	Confident	36 Å²	36	84.3 Å²	84.3	37%	0.371	48%	0.479	S	S	.	.	S	Bend	trans	-71.5	170.9	178.7	0	0	0	0	0	114.3	S350	S350-G352 PolarHBondContact OG-N 3.42Å; S350-G352 VanDerWaalsContact OG-N 3.11Å
353	K	53.3	Low	77.9	Confident	204 Å²	204	84.1 Å²	84.1	89%	0.887	48%	0.482	S	S	*	.	S	Bend	trans	-73.1	-32.9	-174.6	-66	-175.8	178.5	-179.8	0	113.9	V355	K353-V355 PolarHBondContact O-N 2.65Å
354	D	60.2	Low	77.8	Confident	162 Å²	162	86.2 Å²	86.2	87%	0.866	50%	0.5	S	S	*	.			trans	-98.2	67.6	-169.5	-51.6	-67.1	0	0	0	110.9
355	V	69.7	Low	77.7	Confident	96 Å²	96	86.3 Å²	86.3	58%	0.582	50%	0.497	S	S	*	.			trans	-79.8	126.4	172.5	-179.8	0	0	0	0	109.1	K353 V357	K353-V355 PolarHBondContact O-N 2.65Å; V355-V357 PolarHBondContact O-N 2.94Å
356	S	65	Low	78	Confident	62 Å²	62	81.6 Å²	81.6	43%	0.434	48%	0.476	S	S	.	.			trans	-65.3	119.9	173.4	-173.4	0	0	0	0	110.4	E359	S356-E359 PolarHBondContact OG-N 3.03Å
357	V	76.5	Confident	78.1	Confident	136 Å²	136	84.3 Å²	84.3	82%	0.824	49%	0.488	S	S	*	.	S	Bend	trans	-93.3	-5.6	173	-75.5	0	0	0	0	113	V355	V355-V357 PolarHBondContact O-N 2.94Å
358	N	74.9	Confident	78.1	Confident	154 Å²	154	86.5 Å²	86.5	82%	0.824	50%	0.495	S	S	*	.	S	Bend	trans	-102	-28.4	-172	-63.7	-23.3	0	0	0	113.4
359	E	78.1	Confident	78.3	Confident	117 Å²	117	80.9 Å²	80.9	55%	0.547	47%	0.47	S	S	.	.			trans	-147	152.4	-179.2	68.1	176.9	131.1	0	0	112.2	S356 R365	S356-E359 PolarHBondContact OG-N 3.03Å; E359-R365 IonicContact OE2-NH2 3.61Å; E359-R365 PolarHBondContact OE2-NH2 3.01Å
360	L	81	Confident	78.9	Confident	92 Å²	92	79.4 Å²	79.4	48%	0.482	45%	0.45	S	S	.	.			trans	-77.9	147.2	164	-54.5	178.8	0	0	0	108.8	A364 R365	L360-A364 HydrophobicContact CB-CB 4.11Å; L360-A364 HydrophobicContact CD2-CB 4.2Å; L360-R365 HydrophobicContact CB-CG 3.9Å; L360-R365 PolarHBondContact O-NE 3.05Å; L360-R365 PolarHBondContact O-NH2 3.35Å
361	S	84.1	Confident	79.9	Confident	62 Å²	62	83 Å²	83	43%	0.434	46%	0.46	S	S	.	.			trans	-142.3	155.5	174.9	58.7	0	0	0	0	111.3	G363 A364	S361-G363 PolarHBondContact O-N 3.03Å; S361-A364 WeakPolarHBondContact O-CB 3.21Å; S361-A364 PolarHBondContact O-N 3.34Å
362	G	88.4	Confident	81.5	Confident	1 Å²	1	79.7 Å²	79.7	1%	0.01	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	-121	168.1	0	0	0	0	0	113.4	A364 R365 I366 E438	G362-A364 PolarHBondContact O-N 3.36Å; G362-A364 VanDerWaalsContact O-N 3.12Å; G362-R365 PolarHBondContact O-N 3.21Å; G362-I366 WeakPolarHBondContact O-CG1 3.42Å; G362-I366 PolarHBondContact O-N 3.38Å; G362-E438 WeakPolarHBondContact CA-OE1 3.25Å; G362-E438 PolarHBondContact N-OE1 2.92Å
363	G	92.5	Very high	83	Confident	16 Å²	16	81.6 Å²	81.6	17%	0.165	43%	0.425	C	S	.	.	H	α-helix	trans	-50.3	-36.8	178.8	0	0	0	0	0	114.5	S346 I347 S361 I366 N367	S346-G363 PolarHBondContact O-N 3.2Å; I347-G363 WeakPolarHBondContact O-CA 3.32Å; S361-G363 PolarHBondContact O-N 3.03Å; G363-I366 PolarHBondContact O-N 2.87Å; G363-N367 VanDerWaalsContact O-CB 3.23Å; G363-N367 WeakPolarHBondContact O-CB 3.41Å; G363-N367 PolarHBondContact O-N 3.09Å
364	A	90.9	Very high	84.9	Confident	45 Å²	45	72.1 Å²	72.1	37%	0.372	38%	0.384	S	S	.	.	H	α-helix	trans	-69.5	-35.1	178.7	0	0	0	0	0	112.7	L360 S361 G362 R368	L360-A364 HydrophobicContact CB-CB 4.11Å; L360-A364 HydrophobicContact CD2-CB 4.2Å; S361-A364 WeakPolarHBondContact O-CB 3.21Å; S361-A364 PolarHBondContact O-N 3.34Å; G362-A364 PolarHBondContact O-N 3.36Å; G362-A364 VanDerWaalsContact O-N 3.12Å; A364-R368 PolarHBondContact O-N 3.21Å
365	R	91.5	Very high	86.3	Confident	84 Å²	84	65.1 Å²	65.1	32%	0.317	35%	0.348	S	S	.	.	H	α-helix	trans	-74.1	-41.2	173.4	-71.7	-179.4	-173.8	168.6	8.4	111.5	E359 L360 G362 N367 R368 L369 E438	E359-R365 IonicContact OE2-NH2 3.61Å; E359-R365 PolarHBondContact OE2-NH2 3.01Å; L360-R365 HydrophobicContact CB-CG 3.9Å; L360-R365 PolarHBondContact O-NE 3.05Å; L360-R365 PolarHBondContact O-NH2 3.35Å; G362-R365 PolarHBondContact O-N 3.21Å; R365-N367 VanDerWaalsContact C-N 3.31Å; R365-N367 PolarHBondContact O-N 2.78Å; R365-R368 CarbonylContact O-C 3.51Å; R365-R368 WeakPolarHBondContact O-CA 3.29Å; R365-R368 WeakPolarHBondContact O-CB 3.24Å; R365-R368 PolarHBondContact O-N 2.75Å; R365-R368 VanDerWaalsContact O-N 3.12Å; R365-L369 WeakPolarHBondContact O-CG 3.29Å; R365-L369 PolarHBondContact O-N 2.81Å; R365-E438 HydrophobicContact CB-CG 4.01Å; R365-E438 WeakPolarHBondContact CD-OE1 3.31Å; R365-E438 WeakPolarHBondContact CD-OE2 3.44Å; R365-E438 IonicContact CZ-OE2 3.72Å; R365-E438 IonicContact NE-OE2 2.71Å; R365-E438 IonicContact NH1-OE1 3.9Å; R365-E438 IonicContact NH1-OE2 3.91Å; R365-E438 PolarHBondContact NH1-OE2 2.97Å
366	I	94.8	Very high	86.9	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-43.4	173.9	-65.4	172.7	0	0	0	110.8	I347 G362 G363 R368 L369 F370 V435 E438 L439 I683	I347-I366 HydrophobicContact CD1-CD1 3.96Å; G362-I366 WeakPolarHBondContact O-CG1 3.42Å; G362-I366 PolarHBondContact O-N 3.38Å; G363-I366 PolarHBondContact O-N 2.87Å; I366-R368 PolarHBondContact O-N 2.89Å; I366-L369 WeakPolarHBondContact O-CB 3.44Å; I366-L369 PolarHBondContact O-N 2.84Å; I366-L369 VanDerWaalsContact O-N 3.13Å; I366-F370 HydrophobicContact CG2-CD2 4.18Å; I366-F370 HydrophobicContact CG2-CE1 4.44Å; I366-F370 HydrophobicContact CG2-CE2 3.53Å; I366-F370 HydrophobicContact CG2-CZ 3.69Å; I366-F370 PolarHBondContact O-N 3.18Å; I366-V435 HydrophobicContact CD1-CG1 4.24Å; I366-V435 HydrophobicContact CG1-CG1 4.23Å; I366-V435 HydrophobicContact CG2-CG1 4.2Å; I366-V435 HydrophobicContact CG2-CG2 4.31Å; I366-E438 HydrophobicContact CG1-CB 4.37Å; I366-E438 HydrophobicContact CG1-CG 3.99Å; I366-L439 HydrophobicContact CD1-CD2 3.8Å; I366-L439 HydrophobicContact CD1-CG 4.2Å; I366-I683 HydrophobicContact CD1-CD1 4.24Å; I366-I683 HydrophobicContact CG2-CD1 3.85Å
367	N	93.6	Very high	87.9	Confident	89 Å²	89	59.1 Å²	59.1	48%	0.476	31%	0.306	S	S	.	.	H	α-helix	trans	-60.7	-42.2	174.8	-169.5	-20.4	0	0	0	111.9	G363 R365 L369 F370 H371	G363-N367 VanDerWaalsContact O-CB 3.23Å; G363-N367 WeakPolarHBondContact O-CB 3.41Å; G363-N367 PolarHBondContact O-N 3.09Å; R365-N367 VanDerWaalsContact C-N 3.31Å; R365-N367 PolarHBondContact O-N 2.78Å; N367-L369 VanDerWaalsContact C-N 3.35Å; N367-L369 PolarHBondContact O-N 2.78Å; N367-F370 PolarHBondContact O-N 3.15Å; N367-H371 PolarHBondContact O-N 3.13Å; N367-H371 PolarHBondContact O-ND1 3.24Å; N367-H371 PolarHBondContact OD1-CE1 3.32Å; N367-H371 PolarHBondContact OD1-ND1 2.92Å
368	R	91.9	Very high	88.4	Confident	67 Å²	67	53.2 Å²	53.2	25%	0.253	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-36.6	172.6	-168	-179.6	-175.3	-175.1	3	112.6	A364 R365 I366 E372 R373 D612	A364-R368 PolarHBondContact O-N 3.21Å; R365-R368 CarbonylContact O-C 3.51Å; R365-R368 WeakPolarHBondContact O-CA 3.29Å; R365-R368 WeakPolarHBondContact O-CB 3.24Å; R365-R368 PolarHBondContact O-N 2.75Å; R365-R368 VanDerWaalsContact O-N 3.12Å; I366-R368 PolarHBondContact O-N 2.89Å; R368-E372 HydrophobicContact CG-CB 4.27Å; R368-E372 HydrophobicContact CG-CG 4.17Å; R368-E372 IonicContact CZ-OE2 2.83Å; R368-E372 IonicContact NE-OE2 3.73Å; R368-E372 PolarHBondContact NE-OE2 2.93Å; R368-E372 IonicContact NH2-OE2 2.67Å; R368-E372 PolarHBondContact NH2-OE2 3.05Å; R368-E372 VanDerWaalsContact NH2-OE2 3.08Å; R368-E372 WeakPolarHBondContact O-CA 3.36Å; R368-E372 WeakPolarHBondContact O-CB 3.42Å; R368-E372 PolarHBondContact O-N 3.36Å; R368-R373 PolarHBondContact O-N 2.89Å; R368-D612 IonicContact NH2-OD1 3.18Å
369	L	94.3	Very high	88.5	Confident	29 Å²	29	47 Å²	47	15%	0.152	24%	0.237	C	C	.	.	I	π-helix	trans	-62.1	-44.8	174.4	-69.7	174.6	0	0	0	111.4	R365 I366 N367 R373 F374 L434 V435	R365-L369 WeakPolarHBondContact O-CG 3.29Å; R365-L369 PolarHBondContact O-N 2.81Å; I366-L369 WeakPolarHBondContact O-CB 3.44Å; I366-L369 PolarHBondContact O-N 2.84Å; I366-L369 VanDerWaalsContact O-N 3.13Å; N367-L369 VanDerWaalsContact C-N 3.35Å; N367-L369 PolarHBondContact O-N 2.78Å; L369-R373 HydrophobicContact CD2-CB 3.93Å; L369-R373 HydrophobicContact CD2-CG 4.11Å; L369-R373 PolarHBondContact O-N 3.41Å; L369-F374 WeakPolarHBondContact O-CB 3.47Å; L369-F374 PolarHBondContact O-N 2.92Å; L369-L434 HydrophobicContact CD1-CB 3.83Å; L369-L434 HydrophobicContact CD2-CB 3.91Å; L369-L434 HydrophobicContact CD2-CD1 4.09Å; L369-L434 HydrophobicContact CG-CB 4.5Å; L369-V435 HydrophobicContact CB-CG2 4.38Å; L369-V435 HydrophobicContact CD1-CG2 3.73Å
370	F	95.6	Very high	88.2	Confident	17 Å²	17	47 Å²	47	8%	0.075	24%	0.235	C	C	.	.	I	π-helix	trans	-68.9	-38.3	178.5	-61.6	-31.4	0	0	0	114	I366 N367 P375 V435 P675 I678 M679 I683	I366-F370 HydrophobicContact CG2-CD2 4.18Å; I366-F370 HydrophobicContact CG2-CE1 4.44Å; I366-F370 HydrophobicContact CG2-CE2 3.53Å; I366-F370 HydrophobicContact CG2-CZ 3.69Å; I366-F370 PolarHBondContact O-N 3.18Å; N367-F370 PolarHBondContact O-N 3.15Å; F370-P375 WeakPolarHBondContact O-CD 3.43Å; F370-P375 WeakPolarHBondContact O-CG 3.33Å; F370-V435 HydrophobicContact CE1-CG2 3.91Å; F370-V435 HydrophobicContact CZ-CG2 4.36Å; F370-P675 HydrophobicContact CB-CB 4.2Å; F370-P675 HydrophobicContact CB-CG 4.12Å; F370-P675 HydrophobicContact CD1-CB 3.87Å; F370-P675 HydrophobicContact CD1-CG 4.05Å; F370-P675 HydrophobicContact CD2-CB 3.99Å; F370-P675 HydrophobicContact CE1-CB 4.18Å; F370-P675 HydrophobicContact CE2-CB 4.29Å; F370-P675 HydrophobicContact CG-CB 3.77Å; F370-P675 HydrophobicContact CG-CG 4.09Å; F370-P675 HydrophobicContact CZ-CB 4.38Å; F370-I678 HydrophobicContact CE1-CB 4.1Å; F370-I678 HydrophobicContact CE1-CD1 3.96Å; F370-I678 HydrophobicContact CE1-CG2 3.98Å; F370-I678 HydrophobicContact CZ-CB 4.07Å; F370-I678 HydrophobicContact CZ-CG2 3.8Å; F370-M679 HydrophobicContact CE2-CG 3.93Å; F370-M679 HydrophobicContact CE2-SD 3.89Å; F370-M679 HydrophobicContact CZ-CG 4.31Å; F370-M679 HydrophobicContact CZ-SD 4.41Å; F370-I683 HydrophobicContact CZ-CD1 4.35Å
371	H	90	Very high	87.7	Confident	135 Å²	135	43.8 Å²	43.8	63%	0.625	22%	0.219	S	C	*	.	I	π-helix	trans	-100.1	-24.1	-171.8	-66.4	104	0	0	0	115.4	N367	N367-H371 PolarHBondContact O-N 3.13Å; N367-H371 PolarHBondContact O-ND1 3.24Å; N367-H371 PolarHBondContact OD1-CE1 3.32Å; N367-H371 PolarHBondContact OD1-ND1 2.92Å
372	E	88.5	Confident	86.5	Confident	64 Å²	64	45.4 Å²	45.4	30%	0.299	22%	0.219	S	C	.	.	I	π-helix	trans	-106.7	-58.5	172.3	-62.3	-163.8	147.4	0	0	112	R368 F376 R522	R368-E372 HydrophobicContact CG-CB 4.27Å; R368-E372 HydrophobicContact CG-CG 4.17Å; R368-E372 IonicContact CZ-OE2 2.83Å; R368-E372 IonicContact NE-OE2 3.73Å; R368-E372 PolarHBondContact NE-OE2 2.93Å; R368-E372 IonicContact NH2-OE2 2.67Å; R368-E372 PolarHBondContact NH2-OE2 3.05Å; R368-E372 VanDerWaalsContact NH2-OE2 3.08Å; R368-E372 WeakPolarHBondContact O-CA 3.36Å; R368-E372 WeakPolarHBondContact O-CB 3.42Å; R368-E372 PolarHBondContact O-N 3.36Å; E372-F376 WeakPolarHBondContact O-CB 3.22Å; E372-F376 PolarHBondContact O-N 3Å; E372-F376 VanDerWaalsContact O-N 3.07Å; E372-R522 IonicContact OE1-NH1 2.77Å; E372-R522 PolarHBondContact OE1-NH1 3.49Å
373	R	87.5	Confident	85.3	Confident	76 Å²	76	47.8 Å²	47.8	29%	0.287	23%	0.231	S	C	.	.	I	π-helix	trans	-75.4	-43.7	-163.2	-170.8	55.2	167.5	-170.2	-8.5	114.6	R368 L369 F376 E377 L434 E614	R368-R373 PolarHBondContact O-N 2.89Å; L369-R373 HydrophobicContact CD2-CB 3.93Å; L369-R373 HydrophobicContact CD2-CG 4.11Å; L369-R373 PolarHBondContact O-N 3.41Å; R373-F376 WeakPolarHBondContact O-CB 3.42Å; R373-F376 PolarHBondContact O-N 3.21Å; R373-E377 PolarHBondContact O-N 3.48Å; R373-L434 HydrophobicContact CG-CD1 3.93Å; R373-E614 IonicContact CZ-OE2 3.13Å; R373-E614 IonicContact NH1-OE2 3.4Å; R373-E614 PolarHBondContact NH1-OE2 3.46Å; R373-E614 IonicContact NH2-OE2 2.7Å
374	F	93.9	Very high	84.1	Confident	6 Å²	6	49.8 Å²	49.8	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-68.8	-44.8	178.6	170.3	-126	0	0	0	112.6	L369 F376 E377 I378 P427 A428 C431 I670 R671 V674 P675	L369-F374 WeakPolarHBondContact O-CB 3.47Å; L369-F374 PolarHBondContact O-N 2.92Å; F374-F376 VanDerWaalsContact C-N 3.29Å; F374-F376 PolarHBondContact O-N 3.45Å; F374-E377 PolarHBondContact O-N 3.43Å; F374-I378 HydrophobicContact CD2-CD1 4.18Å; F374-I378 HydrophobicContact CD2-CG1 4.44Å; F374-I378 HydrophobicContact CE1-CD1 4.22Å; F374-I378 HydrophobicContact CE2-CD1 3.62Å; F374-I378 HydrophobicContact CE2-CG1 4.07Å; F374-I378 HydrophobicContact CZ-CD1 3.64Å; F374-I378 PolarHBondContact O-N 2.78Å; F374-I378 VanDerWaalsContact O-N 3.15Å; F374-P427 HydrophobicContact CD2-CB 4.33Å; F374-P427 WeakPolarHBondContact CD2-O 3.31Å; F374-P427 HydrophobicContact CE2-CB 4.17Å; F374-A428 HydrophobicContact CE2-CB 4.43Å; F374-C431 HydrophobicContact CB-CB 4.18Å; F374-C431 HydrophobicContact CD2-CB 3.79Å; F374-C431 HydrophobicContact CE2-CB 4.39Å; F374-C431 HydrophobicContact CG-CB 4.03Å; F374-I670 HydrophobicContact CZ-CG2 4.11Å; F374-R671 HydrophobicContact CE1-CG 4.36Å; F374-V674 HydrophobicContact CD1-CG1 4.34Å; F374-V674 HydrophobicContact CE1-CB 3.61Å; F374-V674 HydrophobicContact CE1-CG1 3.72Å; F374-V674 HydrophobicContact CE1-CG2 4.29Å; F374-V674 HydrophobicContact CE2-CG1 4.16Å; F374-V674 HydrophobicContact CZ-CB 3.56Å; F374-V674 HydrophobicContact CZ-CG1 3.62Å; F374-V674 HydrophobicContact CZ-CG2 3.75Å; F374-P675 HydrophobicContact CD1-CG 4.48Å
375	P	89.2	Confident	83.4	Confident	15 Å²	15	51.5 Å²	51.5	10%	0.097	24%	0.238	C	C	.	.	H	α-helix	trans	-51.2	-43.5	165.1	-34.9	40.6	0	0	0	114.2	F370 V379	F370-P375 WeakPolarHBondContact O-CD 3.43Å; F370-P375 WeakPolarHBondContact O-CG 3.33Å; P375-V379 WeakPolarHBondContact O-CG2 3.37Å; P375-V379 PolarHBondContact O-N 3.31Å; P375-V379 VanDerWaalsContact O-N 3.08Å
376	F	82.6	Confident	82.8	Confident	18 Å²	18	54.9 Å²	54.9	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-45.6	175.5	164.9	-100.2	0	0	0	112.5	E372 R373 F374 I378 V379 K380 A618 L621	E372-F376 WeakPolarHBondContact O-CB 3.22Å; E372-F376 PolarHBondContact O-N 3Å; E372-F376 VanDerWaalsContact O-N 3.07Å; R373-F376 WeakPolarHBondContact O-CB 3.42Å; R373-F376 PolarHBondContact O-N 3.21Å; F374-F376 VanDerWaalsContact C-N 3.29Å; F374-F376 PolarHBondContact O-N 3.45Å; F376-I378 VanDerWaalsContact C-N 3.28Å; F376-I378 PolarHBondContact O-N 3.14Å; F376-V379 PolarHBondContact O-N 3.02Å; F376-K380 HydrophobicContact CE1-CD 3.96Å; F376-K380 HydrophobicContact CZ-CD 4.08Å; F376-K380 WeakPolarHBondContact O-CB 3.37Å; F376-K380 PolarHBondContact O-N 3.21Å; F376-A618 HydrophobicContact CB-CB 3.86Å; F376-A618 HydrophobicContact CD2-CB 3.4Å; F376-A618 HydrophobicContact CE2-CB 4.17Å; F376-A618 HydrophobicContact CG-CB 3.9Å; F376-L621 HydrophobicContact CD2-CD1 3.78Å; F376-L621 HydrophobicContact CE2-CD1 3.57Å
377	E	85.4	Confident	82.2	Confident	14 Å²	14	56.8 Å²	56.8	7%	0.065	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-35.1	-178	-155.4	77.2	-142.7	0	0	111.6	R373 F374 K380 M381 P427 K430	R373-E377 PolarHBondContact O-N 3.48Å; F374-E377 PolarHBondContact O-N 3.43Å; E377-K380 IonicContact OE1-NZ 3.62Å; E377-K380 PolarHBondContact OE1-NZ 3.34Å; E377-M381 VanDerWaalsContact O-CG 3.31Å; E377-M381 WeakPolarHBondContact O-CG 3.39Å; E377-M381 PolarHBondContact O-N 3Å; E377-P427 HydrophobicContact CB-CB 3.99Å; E377-P427 HydrophobicContact CG-CB 4.01Å; E377-K430 HydrophobicContact CG-CD 3.9Å; E377-K430 IonicContact OE1-NZ 2.65Å; E377-K430 PolarHBondContact OE1-NZ 3.02Å; E377-K430 IonicContact OE2-NZ 2.65Å; E377-K430 PolarHBondContact OE2-NZ 3.17Å
378	I	87	Confident	81.9	Confident	12 Å²	12	53 Å²	53	6%	0.062	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-47.6	172.3	-63.2	166.7	0	0	0	111.6	F374 F376 K380 M381 L424 P427 T667 R671	F374-I378 HydrophobicContact CD2-CD1 4.18Å; F374-I378 HydrophobicContact CD2-CG1 4.44Å; F374-I378 HydrophobicContact CE1-CD1 4.22Å; F374-I378 HydrophobicContact CE2-CD1 3.62Å; F374-I378 HydrophobicContact CE2-CG1 4.07Å; F374-I378 HydrophobicContact CZ-CD1 3.64Å; F374-I378 PolarHBondContact O-N 2.78Å; F374-I378 VanDerWaalsContact O-N 3.15Å; F376-I378 VanDerWaalsContact C-N 3.28Å; F376-I378 PolarHBondContact O-N 3.14Å; I378-K380 VanDerWaalsContact C-N 3.28Å; I378-K380 PolarHBondContact O-N 2.78Å; I378-M381 VanDerWaalsContact O-CB 3.31Å; I378-M381 WeakPolarHBondContact O-CB 3.49Å; I378-M381 PolarHBondContact O-N 2.83Å; I378-L424 HydrophobicContact CG2-CD2 4.1Å; I378-P427 HydrophobicContact CG1-CB 3.85Å; I378-P427 HydrophobicContact CG1-CG 3.81Å; I378-T667 HydrophobicContact CG2-CG2 3.8Å; I378-R671 HydrophobicContact CD1-CG 3.43Å; I378-R671 VanDerWaalsContact CD1-CG 3.43Å
379	V	78.4	Confident	81.7	Confident	23 Å²	23	53.6 Å²	53.6	14%	0.139	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-33.2	179.7	172.6	0	0	0	0	111.6	P375 F376 M381 E382 L621	P375-V379 WeakPolarHBondContact O-CG2 3.37Å; P375-V379 PolarHBondContact O-N 3.31Å; P375-V379 VanDerWaalsContact O-N 3.08Å; F376-V379 PolarHBondContact O-N 3.02Å; V379-M381 PolarHBondContact O-N 3.29Å; V379-E382 VanDerWaalsContact O-CB 3.27Å; V379-E382 WeakPolarHBondContact O-CB 3.04Å; V379-E382 VanDerWaalsContact O-CG 3.31Å; V379-E382 WeakPolarHBondContact O-CG 3.2Å; V379-E382 PolarHBondContact O-N 3.01Å; V379-L621 HydrophobicContact CG1-CB 3.89Å; V379-L621 HydrophobicContact CG1-CD2 4.31Å; V379-L621 HydrophobicContact CG1-CG 4.48Å
380	K	72	Confident	81.5	Confident	116 Å²	116	56 Å²	56	50%	0.504	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-21	173.4	178.5	-176.5	162.4	-156.1	0	113.1	F376 E377 I378 E382	F376-K380 HydrophobicContact CE1-CD 3.96Å; F376-K380 HydrophobicContact CZ-CD 4.08Å; F376-K380 WeakPolarHBondContact O-CB 3.37Å; F376-K380 PolarHBondContact O-N 3.21Å; E377-K380 IonicContact OE1-NZ 3.62Å; E377-K380 PolarHBondContact OE1-NZ 3.34Å; I378-K380 VanDerWaalsContact C-N 3.28Å; I378-K380 PolarHBondContact O-N 2.78Å; K380-E382 VanDerWaalsContact C-N 3.29Å
381	M	70.3	Confident	81.3	Confident	26 Å²	26	57.8 Å²	57.8	13%	0.128	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-4.3	174.2	-62.1	156.1	64.1	0	0	113.7	E377 I378 V379 I383 R423 L424 P427	E377-M381 VanDerWaalsContact O-CG 3.31Å; E377-M381 WeakPolarHBondContact O-CG 3.39Å; E377-M381 PolarHBondContact O-N 3Å; I378-M381 VanDerWaalsContact O-CB 3.31Å; I378-M381 WeakPolarHBondContact O-CB 3.49Å; I378-M381 PolarHBondContact O-N 2.83Å; V379-M381 PolarHBondContact O-N 3.29Å; M381-I383 PolarHBondContact O-N 3.11Å; M381-R423 VanDerWaalsContact CE-C 3.41Å; M381-R423 HydrophobicContact CE-CB 3.58Å; M381-R423 WeakPolarHBondContact CE-O 3.48Å; M381-R423 PolarHBondContact O-NH1 3.47Å; M381-R423 PolarHBondContact O-NH2 2.96Å; M381-L424 HydrophobicContact CE-CD2 4.16Å; M381-P427 HydrophobicContact CE-CG 4.11Å; M381-P427 HydrophobicContact SD-CB 3.95Å; M381-P427 VanDerWaalsContact SD-CD 3.52Å; M381-P427 HydrophobicContact SD-CG 3.42Å; M381-P427 WeakPolarHBondContact SD-CG 3.3Å
382	E	59.1	Low	81.3	Confident	96 Å²	96	51.3 Å²	51.3	45%	0.449	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-53.9	131.9	-176.7	-80.4	-177.6	-163.5	0	0	111.8	V379 K380 Y626	V379-E382 VanDerWaalsContact O-CB 3.27Å; V379-E382 WeakPolarHBondContact O-CB 3.04Å; V379-E382 VanDerWaalsContact O-CG 3.31Å; V379-E382 WeakPolarHBondContact O-CG 3.2Å; V379-E382 PolarHBondContact O-N 3.01Å; K380-E382 VanDerWaalsContact C-N 3.29Å; E382-Y626 WeakPolarHBondContact OE2-CE1 3.4Å; E382-Y626 PolarHBondContact OE2-OH 2.89Å
383	I	62.6	Low	81.4	Confident	51 Å²	51	48.7 Å²	48.7	26%	0.262	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-73.1	153.4	-168.6	-47.2	127.6	0	0	0	108	M381 E385 L388 Q420	M381-I383 PolarHBondContact O-N 3.11Å; I383-E385 PolarHBondContact O-N 2.85Å; I383-E385 VanDerWaalsContact O-N 3.1Å; I383-L388 HydrophobicContact CB-CB 4.32Å; I383-L388 HydrophobicContact CD1-CD1 4.3Å; I383-L388 HydrophobicContact CD1-CD2 4.14Å; I383-L388 HydrophobicContact CG2-CB 3.85Å; I383-Q420 VanDerWaalsContact CD1-CD 3.42Å; I383-Q420 HydrophobicContact CD1-CG 3.84Å
384	N	68.1	Low	81.6	Confident	58 Å²	58	49.9 Å²	49.9	31%	0.31	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-60.1	118.7	164.2	-168.9	-8.9	0	0	0	108	K386 E387 L388	N384-K386 PolarHBondContact O-N 2.86Å; N384-K386 VanDerWaalsContact O-N 3.07Å; N384-K386 WeakPolarHBondContact OD1-CB 3.4Å; N384-K386 PolarHBondContact OD1-N 3.37Å; N384-K386 VanDerWaalsContact OD1-N 3.14Å; N384-E387 HydrophobicContact CB-CB 3.86Å; N384-E387 HydrophobicContact CB-CG 3.82Å; N384-E387 CarbonylContact O-C 3.6Å; N384-E387 PolarHBondContact O-N 2.85Å; N384-L388 WeakPolarHBondContact O-CB 3.35Å; N384-L388 PolarHBondContact O-N 2.72Å
385	E	76.2	Confident	81.5	Confident	80 Å²	80	50.4 Å²	50.4	37%	0.374	23%	0.234	S	C	.	.	H	α-helix	trans	-58.3	-22.2	175.6	-91.5	-89.3	132.9	0	0	112.1	I383 R389 R656	I383-E385 PolarHBondContact O-N 2.85Å; I383-E385 VanDerWaalsContact O-N 3.1Å; E385-R389 WeakPolarHBondContact O-CG 3.29Å; E385-R389 PolarHBondContact O-N 2.79Å; E385-R389 PolarHBondContact O-NH1 3.41Å; E385-R389 IonicContact OE2-CZ 2.83Å; E385-R389 IonicContact OE2-NH1 2.72Å; E385-R389 PolarHBondContact OE2-NH1 3.06Å; E385-R389 IonicContact OE2-NH2 3.97Å; E385-R389 PolarHBondContact OE2-NH2 2.91Å; E385-R656 WeakPolarHBondContact OE1-CD 3.37Å; E385-R656 IonicContact OE1-CZ 3.21Å; E385-R656 IonicContact OE1-NE 3.83Å; E385-R656 IonicContact OE1-NH1 2.69Å; E385-R656 PolarHBondContact OE1-NH1 3.15Å; E385-R656 WeakPolarHBondContact OE2-CD 3.38Å; E385-R656 IonicContact OE2-NH1 2.66Å
386	K	77.9	Confident	81.4	Confident	155 Å²	155	49.7 Å²	49.7	67%	0.674	23%	0.229	S	C	*	.	H	α-helix	trans	-72.4	-52.5	167.3	-168.6	-175.9	179.4	-172	0	112.4	N384 L388 R389 K390	N384-K386 PolarHBondContact O-N 2.86Å; N384-K386 VanDerWaalsContact O-N 3.07Å; N384-K386 WeakPolarHBondContact OD1-CB 3.4Å; N384-K386 PolarHBondContact OD1-N 3.37Å; N384-K386 VanDerWaalsContact OD1-N 3.14Å; K386-L388 VanDerWaalsContact C-N 3.33Å; K386-L388 PolarHBondContact O-N 3.41Å; K386-R389 PolarHBondContact O-N 2.8Å; K386-K390 WeakPolarHBondContact O-CB 3.17Å; K386-K390 PolarHBondContact O-N 3.29Å
387	E	81.9	Confident	81.7	Confident	46 Å²	46	53.1 Å²	53.1	22%	0.215	24%	0.241	C	C	.	.	H	α-helix	trans	-68.6	-29.9	179.9	-59.2	-52.8	93.2	0	0	112.3	N384 K390 E391	N384-E387 HydrophobicContact CB-CB 3.86Å; N384-E387 HydrophobicContact CB-CG 3.82Å; N384-E387 CarbonylContact O-C 3.6Å; N384-E387 PolarHBondContact O-N 2.85Å; E387-K390 CarbonylContact O-C 3.32Å; E387-K390 WeakPolarHBondContact O-CB 3.25Å; E387-K390 PolarHBondContact O-N 3.42Å; E387-K390 WeakPolarHBondContact OE1-CD 3.47Å; E387-K390 IonicContact OE1-NZ 2.77Å; E387-K390 WeakPolarHBondContact OE2-CD 3.38Å; E387-K390 IonicContact OE2-NZ 3.35Å; E387-K390 PolarHBondContact OE2-NZ 3.37Å; E387-E391 VanDerWaalsContact O-CB 3.32Å; E387-E391 WeakPolarHBondContact O-CB 3.45Å; E387-E391 VanDerWaalsContact O-CG 3.26Å; E387-E391 WeakPolarHBondContact O-CG 3.45Å; E387-E391 PolarHBondContact O-N 3.39Å
388	L	86.9	Confident	81.8	Confident	8 Å²	8	58.5 Å²	58.5	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-45.5	172.6	179.6	56.3	0	0	0	110.7	I383 N384 K386 E391 I392 I416 R656	I383-L388 HydrophobicContact CB-CB 4.32Å; I383-L388 HydrophobicContact CD1-CD1 4.3Å; I383-L388 HydrophobicContact CD1-CD2 4.14Å; I383-L388 HydrophobicContact CG2-CB 3.85Å; N384-L388 WeakPolarHBondContact O-CB 3.35Å; N384-L388 PolarHBondContact O-N 2.72Å; K386-L388 VanDerWaalsContact C-N 3.33Å; K386-L388 PolarHBondContact O-N 3.41Å; L388-E391 PolarHBondContact O-N 3.37Å; L388-I392 HydrophobicContact CD1-CD1 3.91Å; L388-I392 HydrophobicContact CD1-CG1 4.23Å; L388-I392 HydrophobicContact CG-CD1 3.87Å; L388-I392 WeakPolarHBondContact O-CB 3.36Å; L388-I392 WeakPolarHBondContact O-CD1 3.1Å; L388-I392 WeakPolarHBondContact O-CG1 3.33Å; L388-I392 PolarHBondContact O-N 2.8Å; L388-I416 HydrophobicContact CD1-CG2 3.76Å; L388-R656 HydrophobicContact CD2-CG 3.97Å; L388-R656 HydrophobicContact CG-CG 4.42Å
389	R	88.2	Confident	81.8	Confident	80 Å²	80	60.2 Å²	60.2	30%	0.302	28%	0.28	S	S	.	.	H	α-helix	trans	-64.3	-39.7	174.4	-73.2	-174.1	-174.8	75.1	0.8	112.1	E385 K386 I392 A393 V652 E653	E385-R389 WeakPolarHBondContact O-CG 3.29Å; E385-R389 PolarHBondContact O-N 2.79Å; E385-R389 PolarHBondContact O-NH1 3.41Å; E385-R389 IonicContact OE2-CZ 2.83Å; E385-R389 IonicContact OE2-NH1 2.72Å; E385-R389 PolarHBondContact OE2-NH1 3.06Å; E385-R389 IonicContact OE2-NH2 3.97Å; E385-R389 PolarHBondContact OE2-NH2 2.91Å; K386-R389 PolarHBondContact O-N 2.8Å; R389-I392 PolarHBondContact O-N 3.32Å; R389-A393 VanDerWaalsContact O-CB 3.3Å; R389-A393 WeakPolarHBondContact O-CB 3.31Å; R389-A393 PolarHBondContact O-N 2.89Å; R389-V652 HydrophobicContact CB-CG1 3.7Å; R389-V652 HydrophobicContact CG-CG1 3.72Å; R389-E653 IonicContact CZ-OE2 3.41Å; R389-E653 IonicContact NE-OE2 3.72Å; R389-E653 PolarHBondContact NE-OE2 2.91Å; R389-E653 IonicContact NH2-OE1 3.6Å; R389-E653 IonicContact NH2-OE2 3.77Å; R389-E653 PolarHBondContact NH2-OE2 2.84Å
390	K	90.3	Very high	82.1	Confident	81 Å²	81	60.8 Å²	60.8	35%	0.352	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-44.2	175.3	-168.8	-172.5	178.2	-176.3	0	112.2	K386 E387 A393 Y394	K386-K390 WeakPolarHBondContact O-CB 3.17Å; K386-K390 PolarHBondContact O-N 3.29Å; E387-K390 CarbonylContact O-C 3.32Å; E387-K390 WeakPolarHBondContact O-CB 3.25Å; E387-K390 PolarHBondContact O-N 3.42Å; E387-K390 WeakPolarHBondContact OE1-CD 3.47Å; E387-K390 IonicContact OE1-NZ 2.77Å; E387-K390 WeakPolarHBondContact OE2-CD 3.38Å; E387-K390 IonicContact OE2-NZ 3.35Å; E387-K390 PolarHBondContact OE2-NZ 3.37Å; K390-A393 PolarHBondContact O-N 3.38Å; K390-Y394 HydrophobicContact CD-CE2 4.25Å; K390-Y394 HydrophobicContact CG-CD2 4.08Å; K390-Y394 HydrophobicContact CG-CE2 3.65Å; K390-Y394 WeakPolarHBondContact O-CD2 3.13Å; K390-Y394 PolarHBondContact O-N 2.88Å
391	E	90.9	Very high	82.7	Confident	53 Å²	53	58 Å²	58	25%	0.248	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-43.6	175.1	-75.4	-174.3	-176.7	0	0	111.8	E387 L388 Y394 A395 I416 K419	E387-E391 VanDerWaalsContact O-CB 3.32Å; E387-E391 WeakPolarHBondContact O-CB 3.45Å; E387-E391 VanDerWaalsContact O-CG 3.26Å; E387-E391 WeakPolarHBondContact O-CG 3.45Å; E387-E391 PolarHBondContact O-N 3.39Å; L388-E391 PolarHBondContact O-N 3.37Å; E391-Y394 PolarHBondContact O-N 3.2Å; E391-A395 WeakPolarHBondContact O-CB 3.46Å; E391-A395 PolarHBondContact O-N 3.18Å; E391-I416 HydrophobicContact CB-CD1 3.83Å; E391-K419 IonicContact OE1-NZ 3.61Å; E391-K419 PolarHBondContact OE1-NZ 3.23Å; E391-K419 IonicContact OE2-NZ 3.68Å; E391-K419 PolarHBondContact OE2-NZ 3.28Å
392	I	91.4	Very high	83.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-44	173.6	-67.1	161.5	0	0	0	110.3	L388 R389 Y394 A395 I396 I416 V652 I655 R656	L388-I392 HydrophobicContact CD1-CD1 3.91Å; L388-I392 HydrophobicContact CD1-CG1 4.23Å; L388-I392 HydrophobicContact CG-CD1 3.87Å; L388-I392 WeakPolarHBondContact O-CB 3.36Å; L388-I392 WeakPolarHBondContact O-CD1 3.1Å; L388-I392 WeakPolarHBondContact O-CG1 3.33Å; L388-I392 PolarHBondContact O-N 2.8Å; R389-I392 PolarHBondContact O-N 3.32Å; I392-Y394 PolarHBondContact O-N 2.68Å; I392-A395 WeakPolarHBondContact O-CB 3.22Å; I392-A395 PolarHBondContact O-N 2.62Å; I392-I396 HydrophobicContact CG2-CD1 3.81Å; I392-I396 HydrophobicContact CG2-CG1 4.37Å; I392-I396 VanDerWaalsContact O-CG1 3.28Å; I392-I396 WeakPolarHBondContact O-CG1 3.37Å; I392-I396 PolarHBondContact O-N 2.69Å; I392-I416 HydrophobicContact CG1-CD1 4.18Å; I392-I416 HydrophobicContact CG1-CG1 3.9Å; I392-I416 HydrophobicContact CG1-CG2 4.25Å; I392-V652 HydrophobicContact CB-CG1 4.35Å; I392-V652 HydrophobicContact CG2-CB 4.22Å; I392-V652 HydrophobicContact CG2-CG1 4.2Å; I392-V652 HydrophobicContact CG2-CG2 4.07Å; I392-I655 HydrophobicContact CD1-CG2 4.09Å; I392-I655 HydrophobicContact CG1-CG2 4.03Å; I392-I655 HydrophobicContact CG2-CB 3.85Å; I392-I655 HydrophobicContact CG2-CD1 4.02Å; I392-I655 HydrophobicContact CG2-CG2 3.78Å; I392-R656 HydrophobicContact CD1-CB 3.87Å; I392-R656 HydrophobicContact CD1-CG 4.39Å
393	A	90	Very high	84.3	Confident	8 Å²	8	70.2 Å²	70.2	7%	0.066	34%	0.337	C	S	.	.	H	α-helix	trans	-62.7	-41.8	177.5	0	0	0	0	0	112.3	R389 K390 R397 V652	R389-A393 VanDerWaalsContact O-CB 3.3Å; R389-A393 WeakPolarHBondContact O-CB 3.31Å; R389-A393 PolarHBondContact O-N 2.89Å; K390-A393 PolarHBondContact O-N 3.38Å; A393-R397 WeakPolarHBondContact O-CB 3.08Å; A393-R397 VanDerWaalsContact O-CG 3.24Å; A393-R397 WeakPolarHBondContact O-CG 3.36Å; A393-R397 PolarHBondContact O-N 3.44Å; A393-V652 HydrophobicContact CB-CG2 3.89Å
394	Y	91.3	Very high	84.6	Confident	101 Å²	101	74.1 Å²	74.1	40%	0.396	36%	0.363	S	S	.	.	H	α-helix	trans	-65.3	-39.8	171.7	-74.5	-53.3	0	0	0	112.3	K390 E391 I392 R397 N398	K390-Y394 HydrophobicContact CD-CE2 4.25Å; K390-Y394 HydrophobicContact CG-CD2 4.08Å; K390-Y394 HydrophobicContact CG-CE2 3.65Å; K390-Y394 WeakPolarHBondContact O-CD2 3.13Å; K390-Y394 PolarHBondContact O-N 2.88Å; E391-Y394 PolarHBondContact O-N 3.2Å; I392-Y394 PolarHBondContact O-N 2.68Å; Y394-R397 PolarHBondContact O-N 2.7Å; Y394-N398 VanDerWaalsContact O-CB 3.23Å; Y394-N398 WeakPolarHBondContact O-CB 3.3Å; Y394-N398 PolarHBondContact O-N 3.46Å; Y394-N398 PolarHBondContact O-ND2 3.32Å
395	A	91.1	Very high	84.7	Confident	17 Å²	17	72 Å²	72	14%	0.14	36%	0.355	C	S	.	.	H	α-helix	trans	-60	-51.5	176.3	0	0	0	0	0	111	E391 I392 R397 N398 I399 A412 I416	E391-A395 WeakPolarHBondContact O-CB 3.46Å; E391-A395 PolarHBondContact O-N 3.18Å; I392-A395 WeakPolarHBondContact O-CB 3.22Å; I392-A395 PolarHBondContact O-N 2.62Å; A395-R397 PolarHBondContact O-N 3.43Å; A395-N398 PolarHBondContact O-N 2.76Å; A395-I399 WeakPolarHBondContact O-CB 3.32Å; A395-I399 VanDerWaalsContact O-CD1 3.29Å; A395-I399 WeakPolarHBondContact O-CD1 3.49Å; A395-I399 WeakPolarHBondContact O-CG1 3.45Å; A395-I399 PolarHBondContact O-N 3.04Å; A395-A412 HydrophobicContact CB-CB 4.24Å; A395-I416 HydrophobicContact CB-CD1 4.43Å; A395-I416 HydrophobicContact CB-CG1 4.38Å
396	I	88.3	Confident	84.3	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.005	37%	0.371	C	S	.	.	H	α-helix	trans	-56.3	-51.8	175.9	-63.4	161.8	0	0	0	110.6	I392 N398 I399 H400 T408 A412 L648 Q651 V652 I655	I392-I396 HydrophobicContact CG2-CD1 3.81Å; I392-I396 HydrophobicContact CG2-CG1 4.37Å; I392-I396 VanDerWaalsContact O-CG1 3.28Å; I392-I396 WeakPolarHBondContact O-CG1 3.37Å; I392-I396 PolarHBondContact O-N 2.69Å; I396-N398 VanDerWaalsContact C-N 3.34Å; I396-N398 PolarHBondContact O-N 3.04Å; I396-I399 PolarHBondContact O-N 3.1Å; I396-H400 WeakPolarHBondContact CG2-CE1 3.48Å; I396-H400 WeakPolarHBondContact CG2-NE2 3.3Å; I396-H400 PolarHBondContact O-CD2 3.02Å; I396-H400 VanDerWaalsContact O-CG 3.28Å; I396-H400 PolarHBondContact O-N 3.17Å; I396-T408 HydrophobicContact CG2-CG2 4.49Å; I396-A412 HydrophobicContact CG1-CB 3.87Å; I396-L648 HydrophobicContact CB-CD1 3.99Å; I396-L648 HydrophobicContact CD1-CD1 3.75Å; I396-L648 HydrophobicContact CG2-CD1 3.59Å; I396-Q651 HydrophobicContact CD1-CB 3.98Å; I396-V652 HydrophobicContact CD1-CG2 3.72Å; I396-I655 HydrophobicContact CD1-CD1 3.84Å; I396-I655 HydrophobicContact CG1-CD1 3.89Å
397	R	87.9	Confident	83.8	Confident	89 Å²	89	76.1 Å²	76.1	34%	0.336	38%	0.378	S	S	.	.	H	α-helix	trans	-57.3	-43.4	178.6	-76.1	173.6	171.7	-166.4	-3.7	112.3	A393 Y394 A395 G401	A393-R397 WeakPolarHBondContact O-CB 3.08Å; A393-R397 VanDerWaalsContact O-CG 3.24Å; A393-R397 WeakPolarHBondContact O-CG 3.36Å; A393-R397 PolarHBondContact O-N 3.44Å; Y394-R397 PolarHBondContact O-N 2.7Å; A395-R397 PolarHBondContact O-N 3.43Å; R397-G401 PolarHBondContact O-N 2.8Å
398	N	87.8	Confident	82.9	Confident	128 Å²	128	74.3 Å²	74.3	68%	0.684	37%	0.37	S	S	*	.	H	α-helix	trans	-72	-31.2	-179.3	-70.6	-18.1	0	0	0	113	Y394 A395 I396	Y394-N398 VanDerWaalsContact O-CB 3.23Å; Y394-N398 WeakPolarHBondContact O-CB 3.3Å; Y394-N398 PolarHBondContact O-N 3.46Å; Y394-N398 PolarHBondContact O-ND2 3.32Å; A395-N398 PolarHBondContact O-N 2.76Å; I396-N398 VanDerWaalsContact C-N 3.34Å; I396-N398 PolarHBondContact O-N 3.04Å
399	I	87.6	Confident	82.1	Confident	48 Å²	48	75.9 Å²	75.9	25%	0.246	38%	0.38	C	S	.	.	H	α-helix	trans	-78.4	-34.1	176.6	-63.4	157.2	0	0	0	111.1	A395 I396 T408 M411 A412	A395-I399 WeakPolarHBondContact O-CB 3.32Å; A395-I399 VanDerWaalsContact O-CD1 3.29Å; A395-I399 WeakPolarHBondContact O-CD1 3.49Å; A395-I399 WeakPolarHBondContact O-CG1 3.45Å; A395-I399 PolarHBondContact O-N 3.04Å; I396-I399 PolarHBondContact O-N 3.1Å; I399-T408 HydrophobicContact CB-CG2 3.8Å; I399-T408 HydrophobicContact CG2-CG2 3.55Å; I399-M411 HydrophobicContact CD1-CB 3.67Å; I399-M411 HydrophobicContact CG1-CB 4.33Å; I399-M411 HydrophobicContact CG2-CB 4.08Å; I399-M411 HydrophobicContact CG2-CE 4.26Å; I399-M411 HydrophobicContact CG2-SD 3.86Å; I399-A412 HydrophobicContact CD1-CB 3.82Å
400	H	85.3	Confident	81.9	Confident	35 Å²	35	77.1 Å²	77.1	16%	0.162	39%	0.393	C	S	.	.	H	α-helix	trans	-60.3	-52.4	166.3	-66.5	171.6	0	0	0	110.7	I396 I402 R403 G405 T408	I396-H400 WeakPolarHBondContact CG2-CE1 3.48Å; I396-H400 WeakPolarHBondContact CG2-NE2 3.3Å; I396-H400 PolarHBondContact O-CD2 3.02Å; I396-H400 VanDerWaalsContact O-CG 3.28Å; I396-H400 PolarHBondContact O-N 3.17Å; H400-I402 PolarHBondContact O-N 3.29Å; H400-I402 VanDerWaalsContact O-N 3.11Å; H400-R403 VanDerWaalsContact O-CB 3.27Å; H400-R403 WeakPolarHBondContact O-CB 3.04Å; H400-R403 WeakPolarHBondContact O-CG 3.43Å; H400-R403 PolarHBondContact O-N 3.18Å; H400-G405 VanDerWaalsContact NE2-CA 3.34Å; H400-G405 WeakPolarHBondContact NE2-CA 3.32Å; H400-T408 PolarHBondContact CD2-OG1 3.48Å; H400-T408 WeakPolarHBondContact NE2-CB 3.46Å; H400-T408 PolarHBondContact NE2-OG1 2.91Å; H400-T408 VanDerWaalsContact NE2-OG1 3.12Å
401	G	83.6	Confident	81.8	Confident	58 Å²	58	78.4 Å²	78.4	60%	0.598	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	-113.5	-172.7	0	0	0	0	0	110.9	R397	R397-G401 PolarHBondContact O-N 2.8Å
402	I	84.2	Confident	81.8	Confident	182 Å²	182	75.9 Å²	75.9	93%	0.933	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	2.2	176.1	64.3	170.4	0	0	0	114.1	H400	H400-I402 PolarHBondContact O-N 3.29Å; H400-I402 VanDerWaalsContact O-N 3.11Å
403	R	78.8	Confident	81.9	Confident	196 Å²	196	76.5 Å²	76.5	74%	0.74	39%	0.393	S	S	*	.	S	Bend	trans	-92.4	146	-176.5	-57.1	175.7	177.4	175.9	-0.2	111.1	H400 G405	H400-R403 VanDerWaalsContact O-CB 3.27Å; H400-R403 WeakPolarHBondContact O-CB 3.04Å; H400-R403 WeakPolarHBondContact O-CG 3.43Å; H400-R403 PolarHBondContact O-N 3.18Å; R403-G405 PolarHBondContact O-N 3.44Å
404	V	70	Confident	82	Confident	132 Å²	132	79.7 Å²	79.7	80%	0.8	41%	0.406	S	S	*	.			trans	-70.1	121.4	165.5	-177.9	0	0	0	0	108.7	L406	V404-L406 PolarHBondContact O-N 3.37Å
405	G	68.6	Low	82.1	Confident	14 Å²	14	77.4 Å²	77.4	14%	0.144	41%	0.408	C	S	.	.			trans	-73.8	77.4	-169.7	0	0	0	0	0	115.4	H400 R403	H400-G405 VanDerWaalsContact NE2-CA 3.34Å; H400-G405 WeakPolarHBondContact NE2-CA 3.32Å; R403-G405 PolarHBondContact O-N 3.44Å
406	L	68.3	Low	82.2	Confident	134 Å²	134	77 Å²	77	70%	0.702	40%	0.403	S	S	*	.	S	Bend	trans	-81.2	-37.7	177.1	-71.6	167	0	0	0	113.5	V404	V404-L406 PolarHBondContact O-N 3.37Å
407	F	66.6	Low	82.5	Confident	188 Å²	188	76.9 Å²	76.9	83%	0.825	40%	0.403	S	S	*	.	S	Bend	trans	-142.2	105.9	-175.7	-56.8	-75.4	0	0	0	109.9
408	T	63.9	Low	82.8	Confident	8 Å²	8	75.7 Å²	75.7	5%	0.049	40%	0.4	C	S	.	.			trans	-152.8	6	-174	-42.5	0	0	0	0	117.3	I396 I399 H400 D410	I396-T408 HydrophobicContact CG2-CG2 4.49Å; I399-T408 HydrophobicContact CB-CG2 3.8Å; I399-T408 HydrophobicContact CG2-CG2 3.55Å; H400-T408 PolarHBondContact CD2-OG1 3.48Å; H400-T408 WeakPolarHBondContact NE2-CB 3.46Å; H400-T408 PolarHBondContact NE2-OG1 2.91Å; H400-T408 VanDerWaalsContact NE2-OG1 3.12Å; T408-D410 VanDerWaalsContact C-N 3.32Å; T408-D410 PolarHBondContact O-N 2.69Å
409	P	70.5	Confident	83.1	Confident	40 Å²	40	74 Å²	74	26%	0.26	39%	0.387	S	S	.	.	H	α-helix	trans	-59	-35.8	175.4	-26.7	34.8	0	0	0	115.9	F413 F500	P409-F413 WeakPolarHBondContact O-CB 3.46Å; P409-F413 PolarHBondContact O-N 2.99Å; P409-F500 HydrophobicContact CB-CD2 4.42Å; P409-F500 HydrophobicContact CB-CE2 3.76Å; P409-F500 HydrophobicContact CG-CE2 3.69Å; P409-F500 HydrophobicContact CG-CZ 4.14Å
410	D	83.7	Confident	83.3	Confident	106 Å²	106	72.2 Å²	72.2	57%	0.567	38%	0.377	S	S	*	.	H	α-helix	trans	-75.5	-56.8	-164.4	58.9	-19.4	0	0	0	113.5	T408 A412 F413 E414	T408-D410 VanDerWaalsContact C-N 3.32Å; T408-D410 PolarHBondContact O-N 2.69Å; D410-A412 VanDerWaalsContact C-N 3.26Å; D410-A412 PolarHBondContact O-N 2.9Å; D410-F413 PolarHBondContact O-N 3.28Å; D410-E414 WeakPolarHBondContact O-CB 3.41Å; D410-E414 PolarHBondContact O-N 2.92Å
411	M	88.9	Confident	83.8	Confident	109 Å²	109	70.5 Å²	70.5	54%	0.537	37%	0.37	S	S	.	.	H	α-helix	trans	-63.1	-33.8	179.1	-69.6	-175.6	68.5	0	0	112.1	I399 A415	I399-M411 HydrophobicContact CD1-CB 3.67Å; I399-M411 HydrophobicContact CG1-CB 4.33Å; I399-M411 HydrophobicContact CG2-CB 4.08Å; I399-M411 HydrophobicContact CG2-CE 4.26Å; I399-M411 HydrophobicContact CG2-SD 3.86Å; M411-A415 WeakPolarHBondContact O-CB 3.47Å; M411-A415 PolarHBondContact O-N 2.97Å
412	A	91	Very high	84.3	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-73.5	-40.1	177.9	0	0	0	0	0	111.6	A395 I396 I399 D410 I416 I655	A395-A412 HydrophobicContact CB-CB 4.24Å; I396-A412 HydrophobicContact CG1-CB 3.87Å; I399-A412 HydrophobicContact CD1-CB 3.82Å; D410-A412 VanDerWaalsContact C-N 3.26Å; D410-A412 PolarHBondContact O-N 2.9Å; A412-I416 VanDerWaalsContact O-CG1 3.23Å; A412-I416 WeakPolarHBondContact O-CG1 3.45Å; A412-I416 PolarHBondContact O-N 3.05Å; A412-I655 HydrophobicContact CB-CD1 3.67Å
413	F	92.2	Very high	84.7	Confident	12 Å²	12	65.8 Å²	65.8	5%	0.053	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-48.7	169.3	167.5	-105.6	0	0	0	111.4	P409 D410 A415 I416 V417 M490 T492 F497 I655 L658 V659 Y662	P409-F413 WeakPolarHBondContact O-CB 3.46Å; P409-F413 PolarHBondContact O-N 2.99Å; D410-F413 PolarHBondContact O-N 3.28Å; F413-A415 PolarHBondContact O-N 3.43Å; F413-I416 PolarHBondContact O-N 3.09Å; F413-V417 HydrophobicContact CD2-CG2 3.71Å; F413-V417 HydrophobicContact CE1-CG2 4.35Å; F413-V417 HydrophobicContact CE2-CG2 3.38Å; F413-V417 HydrophobicContact CG-CG2 4.32Å; F413-V417 HydrophobicContact CZ-CG2 3.75Å; F413-V417 WeakPolarHBondContact O-CB 3.25Å; F413-V417 WeakPolarHBondContact O-CG2 3.16Å; F413-V417 PolarHBondContact O-N 2.69Å; F413-M490 HydrophobicContact CD1-CE 4.29Å; F413-M490 HydrophobicContact CE1-CE 4.15Å; F413-M490 HydrophobicContact CE1-SD 4.37Å; F413-T492 HydrophobicContact CE1-CG2 3.94Å; F413-T492 HydrophobicContact CZ-CG2 4.49Å; F413-F497 HydrophobicContact CE2-CE2 4.33Å; F413-F497 HydrophobicContact CE2-CZ 4.29Å; F413-F497 HydrophobicContact CZ-CE2 4.03Å; F413-F497 AromaticContact CZ-CZ 3.85Å; F413-F497 HydrophobicContact CZ-CZ 3.85Å; F413-I655 HydrophobicContact CB-CG2 4.27Å; F413-L658 HydrophobicContact CD2-CB 3.56Å; F413-L658 HydrophobicContact CE2-CB 3.58Å; F413-V659 HydrophobicContact CD2-CG2 4.06Å; F413-V659 HydrophobicContact CE2-CG2 4.49Å; F413-Y662 HydrophobicContact CZ-CD2 4.21Å; F413-Y662 HydrophobicContact CZ-CG 4.1Å
414	E	92.4	Very high	85.5	Confident	75 Å²	75	56.7 Å²	56.7	35%	0.35	30%	0.296	S	S	.	.	H	α-helix	trans	-57.9	-51.2	179.4	-179.2	170	172.7	0	0	112.5	D410 I416 V417 K418 M490	D410-E414 WeakPolarHBondContact O-CB 3.41Å; D410-E414 PolarHBondContact O-N 2.92Å; E414-I416 VanDerWaalsContact C-N 3.29Å; E414-I416 PolarHBondContact O-N 3.42Å; E414-V417 PolarHBondContact O-N 2.94Å; E414-K418 HydrophobicContact CG-CD 3.85Å; E414-K418 HydrophobicContact CG-CG 4.32Å; E414-K418 WeakPolarHBondContact O-CB 3.43Å; E414-K418 WeakPolarHBondContact O-CG 3.33Å; E414-K418 PolarHBondContact O-N 2.85Å; E414-K418 VanDerWaalsContact OE1-CE 3.23Å; E414-K418 WeakPolarHBondContact OE1-CE 3.21Å; E414-K418 IonicContact OE1-NZ 3.3Å; E414-K418 PolarHBondContact OE1-NZ 3.48Å; E414-M490 HydrophobicContact CB-CE 3.58Å; E414-M490 HydrophobicContact CB-SD 4.32Å; E414-M490 HydrophobicContact CG-CE 3.57Å; E414-M490 HydrophobicContact CG-SD 4.07Å
415	A	92.7	Very high	86.7	Confident	54 Å²	54	52.9 Å²	52.9	45%	0.446	27%	0.268	S	S	.	.	H	α-helix	trans	-59.8	-40.8	-178	0	0	0	0	0	112	M411 F413 K419	M411-A415 WeakPolarHBondContact O-CB 3.47Å; M411-A415 PolarHBondContact O-N 2.97Å; F413-A415 PolarHBondContact O-N 3.43Å; A415-K419 VanDerWaalsContact O-CB 3.29Å; A415-K419 WeakPolarHBondContact O-CB 3.46Å; A415-K419 PolarHBondContact O-N 3.31Å
416	I	93.6	Very high	87.9	Confident	7 Å²	7	58.7 Å²	58.7	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-73.7	-44.7	178.9	-62.7	-70.7	0	0	0	110.9	L388 E391 I392 A395 A412 F413 E414 K419 Q420 V659	L388-I416 HydrophobicContact CD1-CG2 3.76Å; E391-I416 HydrophobicContact CB-CD1 3.83Å; I392-I416 HydrophobicContact CG1-CD1 4.18Å; I392-I416 HydrophobicContact CG1-CG1 3.9Å; I392-I416 HydrophobicContact CG1-CG2 4.25Å; A395-I416 HydrophobicContact CB-CD1 4.43Å; A395-I416 HydrophobicContact CB-CG1 4.38Å; A412-I416 VanDerWaalsContact O-CG1 3.23Å; A412-I416 WeakPolarHBondContact O-CG1 3.45Å; A412-I416 PolarHBondContact O-N 3.05Å; F413-I416 PolarHBondContact O-N 3.09Å; E414-I416 VanDerWaalsContact C-N 3.29Å; E414-I416 PolarHBondContact O-N 3.42Å; I416-K419 PolarHBondContact O-N 3.32Å; I416-Q420 WeakPolarHBondContact O-CG 3.42Å; I416-Q420 PolarHBondContact O-N 3.08Å; I416-V659 HydrophobicContact CB-CG2 4.29Å; I416-V659 HydrophobicContact CG2-CG1 4.15Å; I416-V659 HydrophobicContact CG2-CG2 3.74Å
417	V	94.2	Very high	89.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60	-51.8	177.3	166.6	0	0	0	0	111.1	F413 E414 K419 Q420 I421 M490 V659 Y662	F413-V417 HydrophobicContact CD2-CG2 3.71Å; F413-V417 HydrophobicContact CE1-CG2 4.35Å; F413-V417 HydrophobicContact CE2-CG2 3.38Å; F413-V417 HydrophobicContact CG-CG2 4.32Å; F413-V417 HydrophobicContact CZ-CG2 3.75Å; F413-V417 WeakPolarHBondContact O-CB 3.25Å; F413-V417 WeakPolarHBondContact O-CG2 3.16Å; F413-V417 PolarHBondContact O-N 2.69Å; E414-V417 PolarHBondContact O-N 2.94Å; V417-K419 VanDerWaalsContact C-N 3.26Å; V417-K419 PolarHBondContact O-N 3.4Å; V417-Q420 PolarHBondContact O-N 3.44Å; V417-I421 HydrophobicContact CG1-CD1 3.47Å; V417-I421 VanDerWaalsContact CG1-CD1 3.47Å; V417-I421 HydrophobicContact CG1-CG1 4.02Å; V417-I421 WeakPolarHBondContact O-CG1 3.39Å; V417-I421 PolarHBondContact O-N 2.99Å; V417-M490 HydrophobicContact CB-SD 4.11Å; V417-M490 HydrophobicContact CG1-SD 3.79Å; V417-V659 HydrophobicContact CG2-CG2 4.04Å; V417-Y662 HydrophobicContact CG1-CD1 3.57Å; V417-Y662 HydrophobicContact CG1-CE1 4.03Å; V417-Y662 HydrophobicContact CG1-CG 4.37Å
418	K	95.4	Very high	90.6	Very high	64 Å²	64	43.5 Å²	43.5	28%	0.278	22%	0.22	S	C	.	.	H	α-helix	trans	-61.1	-35.4	179.2	-70.6	-175.9	174.5	-177.2	0	112.3	E414 S422 L487 M490	E414-K418 HydrophobicContact CG-CD 3.85Å; E414-K418 HydrophobicContact CG-CG 4.32Å; E414-K418 WeakPolarHBondContact O-CB 3.43Å; E414-K418 WeakPolarHBondContact O-CG 3.33Å; E414-K418 PolarHBondContact O-N 2.85Å; E414-K418 VanDerWaalsContact OE1-CE 3.23Å; E414-K418 WeakPolarHBondContact OE1-CE 3.21Å; E414-K418 IonicContact OE1-NZ 3.3Å; E414-K418 PolarHBondContact OE1-NZ 3.48Å; K418-S422 WeakPolarHBondContact O-CB 3.41Å; K418-S422 PolarHBondContact O-N 2.96Å; K418-S422 PolarHBondContact O-OG 3.45Å; K418-L487 HydrophobicContact CB-CD2 3.9Å; K418-L487 WeakPolarHBondContact CE-O 3.43Å; K418-L487 HydrophobicContact CG-CD2 4.1Å; K418-L487 PolarHBondContact NZ-O 3.19Å; K418-L487 WeakPolarHBondContact O-CD2 3.45Å; K418-M490 HydrophobicContact CG-SD 4.49Å
419	K	93.7	Very high	92.2	Very high	93 Å²	93	45.3 Å²	45.3	40%	0.404	23%	0.229	S	C	.	.	H	α-helix	trans	-64.3	-35.8	171.5	-176.1	179.6	174.3	-169	0	113.1	E391 A415 I416 V417 S422 R423	E391-K419 IonicContact OE1-NZ 3.61Å; E391-K419 PolarHBondContact OE1-NZ 3.23Å; E391-K419 IonicContact OE2-NZ 3.68Å; E391-K419 PolarHBondContact OE2-NZ 3.28Å; A415-K419 VanDerWaalsContact O-CB 3.29Å; A415-K419 WeakPolarHBondContact O-CB 3.46Å; A415-K419 PolarHBondContact O-N 3.31Å; I416-K419 PolarHBondContact O-N 3.32Å; V417-K419 VanDerWaalsContact C-N 3.26Å; V417-K419 PolarHBondContact O-N 3.4Å; K419-S422 PolarHBondContact O-OG 3.32Å; K419-S422 VanDerWaalsContact O-OG 3.13Å; K419-R423 WeakPolarHBondContact O-CG 3.16Å
420	Q	92.3	Very high	93.4	Very high	9 Å²	9	46.4 Å²	46.4	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-81.2	-36.5	177.1	-58.6	-47.2	-33.3	0	0	113.1	I383 I416 V417 R423 M663	I383-Q420 VanDerWaalsContact CD1-CD 3.42Å; I383-Q420 HydrophobicContact CD1-CG 3.84Å; I416-Q420 WeakPolarHBondContact O-CG 3.42Å; I416-Q420 PolarHBondContact O-N 3.08Å; V417-Q420 PolarHBondContact O-N 3.44Å; Q420-R423 PolarHBondContact O-N 3.04Å; Q420-M663 HydrophobicContact CB-CE 3.73Å; Q420-M663 HydrophobicContact CB-CG 4.08Å; Q420-M663 HydrophobicContact CB-SD 3.59Å; Q420-M663 VanDerWaalsContact CB-SD 3.59Å
421	I	95.1	Very high	94.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.6	-48	175	-66.3	176.4	0	0	0	110.7	V417 R423 L424 V483 E486 L487 Y662 M663 V666	V417-I421 HydrophobicContact CG1-CD1 3.47Å; V417-I421 VanDerWaalsContact CG1-CD1 3.47Å; V417-I421 HydrophobicContact CG1-CG1 4.02Å; V417-I421 WeakPolarHBondContact O-CG1 3.39Å; V417-I421 PolarHBondContact O-N 2.99Å; I421-R423 PolarHBondContact O-N 2.86Å; I421-R423 VanDerWaalsContact O-N 3.14Å; I421-L424 VanDerWaalsContact O-CB 3.27Å; I421-L424 WeakPolarHBondContact O-CB 3.43Å; I421-L424 PolarHBondContact O-N 3.46Å; I421-V483 HydrophobicContact CG2-CG1 3.85Å; I421-V483 WeakPolarHBondContact O-CG1 3.22Å; I421-E486 HydrophobicContact CD1-CB 4.41Å; I421-E486 WeakPolarHBondContact CD1-O 3.06Å; I421-E486 HydrophobicContact CG2-CB 3.72Å; I421-L487 HydrophobicContact CB-CD2 3.82Å; I421-L487 HydrophobicContact CB-CG 4.46Å; I421-L487 HydrophobicContact CG2-CD2 3.7Å; I421-L487 HydrophobicContact CG2-CG 3.78Å; I421-Y662 HydrophobicContact CD1-CD1 4.35Å; I421-Y662 HydrophobicContact CD1-CE1 3.96Å; I421-M663 HydrophobicContact CG1-CE 4.21Å; I421-M663 HydrophobicContact CG1-SD 3.71Å; I421-V666 HydrophobicContact CD1-CG2 4Å; I421-V666 HydrophobicContact CG1-CG1 4.22Å; I421-V666 HydrophobicContact CG1-CG2 4.21Å; I421-V666 HydrophobicContact CG2-CG1 4.44Å
422	S	95.1	Very high	94.5	Very high	50 Å²	50	36.4 Å²	36.4	35%	0.35	18%	0.179	S	C	.	.	H	α-helix	trans	-59.8	-27.4	-178.4	50.8	0	0	0	0	113.9	K418 K419 L424	K418-S422 WeakPolarHBondContact O-CB 3.41Å; K418-S422 PolarHBondContact O-N 2.96Å; K418-S422 PolarHBondContact O-OG 3.45Å; K419-S422 PolarHBondContact O-OG 3.32Å; K419-S422 VanDerWaalsContact O-OG 3.13Å; S422-L424 VanDerWaalsContact C-N 3.29Å; S422-L424 PolarHBondContact O-N 2.71Å
423	R	92.7	Very high	94.9	Very high	90 Å²	90	39.4 Å²	39.4	34%	0.34	20%	0.195	S	C	.	.	H	α-helix	trans	-67.3	-25.7	173.6	-65.3	171	70.3	-140.3	-3.7	113	M381 K419 Q420 I421 K425 E426 P427	M381-R423 VanDerWaalsContact CE-C 3.41Å; M381-R423 HydrophobicContact CE-CB 3.58Å; M381-R423 WeakPolarHBondContact CE-O 3.48Å; M381-R423 PolarHBondContact O-NH1 3.47Å; M381-R423 PolarHBondContact O-NH2 2.96Å; K419-R423 WeakPolarHBondContact O-CG 3.16Å; Q420-R423 PolarHBondContact O-N 3.04Å; I421-R423 PolarHBondContact O-N 2.86Å; I421-R423 VanDerWaalsContact O-N 3.14Å; R423-K425 PolarHBondContact O-N 2.95Å; R423-K425 VanDerWaalsContact O-N 3.08Å; R423-E426 PolarHBondContact O-N 3.02Å; R423-P427 WeakPolarHBondContact O-CD 3.36Å
424	L	94.3	Very high	95.1	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.026	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-9.3	-178.4	-63.1	174.7	0	0	0	114	I378 M381 I421 S422 P427 A428 M663 V666 I670	I378-L424 HydrophobicContact CG2-CD2 4.1Å; M381-L424 HydrophobicContact CE-CD2 4.16Å; I421-L424 VanDerWaalsContact O-CB 3.27Å; I421-L424 WeakPolarHBondContact O-CB 3.43Å; I421-L424 PolarHBondContact O-N 3.46Å; S422-L424 VanDerWaalsContact C-N 3.29Å; S422-L424 PolarHBondContact O-N 2.71Å; L424-P427 WeakPolarHBondContact O-CD 3.41Å; L424-P427 WeakPolarHBondContact O-CG 3.31Å; L424-A428 WeakPolarHBondContact O-CB 3.25Å; L424-M663 HydrophobicContact CD1-CE 3.9Å; L424-M663 HydrophobicContact CG-CE 4.4Å; L424-V666 HydrophobicContact CD1-CG1 3.69Å; L424-I670 HydrophobicContact CD1-CG1 4.18Å
425	K	95.6	Very high	95.4	Very high	52 Å²	52	38.1 Å²	38.1	23%	0.226	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-44.8	170.2	-63.3	-179	-179.4	179.1	0	112.2	R423 A428 L429 V483 E484	R423-K425 PolarHBondContact O-N 2.95Å; R423-K425 VanDerWaalsContact O-N 3.08Å; K425-A428 PolarHBondContact O-N 3.15Å; K425-L429 HydrophobicContact CB-CD1 4.49Å; K425-L429 WeakPolarHBondContact O-CB 3.48Å; K425-L429 VanDerWaalsContact O-CG 3.24Å; K425-L429 WeakPolarHBondContact O-CG 3.31Å; K425-L429 PolarHBondContact O-N 3.07Å; K425-V483 HydrophobicContact CD-CG1 4.46Å; K425-V483 HydrophobicContact CG-CB 3.91Å; K425-V483 HydrophobicContact CG-CG1 3.83Å; K425-V483 HydrophobicContact CG-CG2 3.99Å; K425-E484 IonicContact NZ-OE1 2.7Å; K425-E484 PolarHBondContact NZ-OE1 3.11Å
426	E	94.7	Very high	95.6	Very high	136 Å²	136	36.6 Å²	36.6	64%	0.636	18%	0.176	S	C	*	.	H	α-helix	trans	-57.6	-53.3	-175.9	-169.8	-177.2	168.1	0	0	113.9	R423 A428 K430	R423-E426 PolarHBondContact O-N 3.02Å; E426-A428 VanDerWaalsContact C-N 3.3Å; E426-A428 PolarHBondContact O-N 2.86Å; E426-K430 VanDerWaalsContact O-CB 3.27Å; E426-K430 WeakPolarHBondContact O-CB 3.47Å; E426-K430 PolarHBondContact O-N 2.96Å
427	P	94.2	Very high	95.8	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.013	20%	0.201	C	C	.	.	H	α-helix	trans	-67.7	-29.9	179	31.4	-40.7	0	0	0	112.6	F374 E377 I378 M381 R423 L424 C431	F374-P427 HydrophobicContact CD2-CB 4.33Å; F374-P427 WeakPolarHBondContact CD2-O 3.31Å; F374-P427 HydrophobicContact CE2-CB 4.17Å; E377-P427 HydrophobicContact CB-CB 3.99Å; E377-P427 HydrophobicContact CG-CB 4.01Å; I378-P427 HydrophobicContact CG1-CB 3.85Å; I378-P427 HydrophobicContact CG1-CG 3.81Å; M381-P427 HydrophobicContact CE-CG 4.11Å; M381-P427 HydrophobicContact SD-CB 3.95Å; M381-P427 VanDerWaalsContact SD-CD 3.52Å; M381-P427 HydrophobicContact SD-CG 3.42Å; M381-P427 WeakPolarHBondContact SD-CG 3.3Å; R423-P427 WeakPolarHBondContact O-CD 3.36Å; L424-P427 WeakPolarHBondContact O-CD 3.41Å; L424-P427 WeakPolarHBondContact O-CG 3.31Å; P427-C431 WeakPolarHBondContact O-CB 3.47Å; P427-C431 PolarHBondContact O-N 3.41Å
428	A	96.9	Very high	95.9	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-69.6	-49	178.7	0	0	0	0	0	111	F374 L424 K425 E426 K430 C431 V432 L479 V674	F374-A428 HydrophobicContact CE2-CB 4.43Å; L424-A428 WeakPolarHBondContact O-CB 3.25Å; K425-A428 PolarHBondContact O-N 3.15Å; E426-A428 VanDerWaalsContact C-N 3.3Å; E426-A428 PolarHBondContact O-N 2.86Å; A428-K430 PolarHBondContact O-N 2.73Å; A428-C431 WeakPolarHBondContact O-CB 3.26Å; A428-C431 PolarHBondContact O-N 3Å; A428-C431 VanDerWaalsContact O-N 3.17Å; A428-V432 PolarHBondContact O-N 3.47Å; A428-L479 HydrophobicContact CB-CD1 4.38Å; A428-V674 HydrophobicContact CB-CG1 4.49Å; A428-V674 HydrophobicContact CB-CG2 3.82Å
429	L	97.6	Very high	95.9	Very high	46 Å²	46	38.6 Å²	38.6	24%	0.241	19%	0.192	C	C	.	.	H	α-helix	trans	-60.4	-44.5	174.7	-66.2	172.2	0	0	0	111.2	K425 C431 V432 D433 K476 I480	K425-L429 HydrophobicContact CB-CD1 4.49Å; K425-L429 WeakPolarHBondContact O-CB 3.48Å; K425-L429 VanDerWaalsContact O-CG 3.24Å; K425-L429 WeakPolarHBondContact O-CG 3.31Å; K425-L429 PolarHBondContact O-N 3.07Å; L429-C431 VanDerWaalsContact C-N 3.26Å; L429-C431 PolarHBondContact O-N 3.36Å; L429-V432 WeakPolarHBondContact O-CA 3.35Å; L429-V432 VanDerWaalsContact O-CB 3.31Å; L429-V432 WeakPolarHBondContact O-CB 3.46Å; L429-V432 PolarHBondContact O-N 3.34Å; L429-D433 PolarHBondContact O-N 3.13Å; L429-K476 HydrophobicContact CD2-CB 3.55Å; L429-K476 HydrophobicContact CD2-CD 4.19Å; L429-K476 HydrophobicContact CD2-CG 3.56Å; L429-I480 HydrophobicContact CD1-CD1 4.49Å; L429-I480 HydrophobicContact CD2-CD1 4.2Å; L429-I480 HydrophobicContact CD2-CG1 4.2Å
430	K	96	Very high	96	Very high	64 Å²	64	34.7 Å²	34.7	28%	0.278	18%	0.179	S	C	.	.	H	α-helix	trans	-62.2	-31.3	176	-164	-173.7	-168.5	-176.2	0	113.2	E377 E426 A428 V432 D433 L434	E377-K430 HydrophobicContact CG-CD 3.9Å; E377-K430 IonicContact OE1-NZ 2.65Å; E377-K430 PolarHBondContact OE1-NZ 3.02Å; E377-K430 IonicContact OE2-NZ 2.65Å; E377-K430 PolarHBondContact OE2-NZ 3.17Å; E426-K430 VanDerWaalsContact O-CB 3.27Å; E426-K430 WeakPolarHBondContact O-CB 3.47Å; E426-K430 PolarHBondContact O-N 2.96Å; A428-K430 PolarHBondContact O-N 2.73Å; K430-V432 VanDerWaalsContact C-N 3.34Å; K430-D433 WeakPolarHBondContact CA-OD2 3.46Å; K430-D433 PolarHBondContact O-N 3.06Å; K430-L434 HydrophobicContact CG-CD1 4.49Å; K430-L434 VanDerWaalsContact O-CG 3.32Å; K430-L434 WeakPolarHBondContact O-CG 3.49Å; K430-L434 PolarHBondContact O-N 3.37Å; K430-L434 VanDerWaalsContact O-N 3.15Å
431	C	97.4	Very high	96.2	Very high	4 Å²	4	37.3 Å²	37.3	3%	0.027	20%	0.196	C	C	.	.	H	α-helix	trans	-66.5	-36.3	172.1	-169.4	0	0	0	0	111.7	F374 P427 A428 L429 V435 V674 I678	F374-C431 HydrophobicContact CB-CB 4.18Å; F374-C431 HydrophobicContact CD2-CB 3.79Å; F374-C431 HydrophobicContact CE2-CB 4.39Å; F374-C431 HydrophobicContact CG-CB 4.03Å; P427-C431 WeakPolarHBondContact O-CB 3.47Å; P427-C431 PolarHBondContact O-N 3.41Å; A428-C431 WeakPolarHBondContact O-CB 3.26Å; A428-C431 PolarHBondContact O-N 3Å; A428-C431 VanDerWaalsContact O-N 3.17Å; L429-C431 VanDerWaalsContact C-N 3.26Å; L429-C431 PolarHBondContact O-N 3.36Å; C431-V435 VanDerWaalsContact O-CG2 3.31Å; C431-V435 WeakPolarHBondContact O-CG2 3.47Å; C431-V435 PolarHBondContact O-N 3.45Å; C431-V674 HydrophobicContact CB-CG1 4.26Å; C431-I678 HydrophobicContact CB-CD1 4.17Å
432	V	98.4	Very high	96.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-50.1	172.1	-170.8	0	0	0	0	110	A428 L429 K430 L434 V435 V436 E472 C475 K476 L479 I678 M682	A428-V432 PolarHBondContact O-N 3.47Å; L429-V432 WeakPolarHBondContact O-CA 3.35Å; L429-V432 VanDerWaalsContact O-CB 3.31Å; L429-V432 WeakPolarHBondContact O-CB 3.46Å; L429-V432 PolarHBondContact O-N 3.34Å; K430-V432 VanDerWaalsContact C-N 3.34Å; V432-L434 VanDerWaalsContact C-N 3.31Å; V432-L434 PolarHBondContact O-N 3.34Å; V432-V435 PolarHBondContact O-N 3.26Å; V432-V435 VanDerWaalsContact O-N 3.07Å; V432-V436 HydrophobicContact CG1-CG2 4.1Å; V432-V436 WeakPolarHBondContact O-CG2 3.08Å; V432-V436 PolarHBondContact O-N 3.39Å; V432-E472 HydrophobicContact CG1-CG 4.11Å; V432-C475 HydrophobicContact CG1-CB 4.48Å; V432-K476 HydrophobicContact CB-CG 4.25Å; V432-K476 HydrophobicContact CG1-CG 4.18Å; V432-K476 HydrophobicContact CG2-CG 4.22Å; V432-L479 HydrophobicContact CG2-CD1 3.63Å; V432-I678 HydrophobicContact CG2-CD1 4.04Å; V432-I678 HydrophobicContact CG2-CG1 4.1Å; V432-M682 HydrophobicContact CG1-CE 4.13Å; V432-M682 HydrophobicContact CG1-SD 3.8Å
433	D	98	Very high	96.2	Very high	63 Å²	63	35.1 Å²	35.1	34%	0.337	18%	0.18	S	C	.	.	H	α-helix	trans	-54.3	-44.8	-178.2	-60	-33.9	0	0	0	112.7	L429 K430 T437 K476	L429-D433 PolarHBondContact O-N 3.13Å; K430-D433 WeakPolarHBondContact CA-OD2 3.46Å; K430-D433 PolarHBondContact O-N 3.06Å; D433-T437 WeakPolarHBondContact O-CB 3.27Å; D433-T437 PolarHBondContact O-N 2.93Å; D433-T437 PolarHBondContact O-OG1 3.19Å; D433-K476 WeakPolarHBondContact OD1-CE 3.49Å; D433-K476 IonicContact OD1-NZ 2.73Å; D433-K476 PolarHBondContact OD1-NZ 3.3Å
434	L	97	Very high	96.3	Very high	60 Å²	60	34.2 Å²	34.2	31%	0.314	18%	0.182	S	C	.	.	H	α-helix	trans	-68.4	-36.5	179.5	-67.9	169.5	0	0	0	112.3	L369 R373 K430 V432 T437 E438	L369-L434 HydrophobicContact CD1-CB 3.83Å; L369-L434 HydrophobicContact CD2-CB 3.91Å; L369-L434 HydrophobicContact CD2-CD1 4.09Å; L369-L434 HydrophobicContact CG-CB 4.5Å; R373-L434 HydrophobicContact CG-CD1 3.93Å; K430-L434 HydrophobicContact CG-CD1 4.49Å; K430-L434 VanDerWaalsContact O-CG 3.32Å; K430-L434 WeakPolarHBondContact O-CG 3.49Å; K430-L434 PolarHBondContact O-N 3.37Å; K430-L434 VanDerWaalsContact O-N 3.15Å; V432-L434 VanDerWaalsContact C-N 3.31Å; V432-L434 PolarHBondContact O-N 3.34Å; L434-T437 PolarHBondContact O-N 2.95Å; L434-E438 PolarHBondContact O-N 3.49Å
435	V	98.1	Very high	96.2	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-74.6	-38.2	177	175.8	0	0	0	0	111.4	I366 L369 F370 C431 V432 T437 E438 L439 I678 M682 I683	I366-V435 HydrophobicContact CD1-CG1 4.24Å; I366-V435 HydrophobicContact CG1-CG1 4.23Å; I366-V435 HydrophobicContact CG2-CG1 4.2Å; I366-V435 HydrophobicContact CG2-CG2 4.31Å; L369-V435 HydrophobicContact CB-CG2 4.38Å; L369-V435 HydrophobicContact CD1-CG2 3.73Å; F370-V435 HydrophobicContact CE1-CG2 3.91Å; F370-V435 HydrophobicContact CZ-CG2 4.36Å; C431-V435 VanDerWaalsContact O-CG2 3.31Å; C431-V435 WeakPolarHBondContact O-CG2 3.47Å; C431-V435 PolarHBondContact O-N 3.45Å; V432-V435 PolarHBondContact O-N 3.26Å; V432-V435 VanDerWaalsContact O-N 3.07Å; V435-T437 VanDerWaalsContact C-N 3.27Å; V435-T437 PolarHBondContact O-N 3.33Å; V435-E438 PolarHBondContact O-N 2.84Å; V435-L439 HydrophobicContact CG1-CD1 4.03Å; V435-L439 HydrophobicContact CG1-CG 4.26Å; V435-L439 WeakPolarHBondContact O-CB 3.44Å; V435-L439 VanDerWaalsContact O-CG 3.28Å; V435-L439 WeakPolarHBondContact O-CG 3.43Å; V435-L439 PolarHBondContact O-N 2.85Å; V435-I678 HydrophobicContact CB-CG2 4.18Å; V435-I678 HydrophobicContact CG1-CG2 3.79Å; V435-I678 HydrophobicContact CG2-CG2 4.32Å; V435-M682 HydrophobicContact CB-CE 3.95Å; V435-M682 HydrophobicContact CG1-CE 3.59Å; V435-I683 HydrophobicContact CG1-CD1 3.98Å; V435-I683 HydrophobicContact CG1-CG1 4.36Å
436	V	97.9	Very high	96.1	Very high	22 Å²	22	35.7 Å²	35.7	13%	0.133	20%	0.199	C	C	.	.	H	α-helix	trans	-58.4	-42	171	170.7	0	0	0	0	110.9	V432 L439 G440 L468 E472 M682	V432-V436 HydrophobicContact CG1-CG2 4.1Å; V432-V436 WeakPolarHBondContact O-CG2 3.08Å; V432-V436 PolarHBondContact O-N 3.39Å; V436-L439 PolarHBondContact O-N 3.5Å; V436-G440 PolarHBondContact O-N 2.85Å; V436-L468 HydrophobicContact CG1-CD2 4.17Å; V436-L468 HydrophobicContact CG1-CG 4.27Å; V436-L468 HydrophobicContact CG2-CD1 4.47Å; V436-E472 HydrophobicContact CG2-CB 3.86Å; V436-E472 HydrophobicContact CG2-CG 3.8Å; V436-M682 HydrophobicContact CG2-CE 3.57Å; V436-M682 HydrophobicContact CG2-SD 3.47Å; V436-M682 WeakPolarHBondContact CG2-SD 3.29Å
437	T	97.1	Very high	96.1	Very high	93 Å²	93	29.2 Å²	29.2	57%	0.571	17%	0.169	S	C	*	.	H	α-helix	trans	-60.4	-47.2	178.1	-56.7	0	0	0	0	111.7	D433 L434 V435 G440 T441	D433-T437 WeakPolarHBondContact O-CB 3.27Å; D433-T437 PolarHBondContact O-N 2.93Å; D433-T437 PolarHBondContact O-OG1 3.19Å; L434-T437 PolarHBondContact O-N 2.95Å; V435-T437 VanDerWaalsContact C-N 3.27Å; V435-T437 PolarHBondContact O-N 3.33Å; T437-G440 PolarHBondContact O-N 3.43Å; T437-T441 PolarHBondContact O-N 3.32Å
438	E	95.5	Very high	96	Very high	19 Å²	19	33.6 Å²	33.6	9%	0.089	19%	0.189	C	C	.	.	H	α-helix	trans	-70.1	-36.1	177	-177.7	60.7	-155.1	0	0	112.5	G362 R365 I366 L434 V435 G440 T441 V442	G362-E438 WeakPolarHBondContact CA-OE1 3.25Å; G362-E438 PolarHBondContact N-OE1 2.92Å; R365-E438 HydrophobicContact CB-CG 4.01Å; R365-E438 WeakPolarHBondContact CD-OE1 3.31Å; R365-E438 WeakPolarHBondContact CD-OE2 3.44Å; R365-E438 IonicContact CZ-OE2 3.72Å; R365-E438 IonicContact NE-OE2 2.71Å; R365-E438 IonicContact NH1-OE1 3.9Å; R365-E438 IonicContact NH1-OE2 3.91Å; R365-E438 PolarHBondContact NH1-OE2 2.97Å; I366-E438 HydrophobicContact CG1-CB 4.37Å; I366-E438 HydrophobicContact CG1-CG 3.99Å; L434-E438 PolarHBondContact O-N 3.49Å; V435-E438 PolarHBondContact O-N 2.84Å; E438-G440 VanDerWaalsContact C-N 3.27Å; E438-G440 PolarHBondContact O-N 2.88Å; E438-T441 PolarHBondContact O-N 3.28Å; E438-T441 PolarHBondContact O-OG1 3.02Å; E438-V442 WeakPolarHBondContact O-CG2 3.35Å; E438-V442 PolarHBondContact O-N 3.24Å
439	L	96.9	Very high	95.6	Very high	1 Å²	1	38 Å²	38	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-36.7	172.8	-71.7	173.2	0	0	0	111.8	F343 I347 I366 V435 V436 V442 I443 L468 M682 I683	F343-L439 HydrophobicContact CZ-CD2 4.25Å; I347-L439 HydrophobicContact CD1-CD2 3.51Å; I347-L439 HydrophobicContact CG1-CD2 4.43Å; I366-L439 HydrophobicContact CD1-CD2 3.8Å; I366-L439 HydrophobicContact CD1-CG 4.2Å; V435-L439 HydrophobicContact CG1-CD1 4.03Å; V435-L439 HydrophobicContact CG1-CG 4.26Å; V435-L439 WeakPolarHBondContact O-CB 3.44Å; V435-L439 VanDerWaalsContact O-CG 3.28Å; V435-L439 WeakPolarHBondContact O-CG 3.43Å; V435-L439 PolarHBondContact O-N 2.85Å; V436-L439 PolarHBondContact O-N 3.5Å; L439-V442 PolarHBondContact O-N 3.03Å; L439-I443 WeakPolarHBondContact O-CD1 3.46Å; L439-I443 VanDerWaalsContact O-CG1 3.25Å; L439-I443 WeakPolarHBondContact O-CG1 3.44Å; L439-I443 PolarHBondContact O-N 3.5Å; L439-L468 HydrophobicContact CB-CD1 4.26Å; L439-L468 HydrophobicContact CB-CD2 3.77Å; L439-L468 HydrophobicContact CD1-CD1 3.63Å; L439-M682 HydrophobicContact CD1-CE 3.8Å; L439-M682 HydrophobicContact CD1-CG 4.37Å; L439-I683 HydrophobicContact CD1-CG1 3.92Å; L439-I683 HydrophobicContact CD2-CG1 4.31Å
440	G	96.2	Very high	95.3	Very high	12 Å²	12	36 Å²	36	12%	0.124	20%	0.202	C	C	.	.	H	α-helix	trans	-61.4	-40.2	172.6	0	0	0	0	0	113.2	V436 T437 E438 N444	V436-G440 PolarHBondContact O-N 2.85Å; T437-G440 PolarHBondContact O-N 3.43Å; E438-G440 VanDerWaalsContact C-N 3.27Å; E438-G440 PolarHBondContact O-N 2.88Å; G440-N444 PolarHBondContact O-N 3.46Å; G440-N444 VanDerWaalsContact O-N 3.15Å; G440-N444 PolarHBondContact O-OD1 3.21Å
441	T	94.5	Very high	95	Very high	64 Å²	64	35.7 Å²	35.7	39%	0.393	21%	0.208	S	C	.	.	H	α-helix	trans	-68.7	-37.2	175.5	63.6	0	0	0	0	111.8	T437 E438 S445	T437-T441 PolarHBondContact O-N 3.32Å; E438-T441 PolarHBondContact O-N 3.28Å; E438-T441 PolarHBondContact O-OG1 3.02Å; T441-S445 WeakPolarHBondContact O-CB 3.5Å; T441-S445 PolarHBondContact O-N 2.93Å
442	V	94.7	Very high	94.5	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.018	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-49.8	173.1	173	0	0	0	0	111.4	F343 S346 I347 E438 L439 N444 S445 C446	F343-V442 HydrophobicContact CD2-CG1 3.75Å; F343-V442 HydrophobicContact CE2-CG1 3.98Å; S346-V442 WeakPolarHBondContact OG-CG1 3.29Å; I347-V442 HydrophobicContact CD1-CB 4.47Å; I347-V442 HydrophobicContact CD1-CG1 4.11Å; I347-V442 HydrophobicContact CD1-CG2 4.15Å; I347-V442 HydrophobicContact CG1-CG1 4.49Å; E438-V442 WeakPolarHBondContact O-CG2 3.35Å; E438-V442 PolarHBondContact O-N 3.24Å; L439-V442 PolarHBondContact O-N 3.03Å; V442-N444 VanDerWaalsContact C-N 3.33Å; V442-N444 PolarHBondContact O-N 3.46Å; V442-S445 PolarHBondContact O-N 3.44Å; V442-S445 VanDerWaalsContact O-N 3.14Å; V442-C446 PolarHBondContact O-N 3.37Å; V442-C446 PolarHBondContact O-SG 2.99Å
443	I	96.1	Very high	94.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-54.1	-50.4	178.6	-70.7	159.4	0	0	0	110.6	F339 F343 L439 S445 C446 A447 V464 L468	F339-I443 HydrophobicContact CZ-CG2 4.31Å; F343-I443 HydrophobicContact CD2-CG1 4.33Å; F343-I443 HydrophobicContact CE2-CG1 3.94Å; L439-I443 WeakPolarHBondContact O-CD1 3.46Å; L439-I443 VanDerWaalsContact O-CG1 3.25Å; L439-I443 WeakPolarHBondContact O-CG1 3.44Å; L439-I443 PolarHBondContact O-N 3.5Å; I443-S445 VanDerWaalsContact C-N 3.33Å; I443-S445 PolarHBondContact O-N 3.41Å; I443-C446 PolarHBondContact O-N 2.94Å; I443-A447 WeakPolarHBondContact O-CB 3.22Å; I443-A447 PolarHBondContact O-N 3.41Å; I443-V464 HydrophobicContact CD1-CG1 3.69Å; I443-V464 HydrophobicContact CG1-CG1 3.86Å; I443-V464 HydrophobicContact CG2-CB 4.45Å; I443-V464 HydrophobicContact CG2-CG1 4.38Å; I443-L468 HydrophobicContact CD1-CD2 3.79Å
444	N	94.9	Very high	94	Very high	71 Å²	71	39.6 Å²	39.6	38%	0.38	22%	0.224	S	C	.	.	H	α-helix	trans	-65	-37	-178.9	-63.2	-2.8	0	0	0	111.8	G440 V442 A447 E448	G440-N444 PolarHBondContact O-N 3.46Å; G440-N444 VanDerWaalsContact O-N 3.15Å; G440-N444 PolarHBondContact O-OD1 3.21Å; V442-N444 VanDerWaalsContact C-N 3.33Å; V442-N444 PolarHBondContact O-N 3.46Å; N444-A447 PolarHBondContact O-N 2.98Å; N444-E448 PolarHBondContact O-N 3.09Å; N444-E448 VanDerWaalsContact O-N 3.13Å
445	S	92.8	Very high	93.7	Very high	84 Å²	84	41.9 Å²	41.9	59%	0.587	23%	0.228	S	C	*	.	H	α-helix	trans	-67.7	-34.4	176.4	-171.4	0	0	0	0	113	T441 V442 I443	T441-S445 WeakPolarHBondContact O-CB 3.5Å; T441-S445 PolarHBondContact O-N 2.93Å; V442-S445 PolarHBondContact O-N 3.44Å; V442-S445 VanDerWaalsContact O-N 3.14Å; I443-S445 VanDerWaalsContact C-N 3.33Å; I443-S445 PolarHBondContact O-N 3.41Å
446	C	93.8	Very high	93.5	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.034	23%	0.228	C	C	.	.	H	α-helix	trans	-74.6	-36.8	174.5	-61.8	0	0	0	0	111.2	F339 D342 V442 I443 E448 N449	F339-C446 HydrophobicContact CD2-CB 3.62Å; F339-C446 HydrophobicContact CE2-CB 3.62Å; F339-C446 HydrophobicContact CG-CB 4.47Å; F339-C446 HydrophobicContact CZ-CB 4.47Å; D342-C446 VanDerWaalsContact C-SG 3.58Å; D342-C446 HydrophobicContact CB-CB 4.31Å; V442-C446 PolarHBondContact O-N 3.37Å; V442-C446 PolarHBondContact O-SG 2.99Å; I443-C446 PolarHBondContact O-N 2.94Å; C446-E448 VanDerWaalsContact C-N 3.3Å; C446-E448 PolarHBondContact O-N 3.45Å; C446-N449 PolarHBondContact O-N 2.9Å
447	A	94.7	Very high	93.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-70	-22.2	179.2	0	0	0	0	0	113.7	F339 I443 N444 N449 M450 R457 E461	F339-A447 HydrophobicContact CD2-CB 4.48Å; F339-A447 HydrophobicContact CE2-CB 4.1Å; I443-A447 WeakPolarHBondContact O-CB 3.22Å; I443-A447 PolarHBondContact O-N 3.41Å; N444-A447 PolarHBondContact O-N 2.98Å; A447-N449 PolarHBondContact O-N 3.19Å; A447-M450 WeakPolarHBondContact O-CA 3.41Å; A447-M450 WeakPolarHBondContact O-CB 3.23Å; A447-M450 PolarHBondContact O-N 3.27Å; A447-R457 HydrophobicContact CB-CG 4.06Å; A447-E461 HydrophobicContact CB-CG 3.49Å; A447-E461 VanDerWaalsContact CB-CG 3.49Å; A447-E461 VanDerWaalsContact CB-OE1 3.25Å; A447-E461 WeakPolarHBondContact CB-OE1 3.3Å
448	E	91.9	Very high	93.2	Very high	94 Å²	94	44.4 Å²	44.4	44%	0.439	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-59.6	-28.7	174.6	-163	60	-116.2	0	0	112.9	N444 C446 M450 S451 R457	N444-E448 PolarHBondContact O-N 3.09Å; N444-E448 VanDerWaalsContact O-N 3.13Å; C446-E448 VanDerWaalsContact C-N 3.3Å; C446-E448 PolarHBondContact O-N 3.45Å; E448-M450 PolarHBondContact O-N 2.7Å; E448-S451 WeakPolarHBondContact O-CB 3.37Å; E448-S451 PolarHBondContact O-N 2.8Å; E448-S451 PolarHBondContact O-OG 2.86Å; E448-S451 WeakPolarHBondContact OE1-CB 3.39Å; E448-R457 IonicContact OE1-CZ 2.68Å; E448-R457 IonicContact OE1-NH1 3.15Å; E448-R457 PolarHBondContact OE1-NH1 3.32Å; E448-R457 IonicContact OE2-CZ 3.96Å; E448-R457 IonicContact OE2-NH1 2.84Å; E448-R457 PolarHBondContact OE2-NH1 3.43Å; E448-R457 IonicContact OE2-NH2 2.69Å; E448-R457 PolarHBondContact OE2-NH2 2.73Å
449	N	88.8	Confident	93.1	Very high	94 Å²	94	44.3 Å²	44.3	50%	0.503	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-64.4	-17.5	172.9	-72	-20.2	0	0	0	112.9	D342 C446 A447	D342-N449 PolarHBondContact OD2-ND2 3.33Å; C446-N449 PolarHBondContact O-N 2.9Å; A447-N449 PolarHBondContact O-N 3.19Å
450	M	91.5	Very high	93.1	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-91.6	4.7	174.1	-62.3	177.7	165.4	0	0	113.8	M335 V336 F339 A447 E448 R452 Y453 L456 R457 V460	M335-M450 VanDerWaalsContact C-CE 3.47Å; M335-M450 HydrophobicContact CB-CE 3.96Å; M335-M450 HydrophobicContact CB-CG 4.34Å; M335-M450 VanDerWaalsContact O-CE 3.24Å; M335-M450 WeakPolarHBondContact O-CE 3.48Å; V336-M450 HydrophobicContact CG2-CE 4.36Å; F339-M450 HydrophobicContact CB-CE 3.61Å; F339-M450 HydrophobicContact CD2-CE 4.5Å; F339-M450 HydrophobicContact CG-CE 4.2Å; A447-M450 WeakPolarHBondContact O-CA 3.41Å; A447-M450 WeakPolarHBondContact O-CB 3.23Å; A447-M450 PolarHBondContact O-N 3.27Å; E448-M450 PolarHBondContact O-N 2.7Å; M450-R452 PolarHBondContact O-N 3.01Å; M450-Y453 CarbonylContact O-C 3.6Å; M450-Y453 PolarHBondContact O-N 2.9Å; M450-L456 HydrophobicContact CE-CD2 4.47Å; M450-L456 HydrophobicContact SD-CD2 4.31Å; M450-L456 HydrophobicContact SD-CG 4.11Å; M450-R457 HydrophobicContact CB-CB 3.97Å; M450-R457 HydrophobicContact CB-CG 4.5Å; M450-V460 HydrophobicContact CE-CG2 3.99Å; M450-V460 HydrophobicContact SD-CB 4.09Å; M450-V460 HydrophobicContact SD-CG1 4.25Å; M450-V460 HydrophobicContact SD-CG2 3.83Å
451	S	89.7	Confident	93.1	Very high	58 Å²	58	45.6 Å²	45.6	41%	0.406	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-14.5	-177.4	52.3	0	0	0	0	116.4	E448 Y453	E448-S451 WeakPolarHBondContact O-CB 3.37Å; E448-S451 PolarHBondContact O-N 2.8Å; E448-S451 PolarHBondContact O-OG 2.86Å; E448-S451 WeakPolarHBondContact OE1-CB 3.39Å; S451-Y453 VanDerWaalsContact C-N 3.31Å
452	R	87.1	Confident	93.1	Very high	87 Å²	87	48.5 Å²	48.5	33%	0.328	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-30	167.9	-175.6	175.6	-176.2	172.7	0.2	113.3	M450 E710 S711 A714	M450-R452 PolarHBondContact O-N 3.01Å; R452-E710 IonicContact CZ-OE1 3.79Å; R452-E710 VanDerWaalsContact CZ-OE1 3.23Å; R452-E710 IonicContact NE-OE1 3.8Å; R452-E710 PolarHBondContact NE-OE1 3.07Å; R452-E710 IonicContact NH2-OE1 2.68Å; R452-E710 PolarHBondContact NH2-OE1 3.28Å; R452-E710 WeakPolarHBondContact O-CA 3.42Å; R452-S711 PolarHBondContact O-N 2.73Å; R452-A714 HydrophobicContact CG-CB 4.17Å
453	Y	91.6	Very high	93.2	Very high	18 Å²	18	49 Å²	49	7%	0.071	24%	0.239	C	C	.	.	S	Bend	trans	-126.2	80.7	-174	-59.1	-66.9	0	0	0	109.7	M335 M450 S451 R455 L456 R457 M708 E710	M335-Y453 HydrophobicContact CG-CD2 4.42Å; M450-Y453 CarbonylContact O-C 3.6Å; M450-Y453 PolarHBondContact O-N 2.9Å; S451-Y453 VanDerWaalsContact C-N 3.31Å; Y453-R455 VanDerWaalsContact C-N 3.31Å; Y453-R455 PolarHBondContact O-N 2.83Å; Y453-L456 PolarHBondContact O-N 3.27Å; Y453-R457 PolarHBondContact O-N 3.25Å; Y453-M708 HydrophobicContact CD1-CB 4.46Å; Y453-M708 HydrophobicContact CD1-CE 4.02Å; Y453-M708 WeakPolarHBondContact CD1-O 3.36Å; Y453-M708 HydrophobicContact CD2-CE 3.75Å; Y453-M708 HydrophobicContact CE1-CE 3.88Å; Y453-M708 WeakPolarHBondContact CE1-O 3.39Å; Y453-M708 HydrophobicContact CE2-CE 3.61Å; Y453-M708 HydrophobicContact CG-CE 3.96Å; Y453-M708 HydrophobicContact CG-SD 4.42Å; Y453-E710 HydrophobicContact CE1-CG 3.94Å
454	P	92.2	Very high	93.3	Very high	45 Å²	45	49 Å²	49	29%	0.292	24%	0.239	S	C	.	.	H	α-helix	trans	-58.7	-37.6	-169.4	-26.6	36.1	0	0	0	114	R457 E458	P454-R457 WeakPolarHBondContact O-CB 3.37Å; P454-R457 PolarHBondContact O-N 3.07Å; P454-E458 WeakPolarHBondContact O-CB 3.31Å; P454-E458 WeakPolarHBondContact O-CG 3.26Å; P454-E458 PolarHBondContact O-N 3.11Å
455	R	91.6	Very high	93.4	Very high	108 Å²	108	47.5 Å²	47.5	41%	0.408	23%	0.231	S	C	.	.	H	α-helix	trans	-66.8	-44.3	177.8	-65.3	167.4	-172.6	-101.3	18.6	112.3	Y453 R457 E458 D459 S706 E709	Y453-R455 VanDerWaalsContact C-N 3.31Å; Y453-R455 PolarHBondContact O-N 2.83Å; R455-R457 VanDerWaalsContact C-N 3.28Å; R455-R457 PolarHBondContact O-N 3.5Å; R455-E458 PolarHBondContact O-N 3.33Å; R455-D459 VanDerWaalsContact O-CB 3.31Å; R455-D459 WeakPolarHBondContact O-CB 3.42Å; R455-D459 PolarHBondContact O-N 3.34Å; R455-S706 WeakPolarHBondContact CD-O 3.4Å; R455-E709 IonicContact CZ-OE2 2.84Å; R455-E709 IonicContact NE-OE2 2.73Å; R455-E709 PolarHBondContact NE-OE2 3.46Å; R455-E709 IonicContact NH2-OE2 3.42Å; R455-E709 PolarHBondContact NH2-OE2 2.8Å
456	L	93.7	Very high	93.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.6	-43.6	172.6	176.7	65.5	0	0	0	111	M332 M335 M450 Y453 D459 V460 L698 L707 M708	M332-L456 HydrophobicContact CG-CD1 4Å; M332-L456 HydrophobicContact CG-CD2 4.37Å; M332-L456 HydrophobicContact SD-CD1 4.48Å; M335-L456 HydrophobicContact CB-CD2 3.9Å; M335-L456 HydrophobicContact CG-CD2 4.27Å; M450-L456 HydrophobicContact CE-CD2 4.47Å; M450-L456 HydrophobicContact SD-CD2 4.31Å; M450-L456 HydrophobicContact SD-CG 4.11Å; Y453-L456 PolarHBondContact O-N 3.27Å; L456-D459 PolarHBondContact O-N 3.42Å; L456-V460 HydrophobicContact CD1-CG2 4.22Å; L456-V460 WeakPolarHBondContact O-CB 3.46Å; L456-V460 VanDerWaalsContact O-CG2 3.31Å; L456-V460 WeakPolarHBondContact O-CG2 3.44Å; L456-V460 PolarHBondContact O-N 3.07Å; L456-L698 HydrophobicContact CD1-CD1 3.98Å; L456-L698 HydrophobicContact CD1-CD2 4.04Å; L456-L707 PolarHBondContact N-O 3.1Å; L456-M708 HydrophobicContact CD2-SD 3.86Å
457	R	94.8	Very high	93.7	Very high	51 Å²	51	47.9 Å²	47.9	19%	0.192	23%	0.231	C	C	.	.	H	α-helix	trans	-60	-54.7	176	179.1	-166.8	174.2	147.8	15	111.7	A447 E448 M450 Y453 P454 R455 D459 V460 E461	A447-R457 HydrophobicContact CB-CG 4.06Å; E448-R457 IonicContact OE1-CZ 2.68Å; E448-R457 IonicContact OE1-NH1 3.15Å; E448-R457 PolarHBondContact OE1-NH1 3.32Å; E448-R457 IonicContact OE2-CZ 3.96Å; E448-R457 IonicContact OE2-NH1 2.84Å; E448-R457 PolarHBondContact OE2-NH1 3.43Å; E448-R457 IonicContact OE2-NH2 2.69Å; E448-R457 PolarHBondContact OE2-NH2 2.73Å; M450-R457 HydrophobicContact CB-CB 3.97Å; M450-R457 HydrophobicContact CB-CG 4.5Å; Y453-R457 PolarHBondContact O-N 3.25Å; P454-R457 WeakPolarHBondContact O-CB 3.37Å; P454-R457 PolarHBondContact O-N 3.07Å; R455-R457 VanDerWaalsContact C-N 3.28Å; R455-R457 PolarHBondContact O-N 3.5Å; R457-D459 PolarHBondContact O-N 3.18Å; R457-V460 PolarHBondContact O-N 3.5Å; R457-E461 HydrophobicContact CG-CG 4.41Å; R457-E461 IonicContact CZ-OE1 3.92Å; R457-E461 IonicContact NE-OE1 2.89Å; R457-E461 PolarHBondContact NE-OE1 2.95Å; R457-E461 IonicContact NH2-OE1 3.94Å; R457-E461 PolarHBondContact NH2-OE1 3.18Å; R457-E461 VanDerWaalsContact NH2-OE1 3.15Å; R457-E461 WeakPolarHBondContact O-CB 3.36Å; R457-E461 WeakPolarHBondContact O-CG 3.2Å; R457-E461 PolarHBondContact O-N 3.39Å
458	E	93.6	Very high	93.9	Very high	116 Å²	116	48 Å²	48	54%	0.542	23%	0.231	S	C	.	.	H	α-helix	trans	-57.9	-38	179.8	-74.9	169.2	-153.8	0	0	111.9	P454 R455 R462	P454-E458 WeakPolarHBondContact O-CB 3.31Å; P454-E458 WeakPolarHBondContact O-CG 3.26Å; P454-E458 PolarHBondContact O-N 3.11Å; R455-E458 PolarHBondContact O-N 3.33Å; E458-R462 WeakPolarHBondContact O-CB 3.32Å; E458-R462 PolarHBondContact O-N 2.99Å
459	D	94.1	Very high	94.2	Very high	18 Å²	18	51.1 Å²	51.1	10%	0.096	24%	0.239	C	C	.	.	H	α-helix	trans	-70.2	-45.6	176.6	-83.5	35.4	0	0	0	112.1	R455 L456 R457 R462 I463 L698 C701 L707	R455-D459 VanDerWaalsContact O-CB 3.31Å; R455-D459 WeakPolarHBondContact O-CB 3.42Å; R455-D459 PolarHBondContact O-N 3.34Å; L456-D459 PolarHBondContact O-N 3.42Å; R457-D459 PolarHBondContact O-N 3.18Å; D459-R462 PolarHBondContact O-N 3.14Å; D459-R462 IonicContact OD1-CZ 2.73Å; D459-R462 VanDerWaalsContact OD1-CZ 3.26Å; D459-R462 IonicContact OD1-NH1 2.75Å; D459-R462 PolarHBondContact OD1-NH1 2.95Å; D459-R462 IonicContact OD1-NH2 3.08Å; D459-R462 PolarHBondContact OD1-NH2 3.03Å; D459-R462 IonicContact OD2-CZ 2.87Å; D459-R462 IonicContact OD2-NH1 3.77Å; D459-R462 IonicContact OD2-NH2 3.36Å; D459-R462 PolarHBondContact OD2-NH2 2.67Å; D459-I463 WeakPolarHBondContact O-CB 3.24Å; D459-I463 VanDerWaalsContact O-CD1 3.29Å; D459-I463 WeakPolarHBondContact O-CD1 3.14Å; D459-I463 WeakPolarHBondContact O-CG1 3.26Å; D459-I463 PolarHBondContact O-N 2.7Å; D459-L698 HydrophobicContact CB-CD2 3.8Å; D459-C701 WeakPolarHBondContact OD2-CB 3.39Å; D459-L707 HydrophobicContact CB-CD2 4.06Å
460	V	95.9	Very high	94.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-50.4	174.2	167.9	0	0	0	0	111.1	F339 M450 L456 R457 R462 I463 V464 L694 L698	F339-V460 HydrophobicContact CD1-CG1 4.13Å; F339-V460 HydrophobicContact CD2-CG1 3.95Å; F339-V460 HydrophobicContact CE1-CG1 3.9Å; F339-V460 HydrophobicContact CE2-CG1 3.71Å; F339-V460 HydrophobicContact CG-CG1 4.16Å; F339-V460 HydrophobicContact CZ-CG1 3.69Å; M450-V460 HydrophobicContact CE-CG2 3.99Å; M450-V460 HydrophobicContact SD-CB 4.09Å; M450-V460 HydrophobicContact SD-CG1 4.25Å; M450-V460 HydrophobicContact SD-CG2 3.83Å; L456-V460 HydrophobicContact CD1-CG2 4.22Å; L456-V460 WeakPolarHBondContact O-CB 3.46Å; L456-V460 VanDerWaalsContact O-CG2 3.31Å; L456-V460 WeakPolarHBondContact O-CG2 3.44Å; L456-V460 PolarHBondContact O-N 3.07Å; R457-V460 PolarHBondContact O-N 3.5Å; V460-R462 VanDerWaalsContact C-N 3.32Å; V460-R462 PolarHBondContact O-N 2.92Å; V460-I463 PolarHBondContact O-N 2.95Å; V460-V464 HydrophobicContact CG1-CG2 4.31Å; V460-V464 WeakPolarHBondContact O-CB 3.5Å; V460-V464 VanDerWaalsContact O-CG2 3.31Å; V460-V464 WeakPolarHBondContact O-CG2 3.36Å; V460-V464 PolarHBondContact O-N 3.3Å; V460-L694 HydrophobicContact CG1-CD2 4.3Å; V460-L694 HydrophobicContact CG2-CD1 4.42Å; V460-L698 HydrophobicContact CG2-CD1 3.89Å; V460-L698 HydrophobicContact CG2-CD2 3.93Å; V460-L698 HydrophobicContact CG2-CG 4.43Å
461	E	96.1	Very high	94.9	Very high	40 Å²	40	52.7 Å²	52.7	19%	0.187	24%	0.244	C	C	.	.	H	α-helix	trans	-57.7	-44.6	177	-73.9	-179.4	-173.3	0	0	110.9	A447 R457 N465	A447-E461 HydrophobicContact CB-CG 3.49Å; A447-E461 VanDerWaalsContact CB-CG 3.49Å; A447-E461 VanDerWaalsContact CB-OE1 3.25Å; A447-E461 WeakPolarHBondContact CB-OE1 3.3Å; R457-E461 HydrophobicContact CG-CG 4.41Å; R457-E461 IonicContact CZ-OE1 3.92Å; R457-E461 IonicContact NE-OE1 2.89Å; R457-E461 PolarHBondContact NE-OE1 2.95Å; R457-E461 IonicContact NH2-OE1 3.94Å; R457-E461 PolarHBondContact NH2-OE1 3.18Å; R457-E461 VanDerWaalsContact NH2-OE1 3.15Å; R457-E461 WeakPolarHBondContact O-CB 3.36Å; R457-E461 WeakPolarHBondContact O-CG 3.2Å; R457-E461 PolarHBondContact O-N 3.39Å; E461-N465 WeakPolarHBondContact O-CB 3.38Å; E461-N465 PolarHBondContact O-N 2.8Å; E461-N465 PolarHBondContact O-ND2 2.83Å
462	R	95.6	Very high	95.3	Very high	124 Å²	124	51.7 Å²	51.7	47%	0.468	23%	0.232	S	C	.	.	H	α-helix	trans	-63.5	-48.6	178.2	-178.7	178.6	70.1	-112	4.4	112.5	E458 D459 V460 S466	E458-R462 WeakPolarHBondContact O-CB 3.32Å; E458-R462 PolarHBondContact O-N 2.99Å; D459-R462 PolarHBondContact O-N 3.14Å; D459-R462 IonicContact OD1-CZ 2.73Å; D459-R462 VanDerWaalsContact OD1-CZ 3.26Å; D459-R462 IonicContact OD1-NH1 2.75Å; D459-R462 PolarHBondContact OD1-NH1 2.95Å; D459-R462 IonicContact OD1-NH2 3.08Å; D459-R462 PolarHBondContact OD1-NH2 3.03Å; D459-R462 IonicContact OD2-CZ 2.87Å; D459-R462 IonicContact OD2-NH1 3.77Å; D459-R462 IonicContact OD2-NH2 3.36Å; D459-R462 PolarHBondContact OD2-NH2 2.67Å; V460-R462 VanDerWaalsContact C-N 3.32Å; V460-R462 PolarHBondContact O-N 2.92Å; R462-S466 VanDerWaalsContact O-CB 3.29Å; R462-S466 WeakPolarHBondContact O-CB 3.5Å; R462-S466 PolarHBondContact O-N 3.27Å
463	I	96.7	Very high	95.8	Very high	15 Å²	15	52.3 Å²	52.3	8%	0.077	24%	0.239	C	C	.	.	H	α-helix	trans	-64.1	-50	-177.6	-67.6	159.8	0	0	0	109.8	D459 V460 S466 Q467 F689 L694 H697 L698	D459-I463 WeakPolarHBondContact O-CB 3.24Å; D459-I463 VanDerWaalsContact O-CD1 3.29Å; D459-I463 WeakPolarHBondContact O-CD1 3.14Å; D459-I463 WeakPolarHBondContact O-CG1 3.26Å; D459-I463 PolarHBondContact O-N 2.7Å; V460-I463 PolarHBondContact O-N 2.95Å; I463-S466 WeakPolarHBondContact O-CB 3.36Å; I463-S466 PolarHBondContact O-N 2.81Å; I463-Q467 PolarHBondContact O-N 3.3Å; I463-F689 HydrophobicContact CG2-CE1 3.77Å; I463-F689 HydrophobicContact CG2-CZ 3.63Å; I463-L694 HydrophobicContact CB-CD1 4Å; I463-L694 HydrophobicContact CD1-CD1 4.25Å; I463-L694 HydrophobicContact CG2-CD1 3.67Å; I463-H697 HydrophobicContact CD1-CB 3.95Å; I463-H697 HydrophobicContact CG1-CB 4.37Å; I463-H697 HydrophobicContact CG2-CB 3.9Å; I463-L698 HydrophobicContact CD1-CD2 3.66Å; I463-L698 HydrophobicContact CD1-CG 4.01Å
464	V	97.5	Very high	96.1	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-70.2	-39.8	-175.8	-177.5	0	0	0	0	111.8	F339 I443 V460 S466 Q467 L468 T686 I690 L694	F339-V464 HydrophobicContact CE1-CG2 4.08Å; F339-V464 HydrophobicContact CZ-CG2 4.23Å; I443-V464 HydrophobicContact CD1-CG1 3.69Å; I443-V464 HydrophobicContact CG1-CG1 3.86Å; I443-V464 HydrophobicContact CG2-CB 4.45Å; I443-V464 HydrophobicContact CG2-CG1 4.38Å; V460-V464 HydrophobicContact CG1-CG2 4.31Å; V460-V464 WeakPolarHBondContact O-CB 3.5Å; V460-V464 VanDerWaalsContact O-CG2 3.31Å; V460-V464 WeakPolarHBondContact O-CG2 3.36Å; V460-V464 PolarHBondContact O-N 3.3Å; V464-S466 VanDerWaalsContact C-N 3.27Å; V464-S466 PolarHBondContact O-N 3.05Å; V464-Q467 PolarHBondContact O-N 3.04Å; V464-L468 WeakPolarHBondContact O-CB 3.2Å; V464-L468 PolarHBondContact O-N 3.27Å; V464-T686 HydrophobicContact CG1-CG2 4.14Å; V464-I690 HydrophobicContact CG1-CD1 3.73Å; V464-I690 HydrophobicContact CG1-CG1 3.91Å; V464-I690 HydrophobicContact CG2-CG1 3.96Å; V464-L694 HydrophobicContact CG2-CD1 3.85Å; V464-L694 HydrophobicContact CG2-CD2 4Å
465	N	97.3	Very high	96.4	Very high	39 Å²	39	56 Å²	56	21%	0.209	25%	0.247	C	C	.	.	H	α-helix	trans	-68.7	-24.3	172.8	-77.5	-76.8	0	0	0	112.9	E461 R469	E461-N465 WeakPolarHBondContact O-CB 3.38Å; E461-N465 PolarHBondContact O-N 2.8Å; E461-N465 PolarHBondContact O-ND2 2.83Å; N465-R469 PolarHBondContact O-N 3.41Å
466	S	96.7	Very high	96.7	Very high	73 Å²	73	52.3 Å²	52.3	51%	0.51	23%	0.234	S	C	.	.	H	α-helix	trans	-70.8	-45.6	171.6	-164.6	0	0	0	0	111.3	R462 I463 V464 R469 D470	R462-S466 VanDerWaalsContact O-CB 3.29Å; R462-S466 WeakPolarHBondContact O-CB 3.5Å; R462-S466 PolarHBondContact O-N 3.27Å; I463-S466 WeakPolarHBondContact O-CB 3.36Å; I463-S466 PolarHBondContact O-N 2.81Å; V464-S466 VanDerWaalsContact C-N 3.27Å; V464-S466 PolarHBondContact O-N 3.05Å; S466-R469 PolarHBondContact O-N 2.92Å; S466-D470 PolarHBondContact O-N 3.22Å
467	Q	97.3	Very high	97	Very high	23 Å²	23	56 Å²	56	11%	0.107	25%	0.254	C	S	.	.	H	α-helix	trans	-61.2	-44.3	173.9	179.2	73.7	-27.3	0	0	111.5	I463 V464 R469 D470 R471 F689	I463-Q467 PolarHBondContact O-N 3.3Å; V464-Q467 PolarHBondContact O-N 3.04Å; Q467-R469 PolarHBondContact O-N 3.01Å; Q467-D470 WeakPolarHBondContact O-CB 3.21Å; Q467-D470 PolarHBondContact O-N 2.68Å; Q467-D470 VanDerWaalsContact O-N 3.16Å; Q467-R471 HydrophobicContact CG-CG 4.34Å; Q467-R471 WeakPolarHBondContact O-CG 3.45Å; Q467-R471 PolarHBondContact O-N 3.34Å; Q467-F689 HydrophobicContact CB-CD1 3.78Å; Q467-F689 HydrophobicContact CB-CE1 3.71Å; Q467-F689 HydrophobicContact CB-CG 4.23Å; Q467-F689 HydrophobicContact CB-CZ 4.1Å; Q467-F689 HydrophobicContact CG-CB 3.99Å; Q467-F689 HydrophobicContact CG-CD1 3.59Å; Q467-F689 HydrophobicContact CG-CD2 4.02Å; Q467-F689 HydrophobicContact CG-CE1 4.03Å; Q467-F689 HydrophobicContact CG-CE2 4.42Å; Q467-F689 HydrophobicContact CG-CG 3.58Å; Q467-F689 HydrophobicContact CG-CZ 4.43Å; Q467-F689 VanDerWaalsContact NE2-CG 3.34Å
468	L	97.8	Very high	97.1	Very high	2 Å²	2	58 Å²	58	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-38.2	179.4	179.5	57.9	0	0	0	112	V436 L439 I443 V464 R471 E472 M682	V436-L468 HydrophobicContact CG1-CD2 4.17Å; V436-L468 HydrophobicContact CG1-CG 4.27Å; V436-L468 HydrophobicContact CG2-CD1 4.47Å; L439-L468 HydrophobicContact CB-CD1 4.26Å; L439-L468 HydrophobicContact CB-CD2 3.77Å; L439-L468 HydrophobicContact CD1-CD1 3.63Å; I443-L468 HydrophobicContact CD1-CD2 3.79Å; V464-L468 WeakPolarHBondContact O-CB 3.2Å; V464-L468 PolarHBondContact O-N 3.27Å; L468-R471 PolarHBondContact O-N 3.5Å; L468-E472 VanDerWaalsContact O-CB 3.32Å; L468-E472 WeakPolarHBondContact O-CB 3.12Å; L468-E472 PolarHBondContact O-N 2.79Å; L468-M682 HydrophobicContact CD1-CG 3.77Å; L468-M682 HydrophobicContact CD1-SD 4.2Å
469	R	97.7	Very high	97.3	Very high	161 Å²	161	52.8 Å²	52.8	61%	0.608	24%	0.241	S	C	*	.	H	α-helix	trans	-75.5	-30.2	177.5	-73.5	-172.1	-70.7	-141.8	-1.2	114.5	N465 S466 Q467 Q473	N465-R469 PolarHBondContact O-N 3.41Å; S466-R469 PolarHBondContact O-N 2.92Å; Q467-R469 PolarHBondContact O-N 3.01Å; R469-Q473 PolarHBondContact O-N 2.8Å
470	D	97.6	Very high	97.5	Very high	77 Å²	77	54.5 Å²	54.5	41%	0.412	25%	0.25	S	C	.	.	H	α-helix	trans	-62.5	-47	167.4	172.2	73.2	0	0	0	110.6	S466 Q467 Q473 R474	S466-D470 PolarHBondContact O-N 3.22Å; Q467-D470 WeakPolarHBondContact O-CB 3.21Å; Q467-D470 PolarHBondContact O-N 2.68Å; Q467-D470 VanDerWaalsContact O-N 3.16Å; D470-Q473 PolarHBondContact O-N 2.99Å; D470-R474 WeakPolarHBondContact O-CB 3.47Å; D470-R474 PolarHBondContact O-N 3.29Å
471	R	98	Very high	97.6	Very high	52 Å²	52	57.5 Å²	57.5	20%	0.196	27%	0.265	C	S	.	.	H	α-helix	trans	-69.9	-34	179.9	-61.8	-59.3	127.8	122.6	7.7	113.4	Q467 L468 C475 L681 M682 S685	Q467-R471 HydrophobicContact CG-CG 4.34Å; Q467-R471 WeakPolarHBondContact O-CG 3.45Å; Q467-R471 PolarHBondContact O-N 3.34Å; L468-R471 PolarHBondContact O-N 3.5Å; R471-C475 WeakPolarHBondContact O-CB 3.48Å; R471-C475 PolarHBondContact O-N 2.85Å; R471-L681 WeakPolarHBondContact CD-O 3.02Å; R471-M682 HydrophobicContact CB-CB 4.4Å; R471-M682 HydrophobicContact CB-CG 4.05Å; R471-S685 WeakPolarHBondContact CD-OG 3.29Å; R471-S685 PolarHBondContact NH1-OG 3.46Å
472	E	98.3	Very high	97.6	Very high	36 Å²	36	57 Å²	57	17%	0.168	26%	0.264	C	S	.	.	H	α-helix	trans	-54.8	-57.5	168.8	173.1	-169.4	162	0	0	110.9	V432 V436 L468 R474 C475 K476 M682	V432-E472 HydrophobicContact CG1-CG 4.11Å; V436-E472 HydrophobicContact CG2-CB 3.86Å; V436-E472 HydrophobicContact CG2-CG 3.8Å; L468-E472 VanDerWaalsContact O-CB 3.32Å; L468-E472 WeakPolarHBondContact O-CB 3.12Å; L468-E472 PolarHBondContact O-N 2.79Å; E472-R474 VanDerWaalsContact C-N 3.35Å; E472-R474 PolarHBondContact O-N 2.96Å; E472-C475 WeakPolarHBondContact O-CB 3.21Å; E472-C475 PolarHBondContact O-N 2.66Å; E472-C475 VanDerWaalsContact O-N 3.16Å; E472-K476 HydrophobicContact CG-CD 4.07Å; E472-K476 WeakPolarHBondContact O-CG 3.33Å; E472-K476 PolarHBondContact O-N 3.25Å; E472-K476 IonicContact OE1-NZ 2.6Å; E472-K476 PolarHBondContact OE1-NZ 3.17Å; E472-M682 HydrophobicContact CB-SD 4.27Å
473	Q	98	Very high	97.7	Very high	100 Å²	100	51.2 Å²	51.2	47%	0.467	24%	0.242	S	C	.	.	H	α-helix	trans	-61.1	-45.8	-178	-176.5	59.6	51.2	0	0	110.9	R469 D470 C475 K476 D477	R469-Q473 PolarHBondContact O-N 2.8Å; D470-Q473 PolarHBondContact O-N 2.99Å; Q473-C475 VanDerWaalsContact C-N 3.3Å; Q473-C475 PolarHBondContact O-N 3.26Å; Q473-K476 WeakPolarHBondContact O-CB 3.44Å; Q473-K476 PolarHBondContact O-N 2.84Å; Q473-K476 VanDerWaalsContact O-N 3.17Å; Q473-D477 PolarHBondContact NE2-OD1 3.34Å; Q473-D477 PolarHBondContact NE2-OD2 3.32Å; Q473-D477 VanDerWaalsContact O-CG 3.26Å; Q473-D477 PolarHBondContact O-N 3.19Å
474	R	98	Very high	97.7	Very high	142 Å²	142	54.3 Å²	54.3	54%	0.536	26%	0.256	S	S	.	.	H	α-helix	trans	-59.3	-38.8	176.1	-172.2	179.5	-177.8	124.1	0.3	112.5	D470 E472 Q478	D470-R474 WeakPolarHBondContact O-CB 3.47Å; D470-R474 PolarHBondContact O-N 3.29Å; E472-R474 VanDerWaalsContact C-N 3.35Å; E472-R474 PolarHBondContact O-N 2.96Å; R474-Q478 WeakPolarHBondContact O-CG 3.11Å; R474-Q478 PolarHBondContact O-N 2.9Å
475	C	98.5	Very high	97.7	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66	-47.4	175.2	-169.5	0	0	0	0	110.9	V432 R471 E472 Q473 D477 Q478 L479 L681	V432-C475 HydrophobicContact CG1-CB 4.48Å; R471-C475 WeakPolarHBondContact O-CB 3.48Å; R471-C475 PolarHBondContact O-N 2.85Å; E472-C475 WeakPolarHBondContact O-CB 3.21Å; E472-C475 PolarHBondContact O-N 2.66Å; E472-C475 VanDerWaalsContact O-N 3.16Å; Q473-C475 VanDerWaalsContact C-N 3.3Å; Q473-C475 PolarHBondContact O-N 3.26Å; C475-D477 VanDerWaalsContact C-N 3.35Å; C475-D477 PolarHBondContact O-N 2.92Å; C475-Q478 PolarHBondContact O-N 2.69Å; C475-L479 WeakPolarHBondContact O-CG 3.08Å; C475-L479 PolarHBondContact O-N 3.11Å; C475-L681 HydrophobicContact CB-CB 4.3Å
476	K	98.5	Very high	97.6	Very high	29 Å²	29	60.8 Å²	60.8	13%	0.126	28%	0.28	C	S	.	.	H	α-helix	trans	-56.7	-45.2	176.8	-70.9	176.7	173.4	177.6	0	112.1	L429 V432 D433 E472 Q473 Q478 L479 I480	L429-K476 HydrophobicContact CD2-CB 3.55Å; L429-K476 HydrophobicContact CD2-CD 4.19Å; L429-K476 HydrophobicContact CD2-CG 3.56Å; V432-K476 HydrophobicContact CB-CG 4.25Å; V432-K476 HydrophobicContact CG1-CG 4.18Å; V432-K476 HydrophobicContact CG2-CG 4.22Å; D433-K476 WeakPolarHBondContact OD1-CE 3.49Å; D433-K476 IonicContact OD1-NZ 2.73Å; D433-K476 PolarHBondContact OD1-NZ 3.3Å; E472-K476 HydrophobicContact CG-CD 4.07Å; E472-K476 WeakPolarHBondContact O-CG 3.33Å; E472-K476 PolarHBondContact O-N 3.25Å; E472-K476 IonicContact OE1-NZ 2.6Å; E472-K476 PolarHBondContact OE1-NZ 3.17Å; Q473-K476 WeakPolarHBondContact O-CB 3.44Å; Q473-K476 PolarHBondContact O-N 2.84Å; Q473-K476 VanDerWaalsContact O-N 3.17Å; K476-Q478 PolarHBondContact O-N 3.09Å; K476-L479 PolarHBondContact O-N 3.22Å; K476-I480 VanDerWaalsContact O-CG1 3.31Å; K476-I480 WeakPolarHBondContact O-CG1 3.22Å; K476-I480 PolarHBondContact O-N 3.38Å
477	D	98.3	Very high	97.6	Very high	77 Å²	77	58.6 Å²	58.6	41%	0.412	26%	0.262	S	S	.	.	H	α-helix	trans	-62.9	-41.4	178.3	-65.3	-26.2	0	0	0	112.3	Q473 C475 I480 L481	Q473-D477 PolarHBondContact NE2-OD1 3.34Å; Q473-D477 PolarHBondContact NE2-OD2 3.32Å; Q473-D477 VanDerWaalsContact O-CG 3.26Å; Q473-D477 PolarHBondContact O-N 3.19Å; C475-D477 VanDerWaalsContact C-N 3.35Å; C475-D477 PolarHBondContact O-N 2.92Å; D477-I480 PolarHBondContact O-N 3.43Å; D477-L481 WeakPolarHBondContact O-CB 3.16Å; D477-L481 PolarHBondContact O-N 3.09Å
478	Q	98.2	Very high	97.5	Very high	95 Å²	95	61.3 Å²	61.3	44%	0.444	29%	0.289	S	S	.	.	H	α-helix	trans	-68.9	-35.3	175.8	-67.3	-60.2	-77.2	0	0	112.7	R474 C475 K476 L481 L482 L681	R474-Q478 WeakPolarHBondContact O-CG 3.11Å; R474-Q478 PolarHBondContact O-N 2.9Å; C475-Q478 PolarHBondContact O-N 2.69Å; K476-Q478 PolarHBondContact O-N 3.09Å; Q478-L481 PolarHBondContact O-N 3.29Å; Q478-L482 PolarHBondContact O-N 3.38Å; Q478-L681 HydrophobicContact CB-CD1 3.73Å; Q478-L681 HydrophobicContact CG-CD1 3.79Å
479	L	98.1	Very high	97.3	Very high	5 Å²	5	68.5 Å²	68.5	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-71.2	-33.6	174.9	-67.9	-174.8	0	0	0	112.6	A428 V432 C475 K476 L482 V483 V674 A677	A428-L479 HydrophobicContact CB-CD1 4.38Å; V432-L479 HydrophobicContact CG2-CD1 3.63Å; C475-L479 WeakPolarHBondContact O-CG 3.08Å; C475-L479 PolarHBondContact O-N 3.11Å; K476-L479 PolarHBondContact O-N 3.22Å; L479-L482 HydrophobicContact CD2-CD2 4.45Å; L479-V483 PolarHBondContact O-N 3.46Å; L479-V674 HydrophobicContact CD1-CG1 4.07Å; L479-V674 HydrophobicContact CD1-CG2 4.26Å; L479-V674 HydrophobicContact CD2-CB 4.38Å; L479-V674 HydrophobicContact CD2-CG2 3.79Å; L479-A677 HydrophobicContact CD2-CB 3.65Å
480	I	98.1	Very high	97	Very high	55 Å²	55	62.4 Å²	62.4	28%	0.282	30%	0.296	S	S	.	.	H	α-helix	trans	-64.4	-47.1	170.6	-69.6	163.7	0	0	0	109.9	L429 K476 D477 L482 V483 E484	L429-I480 HydrophobicContact CD1-CD1 4.49Å; L429-I480 HydrophobicContact CD2-CD1 4.2Å; L429-I480 HydrophobicContact CD2-CG1 4.2Å; K476-I480 VanDerWaalsContact O-CG1 3.31Å; K476-I480 WeakPolarHBondContact O-CG1 3.22Å; K476-I480 PolarHBondContact O-N 3.38Å; D477-I480 PolarHBondContact O-N 3.43Å; I480-L482 VanDerWaalsContact C-N 3.32Å; I480-L482 PolarHBondContact O-N 3.45Å; I480-V483 PolarHBondContact O-N 3.47Å; I480-V483 VanDerWaalsContact O-N 3.1Å; I480-E484 PolarHBondContact O-N 3.15Å
481	L	97.6	Very high	96.7	Very high	62 Å²	62	61.4 Å²	61.4	33%	0.325	29%	0.291	S	S	.	.	H	α-helix	trans	-59.9	-38.4	177.2	179.2	60.4	0	0	0	112.7	D477 Q478 V483 E484 Y485	D477-L481 WeakPolarHBondContact O-CB 3.16Å; D477-L481 PolarHBondContact O-N 3.09Å; Q478-L481 PolarHBondContact O-N 3.29Å; L481-V483 VanDerWaalsContact C-N 3.31Å; L481-V483 PolarHBondContact O-N 3.42Å; L481-E484 WeakPolarHBondContact O-CB 3.41Å; L481-E484 PolarHBondContact O-N 3.45Å; L481-E484 VanDerWaalsContact O-N 3.12Å; L481-Y485 HydrophobicContact CD1-CD1 4.35Å; L481-Y485 HydrophobicContact CD1-CE1 3.72Å; L481-Y485 HydrophobicContact CG-CE1 4.08Å; L481-Y485 HydrophobicContact CG-CE2 4.19Å; L481-Y485 PolarHBondContact O-N 3.39Å
482	L	96.7	Very high	96.3	Very high	31 Å²	31	62.2 Å²	62.2	16%	0.162	30%	0.301	C	S	.	.	H	α-helix	trans	-59.9	-40.9	173.9	178.3	61.8	0	0	0	112.1	Q478 L479 I480 Y485 E486 I670 L673	Q478-L482 PolarHBondContact O-N 3.38Å; L479-L482 HydrophobicContact CD2-CD2 4.45Å; I480-L482 VanDerWaalsContact C-N 3.32Å; I480-L482 PolarHBondContact O-N 3.45Å; L482-Y485 PolarHBondContact O-N 3.39Å; L482-E486 PolarHBondContact O-N 3.18Å; L482-I670 HydrophobicContact CD2-CD1 3.82Å; L482-I670 HydrophobicContact CG-CD1 3.89Å; L482-L673 HydrophobicContact CD1-CD1 3.74Å; L482-L673 HydrophobicContact CD2-CB 3.73Å; L482-L673 HydrophobicContact CD2-CD1 3.95Å; L482-L673 HydrophobicContact CG-CD1 4.49Å
483	V	96.8	Very high	95.9	Very high	2 Å²	2	67.1 Å²	67.1	1%	0.012	33%	0.329	C	S	.	.	H	α-helix	trans	-71.9	-31.1	174.6	-178.1	0	0	0	0	111.6	I421 K425 L479 I480 L481 Y485 E486 L487 I670	I421-V483 HydrophobicContact CG2-CG1 3.85Å; I421-V483 WeakPolarHBondContact O-CG1 3.22Å; K425-V483 HydrophobicContact CD-CG1 4.46Å; K425-V483 HydrophobicContact CG-CB 3.91Å; K425-V483 HydrophobicContact CG-CG1 3.83Å; K425-V483 HydrophobicContact CG-CG2 3.99Å; L479-V483 PolarHBondContact O-N 3.46Å; I480-V483 PolarHBondContact O-N 3.47Å; I480-V483 VanDerWaalsContact O-N 3.1Å; L481-V483 VanDerWaalsContact C-N 3.31Å; L481-V483 PolarHBondContact O-N 3.42Å; V483-Y485 VanDerWaalsContact C-N 3.32Å; V483-Y485 PolarHBondContact O-N 3.08Å; V483-E486 PolarHBondContact O-N 3.41Å; V483-L487 HydrophobicContact CG1-CD1 4.21Å; V483-L487 HydrophobicContact CG1-CG 4.46Å; V483-L487 VanDerWaalsContact O-CG 3.3Å; V483-L487 WeakPolarHBondContact O-CG 3.44Å; V483-L487 PolarHBondContact O-N 3.02Å; V483-I670 HydrophobicContact CG2-CD1 4.04Å
484	E	97.4	Very high	95.5	Very high	79 Å²	79	65 Å²	65	37%	0.369	32%	0.319	S	S	.	.	H	α-helix	trans	-64.1	-33.9	171.3	-65.2	-55.3	152.4	0	0	112.7	K425 I480 L481 L487 A488	K425-E484 IonicContact NZ-OE1 2.7Å; K425-E484 PolarHBondContact NZ-OE1 3.11Å; I480-E484 PolarHBondContact O-N 3.15Å; L481-E484 WeakPolarHBondContact O-CB 3.41Å; L481-E484 PolarHBondContact O-N 3.45Å; L481-E484 VanDerWaalsContact O-N 3.12Å; E484-L487 PolarHBondContact O-N 3.24Å; E484-A488 VanDerWaalsContact O-CB 3.24Å; E484-A488 WeakPolarHBondContact O-CB 3.3Å; E484-A488 PolarHBondContact O-N 3.47Å
485	Y	96.9	Very high	95.1	Very high	146 Å²	146	66.7 Å²	66.7	57%	0.573	33%	0.333	S	S	*	.	H	α-helix	trans	-62.8	-44.4	173.5	-63.6	-28.5	0	0	0	112.1	L481 L482 V483 L487 A488 Y489	L481-Y485 HydrophobicContact CD1-CD1 4.35Å; L481-Y485 HydrophobicContact CD1-CE1 3.72Å; L481-Y485 HydrophobicContact CG-CE1 4.08Å; L481-Y485 HydrophobicContact CG-CE2 4.19Å; L481-Y485 PolarHBondContact O-N 3.39Å; L482-Y485 PolarHBondContact O-N 3.39Å; V483-Y485 VanDerWaalsContact C-N 3.32Å; V483-Y485 PolarHBondContact O-N 3.08Å; Y485-L487 VanDerWaalsContact C-N 3.26Å; Y485-L487 PolarHBondContact O-N 3.02Å; Y485-A488 PolarHBondContact O-N 2.85Å; Y485-Y489 PolarHBondContact O-N 3.19Å
486	E	95.7	Very high	94.6	Very high	30 Å²	30	70.2 Å²	70.2	14%	0.14	35%	0.352	C	S	.	.	H	α-helix	trans	-66.7	-24.8	175.7	-65.1	-78.1	-167.3	0	0	112.7	I421 L482 V483 V666	I421-E486 HydrophobicContact CD1-CB 4.41Å; I421-E486 WeakPolarHBondContact CD1-O 3.06Å; I421-E486 HydrophobicContact CG2-CB 3.72Å; L482-E486 PolarHBondContact O-N 3.18Å; V483-E486 PolarHBondContact O-N 3.41Å; E486-V666 HydrophobicContact CB-CG1 4.15Å; E486-V666 HydrophobicContact CG-CG1 3.89Å
487	L	95.3	Very high	94.3	Very high	26 Å²	26	70.1 Å²	70.1	14%	0.136	35%	0.351	C	S	.	.	H	α-helix	trans	-83.6	-30.1	172.8	-70.1	170.6	0	0	0	113.3	K418 I421 V483 E484 Y485	K418-L487 HydrophobicContact CB-CD2 3.9Å; K418-L487 WeakPolarHBondContact CE-O 3.43Å; K418-L487 HydrophobicContact CG-CD2 4.1Å; K418-L487 PolarHBondContact NZ-O 3.19Å; K418-L487 WeakPolarHBondContact O-CD2 3.45Å; I421-L487 HydrophobicContact CB-CD2 3.82Å; I421-L487 HydrophobicContact CB-CG 4.46Å; I421-L487 HydrophobicContact CG2-CD2 3.7Å; I421-L487 HydrophobicContact CG2-CG 3.78Å; V483-L487 HydrophobicContact CG1-CD1 4.21Å; V483-L487 HydrophobicContact CG1-CG 4.46Å; V483-L487 VanDerWaalsContact O-CG 3.3Å; V483-L487 WeakPolarHBondContact O-CG 3.44Å; V483-L487 PolarHBondContact O-N 3.02Å; E484-L487 PolarHBondContact O-N 3.24Å; Y485-L487 VanDerWaalsContact C-N 3.26Å; Y485-L487 PolarHBondContact O-N 3.02Å
488	A	95.6	Very high	93.7	Very high	81 Å²	81	69.1 Å²	69.1	67%	0.669	35%	0.345	S	S	*	.	H	α-helix	trans	-74.1	-37	-176	0	0	0	0	0	112.8	E484 Y485	E484-A488 VanDerWaalsContact O-CB 3.24Å; E484-A488 WeakPolarHBondContact O-CB 3.3Å; E484-A488 PolarHBondContact O-N 3.47Å; Y485-A488 PolarHBondContact O-N 2.85Å
489	Y	93.8	Very high	93	Very high	152 Å²	152	65.7 Å²	65.7	60%	0.596	34%	0.335	S	S	*	.			trans	-142.1	119.7	-178.8	-177.5	-103.7	0	0	0	112.7	Y485 N491	Y485-Y489 PolarHBondContact O-N 3.19Å; Y489-N491 HydrophobicContact CD1-CB 4.3Å; Y489-N491 HydrophobicContact CE1-CB 3.89Å
490	M	91.1	Very high	92.2	Very high	33 Å²	33	69.8 Å²	69.8	16%	0.163	35%	0.353	C	S	.	.			trans	-90.9	110.1	174.7	-60.2	-170.5	-52.3	0	0	110.4	F413 E414 V417 K418 T492 Y662	F413-M490 HydrophobicContact CD1-CE 4.29Å; F413-M490 HydrophobicContact CE1-CE 4.15Å; F413-M490 HydrophobicContact CE1-SD 4.37Å; E414-M490 HydrophobicContact CB-CE 3.58Å; E414-M490 HydrophobicContact CB-SD 4.32Å; E414-M490 HydrophobicContact CG-CE 3.57Å; E414-M490 HydrophobicContact CG-SD 4.07Å; V417-M490 HydrophobicContact CB-SD 4.11Å; V417-M490 HydrophobicContact CG1-SD 3.79Å; K418-M490 HydrophobicContact CG-SD 4.49Å; M490-T492 PolarHBondContact O-N 3.22Å; M490-Y662 WeakPolarHBondContact CA-OH 3.11Å
491	N	91.8	Very high	91.3	Very high	57 Å²	57	70.4 Å²	70.4	31%	0.305	37%	0.367	S	S	.	.			trans	-82.6	79.9	180	-174.4	8.7	0	0	0	111.9	Y489 N493 H494 Y662	Y489-N491 HydrophobicContact CD1-CB 4.3Å; Y489-N491 HydrophobicContact CE1-CB 3.89Å; N491-N493 PolarHBondContact O-N 3.24Å; N491-N493 PolarHBondContact OD1-N 2.96Å; N491-N493 VanDerWaalsContact OD1-N 3.17Å; N491-H494 HydrophobicContact CB-CB 4.46Å; N491-H494 VanDerWaalsContact O-CB 3.26Å; N491-H494 WeakPolarHBondContact O-CB 3.43Å; N491-H494 PolarHBondContact O-N 2.75Å; N491-H494 VanDerWaalsContact O-N 3.15Å; N491-H494 PolarHBondContact OD1-N 2.98Å; N491-Y662 PolarHBondContact N-OH 2.78Å
492	T	90.1	Very high	90.6	Very high	68 Å²	68	72.7 Å²	72.7	42%	0.417	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-1.2	174.7	51.5	0	0	0	0	114.2	F413 M490 F497	F413-T492 HydrophobicContact CE1-CG2 3.94Å; F413-T492 HydrophobicContact CZ-CG2 4.49Å; M490-T492 PolarHBondContact O-N 3.22Å; T492-F497 HydrophobicContact CG2-CE1 4.09Å; T492-F497 HydrophobicContact CG2-CZ 4.36Å; T492-F497 VanDerWaalsContact O-CD1 3.28Å; T492-F497 WeakPolarHBondContact O-CD1 3.33Å
493	N	89.7	Confident	89.8	Confident	139 Å²	139	71.2 Å²	71.2	74%	0.743	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	7.4	170.7	-63.8	-44.9	0	0	0	112.9	N491	N491-N493 PolarHBondContact O-N 3.24Å; N491-N493 PolarHBondContact OD1-N 2.96Å; N491-N493 VanDerWaalsContact OD1-N 3.17Å
494	H	89.5	Confident	89	Confident	55 Å²	55	75.7 Å²	75.7	26%	0.255	39%	0.392	S	S	.	.			trans	-65.1	139.1	179.2	-173.5	-71.3	0	0	0	112	N491 D496 F497 I665	N491-H494 HydrophobicContact CB-CB 4.46Å; N491-H494 VanDerWaalsContact O-CB 3.26Å; N491-H494 WeakPolarHBondContact O-CB 3.43Å; N491-H494 PolarHBondContact O-N 2.75Å; N491-H494 VanDerWaalsContact O-N 3.15Å; N491-H494 PolarHBondContact OD1-N 2.98Å; H494-D496 IonicContact CE1-OD2 2.67Å; H494-D496 PolarHBondContact ND1-N 3.4Å; H494-D496 VanDerWaalsContact ND1-N 3.12Å; H494-D496 PolarHBondContact O-N 3.07Å; H494-F497 HydrophobicContact CB-CB 4.39Å; H494-F497 WeakPolarHBondContact O-CB 3.41Å; H494-F497 PolarHBondContact O-N 3.31Å; H494-I665 HydrophobicContact CB-CD1 4.17Å
495	E	89.2	Confident	88	Confident	179 Å²	179	74.8 Å²	74.8	84%	0.836	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-43.8	-174.4	57.1	-178.6	-171.1	0	0	114.8	F497	E495-F497 PolarHBondContact O-N 2.88Å
496	D	88.1	Confident	87	Confident	74 Å²	74	72.3 Å²	72.3	40%	0.396	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-2.6	174.2	-78	-27.5	0	0	0	114.3	H494 I665 K668	H494-D496 IonicContact CE1-OD2 2.67Å; H494-D496 PolarHBondContact ND1-N 3.4Å; H494-D496 VanDerWaalsContact ND1-N 3.12Å; H494-D496 PolarHBondContact O-N 3.07Å; D496-I665 HydrophobicContact CB-CD1 4.11Å; D496-I665 HydrophobicContact CB-CG1 3.82Å; D496-K668 IonicContact OD2-NZ 2.63Å; D496-K668 PolarHBondContact OD2-NZ 3.15Å
497	F	91.5	Very high	85.9	Confident	27 Å²	27	72 Å²	72	12%	0.118	39%	0.393	C	S	.	.			trans	-86.9	125.1	-177.3	-172.4	-118	0	0	0	111.4	F413 T492 H494 E495 G499 L658 S661 Y662 I665	F413-F497 HydrophobicContact CE2-CE2 4.33Å; F413-F497 HydrophobicContact CE2-CZ 4.29Å; F413-F497 HydrophobicContact CZ-CE2 4.03Å; F413-F497 AromaticContact CZ-CZ 3.85Å; F413-F497 HydrophobicContact CZ-CZ 3.85Å; T492-F497 HydrophobicContact CG2-CE1 4.09Å; T492-F497 HydrophobicContact CG2-CZ 4.36Å; T492-F497 VanDerWaalsContact O-CD1 3.28Å; T492-F497 WeakPolarHBondContact O-CD1 3.33Å; H494-F497 HydrophobicContact CB-CB 4.39Å; H494-F497 WeakPolarHBondContact O-CB 3.41Å; H494-F497 PolarHBondContact O-N 3.31Å; E495-F497 PolarHBondContact O-N 2.88Å; F497-G499 PolarHBondContact O-N 3.37Å; F497-G499 VanDerWaalsContact O-N 3.1Å; F497-L658 HydrophobicContact CE1-CD2 4.19Å; F497-L658 HydrophobicContact CE2-CD2 4.25Å; F497-L658 HydrophobicContact CZ-CB 4.32Å; F497-L658 HydrophobicContact CZ-CD2 3.62Å; F497-S661 WeakPolarHBondContact CD2-OG 3.36Å; F497-Y662 HydrophobicContact CD2-CD2 4.02Å; F497-Y662 HydrophobicContact CE2-CD2 4.03Å; F497-Y662 HydrophobicContact CE2-CG 4.49Å; F497-I665 HydrophobicContact CB-CD1 3.84Å; F497-I665 HydrophobicContact CD2-CD1 4.34Å
498	I	86	Confident	84.7	Confident	55 Å²	55	74.7 Å²	74.7	28%	0.282	41%	0.414	S	S	.	.			trans	-60.7	-26.2	-174.5	62.4	179.8	0	0	0	114.2	N502 A503 N657 L658 S661	I498-N502 HydrophobicContact CB-CB 4.29Å; I498-N502 WeakPolarHBondContact O-CB 3.42Å; I498-N502 PolarHBondContact O-ND2 2.75Å; I498-A503 HydrophobicContact CD1-CB 3.69Å; I498-A503 HydrophobicContact CG1-CB 4.29Å; I498-N657 HydrophobicContact CD1-CB 4.11Å; I498-N657 WeakPolarHBondContact CD1-O 3.31Å; I498-L658 HydrophobicContact CG1-CD2 4.23Å; I498-S661 PolarHBondContact N-OG 2.99Å
499	G	83	Confident	83	Confident	23 Å²	23	73.9 Å²	73.9	24%	0.237	41%	0.408	C	S	.	.	H	α-helix	trans	70.3	163	-173.3	0	0	0	0	0	113.9	F497 A501 N502 A503	F497-G499 PolarHBondContact O-N 3.37Å; F497-G499 VanDerWaalsContact O-N 3.1Å; G499-A501 PolarHBondContact O-N 3.03Å; G499-N502 PolarHBondContact O-N 3.18Å; G499-A503 PolarHBondContact O-N 2.81Å
500	F	81.7	Confident	80.6	Confident	91 Å²	91	72.7 Å²	72.7	40%	0.399	42%	0.417	S	S	.	.	H	α-helix	trans	-59.8	-49.2	-170.7	-172.8	-93.1	0	0	0	113.6	P409 N502 A503 E504 T654 L658	P409-F500 HydrophobicContact CB-CD2 4.42Å; P409-F500 HydrophobicContact CB-CE2 3.76Å; P409-F500 HydrophobicContact CG-CE2 3.69Å; P409-F500 HydrophobicContact CG-CZ 4.14Å; F500-N502 VanDerWaalsContact C-N 3.33Å; F500-N502 PolarHBondContact O-N 3.48Å; F500-A503 WeakPolarHBondContact O-CB 3.44Å; F500-A503 PolarHBondContact O-N 2.73Å; F500-E504 HydrophobicContact CE1-CB 4.22Å; F500-E504 WeakPolarHBondContact CE1-OE2 3.45Å; F500-E504 PolarHBondContact O-N 3.24Å; F500-T654 HydrophobicContact CD2-CG2 4.3Å; F500-T654 HydrophobicContact CE2-CG2 3.79Å; F500-T654 HydrophobicContact CZ-CG2 4.17Å; F500-L658 HydrophobicContact CD2-CD1 4.11Å
501	A	80.9	Confident	78.1	Confident	69 Å²	69	80 Å²	80	57%	0.57	45%	0.45	S	S	*	.	H	α-helix	trans	-60.4	-39	-175.4	0	0	0	0	0	113.3	G499 A505	G499-A501 PolarHBondContact O-N 3.03Å; A501-A505 WeakPolarHBondContact O-CB 3.39Å; A501-A505 PolarHBondContact O-N 2.98Å
502	N	81.5	Confident	75.5	Confident	109 Å²	109	88.8 Å²	88.8	58%	0.583	48%	0.479	S	S	*	.	H	α-helix	trans	-74	-31.7	176.5	-64.4	-48.7	0	0	0	112	I498 G499 F500 K506	I498-N502 HydrophobicContact CB-CB 4.29Å; I498-N502 WeakPolarHBondContact O-CB 3.42Å; I498-N502 PolarHBondContact O-ND2 2.75Å; G499-N502 PolarHBondContact O-N 3.18Å; F500-N502 VanDerWaalsContact C-N 3.33Å; F500-N502 PolarHBondContact O-N 3.48Å; N502-K506 WeakPolarHBondContact O-CB 3.44Å; N502-K506 PolarHBondContact O-N 2.88Å
503	A	80.3	Confident	73.2	Confident	0 Å²	0	92.3 Å²	92.3	0%	0	49%	0.491	C	S	.	.	H	α-helix	trans	-66.8	-44	174.3	0	0	0	0	0	111.9	I498 G499 F500 K506 A507 T654 N657 L658	I498-A503 HydrophobicContact CD1-CB 3.69Å; I498-A503 HydrophobicContact CG1-CB 4.29Å; G499-A503 PolarHBondContact O-N 2.81Å; F500-A503 WeakPolarHBondContact O-CB 3.44Å; F500-A503 PolarHBondContact O-N 2.73Å; A503-K506 PolarHBondContact O-N 2.84Å; A503-A507 WeakPolarHBondContact O-CB 3.29Å; A503-A507 PolarHBondContact O-N 2.89Å; A503-T654 HydrophobicContact CB-CG2 4.04Å; A503-N657 HydrophobicContact CB-CB 4.1Å; A503-L658 HydrophobicContact CB-CD1 4.44Å; A503-L658 HydrophobicContact CB-CD2 3.59Å; A503-L658 HydrophobicContact CB-CG 3.66Å
504	E	79	Confident	71.1	Confident	96 Å²	96	91.8 Å²	91.8	45%	0.449	48%	0.482	S	S	.	.	H	α-helix	trans	-70.1	-43.2	178.5	-177.5	174.6	-137.2	0	0	112.2	F500 K506 A507 S508 T654	F500-E504 HydrophobicContact CE1-CB 4.22Å; F500-E504 WeakPolarHBondContact CE1-OE2 3.45Å; F500-E504 PolarHBondContact O-N 3.24Å; E504-K506 VanDerWaalsContact C-N 3.25Å; E504-K506 PolarHBondContact O-N 2.69Å; E504-A507 PolarHBondContact O-N 2.92Å; E504-S508 WeakPolarHBondContact O-CB 3.49Å; E504-S508 PolarHBondContact O-N 3.33Å; E504-S508 PolarHBondContact O-OG 3.48Å; E504-T654 HydrophobicContact CB-CG2 4.17Å
505	A	78.3	Confident	68.6	Low	61 Å²	61	95.5 Å²	95.5	50%	0.504	50%	0.504	S	S	.	.	H	α-helix	trans	-60.2	-36.9	172.9	0	0	0	0	0	111.9	A501 S508 A509	A501-A505 WeakPolarHBondContact O-CB 3.39Å; A501-A505 PolarHBondContact O-N 2.98Å; A505-S508 PolarHBondContact O-N 2.83Å; A505-A509 WeakPolarHBondContact O-CB 3.45Å; A505-A509 PolarHBondContact O-N 3.01Å; A505-A509 VanDerWaalsContact O-N 3.13Å
506	K	75.6	Confident	66.5	Low	93 Å²	93	92.4 Å²	92.4	40%	0.404	49%	0.492	S	S	.	.	H	α-helix	trans	-74	-35.8	176.1	-174.6	-177.8	173.7	-154.8	0	112.9	N502 A503 E504 S508 A509 N657	N502-K506 WeakPolarHBondContact O-CB 3.44Å; N502-K506 PolarHBondContact O-N 2.88Å; A503-K506 PolarHBondContact O-N 2.84Å; E504-K506 VanDerWaalsContact C-N 3.25Å; E504-K506 PolarHBondContact O-N 2.69Å; K506-S508 PolarHBondContact O-N 2.83Å; K506-A509 PolarHBondContact O-N 3.22Å; K506-N657 WeakPolarHBondContact CD-OD1 3.34Å; K506-N657 WeakPolarHBondContact CE-OD1 3.39Å; K506-N657 PolarHBondContact NZ-OD1 2.75Å
507	A	72.2	Confident	64.8	Low	24 Å²	24	91.6 Å²	91.6	20%	0.198	50%	0.501	C	S	.	.	H	α-helix	trans	-66.1	-29.3	171.2	0	0	0	0	0	112.1	A503 E504 E653 T654	A503-A507 WeakPolarHBondContact O-CB 3.29Å; A503-A507 PolarHBondContact O-N 2.89Å; E504-A507 PolarHBondContact O-N 2.92Å; A507-E653 HydrophobicContact CB-CB 4.09Å; A507-E653 HydrophobicContact CB-CG 3.99Å; A507-T654 WeakPolarHBondContact CB-OG1 3.36Å
508	S	70.3	Confident	63.5	Low	82 Å²	82	95.1 Å²	95.1	57%	0.573	52%	0.521	S	S	*	.	H	α-helix	trans	-80.5	-17.1	175.2	-55.8	0	0	0	0	113.8	E504 A505 K506	E504-S508 WeakPolarHBondContact O-CB 3.49Å; E504-S508 PolarHBondContact O-N 3.33Å; E504-S508 PolarHBondContact O-OG 3.48Å; A505-S508 PolarHBondContact O-N 2.83Å; K506-S508 PolarHBondContact O-N 2.83Å
509	A	60.1	Low	63.1	Low	64 Å²	64	99.7 Å²	99.7	53%	0.529	54%	0.541	S	S	.	.	S	Bend	trans	-97.9	95.6	-177	0	0	0	0	0	111.4	A505 K506 Q511	A505-A509 WeakPolarHBondContact O-CB 3.45Å; A505-A509 PolarHBondContact O-N 3.01Å; A505-A509 VanDerWaalsContact O-N 3.13Å; K506-A509 PolarHBondContact O-N 3.22Å; A509-Q511 PolarHBondContact O-N 3.42Å
510	T	42.4	Very low	63.2	Low	128 Å²	128	102.4 Å²	102.4	79%	0.785	55%	0.553	S	S	*	*			trans	-55.2	121.9	-179.5	-44.4	0	0	0	0	112.2
511	Q	39.9	Very low	63.2	Low	185 Å²	185	99.2 Å²	99.2	86%	0.864	54%	0.54	S	S	*	.			trans	41.5	96.4	165.3	-67.6	-178.8	-17.8	0	0	117.3	A509	A509-Q511 PolarHBondContact O-N 3.42Å
512	R	37.1	Very low	63.6	Low	243 Å²	243	98.2 Å²	98.2	92%	0.917	52%	0.522	S	S	*	.			trans	-115.7	115.1	145.9	-70.1	-173.4	177.1	-174.8	-0.7	109
513	Q	40.6	Very low	64.2	Low	141 Å²	141	97.2 Å²	97.2	66%	0.659	51%	0.512	S	S	*	.			trans	-57.4	139.1	169.2	-86.2	177.4	-41.5	0	0	109.4	N515 D568	Q513-N515 PolarHBondContact O-N 3.01Å; Q513-N515 VanDerWaalsContact O-N 3.08Å; Q513-D568 PolarHBondContact NE2-OD2 3.29Å
514	K	45.5	Very low	64.8	Low	128 Å²	128	97.8 Å²	97.8	56%	0.557	52%	0.518	S	S	*	.			trans	-78.4	87.7	175.2	-69.2	178.9	-175.1	169.8	0	108.4	L516 D660	K514-L516 VanDerWaalsContact C-N 3.3Å; K514-L516 HydrophobicContact CB-CD1 4.1Å; K514-L516 PolarHBondContact O-N 3.02Å; K514-D660 IonicContact NZ-OD2 3.9Å; K514-D660 PolarHBondContact NZ-OD2 3.1Å
515	N	36.8	Very low	65.5	Low	134 Å²	134	98.7 Å²	98.7	72%	0.717	52%	0.517	S	S	*	.			trans	-64.6	91.5	167.8	-69.9	19.9	0	0	0	109.2	Q513 G517	Q513-N515 PolarHBondContact O-N 3.01Å; Q513-N515 VanDerWaalsContact O-N 3.08Å; N515-G517 VanDerWaalsContact C-N 3.32Å; N515-G517 PolarHBondContact O-N 3.46Å; N515-G517 VanDerWaalsContact O-N 3.08Å
516	L	46.6	Very low	66.3	Low	114 Å²	114	95.9 Å²	95.9	60%	0.597	49%	0.494	S	S	*	.			trans	-70.3	97.2	159	-85.5	73.5	0	0	0	105.5	K514 N518 S547	K514-L516 VanDerWaalsContact C-N 3.3Å; K514-L516 HydrophobicContact CB-CD1 4.1Å; K514-L516 PolarHBondContact O-N 3.02Å; L516-N518 PolarHBondContact O-N 2.77Å; L516-S547 VanDerWaalsContact O-CB 3.22Å; L516-S547 WeakPolarHBondContact O-CB 3.23Å; L516-S547 PolarHBondContact O-OG 3.28Å
517	G	52.5	Low	67.2	Low	56 Å²	56	92.7 Å²	92.7	58%	0.577	48%	0.482	S	S	*	.			trans	-53.6	116	-169.7	0	0	0	0	0	112.9	N515 Q519	N515-G517 VanDerWaalsContact C-N 3.32Å; N515-G517 PolarHBondContact O-N 3.46Å; N515-G517 VanDerWaalsContact O-N 3.08Å; G517-Q519 VanDerWaalsContact C-N 3.26Å; G517-Q519 WeakPolarHBondContact O-CG 3.28Å; G517-Q519 PolarHBondContact O-N 2.8Å
518	N	63.1	Low	68.1	Low	102 Å²	102	91.5 Å²	91.5	55%	0.545	47%	0.473	S	S	.	.	S	Bend	trans	0.6	54.8	175.5	-159.1	45.1	0	0	0	119.3	L516 S546 S547 D548	L516-N518 PolarHBondContact O-N 2.77Å; N518-S546 WeakPolarHBondContact OD1-CB 3.45Å; N518-S546 PolarHBondContact OD1-OG 2.99Å; N518-S547 VanDerWaalsContact CA-OG 3.3Å; N518-S547 WeakPolarHBondContact CA-OG 3.42Å; N518-S547 PolarHBondContact N-OG 3.1Å; N518-D548 WeakPolarHBondContact CA-OD2 3.28Å; N518-D548 PolarHBondContact N-OD2 2.98Å
519	Q	77.2	Confident	69	Low	150 Å²	150	89 Å²	89	70%	0.701	45%	0.451	S	S	*	.			trans	-84.9	140.8	174.4	-79.5	178.5	15.1	0	0	110.3	G517 I521 S546 S547	G517-Q519 VanDerWaalsContact C-N 3.26Å; G517-Q519 WeakPolarHBondContact O-CG 3.28Å; G517-Q519 PolarHBondContact O-N 2.8Å; Q519-I521 PolarHBondContact O-N 2.8Å; Q519-S546 CarbonylContact O-C 3.57Å; Q519-S546 WeakPolarHBondContact O-CA 3.49Å; Q519-S546 VanDerWaalsContact O-CB 3.25Å; Q519-S546 WeakPolarHBondContact O-CB 3.17Å; Q519-S547 PolarHBondContact N-OG 3.33Å; Q519-S547 PolarHBondContact O-N 3.29Å
520	V	86.2	Confident	70.1	Confident	81 Å²	81	87.3 Å²	87.3	49%	0.491	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	124.2	174	176.7	0	0	0	0	110	K523 V544	V520-K523 HydrophobicContact CG1-CD 4.33Å; V520-K523 HydrophobicContact CG1-CG 3.66Å; V520-V544 HydrophobicContact CG1-CG1 4.06Å; V520-V544 HydrophobicContact CG2-CG1 3.97Å
521	I	81.7	Confident	71.7	Confident	24 Å²	24	82.5 Å²	82.5	12%	0.123	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-39.5	-175.8	-70.4	178.4	0	0	0	111.6	Q519 L545 S619 R622 A623	Q519-I521 PolarHBondContact O-N 2.8Å; I521-L545 HydrophobicContact CB-CD2 4.46Å; I521-L545 HydrophobicContact CB-CG 4.32Å; I521-L545 HydrophobicContact CG2-CD2 4.16Å; I521-L545 PolarHBondContact N-O 2.94Å; I521-S619 WeakPolarHBondContact CG2-O 3.36Å; I521-R622 HydrophobicContact CG2-CB 3.9Å; I521-R622 PolarHBondContact O-NH1 3.04Å; I521-R622 VanDerWaalsContact O-NH1 3.11Å; I521-A623 HydrophobicContact CD1-CB 3.62Å
522	R	89.7	Confident	72.8	Confident	48 Å²	48	74.8 Å²	74.8	18%	0.181	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	150	172.1	-172	166.1	-173.5	104.7	-4.7	110.6	E372 L545 D612 W616 S619	E372-R522 IonicContact OE1-NH1 2.77Å; E372-R522 PolarHBondContact OE1-NH1 3.49Å; R522-L545 PolarHBondContact N-O 2.9Å; R522-L545 PolarHBondContact O-N 3.39Å; R522-D612 IonicContact NH2-OD1 3.9Å; R522-W616 HydrophobicContact CB-CE3 4.48Å; R522-W616 HydrophobicContact CB-CH2 4.43Å; R522-W616 HydrophobicContact CB-CZ3 4.14Å; R522-W616 HydrophobicContact CG-CD2 4.43Å; R522-W616 HydrophobicContact CG-CE3 4.31Å; R522-W616 HydrophobicContact CG-CH2 4.13Å; R522-W616 HydrophobicContact CG-CZ2 4.26Å; R522-W616 HydrophobicContact CG-CZ3 4.15Å; R522-S619 WeakPolarHBondContact CD-OG 3.38Å
523	K	93.5	Very high	73.6	Confident	88 Å²	88	71.1 Å²	71.1	38%	0.383	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	158.2	164.9	-59.1	-168.7	168	-168.5	0	109.6	V520 W542 F543 V544 E558	V520-K523 HydrophobicContact CG1-CD 4.33Å; V520-K523 HydrophobicContact CG1-CG 3.66Å; K523-W542 HydrophobicContact CB-CH2 4.32Å; K523-W542 HydrophobicContact CB-CZ2 3.66Å; K523-W542 HydrophobicContact CD-CZ2 4.24Å; K523-F543 CarbonylContact C-O 3.57Å; K523-F543 VanDerWaalsContact CA-O 3.26Å; K523-F543 WeakPolarHBondContact CA-O 3.18Å; K523-V544 HydrophobicContact CD-CG2 4.02Å; K523-V544 HydrophobicContact CG-CB 4.46Å; K523-V544 HydrophobicContact CG-CG1 4.23Å; K523-V544 HydrophobicContact CG-CG2 4.02Å; K523-E558 WeakPolarHBondContact CD-OE1 3.41Å; K523-E558 VanDerWaalsContact CE-OE1 3.29Å; K523-E558 WeakPolarHBondContact CE-OE1 3.21Å; K523-E558 IonicContact NZ-OE1 3.65Å; K523-E558 PolarHBondContact NZ-OE1 2.96Å; K523-E558 IonicContact NZ-OE2 3.64Å; K523-E558 PolarHBondContact NZ-OE2 2.89Å
524	G	93.4	Very high	74.2	Confident	12 Å²	12	70.7 Å²	70.7	12%	0.124	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.4	172.3	174.6	0	0	0	0	0	113.6	W542 F543	G524-W542 VanDerWaalsContact C-CE3 3.45Å; G524-W542 VanDerWaalsContact CA-CZ3 3.43Å; G524-F543 PolarHBondContact N-O 3.47Å; G524-F543 PolarHBondContact O-N 2.95Å
525	W	93.7	Very high	74.3	Confident	115 Å²	115	75.2 Å²	75.2	44%	0.436	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	139.3	172.9	-68.1	96.5	0	0	0	111.8	D540 W542 D556	W525-D540 HydrophobicContact CE3-CB 4.12Å; W525-D540 HydrophobicContact CZ3-CB 4.44Å; W525-W542 AromaticContact CD1-CE3 3.65Å; W525-W542 AromaticContact CD1-CZ3 3.69Å; W525-W542 HydrophobicContact CD2-CE3 4.11Å; W525-W542 AromaticContact CE2-CE3 3.85Å; W525-W542 AromaticContact CG-CE3 3.98Å; W525-W542 HydrophobicContact CG-CE3 3.98Å; W525-W542 HydrophobicContact CG-CZ3 4.38Å; W525-W542 HydrophobicContact CH2-CB 4.48Å; W525-W542 HydrophobicContact CZ3-CB 4.47Å; W525-W542 AromaticContact NE1-CE3 3.54Å; W525-W542 AromaticContact NE1-CZ3 3.73Å; W525-D556 HydrophobicContact CZ2-CB 4.37Å
526	L	95	Very high	75.2	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.005	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	144	164.6	-70.8	170.7	0	0	0	109.9	F541 F543 L605 S606 A607 W616	L526-F541 PolarHBondContact N-O 3.47Å; L526-F541 VanDerWaalsContact N-O 3.11Å; L526-F541 PolarHBondContact O-N 2.81Å; L526-F543 HydrophobicContact CB-CD2 3.59Å; L526-F543 HydrophobicContact CB-CE2 3.7Å; L526-F543 HydrophobicContact CB-CG 4.34Å; L526-F543 HydrophobicContact CD1-CB 4.34Å; L526-F543 HydrophobicContact CD1-CD1 4.41Å; L526-F543 HydrophobicContact CD1-CD2 4.12Å; L526-F543 HydrophobicContact CD1-CE2 4.48Å; L526-F543 HydrophobicContact CD1-CG 4.04Å; L526-F543 HydrophobicContact CG-CD2 4.22Å; L526-L605 HydrophobicContact CB-CD2 4.44Å; L526-L605 HydrophobicContact CD1-CD1 4.2Å; L526-L605 HydrophobicContact CD1-CD2 4.46Å; L526-S606 WeakPolarHBondContact CA-O 3.34Å; L526-S606 VanDerWaalsContact CD2-O 3.26Å; L526-S606 WeakPolarHBondContact CD2-O 3.43Å; L526-A607 HydrophobicContact CD2-CB 3.85Å; L526-W616 HydrophobicContact CD1-CD2 3.84Å; L526-W616 HydrophobicContact CD1-CE3 4.09Å; L526-W616 HydrophobicContact CD1-CG 4.3Å; L526-W616 HydrophobicContact CD1-CH2 4.29Å; L526-W616 HydrophobicContact CD1-CZ2 4.04Å; L526-W616 HydrophobicContact CD1-CZ3 4.31Å; L526-W616 HydrophobicContact CD2-CD2 4.23Å; L526-W616 HydrophobicContact CD2-CG 3.97Å; L526-W616 HydrophobicContact CG-CD2 4.2Å; L526-W616 HydrophobicContact CG-CG 4.45Å; L526-W616 HydrophobicContact CG-CZ2 4.02Å
527	T	93.1	Very high	76.5	Confident	26 Å²	26	68.2 Å²	68.2	16%	0.16	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	122	172.2	-44.3	0	0	0	0	109.9	H529 D540 L605 S606	T527-H529 PolarHBondContact O-CD2 2.99Å; T527-D540 WeakPolarHBondContact CA-OD1 3.25Å; T527-D540 WeakPolarHBondContact CB-OD1 3.25Å; T527-D540 WeakPolarHBondContact CG2-OD1 3.41Å; T527-D540 PolarHBondContact OG1-OD1 3.43Å; T527-L605 VanDerWaalsContact O-CA 3.32Å; T527-L605 WeakPolarHBondContact O-CA 3.45Å; T527-S606 WeakPolarHBondContact CB-OG 3.26Å; T527-S606 PolarHBondContact N-O 3.14Å; T527-S606 PolarHBondContact O-N 3.21Å; T527-S606 VanDerWaalsContact O-N 3.1Å
528	I	92.6	Very high	78.1	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.8	168.2	-46.8	175.4	0	0	0	108.9	I531 S538 R539 F541 F543 W552 L603 E604 L605	I528-I531 HydrophobicContact CB-CD1 4.16Å; I528-I531 HydrophobicContact CB-CG1 4.11Å; I528-I531 HydrophobicContact CD1-CD1 3.68Å; I528-I531 HydrophobicContact CG2-CB 4.25Å; I528-I531 HydrophobicContact CG2-CD1 3.93Å; I528-I531 HydrophobicContact CG2-CG1 3.68Å; I528-I531 HydrophobicContact CG2-CG2 3.68Å; I528-S538 CarbonylContact O-C 3.57Å; I528-S538 VanDerWaalsContact O-CA 3.25Å; I528-S538 WeakPolarHBondContact O-CA 3.27Å; I528-R539 PolarHBondContact N-O 2.84Å; I528-R539 PolarHBondContact O-N 2.92Å; I528-F541 HydrophobicContact CB-CD2 4.43Å; I528-F541 HydrophobicContact CD1-CD2 3.42Å; I528-F541 VanDerWaalsContact CD1-CD2 3.42Å; I528-F541 HydrophobicContact CD1-CE2 3.78Å; I528-F541 HydrophobicContact CD1-CG 4.23Å; I528-F541 HydrophobicContact CG1-CD2 3.8Å; I528-F541 HydrophobicContact CG1-CE2 4.3Å; I528-F543 HydrophobicContact CD1-CE2 3.99Å; I528-F543 HydrophobicContact CD1-CZ 3.57Å; I528-F543 HydrophobicContact CG1-CE2 3.82Å; I528-F543 HydrophobicContact CG1-CZ 3.62Å; I528-W552 HydrophobicContact CD1-CD2 4.24Å; I528-W552 HydrophobicContact CD1-CG 4.31Å; I528-W552 HydrophobicContact CD1-CZ2 4.25Å; I528-L603 HydrophobicContact CD1-CD1 4.39Å; I528-L603 HydrophobicContact CG2-CD1 3.54Å; I528-L603 HydrophobicContact CG2-CG 4.22Å; I528-E604 CarbonylContact C-O 3.58Å; I528-E604 WeakPolarHBondContact CA-O 3.31Å; I528-L605 HydrophobicContact CG1-CD2 3.87Å
529	H	88.2	Confident	79.3	Confident	28 Å²	28	70.5 Å²	70.5	13%	0.13	36%	0.36	C	S	.	.			trans	-95	-20.5	-171.1	-73.6	-92.4	0	0	0	115.7	T527 K585 E604 S606	T527-H529 PolarHBondContact O-CD2 2.99Å; H529-K585 VanDerWaalsContact CE1-CE 3.4Å; H529-K585 WeakPolarHBondContact CE1-CE 3.48Å; H529-K585 WeakPolarHBondContact ND1-CE 3.44Å; H529-K585 PolarHBondContact ND1-NZ 2.84Å; H529-E604 HydrophobicContact CB-CB 4.03Å; H529-E604 PolarHBondContact N-O 2.86Å; H529-S606 PolarHBondContact NE2-OG 2.94Å
530	N	83.4	Confident	80	Confident	29 Å²	29	67.9 Å²	67.9	16%	0.155	35%	0.351	C	S	.	.	S	Bend	trans	-122.7	15.6	-162	67.4	-10.4	0	0	0	115.2	Y600 Q602 E604	N530-Y600 WeakPolarHBondContact O-CD1 3.37Å; N530-Y600 WeakPolarHBondContact O-CE1 3.28Å; N530-Y600 VanDerWaalsContact O-CZ 3.26Å; N530-Q602 PolarHBondContact ND2-O 3Å; N530-E604 HydrophobicContact CB-CB 4.34Å; N530-E604 WeakPolarHBondContact ND2-CG 3.35Å; N530-E604 PolarHBondContact ND2-N 2.95Å; N530-E604 PolarHBondContact ND2-OE1 3.24Å; N530-E604 PolarHBondContact OD1-N 2.86Å
531	I	75.6	Confident	80.4	Confident	28 Å²	28	65 Å²	65	14%	0.144	33%	0.332	C	S	.	.			trans	-114.1	10.1	-173.9	70	163	0	0	0	116.2	I528 F541 Y597 Y600 L603	I528-I531 HydrophobicContact CB-CD1 4.16Å; I528-I531 HydrophobicContact CB-CG1 4.11Å; I528-I531 HydrophobicContact CD1-CD1 3.68Å; I528-I531 HydrophobicContact CG2-CB 4.25Å; I528-I531 HydrophobicContact CG2-CD1 3.93Å; I528-I531 HydrophobicContact CG2-CG1 3.68Å; I528-I531 HydrophobicContact CG2-CG2 3.68Å; I531-F541 HydrophobicContact CD1-CE2 3.93Å; I531-F541 HydrophobicContact CD1-CZ 4.3Å; I531-Y597 HydrophobicContact CB-CD1 4.25Å; I531-Y597 HydrophobicContact CB-CE1 3.98Å; I531-Y597 HydrophobicContact CD1-CE1 4.01Å; I531-Y597 HydrophobicContact CG2-CD1 3.69Å; I531-Y597 HydrophobicContact CG2-CE1 3.93Å; I531-Y600 HydrophobicContact CB-CE2 4.14Å; I531-Y600 HydrophobicContact CG2-CD2 4.03Å; I531-Y600 HydrophobicContact CG2-CE2 4.15Å; I531-L603 HydrophobicContact CG2-CD1 3.93Å
532	S	62.5	Low	81	Confident	22 Å²	22	66 Å²	66	15%	0.154	33%	0.334	C	S	.	.			trans	-80.5	144.8	178.1	-177.4	0	0	0	0	112.6	M534 G537	S532-M534 WeakPolarHBondContact CB-O 3.3Å; S532-M534 PolarHBondContact O-N 3.29Å; S532-M534 PolarHBondContact OG-N 3.22Å; S532-M534 PolarHBondContact OG-O 2.7Å; S532-G537 WeakPolarHBondContact CB-O 3.38Å
533	F	54.5	Low	81.4	Confident	167 Å²	167	63.7 Å²	63.7	73%	0.732	33%	0.326	S	S	*	.	S	Bend	trans	-64	-26.1	170.6	64.3	-85.6	0	0	0	112.4
534	M	52.8	Low	81.5	Confident	132 Å²	132	60 Å²	60	65%	0.65	31%	0.311	S	S	*	.	S	Bend	trans	-87.5	119	165.6	-79	175.4	166.7	0	0	109.2	S532 G536 G537	S532-M534 WeakPolarHBondContact CB-O 3.3Å; S532-M534 PolarHBondContact O-N 3.29Å; S532-M534 PolarHBondContact OG-N 3.22Å; S532-M534 PolarHBondContact OG-O 2.7Å; M534-G536 PolarHBondContact O-N 2.91Å; M534-G537 PolarHBondContact O-N 3.39Å
535	K	48.1	Very low	81.5	Confident	222 Å²	222	59.4 Å²	59.4	97%	0.965	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	97.5	-179.5	-170.4	178.1	-176.4	-179.8	0	111.1
536	G	56.9	Low	81.3	Confident	79 Å²	79	54.4 Å²	54.4	81%	0.814	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	115.4	3.2	-179.5	0	0	0	0	0	116.6	M534	M534-G536 PolarHBondContact O-N 2.91Å
537	G	73.6	Confident	80.6	Confident	23 Å²	23	55.1 Å²	55.1	24%	0.237	29%	0.292	C	S	.	.			trans	-83.4	127.1	177.3	0	0	0	0	0	114.2	S532 M534	S532-G537 WeakPolarHBondContact CB-O 3.38Å; M534-G537 PolarHBondContact O-N 3.39Å
538	S	84.5	Confident	80.3	Confident	65 Å²	65	56.6 Å²	56.6	46%	0.455	30%	0.299	S	S	.	.			trans	-90.7	159.7	167.6	57.7	0	0	0	0	112.3	I528	I528-S538 CarbonylContact O-C 3.57Å; I528-S538 VanDerWaalsContact O-CA 3.25Å; I528-S538 WeakPolarHBondContact O-CA 3.27Å
539	R	88.8	Confident	80.4	Confident	140 Å²	140	58 Å²	58	53%	0.528	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	140.9	172.8	-72	-169.1	177.9	-161	-3.8	112.2	I528 F541	I528-R539 PolarHBondContact N-O 2.84Å; I528-R539 PolarHBondContact O-N 2.92Å; R539-F541 HydrophobicContact CB-CD2 4.3Å; R539-F541 HydrophobicContact CB-CE2 3.58Å; R539-F541 HydrophobicContact CB-CZ 4.11Å
540	D	91.4	Very high	80.8	Confident	95 Å²	95	56.7 Å²	56.7	51%	0.508	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	142.9	172.4	-55	-49.6	0	0	0	111.6	W525 T527	W525-D540 HydrophobicContact CE3-CB 4.12Å; W525-D540 HydrophobicContact CZ3-CB 4.44Å; T527-D540 WeakPolarHBondContact CA-OD1 3.25Å; T527-D540 WeakPolarHBondContact CB-OD1 3.25Å; T527-D540 WeakPolarHBondContact CG2-OD1 3.41Å; T527-D540 PolarHBondContact OG1-OD1 3.43Å
541	F	94.7	Very high	81.3	Confident	21 Å²	21	55.8 Å²	55.8	9%	0.092	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	155.5	173.9	-65.9	-87.5	0	0	0	109.9	L526 I528 I531 R539 F543 W552 Y553 K562	L526-F541 PolarHBondContact N-O 3.47Å; L526-F541 VanDerWaalsContact N-O 3.11Å; L526-F541 PolarHBondContact O-N 2.81Å; I528-F541 HydrophobicContact CB-CD2 4.43Å; I528-F541 HydrophobicContact CD1-CD2 3.42Å; I528-F541 VanDerWaalsContact CD1-CD2 3.42Å; I528-F541 HydrophobicContact CD1-CE2 3.78Å; I528-F541 HydrophobicContact CD1-CG 4.23Å; I528-F541 HydrophobicContact CG1-CD2 3.8Å; I528-F541 HydrophobicContact CG1-CE2 4.3Å; I531-F541 HydrophobicContact CD1-CE2 3.93Å; I531-F541 HydrophobicContact CD1-CZ 4.3Å; R539-F541 HydrophobicContact CB-CD2 4.3Å; R539-F541 HydrophobicContact CB-CE2 3.58Å; R539-F541 HydrophobicContact CB-CZ 4.11Å; F541-F543 HydrophobicContact CB-CD2 4.25Å; F541-F543 HydrophobicContact CB-CE2 3.94Å; F541-F543 WeakPolarHBondContact O-CD2 3.43Å; F541-W552 HydrophobicContact CB-CB 4.2Å; F541-W552 HydrophobicContact CB-CG 4.45Å; F541-W552 AromaticContact CD1-CD1 3.93Å; F541-W552 AromaticContact CG-CD1 3.82Å; F541-Y553 WeakPolarHBondContact CB-O 3.33Å; F541-Y553 WeakPolarHBondContact CD1-O 3.49Å; F541-K562 HydrophobicContact CD1-CG 4.22Å; F541-K562 HydrophobicContact CE1-CG 4.02Å
542	W	95.8	Very high	82.2	Confident	44 Å²	44	54.5 Å²	54.5	17%	0.167	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	121	170.6	-179.1	-107.8	0	0	0	109.7	K523 G524 W525 W552 Y553 D555 D556 E558	K523-W542 HydrophobicContact CB-CH2 4.32Å; K523-W542 HydrophobicContact CB-CZ2 3.66Å; K523-W542 HydrophobicContact CD-CZ2 4.24Å; G524-W542 VanDerWaalsContact C-CE3 3.45Å; G524-W542 VanDerWaalsContact CA-CZ3 3.43Å; W525-W542 AromaticContact CD1-CE3 3.65Å; W525-W542 AromaticContact CD1-CZ3 3.69Å; W525-W542 HydrophobicContact CD2-CE3 4.11Å; W525-W542 AromaticContact CE2-CE3 3.85Å; W525-W542 AromaticContact CG-CE3 3.98Å; W525-W542 HydrophobicContact CG-CE3 3.98Å; W525-W542 HydrophobicContact CG-CZ3 4.38Å; W525-W542 HydrophobicContact CH2-CB 4.48Å; W525-W542 HydrophobicContact CZ3-CB 4.47Å; W525-W542 AromaticContact NE1-CE3 3.54Å; W525-W542 AromaticContact NE1-CZ3 3.73Å; W542-W552 CarbonylContact O-C 3.43Å; W542-W552 VanDerWaalsContact O-CA 3.25Å; W542-W552 WeakPolarHBondContact O-CA 3.26Å; W542-Y553 PolarHBondContact N-O 3.34Å; W542-Y553 VanDerWaalsContact N-O 3.1Å; W542-Y553 PolarHBondContact O-N 3.07Å; W542-D555 WeakPolarHBondContact CB-O 3.47Å; W542-D556 HydrophobicContact CD2-CB 3.67Å; W542-D556 HydrophobicContact CE3-CB 3.82Å; W542-D556 HydrophobicContact CG-CB 4.01Å; W542-D556 HydrophobicContact CH2-CB 4.41Å; W542-D556 HydrophobicContact CZ2-CB 4.29Å; W542-D556 HydrophobicContact CZ3-CB 4.18Å; W542-E558 PolarHBondContact NE1-OE1 2.98Å
543	F	97.1	Very high	83.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	142.8	-178.6	-83.2	-99.2	0	0	0	111.9	K523 G524 L526 I528 F541 L550 S551 W552 L603 L605 W616	K523-F543 CarbonylContact C-O 3.57Å; K523-F543 VanDerWaalsContact CA-O 3.26Å; K523-F543 WeakPolarHBondContact CA-O 3.18Å; G524-F543 PolarHBondContact N-O 3.47Å; G524-F543 PolarHBondContact O-N 2.95Å; L526-F543 HydrophobicContact CB-CD2 3.59Å; L526-F543 HydrophobicContact CB-CE2 3.7Å; L526-F543 HydrophobicContact CB-CG 4.34Å; L526-F543 HydrophobicContact CD1-CB 4.34Å; L526-F543 HydrophobicContact CD1-CD1 4.41Å; L526-F543 HydrophobicContact CD1-CD2 4.12Å; L526-F543 HydrophobicContact CD1-CE2 4.48Å; L526-F543 HydrophobicContact CD1-CG 4.04Å; L526-F543 HydrophobicContact CG-CD2 4.22Å; I528-F543 HydrophobicContact CD1-CE2 3.99Å; I528-F543 HydrophobicContact CD1-CZ 3.57Å; I528-F543 HydrophobicContact CG1-CE2 3.82Å; I528-F543 HydrophobicContact CG1-CZ 3.62Å; F541-F543 HydrophobicContact CB-CD2 4.25Å; F541-F543 HydrophobicContact CB-CE2 3.94Å; F541-F543 WeakPolarHBondContact O-CD2 3.43Å; F543-L550 HydrophobicContact CD1-CD1 3.64Å; F543-L550 HydrophobicContact CD1-CD2 3.85Å; F543-L550 HydrophobicContact CD1-CG 3.69Å; F543-L550 HydrophobicContact CE1-CD1 4.36Å; F543-L550 HydrophobicContact CE1-CD2 3.68Å; F543-L550 HydrophobicContact CE1-CG 3.97Å; F543-S551 WeakPolarHBondContact CA-O 3.46Å; F543-W552 HydrophobicContact CD1-CB 3.69Å; F543-W552 HydrophobicContact CD1-CE3 4.25Å; F543-W552 HydrophobicContact CD1-CG 4.45Å; F543-W552 HydrophobicContact CD2-CB 3.97Å; F543-W552 HydrophobicContact CE1-CB 3.68Å; F543-W552 AromaticContact CE1-CD2 3.83Å; F543-W552 HydrophobicContact CE1-CD2 3.83Å; F543-W552 AromaticContact CE1-CE3 3.5Å; F543-W552 HydrophobicContact CE1-CE3 3.5Å; F543-W552 AromaticContact CE1-CG 3.96Å; F543-W552 HydrophobicContact CE1-CG 3.96Å; F543-W552 HydrophobicContact CE1-CZ3 4.3Å; F543-W552 HydrophobicContact CE2-CB 3.95Å; F543-W552 HydrophobicContact CE2-CG 4.36Å; F543-W552 HydrophobicContact CG-CB 3.88Å; F543-W552 HydrophobicContact CZ-CB 3.83Å; F543-W552 AromaticContact CZ-CD2 3.99Å; F543-W552 HydrophobicContact CZ-CD2 3.99Å; F543-W552 HydrophobicContact CZ-CE3 4.09Å; F543-W552 AromaticContact CZ-CG 3.93Å; F543-W552 HydrophobicContact CZ-CG 3.93Å; F543-L603 HydrophobicContact CE1-CD2 4.5Å; F543-L605 HydrophobicContact CE1-CD2 4.24Å; F543-L605 HydrophobicContact CE2-CD2 4.21Å; F543-L605 HydrophobicContact CZ-CD2 3.63Å; F543-W616 HydrophobicContact CB-CH2 3.69Å; F543-W616 HydrophobicContact CB-CZ2 4.18Å; F543-W616 HydrophobicContact CB-CZ3 4.46Å
544	V	94.9	Very high	85.5	Confident	11 Å²	11	51.9 Å²	51.9	7%	0.067	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	108.8	172.4	179.4	0	0	0	0	107.7	V520 K523 S551 Y553 E558	V520-V544 HydrophobicContact CG1-CG1 4.06Å; V520-V544 HydrophobicContact CG2-CG1 3.97Å; K523-V544 HydrophobicContact CD-CG2 4.02Å; K523-V544 HydrophobicContact CG-CB 4.46Å; K523-V544 HydrophobicContact CG-CG1 4.23Å; K523-V544 HydrophobicContact CG-CG2 4.02Å; V544-S551 PolarHBondContact N-O 2.99Å; V544-S551 PolarHBondContact O-N 3.25Å; V544-Y553 HydrophobicContact CB-CE2 3.97Å; V544-Y553 HydrophobicContact CG2-CD2 4.06Å; V544-Y553 HydrophobicContact CG2-CE2 3.54Å; V544-E558 HydrophobicContact CG2-CG 4.26Å; V544-E558 WeakPolarHBondContact CG2-OE1 3.3Å
545	L	94.2	Very high	87.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	122	173.3	175.8	65.7	0	0	0	108.9	I521 R522 L550 L567 W616 S619 F620 A623	I521-L545 HydrophobicContact CB-CD2 4.46Å; I521-L545 HydrophobicContact CB-CG 4.32Å; I521-L545 HydrophobicContact CG2-CD2 4.16Å; I521-L545 PolarHBondContact N-O 2.94Å; R522-L545 PolarHBondContact N-O 2.9Å; R522-L545 PolarHBondContact O-N 3.39Å; L545-L550 HydrophobicContact CB-CD1 3.9Å; L545-L550 HydrophobicContact CD1-CB 4.39Å; L545-L550 HydrophobicContact CD1-CD1 4.01Å; L545-L567 HydrophobicContact CD1-CD1 3.6Å; L545-L567 HydrophobicContact CD1-CD2 4.14Å; L545-L567 HydrophobicContact CD1-CG 4.49Å; L545-W616 HydrophobicContact CB-CZ3 4.02Å; L545-S619 VanDerWaalsContact CD2-C 3.43Å; L545-S619 WeakPolarHBondContact CD2-O 3.33Å; L545-F620 HydrophobicContact CD1-CD1 3.98Å; L545-F620 HydrophobicContact CD1-CE1 3.79Å; L545-F620 HydrophobicContact CD2-CD1 4.07Å; L545-F620 HydrophobicContact CD2-CE1 4.27Å; L545-F620 HydrophobicContact CD2-CG 4.27Å; L545-A623 HydrophobicContact CD1-CB 3.89Å; L545-A623 HydrophobicContact CD2-CB 4.13Å; L545-A623 HydrophobicContact CG-CB 4.14Å
546	S	90	Very high	89.2	Confident	9 Å²	9	40.9 Å²	40.9	6%	0.063	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-179.9	165.3	73.8	0	0	0	0	111.5	N518 Q519 D548 N549 L567	N518-S546 WeakPolarHBondContact OD1-CB 3.45Å; N518-S546 PolarHBondContact OD1-OG 2.99Å; Q519-S546 CarbonylContact O-C 3.57Å; Q519-S546 WeakPolarHBondContact O-CA 3.49Å; Q519-S546 VanDerWaalsContact O-CB 3.25Å; Q519-S546 WeakPolarHBondContact O-CB 3.17Å; S546-D548 PolarHBondContact O-N 2.7Å; S546-D548 PolarHBondContact OG-N 3.25Å; S546-N549 PolarHBondContact N-O 3.3Å; S546-N549 PolarHBondContact OG-N 2.99Å; S546-N549 VanDerWaalsContact OG-N 3.13Å; S546-N549 PolarHBondContact OG-O 3.13Å; S546-L567 WeakPolarHBondContact O-CD1 3.43Å
547	S	80.7	Confident	90.6	Very high	16 Å²	16	42.7 Å²	42.7	11%	0.112	22%	0.216	C	C	.	.	S	Bend	trans	-55.8	-33.7	170.6	41.7	0	0	0	0	114	L516 N518 Q519	L516-S547 VanDerWaalsContact O-CB 3.22Å; L516-S547 WeakPolarHBondContact O-CB 3.23Å; L516-S547 PolarHBondContact O-OG 3.28Å; N518-S547 VanDerWaalsContact CA-OG 3.3Å; N518-S547 WeakPolarHBondContact CA-OG 3.42Å; N518-S547 PolarHBondContact N-OG 3.1Å; Q519-S547 PolarHBondContact N-OG 3.33Å; Q519-S547 PolarHBondContact O-N 3.29Å
548	D	86.9	Confident	91.4	Very high	58 Å²	58	44.1 Å²	44.1	31%	0.31	22%	0.217	S	C	.	.	S	Bend	trans	-112.4	-23.7	-169	-49.8	-48.6	0	0	0	112.8	N518 S546 L567	N518-D548 WeakPolarHBondContact CA-OD2 3.28Å; N518-D548 PolarHBondContact N-OD2 2.98Å; S546-D548 PolarHBondContact O-N 2.7Å; S546-D548 PolarHBondContact OG-N 3.25Å; D548-L567 PolarHBondContact O-N 3.42Å
549	N	93.5	Very high	91.5	Very high	30 Å²	30	48.3 Å²	48.3	16%	0.16	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	145.4	-169.5	-67.6	-91	0	0	0	113.9	S546 M564 L565	S546-N549 PolarHBondContact N-O 3.3Å; S546-N549 PolarHBondContact OG-N 2.99Å; S546-N549 VanDerWaalsContact OG-N 3.13Å; S546-N549 PolarHBondContact OG-O 3.13Å; N549-M564 HydrophobicContact CB-CG 3.84Å; N549-M564 HydrophobicContact CB-SD 4.31Å; N549-M564 WeakPolarHBondContact OD1-CG 3.29Å; N549-L565 CarbonylContact C-O 3.46Å; N549-L565 WeakPolarHBondContact CA-O 3.38Å
550	L	96	Very high	91.4	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	108.4	161	-174.8	71.4	0	0	0	109.6	F543 L545 L565 L567 L588 L603 F620	F543-L550 HydrophobicContact CD1-CD1 3.64Å; F543-L550 HydrophobicContact CD1-CD2 3.85Å; F543-L550 HydrophobicContact CD1-CG 3.69Å; F543-L550 HydrophobicContact CE1-CD1 4.36Å; F543-L550 HydrophobicContact CE1-CD2 3.68Å; F543-L550 HydrophobicContact CE1-CG 3.97Å; L545-L550 HydrophobicContact CB-CD1 3.9Å; L545-L550 HydrophobicContact CD1-CB 4.39Å; L545-L550 HydrophobicContact CD1-CD1 4.01Å; L550-L565 HydrophobicContact CB-CB 4.34Å; L550-L565 HydrophobicContact CD2-CD2 4.41Å; L550-L565 PolarHBondContact N-O 3.21Å; L550-L565 PolarHBondContact O-N 3.07Å; L550-L567 HydrophobicContact CB-CD2 3.86Å; L550-L588 HydrophobicContact CD2-CD1 3.56Å; L550-L603 HydrophobicContact CD2-CD2 4.46Å; L550-F620 HydrophobicContact CB-CE1 4.49Å; L550-F620 HydrophobicContact CD1-CE1 3.86Å; L550-F620 HydrophobicContact CD1-CZ 3.65Å; L550-F620 HydrophobicContact CD2-CE1 3.88Å; L550-F620 HydrophobicContact CD2-CZ 3.71Å; L550-F620 HydrophobicContact CG-CE1 4.3Å; L550-F620 HydrophobicContact CG-CZ 4.28Å
551	S	95.3	Very high	91.5	Very high	9 Å²	9	45.9 Å²	45.9	6%	0.063	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	149.5	169.7	-62.6	0	0	0	0	110.8	F543 V544 K561 Y563 M564	F543-S551 WeakPolarHBondContact CA-O 3.46Å; V544-S551 PolarHBondContact N-O 2.99Å; V544-S551 PolarHBondContact O-N 3.25Å; S551-K561 PolarHBondContact OG-NZ 3.26Å; S551-Y563 WeakPolarHBondContact CA-O 3.49Å; S551-M564 WeakPolarHBondContact OG-CG 3.19Å
552	W	94.4	Very high	91.3	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	150.3	164.2	65	95.6	0	0	0	113.2	I528 F541 W542 F543 K562 Y563 L565 Y597 L603	I528-W552 HydrophobicContact CD1-CD2 4.24Å; I528-W552 HydrophobicContact CD1-CG 4.31Å; I528-W552 HydrophobicContact CD1-CZ2 4.25Å; F541-W552 HydrophobicContact CB-CB 4.2Å; F541-W552 HydrophobicContact CB-CG 4.45Å; F541-W552 AromaticContact CD1-CD1 3.93Å; F541-W552 AromaticContact CG-CD1 3.82Å; W542-W552 CarbonylContact O-C 3.43Å; W542-W552 VanDerWaalsContact O-CA 3.25Å; W542-W552 WeakPolarHBondContact O-CA 3.26Å; F543-W552 HydrophobicContact CD1-CB 3.69Å; F543-W552 HydrophobicContact CD1-CE3 4.25Å; F543-W552 HydrophobicContact CD1-CG 4.45Å; F543-W552 HydrophobicContact CD2-CB 3.97Å; F543-W552 HydrophobicContact CE1-CB 3.68Å; F543-W552 AromaticContact CE1-CD2 3.83Å; F543-W552 HydrophobicContact CE1-CD2 3.83Å; F543-W552 AromaticContact CE1-CE3 3.5Å; F543-W552 HydrophobicContact CE1-CE3 3.5Å; F543-W552 AromaticContact CE1-CG 3.96Å; F543-W552 HydrophobicContact CE1-CG 3.96Å; F543-W552 HydrophobicContact CE1-CZ3 4.3Å; F543-W552 HydrophobicContact CE2-CB 3.95Å; F543-W552 HydrophobicContact CE2-CG 4.36Å; F543-W552 HydrophobicContact CG-CB 3.88Å; F543-W552 HydrophobicContact CZ-CB 3.83Å; F543-W552 AromaticContact CZ-CD2 3.99Å; F543-W552 HydrophobicContact CZ-CD2 3.99Å; F543-W552 HydrophobicContact CZ-CE3 4.09Å; F543-W552 AromaticContact CZ-CG 3.93Å; F543-W552 HydrophobicContact CZ-CG 3.93Å; W552-K562 PolarHBondContact O-N 2.93Å; W552-Y563 AromaticContact CH2-CD1 3.38Å; W552-Y563 HydrophobicContact CH2-CD1 3.38Å; W552-Y563 HydrophobicContact CH2-CE1 4.28Å; W552-Y563 AromaticContact CH2-CG 3.94Å; W552-Y563 HydrophobicContact CH2-CG 3.94Å; W552-Y563 AromaticContact CZ2-CD1 3.99Å; W552-Y563 HydrophobicContact CZ2-CD1 3.99Å; W552-Y563 HydrophobicContact CZ2-CG 4.07Å; W552-Y563 AromaticContact CZ3-CD1 3.73Å; W552-Y563 HydrophobicContact CZ3-CD1 3.73Å; W552-Y563 HydrophobicContact CZ3-CG 4.41Å; W552-Y563 PolarHBondContact N-O 3.43Å; W552-Y563 PolarHBondContact O-N 2.98Å; W552-L565 HydrophobicContact CZ3-CB 4.14Å; W552-Y597 HydrophobicContact CH2-CD2 4.2Å; W552-Y597 HydrophobicContact CH2-CG 4.27Å; W552-Y597 HydrophobicContact CZ2-CD1 4.43Å; W552-Y597 AromaticContact CZ2-CD2 3.94Å; W552-Y597 HydrophobicContact CZ2-CD2 3.94Å; W552-Y597 HydrophobicContact CZ2-CE2 4.13Å; W552-Y597 HydrophobicContact CZ2-CG 4.1Å; W552-L603 HydrophobicContact CE3-CD2 4.46Å; W552-L603 HydrophobicContact CH2-CD1 4.08Å; W552-L603 HydrophobicContact CH2-CD2 3.75Å; W552-L603 HydrophobicContact CZ2-CD1 4.31Å; W552-L603 HydrophobicContact CZ3-CD2 3.71Å
553	Y	95.4	Very high	91.2	Very high	24 Å²	24	50.2 Å²	50.2	9%	0.094	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	158.1	-169.7	-56.4	-98.5	0	0	0	109.9	F541 W542 V544 D555 E558 E560 K561	F541-Y553 WeakPolarHBondContact CB-O 3.33Å; F541-Y553 WeakPolarHBondContact CD1-O 3.49Å; W542-Y553 PolarHBondContact N-O 3.34Å; W542-Y553 VanDerWaalsContact N-O 3.1Å; W542-Y553 PolarHBondContact O-N 3.07Å; V544-Y553 HydrophobicContact CB-CE2 3.97Å; V544-Y553 HydrophobicContact CG2-CD2 4.06Å; V544-Y553 HydrophobicContact CG2-CE2 3.54Å; Y553-D555 WeakPolarHBondContact CB-O 3.44Å; Y553-D555 PolarHBondContact O-N 2.81Å; Y553-E558 VanDerWaalsContact CD1-C 3.49Å; Y553-E558 HydrophobicContact CD1-CB 4.01Å; Y553-E558 HydrophobicContact CD1-CG 4.3Å; Y553-E558 WeakPolarHBondContact CD1-O 3.33Å; Y553-E558 HydrophobicContact CD2-CG 3.92Å; Y553-E558 HydrophobicContact CE1-CB 3.97Å; Y553-E558 HydrophobicContact CE1-CG 4.34Å; Y553-E558 WeakPolarHBondContact CE1-O 3.41Å; Y553-E558 HydrophobicContact CE2-CB 4.48Å; Y553-E558 HydrophobicContact CE2-CG 3.97Å; Y553-E558 HydrophobicContact CG-CB 4.29Å; Y553-E558 HydrophobicContact CG-CG 4.09Å; Y553-E560 WeakPolarHBondContact CA-O 3.41Å; Y553-K561 VanDerWaalsContact CD1-CA 3.44Å; Y553-K561 HydrophobicContact CD1-CB 3.75Å; Y553-K561 HydrophobicContact CD1-CG 4.27Å; Y553-K561 HydrophobicContact CE1-CB 3.58Å; Y553-K561 HydrophobicContact CE1-CD 4.47Å; Y553-K561 HydrophobicContact CE1-CG 3.96Å; Y553-K561 WeakPolarHBondContact OH-CE 3.3Å; Y553-K561 PolarHBondContact OH-NZ 2.94Å
554	K	89.9	Confident	91	Very high	110 Å²	110	54.8 Å²	54.8	48%	0.478	26%	0.258	S	S	.	.	S	Bend	trans	-58.5	-34.6	175.4	-178.2	174.8	149.6	-80.3	0	112.7	E560	K554-E560 HydrophobicContact CB-CB 4.23Å; K554-E560 WeakPolarHBondContact CD-OE2 3.37Å; K554-E560 PolarHBondContact N-O 2.77Å; K554-E560 VanDerWaalsContact N-O 3.17Å
555	D	89.2	Confident	91	Very high	25 Å²	25	54.2 Å²	54.2	13%	0.134	26%	0.255	C	S	.	.	S	Bend	trans	-154	165.3	-168	28.2	51.4	0	0	0	110.3	W542 Y553 E557 E558	W542-D555 WeakPolarHBondContact CB-O 3.47Å; Y553-D555 WeakPolarHBondContact CB-O 3.44Å; Y553-D555 PolarHBondContact O-N 2.81Å; D555-E557 PolarHBondContact O-N 3.42Å; D555-E558 PolarHBondContact O-N 3.44Å
556	D	89	Confident	90.9	Very high	98 Å²	98	57.2 Å²	57.2	52%	0.524	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-8.1	179.3	59.8	-36.3	0	0	0	114	W525 W542 E558	W525-D556 HydrophobicContact CZ2-CB 4.37Å; W542-D556 HydrophobicContact CD2-CB 3.67Å; W542-D556 HydrophobicContact CE3-CB 3.82Å; W542-D556 HydrophobicContact CG-CB 4.01Å; W542-D556 HydrophobicContact CH2-CB 4.41Å; W542-D556 HydrophobicContact CZ2-CB 4.29Å; W542-D556 HydrophobicContact CZ3-CB 4.18Å; D556-E558 PolarHBondContact O-N 3.06Å
557	E	87.8	Confident	90.9	Very high	117 Å²	117	57.1 Å²	57.1	55%	0.547	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.2	166.4	-59.3	-157.3	110.9	0	0	113.4	D555 K559	D555-E557 PolarHBondContact O-N 3.42Å; E557-K559 HydrophobicContact CB-CD 4.07Å; E557-K559 HydrophobicContact CB-CG 4.05Å; E557-K559 PolarHBondContact O-N 3.04Å; E557-K559 IonicContact OE1-NZ 2.84Å; E557-K559 PolarHBondContact OE1-NZ 2.73Å; E557-K559 WeakPolarHBondContact OE2-CD 3.28Å; E557-K559 WeakPolarHBondContact OE2-CE 3.36Å; E557-K559 IonicContact OE2-NZ 3.9Å; E557-K559 PolarHBondContact OE2-NZ 2.77Å
558	E	89.3	Confident	91.2	Very high	54 Å²	54	61.8 Å²	61.8	25%	0.252	30%	0.297	S	S	.	.			trans	56.9	14.7	-180	-71.8	173.3	-148.6	0	0	115.4	K523 W542 V544 Y553 D555 D556	K523-E558 WeakPolarHBondContact CD-OE1 3.41Å; K523-E558 VanDerWaalsContact CE-OE1 3.29Å; K523-E558 WeakPolarHBondContact CE-OE1 3.21Å; K523-E558 IonicContact NZ-OE1 3.65Å; K523-E558 PolarHBondContact NZ-OE1 2.96Å; K523-E558 IonicContact NZ-OE2 3.64Å; K523-E558 PolarHBondContact NZ-OE2 2.89Å; W542-E558 PolarHBondContact NE1-OE1 2.98Å; V544-E558 HydrophobicContact CG2-CG 4.26Å; V544-E558 WeakPolarHBondContact CG2-OE1 3.3Å; Y553-E558 VanDerWaalsContact CD1-C 3.49Å; Y553-E558 HydrophobicContact CD1-CB 4.01Å; Y553-E558 HydrophobicContact CD1-CG 4.3Å; Y553-E558 WeakPolarHBondContact CD1-O 3.33Å; Y553-E558 HydrophobicContact CD2-CG 3.92Å; Y553-E558 HydrophobicContact CE1-CB 3.97Å; Y553-E558 HydrophobicContact CE1-CG 4.34Å; Y553-E558 WeakPolarHBondContact CE1-O 3.41Å; Y553-E558 HydrophobicContact CE2-CB 4.48Å; Y553-E558 HydrophobicContact CE2-CG 3.97Å; Y553-E558 HydrophobicContact CG-CB 4.29Å; Y553-E558 HydrophobicContact CG-CG 4.09Å; D555-E558 PolarHBondContact O-N 3.44Å; D556-E558 PolarHBondContact O-N 3.06Å
559	K	87.1	Confident	91.1	Very high	152 Å²	152	61.3 Å²	61.3	66%	0.661	31%	0.305	S	S	*	.			trans	-73.1	-43.8	-178.5	-66	173	-168.3	161.1	0	113.1	E557	E557-K559 HydrophobicContact CB-CD 4.07Å; E557-K559 HydrophobicContact CB-CG 4.05Å; E557-K559 PolarHBondContact O-N 3.04Å; E557-K559 IonicContact OE1-NZ 2.84Å; E557-K559 PolarHBondContact OE1-NZ 2.73Å; E557-K559 WeakPolarHBondContact OE2-CD 3.28Å; E557-K559 WeakPolarHBondContact OE2-CE 3.36Å; E557-K559 IonicContact OE2-NZ 3.9Å; E557-K559 PolarHBondContact OE2-NZ 2.77Å
560	E	87.7	Confident	91.1	Very high	91 Å²	91	60.1 Å²	60.1	43%	0.425	30%	0.298	S	S	.	.	S	Bend	trans	-107.2	85	-175.7	-157.4	-158.1	166.7	0	0	111.9	Y553 K554 K562	Y553-E560 WeakPolarHBondContact CA-O 3.41Å; K554-E560 HydrophobicContact CB-CB 4.23Å; K554-E560 WeakPolarHBondContact CD-OE2 3.37Å; K554-E560 PolarHBondContact N-O 2.77Å; K554-E560 VanDerWaalsContact N-O 3.17Å; E560-K562 PolarHBondContact O-N 3.39Å; E560-K562 IonicContact OE1-NZ 2.66Å; E560-K562 PolarHBondContact OE1-NZ 3.48Å; E560-K562 VanDerWaalsContact OE2-CE 3.27Å; E560-K562 WeakPolarHBondContact OE2-CE 3.13Å; E560-K562 IonicContact OE2-NZ 2.73Å; E560-K562 PolarHBondContact OE2-NZ 3.32Å
561	K	92.1	Very high	90.9	Very high	93 Å²	93	63.7 Å²	63.7	40%	0.404	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	120.7	173.7	-170.8	177.7	-63.8	-151.4	0	110.3	S551 Y553 Y563 M564	S551-K561 PolarHBondContact OG-NZ 3.26Å; Y553-K561 VanDerWaalsContact CD1-CA 3.44Å; Y553-K561 HydrophobicContact CD1-CB 3.75Å; Y553-K561 HydrophobicContact CD1-CG 4.27Å; Y553-K561 HydrophobicContact CE1-CB 3.58Å; Y553-K561 HydrophobicContact CE1-CD 4.47Å; Y553-K561 HydrophobicContact CE1-CG 3.96Å; Y553-K561 WeakPolarHBondContact OH-CE 3.3Å; Y553-K561 PolarHBondContact OH-NZ 2.94Å; K561-Y563 WeakPolarHBondContact CG-O 3.42Å; K561-M564 HydrophobicContact CD-CB 4.24Å
562	K	91.2	Very high	90.8	Very high	77 Å²	77	63.5 Å²	63.5	34%	0.335	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-37.9	178.6	-62.7	-66.7	175.1	-178.6	0	112.5	F541 W552 E560	F541-K562 HydrophobicContact CD1-CG 4.22Å; F541-K562 HydrophobicContact CE1-CG 4.02Å; W552-K562 PolarHBondContact O-N 2.93Å; E560-K562 PolarHBondContact O-N 3.39Å; E560-K562 IonicContact OE1-NZ 2.66Å; E560-K562 PolarHBondContact OE1-NZ 3.48Å; E560-K562 VanDerWaalsContact OE2-CE 3.27Å; E560-K562 WeakPolarHBondContact OE2-CE 3.13Å; E560-K562 IonicContact OE2-NZ 2.73Å; E560-K562 PolarHBondContact OE2-NZ 3.32Å
563	Y	93.4	Very high	90.6	Very high	80 Å²	80	67.5 Å²	67.5	31%	0.314	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	165.9	177.1	-160.1	-116.3	0	0	0	111.7	S551 W552 K561 L565 V596 Y597	S551-Y563 WeakPolarHBondContact CA-O 3.49Å; W552-Y563 AromaticContact CH2-CD1 3.38Å; W552-Y563 HydrophobicContact CH2-CD1 3.38Å; W552-Y563 HydrophobicContact CH2-CE1 4.28Å; W552-Y563 AromaticContact CH2-CG 3.94Å; W552-Y563 HydrophobicContact CH2-CG 3.94Å; W552-Y563 AromaticContact CZ2-CD1 3.99Å; W552-Y563 HydrophobicContact CZ2-CD1 3.99Å; W552-Y563 HydrophobicContact CZ2-CG 4.07Å; W552-Y563 AromaticContact CZ3-CD1 3.73Å; W552-Y563 HydrophobicContact CZ3-CD1 3.73Å; W552-Y563 HydrophobicContact CZ3-CG 4.41Å; W552-Y563 PolarHBondContact N-O 3.43Å; W552-Y563 PolarHBondContact O-N 2.98Å; K561-Y563 WeakPolarHBondContact CG-O 3.42Å; Y563-L565 HydrophobicContact CD1-CB 4.09Å; Y563-L565 HydrophobicContact CE1-CB 4.04Å; Y563-L565 HydrophobicContact CE1-CD1 4.48Å; Y563-V596 WeakPolarHBondContact CE1-O 3.34Å; Y563-V596 PolarHBondContact OH-O 2.77Å; Y563-Y597 AromaticContact CD1-CD2 3.8Å; Y563-Y597 HydrophobicContact CD1-CD2 3.8Å; Y563-Y597 HydrophobicContact CD1-CE2 4.47Å; Y563-Y597 AromaticContact CD2-CD2 3.6Å; Y563-Y597 HydrophobicContact CD2-CD2 3.6Å; Y563-Y597 AromaticContact CD2-CE2 3.7Å; Y563-Y597 HydrophobicContact CD2-CE2 3.7Å; Y563-Y597 AromaticContact CE1-CD2 3.94Å; Y563-Y597 HydrophobicContact CE1-CD2 3.94Å; Y563-Y597 AromaticContact CE2-CD2 3.77Å; Y563-Y597 HydrophobicContact CE2-CD2 3.77Å; Y563-Y597 HydrophobicContact CE2-CE2 4.21Å; Y563-Y597 AromaticContact CG-CD2 3.6Å; Y563-Y597 HydrophobicContact CG-CD2 3.6Å; Y563-Y597 AromaticContact CG-CE2 3.84Å; Y563-Y597 HydrophobicContact CG-CE2 3.84Å; Y563-Y597 AromaticContact CZ-CD2 3.93Å
564	M	93.1	Very high	90.3	Very high	95 Å²	95	71.3 Å²	71.3	47%	0.468	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	113.6	169.2	-170.4	169.5	81.8	0	0	107.8	N549 S551 K561	N549-M564 HydrophobicContact CB-CG 3.84Å; N549-M564 HydrophobicContact CB-SD 4.31Å; N549-M564 WeakPolarHBondContact OD1-CG 3.29Å; S551-M564 WeakPolarHBondContact OG-CG 3.19Å; K561-M564 HydrophobicContact CD-CB 4.24Å
565	L	93.9	Very high	90.2	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	115.5	-179.2	170.9	61.9	0	0	0	109.5	N549 L550 W552 Y563 L570 L588 Y590 V596 L603	N549-L565 CarbonylContact C-O 3.46Å; N549-L565 WeakPolarHBondContact CA-O 3.38Å; L550-L565 HydrophobicContact CB-CB 4.34Å; L550-L565 HydrophobicContact CD2-CD2 4.41Å; L550-L565 PolarHBondContact N-O 3.21Å; L550-L565 PolarHBondContact O-N 3.07Å; W552-L565 HydrophobicContact CZ3-CB 4.14Å; Y563-L565 HydrophobicContact CD1-CB 4.09Å; Y563-L565 HydrophobicContact CE1-CB 4.04Å; Y563-L565 HydrophobicContact CE1-CD1 4.48Å; L565-L570 HydrophobicContact CD1-CD1 4.48Å; L565-L570 HydrophobicContact CD2-CD1 4.37Å; L565-L570 HydrophobicContact CD2-CD2 3.8Å; L565-L570 HydrophobicContact CG-CD2 4.22Å; L565-L588 HydrophobicContact CD2-CD1 4.41Å; L565-Y590 HydrophobicContact CD1-CE2 4.36Å; L565-Y590 VanDerWaalsContact CD1-OH 3.32Å; L565-Y590 WeakPolarHBondContact CD1-OH 3.48Å; L565-V596 HydrophobicContact CD1-CG1 3.69Å; L565-V596 HydrophobicContact CD2-CG1 3.47Å; L565-V596 VanDerWaalsContact CD2-CG1 3.47Å; L565-V596 HydrophobicContact CG-CG1 4.23Å; L565-L603 HydrophobicContact CD2-CD2 4.49Å
566	P	92.6	Very high	89.5	Confident	62 Å²	62	75.4 Å²	75.4	40%	0.403	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	137.3	170.5	-21.5	34.2	0	0	0	111.2	Y590	P566-Y590 PolarHBondContact O-OH 2.99Å
567	L	90.1	Very high	88.4	Confident	8 Å²	8	73.4 Å²	73.4	4%	0.042	37%	0.369	C	S	.	.			trans	-84.1	-15.6	-177.3	-56.8	-178	0	0	0	113.8	L545 S546 D548 L550 G569 L570 A623 V625	L545-L567 HydrophobicContact CD1-CD1 3.6Å; L545-L567 HydrophobicContact CD1-CD2 4.14Å; L545-L567 HydrophobicContact CD1-CG 4.49Å; S546-L567 WeakPolarHBondContact O-CD1 3.43Å; D548-L567 PolarHBondContact O-N 3.42Å; L550-L567 HydrophobicContact CB-CD2 3.86Å; L567-G569 PolarHBondContact O-N 2.95Å; L567-L570 HydrophobicContact CD2-CD2 4.03Å; L567-L570 WeakPolarHBondContact O-CB 3.23Å; L567-L570 PolarHBondContact O-N 2.96Å; L567-A623 HydrophobicContact CD1-CB 3.56Å; L567-V625 HydrophobicContact CB-CG2 3.82Å; L567-V625 HydrophobicContact CD1-CG2 4.24Å; L567-V625 HydrophobicContact CD2-CG2 3.95Å; L567-V625 HydrophobicContact CG-CG2 4.2Å
568	D	86.5	Confident	87.3	Confident	114 Å²	114	70.4 Å²	70.4	61%	0.61	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	129.6	-176.8	-165.9	11.3	0	0	0	111.5	Q513 L570 Y590	Q513-D568 PolarHBondContact NE2-OD2 3.29Å; D568-L570 PolarHBondContact O-N 2.87Å; D568-Y590 WeakPolarHBondContact O-CE1 3.35Å
569	G	86.2	Confident	86	Confident	47 Å²	47	78 Å²	78	49%	0.485	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	-2.4	-173.3	0	0	0	0	0	116.4	L567 P591	L567-G569 PolarHBondContact O-N 2.95Å; G569-P591 WeakPolarHBondContact O-CD 3.23Å
570	L	92.6	Very high	84.8	Confident	5 Å²	5	79.6 Å²	79.6	3%	0.026	41%	0.414	C	S	.	.			trans	-76.2	143.1	-178.7	-161.5	73.5	0	0	0	111.2	L565 L567 D568 L588 Y590 V596 V625	L565-L570 HydrophobicContact CD1-CD1 4.48Å; L565-L570 HydrophobicContact CD2-CD1 4.37Å; L565-L570 HydrophobicContact CD2-CD2 3.8Å; L565-L570 HydrophobicContact CG-CD2 4.22Å; L567-L570 HydrophobicContact CD2-CD2 4.03Å; L567-L570 WeakPolarHBondContact O-CB 3.23Å; L567-L570 PolarHBondContact O-N 2.96Å; D568-L570 PolarHBondContact O-N 2.87Å; L570-L588 HydrophobicContact CD1-CB 4.44Å; L570-L588 HydrophobicContact CD2-CB 4.1Å; L570-L588 HydrophobicContact CD2-CD1 4.16Å; L570-L588 HydrophobicContact CG-CB 4.34Å; L570-Y590 HydrophobicContact CB-CD1 4.36Å; L570-Y590 HydrophobicContact CB-CE1 3.96Å; L570-Y590 HydrophobicContact CD1-CD1 3.85Å; L570-Y590 HydrophobicContact CD1-CD2 4.45Å; L570-Y590 HydrophobicContact CD1-CE1 3.58Å; L570-Y590 HydrophobicContact CD1-CE2 4.25Å; L570-Y590 HydrophobicContact CD1-CG 4.27Å; L570-Y590 HydrophobicContact CG-CE1 4.39Å; L570-V596 HydrophobicContact CD1-CG1 4.49Å; L570-V596 HydrophobicContact CD1-CG2 4.3Å; L570-V625 HydrophobicContact CB-CG2 4.36Å; L570-V625 HydrophobicContact CD2-CG1 4.45Å; L570-V625 HydrophobicContact CD2-CG2 4.32Å; L570-V625 HydrophobicContact CG-CG1 4.48Å
571	K	92.2	Very high	83.9	Confident	76 Å²	76	77.6 Å²	77.6	33%	0.33	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	159	170.4	-69.8	-167.8	-170.3	167.6	0	111.4	L588 F589 P591 Y626	K571-L588 CarbonylContact O-C 3.55Å; K571-L588 WeakPolarHBondContact O-CA 3.26Å; K571-F589 HydrophobicContact CB-CD1 4.34Å; K571-F589 HydrophobicContact CB-CE1 3.64Å; K571-F589 HydrophobicContact CB-CZ 3.78Å; K571-F589 HydrophobicContact CD-CZ 4.42Å; K571-F589 PolarHBondContact N-O 3.27Å; K571-F589 WeakPolarHBondContact O-CD1 3.36Å; K571-F589 PolarHBondContact O-N 3.44Å; K571-P591 HydrophobicContact CD-CG 3.71Å; K571-P591 HydrophobicContact CG-CG 3.85Å; K571-Y626 WeakPolarHBondContact CA-O 3.47Å; K571-Y626 WeakPolarHBondContact CB-O 3.18Å
572	L	92.4	Very high	82.8	Confident	4 Å²	4	84.7 Å²	84.7	2%	0.021	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	154.6	170.1	72.9	85	0	0	0	111.1	A587 L588 K617 F620 V625 Y626 P627 E628	L572-A587 CarbonylContact C-O 3.48Å; L572-A587 VanDerWaalsContact CA-O 3.27Å; L572-A587 WeakPolarHBondContact CA-O 3.34Å; L572-L588 HydrophobicContact CB-CD2 3.69Å; L572-K617 HydrophobicContact CD1-CG 4.44Å; L572-F620 HydrophobicContact CD2-CB 3.79Å; L572-V625 HydrophobicContact CB-CG1 4.21Å; L572-V625 HydrophobicContact CD2-CG1 4.39Å; L572-Y626 PolarHBondContact N-O 3.29Å; L572-P627 HydrophobicContact CD1-CB 4.3Å; L572-P627 HydrophobicContact CD1-CG 4.06Å; L572-P627 HydrophobicContact CG-CG 4.47Å; L572-P627 CarbonylContact O-C 3.55Å; L572-P627 VanDerWaalsContact O-CA 3.24Å; L572-P627 WeakPolarHBondContact O-CA 3.46Å; L572-E628 PolarHBondContact O-N 3.29Å
573	R	91.2	Very high	82.4	Confident	85 Å²	85	83.8 Å²	83.8	32%	0.321	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	153	167.9	65	-171.6	178.1	-169	-0.8	111	F586 A587 F589 E628	R573-F586 CarbonylContact O-C 3.48Å; R573-F586 WeakPolarHBondContact O-CA 3.43Å; R573-F586 WeakPolarHBondContact O-CB 3.47Å; R573-A587 HydrophobicContact CG-CB 4.15Å; R573-A587 PolarHBondContact N-O 3.31Å; R573-A587 PolarHBondContact O-N 2.87Å; R573-F589 HydrophobicContact CB-CE1 4.17Å; R573-F589 HydrophobicContact CG-CD1 4.16Å; R573-F589 HydrophobicContact CG-CE1 3.98Å; R573-E628 HydrophobicContact CB-CB 3.99Å; R573-E628 WeakPolarHBondContact CD-OE2 3.3Å; R573-E628 IonicContact CZ-OE2 2.67Å; R573-E628 IonicContact NE-OE2 3.76Å; R573-E628 IonicContact NH1-OE2 3.18Å; R573-E628 PolarHBondContact NH1-OE2 3.34Å
574	D	89.2	Confident	81.9	Confident	105 Å²	105	85 Å²	85	56%	0.561	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	145.1	169.3	-78.9	-68	0	0	0	110.6	K617	D574-K617 WeakPolarHBondContact OD1-CE 3.36Å; D574-K617 IonicContact OD1-NZ 2.69Å; D574-K617 PolarHBondContact OD1-NZ 3Å; D574-K617 IonicContact OD2-NZ 2.81Å; D574-K617 PolarHBondContact OD2-NZ 2.92Å
575	V	86.6	Confident	81.7	Confident	34 Å²	34	82.3 Å²	82.3	21%	0.206	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	120.3	179.8	173.9	0	0	0	0	107.9	A577 K585 A587 E604	V575-A577 PolarHBondContact O-N 3.01Å; V575-K585 HydrophobicContact CB-CB 3.83Å; V575-K585 HydrophobicContact CG1-CB 4.27Å; V575-K585 HydrophobicContact CG1-CD 4.45Å; V575-K585 PolarHBondContact N-O 2.84Å; V575-A587 HydrophobicContact CG2-CB 3.42Å; V575-A587 VanDerWaalsContact CG2-CB 3.42Å; V575-E604 HydrophobicContact CG2-CG 4.38Å
576	E	74.7	Confident	81.7	Confident	186 Å²	186	82.3 Å²	82.3	87%	0.869	43%	0.429	S	S	*	.			trans	-58.9	129.2	-178.9	-64.8	-174.5	164.5	0	0	111.3	G578	E576-G578 PolarHBondContact O-N 2.85Å; E576-G578 VanDerWaalsContact O-N 3.09Å
577	A	66.7	Low	81.8	Confident	57 Å²	57	79.3 Å²	79.3	47%	0.471	41%	0.41	S	S	.	.			trans	-74.1	101.9	176.3	0	0	0	0	0	109.3	V575	V575-A577 PolarHBondContact O-N 3.01Å
578	G	64.3	Low	82	Confident	53 Å²	53	79 Å²	79	55%	0.546	41%	0.408	S	S	.	.			trans	-56.3	151.1	175	0	0	0	0	0	112.1	E576 M580 S581	E576-G578 PolarHBondContact O-N 2.85Å; E576-G578 VanDerWaalsContact O-N 3.09Å; G578-M580 PolarHBondContact O-N 3.24Å; G578-S581 PolarHBondContact O-N 2.89Å
579	F	62.2	Low	82.4	Confident	214 Å²	214	74.1 Å²	74.1	94%	0.939	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40	-22.2	-164	-172.6	-102.2	0	0	0	119.1
580	M	62.6	Low	82.7	Confident	186 Å²	186	73.6 Å²	73.6	92%	0.916	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-1.5	-179.2	-58.5	-178.3	-174.3	0	0	114.6	G578	G578-M580 PolarHBondContact O-N 3.24Å
581	S	67.8	Low	82.4	Confident	49 Å²	49	76.5 Å²	76.5	34%	0.343	38%	0.384	S	S	.	.			trans	-109.7	143.2	-178.6	-169.3	0	0	0	0	113	G578 T583	G578-S581 PolarHBondContact O-N 2.89Å; S581-T583 PolarHBondContact OG-N 3.43Å; S581-T583 VanDerWaalsContact OG-N 3.11Å; S581-T583 PolarHBondContact OG-OG1 3.4Å
582	R	70.3	Confident	82.1	Confident	242 Å²	242	77.3 Å²	77.3	91%	0.913	39%	0.392	S	S	*	.			trans	-107.4	3.7	167.1	-65	-173.6	177.8	-169.9	-0.6	113.3	H584	R582-H584 PolarHBondContact O-N 2.87Å
583	T	80.8	Confident	81.8	Confident	57 Å²	57	81.8 Å²	81.8	35%	0.35	42%	0.416	S	S	.	.			trans	-74.5	117.9	-178.6	61.8	0	0	0	0	110.7	S581 K585	S581-T583 PolarHBondContact OG-N 3.43Å; S581-T583 VanDerWaalsContact OG-N 3.11Å; S581-T583 PolarHBondContact OG-OG1 3.4Å; T583-K585 PolarHBondContact O-N 2.8Å; T583-K585 WeakPolarHBondContact OG1-CE 3.39Å
584	H	83.2	Confident	81.7	Confident	105 Å²	105	83.8 Å²	83.8	49%	0.486	43%	0.427	S	S	.	.			trans	-66.6	125.8	167.3	-62	-77.6	0	0	0	109.6	R582 S606 L610 V613	R582-H584 PolarHBondContact O-N 2.87Å; H584-S606 WeakPolarHBondContact O-CB 3.49Å; H584-L610 HydrophobicContact CB-CD1 4.21Å; H584-V613 HydrophobicContact CB-CG2 4.43Å
585	K	89.7	Confident	81.8	Confident	39 Å²	39	82.3 Å²	82.3	17%	0.17	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.7	-175	-73.2	-179.2	176.7	-164.9	0	111.2	H529 V575 T583 L605	H529-K585 VanDerWaalsContact CE1-CE 3.4Å; H529-K585 WeakPolarHBondContact CE1-CE 3.48Å; H529-K585 WeakPolarHBondContact ND1-CE 3.44Å; H529-K585 PolarHBondContact ND1-NZ 2.84Å; V575-K585 HydrophobicContact CB-CB 3.83Å; V575-K585 HydrophobicContact CG1-CB 4.27Å; V575-K585 HydrophobicContact CG1-CD 4.45Å; V575-K585 PolarHBondContact N-O 2.84Å; T583-K585 PolarHBondContact O-N 2.8Å; T583-K585 WeakPolarHBondContact OG1-CE 3.39Å; K585-L605 WeakPolarHBondContact CA-O 3.4Å
586	F	93.5	Very high	82	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	152.4	165.6	66.9	-78.2	0	0	0	110	R573 L588 L605 V613 W616 F620	R573-F586 CarbonylContact O-C 3.48Å; R573-F586 WeakPolarHBondContact O-CA 3.43Å; R573-F586 WeakPolarHBondContact O-CB 3.47Å; F586-L588 HydrophobicContact CD2-CD2 4.29Å; F586-L588 HydrophobicContact CE2-CD2 4.16Å; F586-L588 HydrophobicContact CE2-CG 4.43Å; F586-L605 HydrophobicContact CD1-CB 4.24Å; F586-L605 HydrophobicContact CD2-CB 4.49Å; F586-L605 HydrophobicContact CE1-CB 3.77Å; F586-L605 HydrophobicContact CE2-CB 4.04Å; F586-L605 HydrophobicContact CE2-CD1 3.74Å; F586-L605 HydrophobicContact CE2-CG 4.48Å; F586-L605 HydrophobicContact CZ-CB 3.66Å; F586-L605 HydrophobicContact CZ-CD1 3.83Å; F586-L605 HydrophobicContact CZ-CG 4.39Å; F586-L605 PolarHBondContact N-O 2.67Å; F586-L605 PolarHBondContact O-N 2.83Å; F586-V613 HydrophobicContact CD1-CG1 3.95Å; F586-V613 HydrophobicContact CE1-CG1 4.42Å; F586-W616 HydrophobicContact CE1-CB 4.46Å; F586-W616 HydrophobicContact CZ-CB 4.25Å; F586-F620 AromaticContact CE2-CD2 3.84Å; F586-F620 HydrophobicContact CE2-CD2 3.84Å; F586-F620 AromaticContact CE2-CE2 3.62Å; F586-F620 HydrophobicContact CE2-CE2 3.62Å; F586-F620 HydrophobicContact CE2-CZ 4.48Å; F586-F620 HydrophobicContact CZ-CD2 4.19Å; F586-F620 AromaticContact CZ-CE2 3.77Å; F586-F620 HydrophobicContact CZ-CE2 3.77Å
587	A	94.1	Very high	82.7	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	134.7	177.9	0	0	0	0	0	110.5	L572 R573 V575 Q602 L603 E604	L572-A587 CarbonylContact C-O 3.48Å; L572-A587 VanDerWaalsContact CA-O 3.27Å; L572-A587 WeakPolarHBondContact CA-O 3.34Å; R573-A587 HydrophobicContact CG-CB 4.15Å; R573-A587 PolarHBondContact N-O 3.31Å; R573-A587 PolarHBondContact O-N 2.87Å; V575-A587 HydrophobicContact CG2-CB 3.42Å; V575-A587 VanDerWaalsContact CG2-CB 3.42Å; A587-Q602 HydrophobicContact CB-CB 4.22Å; A587-Q602 HydrophobicContact CB-CG 4.3Å; A587-L603 WeakPolarHBondContact CA-O 3.33Å; A587-E604 HydrophobicContact CB-CG 4.23Å
588	L	95.7	Very high	83.7	Confident	0 Å²	0	77 Å²	77	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.8	165	-56.7	179.2	0	0	0	109.3	L550 L565 L570 K571 L572 F586 Q602 L603 L605 F620 V625	L550-L588 HydrophobicContact CD2-CD1 3.56Å; L565-L588 HydrophobicContact CD2-CD1 4.41Å; L570-L588 HydrophobicContact CD1-CB 4.44Å; L570-L588 HydrophobicContact CD2-CB 4.1Å; L570-L588 HydrophobicContact CD2-CD1 4.16Å; L570-L588 HydrophobicContact CG-CB 4.34Å; K571-L588 CarbonylContact O-C 3.55Å; K571-L588 WeakPolarHBondContact O-CA 3.26Å; L572-L588 HydrophobicContact CB-CD2 3.69Å; F586-L588 HydrophobicContact CD2-CD2 4.29Å; F586-L588 HydrophobicContact CE2-CD2 4.16Å; F586-L588 HydrophobicContact CE2-CG 4.43Å; L588-Q602 CarbonylContact O-C 3.54Å; L588-Q602 WeakPolarHBondContact O-CA 3.35Å; L588-L603 HydrophobicContact CB-CB 4.4Å; L588-L603 PolarHBondContact N-O 3.1Å; L588-L603 PolarHBondContact O-N 3.07Å; L588-L605 HydrophobicContact CD1-CD1 3.71Å; L588-L605 HydrophobicContact CG-CD1 3.98Å; L588-F620 HydrophobicContact CD1-CD1 4.45Å; L588-F620 HydrophobicContact CD1-CE1 3.65Å; L588-F620 HydrophobicContact CD1-CE2 4.5Å; L588-F620 HydrophobicContact CD1-CZ 3.7Å; L588-F620 HydrophobicContact CD2-CD1 4.27Å; L588-F620 HydrophobicContact CD2-CE1 4.24Å; L588-F620 HydrophobicContact CD2-CG 4.48Å; L588-F620 HydrophobicContact CD2-CZ 4.45Å; L588-V625 HydrophobicContact CD2-CG1 4.14Å
589	F	94.1	Very high	84.7	Confident	12 Å²	12	80.9 Å²	80.9	5%	0.053	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	159.8	-176	74.6	-72.5	0	0	0	112	K571 R573 Q602 E628	K571-F589 HydrophobicContact CB-CD1 4.34Å; K571-F589 HydrophobicContact CB-CE1 3.64Å; K571-F589 HydrophobicContact CB-CZ 3.78Å; K571-F589 HydrophobicContact CD-CZ 4.42Å; K571-F589 PolarHBondContact N-O 3.27Å; K571-F589 WeakPolarHBondContact O-CD1 3.36Å; K571-F589 PolarHBondContact O-N 3.44Å; R573-F589 HydrophobicContact CB-CE1 4.17Å; R573-F589 HydrophobicContact CG-CD1 4.16Å; R573-F589 HydrophobicContact CG-CE1 3.98Å; F589-Q602 HydrophobicContact CB-CB 3.86Å; F589-E628 HydrophobicContact CE1-CB 4.02Å; F589-E628 WeakPolarHBondContact CE2-OE1 3.26Å; F589-E628 HydrophobicContact CZ-CB 3.79Å; F589-E628 HydrophobicContact CZ-CG 3.98Å; F589-E628 WeakPolarHBondContact CZ-OE1 3.33Å; F589-E628 WeakPolarHBondContact CZ-OE2 3.29Å
590	Y	92.8	Very high	86	Confident	36 Å²	36	74.2 Å²	74.2	14%	0.141	36%	0.357	C	S	.	.			trans	-93.9	131.1	170.6	-67.8	-61.3	0	0	0	110.5	L565 P566 D568 L570 D592 N593 K594 V596	L565-Y590 HydrophobicContact CD1-CE2 4.36Å; L565-Y590 VanDerWaalsContact CD1-OH 3.32Å; L565-Y590 WeakPolarHBondContact CD1-OH 3.48Å; P566-Y590 PolarHBondContact O-OH 2.99Å; D568-Y590 WeakPolarHBondContact O-CE1 3.35Å; L570-Y590 HydrophobicContact CB-CD1 4.36Å; L570-Y590 HydrophobicContact CB-CE1 3.96Å; L570-Y590 HydrophobicContact CD1-CD1 3.85Å; L570-Y590 HydrophobicContact CD1-CD2 4.45Å; L570-Y590 HydrophobicContact CD1-CE1 3.58Å; L570-Y590 HydrophobicContact CD1-CE2 4.25Å; L570-Y590 HydrophobicContact CD1-CG 4.27Å; L570-Y590 HydrophobicContact CG-CE1 4.39Å; Y590-D592 WeakPolarHBondContact CB-OD1 3.33Å; Y590-D592 PolarHBondContact O-N 3.48Å; Y590-N593 PolarHBondContact O-N 2.95Å; Y590-K594 HydrophobicContact CD2-CB 3.86Å; Y590-K594 HydrophobicContact CG-CB 4.23Å; Y590-V596 HydrophobicContact CD2-CG2 3.98Å; Y590-V596 HydrophobicContact CE2-CG2 4.26Å
591	P	86.1	Confident	87.4	Confident	66 Å²	66	70.4 Å²	70.4	43%	0.429	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.6	-177.7	-25.7	35.2	0	0	0	115.1	G569 K571 N593	G569-P591 WeakPolarHBondContact O-CD 3.23Å; K571-P591 HydrophobicContact CD-CG 3.71Å; K571-P591 HydrophobicContact CG-CG 3.85Å; P591-N593 PolarHBondContact O-N 3.43Å
592	D	86.2	Confident	88.5	Confident	93 Å²	93	70.1 Å²	70.1	50%	0.497	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	10.6	173.9	61	12.3	0	0	0	113.1	Y590 K594	Y590-D592 WeakPolarHBondContact CB-OD1 3.33Å; Y590-D592 PolarHBondContact O-N 3.48Å; D592-K594 PolarHBondContact O-N 2.84Å; D592-K594 WeakPolarHBondContact OD1-CB 3.41Å; D592-K594 WeakPolarHBondContact OD1-CD 3.2Å; D592-K594 WeakPolarHBondContact OD1-CG 3.37Å; D592-K594 PolarHBondContact OD1-N 2.69Å; D592-K594 WeakPolarHBondContact OD2-CD 3.35Å; D592-K594 WeakPolarHBondContact OD2-CE 3.47Å; D592-K594 IonicContact OD2-NZ 3.19Å; D592-K594 PolarHBondContact OD2-NZ 2.81Å
593	N	86.2	Confident	89.7	Confident	98 Å²	98	58.6 Å²	58.6	52%	0.524	29%	0.285	S	S	.	.			trans	66.5	18.4	173.6	-126.7	-46	0	0	0	114.2	Y590 P591 K601	Y590-N593 PolarHBondContact O-N 2.95Å; P591-N593 PolarHBondContact O-N 3.43Å; N593-K601 WeakPolarHBondContact O-CE 3.36Å; N593-K601 VanDerWaalsContact OD1-CD 3.3Å; N593-K601 WeakPolarHBondContact OD1-CD 3.35Å; N593-K601 WeakPolarHBondContact OD1-CE 3.32Å; N593-K601 PolarHBondContact OD1-NZ 2.82Å
594	K	89.8	Confident	90.3	Very high	127 Å²	127	57.6 Å²	57.6	55%	0.552	28%	0.276	S	S	*	.			trans	-60.1	154.6	167.6	-76.6	169.9	-175.5	147.3	0	111.8	Y590 D592	Y590-K594 HydrophobicContact CD2-CB 3.86Å; Y590-K594 HydrophobicContact CG-CB 4.23Å; D592-K594 PolarHBondContact O-N 2.84Å; D592-K594 WeakPolarHBondContact OD1-CB 3.41Å; D592-K594 WeakPolarHBondContact OD1-CD 3.2Å; D592-K594 WeakPolarHBondContact OD1-CG 3.37Å; D592-K594 PolarHBondContact OD1-N 2.69Å; D592-K594 WeakPolarHBondContact OD2-CD 3.35Å; D592-K594 WeakPolarHBondContact OD2-CE 3.47Å; D592-K594 IonicContact OD2-NZ 3.19Å; D592-K594 PolarHBondContact OD2-NZ 2.81Å
595	N	91.1	Very high	90.9	Very high	75 Å²	75	52.6 Å²	52.6	40%	0.401	25%	0.253	S	S	.	.			trans	-72.1	133.4	174.2	-57.8	-8	0	0	0	110.6	K598 D599 Y600	N595-K598 WeakPolarHBondContact CB-O 3.49Å; N595-K598 PolarHBondContact ND2-O 2.83Å; N595-D599 WeakPolarHBondContact ND2-CA 3.46Å; N595-Y600 CarbonylContact C-O 3.59Å; N595-Y600 WeakPolarHBondContact CA-O 2.95Å
596	V	91.1	Very high	91	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-83.9	-37.5	176.2	177.8	0	0	0	0	110.8	Y563 L565 L570 Y590 Y600 K601 L603	Y563-V596 WeakPolarHBondContact CE1-O 3.34Å; Y563-V596 PolarHBondContact OH-O 2.77Å; L565-V596 HydrophobicContact CD1-CG1 3.69Å; L565-V596 HydrophobicContact CD2-CG1 3.47Å; L565-V596 VanDerWaalsContact CD2-CG1 3.47Å; L565-V596 HydrophobicContact CG-CG1 4.23Å; L570-V596 HydrophobicContact CD1-CG1 4.49Å; L570-V596 HydrophobicContact CD1-CG2 4.3Å; Y590-V596 HydrophobicContact CD2-CG2 3.98Å; Y590-V596 HydrophobicContact CE2-CG2 4.26Å; V596-Y600 PolarHBondContact N-O 2.79Å; V596-K601 WeakPolarHBondContact CG2-O 3.23Å; V596-L603 HydrophobicContact CG1-CB 3.96Å
597	Y	88.4	Confident	90.9	Very high	29 Å²	29	52 Å²	52	11%	0.114	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-152.3	120.6	-179.6	172.8	-113.5	0	0	0	109.2	I531 W552 Y563 D599 Y600	I531-Y597 HydrophobicContact CB-CD1 4.25Å; I531-Y597 HydrophobicContact CB-CE1 3.98Å; I531-Y597 HydrophobicContact CD1-CE1 4.01Å; I531-Y597 HydrophobicContact CG2-CD1 3.69Å; I531-Y597 HydrophobicContact CG2-CE1 3.93Å; W552-Y597 HydrophobicContact CH2-CD2 4.2Å; W552-Y597 HydrophobicContact CH2-CG 4.27Å; W552-Y597 HydrophobicContact CZ2-CD1 4.43Å; W552-Y597 AromaticContact CZ2-CD2 3.94Å; W552-Y597 HydrophobicContact CZ2-CD2 3.94Å; W552-Y597 HydrophobicContact CZ2-CE2 4.13Å; W552-Y597 HydrophobicContact CZ2-CG 4.1Å; Y563-Y597 AromaticContact CD1-CD2 3.8Å; Y563-Y597 HydrophobicContact CD1-CD2 3.8Å; Y563-Y597 HydrophobicContact CD1-CE2 4.47Å; Y563-Y597 AromaticContact CD2-CD2 3.6Å; Y563-Y597 HydrophobicContact CD2-CD2 3.6Å; Y563-Y597 AromaticContact CD2-CE2 3.7Å; Y563-Y597 HydrophobicContact CD2-CE2 3.7Å; Y563-Y597 AromaticContact CE1-CD2 3.94Å; Y563-Y597 HydrophobicContact CE1-CD2 3.94Å; Y563-Y597 AromaticContact CE2-CD2 3.77Å; Y563-Y597 HydrophobicContact CE2-CD2 3.77Å; Y563-Y597 HydrophobicContact CE2-CE2 4.21Å; Y563-Y597 AromaticContact CG-CD2 3.6Å; Y563-Y597 HydrophobicContact CG-CD2 3.6Å; Y563-Y597 AromaticContact CG-CE2 3.84Å; Y563-Y597 HydrophobicContact CG-CE2 3.84Å; Y563-Y597 AromaticContact CZ-CD2 3.93Å; Y597-D599 PolarHBondContact O-N 3Å; Y597-D599 VanDerWaalsContact O-N 3.11Å; Y597-Y600 HydrophobicContact CD1-CD2 4.01Å; Y597-Y600 HydrophobicContact CD1-CE2 4.5Å; Y597-Y600 PolarHBondContact N-O 2.93Å; Y597-Y600 WeakPolarHBondContact O-CB 3.24Å; Y597-Y600 VanDerWaalsContact O-CD2 3.31Å; Y597-Y600 WeakPolarHBondContact O-CD2 3.24Å; Y597-Y600 PolarHBondContact O-N 3.4Å
598	K	87.1	Confident	90.5	Very high	136 Å²	136	60.1 Å²	60.1	59%	0.591	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	-113	-174.9	-58.1	-177.6	176.7	-174.5	0	111.8	N595	N595-K598 WeakPolarHBondContact CB-O 3.49Å; N595-K598 PolarHBondContact ND2-O 2.83Å
599	D	85.5	Confident	89.8	Confident	135 Å²	135	63.3 Å²	63.3	72%	0.722	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-1.9	-178.4	-46.1	-57.6	0	0	0	112.5	N595 Y597	N595-D599 WeakPolarHBondContact ND2-CA 3.46Å; Y597-D599 PolarHBondContact O-N 3Å; Y597-D599 VanDerWaalsContact O-N 3.11Å
600	Y	90.2	Very high	89.2	Confident	74 Å²	74	66.7 Å²	66.7	29%	0.29	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-89.7	119.2	-173.8	-56.2	-72.6	0	0	0	111.5	N530 I531 N595 V596 Y597 Q602	N530-Y600 WeakPolarHBondContact O-CD1 3.37Å; N530-Y600 WeakPolarHBondContact O-CE1 3.28Å; N530-Y600 VanDerWaalsContact O-CZ 3.26Å; I531-Y600 HydrophobicContact CB-CE2 4.14Å; I531-Y600 HydrophobicContact CG2-CD2 4.03Å; I531-Y600 HydrophobicContact CG2-CE2 4.15Å; N595-Y600 CarbonylContact C-O 3.59Å; N595-Y600 WeakPolarHBondContact CA-O 2.95Å; V596-Y600 PolarHBondContact N-O 2.79Å; Y597-Y600 HydrophobicContact CD1-CD2 4.01Å; Y597-Y600 HydrophobicContact CD1-CE2 4.5Å; Y597-Y600 PolarHBondContact N-O 2.93Å; Y597-Y600 WeakPolarHBondContact O-CB 3.24Å; Y597-Y600 VanDerWaalsContact O-CD2 3.31Å; Y597-Y600 WeakPolarHBondContact O-CD2 3.24Å; Y597-Y600 PolarHBondContact O-N 3.4Å; Y600-Q602 VanDerWaalsContact C-N 3.28Å; Y600-Q602 PolarHBondContact O-N 2.79Å
601	K	91	Very high	88.5	Confident	105 Å²	105	69.9 Å²	69.9	46%	0.457	36%	0.355	S	S	.	.	S	Bend	trans	-73.4	-13.9	178.7	-68.5	175.7	150.3	-146.9	0	115	N593 V596	N593-K601 WeakPolarHBondContact O-CE 3.36Å; N593-K601 VanDerWaalsContact OD1-CD 3.3Å; N593-K601 WeakPolarHBondContact OD1-CD 3.35Å; N593-K601 WeakPolarHBondContact OD1-CE 3.32Å; N593-K601 PolarHBondContact OD1-NZ 2.82Å; V596-K601 WeakPolarHBondContact CG2-O 3.23Å
602	Q	92.9	Very high	88.4	Confident	43 Å²	43	68.8 Å²	68.8	20%	0.201	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	154.1	173	72.2	-177.2	16.3	0	0	110.6	N530 A587 L588 F589 Y600 E604	N530-Q602 PolarHBondContact ND2-O 3Å; A587-Q602 HydrophobicContact CB-CB 4.22Å; A587-Q602 HydrophobicContact CB-CG 4.3Å; L588-Q602 CarbonylContact O-C 3.54Å; L588-Q602 WeakPolarHBondContact O-CA 3.35Å; F589-Q602 HydrophobicContact CB-CB 3.86Å; Y600-Q602 VanDerWaalsContact C-N 3.28Å; Y600-Q602 PolarHBondContact O-N 2.79Å; Q602-E604 HydrophobicContact CG-CG 4.31Å; Q602-E604 PolarHBondContact NE2-OE1 3.48Å
603	L	93.8	Very high	88.5	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	110.6	173.8	-171.2	74.1	0	0	0	108.8	I528 I531 F543 L550 W552 L565 A587 L588 V596 L605	I528-L603 HydrophobicContact CD1-CD1 4.39Å; I528-L603 HydrophobicContact CG2-CD1 3.54Å; I528-L603 HydrophobicContact CG2-CG 4.22Å; I531-L603 HydrophobicContact CG2-CD1 3.93Å; F543-L603 HydrophobicContact CE1-CD2 4.5Å; L550-L603 HydrophobicContact CD2-CD2 4.46Å; W552-L603 HydrophobicContact CE3-CD2 4.46Å; W552-L603 HydrophobicContact CH2-CD1 4.08Å; W552-L603 HydrophobicContact CH2-CD2 3.75Å; W552-L603 HydrophobicContact CZ2-CD1 4.31Å; W552-L603 HydrophobicContact CZ3-CD2 3.71Å; L565-L603 HydrophobicContact CD2-CD2 4.49Å; A587-L603 WeakPolarHBondContact CA-O 3.33Å; L588-L603 HydrophobicContact CB-CB 4.4Å; L588-L603 PolarHBondContact N-O 3.1Å; L588-L603 PolarHBondContact O-N 3.07Å; V596-L603 HydrophobicContact CG1-CB 3.96Å; L603-L605 HydrophobicContact CD2-CD1 4.36Å; L603-L605 HydrophobicContact CD2-CD2 4.15Å; L603-L605 HydrophobicContact CD2-CG 4.48Å; L603-L605 HydrophobicContact CG-CD2 4.14Å; L603-L605 HydrophobicContact CG-CG 4.38Å
604	E	93.9	Very high	88.4	Confident	36 Å²	36	61.6 Å²	61.6	17%	0.168	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	122	-176.5	-75.8	162	-127.8	0	0	111.8	I528 H529 N530 V575 A587 Q602	I528-E604 CarbonylContact C-O 3.58Å; I528-E604 WeakPolarHBondContact CA-O 3.31Å; H529-E604 HydrophobicContact CB-CB 4.03Å; H529-E604 PolarHBondContact N-O 2.86Å; N530-E604 HydrophobicContact CB-CB 4.34Å; N530-E604 WeakPolarHBondContact ND2-CG 3.35Å; N530-E604 PolarHBondContact ND2-N 2.95Å; N530-E604 PolarHBondContact ND2-OE1 3.24Å; N530-E604 PolarHBondContact OD1-N 2.86Å; V575-E604 HydrophobicContact CG2-CG 4.38Å; A587-E604 HydrophobicContact CB-CG 4.23Å; Q602-E604 HydrophobicContact CG-CG 4.31Å; Q602-E604 PolarHBondContact NE2-OE1 3.48Å
605	L	95.1	Very high	88.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	143.6	-169.2	-60.6	173.5	0	0	0	111.9	L526 T527 I528 F543 K585 F586 L588 L603 F620	L526-L605 HydrophobicContact CB-CD2 4.44Å; L526-L605 HydrophobicContact CD1-CD1 4.2Å; L526-L605 HydrophobicContact CD1-CD2 4.46Å; T527-L605 VanDerWaalsContact O-CA 3.32Å; T527-L605 WeakPolarHBondContact O-CA 3.45Å; I528-L605 HydrophobicContact CG1-CD2 3.87Å; F543-L605 HydrophobicContact CE1-CD2 4.24Å; F543-L605 HydrophobicContact CE2-CD2 4.21Å; F543-L605 HydrophobicContact CZ-CD2 3.63Å; K585-L605 WeakPolarHBondContact CA-O 3.4Å; F586-L605 HydrophobicContact CD1-CB 4.24Å; F586-L605 HydrophobicContact CD2-CB 4.49Å; F586-L605 HydrophobicContact CE1-CB 3.77Å; F586-L605 HydrophobicContact CE2-CB 4.04Å; F586-L605 HydrophobicContact CE2-CD1 3.74Å; F586-L605 HydrophobicContact CE2-CG 4.48Å; F586-L605 HydrophobicContact CZ-CB 3.66Å; F586-L605 HydrophobicContact CZ-CD1 3.83Å; F586-L605 HydrophobicContact CZ-CG 4.39Å; F586-L605 PolarHBondContact N-O 2.67Å; F586-L605 PolarHBondContact O-N 2.83Å; L588-L605 HydrophobicContact CD1-CD1 3.71Å; L588-L605 HydrophobicContact CG-CD1 3.98Å; L603-L605 HydrophobicContact CD2-CD1 4.36Å; L603-L605 HydrophobicContact CD2-CD2 4.15Å; L603-L605 HydrophobicContact CD2-CG 4.48Å; L603-L605 HydrophobicContact CG-CD2 4.14Å; L603-L605 HydrophobicContact CG-CG 4.38Å; L605-F620 HydrophobicContact CD1-CZ 4.44Å
606	S	93.1	Very high	88	Confident	6 Å²	6	52.6 Å²	52.6	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	159.9	165.3	66.3	0	0	0	0	111.9	L526 T527 H529 H584	L526-S606 WeakPolarHBondContact CA-O 3.34Å; L526-S606 VanDerWaalsContact CD2-O 3.26Å; L526-S606 WeakPolarHBondContact CD2-O 3.43Å; T527-S606 WeakPolarHBondContact CB-OG 3.26Å; T527-S606 PolarHBondContact N-O 3.14Å; T527-S606 PolarHBondContact O-N 3.21Å; T527-S606 VanDerWaalsContact O-N 3.1Å; H529-S606 PolarHBondContact NE2-OG 2.94Å; H584-S606 WeakPolarHBondContact O-CB 3.49Å
607	A	90.8	Very high	87.8	Confident	20 Å²	20	53.3 Å²	53.3	17%	0.165	27%	0.267	C	S	.	.			trans	-116.7	-179.8	170.5	0	0	0	0	0	110.8	L526 D612 V613	L526-A607 HydrophobicContact CD2-CB 3.85Å; A607-D612 HydrophobicContact CB-CB 3.47Å; A607-D612 VanDerWaalsContact CB-CB 3.47Å; A607-V613 HydrophobicContact CB-CG2 3.93Å
608	L	85.3	Confident	87.4	Confident	171 Å²	171	52.6 Å²	52.6	90%	0.895	27%	0.267	S	S	*	.	S	Bend	trans	-65.5	-38.6	-178.7	-69	169	0	0	0	113.2
609	T	81.6	Confident	87.3	Confident	67 Å²	67	46.4 Å²	46.4	41%	0.411	24%	0.241	S	C	.	.	S	Bend	trans	-124.9	163.1	-178.7	73.3	0	0	0	0	112.1	D611 D612 V613	T609-D611 VanDerWaalsContact C-N 3.3Å; T609-D611 PolarHBondContact OG1-N 3.17Å; T609-D612 PolarHBondContact O-N 3.41Å; T609-D612 PolarHBondContact OG1-N 3.11Å; T609-D612 PolarHBondContact OG1-OD2 3.11Å; T609-V613 PolarHBondContact O-N 3.11Å; T609-V613 VanDerWaalsContact O-N 3.09Å
610	L	82.5	Confident	87.3	Confident	83 Å²	83	40 Å²	40	44%	0.435	21%	0.206	S	C	.	.	H	α-helix	trans	-62.1	-38.8	171.3	178.4	59.1	0	0	0	111.5	H584 D612 V613 E614	H584-L610 HydrophobicContact CB-CD1 4.21Å; L610-D612 VanDerWaalsContact C-N 3.29Å; L610-D612 PolarHBondContact O-N 2.77Å; L610-V613 PolarHBondContact O-N 3.46Å; L610-E614 HydrophobicContact CD1-CG 4.33Å; L610-E614 WeakPolarHBondContact O-CG 3.45Å; L610-E614 PolarHBondContact O-N 2.92Å
611	D	77.4	Confident	86.8	Confident	103 Å²	103	36.9 Å²	36.9	55%	0.551	20%	0.195	S	C	*	.	H	α-helix	trans	-64.3	-34.1	177.1	-68.4	-18	0	0	0	112.2	T609 A615	T609-D611 VanDerWaalsContact C-N 3.3Å; T609-D611 PolarHBondContact OG1-N 3.17Å; D611-A615 WeakPolarHBondContact O-CB 3.46Å; D611-A615 PolarHBondContact O-N 2.94Å
612	D	84.4	Confident	85.9	Confident	43 Å²	43	39.1 Å²	39.1	23%	0.23	20%	0.2	C	C	.	.	H	α-helix	trans	-71.4	-39.6	173.4	-65.6	-49.3	0	0	0	112	R368 R522 A607 T609 L610 A615 W616	R368-D612 IonicContact NH2-OD1 3.18Å; R522-D612 IonicContact NH2-OD1 3.9Å; A607-D612 HydrophobicContact CB-CB 3.47Å; A607-D612 VanDerWaalsContact CB-CB 3.47Å; T609-D612 PolarHBondContact O-N 3.41Å; T609-D612 PolarHBondContact OG1-N 3.11Å; T609-D612 PolarHBondContact OG1-OD2 3.11Å; L610-D612 VanDerWaalsContact C-N 3.29Å; L610-D612 PolarHBondContact O-N 2.77Å; D612-A615 PolarHBondContact O-N 3.2Å; D612-W616 WeakPolarHBondContact O-CB 3.42Å; D612-W616 PolarHBondContact O-N 3.12Å
613	V	87.6	Confident	85.3	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-59.6	-46.8	172.7	167.4	0	0	0	0	110.5	H584 F586 A607 T609 L610 W616 K617	H584-V613 HydrophobicContact CB-CG2 4.43Å; F586-V613 HydrophobicContact CD1-CG1 3.95Å; F586-V613 HydrophobicContact CE1-CG1 4.42Å; A607-V613 HydrophobicContact CB-CG2 3.93Å; T609-V613 PolarHBondContact O-N 3.11Å; T609-V613 VanDerWaalsContact O-N 3.09Å; L610-V613 PolarHBondContact O-N 3.46Å; V613-W616 PolarHBondContact O-N 3.04Å; V613-K617 WeakPolarHBondContact O-CG 3.38Å; V613-K617 PolarHBondContact O-N 3.48Å
614	E	84.3	Confident	84.5	Confident	39 Å²	39	39.5 Å²	39.5	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-65.9	-40.4	177.3	-71.8	-75.3	109.3	0	0	112.3	R373 L610 W616 K617 A618	R373-E614 IonicContact CZ-OE2 3.13Å; R373-E614 IonicContact NH1-OE2 3.4Å; R373-E614 PolarHBondContact NH1-OE2 3.46Å; R373-E614 IonicContact NH2-OE2 2.7Å; L610-E614 HydrophobicContact CD1-CG 4.33Å; L610-E614 WeakPolarHBondContact O-CG 3.45Å; L610-E614 PolarHBondContact O-N 2.92Å; E614-W616 VanDerWaalsContact C-N 3.34Å; E614-W616 PolarHBondContact O-N 3.19Å; E614-K617 PolarHBondContact O-N 2.91Å; E614-K617 WeakPolarHBondContact OE1-CD 3.41Å; E614-K617 WeakPolarHBondContact OE1-CE 3.43Å; E614-K617 IonicContact OE1-NZ 2.63Å; E614-K617 PolarHBondContact OE1-NZ 3.32Å; E614-A618 WeakPolarHBondContact O-CB 3.18Å; E614-A618 PolarHBondContact O-N 2.79Å
615	A	82.7	Confident	84	Confident	6 Å²	6	37.8 Å²	37.8	5%	0.05	21%	0.206	C	C	.	.	H	α-helix	trans	-69.2	-30	175.8	0	0	0	0	0	113	D611 D612 S619	D611-A615 WeakPolarHBondContact O-CB 3.46Å; D611-A615 PolarHBondContact O-N 2.94Å; D612-A615 PolarHBondContact O-N 3.2Å; A615-S619 WeakPolarHBondContact O-CB 3.14Å; A615-S619 PolarHBondContact O-N 3.12Å; A615-S619 VanDerWaalsContact O-N 3.08Å; A615-S619 PolarHBondContact O-OG 2.95Å
616	W	89.9	Confident	83.3	Confident	6 Å²	6	42.5 Å²	42.5	2%	0.023	23%	0.225	C	C	.	.	H	α-helix	trans	-68.4	-47.6	168.4	-88.3	110.4	0	0	0	111.6	R522 L526 F543 L545 F586 D612 V613 E614 A618 S619 F620	R522-W616 HydrophobicContact CB-CE3 4.48Å; R522-W616 HydrophobicContact CB-CH2 4.43Å; R522-W616 HydrophobicContact CB-CZ3 4.14Å; R522-W616 HydrophobicContact CG-CD2 4.43Å; R522-W616 HydrophobicContact CG-CE3 4.31Å; R522-W616 HydrophobicContact CG-CH2 4.13Å; R522-W616 HydrophobicContact CG-CZ2 4.26Å; R522-W616 HydrophobicContact CG-CZ3 4.15Å; L526-W616 HydrophobicContact CD1-CD2 3.84Å; L526-W616 HydrophobicContact CD1-CE3 4.09Å; L526-W616 HydrophobicContact CD1-CG 4.3Å; L526-W616 HydrophobicContact CD1-CH2 4.29Å; L526-W616 HydrophobicContact CD1-CZ2 4.04Å; L526-W616 HydrophobicContact CD1-CZ3 4.31Å; L526-W616 HydrophobicContact CD2-CD2 4.23Å; L526-W616 HydrophobicContact CD2-CG 3.97Å; L526-W616 HydrophobicContact CG-CD2 4.2Å; L526-W616 HydrophobicContact CG-CG 4.45Å; L526-W616 HydrophobicContact CG-CZ2 4.02Å; F543-W616 HydrophobicContact CB-CH2 3.69Å; F543-W616 HydrophobicContact CB-CZ2 4.18Å; F543-W616 HydrophobicContact CB-CZ3 4.46Å; L545-W616 HydrophobicContact CB-CZ3 4.02Å; F586-W616 HydrophobicContact CE1-CB 4.46Å; F586-W616 HydrophobicContact CZ-CB 4.25Å; D612-W616 WeakPolarHBondContact O-CB 3.42Å; D612-W616 PolarHBondContact O-N 3.12Å; V613-W616 PolarHBondContact O-N 3.04Å; E614-W616 VanDerWaalsContact C-N 3.34Å; E614-W616 PolarHBondContact O-N 3.19Å; W616-A618 VanDerWaalsContact C-N 3.28Å; W616-A618 PolarHBondContact O-N 3.26Å; W616-S619 CarbonylContact O-C 3.52Å; W616-S619 WeakPolarHBondContact O-CA 3.39Å; W616-S619 WeakPolarHBondContact O-CB 3.38Å; W616-S619 PolarHBondContact O-N 3.36Å; W616-F620 AromaticContact CE3-CE2 3.93Å; W616-F620 HydrophobicContact CE3-CE2 3.93Å; W616-F620 WeakPolarHBondContact O-CD2 3.31Å; W616-F620 PolarHBondContact O-N 2.92Å
617	K	87.3	Confident	82.8	Confident	16 Å²	16	45.1 Å²	45.1	7%	0.07	24%	0.242	C	C	.	.	H	α-helix	trans	-55.1	-43.2	172.1	-69.5	175.5	-171.1	176.2	0	111.9	L572 D574 V613 E614 S619 F620 L621	L572-K617 HydrophobicContact CD1-CG 4.44Å; D574-K617 WeakPolarHBondContact OD1-CE 3.36Å; D574-K617 IonicContact OD1-NZ 2.69Å; D574-K617 PolarHBondContact OD1-NZ 3Å; D574-K617 IonicContact OD2-NZ 2.81Å; D574-K617 PolarHBondContact OD2-NZ 2.92Å; V613-K617 WeakPolarHBondContact O-CG 3.38Å; V613-K617 PolarHBondContact O-N 3.48Å; E614-K617 PolarHBondContact O-N 2.91Å; E614-K617 WeakPolarHBondContact OE1-CD 3.41Å; E614-K617 WeakPolarHBondContact OE1-CE 3.43Å; E614-K617 IonicContact OE1-NZ 2.63Å; E614-K617 PolarHBondContact OE1-NZ 3.32Å; K617-S619 PolarHBondContact O-N 2.9Å; K617-F620 PolarHBondContact O-N 3.31Å; K617-L621 PolarHBondContact O-N 2.93Å
618	A	78.1	Confident	82.2	Confident	13 Å²	13	47.8 Å²	47.8	11%	0.107	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-33.3	175.4	0	0	0	0	0	113.2	F376 E614 W616 R622	F376-A618 HydrophobicContact CB-CB 3.86Å; F376-A618 HydrophobicContact CD2-CB 3.4Å; F376-A618 HydrophobicContact CE2-CB 4.17Å; F376-A618 HydrophobicContact CG-CB 3.9Å; E614-A618 WeakPolarHBondContact O-CB 3.18Å; E614-A618 PolarHBondContact O-N 2.79Å; W616-A618 VanDerWaalsContact C-N 3.28Å; W616-A618 PolarHBondContact O-N 3.26Å; A618-R622 WeakPolarHBondContact O-CG 3.39Å; A618-R622 PolarHBondContact O-N 2.92Å; A618-R622 VanDerWaalsContact O-N 3.12Å
619	S	85.1	Confident	81.3	Confident	6 Å²	6	45.7 Å²	45.7	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-76.5	-38.9	176.4	-58.1	0	0	0	0	111.7	I521 R522 L545 A615 W616 K617 L621 R622 A623	I521-S619 WeakPolarHBondContact CG2-O 3.36Å; R522-S619 WeakPolarHBondContact CD-OG 3.38Å; L545-S619 VanDerWaalsContact CD2-C 3.43Å; L545-S619 WeakPolarHBondContact CD2-O 3.33Å; A615-S619 WeakPolarHBondContact O-CB 3.14Å; A615-S619 PolarHBondContact O-N 3.12Å; A615-S619 VanDerWaalsContact O-N 3.08Å; A615-S619 PolarHBondContact O-OG 2.95Å; W616-S619 CarbonylContact O-C 3.52Å; W616-S619 WeakPolarHBondContact O-CA 3.39Å; W616-S619 WeakPolarHBondContact O-CB 3.38Å; W616-S619 PolarHBondContact O-N 3.36Å; K617-S619 PolarHBondContact O-N 2.9Å; S619-L621 VanDerWaalsContact C-N 3.35Å; S619-L621 PolarHBondContact O-N 3.44Å; S619-R622 WeakPolarHBondContact O-CB 3.48Å; S619-R622 PolarHBondContact O-N 3.36Å; S619-A623 PolarHBondContact O-N 3.1Å; S619-A623 VanDerWaalsContact O-N 3.08Å
620	F	86.4	Confident	79.9	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-41.8	171.1	-81.8	-67.2	0	0	0	112.2	L545 L550 L572 F586 L588 L605 W616 K617 A623 G624 V625	L545-F620 HydrophobicContact CD1-CD1 3.98Å; L545-F620 HydrophobicContact CD1-CE1 3.79Å; L545-F620 HydrophobicContact CD2-CD1 4.07Å; L545-F620 HydrophobicContact CD2-CE1 4.27Å; L545-F620 HydrophobicContact CD2-CG 4.27Å; L550-F620 HydrophobicContact CB-CE1 4.49Å; L550-F620 HydrophobicContact CD1-CE1 3.86Å; L550-F620 HydrophobicContact CD1-CZ 3.65Å; L550-F620 HydrophobicContact CD2-CE1 3.88Å; L550-F620 HydrophobicContact CD2-CZ 3.71Å; L550-F620 HydrophobicContact CG-CE1 4.3Å; L550-F620 HydrophobicContact CG-CZ 4.28Å; L572-F620 HydrophobicContact CD2-CB 3.79Å; F586-F620 AromaticContact CE2-CD2 3.84Å; F586-F620 HydrophobicContact CE2-CD2 3.84Å; F586-F620 AromaticContact CE2-CE2 3.62Å; F586-F620 HydrophobicContact CE2-CE2 3.62Å; F586-F620 HydrophobicContact CE2-CZ 4.48Å; F586-F620 HydrophobicContact CZ-CD2 4.19Å; F586-F620 AromaticContact CZ-CE2 3.77Å; F586-F620 HydrophobicContact CZ-CE2 3.77Å; L588-F620 HydrophobicContact CD1-CD1 4.45Å; L588-F620 HydrophobicContact CD1-CE1 3.65Å; L588-F620 HydrophobicContact CD1-CE2 4.5Å; L588-F620 HydrophobicContact CD1-CZ 3.7Å; L588-F620 HydrophobicContact CD2-CD1 4.27Å; L588-F620 HydrophobicContact CD2-CE1 4.24Å; L588-F620 HydrophobicContact CD2-CG 4.48Å; L588-F620 HydrophobicContact CD2-CZ 4.45Å; L605-F620 HydrophobicContact CD1-CZ 4.44Å; W616-F620 AromaticContact CE3-CE2 3.93Å; W616-F620 HydrophobicContact CE3-CE2 3.93Å; W616-F620 WeakPolarHBondContact O-CD2 3.31Å; W616-F620 PolarHBondContact O-N 2.92Å; K617-F620 PolarHBondContact O-N 3.31Å; F620-A623 CarbonylContact O-C 3.46Å; F620-A623 VanDerWaalsContact O-C 3.32Å; F620-A623 WeakPolarHBondContact O-CA 3.47Å; F620-A623 WeakPolarHBondContact O-CB 3.25Å; F620-A623 PolarHBondContact O-N 2.94Å; F620-G624 PolarHBondContact O-N 3.14Å; F620-V625 CarbonylContact C-O 3.4Å; F620-V625 HydrophobicContact CB-CB 4.07Å; F620-V625 HydrophobicContact CB-CG1 4.42Å; F620-V625 HydrophobicContact CD1-CB 4.19Å; F620-V625 HydrophobicContact CD1-CG1 4.37Å; F620-V625 HydrophobicContact CD1-CG2 4.23Å; F620-V625 PolarHBondContact O-N 3.16Å
621	L	80	Confident	78	Confident	10 Å²	10	52.4 Å²	52.4	5%	0.052	27%	0.269	C	S	.	.	H	α-helix	trans	-59.8	-44.6	171.5	-80.5	165.7	0	0	0	112.6	F376 V379 K617 S619 A623 G624 Y626	F376-L621 HydrophobicContact CD2-CD1 3.78Å; F376-L621 HydrophobicContact CE2-CD1 3.57Å; V379-L621 HydrophobicContact CG1-CB 3.89Å; V379-L621 HydrophobicContact CG1-CD2 4.31Å; V379-L621 HydrophobicContact CG1-CG 4.48Å; K617-L621 PolarHBondContact O-N 2.93Å; S619-L621 VanDerWaalsContact C-N 3.35Å; S619-L621 PolarHBondContact O-N 3.44Å; L621-A623 PolarHBondContact O-N 2.9Å; L621-A623 VanDerWaalsContact O-N 3.16Å; L621-G624 PolarHBondContact O-N 3.36Å; L621-Y626 HydrophobicContact CD2-CD1 3.42Å; L621-Y626 VanDerWaalsContact CD2-CD1 3.42Å; L621-Y626 HydrophobicContact CD2-CE1 3.88Å; L621-Y626 HydrophobicContact CD2-CG 4.25Å
622	R	72.7	Confident	76.3	Confident	152 Å²	152	56.4 Å²	56.4	57%	0.574	28%	0.276	S	S	*	.	H	α-helix	trans	-60.6	-20.5	172.3	-76.3	175.4	60.8	-141.1	-6	113.5	I521 A618 S619	I521-R622 HydrophobicContact CG2-CB 3.9Å; I521-R622 PolarHBondContact O-NH1 3.04Å; I521-R622 VanDerWaalsContact O-NH1 3.11Å; A618-R622 WeakPolarHBondContact O-CG 3.39Å; A618-R622 PolarHBondContact O-N 2.92Å; A618-R622 VanDerWaalsContact O-N 3.12Å; S619-R622 WeakPolarHBondContact O-CB 3.48Å; S619-R622 PolarHBondContact O-N 3.36Å
623	A	80	Confident	74.2	Confident	11 Å²	11	63.5 Å²	63.5	9%	0.091	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	12.8	176.2	0	0	0	0	0	113.3	I521 L545 L567 S619 F620 L621 V625	I521-A623 HydrophobicContact CD1-CB 3.62Å; L545-A623 HydrophobicContact CD1-CB 3.89Å; L545-A623 HydrophobicContact CD2-CB 4.13Å; L545-A623 HydrophobicContact CG-CB 4.14Å; L567-A623 HydrophobicContact CD1-CB 3.56Å; S619-A623 PolarHBondContact O-N 3.1Å; S619-A623 VanDerWaalsContact O-N 3.08Å; F620-A623 CarbonylContact O-C 3.46Å; F620-A623 VanDerWaalsContact O-C 3.32Å; F620-A623 WeakPolarHBondContact O-CA 3.47Å; F620-A623 WeakPolarHBondContact O-CB 3.25Å; F620-A623 PolarHBondContact O-N 2.94Å; L621-A623 PolarHBondContact O-N 2.9Å; L621-A623 VanDerWaalsContact O-N 3.16Å; A623-V625 VanDerWaalsContact C-N 3.33Å; A623-V625 PolarHBondContact O-N 3.34Å
624	G	75.7	Confident	72	Confident	39 Å²	39	69.9 Å²	69.9	40%	0.402	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	10	177.5	0	0	0	0	0	115.7	F620 L621 Y626	F620-G624 PolarHBondContact O-N 3.14Å; L621-G624 PolarHBondContact O-N 3.36Å; G624-Y626 WeakPolarHBondContact O-CD2 3.14Å; G624-Y626 VanDerWaalsContact O-CE2 3.23Å; G624-Y626 WeakPolarHBondContact O-CE2 3.36Å
625	V	84.1	Confident	69.9	Low	0 Å²	0	74.2 Å²	74.2	0%	0	36%	0.362	C	S	.	.			trans	-93.6	107.3	175.7	179.9	0	0	0	0	109.4	L567 L570 L572 L588 F620 A623	L567-V625 HydrophobicContact CB-CG2 3.82Å; L567-V625 HydrophobicContact CD1-CG2 4.24Å; L567-V625 HydrophobicContact CD2-CG2 3.95Å; L567-V625 HydrophobicContact CG-CG2 4.2Å; L570-V625 HydrophobicContact CB-CG2 4.36Å; L570-V625 HydrophobicContact CD2-CG1 4.45Å; L570-V625 HydrophobicContact CD2-CG2 4.32Å; L570-V625 HydrophobicContact CG-CG1 4.48Å; L572-V625 HydrophobicContact CB-CG1 4.21Å; L572-V625 HydrophobicContact CD2-CG1 4.39Å; L588-V625 HydrophobicContact CD2-CG1 4.14Å; F620-V625 CarbonylContact C-O 3.4Å; F620-V625 HydrophobicContact CB-CB 4.07Å; F620-V625 HydrophobicContact CB-CG1 4.42Å; F620-V625 HydrophobicContact CD1-CB 4.19Å; F620-V625 HydrophobicContact CD1-CG1 4.37Å; F620-V625 HydrophobicContact CD1-CG2 4.23Å; F620-V625 PolarHBondContact O-N 3.16Å; A623-V625 VanDerWaalsContact C-N 3.33Å; A623-V625 PolarHBondContact O-N 3.34Å
626	Y	80.6	Confident	67.6	Low	99 Å²	99	83.2 Å²	83.2	39%	0.388	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	154.7	-172.3	-65	-85.1	0	0	0	113.4	E382 K571 L572 L621 G624	E382-Y626 WeakPolarHBondContact OE2-CE1 3.4Å; E382-Y626 PolarHBondContact OE2-OH 2.89Å; K571-Y626 WeakPolarHBondContact CA-O 3.47Å; K571-Y626 WeakPolarHBondContact CB-O 3.18Å; L572-Y626 PolarHBondContact N-O 3.29Å; L621-Y626 HydrophobicContact CD2-CD1 3.42Å; L621-Y626 VanDerWaalsContact CD2-CD1 3.42Å; L621-Y626 HydrophobicContact CD2-CE1 3.88Å; L621-Y626 HydrophobicContact CD2-CG 4.25Å; G624-Y626 WeakPolarHBondContact O-CD2 3.14Å; G624-Y626 VanDerWaalsContact O-CE2 3.23Å; G624-Y626 WeakPolarHBondContact O-CE2 3.36Å
627	P	81.5	Confident	65.1	Low	62 Å²	62	88.2 Å²	88.2	40%	0.403	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	141.9	171.4	-27.9	33.9	0	0	0	114.3	L572 K629	L572-P627 HydrophobicContact CD1-CB 4.3Å; L572-P627 HydrophobicContact CD1-CG 4.06Å; L572-P627 HydrophobicContact CG-CG 4.47Å; L572-P627 CarbonylContact O-C 3.55Å; L572-P627 VanDerWaalsContact O-CA 3.24Å; L572-P627 WeakPolarHBondContact O-CA 3.46Å; P627-K629 PolarHBondContact O-N 2.83Å
628	E	78.8	Confident	62.8	Low	76 Å²	76	91 Å²	91	36%	0.355	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-59.1	131.7	156.9	-173.4	155	-120.3	0	0	109.2	L572 R573 F589	L572-E628 PolarHBondContact O-N 3.29Å; R573-E628 HydrophobicContact CB-CB 3.99Å; R573-E628 WeakPolarHBondContact CD-OE2 3.3Å; R573-E628 IonicContact CZ-OE2 2.67Å; R573-E628 IonicContact NE-OE2 3.76Å; R573-E628 IonicContact NH1-OE2 3.18Å; R573-E628 PolarHBondContact NH1-OE2 3.34Å; F589-E628 HydrophobicContact CE1-CB 4.02Å; F589-E628 WeakPolarHBondContact CE2-OE1 3.26Å; F589-E628 HydrophobicContact CZ-CB 3.79Å; F589-E628 HydrophobicContact CZ-CG 3.98Å; F589-E628 WeakPolarHBondContact CZ-OE1 3.33Å; F589-E628 WeakPolarHBondContact CZ-OE2 3.29Å
629	K	66.3	Low	60.8	Low	126 Å²	126	100.2 Å²	100.2	55%	0.548	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-86.8	119.7	172.5	-58.2	-164.4	178.9	-160.2	0	107.1	P627	P627-K629 PolarHBondContact O-N 2.83Å
630	Q	52.2	Low	58.6	Low	178 Å²	178	106.5 Å²	106.5	83%	0.832	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-53.6	126.4	161.7	-71.3	176.3	-24.8	0	0	107.4	R632	Q630-R632 PolarHBondContact O-N 3.45Å
631	P	44.1	Very low	56.4	Low	113 Å²	113	109.7 Å²	109.7	73%	0.734	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-63.5	125.3	176.8	26.2	-32.7	0	0	0	108.4	Q633	P631-Q633 PolarHBondContact O-N 2.77Å
632	R	40.8	Very low	54.5	Low	187 Å²	187	115.9 Å²	115.9	71%	0.706	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-65.5	128	165.9	-72.7	175.5	170.1	172.5	-6.1	107	Q630 D634 E635	Q630-R632 PolarHBondContact O-N 3.45Å; R632-D634 PolarHBondContact O-N 3.13Å; R632-D634 VanDerWaalsContact O-N 3.08Å; R632-E635 HydrophobicContact CB-CG 4.36Å; R632-E635 PolarHBondContact O-N 2.7Å
633	Q	40.4	Very low	53.1	Low	193 Å²	193	113.4 Å²	113.4	90%	0.902	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-11.3	-177.4	-72.3	-179.1	-37.8	0	0	112.9	P631	P631-Q633 PolarHBondContact O-N 2.77Å
634	D	40.3	Very low	51.7	Low	136 Å²	136	115.9 Å²	115.9	73%	0.727	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	7.5	177.1	-43.2	-64.7	0	0	0	114.3	R632 E636	R632-D634 PolarHBondContact O-N 3.13Å; R632-D634 VanDerWaalsContact O-N 3.08Å; D634-E636 PolarHBondContact O-N 3.32Å
635	E	41.1	Very low	51.3	Low	129 Å²	129	118.2 Å²	118.2	60%	0.603	62%	0.616	S	S	*	*			trans	-83.4	25.9	178.7	-79.5	-175.3	-147.3	0	0	114.8	R632 V637	R632-E635 HydrophobicContact CB-CG 4.36Å; R632-E635 PolarHBondContact O-N 2.7Å; E635-V637 PolarHBondContact O-N 3.1Å; E635-V637 VanDerWaalsContact O-N 3.15Å
636	E	34.3	Very low	51	Low	196 Å²	196	121.9 Å²	121.9	92%	0.916	64%	0.64	S	S	*	*			trans	-79.8	42.2	156.8	-71.3	-160.9	158.9	0	0	112.1	D634 A638	D634-E636 PolarHBondContact O-N 3.32Å; E636-A638 PolarHBondContact O-N 2.93Å
637	V	38.4	Very low	50.9	Low	111 Å²	111	122.3 Å²	122.3	67%	0.673	65%	0.646	S	S	*	*			trans	-98.9	85.7	174.1	-176.3	0	0	0	0	109.8	E635	E635-V637 PolarHBondContact O-N 3.1Å; E635-V637 VanDerWaalsContact O-N 3.15Å
638	A	38	Very low	50.9	Low	75 Å²	75	120 Å²	120	62%	0.62	63%	0.63	S	S	*	*			trans	36.8	119.6	159.5	0	0	0	0	0	118.9	E636 E640	E636-A638 PolarHBondContact O-N 2.93Å; A638-E640 HydrophobicContact CB-CG 4.16Å; A638-E640 PolarHBondContact O-N 2.87Å
639	E	35.4	Very low	51.1	Low	205 Å²	205	121.6 Å²	121.6	96%	0.958	64%	0.637	S	S	*	*			trans	-71	64	161.4	-62.4	-167.8	124.9	0	0	111.7	S641	E639-S641 PolarHBondContact O-N 2.94Å
640	E	38.9	Very low	51.9	Low	138 Å²	138	123.3 Å²	123.3	65%	0.645	64%	0.64	S	S	*	*			trans	-67.3	97	175.3	-82.5	-157.7	142.8	0	0	111.8	A638	A638-E640 HydrophobicContact CB-CG 4.16Å; A638-E640 PolarHBondContact O-N 2.87Å
641	S	40.4	Very low	53.5	Low	68 Å²	68	116.4 Å²	116.4	48%	0.476	61%	0.608	S	S	.	*			trans	64.1	92.7	163.9	64.4	0	0	0	0	116	E639 S643	E639-S641 PolarHBondContact O-N 2.94Å; S641-S643 PolarHBondContact O-N 3.01Å
642	S	41	Very low	55.6	Low	140 Å²	140	111.5 Å²	111.5	98%	0.979	58%	0.576	S	S	*	*	S	Bend	trans	-69.3	40.6	164.9	46.1	0	0	0	0	113.7
643	S	43	Very low	57.8	Low	100 Å²	100	104.6 Å²	104.6	70%	0.699	55%	0.552	S	S	*	*			trans	-145.5	71.7	-178.3	175.5	0	0	0	0	109.5	S641	S641-S643 PolarHBondContact O-N 3.01Å
644	M	50.4	Low	60	Low	62 Å²	62	95.8 Å²	95.8	31%	0.305	51%	0.511	S	S	.	.			trans	-66.4	143.3	168.4	-63	-110	86.3	0	0	109.6	L648 E649	M644-L648 HydrophobicContact CE-CD2 3.67Å; M644-L648 HydrophobicContact SD-CD2 4.47Å; M644-E649 HydrophobicContact CB-CG 3.47Å; M644-E649 VanDerWaalsContact CB-CG 3.47Å; M644-E649 HydrophobicContact CG-CG 4.17Å
645	D	68.1	Low	62.3	Low	89 Å²	89	89.4 Å²	89.4	48%	0.476	48%	0.477	S	S	.	.			trans	-65.2	126.8	165.9	170.3	4.8	0	0	0	109.1	Q647 L648 E649	D645-Q647 PolarHBondContact O-N 3.46Å; D645-Q647 VanDerWaalsContact O-N 3.07Å; D645-Q647 WeakPolarHBondContact OD1-CB 3.26Å; D645-Q647 PolarHBondContact OD1-N 3.11Å; D645-L648 HydrophobicContact CB-CB 4Å; D645-L648 WeakPolarHBondContact O-CA 3.47Å; D645-L648 WeakPolarHBondContact O-CB 3.38Å; D645-L648 PolarHBondContact O-N 2.67Å; D645-E649 PolarHBondContact O-N 2.89Å
646	P	76.4	Confident	64.6	Low	77 Å²	77	84.2 Å²	84.2	50%	0.5	45%	0.452	S	S	.	.	H	α-helix	trans	-55.5	-23.2	176.3	-27.2	35.8	0	0	0	114.7	R650	P646-R650 VanDerWaalsContact O-CG 3.32Å; P646-R650 WeakPolarHBondContact O-CG 3.39Å; P646-R650 PolarHBondContact O-N 2.93Å
647	Q	78.6	Confident	67.2	Low	108 Å²	108	75 Å²	75	51%	0.505	41%	0.409	S	S	.	.	H	α-helix	trans	-73.1	-41.9	170.7	-178	171.9	-37	0	0	111.6	D645 R650 Q651	D645-Q647 PolarHBondContact O-N 3.46Å; D645-Q647 VanDerWaalsContact O-N 3.07Å; D645-Q647 WeakPolarHBondContact OD1-CB 3.26Å; D645-Q647 PolarHBondContact OD1-N 3.11Å; Q647-R650 PolarHBondContact O-N 2.87Å; Q647-Q651 WeakPolarHBondContact O-CG 3.3Å; Q647-Q651 PolarHBondContact O-N 2.84Å
648	L	83.1	Confident	69.7	Low	14 Å²	14	70.2 Å²	70.2	7%	0.073	38%	0.379	C	S	.	.	H	α-helix	trans	-64.8	-40.9	175.4	179.6	59.3	0	0	0	111.6	I396 M644 D645 R650 Q651 V652	I396-L648 HydrophobicContact CB-CD1 3.99Å; I396-L648 HydrophobicContact CD1-CD1 3.75Å; I396-L648 HydrophobicContact CG2-CD1 3.59Å; M644-L648 HydrophobicContact CE-CD2 3.67Å; M644-L648 HydrophobicContact SD-CD2 4.47Å; D645-L648 HydrophobicContact CB-CB 4Å; D645-L648 WeakPolarHBondContact O-CA 3.47Å; D645-L648 WeakPolarHBondContact O-CB 3.38Å; D645-L648 PolarHBondContact O-N 2.67Å; L648-R650 VanDerWaalsContact C-N 3.35Å; L648-R650 PolarHBondContact O-N 2.91Å; L648-Q651 PolarHBondContact O-N 3.35Å; L648-V652 HydrophobicContact CD1-CG2 4.17Å; L648-V652 HydrophobicContact CG-CG2 4.38Å; L648-V652 WeakPolarHBondContact O-CB 3.48Å; L648-V652 VanDerWaalsContact O-CG2 3.26Å; L648-V652 WeakPolarHBondContact O-CG2 3.44Å; L648-V652 PolarHBondContact O-N 3.47Å
649	E	83	Confident	72.2	Confident	109 Å²	109	66.8 Å²	66.8	51%	0.509	35%	0.351	S	S	.	.	H	α-helix	trans	-59.5	-43.6	176.2	-64.6	-167.5	140.8	0	0	112.3	M644 D645 V652 E653	M644-E649 HydrophobicContact CB-CG 3.47Å; M644-E649 VanDerWaalsContact CB-CG 3.47Å; M644-E649 HydrophobicContact CG-CG 4.17Å; D645-E649 PolarHBondContact O-N 2.89Å; E649-V652 PolarHBondContact O-N 3.08Å; E649-E653 PolarHBondContact O-N 3.34Å
650	R	82.4	Confident	74.8	Confident	161 Å²	161	58.5 Å²	58.5	61%	0.608	31%	0.313	S	S	*	.	H	α-helix	trans	-64.4	-41.2	175.5	-69.2	174.3	-161.7	175.5	6.4	112.2	P646 Q647 L648 T654	P646-R650 VanDerWaalsContact O-CG 3.32Å; P646-R650 WeakPolarHBondContact O-CG 3.39Å; P646-R650 PolarHBondContact O-N 2.93Å; Q647-R650 PolarHBondContact O-N 2.87Å; L648-R650 VanDerWaalsContact C-N 3.35Å; L648-R650 PolarHBondContact O-N 2.91Å; R650-T654 VanDerWaalsContact O-CB 3.26Å; R650-T654 WeakPolarHBondContact O-CB 3.13Å; R650-T654 PolarHBondContact O-N 2.9Å; R650-T654 PolarHBondContact O-OG1 2.68Å
651	Q	84.8	Confident	77.1	Confident	34 Å²	34	52.2 Å²	52.2	16%	0.159	28%	0.284	C	S	.	.	H	α-helix	trans	-62.4	-43.9	174.9	-73.4	177.3	-12.3	0	0	111.2	I396 Q647 L648 T654 I655	I396-Q651 HydrophobicContact CD1-CB 3.98Å; Q647-Q651 WeakPolarHBondContact O-CG 3.3Å; Q647-Q651 PolarHBondContact O-N 2.84Å; L648-Q651 PolarHBondContact O-N 3.35Å; Q651-T654 PolarHBondContact O-N 3.25Å; Q651-I655 WeakPolarHBondContact O-CG1 3.42Å; Q651-I655 PolarHBondContact O-N 3.03Å
652	V	88.5	Confident	79.7	Confident	9 Å²	9	49.3 Å²	49.3	6%	0.055	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-49.6	177.4	168.3	0	0	0	0	111.5	R389 I392 A393 I396 L648 E649 I655 R656	R389-V652 HydrophobicContact CB-CG1 3.7Å; R389-V652 HydrophobicContact CG-CG1 3.72Å; I392-V652 HydrophobicContact CB-CG1 4.35Å; I392-V652 HydrophobicContact CG2-CB 4.22Å; I392-V652 HydrophobicContact CG2-CG1 4.2Å; I392-V652 HydrophobicContact CG2-CG2 4.07Å; A393-V652 HydrophobicContact CB-CG2 3.89Å; I396-V652 HydrophobicContact CD1-CG2 3.72Å; L648-V652 HydrophobicContact CD1-CG2 4.17Å; L648-V652 HydrophobicContact CG-CG2 4.38Å; L648-V652 WeakPolarHBondContact O-CB 3.48Å; L648-V652 VanDerWaalsContact O-CG2 3.26Å; L648-V652 WeakPolarHBondContact O-CG2 3.44Å; L648-V652 PolarHBondContact O-N 3.47Å; E649-V652 PolarHBondContact O-N 3.08Å; V652-I655 PolarHBondContact O-N 2.68Å; V652-R656 WeakPolarHBondContact O-CB 3.49Å; V652-R656 PolarHBondContact O-N 2.97Å
653	E	86.6	Confident	82.1	Confident	43 Å²	43	43.8 Å²	43.8	20%	0.201	22%	0.222	C	C	.	.	H	α-helix	trans	-72.1	-31.7	179.8	-173.4	55.9	-134.1	0	0	112.4	R389 A507 E649 R656 N657	R389-E653 IonicContact CZ-OE2 3.41Å; R389-E653 IonicContact NE-OE2 3.72Å; R389-E653 PolarHBondContact NE-OE2 2.91Å; R389-E653 IonicContact NH2-OE1 3.6Å; R389-E653 IonicContact NH2-OE2 3.77Å; R389-E653 PolarHBondContact NH2-OE2 2.84Å; A507-E653 HydrophobicContact CB-CB 4.09Å; A507-E653 HydrophobicContact CB-CG 3.99Å; E649-E653 PolarHBondContact O-N 3.34Å; E653-R656 PolarHBondContact O-N 3.46Å; E653-R656 WeakPolarHBondContact OE1-CD 3.19Å; E653-R656 IonicContact OE1-CZ 2.91Å; E653-R656 IonicContact OE1-NE 3.32Å; E653-R656 PolarHBondContact OE1-NE 3.23Å; E653-R656 IonicContact OE2-NE 2.7Å; E653-N657 PolarHBondContact O-N 2.6Å; E653-N657 PolarHBondContact O-ND2 2.97Å; E653-N657 PolarHBondContact OE1-ND2 2.84Å
654	T	86.9	Confident	84.4	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.043	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-49.8	172.6	-60.1	0	0	0	0	110.6	F500 A503 E504 A507 R650 Q651 R656 N657 L658	F500-T654 HydrophobicContact CD2-CG2 4.3Å; F500-T654 HydrophobicContact CE2-CG2 3.79Å; F500-T654 HydrophobicContact CZ-CG2 4.17Å; A503-T654 HydrophobicContact CB-CG2 4.04Å; E504-T654 HydrophobicContact CB-CG2 4.17Å; A507-T654 WeakPolarHBondContact CB-OG1 3.36Å; R650-T654 VanDerWaalsContact O-CB 3.26Å; R650-T654 WeakPolarHBondContact O-CB 3.13Å; R650-T654 PolarHBondContact O-N 2.9Å; R650-T654 PolarHBondContact O-OG1 2.68Å; Q651-T654 PolarHBondContact O-N 3.25Å; T654-R656 PolarHBondContact O-N 3.1Å; T654-N657 PolarHBondContact O-N 3.49Å; T654-L658 HydrophobicContact CG2-CD1 4.36Å; T654-L658 WeakPolarHBondContact O-CG 3.31Å; T654-L658 PolarHBondContact O-N 3Å
655	I	89.9	Confident	86.4	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-42	175.6	-69.8	160.7	0	0	0	110.8	I392 I396 A412 F413 Q651 V652 N657 L658 V659	I392-I655 HydrophobicContact CD1-CG2 4.09Å; I392-I655 HydrophobicContact CG1-CG2 4.03Å; I392-I655 HydrophobicContact CG2-CB 3.85Å; I392-I655 HydrophobicContact CG2-CD1 4.02Å; I392-I655 HydrophobicContact CG2-CG2 3.78Å; I396-I655 HydrophobicContact CD1-CD1 3.84Å; I396-I655 HydrophobicContact CG1-CD1 3.89Å; A412-I655 HydrophobicContact CB-CD1 3.67Å; F413-I655 HydrophobicContact CB-CG2 4.27Å; Q651-I655 WeakPolarHBondContact O-CG1 3.42Å; Q651-I655 PolarHBondContact O-N 3.03Å; V652-I655 PolarHBondContact O-N 2.68Å; I655-N657 VanDerWaalsContact C-N 3.26Å; I655-N657 PolarHBondContact O-N 2.68Å; I655-L658 PolarHBondContact O-N 3.01Å; I655-L658 VanDerWaalsContact O-N 3.09Å; I655-V659 HydrophobicContact CG2-CG2 4.05Å; I655-V659 VanDerWaalsContact O-CG2 3.29Å; I655-V659 WeakPolarHBondContact O-CG2 3.08Å; I655-V659 PolarHBondContact O-N 2.92Å
656	R	89.5	Confident	87.7	Confident	21 Å²	21	39 Å²	39	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-58.1	-38.7	176.3	-168.4	-129.9	73.3	80.5	8.9	112.2	E385 L388 I392 V652 E653 T654 V659 D660	E385-R656 WeakPolarHBondContact OE1-CD 3.37Å; E385-R656 IonicContact OE1-CZ 3.21Å; E385-R656 IonicContact OE1-NE 3.83Å; E385-R656 IonicContact OE1-NH1 2.69Å; E385-R656 PolarHBondContact OE1-NH1 3.15Å; E385-R656 WeakPolarHBondContact OE2-CD 3.38Å; E385-R656 IonicContact OE2-NH1 2.66Å; L388-R656 HydrophobicContact CD2-CG 3.97Å; L388-R656 HydrophobicContact CG-CG 4.42Å; I392-R656 HydrophobicContact CD1-CB 3.87Å; I392-R656 HydrophobicContact CD1-CG 4.39Å; V652-R656 WeakPolarHBondContact O-CB 3.49Å; V652-R656 PolarHBondContact O-N 2.97Å; E653-R656 PolarHBondContact O-N 3.46Å; E653-R656 WeakPolarHBondContact OE1-CD 3.19Å; E653-R656 IonicContact OE1-CZ 2.91Å; E653-R656 IonicContact OE1-NE 3.32Å; E653-R656 PolarHBondContact OE1-NE 3.23Å; E653-R656 IonicContact OE2-NE 2.7Å; T654-R656 PolarHBondContact O-N 3.1Å; R656-V659 PolarHBondContact O-N 2.91Å; R656-D660 IonicContact CZ-OD2 2.73Å; R656-D660 IonicContact NH1-OD2 2.65Å; R656-D660 IonicContact NH2-OD2 3.82Å; R656-D660 PolarHBondContact NH2-OD2 2.69Å; R656-D660 WeakPolarHBondContact O-CB 3.2Å; R656-D660 PolarHBondContact O-N 3.32Å
657	N	87.6	Confident	88.5	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.016	16%	0.164	C	C	.	.	H	α-helix	trans	-69	-38.4	174.6	-78	-63	0	0	0	113.2	I498 A503 K506 E653 T654 I655 S661	I498-N657 HydrophobicContact CD1-CB 4.11Å; I498-N657 WeakPolarHBondContact CD1-O 3.31Å; A503-N657 HydrophobicContact CB-CB 4.1Å; K506-N657 WeakPolarHBondContact CD-OD1 3.34Å; K506-N657 WeakPolarHBondContact CE-OD1 3.39Å; K506-N657 PolarHBondContact NZ-OD1 2.75Å; E653-N657 PolarHBondContact O-N 2.6Å; E653-N657 PolarHBondContact O-ND2 2.97Å; E653-N657 PolarHBondContact OE1-ND2 2.84Å; T654-N657 PolarHBondContact O-N 3.49Å; I655-N657 VanDerWaalsContact C-N 3.26Å; I655-N657 PolarHBondContact O-N 2.68Å; N657-S661 WeakPolarHBondContact O-CB 3.4Å; N657-S661 PolarHBondContact O-N 2.8Å
658	L	91.1	Very high	89.2	Confident	9 Å²	9	37.6 Å²	37.6	5%	0.047	17%	0.166	C	C	.	.	H	α-helix	trans	-64.5	-41.7	172.6	-64	166.8	0	0	0	111	F413 F497 I498 F500 A503 T654 I655 S661 Y662	F413-L658 HydrophobicContact CD2-CB 3.56Å; F413-L658 HydrophobicContact CE2-CB 3.58Å; F497-L658 HydrophobicContact CE1-CD2 4.19Å; F497-L658 HydrophobicContact CE2-CD2 4.25Å; F497-L658 HydrophobicContact CZ-CB 4.32Å; F497-L658 HydrophobicContact CZ-CD2 3.62Å; I498-L658 HydrophobicContact CG1-CD2 4.23Å; F500-L658 HydrophobicContact CD2-CD1 4.11Å; A503-L658 HydrophobicContact CB-CD1 4.44Å; A503-L658 HydrophobicContact CB-CD2 3.59Å; A503-L658 HydrophobicContact CB-CG 3.66Å; T654-L658 HydrophobicContact CG2-CD1 4.36Å; T654-L658 WeakPolarHBondContact O-CG 3.31Å; T654-L658 PolarHBondContact O-N 3Å; I655-L658 PolarHBondContact O-N 3.01Å; I655-L658 VanDerWaalsContact O-N 3.09Å; L658-S661 WeakPolarHBondContact O-CB 3.33Å; L658-S661 PolarHBondContact O-N 3.34Å; L658-Y662 PolarHBondContact O-N 2.99Å
659	V	91.7	Very high	89.7	Confident	4 Å²	4	39 Å²	39	2%	0.024	18%	0.175	C	C	.	.	H	α-helix	trans	-63.9	-47.1	176.8	174.2	0	0	0	0	111.6	F413 I416 V417 I655 R656 S661 Y662 M663	F413-V659 HydrophobicContact CD2-CG2 4.06Å; F413-V659 HydrophobicContact CE2-CG2 4.49Å; I416-V659 HydrophobicContact CB-CG2 4.29Å; I416-V659 HydrophobicContact CG2-CG1 4.15Å; I416-V659 HydrophobicContact CG2-CG2 3.74Å; V417-V659 HydrophobicContact CG2-CG2 4.04Å; I655-V659 HydrophobicContact CG2-CG2 4.05Å; I655-V659 VanDerWaalsContact O-CG2 3.29Å; I655-V659 WeakPolarHBondContact O-CG2 3.08Å; I655-V659 PolarHBondContact O-N 2.92Å; R656-V659 PolarHBondContact O-N 2.91Å; V659-S661 VanDerWaalsContact C-N 3.26Å; V659-S661 PolarHBondContact O-N 3.24Å; V659-Y662 PolarHBondContact O-N 3.28Å; V659-M663 HydrophobicContact CG1-CG 4.04Å; V659-M663 VanDerWaalsContact O-CB 3.28Å; V659-M663 WeakPolarHBondContact O-CB 3.49Å; V659-M663 WeakPolarHBondContact O-CG 3.25Å; V659-M663 PolarHBondContact O-N 3.25Å
660	D	88.3	Confident	90.3	Very high	31 Å²	31	33.9 Å²	33.9	17%	0.166	15%	0.151	C	C	.	.	H	α-helix	trans	-55.1	-41.4	172.2	174.6	3.8	0	0	0	111.1	K514 R656 R664	K514-D660 IonicContact NZ-OD2 3.9Å; K514-D660 PolarHBondContact NZ-OD2 3.1Å; R656-D660 IonicContact CZ-OD2 2.73Å; R656-D660 IonicContact NH1-OD2 2.65Å; R656-D660 IonicContact NH2-OD2 3.82Å; R656-D660 PolarHBondContact NH2-OD2 2.69Å; R656-D660 WeakPolarHBondContact O-CB 3.2Å; R656-D660 PolarHBondContact O-N 3.32Å; D660-R664 WeakPolarHBondContact O-CB 3.3Å; D660-R664 PolarHBondContact O-N 3.4Å; D660-R664 IonicContact OD1-CZ 3.74Å; D660-R664 IonicContact OD1-NE 2.81Å; D660-R664 IonicContact OD1-NH2 3.7Å; D660-R664 PolarHBondContact OD1-NH2 3.25Å
661	S	88.8	Confident	90.9	Very high	6 Å²	6	31.2 Å²	31.2	4%	0.042	14%	0.141	C	C	.	.	H	α-helix	trans	-69.9	-45.3	177.2	-168.6	0	0	0	0	113.5	F497 I498 N657 L658 V659	F497-S661 WeakPolarHBondContact CD2-OG 3.36Å; I498-S661 PolarHBondContact N-OG 2.99Å; N657-S661 WeakPolarHBondContact O-CB 3.4Å; N657-S661 PolarHBondContact O-N 2.8Å; L658-S661 WeakPolarHBondContact O-CB 3.33Å; L658-S661 PolarHBondContact O-N 3.34Å; V659-S661 VanDerWaalsContact C-N 3.26Å; V659-S661 PolarHBondContact O-N 3.24Å
662	Y	93.9	Very high	91.4	Very high	6 Å²	6	33.4 Å²	33.4	2%	0.024	15%	0.154	C	C	.	.	H	α-helix	trans	-73.8	-45	-176.4	-160.1	-90.4	0	0	0	111.5	F413 V417 I421 M490 N491 F497 L658 V659 R664 I665 V666	F413-Y662 HydrophobicContact CZ-CD2 4.21Å; F413-Y662 HydrophobicContact CZ-CG 4.1Å; V417-Y662 HydrophobicContact CG1-CD1 3.57Å; V417-Y662 HydrophobicContact CG1-CE1 4.03Å; V417-Y662 HydrophobicContact CG1-CG 4.37Å; I421-Y662 HydrophobicContact CD1-CD1 4.35Å; I421-Y662 HydrophobicContact CD1-CE1 3.96Å; M490-Y662 WeakPolarHBondContact CA-OH 3.11Å; N491-Y662 PolarHBondContact N-OH 2.78Å; F497-Y662 HydrophobicContact CD2-CD2 4.02Å; F497-Y662 HydrophobicContact CE2-CD2 4.03Å; F497-Y662 HydrophobicContact CE2-CG 4.49Å; L658-Y662 PolarHBondContact O-N 2.99Å; V659-Y662 PolarHBondContact O-N 3.28Å; Y662-R664 PolarHBondContact O-N 2.92Å; Y662-I665 WeakPolarHBondContact O-CB 3.37Å; Y662-I665 PolarHBondContact O-N 3.45Å; Y662-V666 HydrophobicContact CD1-CG2 3.68Å; Y662-V666 HydrophobicContact CE1-CG2 3.36Å; Y662-V666 PolarHBondContact O-N 3.01Å; Y662-V666 VanDerWaalsContact O-N 3.1Å
663	M	92.1	Very high	91.9	Very high	25 Å²	25	35.9 Å²	35.9	12%	0.123	17%	0.167	C	C	.	.	H	α-helix	trans	-63.6	-27.4	178.3	-69.3	-54.1	-54.8	0	0	112.6	Q420 I421 L424 V659 I665 T667	Q420-M663 HydrophobicContact CB-CE 3.73Å; Q420-M663 HydrophobicContact CB-CG 4.08Å; Q420-M663 HydrophobicContact CB-SD 3.59Å; Q420-M663 VanDerWaalsContact CB-SD 3.59Å; I421-M663 HydrophobicContact CG1-CE 4.21Å; I421-M663 HydrophobicContact CG1-SD 3.71Å; L424-M663 HydrophobicContact CD1-CE 3.9Å; L424-M663 HydrophobicContact CG-CE 4.4Å; V659-M663 HydrophobicContact CG1-CG 4.04Å; V659-M663 VanDerWaalsContact O-CB 3.28Å; V659-M663 WeakPolarHBondContact O-CB 3.49Å; V659-M663 WeakPolarHBondContact O-CG 3.25Å; V659-M663 PolarHBondContact O-N 3.25Å; M663-I665 VanDerWaalsContact C-N 3.34Å; M663-T667 WeakPolarHBondContact O-CB 3.45Å; M663-T667 PolarHBondContact O-N 2.73Å; M663-T667 PolarHBondContact O-OG1 3.26Å
664	R	90.8	Very high	92.4	Very high	143 Å²	143	33.9 Å²	33.9	54%	0.54	16%	0.157	S	C	.	.	H	α-helix	trans	-64.1	-36.6	171.5	177.4	-176.5	-56.5	-85	-15.9	112.7	D660 Y662 K668	D660-R664 WeakPolarHBondContact O-CB 3.3Å; D660-R664 PolarHBondContact O-N 3.4Å; D660-R664 IonicContact OD1-CZ 3.74Å; D660-R664 IonicContact OD1-NE 2.81Å; D660-R664 IonicContact OD1-NH2 3.7Å; D660-R664 PolarHBondContact OD1-NH2 3.25Å; Y662-R664 PolarHBondContact O-N 2.92Å; R664-K668 WeakPolarHBondContact O-CB 3.49Å; R664-K668 PolarHBondContact O-N 2.88Å; R664-K668 VanDerWaalsContact O-N 3.14Å
665	I	93.3	Very high	92.9	Very high	7 Å²	7	34.5 Å²	34.5	4%	0.036	16%	0.162	C	C	.	.	H	α-helix	trans	-69.3	-57.5	175.1	-60.2	163.2	0	0	0	109.3	H494 D496 F497 Y662 M663 T667 K668 T669	H494-I665 HydrophobicContact CB-CD1 4.17Å; D496-I665 HydrophobicContact CB-CD1 4.11Å; D496-I665 HydrophobicContact CB-CG1 3.82Å; F497-I665 HydrophobicContact CB-CD1 3.84Å; F497-I665 HydrophobicContact CD2-CD1 4.34Å; Y662-I665 WeakPolarHBondContact O-CB 3.37Å; Y662-I665 PolarHBondContact O-N 3.45Å; M663-I665 VanDerWaalsContact C-N 3.34Å; I665-T667 VanDerWaalsContact C-N 3.29Å; I665-T667 PolarHBondContact O-N 2.9Å; I665-K668 WeakPolarHBondContact O-CA 3.29Å; I665-K668 WeakPolarHBondContact O-CB 3.39Å; I665-K668 PolarHBondContact O-N 3.23Å; I665-T669 PolarHBondContact O-N 2.93Å; I665-T669 PolarHBondContact O-OG1 3.47Å
666	V	95	Very high	93.3	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-58.2	-41.6	-179	-174.7	0	0	0	0	111.6	I421 L424 E486 Y662 K668 T669 I670	I421-V666 HydrophobicContact CD1-CG2 4Å; I421-V666 HydrophobicContact CG1-CG1 4.22Å; I421-V666 HydrophobicContact CG1-CG2 4.21Å; I421-V666 HydrophobicContact CG2-CG1 4.44Å; L424-V666 HydrophobicContact CD1-CG1 3.69Å; E486-V666 HydrophobicContact CB-CG1 4.15Å; E486-V666 HydrophobicContact CG-CG1 3.89Å; Y662-V666 HydrophobicContact CD1-CG2 3.68Å; Y662-V666 HydrophobicContact CE1-CG2 3.36Å; Y662-V666 PolarHBondContact O-N 3.01Å; Y662-V666 VanDerWaalsContact O-N 3.1Å; V666-K668 VanDerWaalsContact C-N 3.34Å; V666-K668 PolarHBondContact O-N 2.93Å; V666-T669 PolarHBondContact O-N 3.47Å; V666-I670 HydrophobicContact CG1-CG1 4.08Å; V666-I670 WeakPolarHBondContact O-CB 3.48Å; V666-I670 VanDerWaalsContact O-CG1 3.31Å; V666-I670 WeakPolarHBondContact O-CG1 3.27Å; V666-I670 PolarHBondContact O-N 3.11Å
667	T	92.9	Very high	93.7	Very high	30 Å²	30	39.9 Å²	39.9	18%	0.184	19%	0.189	C	C	.	.	H	α-helix	trans	-66.2	-34.7	177.5	-61	0	0	0	0	112.3	I378 M663 I665 R671	I378-T667 HydrophobicContact CG2-CG2 3.8Å; M663-T667 WeakPolarHBondContact O-CB 3.45Å; M663-T667 PolarHBondContact O-N 2.73Å; M663-T667 PolarHBondContact O-OG1 3.26Å; I665-T667 VanDerWaalsContact C-N 3.29Å; I665-T667 PolarHBondContact O-N 2.9Å; T667-R671 HydrophobicContact CG2-CG 4.29Å; T667-R671 WeakPolarHBondContact O-CB 3.48Å; T667-R671 WeakPolarHBondContact O-CG 3.38Å; T667-R671 PolarHBondContact O-N 3.42Å
668	K	92.9	Very high	94.3	Very high	124 Å²	124	39.7 Å²	39.7	54%	0.539	19%	0.189	S	C	.	.	H	α-helix	trans	-65.7	-46	173.5	173.5	-177.3	166.7	-172.6	0	110.2	D496 R664 I665 V666 R671 D672	D496-K668 IonicContact OD2-NZ 2.63Å; D496-K668 PolarHBondContact OD2-NZ 3.15Å; R664-K668 WeakPolarHBondContact O-CB 3.49Å; R664-K668 PolarHBondContact O-N 2.88Å; R664-K668 VanDerWaalsContact O-N 3.14Å; I665-K668 WeakPolarHBondContact O-CA 3.29Å; I665-K668 WeakPolarHBondContact O-CB 3.39Å; I665-K668 PolarHBondContact O-N 3.23Å; V666-K668 VanDerWaalsContact C-N 3.34Å; V666-K668 PolarHBondContact O-N 2.93Å; K668-R671 PolarHBondContact O-N 2.85Å; K668-D672 PolarHBondContact O-N 3.01Å
669	T	94.8	Very high	94.6	Very high	44 Å²	44	43.3 Å²	43.3	27%	0.27	21%	0.206	S	C	.	.	H	α-helix	trans	-59.8	-54.1	174.9	-55.6	0	0	0	0	112.3	I665 V666 R671 D672 L673	I665-T669 PolarHBondContact O-N 2.93Å; I665-T669 PolarHBondContact O-OG1 3.47Å; V666-T669 PolarHBondContact O-N 3.47Å; T669-R671 VanDerWaalsContact C-N 3.32Å; T669-R671 PolarHBondContact O-N 2.96Å; T669-D672 PolarHBondContact O-N 3.08Å; T669-D672 VanDerWaalsContact O-N 3.16Å; T669-L673 HydrophobicContact CG2-CD1 3.65Å; T669-L673 HydrophobicContact CG2-CG 4.3Å; T669-L673 WeakPolarHBondContact O-CB 3.47Å; T669-L673 WeakPolarHBondContact O-CG 3.43Å; T669-L673 PolarHBondContact O-N 2.81Å
670	I	95.6	Very high	94.9	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-36.8	-179	-68.2	-64.2	0	0	0	111.7	F374 L424 L482 V483 V666 D672 V674	F374-I670 HydrophobicContact CZ-CG2 4.11Å; L424-I670 HydrophobicContact CD1-CG1 4.18Å; L482-I670 HydrophobicContact CD2-CD1 3.82Å; L482-I670 HydrophobicContact CG-CD1 3.89Å; V483-I670 HydrophobicContact CG2-CD1 4.04Å; V666-I670 HydrophobicContact CG1-CG1 4.08Å; V666-I670 WeakPolarHBondContact O-CB 3.48Å; V666-I670 VanDerWaalsContact O-CG1 3.31Å; V666-I670 WeakPolarHBondContact O-CG1 3.27Å; V666-I670 PolarHBondContact O-N 3.11Å; I670-D672 VanDerWaalsContact C-N 3.32Å; I670-D672 PolarHBondContact O-N 2.73Å; I670-V674 HydrophobicContact CG2-CG2 3.96Å; I670-V674 WeakPolarHBondContact O-CB 3.11Å; I670-V674 VanDerWaalsContact O-CG2 3.3Å; I670-V674 WeakPolarHBondContact O-CG2 3.36Å; I670-V674 PolarHBondContact O-N 2.93Å; I670-V674 VanDerWaalsContact O-N 3.1Å
671	R	94	Very high	95.4	Very high	106 Å²	106	48.9 Å²	48.9	40%	0.4	23%	0.232	S	C	.	.	H	α-helix	trans	-69.9	-25.6	177	-77	177.1	61.2	172.2	-5.2	114.3	F374 I378 T667 K668 T669 P675	F374-R671 HydrophobicContact CE1-CG 4.36Å; I378-R671 HydrophobicContact CD1-CG 3.43Å; I378-R671 VanDerWaalsContact CD1-CG 3.43Å; T667-R671 HydrophobicContact CG2-CG 4.29Å; T667-R671 WeakPolarHBondContact O-CB 3.48Å; T667-R671 WeakPolarHBondContact O-CG 3.38Å; T667-R671 PolarHBondContact O-N 3.42Å; K668-R671 PolarHBondContact O-N 2.85Å; T669-R671 VanDerWaalsContact C-N 3.32Å; T669-R671 PolarHBondContact O-N 2.96Å; R671-P675 VanDerWaalsContact O-CD 3.31Å; R671-P675 WeakPolarHBondContact O-CD 3.26Å
672	D	95.7	Very high	95.8	Very high	79 Å²	79	48.6 Å²	48.6	42%	0.422	23%	0.23	S	C	.	.	H	α-helix	trans	-85.2	-42.7	175.4	176.5	79.5	0	0	0	112.2	K668 T669 I670 K676	K668-D672 PolarHBondContact O-N 3.01Å; T669-D672 PolarHBondContact O-N 3.08Å; T669-D672 VanDerWaalsContact O-N 3.16Å; I670-D672 VanDerWaalsContact C-N 3.32Å; I670-D672 PolarHBondContact O-N 2.73Å; D672-K676 WeakPolarHBondContact O-CD 3.49Å; D672-K676 WeakPolarHBondContact O-CG 3.32Å; D672-K676 VanDerWaalsContact OD1-CE 3.25Å; D672-K676 WeakPolarHBondContact OD1-CE 3.49Å; D672-K676 IonicContact OD1-NZ 2.75Å; D672-K676 PolarHBondContact OD1-NZ 2.9Å; D672-K676 WeakPolarHBondContact OD2-CE 3.22Å; D672-K676 IonicContact OD2-NZ 2.84Å; D672-K676 PolarHBondContact OD2-NZ 2.94Å
673	L	97.8	Very high	95.9	Very high	61 Å²	61	48.5 Å²	48.5	32%	0.319	23%	0.229	S	C	.	.	H	α-helix	trans	-81.5	-33	-172.9	-66.4	-177.7	0	0	0	114.3	L482 T669 K676 A677	L482-L673 HydrophobicContact CD1-CD1 3.74Å; L482-L673 HydrophobicContact CD2-CB 3.73Å; L482-L673 HydrophobicContact CD2-CD1 3.95Å; L482-L673 HydrophobicContact CG-CD1 4.49Å; T669-L673 HydrophobicContact CG2-CD1 3.65Å; T669-L673 HydrophobicContact CG2-CG 4.3Å; T669-L673 WeakPolarHBondContact O-CB 3.47Å; T669-L673 WeakPolarHBondContact O-CG 3.43Å; T669-L673 PolarHBondContact O-N 2.81Å; L673-K676 PolarHBondContact O-N 3.13Å; L673-A677 WeakPolarHBondContact O-CB 3.38Å; L673-A677 PolarHBondContact O-N 2.74Å
674	V	98.1	Very high	96.1	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-61.4	-49.2	-179.8	166.1	0	0	0	0	112.4	F374 A428 C431 L479 I670 K676 A677 I678	F374-V674 HydrophobicContact CD1-CG1 4.34Å; F374-V674 HydrophobicContact CE1-CB 3.61Å; F374-V674 HydrophobicContact CE1-CG1 3.72Å; F374-V674 HydrophobicContact CE1-CG2 4.29Å; F374-V674 HydrophobicContact CE2-CG1 4.16Å; F374-V674 HydrophobicContact CZ-CB 3.56Å; F374-V674 HydrophobicContact CZ-CG1 3.62Å; F374-V674 HydrophobicContact CZ-CG2 3.75Å; A428-V674 HydrophobicContact CB-CG1 4.49Å; A428-V674 HydrophobicContact CB-CG2 3.82Å; C431-V674 HydrophobicContact CB-CG1 4.26Å; L479-V674 HydrophobicContact CD1-CG1 4.07Å; L479-V674 HydrophobicContact CD1-CG2 4.26Å; L479-V674 HydrophobicContact CD2-CB 4.38Å; L479-V674 HydrophobicContact CD2-CG2 3.79Å; I670-V674 HydrophobicContact CG2-CG2 3.96Å; I670-V674 WeakPolarHBondContact O-CB 3.11Å; I670-V674 VanDerWaalsContact O-CG2 3.3Å; I670-V674 WeakPolarHBondContact O-CG2 3.36Å; I670-V674 PolarHBondContact O-N 2.93Å; I670-V674 VanDerWaalsContact O-N 3.1Å; V674-K676 VanDerWaalsContact C-N 3.31Å; V674-K676 PolarHBondContact O-N 3.01Å; V674-A677 PolarHBondContact O-N 2.7Å; V674-I678 HydrophobicContact CG1-CD1 3.75Å; V674-I678 WeakPolarHBondContact O-CG1 3.15Å; V674-I678 PolarHBondContact O-N 2.9Å
675	P	97.9	Very high	96.4	Very high	21 Å²	21	46.1 Å²	46.1	14%	0.136	23%	0.227	C	C	.	.	H	α-helix	trans	-58	-40.9	174	-27.2	37	0	0	0	113.1	F370 F374 R671 I678 M679	F370-P675 HydrophobicContact CB-CB 4.2Å; F370-P675 HydrophobicContact CB-CG 4.12Å; F370-P675 HydrophobicContact CD1-CB 3.87Å; F370-P675 HydrophobicContact CD1-CG 4.05Å; F370-P675 HydrophobicContact CD2-CB 3.99Å; F370-P675 HydrophobicContact CE1-CB 4.18Å; F370-P675 HydrophobicContact CE2-CB 4.29Å; F370-P675 HydrophobicContact CG-CB 3.77Å; F370-P675 HydrophobicContact CG-CG 4.09Å; F370-P675 HydrophobicContact CZ-CB 4.38Å; F374-P675 HydrophobicContact CD1-CG 4.48Å; R671-P675 VanDerWaalsContact O-CD 3.31Å; R671-P675 WeakPolarHBondContact O-CD 3.26Å; P675-I678 PolarHBondContact O-N 2.78Å; P675-M679 WeakPolarHBondContact O-CB 3.21Å; P675-M679 VanDerWaalsContact O-CG 3.31Å; P675-M679 WeakPolarHBondContact O-CG 3.44Å; P675-M679 PolarHBondContact O-N 3Å
676	K	98.2	Very high	96.5	Very high	113 Å²	113	45.8 Å²	45.8	49%	0.491	23%	0.225	S	C	.	.	H	α-helix	trans	-65.6	-42.3	179.3	-67.5	173.8	-172.2	174.1	0	112.2	D672 L673 V674 M679 H680	D672-K676 WeakPolarHBondContact O-CD 3.49Å; D672-K676 WeakPolarHBondContact O-CG 3.32Å; D672-K676 VanDerWaalsContact OD1-CE 3.25Å; D672-K676 WeakPolarHBondContact OD1-CE 3.49Å; D672-K676 IonicContact OD1-NZ 2.75Å; D672-K676 PolarHBondContact OD1-NZ 2.9Å; D672-K676 WeakPolarHBondContact OD2-CE 3.22Å; D672-K676 IonicContact OD2-NZ 2.84Å; D672-K676 PolarHBondContact OD2-NZ 2.94Å; L673-K676 PolarHBondContact O-N 3.13Å; V674-K676 VanDerWaalsContact C-N 3.31Å; V674-K676 PolarHBondContact O-N 3.01Å; K676-M679 PolarHBondContact O-N 3.39Å; K676-H680 WeakPolarHBondContact O-CB 3.23Å; K676-H680 PolarHBondContact O-N 2.97Å
677	A	98.3	Very high	96.5	Very high	22 Å²	22	46.8 Å²	46.8	18%	0.182	23%	0.23	C	C	.	.	H	α-helix	trans	-64	-41.4	175.8	0	0	0	0	0	111.9	L479 L673 V674 L681	L479-A677 HydrophobicContact CD2-CB 3.65Å; L673-A677 WeakPolarHBondContact O-CB 3.38Å; L673-A677 PolarHBondContact O-N 2.74Å; V674-A677 PolarHBondContact O-N 2.7Å; A677-L681 HydrophobicContact CB-CD1 4.31Å; A677-L681 WeakPolarHBondContact O-CB 3.48Å; A677-L681 WeakPolarHBondContact O-CG 3.33Å; A677-L681 PolarHBondContact O-N 3.15Å
678	I	98.5	Very high	96.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-45.1	176.1	-66.5	168.7	0	0	0	110.9	F370 C431 V432 V435 V674 P675 H680 M682 I683	F370-I678 HydrophobicContact CE1-CB 4.1Å; F370-I678 HydrophobicContact CE1-CD1 3.96Å; F370-I678 HydrophobicContact CE1-CG2 3.98Å; F370-I678 HydrophobicContact CZ-CB 4.07Å; F370-I678 HydrophobicContact CZ-CG2 3.8Å; C431-I678 HydrophobicContact CB-CD1 4.17Å; V432-I678 HydrophobicContact CG2-CD1 4.04Å; V432-I678 HydrophobicContact CG2-CG1 4.1Å; V435-I678 HydrophobicContact CB-CG2 4.18Å; V435-I678 HydrophobicContact CG1-CG2 3.79Å; V435-I678 HydrophobicContact CG2-CG2 4.32Å; V674-I678 HydrophobicContact CG1-CD1 3.75Å; V674-I678 WeakPolarHBondContact O-CG1 3.15Å; V674-I678 PolarHBondContact O-N 2.9Å; P675-I678 PolarHBondContact O-N 2.78Å; I678-H680 PolarHBondContact O-N 3.26Å; I678-M682 HydrophobicContact CG2-CE 3.88Å; I678-M682 WeakPolarHBondContact O-CB 3.31Å; I678-M682 PolarHBondContact O-N 3.35Å; I678-I683 HydrophobicContact CG2-CD1 4.14Å; I678-I683 PolarHBondContact O-N 3.32Å; I678-I683 VanDerWaalsContact O-N 3.09Å
679	M	97.5	Very high	96.9	Very high	84 Å²	84	44.7 Å²	44.7	41%	0.414	22%	0.22	S	C	.	.	I	π-helix	trans	-58.1	-47.1	176.1	-77.1	-60.4	-55.2	0	0	112.2	F370 P675 K676 I683 H684	F370-M679 HydrophobicContact CE2-CG 3.93Å; F370-M679 HydrophobicContact CE2-SD 3.89Å; F370-M679 HydrophobicContact CZ-CG 4.31Å; F370-M679 HydrophobicContact CZ-SD 4.41Å; P675-M679 WeakPolarHBondContact O-CB 3.21Å; P675-M679 VanDerWaalsContact O-CG 3.31Å; P675-M679 WeakPolarHBondContact O-CG 3.44Å; P675-M679 PolarHBondContact O-N 3Å; K676-M679 PolarHBondContact O-N 3.39Å; M679-I683 HydrophobicContact CE-CG2 4.21Å; M679-I683 PolarHBondContact O-N 3.25Å; M679-I683 HydrophobicContact SD-CB 4.42Å; M679-I683 HydrophobicContact SD-CD1 3.46Å; M679-I683 WeakPolarHBondContact SD-CD1 2.9Å; M679-I683 HydrophobicContact SD-CG2 4.46Å; M679-H684 WeakPolarHBondContact O-CB 3.33Å; M679-H684 PolarHBondContact O-N 2.81Å
680	H	98.2	Very high	96.9	Very high	120 Å²	120	42.6 Å²	42.6	56%	0.556	21%	0.208	S	C	*	.	I	π-helix	trans	-78	-55.1	-176.5	178.5	60.1	0	0	0	113.2	K676 I678 M682 S685	K676-H680 WeakPolarHBondContact O-CB 3.23Å; K676-H680 PolarHBondContact O-N 2.97Å; I678-H680 PolarHBondContact O-N 3.26Å; H680-M682 VanDerWaalsContact C-N 3.33Å; H680-M682 PolarHBondContact O-N 3Å; H680-S685 PolarHBondContact O-N 2.86Å
681	L	98.1	Very high	96.8	Very high	32 Å²	32	49.3 Å²	49.3	17%	0.168	24%	0.239	C	C	.	.	I	π-helix	trans	-74.8	-23	-170.5	-60.2	172.7	0	0	0	113.3	R471 C475 Q478 A677 S685	R471-L681 WeakPolarHBondContact CD-O 3.02Å; C475-L681 HydrophobicContact CB-CB 4.3Å; Q478-L681 HydrophobicContact CB-CD1 3.73Å; Q478-L681 HydrophobicContact CG-CD1 3.79Å; A677-L681 HydrophobicContact CB-CD1 4.31Å; A677-L681 WeakPolarHBondContact O-CB 3.48Å; A677-L681 WeakPolarHBondContact O-CG 3.33Å; A677-L681 PolarHBondContact O-N 3.15Å; L681-S685 WeakPolarHBondContact O-CB 3.3Å
682	M	97.9	Very high	96.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.245	C	C	.	.	I	π-helix	trans	-120.4	-60.5	-172.9	-161.7	168.5	82.2	0	0	112.5	V432 V435 V436 L439 L468 R471 E472 I678 H680 T686	V432-M682 HydrophobicContact CG1-CE 4.13Å; V432-M682 HydrophobicContact CG1-SD 3.8Å; V435-M682 HydrophobicContact CB-CE 3.95Å; V435-M682 HydrophobicContact CG1-CE 3.59Å; V436-M682 HydrophobicContact CG2-CE 3.57Å; V436-M682 HydrophobicContact CG2-SD 3.47Å; V436-M682 WeakPolarHBondContact CG2-SD 3.29Å; L439-M682 HydrophobicContact CD1-CE 3.8Å; L439-M682 HydrophobicContact CD1-CG 4.37Å; L468-M682 HydrophobicContact CD1-CG 3.77Å; L468-M682 HydrophobicContact CD1-SD 4.2Å; R471-M682 HydrophobicContact CB-CB 4.4Å; R471-M682 HydrophobicContact CB-CG 4.05Å; E472-M682 HydrophobicContact CB-SD 4.27Å; I678-M682 HydrophobicContact CG2-CE 3.88Å; I678-M682 WeakPolarHBondContact O-CB 3.31Å; I678-M682 PolarHBondContact O-N 3.35Å; H680-M682 VanDerWaalsContact C-N 3.33Å; H680-M682 PolarHBondContact O-N 3Å; M682-T686 VanDerWaalsContact O-CB 3.24Å; M682-T686 WeakPolarHBondContact O-CB 3.26Å; M682-T686 PolarHBondContact O-N 3.25Å; M682-T686 PolarHBondContact O-OG1 2.68Å
683	I	96.7	Very high	96.8	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	25%	0.246	C	C	.	.	I	π-helix	trans	-67.8	-58.2	-173	-65.7	165.9	0	0	0	111.3	I347 I366 F370 V435 L439 I678 M679 T686 N687	I347-I683 HydrophobicContact CG2-CG2 3.51Å; I366-I683 HydrophobicContact CD1-CD1 4.24Å; I366-I683 HydrophobicContact CG2-CD1 3.85Å; F370-I683 HydrophobicContact CZ-CD1 4.35Å; V435-I683 HydrophobicContact CG1-CD1 3.98Å; V435-I683 HydrophobicContact CG1-CG1 4.36Å; L439-I683 HydrophobicContact CD1-CG1 3.92Å; L439-I683 HydrophobicContact CD2-CG1 4.31Å; I678-I683 HydrophobicContact CG2-CD1 4.14Å; I678-I683 PolarHBondContact O-N 3.32Å; I678-I683 VanDerWaalsContact O-N 3.09Å; M679-I683 HydrophobicContact CE-CG2 4.21Å; M679-I683 PolarHBondContact O-N 3.25Å; M679-I683 HydrophobicContact SD-CB 4.42Å; M679-I683 HydrophobicContact SD-CD1 3.46Å; M679-I683 WeakPolarHBondContact SD-CD1 2.9Å; M679-I683 HydrophobicContact SD-CG2 4.46Å; I683-T686 PolarHBondContact O-N 3Å; I683-N687 PolarHBondContact O-N 3.09Å
684	H	95.8	Very high	96.7	Very high	92 Å²	92	45.8 Å²	45.8	43%	0.426	23%	0.231	S	C	.	.	I	π-helix	trans	-63.8	-43.6	177.7	174.7	52.8	0	0	0	111.3	M679 T686 N687 E688	M679-H684 WeakPolarHBondContact O-CB 3.33Å; M679-H684 PolarHBondContact O-N 2.81Å; H684-T686 VanDerWaalsContact C-N 3.28Å; H684-T686 PolarHBondContact O-N 3.05Å; H684-N687 PolarHBondContact O-N 3.11Å; H684-N687 VanDerWaalsContact O-N 3.1Å; H684-E688 IonicContact CE1-OE1 3.04Å; H684-E688 PolarHBondContact CE1-OE1 3.49Å; H684-E688 IonicContact ND1-OE1 2.78Å; H684-E688 WeakPolarHBondContact O-CG 3.15Å; H684-E688 PolarHBondContact O-N 3.08Å
685	S	96.6	Very high	96.4	Very high	26 Å²	26	48.3 Å²	48.3	18%	0.182	24%	0.244	C	C	.	.	H	α-helix	trans	-65.9	-24.8	178.8	-170.4	0	0	0	0	114.6	R471 H680 L681 F689	R471-S685 WeakPolarHBondContact CD-OG 3.29Å; R471-S685 PolarHBondContact NH1-OG 3.46Å; H680-S685 PolarHBondContact O-N 2.86Å; L681-S685 WeakPolarHBondContact O-CB 3.3Å; S685-F689 PolarHBondContact O-N 2.68Å
686	T	97.1	Very high	96.2	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-79.7	-37.2	170.4	-73.5	0	0	0	0	111.1	F343 V464 M682 I683 H684 F689 I690	F343-T686 HydrophobicContact CZ-CG2 4.09Å; V464-T686 HydrophobicContact CG1-CG2 4.14Å; M682-T686 VanDerWaalsContact O-CB 3.24Å; M682-T686 WeakPolarHBondContact O-CB 3.26Å; M682-T686 PolarHBondContact O-N 3.25Å; M682-T686 PolarHBondContact O-OG1 2.68Å; I683-T686 PolarHBondContact O-N 3Å; H684-T686 VanDerWaalsContact C-N 3.28Å; H684-T686 PolarHBondContact O-N 3.05Å; T686-F689 PolarHBondContact O-N 3.07Å; T686-I690 HydrophobicContact CG2-CD1 3.77Å; T686-I690 HydrophobicContact CG2-CG1 4.38Å; T686-I690 WeakPolarHBondContact O-CB 3.49Å; T686-I690 WeakPolarHBondContact O-CD1 3.3Å; T686-I690 VanDerWaalsContact O-CG1 3.25Å; T686-I690 WeakPolarHBondContact O-CG1 3.43Å; T686-I690 PolarHBondContact O-N 2.89Å
687	N	94.8	Very high	96	Very high	21 Å²	21	47.5 Å²	47.5	11%	0.112	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-49.1	174.1	-163.9	6.3	0	0	0	111.8	F343 I683 H684 F689 I690 H691	F343-N687 HydrophobicContact CD1-CB 4.44Å; F343-N687 HydrophobicContact CE1-CB 4.07Å; I683-N687 PolarHBondContact O-N 3.09Å; H684-N687 PolarHBondContact O-N 3.11Å; H684-N687 VanDerWaalsContact O-N 3.1Å; N687-F689 VanDerWaalsContact C-N 3.29Å; N687-F689 PolarHBondContact O-N 3.29Å; N687-I690 WeakPolarHBondContact O-CB 3.42Å; N687-I690 PolarHBondContact O-N 3.38Å; N687-I690 VanDerWaalsContact O-N 3.12Å; N687-H691 PolarHBondContact O-N 3.05Å
688	E	95.9	Very high	95.7	Very high	101 Å²	101	46.4 Å²	46.4	47%	0.472	24%	0.24	S	C	.	.	H	α-helix	trans	-53.9	-44.1	174.6	-73.4	-67	135.7	0	0	112.2	H684 H691 S692	H684-E688 IonicContact CE1-OE1 3.04Å; H684-E688 PolarHBondContact CE1-OE1 3.49Å; H684-E688 IonicContact ND1-OE1 2.78Å; H684-E688 WeakPolarHBondContact O-CG 3.15Å; H684-E688 PolarHBondContact O-N 3.08Å; E688-H691 PolarHBondContact O-N 3.07Å; E688-S692 WeakPolarHBondContact O-CB 3.24Å; E688-S692 PolarHBondContact O-N 2.95Å; E688-S692 PolarHBondContact O-OG 3.48Å
689	F	97.4	Very high	95.2	Very high	9 Å²	9	51.9 Å²	51.9	4%	0.039	26%	0.261	C	S	.	.	H	α-helix	trans	-66.7	-41.4	177.2	171	-90.2	0	0	0	112.9	I463 Q467 S685 T686 N687 H691 S692 E693 L694 H697	I463-F689 HydrophobicContact CG2-CE1 3.77Å; I463-F689 HydrophobicContact CG2-CZ 3.63Å; Q467-F689 HydrophobicContact CB-CD1 3.78Å; Q467-F689 HydrophobicContact CB-CE1 3.71Å; Q467-F689 HydrophobicContact CB-CG 4.23Å; Q467-F689 HydrophobicContact CB-CZ 4.1Å; Q467-F689 HydrophobicContact CG-CB 3.99Å; Q467-F689 HydrophobicContact CG-CD1 3.59Å; Q467-F689 HydrophobicContact CG-CD2 4.02Å; Q467-F689 HydrophobicContact CG-CE1 4.03Å; Q467-F689 HydrophobicContact CG-CE2 4.42Å; Q467-F689 HydrophobicContact CG-CG 3.58Å; Q467-F689 HydrophobicContact CG-CZ 4.43Å; Q467-F689 VanDerWaalsContact NE2-CG 3.34Å; S685-F689 PolarHBondContact O-N 2.68Å; T686-F689 PolarHBondContact O-N 3.07Å; N687-F689 VanDerWaalsContact C-N 3.29Å; N687-F689 PolarHBondContact O-N 3.29Å; F689-H691 VanDerWaalsContact C-N 3.26Å; F689-H691 PolarHBondContact O-N 3.39Å; F689-S692 PolarHBondContact O-N 3.13Å; F689-E693 HydrophobicContact CD2-CB 3.5Å; F689-E693 VanDerWaalsContact CD2-CB 3.5Å; F689-E693 HydrophobicContact CD2-CG 4.23Å; F689-E693 VanDerWaalsContact CD2-OE2 3.3Å; F689-E693 WeakPolarHBondContact CD2-OE2 3.32Å; F689-E693 HydrophobicContact CE2-CB 3.65Å; F689-E693 WeakPolarHBondContact CE2-OE2 3.21Å; F689-E693 HydrophobicContact CG-CB 4.25Å; F689-E693 PolarHBondContact O-N 3.04Å; F689-L694 PolarHBondContact O-N 3.31Å; F689-H697 AromaticContact CE2-CD2 3.69Å; F689-H697 AromaticContact CE2-NE2 3.78Å; F689-H697 AromaticContact CZ-CD2 3.76Å
690	I	95.9	Very high	94.8	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-59.2	-40.6	173.9	-72.7	164.7	0	0	0	110.2	F339 C340 F343 V464 T686 N687 L694	F339-I690 HydrophobicContact CD1-CG2 3.95Å; F339-I690 HydrophobicContact CE1-CD1 4.13Å; F339-I690 HydrophobicContact CE1-CG1 4.2Å; F339-I690 HydrophobicContact CE1-CG2 3.9Å; C340-I690 HydrophobicContact CB-CG2 4Å; C340-I690 VanDerWaalsContact SG-CG2 3.5Å; C340-I690 PolarHBondContact SG-O 3.42Å; C340-I690 VanDerWaalsContact SG-O 3.37Å; F343-I690 HydrophobicContact CD1-CD1 3.64Å; F343-I690 HydrophobicContact CD2-CD1 3.97Å; F343-I690 HydrophobicContact CE1-CD1 3.73Å; F343-I690 HydrophobicContact CE2-CD1 4.06Å; F343-I690 HydrophobicContact CG-CD1 3.77Å; F343-I690 HydrophobicContact CZ-CD1 3.94Å; V464-I690 HydrophobicContact CG1-CD1 3.73Å; V464-I690 HydrophobicContact CG1-CG1 3.91Å; V464-I690 HydrophobicContact CG2-CG1 3.96Å; T686-I690 HydrophobicContact CG2-CD1 3.77Å; T686-I690 HydrophobicContact CG2-CG1 4.38Å; T686-I690 WeakPolarHBondContact O-CB 3.49Å; T686-I690 WeakPolarHBondContact O-CD1 3.3Å; T686-I690 VanDerWaalsContact O-CG1 3.25Å; T686-I690 WeakPolarHBondContact O-CG1 3.43Å; T686-I690 PolarHBondContact O-N 2.89Å; N687-I690 WeakPolarHBondContact O-CB 3.42Å; N687-I690 PolarHBondContact O-N 3.38Å; N687-I690 VanDerWaalsContact O-N 3.12Å; I690-L694 HydrophobicContact CG2-CD2 4.2Å; I690-L694 WeakPolarHBondContact O-CB 3.48Å
691	H	93.3	Very high	94	Very high	142 Å²	142	51.7 Å²	51.7	66%	0.657	27%	0.265	S	S	*	.	H	α-helix	trans	-74.6	-40.8	-179.7	-159.1	110.6	0	0	0	113.6	N687 E688 F689	N687-H691 PolarHBondContact O-N 3.05Å; E688-H691 PolarHBondContact O-N 3.07Å; F689-H691 VanDerWaalsContact C-N 3.26Å; F689-H691 PolarHBondContact O-N 3.39Å
692	S	93.5	Very high	92.8	Very high	75 Å²	75	52.4 Å²	52.4	52%	0.524	28%	0.28	S	S	.	.	H	α-helix	trans	-106.6	-30.7	-166.9	63	0	0	0	0	115.8	E688 F689	E688-S692 WeakPolarHBondContact O-CB 3.24Å; E688-S692 PolarHBondContact O-N 2.95Å; E688-S692 PolarHBondContact O-OG 3.48Å; F689-S692 PolarHBondContact O-N 3.13Å
693	E	95.2	Very high	91.9	Very high	97 Å²	97	57.2 Å²	57.2	45%	0.453	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-30.6	-168.9	-74.4	179.9	-146.9	0	0	113.6	F689 L695 A696 H697	F689-E693 HydrophobicContact CD2-CB 3.5Å; F689-E693 VanDerWaalsContact CD2-CB 3.5Å; F689-E693 HydrophobicContact CD2-CG 4.23Å; F689-E693 VanDerWaalsContact CD2-OE2 3.3Å; F689-E693 WeakPolarHBondContact CD2-OE2 3.32Å; F689-E693 HydrophobicContact CE2-CB 3.65Å; F689-E693 WeakPolarHBondContact CE2-OE2 3.21Å; F689-E693 HydrophobicContact CG-CB 4.25Å; F689-E693 PolarHBondContact O-N 3.04Å; E693-L695 VanDerWaalsContact C-N 3.32Å; E693-L695 PolarHBondContact O-N 3.25Å; E693-A696 WeakPolarHBondContact O-CA 3.24Å; E693-A696 WeakPolarHBondContact O-CB 3.47Å; E693-A696 PolarHBondContact O-N 2.83Å; E693-H697 PolarHBondContact O-CD2 2.67Å; E693-H697 PolarHBondContact O-N 3.17Å
694	L	95.8	Very high	91.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-51.2	-46	-176.7	174.4	59.5	0	0	0	113.3	V336 F339 V460 I463 V464 F689 I690 A696 H697 L698	V336-L694 HydrophobicContact CG1-CD2 4.36Å; F339-L694 HydrophobicContact CD1-CD2 4.03Å; F339-L694 HydrophobicContact CE1-CD2 4.08Å; V460-L694 HydrophobicContact CG1-CD2 4.3Å; V460-L694 HydrophobicContact CG2-CD1 4.42Å; I463-L694 HydrophobicContact CB-CD1 4Å; I463-L694 HydrophobicContact CD1-CD1 4.25Å; I463-L694 HydrophobicContact CG2-CD1 3.67Å; V464-L694 HydrophobicContact CG2-CD1 3.85Å; V464-L694 HydrophobicContact CG2-CD2 4Å; F689-L694 PolarHBondContact O-N 3.31Å; I690-L694 HydrophobicContact CG2-CD2 4.2Å; I690-L694 WeakPolarHBondContact O-CB 3.48Å; L694-A696 VanDerWaalsContact C-N 3.32Å; L694-A696 PolarHBondContact O-N 2.84Å; L694-H697 PolarHBondContact O-N 3.47Å; L694-L698 HydrophobicContact CD1-CD1 4.44Å; L694-L698 HydrophobicContact CD1-CG 4.38Å; L694-L698 HydrophobicContact CG-CD1 4.33Å; L694-L698 WeakPolarHBondContact O-CG 3.27Å; L694-L698 PolarHBondContact O-N 2.98Å
695	L	92.5	Very high	90.5	Very high	53 Å²	53	57.2 Å²	57.2	28%	0.277	31%	0.308	S	S	.	.	H	α-helix	trans	-62.1	-38.9	178	-179.5	63.8	0	0	0	112.3	M332 L333 E693 H697 L698 Y699	M332-L695 HydrophobicContact CE-CD1 4.07Å; L333-L695 HydrophobicContact CD2-CD1 3.9Å; L333-L695 HydrophobicContact CD2-CD2 3.5Å; L333-L695 VanDerWaalsContact CD2-CD2 3.5Å; L333-L695 HydrophobicContact CD2-CG 4.36Å; E693-L695 VanDerWaalsContact C-N 3.32Å; E693-L695 PolarHBondContact O-N 3.25Å; L695-H697 VanDerWaalsContact C-N 3.34Å; L695-L698 PolarHBondContact O-N 2.6Å; L695-Y699 HydrophobicContact CD1-CD2 4.17Å; L695-Y699 HydrophobicContact CD1-CE2 3.72Å; L695-Y699 HydrophobicContact CD2-CE2 4.37Å; L695-Y699 HydrophobicContact CG-CD2 4.12Å; L695-Y699 HydrophobicContact CG-CE2 3.84Å; L695-Y699 WeakPolarHBondContact O-CD2 3.28Å; L695-Y699 PolarHBondContact O-N 3.3Å
696	A	92.6	Very high	90	Very high	50 Å²	50	58.2 Å²	58.2	41%	0.413	32%	0.315	S	S	.	.	H	α-helix	trans	-70.1	-31.4	177.6	0	0	0	0	0	112.1	E693 L694 Q700	E693-A696 WeakPolarHBondContact O-CA 3.24Å; E693-A696 WeakPolarHBondContact O-CB 3.47Å; E693-A696 PolarHBondContact O-N 2.83Å; L694-A696 VanDerWaalsContact C-N 3.32Å; L694-A696 PolarHBondContact O-N 2.84Å; A696-Q700 WeakPolarHBondContact O-CG 3.25Å; A696-Q700 PolarHBondContact O-NE2 2.88Å
697	H	93.7	Very high	89.5	Confident	67 Å²	67	58.6 Å²	58.6	31%	0.31	32%	0.317	S	S	.	.	H	α-helix	trans	-70.6	-39.2	171.2	-82.9	-80.2	0	0	0	112.7	I463 F689 E693 L694 L695 Y699 Q700 C701	I463-H697 HydrophobicContact CD1-CB 3.95Å; I463-H697 HydrophobicContact CG1-CB 4.37Å; I463-H697 HydrophobicContact CG2-CB 3.9Å; F689-H697 AromaticContact CE2-CD2 3.69Å; F689-H697 AromaticContact CE2-NE2 3.78Å; F689-H697 AromaticContact CZ-CD2 3.76Å; E693-H697 PolarHBondContact O-CD2 2.67Å; E693-H697 PolarHBondContact O-N 3.17Å; L694-H697 PolarHBondContact O-N 3.47Å; L695-H697 VanDerWaalsContact C-N 3.34Å; H697-Y699 PolarHBondContact O-N 3.17Å; H697-Q700 WeakPolarHBondContact O-CA 3.43Å; H697-Q700 WeakPolarHBondContact O-CB 3.26Å; H697-Q700 PolarHBondContact O-N 3.37Å; H697-C701 PolarHBondContact O-N 3.41Å; H697-C701 VanDerWaalsContact O-N 3.15Å; H697-C701 PolarHBondContact O-SG 2.59Å
698	L	92.2	Very high	89.2	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-44.2	175.6	-72	168.8	0	0	0	111.9	V336 L456 D459 V460 I463 L694 L695 Q700 C701	V336-L698 HydrophobicContact CG2-CD1 3.5Å; L456-L698 HydrophobicContact CD1-CD1 3.98Å; L456-L698 HydrophobicContact CD1-CD2 4.04Å; D459-L698 HydrophobicContact CB-CD2 3.8Å; V460-L698 HydrophobicContact CG2-CD1 3.89Å; V460-L698 HydrophobicContact CG2-CD2 3.93Å; V460-L698 HydrophobicContact CG2-CG 4.43Å; I463-L698 HydrophobicContact CD1-CD2 3.66Å; I463-L698 HydrophobicContact CD1-CG 4.01Å; L694-L698 HydrophobicContact CD1-CD1 4.44Å; L694-L698 HydrophobicContact CD1-CG 4.38Å; L694-L698 HydrophobicContact CG-CD1 4.33Å; L694-L698 WeakPolarHBondContact O-CG 3.27Å; L694-L698 PolarHBondContact O-N 2.98Å; L695-L698 PolarHBondContact O-N 2.6Å; L698-Q700 PolarHBondContact O-N 2.81Å; L698-Q700 VanDerWaalsContact O-N 3.13Å; L698-C701 PolarHBondContact O-N 3.23Å; L698-C701 VanDerWaalsContact O-N 3.14Å
699	Y	88.7	Confident	88.7	Confident	115 Å²	115	57.8 Å²	57.8	45%	0.451	31%	0.313	S	S	.	.	H	α-helix	trans	-63.3	-13.6	173.1	-78.3	-62.2	0	0	0	114.5	M332 L695 H697	M332-Y699 HydrophobicContact CE-CD1 4.19Å; M332-Y699 HydrophobicContact CE-CE1 3.58Å; M332-Y699 HydrophobicContact CE-CE2 4.01Å; M332-Y699 VanDerWaalsContact CE-CZ 3.47Å; L695-Y699 HydrophobicContact CD1-CD2 4.17Å; L695-Y699 HydrophobicContact CD1-CE2 3.72Å; L695-Y699 HydrophobicContact CD2-CE2 4.37Å; L695-Y699 HydrophobicContact CG-CD2 4.12Å; L695-Y699 HydrophobicContact CG-CE2 3.84Å; L695-Y699 WeakPolarHBondContact O-CD2 3.28Å; L695-Y699 PolarHBondContact O-N 3.3Å; H697-Y699 PolarHBondContact O-N 3.17Å
700	Q	89	Confident	88.1	Confident	142 Å²	142	58.3 Å²	58.3	66%	0.664	32%	0.315	S	S	*	.	H	α-helix	trans	-96.5	-19	175	-69.9	168.1	58.8	0	0	113.3	A696 H697 L698	A696-Q700 WeakPolarHBondContact O-CG 3.25Å; A696-Q700 PolarHBondContact O-NE2 2.88Å; H697-Q700 WeakPolarHBondContact O-CA 3.43Å; H697-Q700 WeakPolarHBondContact O-CB 3.26Å; H697-Q700 PolarHBondContact O-N 3.37Å; L698-Q700 PolarHBondContact O-N 2.81Å; L698-Q700 VanDerWaalsContact O-N 3.13Å
701	C	81.9	Confident	87.7	Confident	58 Å²	58	59.6 Å²	59.6	39%	0.392	32%	0.324	S	S	.	.	H	α-helix	trans	-77.3	-21.4	-175.5	-74.9	0	0	0	0	114.1	D459 H697 L698	D459-C701 WeakPolarHBondContact OD2-CB 3.39Å; H697-C701 PolarHBondContact O-N 3.41Å; H697-C701 VanDerWaalsContact O-N 3.15Å; H697-C701 PolarHBondContact O-SG 2.59Å; L698-C701 PolarHBondContact O-N 3.23Å; L698-C701 VanDerWaalsContact O-N 3.14Å
702	G	72	Confident	87.3	Confident	46 Å²	46	56.8 Å²	56.8	47%	0.474	33%	0.325	S	S	.	.	S	Bend	trans	164.5	-159.6	173.2	0	0	0	0	0	114.5
703	D	80	Confident	86.7	Confident	101 Å²	101	56.4 Å²	56.4	54%	0.54	33%	0.327	S	S	.	.			trans	-69.1	128.4	177.8	-175.8	2.2	0	0	0	111.6	D705 S706 L707	D703-D705 PolarHBondContact O-N 2.93Å; D703-D705 PolarHBondContact OD1-N 3.47Å; D703-S706 WeakPolarHBondContact O-CB 3.33Å; D703-S706 PolarHBondContact O-N 2.81Å; D703-S706 VanDerWaalsContact O-N 3.09Å; D703-L707 PolarHBondContact O-N 3.33Å
704	Q	81.4	Confident	85.9	Confident	29 Å²	29	52.9 Å²	52.9	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-59.1	-31.5	174.7	-165.3	-161.8	-103.7	0	0	111.7	P325 T329 M332 S706 M708	P325-Q704 PolarHBondContact O-NE2 2.83Å; T329-Q704 VanDerWaalsContact OG1-CD 3.24Å; T329-Q704 PolarHBondContact OG1-NE2 2.95Å; T329-Q704 PolarHBondContact OG1-OE1 3.25Å; M332-Q704 HydrophobicContact CE-CG 4.35Å; M332-Q704 HydrophobicContact SD-CG 4.13Å; Q704-S706 VanDerWaalsContact C-N 3.27Å; Q704-S706 PolarHBondContact O-N 2.82Å; Q704-M708 HydrophobicContact CG-CG 4.39Å; Q704-M708 WeakPolarHBondContact O-CB 3.46Å; Q704-M708 WeakPolarHBondContact O-CG 3.37Å; Q704-M708 PolarHBondContact O-N 3.44Å; Q704-M708 VanDerWaalsContact O-N 3.17Å
705	D	81.7	Confident	85.3	Confident	68 Å²	68	54.7 Å²	54.7	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-67.1	-30	177.9	-87.1	-39.3	0	0	0	112.8	K328 D703	K328-D705 WeakPolarHBondContact CD-OD1 3.26Å; K328-D705 WeakPolarHBondContact CE-OD1 3.43Å; K328-D705 PolarHBondContact NZ-O 3.43Å; K328-D705 IonicContact NZ-OD1 3.72Å; K328-D705 PolarHBondContact NZ-OD1 3.23Å; D703-D705 PolarHBondContact O-N 2.93Å; D703-D705 PolarHBondContact OD1-N 3.47Å
706	S	85.2	Confident	84.7	Confident	47 Å²	47	58.5 Å²	58.5	33%	0.329	34%	0.342	S	S	.	.	H	α-helix	trans	-79	-49.5	173.3	-177.7	0	0	0	0	111.6	R455 D703 Q704 M708 E709	R455-S706 WeakPolarHBondContact CD-O 3.4Å; D703-S706 WeakPolarHBondContact O-CB 3.33Å; D703-S706 PolarHBondContact O-N 2.81Å; D703-S706 VanDerWaalsContact O-N 3.09Å; Q704-S706 VanDerWaalsContact C-N 3.27Å; Q704-S706 PolarHBondContact O-N 2.82Å; S706-M708 PolarHBondContact O-N 3.08Å; S706-M708 VanDerWaalsContact O-N 3.1Å; S706-E709 WeakPolarHBondContact O-CB 3.4Å; S706-E709 PolarHBondContact O-N 2.78Å
707	L	87.2	Confident	84	Confident	8 Å²	8	65.1 Å²	65.1	4%	0.042	36%	0.356	C	S	.	.	H	α-helix	trans	-53.3	-35.5	178.8	-74.4	168.3	0	0	0	112.9	L456 D459 D703	L456-L707 PolarHBondContact N-O 3.1Å; D459-L707 HydrophobicContact CB-CD2 4.06Å; D703-L707 PolarHBondContact O-N 3.33Å
708	M	88.2	Confident	83.5	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.02	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	25	-178.5	-59	-57.9	-64.6	0	0	114.1	K328 A331 M332 Y453 L456 Q704 S706 E710	K328-M708 HydrophobicContact CB-CB 4.09Å; K328-M708 HydrophobicContact CB-CG 4.09Å; K328-M708 HydrophobicContact CD-CB 3.89Å; K328-M708 HydrophobicContact CG-CB 3.77Å; K328-M708 HydrophobicContact CG-CG 4.34Å; A331-M708 HydrophobicContact CB-CE 3.7Å; M332-M708 HydrophobicContact CB-CE 4.19Å; M332-M708 HydrophobicContact CB-CG 4.33Å; M332-M708 HydrophobicContact CB-SD 3.64Å; M332-M708 HydrophobicContact CG-SD 3.91Å; Y453-M708 HydrophobicContact CD1-CB 4.46Å; Y453-M708 HydrophobicContact CD1-CE 4.02Å; Y453-M708 WeakPolarHBondContact CD1-O 3.36Å; Y453-M708 HydrophobicContact CD2-CE 3.75Å; Y453-M708 HydrophobicContact CE1-CE 3.88Å; Y453-M708 WeakPolarHBondContact CE1-O 3.39Å; Y453-M708 HydrophobicContact CE2-CE 3.61Å; Y453-M708 HydrophobicContact CG-CE 3.96Å; Y453-M708 HydrophobicContact CG-SD 4.42Å; L456-M708 HydrophobicContact CD2-SD 3.86Å; Q704-M708 HydrophobicContact CG-CG 4.39Å; Q704-M708 WeakPolarHBondContact O-CB 3.46Å; Q704-M708 WeakPolarHBondContact O-CG 3.37Å; Q704-M708 PolarHBondContact O-N 3.44Å; Q704-M708 VanDerWaalsContact O-N 3.17Å; S706-M708 PolarHBondContact O-N 3.08Å; S706-M708 VanDerWaalsContact O-N 3.1Å; M708-E710 PolarHBondContact O-N 3.27Å
709	E	85.8	Confident	83	Confident	101 Å²	101	67 Å²	67	47%	0.472	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-65.3	124.2	168.9	-174.5	172.7	-147	0	0	110.7	R455 S706	R455-E709 IonicContact CZ-OE2 2.84Å; R455-E709 IonicContact NE-OE2 2.73Å; R455-E709 PolarHBondContact NE-OE2 3.46Å; R455-E709 IonicContact NH2-OE2 3.42Å; R455-E709 PolarHBondContact NH2-OE2 2.8Å; S706-E709 WeakPolarHBondContact O-CB 3.4Å; S706-E709 PolarHBondContact O-N 2.78Å
710	E	84.6	Confident	82.5	Confident	21 Å²	21	66.8 Å²	66.8	10%	0.098	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-69.5	137.4	176.3	-69.6	-162.8	120.6	0	0	111.2	Y320 R452 Y453 M708 R718	Y320-E710 PolarHBondContact OH-OE1 2.98Å; Y320-E710 PolarHBondContact OH-OE2 3.39Å; R452-E710 IonicContact CZ-OE1 3.79Å; R452-E710 VanDerWaalsContact CZ-OE1 3.23Å; R452-E710 IonicContact NE-OE1 3.8Å; R452-E710 PolarHBondContact NE-OE1 3.07Å; R452-E710 IonicContact NH2-OE1 2.68Å; R452-E710 PolarHBondContact NH2-OE1 3.28Å; R452-E710 WeakPolarHBondContact O-CA 3.42Å; Y453-E710 HydrophobicContact CE1-CG 3.94Å; M708-E710 PolarHBondContact O-N 3.27Å; E710-R718 IonicContact OE2-CZ 2.86Å; E710-R718 IonicContact OE2-NE 2.93Å; E710-R718 PolarHBondContact OE2-NE 2.96Å; E710-R718 IonicContact OE2-NH2 3.9Å; E710-R718 PolarHBondContact OE2-NH2 2.99Å
711	S	87.5	Confident	82.1	Confident	28 Å²	28	61.6 Å²	61.6	20%	0.196	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-57.1	146.2	171.4	72.5	0	0	0	0	111.7	R452 A713 A714 T715	R452-S711 PolarHBondContact O-N 2.73Å; S711-A713 PolarHBondContact O-N 2.86Å; S711-A713 VanDerWaalsContact O-N 3.13Å; S711-A714 WeakPolarHBondContact O-CB 3.4Å; S711-A714 PolarHBondContact O-N 3.42Å; S711-A714 WeakPolarHBondContact OG-CB 3.27Å; S711-A714 PolarHBondContact OG-N 2.79Å; S711-T715 PolarHBondContact O-N 2.92Å
712	A	84.3	Confident	82.1	Confident	82 Å²	82	61 Å²	61	68%	0.678	34%	0.336	S	S	*	.	H	α-helix	trans	-55	-35.8	-178.5	0	0	0	0	0	112.5	T715 Q716	A712-T715 PolarHBondContact O-N 2.91Å; A712-Q716 VanDerWaalsContact O-CB 3.3Å; A712-Q716 WeakPolarHBondContact O-CB 3.47Å; A712-Q716 PolarHBondContact O-N 2.94Å
713	A	80.7	Confident	82.4	Confident	68 Å²	68	64.9 Å²	64.9	56%	0.562	34%	0.336	S	S	*	.	H	α-helix	trans	-68	-37.5	175.3	0	0	0	0	0	113.2	S711 R717	S711-A713 PolarHBondContact O-N 2.86Å; S711-A713 VanDerWaalsContact O-N 3.13Å; A713-R717 VanDerWaalsContact O-CB 3.31Å; A713-R717 WeakPolarHBondContact O-CB 3.28Å; A713-R717 PolarHBondContact O-N 3.17Å
714	A	79.8	Confident	82.4	Confident	23 Å²	23	61.7 Å²	61.7	19%	0.19	32%	0.318	C	S	.	.	H	α-helix	trans	-67.8	-43.4	174.1	0	0	0	0	0	111.3	R452 S711 R717 R718	R452-A714 HydrophobicContact CG-CB 4.17Å; S711-A714 WeakPolarHBondContact O-CB 3.4Å; S711-A714 PolarHBondContact O-N 3.42Å; S711-A714 WeakPolarHBondContact OG-CB 3.27Å; S711-A714 PolarHBondContact OG-N 2.79Å; A714-R717 PolarHBondContact O-N 3.37Å; A714-R718 WeakPolarHBondContact O-CB 3.37Å; A714-R718 PolarHBondContact O-N 2.79Å
715	T	81.2	Confident	82.5	Confident	38 Å²	38	60.6 Å²	60.6	23%	0.233	31%	0.313	C	S	.	.	H	α-helix	trans	-59.9	-48.8	173.7	-74.5	0	0	0	0	111.8	S711 A712 R717 R718 E719	S711-T715 PolarHBondContact O-N 2.92Å; A712-T715 PolarHBondContact O-N 2.91Å; T715-R717 PolarHBondContact O-N 3.03Å; T715-R718 PolarHBondContact O-N 3.44Å; T715-R718 PolarHBondContact OG1-NH2 3.23Å; T715-R718 VanDerWaalsContact OG1-NH2 3.15Å; T715-E719 PolarHBondContact O-N 2.81Å
716	Q	80.8	Confident	82.5	Confident	133 Å²	133	62.3 Å²	62.3	62%	0.621	32%	0.319	S	S	*	.	H	α-helix	trans	-60.4	-47.3	177.6	-177.4	179.4	-1.1	0	0	111.7	A712 R718 E719 E720	A712-Q716 VanDerWaalsContact O-CB 3.3Å; A712-Q716 WeakPolarHBondContact O-CB 3.47Å; A712-Q716 PolarHBondContact O-N 2.94Å; Q716-R718 PolarHBondContact O-N 2.73Å; Q716-E719 PolarHBondContact O-N 3.1Å; Q716-E720 WeakPolarHBondContact O-CB 3.24Å; Q716-E720 PolarHBondContact O-N 3.01Å
717	R	78.9	Confident	82.3	Confident	188 Å²	188	60.1 Å²	60.1	71%	0.709	30%	0.303	S	S	*	.	H	α-helix	trans	-60.5	-42.8	177.6	-179.4	178.2	-71.9	168	-1.8	111.9	A713 A714 T715 M721	A713-R717 VanDerWaalsContact O-CB 3.31Å; A713-R717 WeakPolarHBondContact O-CB 3.28Å; A713-R717 PolarHBondContact O-N 3.17Å; A714-R717 PolarHBondContact O-N 3.37Å; T715-R717 PolarHBondContact O-N 3.03Å; R717-M721 VanDerWaalsContact O-CB 3.26Å; R717-M721 WeakPolarHBondContact O-CB 3.37Å; R717-M721 PolarHBondContact O-N 3.43Å
718	R	82.3	Confident	82	Confident	32 Å²	32	59.8 Å²	59.8	12%	0.121	30%	0.301	C	S	.	.	H	α-helix	trans	-59.5	-46.9	175.1	171.5	175.4	51.4	64.8	-3.3	111.3	Y317 E710 A714 T715 Q716 L722	Y317-R718 VanDerWaalsContact CD1-CD 3.46Å; Y317-R718 HydrophobicContact CD1-CG 3.69Å; Y317-R718 HydrophobicContact CE1-CB 4.12Å; Y317-R718 VanDerWaalsContact CE1-CD 3.46Å; Y317-R718 HydrophobicContact CE1-CG 3.66Å; Y317-R718 HydrophobicContact CG-CG 4.22Å; E710-R718 IonicContact OE2-CZ 2.86Å; E710-R718 IonicContact OE2-NE 2.93Å; E710-R718 PolarHBondContact OE2-NE 2.96Å; E710-R718 IonicContact OE2-NH2 3.9Å; E710-R718 PolarHBondContact OE2-NH2 2.99Å; A714-R718 WeakPolarHBondContact O-CB 3.37Å; A714-R718 PolarHBondContact O-N 2.79Å; T715-R718 PolarHBondContact O-N 3.44Å; T715-R718 PolarHBondContact OG1-NH2 3.23Å; T715-R718 VanDerWaalsContact OG1-NH2 3.15Å; Q716-R718 PolarHBondContact O-N 2.73Å; R718-L722 HydrophobicContact CG-CD1 4.08Å; R718-L722 WeakPolarHBondContact O-CB 3.27Å; R718-L722 WeakPolarHBondContact O-CD1 3.43Å; R718-L722 VanDerWaalsContact O-CG 3.27Å; R718-L722 WeakPolarHBondContact O-CG 3.34Å; R718-L722 PolarHBondContact O-N 3.22Å; R718-L722 VanDerWaalsContact O-N 3.11Å
719	E	80.9	Confident	81.9	Confident	74 Å²	74	64.9 Å²	64.9	35%	0.346	32%	0.323	S	S	.	.	H	α-helix	trans	-67.8	-45.5	178.8	-76.3	-171.6	-147.6	0	0	113.4	T715 Q716 M721 L722 R723	T715-E719 PolarHBondContact O-N 2.81Å; Q716-E719 PolarHBondContact O-N 3.1Å; E719-M721 VanDerWaalsContact C-N 3.32Å; E719-M721 PolarHBondContact O-N 2.9Å; E719-L722 PolarHBondContact O-N 3.42Å; E719-R723 WeakPolarHBondContact O-CB 3.01Å; E719-R723 VanDerWaalsContact O-CG 3.22Å; E719-R723 WeakPolarHBondContact O-CG 3.44Å; E719-R723 PolarHBondContact O-N 3.32Å; E719-R723 IonicContact OE2-CZ 3.01Å; E719-R723 IonicContact OE2-NE 2.73Å; E719-R723 IonicContact OE2-NH2 2.92Å; E719-R723 PolarHBondContact OE2-NH2 3.4Å
720	E	79.6	Confident	81.7	Confident	111 Å²	111	63.4 Å²	63.4	52%	0.519	32%	0.317	S	S	.	.	H	α-helix	trans	-57.8	-45.8	177.3	-178.7	177.3	-164.2	0	0	111.1	Q716 L722 R723 M724	Q716-E720 WeakPolarHBondContact O-CB 3.24Å; Q716-E720 PolarHBondContact O-N 3.01Å; E720-L722 PolarHBondContact O-N 3.19Å; E720-R723 PolarHBondContact O-N 3.48Å; E720-M724 VanDerWaalsContact O-CB 3.29Å; E720-M724 WeakPolarHBondContact O-CB 3.42Å; E720-M724 PolarHBondContact O-N 2.66Å
721	M	80.8	Confident	81.6	Confident	33 Å²	33	62.4 Å²	62.4	16%	0.163	31%	0.312	C	S	.	.	H	α-helix	trans	-65.9	-38.3	179.2	-163.5	-174.5	72.6	0	0	112.5	L310 D313 V314 Y317 R717 E719 Y725	L310-M721 HydrophobicContact CD2-CG 3.48Å; L310-M721 VanDerWaalsContact CD2-CG 3.48Å; L310-M721 HydrophobicContact CD2-SD 4.38Å; D313-M721 HydrophobicContact CB-CE 3.64Å; D313-M721 HydrophobicContact CB-SD 3.69Å; V314-M721 HydrophobicContact CG2-CE 3.76Å; Y317-M721 HydrophobicContact CD2-CE 3.37Å; Y317-M721 HydrophobicContact CE2-CE 3.34Å; R717-M721 VanDerWaalsContact O-CB 3.26Å; R717-M721 WeakPolarHBondContact O-CB 3.37Å; R717-M721 PolarHBondContact O-N 3.43Å; E719-M721 VanDerWaalsContact C-N 3.32Å; E719-M721 PolarHBondContact O-N 2.9Å; M721-Y725 WeakPolarHBondContact O-CB 3.34Å; M721-Y725 PolarHBondContact O-N 2.8Å
722	L	81.7	Confident	81.5	Confident	45 Å²	45	62 Å²	62	24%	0.236	31%	0.308	C	S	.	.	H	α-helix	trans	-64	-48.7	172.4	-74.6	166.5	0	0	0	111.3	V314 R718 E719 E720 M724 Y725 H726	V314-L722 HydrophobicContact CG1-CD2 3.84Å; V314-L722 HydrophobicContact CG2-CD2 4.13Å; R718-L722 HydrophobicContact CG-CD1 4.08Å; R718-L722 WeakPolarHBondContact O-CB 3.27Å; R718-L722 WeakPolarHBondContact O-CD1 3.43Å; R718-L722 VanDerWaalsContact O-CG 3.27Å; R718-L722 WeakPolarHBondContact O-CG 3.34Å; R718-L722 PolarHBondContact O-N 3.22Å; R718-L722 VanDerWaalsContact O-N 3.11Å; E719-L722 PolarHBondContact O-N 3.42Å; E720-L722 PolarHBondContact O-N 3.19Å; L722-M724 VanDerWaalsContact C-N 3.31Å; L722-M724 PolarHBondContact O-N 3.38Å; L722-Y725 PolarHBondContact O-N 2.7Å; L722-H726 PolarHBondContact O-CD2 3.3Å; L722-H726 PolarHBondContact O-N 3.37Å
723	R	78.5	Confident	81.5	Confident	129 Å²	129	63.6 Å²	63.6	49%	0.487	30%	0.296	S	S	.	.	H	α-helix	trans	-57.2	-44.3	176.2	-67.1	168.9	-160.8	-162.7	8.2	111.1	V27 E719 E720 H726 A727	V27-R723 HydrophobicContact CG2-CB 4.28Å; E719-R723 WeakPolarHBondContact O-CB 3.01Å; E719-R723 VanDerWaalsContact O-CG 3.22Å; E719-R723 WeakPolarHBondContact O-CG 3.44Å; E719-R723 PolarHBondContact O-N 3.32Å; E719-R723 IonicContact OE2-CZ 3.01Å; E719-R723 IonicContact OE2-NE 2.73Å; E719-R723 IonicContact OE2-NH2 2.92Å; E719-R723 PolarHBondContact OE2-NH2 3.4Å; E720-R723 PolarHBondContact O-N 3.48Å; R723-H726 PolarHBondContact O-N 2.95Å; R723-A727 WeakPolarHBondContact O-CB 3.22Å; R723-A727 PolarHBondContact O-N 3.18Å
724	M	79.1	Confident	81.5	Confident	33 Å²	33	60.7 Å²	60.7	16%	0.163	27%	0.271	C	S	.	.	H	α-helix	trans	-62.1	-45.1	176.9	-175.1	70.9	73.6	0	0	112.6	V27 L29 Q306 L310 E720 L722 A727 C728	V27-M724 HydrophobicContact CG1-CE 3.43Å; V27-M724 VanDerWaalsContact CG1-CE 3.43Å; V27-M724 HydrophobicContact CG1-SD 3.46Å; V27-M724 WeakPolarHBondContact CG1-SD 3.4Å; L29-M724 HydrophobicContact CB-SD 4.38Å; L29-M724 HydrophobicContact CD1-CE 4.46Å; L29-M724 HydrophobicContact CD1-SD 3.97Å; L29-M724 HydrophobicContact CD2-SD 4.38Å; L29-M724 HydrophobicContact CG-SD 4.47Å; Q306-M724 PolarHBondContact NE2-SD 2.93Å; L310-M724 HydrophobicContact CD1-CB 4.19Å; L310-M724 HydrophobicContact CD1-CG 3.5Å; L310-M724 VanDerWaalsContact CD1-CG 3.5Å; L310-M724 HydrophobicContact CD2-CG 4.4Å; E720-M724 VanDerWaalsContact O-CB 3.29Å; E720-M724 WeakPolarHBondContact O-CB 3.42Å; E720-M724 PolarHBondContact O-N 2.66Å; L722-M724 VanDerWaalsContact C-N 3.31Å; L722-M724 PolarHBondContact O-N 3.38Å; M724-A727 PolarHBondContact O-N 3.4Å; M724-C728 PolarHBondContact O-N 3.02Å; M724-C728 PolarHBondContact O-SG 3.25Å
725	Y	84.2	Confident	81.5	Confident	7 Å²	7	59.8 Å²	59.8	3%	0.027	26%	0.263	C	S	.	.	H	α-helix	trans	-62.2	-45.8	176	167.6	-96.4	0	0	0	111.7	M307 L310 E311 V314 M721 L722 A727 C728 K729	M307-Y725 HydrophobicContact CG-CD2 4.18Å; M307-Y725 HydrophobicContact CG-CE2 4.11Å; L310-Y725 HydrophobicContact CB-CD2 4.23Å; E311-Y725 HydrophobicContact CB-CD2 4.44Å; E311-Y725 HydrophobicContact CB-CE2 3.88Å; E311-Y725 HydrophobicContact CG-CE2 4.2Å; E311-Y725 PolarHBondContact OE1-OH 2.8Å; V314-Y725 HydrophobicContact CB-CD2 4.41Å; V314-Y725 HydrophobicContact CB-CG 4.3Å; V314-Y725 HydrophobicContact CG1-CD1 3.89Å; V314-Y725 HydrophobicContact CG1-CD2 4.48Å; V314-Y725 HydrophobicContact CG1-CE1 4.06Å; V314-Y725 HydrophobicContact CG1-CG 4.12Å; V314-Y725 HydrophobicContact CG2-CD1 4.43Å; V314-Y725 HydrophobicContact CG2-CD2 4.34Å; V314-Y725 HydrophobicContact CG2-CG 3.94Å; M721-Y725 WeakPolarHBondContact O-CB 3.34Å; M721-Y725 PolarHBondContact O-N 2.8Å; L722-Y725 PolarHBondContact O-N 2.7Å; Y725-A727 VanDerWaalsContact C-N 3.33Å; Y725-A727 PolarHBondContact O-N 3.44Å; Y725-C728 PolarHBondContact O-N 3Å; Y725-K729 HydrophobicContact CE1-CD 4.34Å; Y725-K729 WeakPolarHBondContact O-CB 3.43Å; Y725-K729 PolarHBondContact O-N 2.87Å
726	H	82.1	Confident	81.3	Confident	104 Å²	104	59 Å²	59	48%	0.481	26%	0.262	S	S	.	.	H	α-helix	trans	-63.1	-38.3	176.3	-74.8	-66.6	0	0	0	112	L722 R723 K729 E730	L722-H726 PolarHBondContact O-CD2 3.3Å; L722-H726 PolarHBondContact O-N 3.37Å; R723-H726 PolarHBondContact O-N 2.95Å; H726-K729 PolarHBondContact O-N 3.15Å; H726-E730 WeakPolarHBondContact O-CB 3.46Å; H726-E730 PolarHBondContact O-N 3.49Å
727	A	79.4	Confident	80.7	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.008	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-46.9	174.4	0	0	0	0	0	112.5	F22 L25 V27 R723 M724 Y725 K729 E730 A731	F22-A727 HydrophobicContact CD1-CB 3.98Å; F22-A727 HydrophobicContact CE1-CB 3.66Å; L25-A727 HydrophobicContact CB-CB 4.42Å; L25-A727 HydrophobicContact CD1-CB 3.47Å; L25-A727 VanDerWaalsContact CD1-CB 3.47Å; V27-A727 HydrophobicContact CG2-CB 4.13Å; R723-A727 WeakPolarHBondContact O-CB 3.22Å; R723-A727 PolarHBondContact O-N 3.18Å; M724-A727 PolarHBondContact O-N 3.4Å; Y725-A727 VanDerWaalsContact C-N 3.33Å; Y725-A727 PolarHBondContact O-N 3.44Å; A727-K729 VanDerWaalsContact C-N 3.33Å; A727-K729 PolarHBondContact O-N 2.87Å; A727-E730 PolarHBondContact O-N 3.11Å; A727-A731 VanDerWaalsContact O-CB 3.26Å; A727-A731 WeakPolarHBondContact O-CB 3.37Å; A727-A731 PolarHBondContact O-N 3.08Å
728	C	82.3	Confident	80	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-41.5	176.9	-63.1	0	0	0	0	111.6	L303 M307 M724 Y725 L732	L303-C728 HydrophobicContact CD2-CB 4.41Å; M307-C728 HydrophobicContact CB-CB 3.95Å; M307-C728 HydrophobicContact CG-CB 4.35Å; M724-C728 PolarHBondContact O-N 3.02Å; M724-C728 PolarHBondContact O-SG 3.25Å; Y725-C728 PolarHBondContact O-N 3Å; C728-L732 WeakPolarHBondContact O-CB 3.36Å; C728-L732 WeakPolarHBondContact O-CD1 3.48Å; C728-L732 VanDerWaalsContact O-CG 3.23Å; C728-L732 WeakPolarHBondContact O-CG 3.17Å; C728-L732 PolarHBondContact O-N 3.33Å
729	K	85	Confident	78.8	Confident	111 Å²	111	50.2 Å²	50.2	48%	0.483	24%	0.242	S	C	.	.	H	α-helix	trans	-66.6	-44.7	179.6	-174.5	172	-177.7	171.9	0	112.8	M307 Y725 H726 A727 L732 R733	M307-K729 HydrophobicContact SD-CB 4.18Å; M307-K729 HydrophobicContact SD-CG 4.4Å; Y725-K729 HydrophobicContact CE1-CD 4.34Å; Y725-K729 WeakPolarHBondContact O-CB 3.43Å; Y725-K729 PolarHBondContact O-N 2.87Å; H726-K729 PolarHBondContact O-N 3.15Å; A727-K729 VanDerWaalsContact C-N 3.33Å; A727-K729 PolarHBondContact O-N 2.87Å; K729-L732 PolarHBondContact O-N 3.25Å; K729-R733 PolarHBondContact O-N 2.84Å
730	E	81.3	Confident	77.4	Confident	71 Å²	71	54.5 Å²	54.5	33%	0.332	26%	0.264	S	S	.	.	H	α-helix	trans	-67.8	-39.8	178.2	-180	58.2	-170.5	0	0	111.5	A21 H726 A727 L732 R733 I734	A21-E730 HydrophobicContact CB-CG 4.47Å; H726-E730 WeakPolarHBondContact O-CB 3.46Å; H726-E730 PolarHBondContact O-N 3.49Å; A727-E730 PolarHBondContact O-N 3.11Å; E730-L732 PolarHBondContact O-N 3.16Å; E730-R733 WeakPolarHBondContact O-CB 3.42Å; E730-R733 PolarHBondContact O-N 2.86Å; E730-R733 IonicContact OE1-CZ 2.8Å; E730-R733 IonicContact OE1-NE 2.83Å; E730-R733 PolarHBondContact OE1-NE 3.34Å; E730-R733 IonicContact OE1-NH2 3.86Å; E730-R733 PolarHBondContact OE1-NH2 2.87Å; E730-R733 IonicContact OE2-CZ 3.47Å; E730-R733 IonicContact OE2-NE 2.67Å; E730-R733 PolarHBondContact OE2-NE 2.9Å; E730-R733 IonicContact OE2-NH2 3.73Å; E730-I734 HydrophobicContact CG-CD1 3.96Å; E730-I734 WeakPolarHBondContact O-CB 3.4Å; E730-I734 WeakPolarHBondContact O-CG1 3.48Å; E730-I734 PolarHBondContact O-N 3.4Å
731	A	82.1	Confident	76	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.1	-42.3	172.7	0	0	0	0	0	112.7	L18 F22 L303 A727 R733 I734 I735	L18-A731 HydrophobicContact CD2-CB 3.62Å; F22-A731 HydrophobicContact CE2-CB 3.63Å; F22-A731 HydrophobicContact CZ-CB 3.42Å; F22-A731 VanDerWaalsContact CZ-CB 3.42Å; L303-A731 HydrophobicContact CD1-CB 3.94Å; L303-A731 HydrophobicContact CD2-CB 4.38Å; A727-A731 VanDerWaalsContact O-CB 3.26Å; A727-A731 WeakPolarHBondContact O-CB 3.37Å; A727-A731 PolarHBondContact O-N 3.08Å; A731-R733 VanDerWaalsContact C-N 3.31Å; A731-R733 PolarHBondContact O-N 3.4Å; A731-I734 PolarHBondContact O-N 2.91Å; A731-I735 VanDerWaalsContact O-CG1 3.24Å; A731-I735 WeakPolarHBondContact O-CG1 3.44Å; A731-I735 PolarHBondContact O-N 2.7Å
732	L	86.1	Confident	74.5	Confident	19 Å²	19	52.7 Å²	52.7	10%	0.099	27%	0.265	C	S	.	.	H	α-helix	trans	-67.2	-30.8	176.1	-73.4	164.8	0	0	0	112.9	R300 L303 Q304 M307 C728 K729 E730 G736	R300-L732 HydrophobicContact CG-CD2 3.96Å; L303-L732 HydrophobicContact CB-CD1 4.37Å; L303-L732 HydrophobicContact CB-CD2 3.85Å; L303-L732 HydrophobicContact CB-CG 4.01Å; Q304-L732 HydrophobicContact CB-CD1 4.34Å; Q304-L732 HydrophobicContact CB-CD2 4.14Å; M307-L732 HydrophobicContact CB-CD1 3.92Å; M307-L732 HydrophobicContact CE-CD1 4.28Å; M307-L732 HydrophobicContact CG-CD1 4.31Å; M307-L732 HydrophobicContact SD-CD1 3.61Å; C728-L732 WeakPolarHBondContact O-CB 3.36Å; C728-L732 WeakPolarHBondContact O-CD1 3.48Å; C728-L732 VanDerWaalsContact O-CG 3.23Å; C728-L732 WeakPolarHBondContact O-CG 3.17Å; C728-L732 PolarHBondContact O-N 3.33Å; K729-L732 PolarHBondContact O-N 3.25Å; E730-L732 PolarHBondContact O-N 3.16Å; L732-G736 PolarHBondContact O-N 3.24Å
733	R	84.7	Confident	72.6	Confident	115 Å²	115	53.3 Å²	53.3	43%	0.434	28%	0.277	S	S	.	.	H	α-helix	trans	-64.3	-54.6	170.9	-168.2	-167.3	68.2	66.8	5.2	110.5	K729 E730 A731 I735 G736 D737	K729-R733 PolarHBondContact O-N 2.84Å; E730-R733 WeakPolarHBondContact O-CB 3.42Å; E730-R733 PolarHBondContact O-N 2.86Å; E730-R733 IonicContact OE1-CZ 2.8Å; E730-R733 IonicContact OE1-NE 2.83Å; E730-R733 PolarHBondContact OE1-NE 3.34Å; E730-R733 IonicContact OE1-NH2 3.86Å; E730-R733 PolarHBondContact OE1-NH2 2.87Å; E730-R733 IonicContact OE2-CZ 3.47Å; E730-R733 IonicContact OE2-NE 2.67Å; E730-R733 PolarHBondContact OE2-NE 2.9Å; E730-R733 IonicContact OE2-NH2 3.73Å; A731-R733 VanDerWaalsContact C-N 3.31Å; A731-R733 PolarHBondContact O-N 3.4Å; R733-I735 VanDerWaalsContact C-N 3.31Å; R733-I735 PolarHBondContact O-N 3.2Å; R733-G736 WeakPolarHBondContact O-CA 3.47Å; R733-G736 PolarHBondContact O-N 3.13Å; R733-D737 IonicContact CZ-OD2 3.53Å; R733-D737 IonicContact NH1-OD2 3.81Å; R733-D737 PolarHBondContact NH1-OD2 3.14Å; R733-D737 PolarHBondContact O-N 3.19Å
734	I	79.8	Confident	70.7	Confident	7 Å²	7	52.8 Å²	52.8	4%	0.036	29%	0.293	C	S	.	.	H	α-helix	trans	-53.4	-44.7	177.5	-72	165.5	0	0	0	111.5	L14 Q17 L18 A21 E730 A731 G736	L14-I734 HydrophobicContact CD1-CG2 3.45Å; L14-I734 VanDerWaalsContact CD1-CG2 3.45Å; L14-I734 WeakPolarHBondContact CD1-O 3.33Å; Q17-I734 HydrophobicContact CB-CD1 4.44Å; Q17-I734 HydrophobicContact CB-CG2 3.92Å; L18-I734 HydrophobicContact CD2-CB 4.03Å; L18-I734 HydrophobicContact CD2-CG2 3.69Å; L18-I734 HydrophobicContact CG-CG2 3.88Å; A21-I734 HydrophobicContact CB-CD1 4.07Å; E730-I734 HydrophobicContact CG-CD1 3.96Å; E730-I734 WeakPolarHBondContact O-CB 3.4Å; E730-I734 WeakPolarHBondContact O-CG1 3.48Å; E730-I734 PolarHBondContact O-N 3.4Å; A731-I734 PolarHBondContact O-N 2.91Å; I734-G736 PolarHBondContact O-N 2.85Å
735	I	80.1	Confident	68.8	Low	5 Å²	5	52.9 Å²	52.9	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-35.5	175	-65.1	171.2	0	0	0	112.2	L18 L296 R300 L303 A731 R733 S739	L18-I735 HydrophobicContact CD1-CD1 4.19Å; L18-I735 HydrophobicContact CD1-CG1 4.01Å; L18-I735 HydrophobicContact CD2-CD1 4.41Å; L18-I735 HydrophobicContact CD2-CG1 4.15Å; L296-I735 HydrophobicContact CD1-CD1 4.05Å; L296-I735 HydrophobicContact CD1-CG1 3.98Å; L296-I735 HydrophobicContact CD1-CG2 4.15Å; L296-I735 HydrophobicContact CG-CG2 4.4Å; R300-I735 HydrophobicContact CB-CG2 4.25Å; R300-I735 HydrophobicContact CG-CG2 4.18Å; L303-I735 HydrophobicContact CD1-CD1 3.77Å; A731-I735 VanDerWaalsContact O-CG1 3.24Å; A731-I735 WeakPolarHBondContact O-CG1 3.44Å; A731-I735 PolarHBondContact O-N 2.7Å; R733-I735 VanDerWaalsContact C-N 3.31Å; R733-I735 PolarHBondContact O-N 3.2Å; I735-S739 WeakPolarHBondContact O-CB 3.5Å; I735-S739 PolarHBondContact O-N 2.91Å; I735-S739 VanDerWaalsContact O-N 3.11Å
736	G	76.7	Confident	66.4	Low	21 Å²	21	59.1 Å²	59.1	22%	0.216	33%	0.332	C	S	.	.	H	α-helix	trans	-63.7	-49	178	0	0	0	0	0	113	L732 R733 I734 V738 S739 M740	L732-G736 PolarHBondContact O-N 3.24Å; R733-G736 WeakPolarHBondContact O-CA 3.47Å; R733-G736 PolarHBondContact O-N 3.13Å; I734-G736 PolarHBondContact O-N 2.85Å; G736-V738 VanDerWaalsContact C-N 3.27Å; G736-V738 PolarHBondContact O-N 3.03Å; G736-S739 PolarHBondContact O-N 2.7Å; G736-M740 PolarHBondContact O-N 3.5Å; G736-M740 VanDerWaalsContact O-N 3.14Å
737	D	69.3	Low	64.2	Low	85 Å²	85	59.9 Å²	59.9	46%	0.455	34%	0.344	S	S	.	.	H	α-helix	trans	-56.5	-40.3	-177	-60.7	-18.6	0	0	0	112.1	R733 S741	R733-D737 IonicContact CZ-OD2 3.53Å; R733-D737 IonicContact NH1-OD2 3.81Å; R733-D737 PolarHBondContact NH1-OD2 3.14Å; R733-D737 PolarHBondContact O-N 3.19Å; D737-S741 PolarHBondContact O-OG 2.87Å
738	V	63	Low	61.9	Low	16 Å²	16	65.4 Å²	65.4	10%	0.097	38%	0.382	C	S	.	.	H	α-helix	trans	-84	-29.9	-179.8	-179.2	0	0	0	0	112.5	Q10 L11 L14 G736 M740 S741 T742	Q10-V738 HydrophobicContact CB-CG1 4.39Å; L11-V738 HydrophobicContact CD2-CG1 4.07Å; L14-V738 HydrophobicContact CB-CG1 4.42Å; L14-V738 HydrophobicContact CB-CG2 4.17Å; L14-V738 HydrophobicContact CD1-CB 4.02Å; L14-V738 HydrophobicContact CD1-CG2 3.79Å; L14-V738 HydrophobicContact CD2-CB 4.07Å; L14-V738 HydrophobicContact CD2-CG1 4.04Å; L14-V738 HydrophobicContact CG-CB 4.43Å; L14-V738 HydrophobicContact CG-CG2 4.38Å; G736-V738 VanDerWaalsContact C-N 3.27Å; G736-V738 PolarHBondContact O-N 3.03Å; V738-M740 VanDerWaalsContact C-N 3.3Å; V738-M740 PolarHBondContact O-N 3.28Å; V738-S741 WeakPolarHBondContact CA-OG 3.11Å; V738-S741 PolarHBondContact O-N 2.74Å; V738-S741 PolarHBondContact O-OG 2.99Å; V738-T742 HydrophobicContact CG1-CG2 3.97Å; V738-T742 WeakPolarHBondContact O-CB 3.43Å; V738-T742 WeakPolarHBondContact O-CG2 3.34Å; V738-T742 PolarHBondContact O-N 3.11Å; V738-T742 VanDerWaalsContact O-N 3.07Å; V738-T742 PolarHBondContact O-OG1 3.04Å
739	S	58.4	Low	59.5	Low	68 Å²	68	68.8 Å²	68.8	48%	0.476	41%	0.41	S	S	.	.	H	α-helix	trans	-63.9	-36	173.8	-170.1	0	0	0	0	112.1	I735 G736 T742 A743	I735-S739 WeakPolarHBondContact O-CB 3.5Å; I735-S739 PolarHBondContact O-N 2.91Å; I735-S739 VanDerWaalsContact O-N 3.11Å; G736-S739 PolarHBondContact O-N 2.7Å; S739-T742 PolarHBondContact O-OG1 3.42Å; S739-A743 PolarHBondContact O-N 2.7Å
740	M	50.7	Low	56.8	Low	164 Å²	164	68.9 Å²	68.9	81%	0.808	42%	0.422	S	S	*	.	H	α-helix	trans	-72.7	-33.1	176.7	-74.4	-166.6	163.3	0	0	113.2	G736 V738	G736-M740 PolarHBondContact O-N 3.5Å; G736-M740 VanDerWaalsContact O-N 3.14Å; V738-M740 VanDerWaalsContact C-N 3.3Å; V738-M740 PolarHBondContact O-N 3.28Å
741	S	49.7	Very low	54.4	Low	76 Å²	76	70.9 Å²	70.9	53%	0.531	44%	0.441	S	S	.	.	H	α-helix	trans	-85.5	-11.5	-179.8	46	0	0	0	0	114.4	D737 V738	D737-S741 PolarHBondContact O-OG 2.87Å; V738-S741 WeakPolarHBondContact CA-OG 3.11Å; V738-S741 PolarHBondContact O-N 2.74Å; V738-S741 PolarHBondContact O-OG 2.99Å
742	T	49.8	Very low	52	Low	29 Å²	29	77.5 Å²	77.5	18%	0.178	47%	0.474	C	S	.	.	H	α-helix	trans	-98.7	-21.7	177.7	49.2	0	0	0	0	114.8	G7 L11 V738 S739 S744 A745	G7-T742 VanDerWaalsContact O-CG2 3.31Å; G7-T742 WeakPolarHBondContact O-CG2 3.45Å; L11-T742 HydrophobicContact CD2-CG2 4.5Å; V738-T742 HydrophobicContact CG1-CG2 3.97Å; V738-T742 WeakPolarHBondContact O-CB 3.43Å; V738-T742 WeakPolarHBondContact O-CG2 3.34Å; V738-T742 PolarHBondContact O-N 3.11Å; V738-T742 VanDerWaalsContact O-N 3.07Å; V738-T742 PolarHBondContact O-OG1 3.04Å; S739-T742 PolarHBondContact O-OG1 3.42Å; T742-S744 PolarHBondContact O-N 3.41Å; T742-A745 PolarHBondContact O-N 2.7Å
743	A	42.1	Very low	49.3	Very low	58 Å²	58	84.4 Å²	84.4	48%	0.479	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-56	-34.8	-178.4	0	0	0	0	0	113.7	S739 A745 I746	S739-A743 PolarHBondContact O-N 2.7Å; A743-A745 PolarHBondContact O-N 2.89Å; A743-A745 VanDerWaalsContact O-N 3.1Å; A743-I746 WeakPolarHBondContact O-CG1 3.22Å; A743-I746 PolarHBondContact O-N 2.95Å
744	S	37.9	Very low	47	Very low	118 Å²	118	83.2 Å²	83.2	83%	0.825	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-69.1	-3.7	-176.8	-49.5	0	0	0	0	115.6	T742	T742-S744 PolarHBondContact O-N 3.41Å
745	A	41.1	Very low	44.7	Very low	36 Å²	36	90 Å²	90	30%	0.298	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-111.2	3.4	-177.4	0	0	0	0	0	114.3	T742 A743 V747	T742-A745 PolarHBondContact O-N 2.7Å; A743-A745 PolarHBondContact O-N 2.89Å; A743-A745 VanDerWaalsContact O-N 3.1Å; A745-V747 PolarHBondContact O-N 3.25Å
746	I	33.5	Very low	42.4	Very low	138 Å²	138	93 Å²	93	71%	0.708	56%	0.559	S	S	*	*			trans	-85.3	84.7	-168.8	-52.2	176.2	0	0	0	111.7	A743	A743-I746 WeakPolarHBondContact O-CG1 3.22Å; A743-I746 PolarHBondContact O-N 2.95Å
747	V	34.4	Very low	40.1	Very low	120 Å²	120	96 Å²	96	73%	0.727	58%	0.581	S	S	*	*	S	Bend	trans	-126.6	132.4	155.6	179.7	0	0	0	0	107.9	M4 A745 A749	M4-V747 WeakPolarHBondContact CE-O 3.42Å; A745-V747 PolarHBondContact O-N 3.25Å; V747-A749 PolarHBondContact O-N 2.72Å; V747-A749 VanDerWaalsContact O-N 3.09Å
748	S	32	Very low	38.2	Very low	116 Å²	116	97.9 Å²	97.9	81%	0.811	60%	0.598	S	S	*	*			trans	-60.3	109.5	-163.9	-53.7	0	0	0	0	114.2
749	A	32.1	Very low	36.7	Very low	72 Å²	72	101 Å²	101	60%	0.595	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-75	128	156.7	0	0	0	0	0	108.7	M4 V747	M4-A749 HydrophobicContact CE-CB 4.12Å; V747-A749 PolarHBondContact O-N 2.72Å; V747-A749 VanDerWaalsContact O-N 3.09Å
750	P	27.7	Very low	35.4	Very low	112 Å²	112	107.1 Å²	107.1	73%	0.727	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-66.5	149.7	177.5	28.2	-34.4	0	0	0	110.7	M752	P750-M752 PolarHBondContact O-N 2.74Å
751	P	32.5	Very low	34.5	Very low	113 Å²	113	105.2 Å²	105.2	73%	0.734	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-62	133.4	173.5	27.4	-33.9	0	0	0	109.5	Q753	P751-Q753 VanDerWaalsContact C-N 3.33Å; P751-Q753 PolarHBondContact O-N 3.22Å
752	M	31.2	Very low	33.5	Very low	140 Å²	140	113 Å²	113	69%	0.69	66%	0.656	S	S	*	*			trans	-67.3	99.5	165	-71.1	-155	-50.3	0	0	108.1	P750 I754	P750-M752 PolarHBondContact O-N 2.74Å; M752-I754 PolarHBondContact O-N 3.37Å; M752-I754 VanDerWaalsContact O-N 3.1Å
753	Q	28.3	Very low	32.5	Very low	163 Å²	163	115.6 Å²	115.6	76%	0.762	68%	0.681	S	S	*	*			trans	-60	111.1	158.4	-70.4	177	-20	0	0	106.7	P751 D755	P751-Q753 VanDerWaalsContact C-N 3.33Å; P751-Q753 PolarHBondContact O-N 3.22Å; Q753-D755 PolarHBondContact O-N 3.01Å
754	I	37.8	Very low	31.9	Very low	91 Å²	91	121.9 Å²	121.9	47%	0.467	70%	0.697	S	S	.	*			trans	-64.4	125.2	148.4	-57	175.1	0	0	0	103.8	M752 I756	M752-I754 PolarHBondContact O-N 3.37Å; M752-I754 VanDerWaalsContact O-N 3.1Å; I754-I756 HydrophobicContact CB-CD1 4.46Å; I754-I756 HydrophobicContact CB-CG1 4.28Å; I754-I756 HydrophobicContact CG2-CG1 4.05Å; I754-I756 PolarHBondContact O-N 3.28Å
755	D	30.2	Very low	31.6	Very low	150 Å²	150	122.2 Å²	122.2	80%	0.802	70%	0.697	S	S	*	*			trans	-68	72.2	-178	-69.5	-55.1	0	0	0	111.9	Q753 A757	Q753-D755 PolarHBondContact O-N 3.01Å; D755-A757 PolarHBondContact O-N 2.99Å
756	I	31.6	Very low	31	Very low	67 Å²	67	129.1 Å²	129.1	34%	0.344	72%	0.723	S	S	.	*			trans	-83.8	92.7	172.9	-59.9	171.3	0	0	0	106.1	I754	I754-I756 HydrophobicContact CB-CD1 4.46Å; I754-I756 HydrophobicContact CB-CG1 4.28Å; I754-I756 HydrophobicContact CG2-CG1 4.05Å; I754-I756 PolarHBondContact O-N 3.28Å
757	A	29.5	Very low	30.8	Very low	83 Å²	83	129.4 Å²	129.4	69%	0.686	73%	0.726	S	S	*	*			trans	-49.4	130.7	166.7	0	0	0	0	0	108.9	D755 S759	D755-A757 PolarHBondContact O-N 2.99Å; A757-S759 PolarHBondContact O-N 2.76Å
758	P	30	Very low	30.6	Very low	126 Å²	126	130.9 Å²	130.9	82%	0.818	74%	0.735	S	S	*	*			trans	-64	109.3	-165.5	22.9	-33.5	0	0	0	111.1	K760	P758-K760 PolarHBondContact O-N 2.84Å
759	S	30.3	Very low	30.5	Very low	82 Å²	82	132 Å²	132	57%	0.573	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-62.1	121	174.8	43	0	0	0	0	109.6	A757	A757-S759 PolarHBondContact O-N 2.76Å
760	K	30.9	Very low	30.6	Very low	196 Å²	196	133.9 Å²	133.9	85%	0.852	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-59.5	139.1	174.2	-72.8	-177.1	176.5	179.1	0	109.1	P758	P758-K760 PolarHBondContact O-N 2.84Å
761	P	31.5	Very low	30.6	Very low	124 Å²	124	134.5 Å²	134.5	81%	0.805	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-53.8	143.3	174.6	-26.6	35.2	0	0	0	111.8	A763	P761-A763 PolarHBondContact O-N 3.1Å
762	W	29.4	Very low	30.2	Very low	239 Å²	239	140.6 Å²	140.6	91%	0.905	75%	0.749	S	S	*	*			trans	-60.9	109.1	-176.9	-155.4	-72.4	0	0	0	110.3
763	A	29.4	Very low	30.2	Very low	83 Å²	83	140 Å²	140	69%	0.686	76%	0.755	S	S	*	*			trans	-64.6	138.5	173.1	0	0	0	0	0	109.4	P761	P761-A763 PolarHBondContact O-N 3.1Å
764	K	29.6	Very low	30.1	Very low	190 Å²	190	140 Å²	140	83%	0.826	76%	0.759	S	S	*	*			trans	-63.7	145.7	177.1	-67.9	-175.1	-178	-177.9	0	109.7	E766	K764-E766 PolarHBondContact O-N 3.25Å
765	P	30.4	Very low	29.6	Very low	126 Å²	126	140.3 Å²	140.3	82%	0.818	78%	0.775	S	S	*	*			trans	-72.7	113.8	-171.8	28.5	-34.6	0	0	0	111.5
766	E	28.1	Very low	29.6	Very low	181 Å²	181	138 Å²	138	85%	0.846	78%	0.777	S	S	*	*			trans	-107.4	110.9	167.5	-70.6	-168.8	153.2	0	0	110.5	K764	K764-E766 PolarHBondContact O-N 3.25Å
767	N	30.9	Very low	29.3	Very low	144 Å²	144	143.2 Å²	143.2	77%	0.77	81%	0.806	S	S	*	*			trans	29.1	90.6	153.6	-61.2	-21	0	0	0	118.4	I769	N767-I769 PolarHBondContact O-N 3.31Å
768	V	28.6	Very low	29.2	Very low	150 Å²	150	142.9 Å²	142.9	91%	0.909	81%	0.81	S	S	*	*			trans	-72.1	113.7	158.6	179.1	0	0	0	0	109.2
769	I	30.3	Very low	29.1	Very low	140 Å²	140	143 Å²	143	72%	0.718	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-101.9	143.6	175.4	-72.1	178.8	0	0	0	108.5	N767	N767-I769 PolarHBondContact O-N 3.31Å
770	P	33.5	Very low	28.9	Very low	112 Å²	112	145 Å²	145	73%	0.727	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-71.6	169.9	-158.2	25.7	-35.6	0	0	0	116.6
771	P	29.1	Very low	28.7	Very low	125 Å²	125	141 Å²	141	81%	0.812	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-78.9	159.8	-156.5	30.9	-37	0	0	0	116.1
772	R	24.6	Very low	28.7	Very low	241 Å²	241	140.3 Å²	140.3	91%	0.909	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-82.5	134.6	-178.4	-75.3	-176.1	167.6	-150.3	-3	113.8
773	P	29.9	Very low	28.6	Very low	127 Å²	127	133.4 Å²	133.4	83%	0.825	81%	0.805	S	S	*	*			trans	-72.1	174.8	159.4	-17.8	33.1	0	0	0	113.5
774	I	27.5	Very low	28.4	Very low	163 Å²	163	137.4 Å²	137.4	84%	0.836	81%	0.814	S	S	*	*			trans	-107.8	136.8	-170	-65.5	173.2	0	0	0	112.3
775	A	25.7	Very low	28.4	Very low	97 Å²	97	134 Å²	134	80%	0.802	81%	0.812	S	S	*	*			trans	44.5	122.6	157	0	0	0	0	0	122.4
776	A	30.5	Very low	28.2	Very low	103 Å²	103	139.4 Å²	139.4	85%	0.851	82%	0.816	S	S	*	*			trans	-160.1	160.6	134.2	0	0	0	0	0	110.6
777	N	25.9	Very low	27.9	Very low	176 Å²	176	137 Å²	137	94%	0.941	81%	0.813	S	S	*	*			trans	-93.6	149.9	-177.2	-63.9	-37	0	0	0	112.9
778	G	26.8	Very low	28	Very low	76 Å²	76	134.9 Å²	134.9	78%	0.784	82%	0.816	S	S	*	*			trans	163.7	123	168.1	0	0	0	0	0	114.4
779	P	28.6	Very low	27.9	Very low	127 Å²	127	133 Å²	133	83%	0.825	81%	0.809	S	S	*	*			trans	-118	138.1	-174.7	38.1	-28.3	0	0	0	116.3
780	S	26.5	Very low	27.9	Very low	124 Å²	124	133.7 Å²	133.7	87%	0.867	81%	0.814	S	S	*	*			trans	-173	155.6	144.2	52.6	0	0	0	0	113.4
781	S	25.8	Very low	28.3	Very low	112 Å²	112	133.8 Å²	133.8	78%	0.783	82%	0.815	S	S	*	*			trans	-85.3	-170.4	179.5	-41.7	0	0	0	0	112.5
782	P	32.3	Very low	28.5	Very low	111 Å²	111	131.6 Å²	131.6	72%	0.721	82%	0.815	S	S	*	*			cis	-143.3	167.9	-0.2	42.7	-23.3	0	0	0	119.3
783	S	26.7	Very low	28.6	Very low	94 Å²	94	125 Å²	125	66%	0.657	81%	0.812	S	S	*	*			trans	52.7	121.5	139.5	66.2	0	0	0	0	126.1
784	L	24.8	Very low	28.7	Very low	166 Å²	166	126.2 Å²	126.2	87%	0.869	82%	0.817	S	S	*	*			trans	63.3	171.2	133.2	-63.1	173.7	0	0	0	119.2
785	P	30.6	Very low	28.5	Very low	120 Å²	120	129.3 Å²	129.3	78%	0.779	82%	0.818	S	S	*	*			cis	-118.9	153.2	-2.6	42.8	-29.4	0	0	0	113.9
786	R	25.4	Very low	28.5	Very low	238 Å²	238	129.1 Å²	129.1	90%	0.898	82%	0.817	S	S	*	*				87.2	108	74.3	-160.7	-175.9	175.4	-179.1	-0.8	117.3
787	V	22.3	Very low	28.2	Very low	130 Å²	130	129.4 Å²	129.4	79%	0.788	81%	0.808	S	S	*	*			trans	-14.6	140.6	158.8	-177.7	0	0	0	0	119.9
788	A	33.4	Very low	28.1	Very low	101 Å²	101	126.2 Å²	126.2	84%	0.835	81%	0.806	S	S	*	*			trans	-135.5	168	151.3	0	0	0	0	0	110.7
789	S	24.7	Very low	28.2	Very low	110 Å²	110	127.2 Å²	127.2	77%	0.769	81%	0.807	S	S	*	*			trans	-154.9	-169.6	-167.9	62.1	0	0	0	0	113.9
790	N	31.1	Very low	28	Very low	154 Å²	154	126.3 Å²	126.3	82%	0.824	81%	0.81	S	S	*	*			trans	92.2	166.4	165.2	-118.8	26.5	0	0	0	117.1
791	P	42.9	Very low	28.1	Very low	115 Å²	115	124.1 Å²	124.1	75%	0.747	81%	0.807	S	S	*	*				-138.3	-168.3	-107.4	42.9	-22.9	0	0	0	115.6
792	G	32	Very low	28	Very low	79 Å²	79	125.6 Å²	125.6	81%	0.814	81%	0.806	S	S	*	*			trans	-153.7	137	167.9	0	0	0	0	0	114
793	A	27.5	Very low	27.5	Very low	102 Å²	102	131.2 Å²	131.2	84%	0.843	81%	0.813	S	S	*	*			trans	-156	149.7	176.1	0	0	0	0	0	110.6
794	V	31.6	Very low	27.9	Very low	152 Å²	152	132.1 Å²	132.1	92%	0.921	82%	0.817	S	S	*	*			trans	-143.9	134.2	-175.1	-176.6	0	0	0	0	111.9
795	R	23.3	Very low	27.8	Very low	229 Å²	229	128.7 Å²	128.7	86%	0.864	81%	0.812	S	S	*	*			trans	-163.7	133.8	172	175.2	-178.9	170.8	-171	-3.2	112.2
796	A	26.5	Very low	27.7	Very low	93 Å²	93	132.1 Å²	132.1	77%	0.769	82%	0.818	S	S	*	*			trans	-157.3	151.2	160.9	0	0	0	0	0	109.7
797	T	24.6	Very low	27.7	Very low	108 Å²	108	128.9 Å²	128.9	66%	0.663	82%	0.818	S	S	*	*			cis	102.9	62.8	2.4	77.7	0	0	0	0	120.5
798	A	22.8	Very low	27.8	Very low	109 Å²	109	133.3 Å²	133.3	90%	0.901	82%	0.822	S	S	*	*			trans	56.9	137.7	130.5	0	0	0	0	0	124.2
799	A	29.4	Very low	27.5	Very low	97 Å²	97	134.6 Å²	134.6	80%	0.802	82%	0.821	S	S	*	*			trans	-156	146.8	153	0	0	0	0	0	107.8
800	A	24.4	Very low	27.5	Very low	108 Å²	108	136.1 Å²	136.1	89%	0.893	83%	0.826	S	S	*	*			cis	101.5	113.7	18.4	0	0	0	0	0	114.8
801	G	28.5	Very low	27.3	Very low	78 Å²	78	133 Å²	133	80%	0.804	82%	0.823	S	S	*	*			trans	173	149.9	177.8	0	0	0	0	0	112.3
802	N	22.5	Very low	26.5	Very low	144 Å²	144	133.9 Å²	133.9	77%	0.77	83%	0.828	S	S	*	*			trans	-151.3	134	-162.6	-138.4	26.5	0	0	0	114
803	W	23.7	Very low	26.1	Very low	228 Å²	228	136.2 Å²	136.2	86%	0.864	83%	0.827	S	S	*	*			trans	63.6	170.8	160.8	-73	53.3	0	0	0	117.7
804	P	34.9	Very low	25.9	Very low	113 Å²	113	136.9 Å²	136.9	73%	0.734	83%	0.825	S	S	*	*			cis	-120.4	-171.7	-5	42.4	-28.5	0	0	0	114.1
805	A	21.8	Very low	25.7	Very low	94 Å²	94	134.5 Å²	134.5	78%	0.777	82%	0.821	S	S	*	*			trans	-106.4	151.2	173.4	0	0	0	0	0	112.8
806	Q	27.8	Very low	25.7	Very low	193 Å²	193	127.9 Å²	127.9	90%	0.902	82%	0.816	S	S	*	*			trans	-141.1	164	165.9	-81.5	-153.7	-47.7	0	0	112.8
807	L	25.6	Very low	25.5	Very low	170 Å²	170	128.1 Å²	128.1	89%	0.89	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-82.3	158.4	-157	-68.5	153.5	0	0	0	115.4
808	Y	24.3	Very low	25.7	Very low	222 Å²	222	129 Å²	129	87%	0.871	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-74.6	144.4	171.5	-65.1	-93.6	0	0	0	112.4
809	P	28.5	Very low	25.7	Very low	128 Å²	128	128.9 Å²	128.9	83%	0.831	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-81.5	132.1	169.7	32.3	-32.5	0	0	0	111.9
810	T	25.1	Very low	25.5	Very low	142 Å²	142	131 Å²	131	87%	0.871	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-83.9	141.6	175.5	48.5	0	0	0	0	112.4
811	A	25.1	Very low	25.7	Very low	90 Å²	90	131.8 Å²	131.8	74%	0.744	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-74.6	153.5	178.3	0	0	0	0	0	113.2
812	P	27.8	Very low	25.3	Very low	132 Å²	132	132.3 Å²	132.3	86%	0.857	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-78.8	149.1	-175.2	-11.8	29.3	0	0	0	113.8
813	T	23.1	Very low	25.4	Very low	129 Å²	129	133.2 Å²	133.2	79%	0.791	82%	0.821	S	S	*	*			trans	-104.5	136.5	178.3	47.3	0	0	0	0	113.2
814	S	22.7	Very low	25.7	Very low	115 Å²	115	127.7 Å²	127.7	80%	0.804	81%	0.814	S	S	*	*			trans	41.2	111.5	148.1	61.8	0	0	0	0	120.3
815	A	27.4	Very low	25.2	Very low	103 Å²	103	130 Å²	130	85%	0.851	82%	0.819	S	S	*	*			trans	-131.2	153.7	138.3	0	0	0	0	0	107.9
816	A	23.6	Very low	25.5	Very low	90 Å²	90	131.4 Å²	131.4	74%	0.744	82%	0.82	S	S	*	*			cis	165.6	138.7	-27.1	0	0	0	0	0	104.9
817	A	23.1	Very low	25.3	Very low	97 Å²	97	131 Å²	131	80%	0.802	82%	0.815	S	S	*	*			trans	54.8	118.5	167.9	0	0	0	0	0	119.8
818	S	28.6	Very low	25.5	Very low	128 Å²	128	129.2 Å²	129.2	90%	0.895	81%	0.805	S	S	*	*				-169.4	159.4	106.8	-79.3	0	0	0	0	110.9
819	S	22.8	Very low	25.7	Very low	105 Å²	105	124.9 Å²	124.9	73%	0.734	80%	0.804	S	S	*	*			trans	-151.4	146.7	-164	57.8	0	0	0	0	113.3
820	V	24.5	Very low	25.3	Very low	141 Å²	141	123.5 Å²	123.5	86%	0.855	80%	0.798	S	S	*	*			trans	70.9	141.4	165.1	172.4	0	0	0	0	112.5
821	P	27.8	Very low	25.3	Very low	126 Å²	126	128.3 Å²	128.3	82%	0.818	80%	0.8	S	S	*	*			cis	-128.4	174.4	33.1	41.7	-26.4	0	0	0	117.9
822	A	20.8	Very low	25.4	Very low	88 Å²	88	129.8 Å²	129.8	73%	0.727	80%	0.802	S	S	*	*			trans	-135.2	142	169.3	0	0	0	0	0	110.5
823	N	25.3	Very low	25.4	Very low	164 Å²	164	128 Å²	128	88%	0.877	80%	0.798	S	S	*	*			trans	177.5	156.6	166.8	-100.1	-28.5	0	0	0	109.5
824	P	29.7	Very low	25.6	Very low	112 Å²	112	127.9 Å²	127.9	73%	0.727	80%	0.799	S	S	*	*			cis	-127.3	166.9	-42.4	37.3	-22.7	0	0	0	112.1
825	I	24.1	Very low	26	Very low	162 Å²	162	129.1 Å²	129.1	83%	0.831	80%	0.802	S	S	*	*			trans	-99.5	127.2	-177.4	-63.8	170.9	0	0	0	111.6
826	P	29.1	Very low	25.8	Very low	122 Å²	122	131.3 Å²	131.3	79%	0.792	80%	0.799	S	S	*	*			trans	-70.2	159	172.3	-18.9	32.9	0	0	0	114.1
827	K	22.1	Very low	25.9	Very low	186 Å²	186	133.6 Å²	133.6	81%	0.809	80%	0.799	S	S	*	*			trans	-122.4	136.8	-174.7	-84.9	-176.7	175.1	179.3	0	114.1
828	I	30.6	Very low	26.2	Very low	131 Å²	131	138.6 Å²	138.6	67%	0.672	81%	0.805	S	S	*	*			trans	62.4	118.4	141.2	-58.5	165.3	0	0	0	116.6
829	P	27.3	Very low	26.1	Very low	131 Å²	131	137.8 Å²	137.8	85%	0.851	80%	0.8	S	S	*	*				-115.4	175.4	101	-10.6	29.6	0	0	0	114.5
830	S	22	Very low	26.5	Very low	100 Å²	100	140.9 Å²	140.9	70%	0.699	81%	0.807	S	S	*	*			trans	-148.6	162.5	179.1	-56.9	0	0	0	0	111.6
831	R	23.4	Very low	26.8	Very low	243 Å²	243	139.5 Å²	139.5	92%	0.917	80%	0.801	S	S	*	*			trans	68.5	164	-178.2	-86.8	-174.1	170.4	-171.3	-2.5	115.2
832	P	28.7	Very low	26.9	Very low	121 Å²	121	139.2 Å²	139.2	79%	0.786	80%	0.799	S	S	*	*			cis	-113.9	172	3.5	40.5	-29.8	0	0	0	115.2
833	A	26.7	Very low	27.4	Very low	94 Å²	94	140.6 Å²	140.6	78%	0.777	80%	0.801	S	S	*	*			trans	-107.7	132.3	168.1	0	0	0	0	0	110
834	P	28	Very low	27.5	Very low	126 Å²	126	141.1 Å²	141.1	82%	0.818	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-97.1	164.4	173.3	36.2	-31.7	0	0	0	113.1
835	T	30.4	Very low	27.6	Very low	141 Å²	141	143.3 Å²	143.3	87%	0.865	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-91.5	170	-163.2	46.9	0	0	0	0	115.9
836	L	23	Very low	27.8	Very low	149 Å²	149	141.3 Å²	141.3	78%	0.78	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-60.2	166.2	169.8	-141.9	76	0	0	0	113.5
837	N	26.4	Very low	27.6	Very low	138 Å²	138	145 Å²	145	74%	0.738	81%	0.811	S	S	*	*			trans	69.4	103.4	166.6	-60.5	-13.6	0	0	0	118.3
838	Q	29.6	Very low	27.9	Very low	202 Å²	202	145.7 Å²	145.7	94%	0.944	81%	0.814	S	S	*	*				-169	159.4	95.9	-98.1	178.2	35.8	0	0	112
839	S	25.6	Very low	27.8	Very low	112 Å²	112	145 Å²	145	78%	0.783	82%	0.816	S	S	*	*			trans	-99.4	143.7	-174.7	53.8	0	0	0	0	113.3
840	L	31	Very low	27.8	Very low	169 Å²	169	146.2 Å²	146.2	89%	0.885	81%	0.813	S	S	*	*			trans	-122.1	150.7	165	-77.5	170.1	0	0	0	110.5
841	P	30.8	Very low	28.1	Very low	112 Å²	112	149.4 Å²	149.4	73%	0.727	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-80.5	155.7	-166.4	31.8	-36.5	0	0	0	114.2
842	P	30.3	Very low	28.4	Very low	120 Å²	120	142.8 Å²	142.8	78%	0.779	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-77.1	141.2	-177.9	31.2	-35.3	0	0	0	113.1
843	P	31.7	Very low	28.6	Very low	117 Å²	117	142.9 Å²	142.9	76%	0.76	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-78.7	149.3	174.1	32.2	-34.5	0	0	0	112.7
844	L	27.9	Very low	28.6	Very low	176 Å²	176	145.3 Å²	145.3	92%	0.921	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-70.8	131.6	178.2	-73.3	151	0	0	0	111.8
845	I	31.4	Very low	28.9	Very low	157 Å²	157	150.1 Å²	150.1	81%	0.805	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-99.4	118.2	176.1	-58.4	177.1	0	0	0	109.4
846	P	28.3	Very low	28.9	Very low	120 Å²	120	147.3 Å²	147.3	78%	0.779	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-68.3	134.9	175.4	-20.3	33.5	0	0	0	112.4
847	Q	25.5	Very low	29.6	Very low	200 Å²	200	151 Å²	151	94%	0.935	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-71.8	142.6	173.6	-65.3	172.8	-27.2	0	0	111
848	K	27.1	Very low	29.9	Very low	201 Å²	201	152.1 Å²	152.1	87%	0.874	81%	0.812	S	S	*	*			trans	-135.1	139.6	163.9	-159.7	170.5	-176.3	179.8	0	111.3
849	V	28.4	Very low	30.1	Very low	117 Å²	117	151.9 Å²	151.9	71%	0.709	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-58.2	137.1	-167.4	179.6	0	0	0	0	113.2
850	I	27	Very low	30.6	Very low	155 Å²	155	152.5 Å²	152.5	80%	0.795	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-96.4	127.7	167.3	-60.6	171.4	0	0	0	108.3
851	H	28.5	Very low	30.9	Very low	167 Å²	167	148.7 Å²	148.7	77%	0.773	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-101.6	137.3	164.2	-78.8	-64.4	0	0	0	109.9
852	P	30.4	Very low	31.2	Very low	104 Å²	104	149.2 Å²	149.2	68%	0.675	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-94.5	145.7	-166.2	35.6	-35.5	0	0	0	114
853	P	32.2	Very low	31.4	Very low	124 Å²	124	153.2 Å²	153.2	81%	0.805	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-84.6	125.3	157	32.5	-28.6	0	0	0	110.4
854	N	27.8	Very low	31.8	Very low	144 Å²	144	155.1 Å²	155.1	77%	0.77	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-70.8	140.8	162.2	-74.5	-42.3	0	0	0	109.6
855	Y	33.7	Very low	32.6	Very low	228 Å²	228	152.2 Å²	152.2	89%	0.894	80%	0.804	S	S	*	*				-163.6	130.6	127.2	-99.5	-65.1	0	0	0	109.6
856	A	30.3	Very low	33	Very low	82 Å²	82	152.4 Å²	152.4	68%	0.678	81%	0.807	S	S	*	*			trans	-109.9	127.8	-174.8	0	0	0	0	0	111.6
857	Y	37.6	Very low	33.5	Very low	225 Å²	225	158.2 Å²	158.2	88%	0.882	81%	0.813	S	S	*	*			trans	-122.8	66.1	167.4	-91.1	-79	0	0	0	110.6	K859	Y857-K859 PolarHBondContact O-N 2.92Å
858	N	32.5	Very low	34.2	Very low	163 Å²	163	154.1 Å²	154.1	87%	0.872	80%	0.804	S	S	*	*			trans	-76.7	100.7	170.2	-86.6	-17.2	0	0	0	110.5
859	K	34.2	Very low	34.8	Very low	197 Å²	197	149.2 Å²	149.2	86%	0.857	80%	0.801	S	S	*	*			trans	-122.3	129.4	150	-78.6	-169.8	175.3	-177.2	0	108.4	Y857	Y857-K859 PolarHBondContact O-N 2.92Å
860	P	35.3	Very low	35.5	Very low	125 Å²	125	150.2 Å²	150.2	81%	0.812	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-70.8	144.4	-177.1	29.3	-34.6	0	0	0	111.4
861	A	37.4	Very low	36.4	Very low	88 Å²	88	148.9 Å²	148.9	73%	0.727	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66	147	173	0	0	0	0	0	111.3
862	P	37.5	Very low	36.9	Very low	124 Å²	124	149.8 Å²	149.8	81%	0.805	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-65.6	139	177.2	27.8	-34.4	0	0	0	111.2
863	K	35.4	Very low	37.1	Very low	203 Å²	203	155.9 Å²	155.9	88%	0.883	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-74.7	128.5	173.1	-72.5	-173	174.5	-173.4	0	110.4
864	I	39.4	Very low	37.5	Very low	158 Å²	158	155.7 Å²	155.7	81%	0.81	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-71.1	131.6	165.6	-59.7	172.4	0	0	0	107.7
865	P	45.2	Very low	38.3	Very low	115 Å²	115	163.5 Å²	163.5	75%	0.747	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-64.4	146.5	176.1	-22.5	34.1	0	0	0	113
866	D	40.4	Very low	38.5	Very low	161 Å²	161	160.3 Å²	160.3	86%	0.861	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-62.6	137.4	178	-70.5	-63.2	0	0	0	112.2
867	R	37.9	Very low	38.9	Very low	241 Å²	241	164.4 Å²	164.4	91%	0.909	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-69.3	125.4	-177.9	-165.1	-179.5	-162.2	173.7	6.6	109.8	A869	R867-A869 PolarHBondContact O-N 3.37Å
868	P	41	Very low	39	Very low	115 Å²	115	161 Å²	161	75%	0.747	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-62.2	136.1	-177.1	24.1	-33.6	0	0	0	111.5	V870	P868-V870 PolarHBondContact O-N 2.84Å
869	A	39.9	Very low	39.4	Very low	97 Å²	97	160.9 Å²	160.9	80%	0.802	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-68.7	126.6	-178.4	0	0	0	0	0	111.2	R867 T871	R867-A869 PolarHBondContact O-N 3.37Å; A869-T871 PolarHBondContact O-N 3.2Å
870	V	42.4	Very low	39.7	Very low	138 Å²	138	158.6 Å²	158.6	84%	0.836	84%	0.841	S	S	*	*			trans	-71.8	113.1	176.1	180	0	0	0	0	109	P868 Q872	P868-V870 PolarHBondContact O-N 2.84Å; V870-Q872 PolarHBondContact O-N 3.29Å
871	T	44.9	Very low	40	Very low	127 Å²	127	160.9 Å²	160.9	78%	0.779	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-67.1	123.8	173.9	42.1	0	0	0	0	110.1	A869 R873	A869-T871 PolarHBondContact O-N 3.2Å; T871-R873 PolarHBondContact O-N 3.02Å
872	Q	40.2	Very low	40.2	Very low	187 Å²	187	166.1 Å²	166.1	87%	0.874	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-67.2	127.5	176.6	-66.6	179.2	-7.9	0	0	109.3	V870	V870-Q872 PolarHBondContact O-N 3.29Å
873	R	35.2	Very low	40.4	Very low	231 Å²	231	169.3 Å²	169.3	87%	0.872	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-71.4	131.4	168.8	-69.2	-176.2	177.5	-175.3	-1.1	108.7	T871	T871-R873 PolarHBondContact O-N 3.02Å
874	P	38.7	Very low	40.8	Very low	121 Å²	121	166.5 Å²	166.5	79%	0.786	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-65	155.4	162.4	30.5	-33.6	0	0	0	109.9
875	Y	44.9	Very low	41	Very low	307 Å²	307	167.3 Å²	167.3	100%	1.204	86%	0.856	S	S	*	*			trans	-78	0	170	-84.5	-93.6	0	0	0	111.3

Retrieved 875 of 875 residues in 1841.7 ms (Link to these results)

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