A0A3Q0KR71_SCHMA Loading...

Helicase, putative

AlphaFold DB , UniProt , Accession A0A3Q0KR71, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,598 aa.

						>A0A3Q0KR71_SCHMA|A0A3Q0KR71
MSVAPVQQGPFMKDQLVQLRAQINAFKLLSKSQPVPETLLLAAEGRQLLSHAPIVMSGPPAPNVSGQQWNQSSVNSMQNVPFVGAPQSSVVQSEFHPANPALAISRVRPNIQPSLVAARIGPPVGYQSYTTSSSNGTFLPGGTGTYGRSRLTPIQRPQGLDPVELLKEREQRIQSRIAQRIKELSSLTVSSTSEQRVSLLIELRALRLLNFQRQLRQDIVSAMRRDTSLETALNVKAYRRPKKQTLREARFTEKLEKQMKHEQEKRRRQKHQEFLNAVLSHGKDFREFHRNVNSRMVKINKAVLNYKANAERDKRKEQERIDRERMRRLMAEDEEGYRCLIDAKKDQRLHHLLTQTDEFISNLTKLVREHKREQSKQRFRERSERRKFAQESALQNAVVFYRKLADDIIKNGGQPPAYFATLPSTEKFPEELNQVNRDWLCGKMSSSSIQLPDVRIPMYQTTTKEIVEGDAAPLASEVCTWLQEHQGWEILPTDTDGSVIHDLLEPDEEFKRKRKFDDDDDDDDNSMVHVGTEDDEYNKRGESGANAPQSYYTLAHAVREEVKEQASILVHGRLKEYQLRGLEWLVSLYNNNLNGILADEMGLGKTIQTIALITYLMERKRVNGPFLIIVPLSVMSNWAMEFDRWGPSVKKILYKGSPQARRLLQTQIKASKINVLLTTYEYIIKDKSALSKVKWKYMIIDEGHRMKNHHCKLTQVLNTYYTAPYRLLLTGTPLQNKLPELWALLNFLLPTIFESVNTFEQWFNAPFAATGEKVELNQEETLLIIRRLHKVLRPFLLRRLKREVESQLPEKVEYVIKCEMSDLQRVLYSHMQSKGVILTDGSEKDKKGKGGCRTLMNTIMQLRKICNHPFMFPHIEMAIAEQNFLNVHNGNPPPTLPVPTQVEGKILYRSSGKFELLDRILPKLKCCGHRVLIFCQMTSLMTIMQDYFDYRNFRYLRLDGTTRSEDRGELLVKFNDTSEDIFIFLLSTRAGGLGLNLQAADTVIIFDSDWNPHQDLQAQDRAHRIGQQNEVRVLRLISINSVEEKILAAARFKLDVDQKVIQAGMFDQKSTGTERRQFLQALLEQDEEADEEEDEAPDDETINQMLARNEEEFEIYQRLDAERQFAESQQAKREPRLMEFSELPKWIVRDDIELERSLSLEDNVFGMKRQRKEVDYSDALTERQFLKAIDEGSLEEAEERQRQKRAARKKRKRLDDSSFLDDGSSETGSVIMAAPQAAKRRRGRPPHGSSTGSTSRSSNQSVSPKLAKKLQRLLDIVIEYKDKDQRILSEPFMKLPTRKELPDYYEVIKKPVDFNRIRQRVKDGKYRSVDELEADILLLCKNAQTYNMDGSLIFEDSVVLQSVWTNARERLEEIESRQQSDSRQSSQYNSYSSQHRHVTIDDEDDEEDEQDDEDEPSETSKHAPISTGPRYVVCNTSATDVTGNTGGDGQQNIPDNSMNEDSLGGLDDLDDEEDTMDDPMEDDDSASRSSFSSKARRMSRKPTYCIARTTNSSVSVISKTHIPPGSHNHTRSLSATESRGTVGVVESIRINTSSVESILPPRKARSHKRVMMVDDSEEEDEEDSDNDAADDDPDDEDF
					

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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	38.2	Very low	45.6	Very low	242 Å²	242	139.4 Å²	139.4	100%	1.192	81%	0.81	S	S	*	*				0	149.3	0	-66.8	172.6	175.1	0	0	107.8
2	S	41.2	Very low	46.9	Very low	118 Å²	118	139.6 Å²	139.6	83%	0.825	80%	0.801	S	S	*	*			trans	40.4	114.1	172.5	-66.8	0	0	0	0	118.1
3	V	31.1	Very low	48.2	Very low	134 Å²	134	142.6 Å²	142.6	81%	0.812	80%	0.799	S	S	*	*			cis	-147	176.9	7.1	-172.6	0	0	0	0	108.7
4	A	38.6	Very low	49.8	Very low	90 Å²	90	139.7 Å²	139.7	74%	0.744	78%	0.781	S	S	*	*			trans	-76.4	-91.5	171.9	0	0	0	0	0	115.6
5	P	44.2	Very low	51.4	Low	104 Å²	104	137.6 Å²	137.6	68%	0.675	76%	0.763	S	S	*	*			trans	-70.8	137.4	-152	-14.3	31.9	0	0	0	112.5
6	V	43.7	Very low	53.1	Low	128 Å²	128	132.9 Å²	132.9	78%	0.776	74%	0.736	S	S	*	*				62	113	63.7	179.6	0	0	0	0	113.4
7	Q	44.8	Very low	54.5	Low	194 Å²	194	129.9 Å²	129.9	91%	0.907	72%	0.721	S	S	*	*			trans	-160.6	176.3	144.2	-106.8	159	29.9	0	0	110.5
8	Q	44.3	Very low	56.1	Low	198 Å²	198	126.3 Å²	126.3	93%	0.925	70%	0.698	S	S	*	*			trans	-106.5	166.4	-150.8	-66.5	165.4	-26.7	0	0	114.9
9	G	54.2	Low	57.6	Low	57 Å²	57	124.3 Å²	124.3	59%	0.588	69%	0.686	S	S	*	*			trans	-152.2	171.5	-178.3	0	0	0	0	0	113.7	F11	G9-F11 PolarHBondContact O-N 3.04Å
10	P	61.4	Low	58.8	Low	140 Å²	140	126.1 Å²	126.1	91%	0.909	68%	0.682	S	S	*	*	S	Bend	trans	-82.1	5.1	-149.6	30.8	-38.3	0	0	0	118.2
11	F	59.9	Low	59.8	Low	128 Å²	128	120.3 Å²	120.3	56%	0.561	65%	0.651	S	S	*	*	S	Bend	trans	-108.4	137	171.6	-85.5	-82.3	0	0	0	110.5	G9 K13 Q15 L16	G9-F11 PolarHBondContact O-N 3.04Å; F11-K13 PolarHBondContact O-N 3.19Å; F11-Q15 HydrophobicContact CD1-CB 4.44Å; F11-L16 HydrophobicContact CB-CB 4.43Å; F11-L16 HydrophobicContact CB-CD1 3.93Å; F11-L16 HydrophobicContact CD2-CD1 3.87Å; F11-L16 HydrophobicContact CG-CD1 3.89Å
12	M	60.8	Low	62	Low	142 Å²	142	113 Å²	113	70%	0.7	61%	0.614	S	S	*	*			trans	-57.3	131.8	163	-74.3	-64.8	-174	0	0	108.8	D14 Q15 L16	M12-D14 PolarHBondContact O-N 3.42Å; M12-D14 VanDerWaalsContact O-N 3.09Å; M12-Q15 HydrophobicContact CB-CG 4.22Å; M12-Q15 WeakPolarHBondContact O-CB 3.32Å; M12-Q15 PolarHBondContact O-N 2.95Å; M12-L16 PolarHBondContact O-N 2.97Å
13	K	64.6	Low	64.1	Low	179 Å²	179	111.1 Å²	111.1	78%	0.778	59%	0.594	S	S	*	*	H	α-helix	trans	-56.4	-36.4	-167	-147.3	173.7	-173.4	178.9	0	112.2	F11 V17	F11-K13 PolarHBondContact O-N 3.19Å; K13-V17 WeakPolarHBondContact O-CG2 3.48Å; K13-V17 PolarHBondContact O-N 3.3Å
14	D	69.8	Low	66.6	Low	102 Å²	102	108.2 Å²	108.2	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-70.3	-36.3	179	-54.5	-67.3	0	0	0	113.7	M12 L16 V17 Q18	M12-D14 PolarHBondContact O-N 3.42Å; M12-D14 VanDerWaalsContact O-N 3.09Å; D14-L16 VanDerWaalsContact C-N 3.32Å; D14-L16 PolarHBondContact O-N 3.18Å; D14-V17 WeakPolarHBondContact O-CB 3.5Å; D14-V17 PolarHBondContact O-N 3.15Å; D14-V17 VanDerWaalsContact O-N 3.12Å; D14-Q18 PolarHBondContact O-N 3.03Å
15	Q	73.8	Confident	68.6	Low	108 Å²	108	104.3 Å²	104.3	51%	0.505	54%	0.542	S	S	.	.	H	α-helix	trans	-63.4	-40.7	175.8	-69.3	177.1	-28	0	0	111.1	F11 M12 V17 Q18 L19	F11-Q15 HydrophobicContact CD1-CB 4.44Å; M12-Q15 HydrophobicContact CB-CG 4.22Å; M12-Q15 WeakPolarHBondContact O-CB 3.32Å; M12-Q15 PolarHBondContact O-N 2.95Å; Q15-V17 VanDerWaalsContact C-N 3.26Å; Q15-V17 PolarHBondContact O-N 3.25Å; Q15-Q18 PolarHBondContact O-N 3.35Å; Q15-L19 PolarHBondContact O-N 3.34Å
16	L	78.6	Confident	70.5	Confident	63 Å²	63	106.4 Å²	106.4	33%	0.33	54%	0.541	S	S	.	.	H	α-helix	trans	-67.3	-28.4	176.4	-153.3	97.8	0	0	0	112	F11 M12 D14 R20	F11-L16 HydrophobicContact CB-CB 4.43Å; F11-L16 HydrophobicContact CB-CD1 3.93Å; F11-L16 HydrophobicContact CD2-CD1 3.87Å; F11-L16 HydrophobicContact CG-CD1 3.89Å; M12-L16 PolarHBondContact O-N 2.97Å; D14-L16 VanDerWaalsContact C-N 3.32Å; D14-L16 PolarHBondContact O-N 3.18Å; L16-R20 WeakPolarHBondContact O-CB 3.4Å; L16-R20 VanDerWaalsContact O-CD 3.3Å; L16-R20 WeakPolarHBondContact O-CD 3.32Å; L16-R20 WeakPolarHBondContact O-CG 3.14Å; L16-R20 PolarHBondContact O-N 3.35Å
17	V	76.8	Confident	72.4	Confident	81 Å²	81	105.8 Å²	105.8	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-73.9	-45.7	172.8	169.2	0	0	0	0	111	K13 D14 Q15 L19 R20 A21	K13-V17 WeakPolarHBondContact O-CG2 3.48Å; K13-V17 PolarHBondContact O-N 3.3Å; D14-V17 WeakPolarHBondContact O-CB 3.5Å; D14-V17 PolarHBondContact O-N 3.15Å; D14-V17 VanDerWaalsContact O-N 3.12Å; Q15-V17 VanDerWaalsContact C-N 3.26Å; Q15-V17 PolarHBondContact O-N 3.25Å; V17-L19 PolarHBondContact O-N 2.91Å; V17-R20 PolarHBondContact O-N 3.5Å; V17-A21 PolarHBondContact O-N 3.38Å
18	Q	83.9	Confident	74.1	Confident	66 Å²	66	98.8 Å²	98.8	31%	0.308	50%	0.496	S	S	.	.	H	α-helix	trans	-59.9	-46.8	177.8	-179.2	173.9	24.8	0	0	111.9	D14 Q15 R20 A21 Q22 A42 A43	D14-Q18 PolarHBondContact O-N 3.03Å; Q15-Q18 PolarHBondContact O-N 3.35Å; Q18-R20 VanDerWaalsContact C-N 3.34Å; Q18-R20 PolarHBondContact O-N 3.43Å; Q18-A21 WeakPolarHBondContact O-CB 3.29Å; Q18-A21 PolarHBondContact O-N 2.71Å; Q18-A21 VanDerWaalsContact O-N 3.1Å; Q18-Q22 WeakPolarHBondContact O-CG 3.36Å; Q18-Q22 PolarHBondContact O-N 2.88Å; Q18-A42 WeakPolarHBondContact CA-O 3.35Å; Q18-A42 WeakPolarHBondContact CG-O 3.45Å; Q18-A43 PolarHBondContact NE2-O 2.81Å
19	L	84	Confident	75.9	Confident	88 Å²	88	94.9 Å²	94.9	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-61.7	-41.5	177.9	-177.7	63.1	0	0	0	112	Q15 V17 A21 Q22 I23	Q15-L19 PolarHBondContact O-N 3.34Å; V17-L19 PolarHBondContact O-N 2.91Å; L19-A21 VanDerWaalsContact C-N 3.3Å; L19-A21 PolarHBondContact O-N 3.14Å; L19-Q22 PolarHBondContact O-N 3.2Å; L19-I23 HydrophobicContact CD1-CD1 4.18Å; L19-I23 HydrophobicContact CG-CD1 4.02Å; L19-I23 VanDerWaalsContact O-CG1 3.31Å; L19-I23 WeakPolarHBondContact O-CG1 3.37Å; L19-I23 PolarHBondContact O-N 2.92Å
20	R	81.5	Confident	77.2	Confident	160 Å²	160	95.9 Å²	95.9	60%	0.604	48%	0.479	S	S	*	.	H	α-helix	trans	-62.6	-36.7	174.1	-75.6	171.2	178.2	-164.5	-1.9	112.1	L16 V17 Q18 N24	L16-R20 WeakPolarHBondContact O-CB 3.4Å; L16-R20 VanDerWaalsContact O-CD 3.3Å; L16-R20 WeakPolarHBondContact O-CD 3.32Å; L16-R20 WeakPolarHBondContact O-CG 3.14Å; L16-R20 PolarHBondContact O-N 3.35Å; V17-R20 PolarHBondContact O-N 3.5Å; Q18-R20 VanDerWaalsContact C-N 3.34Å; Q18-R20 PolarHBondContact O-N 3.43Å; R20-N24 WeakPolarHBondContact O-CB 3.42Å; R20-N24 PolarHBondContact O-N 2.9Å; R20-N24 VanDerWaalsContact O-N 3.16Å; R20-N24 PolarHBondContact O-ND2 3.14Å
21	A	81.3	Confident	78	Confident	5 Å²	5	96.4 Å²	96.4	4%	0.041	47%	0.467	C	S	.	.	H	α-helix	trans	-68.3	-47.2	176	0	0	0	0	0	112.1	V17 Q18 L19 I23 N24 A25 L39 A42 A43	V17-A21 PolarHBondContact O-N 3.38Å; Q18-A21 WeakPolarHBondContact O-CB 3.29Å; Q18-A21 PolarHBondContact O-N 2.71Å; Q18-A21 VanDerWaalsContact O-N 3.1Å; L19-A21 VanDerWaalsContact C-N 3.3Å; L19-A21 PolarHBondContact O-N 3.14Å; A21-I23 PolarHBondContact O-N 3.33Å; A21-N24 PolarHBondContact O-N 3.47Å; A21-N24 VanDerWaalsContact O-N 3.14Å; A21-A25 WeakPolarHBondContact O-CB 3.43Å; A21-A25 PolarHBondContact O-N 2.84Å; A21-L39 HydrophobicContact CB-CD2 3.94Å; A21-A42 VanDerWaalsContact CB-C 3.45Å; A21-A42 HydrophobicContact CB-CB 3.43Å; A21-A42 VanDerWaalsContact CB-CB 3.43Å; A21-A43 HydrophobicContact CB-CB 4.42Å
22	Q	84.5	Confident	78.8	Confident	88 Å²	88	95 Å²	95	41%	0.411	47%	0.473	S	S	.	.	H	α-helix	trans	-57.2	-47.2	176.7	-71.1	173.9	-4.2	0	0	112	Q18 L19 N24 A25 F26 A43	Q18-Q22 WeakPolarHBondContact O-CG 3.36Å; Q18-Q22 PolarHBondContact O-N 2.88Å; L19-Q22 PolarHBondContact O-N 3.2Å; Q22-N24 VanDerWaalsContact C-N 3.31Å; Q22-N24 PolarHBondContact O-N 2.8Å; Q22-A25 PolarHBondContact O-N 3.32Å; Q22-F26 PolarHBondContact O-N 3.46Å; Q22-A43 HydrophobicContact CB-CB 4.44Å; Q22-A43 HydrophobicContact CG-CB 3.66Å; Q22-A43 PolarHBondContact NE2-O 3.48Å
23	I	85.3	Confident	79.5	Confident	79 Å²	79	92.8 Å²	92.8	41%	0.405	46%	0.461	S	S	.	.	H	α-helix	trans	-60.9	-39.5	177	-69.1	167.5	0	0	0	111.6	L19 A21 K27	L19-I23 HydrophobicContact CD1-CD1 4.18Å; L19-I23 HydrophobicContact CG-CD1 4.02Å; L19-I23 VanDerWaalsContact O-CG1 3.31Å; L19-I23 WeakPolarHBondContact O-CG1 3.37Å; L19-I23 PolarHBondContact O-N 2.92Å; A21-I23 PolarHBondContact O-N 3.33Å; I23-K27 HydrophobicContact CG2-CD 4.24Å; I23-K27 VanDerWaalsContact O-CG 3.29Å; I23-K27 WeakPolarHBondContact O-CG 3.49Å; I23-K27 PolarHBondContact O-N 2.8Å; I23-K27 VanDerWaalsContact O-N 3.15Å
24	N	82.3	Confident	80.1	Confident	72 Å²	72	89 Å²	89	39%	0.385	46%	0.455	S	S	.	.	H	α-helix	trans	-75.7	-35.6	179.5	-76.3	-17.9	0	0	0	112.9	R20 A21 Q22 K27 L28 L39	R20-N24 WeakPolarHBondContact O-CB 3.42Å; R20-N24 PolarHBondContact O-N 2.9Å; R20-N24 VanDerWaalsContact O-N 3.16Å; R20-N24 PolarHBondContact O-ND2 3.14Å; A21-N24 PolarHBondContact O-N 3.47Å; A21-N24 VanDerWaalsContact O-N 3.14Å; Q22-N24 VanDerWaalsContact C-N 3.31Å; Q22-N24 PolarHBondContact O-N 2.8Å; N24-K27 PolarHBondContact O-N 3.47Å; N24-L28 WeakPolarHBondContact O-CG 3.5Å; N24-L28 PolarHBondContact O-N 2.9Å; N24-L39 HydrophobicContact CB-CD1 4.15Å; N24-L39 HydrophobicContact CB-CD2 3.72Å
25	A	80.1	Confident	80.5	Confident	9 Å²	9	85.6 Å²	85.6	7%	0.074	44%	0.437	C	S	.	.	H	α-helix	trans	-61.6	-46.6	172.3	0	0	0	0	0	111	A21 Q22 K27 L28 L29 V35	A21-A25 WeakPolarHBondContact O-CB 3.43Å; A21-A25 PolarHBondContact O-N 2.84Å; Q22-A25 PolarHBondContact O-N 3.32Å; A25-K27 VanDerWaalsContact C-N 3.35Å; A25-K27 PolarHBondContact O-N 3.25Å; A25-L28 PolarHBondContact O-N 3.07Å; A25-L28 VanDerWaalsContact O-N 3.11Å; A25-L29 WeakPolarHBondContact O-CG 3.23Å; A25-L29 PolarHBondContact O-N 3.47Å; A25-V35 HydrophobicContact CB-CG1 3.83Å; A25-V35 HydrophobicContact CB-CG2 4.36Å
26	F	85.7	Confident	80.6	Confident	148 Å²	148	83.3 Å²	83.3	65%	0.649	43%	0.432	S	S	*	.	H	α-helix	trans	-58.5	-43.7	175.4	-176.8	-99.8	0	0	0	112.4	Q22 L28 L29 S30	Q22-F26 PolarHBondContact O-N 3.46Å; F26-L28 PolarHBondContact O-N 3.46Å; F26-L29 PolarHBondContact O-N 3.41Å; F26-S30 WeakPolarHBondContact O-CB 3.48Å; F26-S30 PolarHBondContact O-N 2.97Å; F26-S30 PolarHBondContact O-OG 3.13Å
27	K	83.2	Confident	80.4	Confident	114 Å²	114	87.2 Å²	87.2	50%	0.496	45%	0.449	S	S	.	.	H	α-helix	trans	-63.6	-17	176.4	-77.3	173.3	179.7	177.1	0	115	I23 N24 A25 K31	I23-K27 HydrophobicContact CG2-CD 4.24Å; I23-K27 VanDerWaalsContact O-CG 3.29Å; I23-K27 WeakPolarHBondContact O-CG 3.49Å; I23-K27 PolarHBondContact O-N 2.8Å; I23-K27 VanDerWaalsContact O-N 3.15Å; N24-K27 PolarHBondContact O-N 3.47Å; A25-K27 VanDerWaalsContact C-N 3.35Å; A25-K27 PolarHBondContact O-N 3.25Å; K27-K31 WeakPolarHBondContact O-CD 3.33Å; K27-K31 WeakPolarHBondContact O-CG 3.26Å
28	L	80.7	Confident	80.1	Confident	47 Å²	47	88.5 Å²	88.5	25%	0.246	46%	0.457	C	S	.	.	H	α-helix	trans	-92.6	-45.9	174.9	-69.1	170.7	0	0	0	111.1	N24 A25 F26 S30 K31 S32 Q33 V35 P36 L39	N24-L28 WeakPolarHBondContact O-CG 3.5Å; N24-L28 PolarHBondContact O-N 2.9Å; A25-L28 PolarHBondContact O-N 3.07Å; A25-L28 VanDerWaalsContact O-N 3.11Å; F26-L28 PolarHBondContact O-N 3.46Å; L28-S30 VanDerWaalsContact C-N 3.31Å; L28-S30 PolarHBondContact O-N 3.2Å; L28-K31 CarbonylContact O-C 3.54Å; L28-K31 WeakPolarHBondContact O-CA 3.37Å; L28-K31 PolarHBondContact O-N 3.29Å; L28-S32 PolarHBondContact O-N 2.95Å; L28-Q33 CarbonylContact C-O 3.6Å; L28-Q33 HydrophobicContact CB-CB 4.21Å; L28-Q33 HydrophobicContact CD2-CB 3.9Å; L28-Q33 PolarHBondContact O-N 3.35Å; L28-V35 HydrophobicContact CB-CG2 4.24Å; L28-P36 HydrophobicContact CD1-CG 4.49Å; L28-L39 HydrophobicContact CD1-CD1 3.78Å
29	L	81.7	Confident	79.9	Confident	116 Å²	116	87.1 Å²	87.1	61%	0.607	45%	0.451	S	S	*	.	H	α-helix	trans	-56.4	-45	174.9	-68.5	171.9	0	0	0	111.4	A25 F26 K31 S32 V35	A25-L29 WeakPolarHBondContact O-CG 3.23Å; A25-L29 PolarHBondContact O-N 3.47Å; F26-L29 PolarHBondContact O-N 3.41Å; L29-K31 PolarHBondContact O-N 3.33Å; L29-S32 PolarHBondContact O-N 2.92Å; L29-S32 VanDerWaalsContact O-N 3.14Å; L29-V35 HydrophobicContact CD1-CG2 4.26Å; L29-V35 HydrophobicContact CD2-CG2 3.66Å; L29-V35 HydrophobicContact CG-CG2 3.58Å
30	S	81.8	Confident	79.6	Confident	78 Å²	78	87 Å²	87	55%	0.545	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	1.1	177.1	72.6	0	0	0	0	114.6	F26 L28	F26-S30 WeakPolarHBondContact O-CB 3.48Å; F26-S30 PolarHBondContact O-N 2.97Å; F26-S30 PolarHBondContact O-OG 3.13Å; L28-S30 VanDerWaalsContact C-N 3.31Å; L28-S30 PolarHBondContact O-N 3.2Å
31	K	78.3	Confident	79.2	Confident	151 Å²	151	80.9 Å²	80.9	66%	0.657	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.2	12.7	177.1	-64.6	-174.3	179.4	-173.2	0	112.8	K27 L28 L29 Q33	K27-K31 WeakPolarHBondContact O-CD 3.33Å; K27-K31 WeakPolarHBondContact O-CG 3.26Å; L28-K31 CarbonylContact O-C 3.54Å; L28-K31 WeakPolarHBondContact O-CA 3.37Å; L28-K31 PolarHBondContact O-N 3.29Å; L29-K31 PolarHBondContact O-N 3.33Å; K31-Q33 HydrophobicContact CB-CG 4.06Å; K31-Q33 PolarHBondContact O-N 3.37Å; K31-Q33 VanDerWaalsContact O-N 3.1Å
32	S	76.9	Confident	78.9	Confident	100 Å²	100	82.1 Å²	82.1	70%	0.699	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	20.3	-173.5	-56.2	0	0	0	0	114.4	L28 L29	L28-S32 PolarHBondContact O-N 2.95Å; L29-S32 PolarHBondContact O-N 2.92Å; L29-S32 VanDerWaalsContact O-N 3.14Å
33	Q	75.2	Confident	78.5	Confident	94 Å²	94	78.8 Å²	78.8	44%	0.439	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-89	142.2	177.6	-65.5	-62.8	-31.4	0	0	110.1	L28 K31 V35	L28-Q33 CarbonylContact C-O 3.6Å; L28-Q33 HydrophobicContact CB-CB 4.21Å; L28-Q33 HydrophobicContact CD2-CB 3.9Å; L28-Q33 PolarHBondContact O-N 3.35Å; K31-Q33 HydrophobicContact CB-CG 4.06Å; K31-Q33 PolarHBondContact O-N 3.37Å; K31-Q33 VanDerWaalsContact O-N 3.1Å; Q33-V35 PolarHBondContact O-N 3.04Å
34	P	76.2	Confident	78.1	Confident	100 Å²	100	79.6 Å²	79.6	65%	0.649	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-64.4	134.4	175.4	28.3	-33.9	0	0	0	110.1	P36	P34-P36 WeakPolarHBondContact O-CD 3.31Å
35	V	79.3	Confident	77.4	Confident	30 Å²	30	78.2 Å²	78.2	18%	0.182	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-75.6	122.4	169.9	-177.2	0	0	0	0	107.9	A25 L28 L29 Q33 L39 L40	A25-V35 HydrophobicContact CB-CG1 3.83Å; A25-V35 HydrophobicContact CB-CG2 4.36Å; L28-V35 HydrophobicContact CB-CG2 4.24Å; L29-V35 HydrophobicContact CD1-CG2 4.26Å; L29-V35 HydrophobicContact CD2-CG2 3.66Å; L29-V35 HydrophobicContact CG-CG2 3.58Å; Q33-V35 PolarHBondContact O-N 3.04Å; V35-L39 HydrophobicContact CG1-CB 3.84Å; V35-L40 HydrophobicContact CB-CD1 4.45Å; V35-L40 HydrophobicContact CG1-CB 4.34Å; V35-L40 HydrophobicContact CG1-CD1 4.11Å
36	P	74.7	Confident	76.7	Confident	60 Å²	60	85.5 Å²	85.5	39%	0.39	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-56.9	140.8	171.3	-25.2	34	0	0	0	111	L28 P34 T38 L39 L40	L28-P36 HydrophobicContact CD1-CG 4.49Å; P34-P36 WeakPolarHBondContact O-CD 3.31Å; P36-T38 PolarHBondContact O-N 3.13Å; P36-T38 VanDerWaalsContact O-N 3.14Å; P36-L39 HydrophobicContact CB-CB 4.42Å; P36-L39 HydrophobicContact CG-CD1 4.23Å; P36-L39 WeakPolarHBondContact O-CA 3.35Å; P36-L39 WeakPolarHBondContact O-CB 3.39Å; P36-L39 PolarHBondContact O-N 3.49Å; P36-L40 PolarHBondContact O-N 3.13Å
37	E	74.3	Confident	75	Confident	146 Å²	146	85.2 Å²	85.2	68%	0.682	46%	0.459	S	S	*	.	H	α-helix	trans	-54.5	-35.3	178.8	-172.8	174.8	-163.3	0	0	112.3	L39 L40 L41	E37-L39 VanDerWaalsContact C-N 3.35Å; E37-L39 PolarHBondContact O-N 3.21Å; E37-L40 WeakPolarHBondContact O-CB 3.43Å; E37-L40 PolarHBondContact O-N 3.42Å; E37-L41 HydrophobicContact CG-CD1 4.01Å; E37-L41 HydrophobicContact CG-CG 4.49Å; E37-L41 WeakPolarHBondContact O-CB 3.26Å; E37-L41 VanDerWaalsContact O-CG 3.32Å; E37-L41 WeakPolarHBondContact O-CG 3.37Å; E37-L41 PolarHBondContact O-N 3.09Å
38	T	71.9	Confident	72.9	Confident	108 Å²	108	86.6 Å²	86.6	66%	0.663	47%	0.47	S	S	*	.	H	α-helix	trans	-64.8	-33	173.2	53.9	0	0	0	0	113.9	P36 A42	P36-T38 PolarHBondContact O-N 3.13Å; P36-T38 VanDerWaalsContact O-N 3.14Å; T38-A42 WeakPolarHBondContact O-CB 3.35Å; T38-A42 PolarHBondContact O-N 3.32Å
39	L	78.2	Confident	71.1	Confident	36 Å²	36	91.6 Å²	91.6	19%	0.188	50%	0.497	C	S	.	.	H	α-helix	trans	-77.3	-32.3	173.3	-95.3	172.4	0	0	0	111.7	A21 N24 L28 V35 P36 E37 A43	A21-L39 HydrophobicContact CB-CD2 3.94Å; N24-L39 HydrophobicContact CB-CD1 4.15Å; N24-L39 HydrophobicContact CB-CD2 3.72Å; L28-L39 HydrophobicContact CD1-CD1 3.78Å; V35-L39 HydrophobicContact CG1-CB 3.84Å; P36-L39 HydrophobicContact CB-CB 4.42Å; P36-L39 HydrophobicContact CG-CD1 4.23Å; P36-L39 WeakPolarHBondContact O-CA 3.35Å; P36-L39 WeakPolarHBondContact O-CB 3.39Å; P36-L39 PolarHBondContact O-N 3.49Å; E37-L39 VanDerWaalsContact C-N 3.35Å; E37-L39 PolarHBondContact O-N 3.21Å; L39-A43 WeakPolarHBondContact O-CB 3.37Å; L39-A43 PolarHBondContact O-N 3.33Å
40	L	77.8	Confident	68.7	Low	86 Å²	86	91 Å²	91	45%	0.45	50%	0.503	S	S	.	.	H	α-helix	trans	-65.8	-52.8	173.6	-155.3	81.2	0	0	0	110.6	V35 P36 E37 A42 A43 E44	V35-L40 HydrophobicContact CB-CD1 4.45Å; V35-L40 HydrophobicContact CG1-CB 4.34Å; V35-L40 HydrophobicContact CG1-CD1 4.11Å; P36-L40 PolarHBondContact O-N 3.13Å; E37-L40 WeakPolarHBondContact O-CB 3.43Å; E37-L40 PolarHBondContact O-N 3.42Å; L40-A42 PolarHBondContact O-N 3.45Å; L40-A43 WeakPolarHBondContact O-CA 3.44Å; L40-A43 WeakPolarHBondContact O-CB 3.42Å; L40-A43 PolarHBondContact O-N 2.73Å; L40-A43 VanDerWaalsContact O-N 3.08Å; L40-E44 WeakPolarHBondContact O-CG 3.26Å; L40-E44 PolarHBondContact O-N 3.01Å
41	L	74.2	Confident	66.5	Low	32 Å²	32	96.6 Å²	96.6	17%	0.168	52%	0.519	C	S	.	.	H	α-helix	trans	-61.6	-42.9	177.4	-71.9	166.1	0	0	0	112.5	E37 A43 E44 G45 R46 L48	E37-L41 HydrophobicContact CG-CD1 4.01Å; E37-L41 HydrophobicContact CG-CG 4.49Å; E37-L41 WeakPolarHBondContact O-CB 3.26Å; E37-L41 VanDerWaalsContact O-CG 3.32Å; E37-L41 WeakPolarHBondContact O-CG 3.37Å; E37-L41 PolarHBondContact O-N 3.09Å; L41-A43 VanDerWaalsContact C-N 3.28Å; L41-A43 PolarHBondContact O-N 2.83Å; L41-E44 CarbonylContact O-C 3.5Å; L41-E44 PolarHBondContact O-N 3.49Å; L41-G45 PolarHBondContact O-N 3.1Å; L41-R46 HydrophobicContact CD2-CB 4.03Å; L41-R46 PolarHBondContact O-N 3.22Å; L41-L48 HydrophobicContact CD1-CD1 3.48Å; L41-L48 VanDerWaalsContact CD1-CD1 3.48Å; L41-L48 HydrophobicContact CD1-CG 3.91Å
42	A	74.1	Confident	65	Low	30 Å²	30	93.6 Å²	93.6	25%	0.248	52%	0.523	C	S	.	.	H	α-helix	trans	-67.6	-27.9	175.2	0	0	0	0	0	112.4	Q18 A21 T38 L40 G45	Q18-A42 WeakPolarHBondContact CA-O 3.35Å; Q18-A42 WeakPolarHBondContact CG-O 3.45Å; A21-A42 VanDerWaalsContact CB-C 3.45Å; A21-A42 HydrophobicContact CB-CB 3.43Å; A21-A42 VanDerWaalsContact CB-CB 3.43Å; T38-A42 WeakPolarHBondContact O-CB 3.35Å; T38-A42 PolarHBondContact O-N 3.32Å; L40-A42 PolarHBondContact O-N 3.45Å; A42-G45 PolarHBondContact O-N 2.96Å
43	A	76	Confident	63.1	Low	19 Å²	19	94.4 Å²	94.4	16%	0.157	53%	0.526	C	S	.	.	H	α-helix	trans	-73.5	-38.2	171.4	0	0	0	0	0	112.4	Q18 A21 Q22 L39 L40 L41 G45	Q18-A43 PolarHBondContact NE2-O 2.81Å; A21-A43 HydrophobicContact CB-CB 4.42Å; Q22-A43 HydrophobicContact CB-CB 4.44Å; Q22-A43 HydrophobicContact CG-CB 3.66Å; Q22-A43 PolarHBondContact NE2-O 3.48Å; L39-A43 WeakPolarHBondContact O-CB 3.37Å; L39-A43 PolarHBondContact O-N 3.33Å; L40-A43 WeakPolarHBondContact O-CA 3.44Å; L40-A43 WeakPolarHBondContact O-CB 3.42Å; L40-A43 PolarHBondContact O-N 2.73Å; L40-A43 VanDerWaalsContact O-N 3.08Å; L41-A43 VanDerWaalsContact C-N 3.28Å; L41-A43 PolarHBondContact O-N 2.83Å; A43-G45 PolarHBondContact O-N 2.8Å
44	E	77.7	Confident	61.2	Low	95 Å²	95	98.4 Å²	98.4	44%	0.444	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-9.7	170.3	-71.9	-179.3	-158.5	0	0	113.5	L40 L41 R46	L40-E44 WeakPolarHBondContact O-CG 3.26Å; L40-E44 PolarHBondContact O-N 3.01Å; L41-E44 CarbonylContact O-C 3.5Å; L41-E44 PolarHBondContact O-N 3.49Å; E44-R46 VanDerWaalsContact C-N 3.25Å; E44-R46 HydrophobicContact CB-CB 4.48Å; E44-R46 HydrophobicContact CB-CG 4.15Å; E44-R46 PolarHBondContact O-N 3.09Å; E44-R46 WeakPolarHBondContact OE2-CD 3.32Å; E44-R46 IonicContact OE2-CZ 3.7Å; E44-R46 IonicContact OE2-NE 2.62Å; E44-R46 IonicContact OE2-NH1 2.77Å; E44-R46 PolarHBondContact OE2-NH1 3.48Å
45	G	67.4	Low	59.7	Low	43 Å²	43	98.9 Å²	98.9	44%	0.443	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	14.8	-175.9	0	0	0	0	0	113.9	L41 A42 A43	L41-G45 PolarHBondContact O-N 3.1Å; A42-G45 PolarHBondContact O-N 2.96Å; A43-G45 PolarHBondContact O-N 2.8Å
46	R	64.7	Low	57.5	Low	163 Å²	163	104.3 Å²	104.3	62%	0.615	57%	0.574	S	S	*	*			trans	-93	108.8	-176	-72.3	-177.6	170.5	164.1	-12.6	111.6	L41 E44 L48	L41-R46 HydrophobicContact CD2-CB 4.03Å; L41-R46 PolarHBondContact O-N 3.22Å; E44-R46 VanDerWaalsContact C-N 3.25Å; E44-R46 HydrophobicContact CB-CB 4.48Å; E44-R46 HydrophobicContact CB-CG 4.15Å; E44-R46 PolarHBondContact O-N 3.09Å; E44-R46 WeakPolarHBondContact OE2-CD 3.32Å; E44-R46 IonicContact OE2-CZ 3.7Å; E44-R46 IonicContact OE2-NE 2.62Å; E44-R46 IonicContact OE2-NH1 2.77Å; E44-R46 PolarHBondContact OE2-NH1 3.48Å; R46-L48 PolarHBondContact O-N 3.31Å
47	Q	50.8	Low	56.1	Low	142 Å²	142	104.4 Å²	104.4	66%	0.664	58%	0.576	S	S	*	*			trans	-71	123.3	162.8	-64.3	-176.2	-1.7	0	0	109	L49	Q47-L49 PolarHBondContact O-N 2.91Å
48	L	39.2	Very low	54.6	Low	142 Å²	142	98.3 Å²	98.3	74%	0.743	55%	0.553	S	S	*	*			trans	-79	104.8	171.7	-109	-179.7	0	0	0	109.4	L41 R46	L41-L48 HydrophobicContact CD1-CD1 3.48Å; L41-L48 VanDerWaalsContact CD1-CD1 3.48Å; L41-L48 HydrophobicContact CD1-CG 3.91Å; R46-L48 PolarHBondContact O-N 3.31Å
49	L	41.9	Very low	53.4	Low	153 Å²	153	96.4 Å²	96.4	80%	0.801	54%	0.542	S	S	*	.			trans	-74.1	155.4	177.5	-74.9	103.3	0	0	0	112.7	Q47	Q47-L49 PolarHBondContact O-N 2.91Å
50	S	33.3	Very low	51.8	Low	104 Å²	104	96.4 Å²	96.4	73%	0.727	54%	0.544	S	S	*	.			trans	-92.4	130.4	-171.1	56.6	0	0	0	0	114.4
51	H	35.5	Very low	50.2	Low	194 Å²	194	96.4 Å²	96.4	90%	0.898	56%	0.557	S	S	*	*			trans	-158.3	154.7	154.2	-89	-65.2	0	0	0	110.8
52	A	45.2	Very low	48.7	Very low	89 Å²	89	101 Å²	101	74%	0.736	59%	0.589	S	S	*	*				-167.5	150.7	-63.2	0	0	0	0	0	107.8
53	P	38.7	Very low	47.2	Very low	116 Å²	116	106.5 Å²	106.5	75%	0.753	61%	0.614	S	S	*	*			trans	-116.1	173.6	-156.7	42.1	-34.3	0	0	0	117.2	V55	P53-V55 HydrophobicContact CB-CG2 4.21Å
54	I	34.2	Very low	45.6	Very low	178 Å²	178	111.3 Å²	111.3	91%	0.913	64%	0.641	S	S	*	*			trans	-137.5	130.2	169.8	-56.5	-179.3	0	0	0	109.4
55	V	44.2	Very low	44.1	Very low	110 Å²	110	112.3 Å²	112.3	67%	0.667	66%	0.659	S	S	*	*			trans	-151.2	139	-158.3	-177	0	0	0	0	116.4	P53	P53-V55 HydrophobicContact CB-CG2 4.21Å
56	M	34.4	Very low	43.3	Very low	144 Å²	144	113.7 Å²	113.7	71%	0.709	67%	0.673	S	S	*	*			trans	-163.8	151.9	167.3	-61.4	-67.7	153.4	0	0	114.3	R239	M56-R239 VanDerWaalsContact SD-CZ 3.59Å; M56-R239 PolarHBondContact SD-NH1 3.31Å; M56-R239 PolarHBondContact SD-NH2 2.65Å; M56-R239 VanDerWaalsContact SD-NH2 3.4Å
57	S	44.9	Very low	41.8	Very low	62 Å²	62	114.7 Å²	114.7	43%	0.434	69%	0.685	S	S	.	*			trans	-154.4	178.4	178.1	54	0	0	0	0	116.2	V235 K236	S57-V235 WeakPolarHBondContact OG-CB 3.33Å; S57-V235 WeakPolarHBondContact OG-CG2 3.4Å; S57-K236 WeakPolarHBondContact O-CA 3.45Å; S57-K236 WeakPolarHBondContact O-CB 3.36Å; S57-K236 WeakPolarHBondContact O-CD 3.36Å; S57-K236 WeakPolarHBondContact O-CE 2.95Å; S57-K236 WeakPolarHBondContact O-CG 3.41Å; S57-K236 PolarHBondContact O-N 3.31Å; S57-K236 VanDerWaalsContact O-N 3.12Å
58	G	41.5	Very low	40.9	Very low	18 Å²	18	114.1 Å²	114.1	19%	0.186	68%	0.682	C	S	.	*			trans	-89.4	163	-153.5	0	0	0	0	0	125	N234 V235 K236	G58-N234 WeakPolarHBondContact CA-OD1 3.36Å; G58-N234 CarbonylContact O-C 3.57Å; G58-N234 WeakPolarHBondContact O-CA 3.42Å; G58-N234 WeakPolarHBondContact O-CB 3.22Å; G58-N234 PolarHBondContact O-OD1 3.47Å; G58-V235 CarbonylContact O-C 3.54Å; G58-V235 PolarHBondContact O-N 3.09Å; G58-K236 VanDerWaalsContact C-N 3.26Å; G58-K236 VanDerWaalsContact CA-CB 3.43Å; G58-K236 PolarHBondContact O-N 2.77Å
59	P	47.4	Very low	40.3	Very low	69 Å²	69	119.8 Å²	119.8	45%	0.448	69%	0.693	S	S	.	*			trans	53.2	0	163.5	31.4	-39.3	0	0	0	124.5	N234 K236 A237 Y238	P59-N234 WeakPolarHBondContact CA-OD1 3.47Å; P59-N234 VanDerWaalsContact N-OD1 3.14Å; P59-K236 PolarHBondContact O-N 3.5Å; P59-A237 VanDerWaalsContact C-CB 3.43Å; P59-A237 HydrophobicContact CB-CB 4.05Å; P59-A237 WeakPolarHBondContact O-CA 3.32Å; P59-A237 WeakPolarHBondContact O-CB 3.33Å; P59-A237 PolarHBondContact O-N 2.72Å; P59-Y238 PolarHBondContact O-N 3.29Å
60	P	44	Very low	39.8	Very low	35 Å²	35	117.7 Å²	117.7	23%	0.227	68%	0.683	C	S	.	*				0	-166.3	0	44.7	-22.9	0	0	0	119.7	N234 Y238	P60-N234 HydrophobicContact CG-CB 4.37Å; P60-Y238 VanDerWaalsContact CD-CD2 3.43Å; P60-Y238 HydrophobicContact CG-CD2 4.36Å; P60-Y238 HydrophobicContact CG-CE2 3.64Å
61	A	45.7	Very low	39.5	Very low	86 Å²	86	120.6 Å²	120.6	71%	0.711	69%	0.685	S	S	*	*			trans	82.9	142.4	157.3	0	0	0	0	0	128.6
62	P	42.6	Very low	39.1	Very low	129 Å²	129	116 Å²	116	84%	0.838	68%	0.675	S	S	*	*			trans	-116.2	-154.8	-164.6	34.1	-10.8	0	0	0	115.9
63	N	41.7	Very low	38.3	Very low	145 Å²	145	116.3 Å²	116.3	78%	0.775	67%	0.672	S	S	*	*			cis	-169.4	-169.3	20.7	-167.8	15.6	0	0	0	113.7
64	V	42.5	Very low	37.7	Very low	120 Å²	120	116.7 Å²	116.7	73%	0.727	67%	0.672	S	S	*	*			trans	85.3	150.8	159.7	178.5	0	0	0	0	119.1
65	S	47.3	Very low	37.5	Very low	117 Å²	117	116 Å²	116	82%	0.818	67%	0.67	S	S	*	*			cis	-171.7	171.8	-38.6	76.1	0	0	0	0	113.1
66	G	49	Very low	36.6	Very low	72 Å²	72	115.9 Å²	115.9	74%	0.742	67%	0.674	S	S	*	*			trans	157.2	154.6	169.4	0	0	0	0	0	118.5
67	Q	34.5	Very low	36.2	Very low	184 Å²	184	115.9 Å²	115.9	86%	0.86	67%	0.674	S	S	*	*			trans	59.2	134.9	176.3	-74.4	175.5	-28.2	0	0	118.2
68	Q	31	Very low	35.3	Very low	130 Å²	130	120.3 Å²	120.3	61%	0.607	69%	0.688	S	S	*	*				72.5	124.7	62.8	-139.6	170.3	22.3	0	0	112.7	N70	Q68-N70 VanDerWaalsContact CG-OD1 3.28Å; Q68-N70 WeakPolarHBondContact CG-OD1 3.38Å; Q68-N70 PolarHBondContact NE2-OD1 2.74Å; Q68-N70 VanDerWaalsContact NE2-OD1 3.15Å
69	W	26.3	Very low	34.6	Very low	260 Å²	260	126.3 Å²	126.3	99%	0.985	72%	0.716	S	S	*	*	S	Bend	cis	-92.4	149.5	15.4	-60	48	0	0	0	114.5
70	N	32.6	Very low	33.8	Very low	109 Å²	109	129.1 Å²	129.1	58%	0.583	73%	0.731	S	S	*	*			cis	-143.1	158	-37.6	-153.1	8.1	0	0	0	108.1	Q68 S72	Q68-N70 VanDerWaalsContact CG-OD1 3.28Å; Q68-N70 WeakPolarHBondContact CG-OD1 3.38Å; Q68-N70 PolarHBondContact NE2-OD1 2.74Å; Q68-N70 VanDerWaalsContact NE2-OD1 3.15Å; N70-S72 PolarHBondContact O-N 2.69Å
71	Q	26.8	Very low	33.3	Very low	165 Å²	165	132.9 Å²	132.9	77%	0.771	76%	0.756	S	S	*	*			trans	-49.2	124.2	-171	-74.8	169.3	5.5	0	0	113
72	S	26.4	Very low	32.5	Very low	97 Å²	97	137.4 Å²	137.4	68%	0.678	76%	0.76	S	S	*	*			cis	97.6	-168.9	49	75.6	0	0	0	0	112	N70	N70-S72 PolarHBondContact O-N 2.69Å
73	S	29.4	Very low	31.9	Very low	96 Å²	96	137 Å²	137	67%	0.671	76%	0.755	S	S	*	*			trans	86	105.5	173.2	-50.2	0	0	0	0	114.3
74	V	25.9	Very low	31.4	Very low	125 Å²	125	134 Å²	134	76%	0.758	76%	0.758	S	S	*	*				69.7	139.8	68.5	-55.7	0	0	0	0	113.9
75	N	29.2	Very low	30.8	Very low	162 Å²	162	132.7 Å²	132.7	87%	0.866	76%	0.76	S	S	*	*			trans	65.7	167.1	-176.9	-61.4	-16.9	0	0	0	112.6
76	S	25.4	Very low	30.3	Very low	108 Å²	108	132.1 Å²	132.1	76%	0.755	75%	0.753	S	S	*	*			cis	-132.1	171.5	12.1	65.4	0	0	0	0	115.6
77	M	25.6	Very low	29.3	Very low	145 Å²	145	136.9 Å²	136.9	71%	0.714	76%	0.756	S	S	*	*			trans	-46.2	147.9	154.9	-63.5	146.1	57	0	0	112.4
78	Q	25.9	Very low	29	Very low	155 Å²	155	132.8 Å²	132.8	72%	0.724	75%	0.748	S	S	*	*			trans	66.6	145	139.7	-68.4	161.2	-26.7	0	0	120.8
79	N	28.4	Very low	29	Very low	144 Å²	144	132 Å²	132	77%	0.77	76%	0.756	S	S	*	*			trans	71.6	118.3	155.9	-66.2	-2.4	0	0	0	121.6
80	V	29.2	Very low	29	Very low	128 Å²	128	125.7 Å²	125.7	78%	0.776	75%	0.746	S	S	*	*				4.3	160.5	125.2	-67.2	0	0	0	0	120.2
81	P	34.5	Very low	28.8	Very low	114 Å²	114	126.4 Å²	126.4	74%	0.74	75%	0.754	S	S	*	*			cis	-140.8	-150.9	-29.3	36.1	-14.1	0	0	0	112.4
82	F	28.1	Very low	28.7	Very low	180 Å²	180	126.9 Å²	126.9	79%	0.789	76%	0.756	S	S	*	*			trans	98.3	109.1	143.6	-150.6	-105.7	0	0	0	120.6
83	V	29.5	Very low	28.7	Very low	122 Å²	122	126.9 Å²	126.9	74%	0.739	76%	0.757	S	S	*	*			trans	45.9	130.4	138.9	-177.3	0	0	0	0	121
84	G	31	Very low	28.4	Very low	81 Å²	81	130.3 Å²	130.3	84%	0.835	76%	0.762	S	S	*	*			trans	-179.9	86.1	165.2	0	0	0	0	0	114.8
85	A	30.3	Very low	28.4	Very low	93 Å²	93	132.7 Å²	132.7	77%	0.769	76%	0.762	S	S	*	*			trans	-133.4	-171.9	169.3	0	0	0	0	0	108.1
86	P	37.1	Very low	28.3	Very low	104 Å²	104	133.7 Å²	133.7	68%	0.675	76%	0.762	S	S	*	*			cis	-129.1	-142	-18.3	23.1	3.8	0	0	0	110.3
87	Q	28.4	Very low	28.4	Very low	173 Å²	173	133.7 Å²	133.7	81%	0.808	76%	0.759	S	S	*	*			trans	79.3	150.9	154.2	-64.6	172.2	19.6	0	0	119.4
88	S	27.7	Very low	28.4	Very low	98 Å²	98	131.1 Å²	131.1	69%	0.685	76%	0.761	S	S	*	*			cis	-172.7	133.9	-24.2	53.7	0	0	0	0	113.3
89	S	30.6	Very low	29.1	Very low	113 Å²	113	131.1 Å²	131.1	79%	0.79	77%	0.766	S	S	*	*			trans	179	120.1	148.9	46.8	0	0	0	0	107.9
90	V	27	Very low	29.1	Very low	127 Å²	127	129.5 Å²	129.5	77%	0.77	76%	0.763	S	S	*	*			cis	80.9	148.1	47.9	-178.2	0	0	0	0	111.9
91	V	29.3	Very low	28.9	Very low	125 Å²	125	126.4 Å²	126.4	76%	0.758	75%	0.751	S	S	*	*			trans	75	101.6	-168.2	-170.4	0	0	0	0	111
92	Q	24.2	Very low	28.5	Very low	174 Å²	174	127.7 Å²	127.7	81%	0.813	75%	0.751	S	S	*	*			cis	68.4	134.9	20	-146.2	-178.7	21.3	0	0	113.7
93	S	25.7	Very low	28.5	Very low	98 Å²	98	123.5 Å²	123.5	69%	0.685	75%	0.75	S	S	*	*			trans	67	152	-171.3	84.5	0	0	0	0	114
94	E	24	Very low	28.5	Very low	167 Å²	167	124.9 Å²	124.9	78%	0.78	75%	0.751	S	S	*	*			cis	-157.4	-164.2	-13.5	-123.4	172.3	-167.9	0	0	111.1
95	F	26	Very low	28.3	Very low	175 Å²	175	125.3 Å²	125.3	77%	0.768	74%	0.741	S	S	*	*			trans	-43.8	146.5	166.7	-62.8	-105	0	0	0	113.3
96	H	27	Very low	28.5	Very low	184 Å²	184	131.4 Å²	131.4	85%	0.852	74%	0.744	S	S	*	*				-174.7	165.3	118.4	-93.3	-54.7	0	0	0	111
97	P	28	Very low	28.3	Very low	108 Å²	108	132.5 Å²	132.5	70%	0.701	75%	0.749	S	S	*	*			trans	-124.1	-171.3	-144.5	44.7	-33	0	0	0	114.7
98	A	25.7	Very low	28.4	Very low	90 Å²	90	135.7 Å²	135.7	74%	0.744	75%	0.753	S	S	*	*			trans	69.6	137.1	145.5	0	0	0	0	0	120.8
99	N	39.5	Very low	28.6	Very low	156 Å²	156	136.1 Å²	136.1	83%	0.834	75%	0.754	S	S	*	*			trans	-33.1	145.4	141.2	-89.4	-20.5	0	0	0	112.2
100	P	28.1	Very low	28.5	Very low	110 Å²	110	137.4 Å²	137.4	71%	0.714	75%	0.752	S	S	*	*				-146	172.6	70.8	40.2	-22.4	0	0	0	118.4
101	A	25.2	Very low	28.5	Very low	63 Å²	63	138 Å²	138	52%	0.521	75%	0.749	S	S	.	*			trans	-64.2	-178.9	168.5	0	0	0	0	0	115
102	L	26.1	Very low	28.3	Very low	141 Å²	141	140.1 Å²	140.1	74%	0.738	75%	0.751	S	S	*	*			trans	67.3	88.6	155.4	-62.2	170.9	0	0	0	118.9
103	A	27.5	Very low	28.8	Very low	92 Å²	92	136.9 Å²	136.9	76%	0.76	75%	0.745	S	S	*	*			trans	-171.4	153.6	135	0	0	0	0	0	110.7
104	I	29.5	Very low	28.7	Very low	151 Å²	151	137.3 Å²	137.3	77%	0.774	75%	0.748	S	S	*	*			cis	-159.8	146.6	-24.9	-108.3	161	0	0	0	104.4
105	S	28.4	Very low	28.9	Very low	89 Å²	89	137 Å²	137	62%	0.622	75%	0.751	S	S	*	*			trans	65.7	147.9	172.9	-67.4	0	0	0	0	116.9
106	R	33	Very low	28.9	Very low	222 Å²	222	134.6 Å²	134.6	84%	0.838	75%	0.75	S	S	*	*			cis	-156.7	151.4	-6.5	-115.4	161.5	-154.3	-162.6	-0.3	110.4
107	V	34.6	Very low	29.4	Very low	126 Å²	126	129.8 Å²	129.8	76%	0.764	74%	0.742	S	S	*	*			trans	64	84.3	152.6	-175.3	0	0	0	0	117.1
108	R	29.4	Very low	29.4	Very low	240 Å²	240	129.5 Å²	129.5	91%	0.906	75%	0.749	S	S	*	*				-47.6	152.3	127.5	-79.4	-175.5	-177.5	-174	3.6	109.5
109	P	32.7	Very low	29.8	Very low	107 Å²	107	133.5 Å²	133.5	70%	0.695	75%	0.745	S	S	*	*				-158.8	173.7	62.7	43.6	-23.3	0	0	0	119.6
110	N	28.4	Very low	29.3	Very low	141 Å²	141	134.3 Å²	134.3	75%	0.754	75%	0.747	S	S	*	*			trans	65.6	171.5	154.7	-116.9	2.5	0	0	0	115.2
111	I	26.9	Very low	29.4	Very low	140 Å²	140	132.3 Å²	132.3	72%	0.718	75%	0.747	S	S	*	*			cis	-121.8	138.2	3.4	-59.2	173.2	0	0	0	106.3
112	Q	25.6	Very low	30	Very low	168 Å²	168	135.2 Å²	135.2	79%	0.785	76%	0.76	S	S	*	*				33.5	155.3	102.1	-96	-169.4	9.1	0	0	118
113	P	33.9	Very low	30.4	Very low	107 Å²	107	133.8 Å²	133.8	70%	0.695	76%	0.76	S	S	*	*			trans	-82.9	-164.9	-170.5	37.5	-38.7	0	0	0	113.2
114	S	24.1	Very low	30.8	Very low	106 Å²	106	136.4 Å²	136.4	74%	0.741	77%	0.766	S	S	*	*			trans	77.1	132.5	-171.9	84.2	0	0	0	0	112.2
115	L	28.3	Very low	31	Very low	161 Å²	161	131.5 Å²	131.5	84%	0.843	75%	0.753	S	S	*	*			cis	90.9	127.7	44.2	-73.5	166.8	0	0	0	114.1
116	V	25	Very low	31.3	Very low	125 Å²	125	137.1 Å²	137.1	76%	0.758	76%	0.762	S	S	*	*			trans	79.8	94.6	155.2	-177.9	0	0	0	0	120.2
117	A	37.7	Very low	31.5	Very low	83 Å²	83	135.2 Å²	135.2	69%	0.686	76%	0.763	S	S	*	*				62.1	134.1	123.6	0	0	0	0	0	124.5
118	A	28.6	Very low	31.2	Very low	102 Å²	102	134.1 Å²	134.1	84%	0.843	76%	0.76	S	S	*	*			trans	-129	165.9	156.2	0	0	0	0	0	110.5
119	R	33.2	Very low	31.1	Very low	174 Å²	174	129.9 Å²	129.9	66%	0.657	75%	0.745	S	S	*	*			trans	-157.3	173.3	-169.3	-66	-176.1	179.2	144.3	0.2	114.5	Y129	R119-Y129 VanDerWaalsContact CZ-OH 3.3Å; R119-Y129 PolarHBondContact NH1-OH 2.79Å; R119-Y129 VanDerWaalsContact NH2-CZ 3.31Å; R119-Y129 PolarHBondContact NH2-OH 3.49Å
120	I	29.3	Very low	30.7	Very low	172 Å²	172	130.5 Å²	130.5	88%	0.882	75%	0.748	S	S	*	*			trans	121.8	108	145	-64.6	152.8	0	0	0	116.5
121	G	31	Very low	30.8	Very low	69 Å²	69	130 Å²	130	71%	0.711	75%	0.75	S	S	*	*			trans	96.4	148.1	144.4	0	0	0	0	0	119.3
122	P	36.9	Very low	31	Very low	123 Å²	123	128.1 Å²	128.1	80%	0.799	75%	0.749	S	S	*	*	S	Bend	cis	-138	168.3	-37.9	39.4	-25	0	0	0	114.2
123	P	35	Very low	31.3	Very low	111 Å²	111	124.9 Å²	124.9	72%	0.721	75%	0.745	S	S	*	*	S	Bend	cis	-134.8	108.3	-24.5	31.7	-11.5	0	0	0	114.8
124	V	35.2	Very low	31.3	Very low	147 Å²	147	124.9 Å²	124.9	89%	0.891	75%	0.748	S	S	*	*			trans	-157.6	145.5	151.6	-176.2	0	0	0	0	106.3
125	G	33.6	Very low	32.2	Very low	49 Å²	49	127.8 Å²	127.8	51%	0.505	75%	0.754	S	S	.	*			cis	130.1	123.2	-10.1	0	0	0	0	0	113.1
126	Y	34.3	Very low	32.8	Very low	206 Å²	206	122.9 Å²	122.9	81%	0.808	74%	0.743	S	S	*	*			cis	-159	148	-7.2	-75.9	-79.4	0	0	0	109.8
127	Q	37.4	Very low	34	Very low	183 Å²	183	122.9 Å²	122.9	86%	0.855	74%	0.743	S	S	*	*			trans	66.3	156.2	160.9	-68.6	176	-10.4	0	0	116.9
128	S	29.2	Very low	33.7	Very low	102 Å²	102	126.4 Å²	126.4	71%	0.713	74%	0.744	S	S	*	*			cis	-153.4	-170.6	-12.9	-115.5	0	0	0	0	113
129	Y	27	Very low	34.7	Very low	151 Å²	151	126.3 Å²	126.3	59%	0.592	73%	0.728	S	S	*	*			trans	-96.2	170.3	-173.8	-63.9	-95.8	0	0	0	116.1	R119	R119-Y129 VanDerWaalsContact CZ-OH 3.3Å; R119-Y129 PolarHBondContact NH1-OH 2.79Å; R119-Y129 VanDerWaalsContact NH2-CZ 3.31Å; R119-Y129 PolarHBondContact NH2-OH 3.49Å
130	T	24.4	Very low	35.1	Very low	121 Å²	121	122.9 Å²	122.9	74%	0.742	73%	0.729	S	S	*	*			trans	69.8	127.3	145	42	0	0	0	0	122.8
131	T	29.9	Very low	35.7	Very low	131 Å²	131	119.1 Å²	119.1	80%	0.804	73%	0.732	S	S	*	*			trans	35.2	142	139.9	54.9	0	0	0	0	121.2
132	S	30.8	Very low	36.3	Very low	99 Å²	99	118.1 Å²	118.1	69%	0.692	72%	0.722	S	S	*	*			cis	-166.9	162.4	12.9	45.1	0	0	0	0	111.9
133	S	33.7	Very low	36.2	Very low	101 Å²	101	116.3 Å²	116.3	71%	0.706	71%	0.708	S	S	*	*			trans	68.9	151.8	158.1	-55.4	0	0	0	0	119.3
134	S	33.1	Very low	36.4	Very low	107 Å²	107	113.3 Å²	113.3	75%	0.748	70%	0.698	S	S	*	*			trans	56.6	147.3	149.9	55.3	0	0	0	0	122.3
135	N	42.1	Very low	36.4	Very low	166 Å²	166	110.8 Å²	110.8	89%	0.888	68%	0.683	S	S	*	*			trans	1.8	137.1	149	-51.9	-12	0	0	0	119
136	G	41.3	Very low	36.4	Very low	58 Å²	58	118 Å²	118	60%	0.598	70%	0.696	S	S	*	*			trans	-178	61.6	170.3	0	0	0	0	0	116.8	F138	G136-F138 PolarHBondContact O-N 2.76Å
137	T	49.7	Very low	36.6	Very low	125 Å²	125	111.2 Å²	111.2	77%	0.767	69%	0.69	S	S	*	*			trans	-61.8	127.1	174.4	-18.8	0	0	0	0	111.9
138	F	31.6	Very low	36.6	Very low	158 Å²	158	114.1 Å²	114.1	69%	0.693	69%	0.692	S	S	*	*			trans	-144.2	76.5	159.1	-123	-76	0	0	0	112.7	G136 G144	G136-F138 PolarHBondContact O-N 2.76Å; F138-G144 PolarHBondContact O-N 2.64Å
139	L	49.9	Very low	37.1	Very low	100 Å²	100	114.1 Å²	114.1	52%	0.524	69%	0.693	S	S	.	*			trans	-64.7	151.8	151.1	-61.8	167.2	0	0	0	107.6	G142 T143	L139-G142 VanDerWaalsContact CD2-C 3.49Å; L139-T143 WeakPolarHBondContact CA-OG1 3.37Å; L139-T143 WeakPolarHBondContact CD2-O 3.44Å
140	P	41.8	Very low	37.6	Very low	102 Å²	102	117.9 Å²	117.9	66%	0.662	71%	0.706	S	S	*	*	S	Bend		-141.3	168	55.2	39.9	-22	0	0	0	115.8	T143	P140-T143 VanDerWaalsContact CA-OG1 3.31Å; P140-T143 WeakPolarHBondContact CA-OG1 3.14Å; P140-T143 VanDerWaalsContact N-OG1 3.12Å; P140-T143 WeakPolarHBondContact O-CG2 3.4Å; P140-T143 PolarHBondContact O-OG1 2.88Å
141	G	41.9	Very low	38.3	Very low	93 Å²	93	118.9 Å²	118.9	96%	0.959	71%	0.706	S	S	*	*	S	Bend	cis	-116.2	41.8	-6.4	0	0	0	0	0	115.5
142	G	44.2	Very low	39.1	Very low	47 Å²	47	118.5 Å²	118.5	49%	0.485	70%	0.703	S	S	.	*	S	Bend	cis	-174.2	155.9	-2.9	0	0	0	0	0	111.4	L139	L139-G142 VanDerWaalsContact CD2-C 3.49Å
143	T	35	Very low	39.5	Very low	85 Å²	85	119.2 Å²	119.2	52%	0.521	71%	0.706	S	S	.	*			cis	89.2	162.2	32.2	67	0	0	0	0	115.1	L139 P140	L139-T143 WeakPolarHBondContact CA-OG1 3.37Å; L139-T143 WeakPolarHBondContact CD2-O 3.44Å; P140-T143 VanDerWaalsContact CA-OG1 3.31Å; P140-T143 WeakPolarHBondContact CA-OG1 3.14Å; P140-T143 VanDerWaalsContact N-OG1 3.12Å; P140-T143 WeakPolarHBondContact O-CG2 3.4Å; P140-T143 PolarHBondContact O-OG1 2.88Å
144	G	38.3	Very low	40.3	Very low	49 Å²	49	122.2 Å²	122.2	51%	0.505	71%	0.712	S	S	.	*			trans	93.3	56.8	-154.8	0	0	0	0	0	111.9	F138	F138-G144 PolarHBondContact O-N 2.64Å
145	T	36.2	Very low	40.7	Very low	93 Å²	93	125.9 Å²	125.9	57%	0.571	72%	0.718	S	S	*	*				55.7	141.8	73.7	66.1	0	0	0	0	112.9
146	Y	33.6	Very low	40.8	Very low	200 Å²	200	129.1 Å²	129.1	78%	0.784	72%	0.717	S	S	*	*			cis	-140	157.1	47.3	-48.6	-90.9	0	0	0	112.9
147	G	37	Very low	41.6	Very low	65 Å²	65	132.2 Å²	132.2	67%	0.67	73%	0.727	S	S	*	*			cis	165.2	168.8	-7.9	0	0	0	0	0	114.2
148	R	38.8	Very low	41.9	Very low	243 Å²	243	135.7 Å²	135.7	92%	0.917	73%	0.734	S	S	*	*			trans	77.6	141.5	171.6	-69.5	-173.2	165.3	-171.6	-3.2	119.6
149	S	37.9	Very low	43	Very low	103 Å²	103	131.4 Å²	131.4	72%	0.72	74%	0.735	S	S	*	*			cis	-172.8	163.2	-19.5	-111.3	0	0	0	0	114.4
150	R	38.5	Very low	43.6	Very low	229 Å²	229	133.6 Å²	133.6	86%	0.864	75%	0.746	S	S	*	*			trans	72.6	145.2	170.3	-71.2	180	174.5	171.3	-1.8	114.7
151	L	39.9	Very low	44.8	Very low	143 Å²	143	132.5 Å²	132.5	75%	0.749	74%	0.735	S	S	*	*			cis	-148.6	179.6	-10.7	-91.1	150.9	0	0	0	105.7
152	T	45.1	Very low	46	Very low	122 Å²	122	132.3 Å²	132.3	75%	0.748	72%	0.717	S	S	*	*			cis	-158	168.8	11.2	-8	0	0	0	0	107.9
153	P	40	Very low	47.5	Very low	114 Å²	114	133.7 Å²	133.7	74%	0.74	72%	0.716	S	S	*	*			trans	-96	134.8	-164.3	35.9	-33.2	0	0	0	116.7
154	I	50.1	Low	49.4	Very low	165 Å²	165	136 Å²	136	85%	0.846	72%	0.721	S	S	*	*			trans	-173.3	141.6	134.7	-100.9	163.2	0	0	0	108.4
155	Q	42.3	Very low	51.2	Low	184 Å²	184	138.4 Å²	138.4	86%	0.86	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-79.6	132.8	177.1	-170.4	170.4	0.6	0	0	110.2
156	R	42.7	Very low	53.1	Low	234 Å²	234	139.1 Å²	139.1	88%	0.883	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-73.7	134	176.8	-70.7	-171.5	177.9	-164.3	-0.5	110.1
157	P	58.2	Low	55.3	Low	122 Å²	122	136.2 Å²	136.2	79%	0.792	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-71.1	155.2	-176.8	29.7	-35.8	0	0	0	112.2	G159	P157-G159 PolarHBondContact O-N 2.87Å
158	Q	56.7	Low	57.5	Low	198 Å²	198	137 Å²	137	93%	0.925	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-70.2	124.1	169.7	-163.4	169.6	14.7	0	0	108.8
159	G	54.1	Low	59.4	Low	69 Å²	69	132.9 Å²	132.9	71%	0.711	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-79.9	144.1	-176.6	0	0	0	0	0	112.7	P157	P157-G159 PolarHBondContact O-N 2.87Å
160	L	62.9	Low	61.6	Low	145 Å²	145	130.6 Å²	130.6	76%	0.759	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-61	139.1	161.2	-70.4	167	0	0	0	109.3	P162 L165	L160-P162 VanDerWaalsContact O-CD 3.28Å; L160-P162 WeakPolarHBondContact O-CD 3.23Å; L160-L165 HydrophobicContact CB-CD1 4.42Å
161	D	66.7	Low	63.7	Low	80 Å²	80	125.6 Å²	125.6	43%	0.428	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-71.2	116.4	178.2	-177.3	3.2	0	0	0	110.4	V163 E164 L165	D161-V163 PolarHBondContact O-N 2.73Å; D161-V163 VanDerWaalsContact OD1-CB 3.3Å; D161-V163 WeakPolarHBondContact OD1-CB 3.21Å; D161-V163 WeakPolarHBondContact OD1-CG2 3.4Å; D161-V163 PolarHBondContact OD1-N 2.92Å; D161-E164 HydrophobicContact CB-CB 4.1Å; D161-E164 PolarHBondContact O-N 3.24Å; D161-E164 VanDerWaalsContact O-N 3.11Å; D161-L165 PolarHBondContact O-N 3.02Å
162	P	67.6	Low	65.9	Low	88 Å²	88	126.1 Å²	126.1	57%	0.571	64%	0.64	S	S	*	*	H	α-helix	trans	-62.7	-22.6	175.5	27.4	-35.6	0	0	0	112.8	L160 E164 L166	L160-P162 VanDerWaalsContact O-CD 3.28Å; L160-P162 WeakPolarHBondContact O-CD 3.23Å; P162-E164 VanDerWaalsContact C-N 3.35Å; P162-L166 WeakPolarHBondContact O-CB 3.48Å; P162-L166 WeakPolarHBondContact O-CD1 3.25Å; P162-L166 WeakPolarHBondContact O-CG 3.43Å; P162-L166 PolarHBondContact O-N 2.77Å
163	V	74.9	Confident	67.7	Low	77 Å²	77	123 Å²	123	47%	0.467	62%	0.618	S	S	.	*	H	α-helix	trans	-69	-35.2	175	-175.8	0	0	0	0	111.1	D161 L166 K167	D161-V163 PolarHBondContact O-N 2.73Å; D161-V163 VanDerWaalsContact OD1-CB 3.3Å; D161-V163 WeakPolarHBondContact OD1-CB 3.21Å; D161-V163 WeakPolarHBondContact OD1-CG2 3.4Å; D161-V163 PolarHBondContact OD1-N 2.92Å; V163-L166 PolarHBondContact O-N 2.89Å; V163-K167 WeakPolarHBondContact O-CG 3.35Å; V163-K167 PolarHBondContact O-N 3.48Å
164	E	76.3	Confident	69.8	Low	133 Å²	133	122.5 Å²	122.5	62%	0.621	61%	0.605	S	S	*	*	H	α-helix	trans	-71.3	-46.3	178.5	-168.9	163.6	-121.7	0	0	111.6	D161 P162 L166 K167 E168	D161-E164 HydrophobicContact CB-CB 4.1Å; D161-E164 PolarHBondContact O-N 3.24Å; D161-E164 VanDerWaalsContact O-N 3.11Å; P162-E164 VanDerWaalsContact C-N 3.35Å; E164-L166 VanDerWaalsContact C-N 3.26Å; E164-L166 PolarHBondContact O-N 3.33Å; E164-K167 WeakPolarHBondContact O-CB 3.41Å; E164-K167 PolarHBondContact O-N 3.15Å; E164-K167 VanDerWaalsContact O-N 3.15Å; E164-E168 PolarHBondContact O-N 3.02Å
165	L	76.1	Confident	71.5	Confident	100 Å²	100	118.5 Å²	118.5	52%	0.524	59%	0.592	S	S	.	*	H	α-helix	trans	-57.8	-35.7	171	-85.7	160.6	0	0	0	112.9	L160 D161 R169	L160-L165 HydrophobicContact CB-CD1 4.42Å; D161-L165 PolarHBondContact O-N 3.02Å; L165-R169 WeakPolarHBondContact O-CB 3.37Å; L165-R169 PolarHBondContact O-N 3Å
166	L	75.4	Confident	73.5	Confident	107 Å²	107	117.9 Å²	117.9	56%	0.56	58%	0.582	S	S	*	*	H	α-helix	trans	-71.6	-39.5	175.3	-76.5	169.1	0	0	0	112.7	P162 V163 E164 R169 E170	P162-L166 WeakPolarHBondContact O-CB 3.48Å; P162-L166 WeakPolarHBondContact O-CD1 3.25Å; P162-L166 WeakPolarHBondContact O-CG 3.43Å; P162-L166 PolarHBondContact O-N 2.77Å; V163-L166 PolarHBondContact O-N 2.89Å; E164-L166 VanDerWaalsContact C-N 3.26Å; E164-L166 PolarHBondContact O-N 3.33Å; L166-R169 PolarHBondContact O-N 3.44Å; L166-E170 PolarHBondContact O-N 3.03Å
167	K	79.9	Confident	75.6	Confident	140 Å²	140	108.6 Å²	108.6	61%	0.609	55%	0.549	S	S	*	.	H	α-helix	trans	-59.9	-49	173.6	-78	173.1	178.4	173.4	0	111.4	V163 E164 R169 E170 Q171	V163-K167 WeakPolarHBondContact O-CG 3.35Å; V163-K167 PolarHBondContact O-N 3.48Å; E164-K167 WeakPolarHBondContact O-CB 3.41Å; E164-K167 PolarHBondContact O-N 3.15Å; E164-K167 VanDerWaalsContact O-N 3.15Å; K167-R169 VanDerWaalsContact C-N 3.31Å; K167-R169 PolarHBondContact O-N 3.02Å; K167-E170 PolarHBondContact O-N 2.72Å; K167-Q171 WeakPolarHBondContact O-CG 3.44Å; K167-Q171 PolarHBondContact O-N 3.45Å
168	E	82.9	Confident	76.9	Confident	81 Å²	81	105.8 Å²	105.8	38%	0.379	54%	0.536	S	S	.	.	H	α-helix	trans	-62.4	-40.7	-179.1	-156.7	-151.2	177.4	0	0	111.5	E164 E170 Q171 R172	E164-E168 PolarHBondContact O-N 3.02Å; E168-E170 PolarHBondContact O-N 2.96Å; E168-Q171 PolarHBondContact O-N 2.77Å; E168-R172 VanDerWaalsContact CD-CZ 3.48Å; E168-R172 WeakPolarHBondContact O-CG 3.21Å; E168-R172 PolarHBondContact O-N 3.41Å; E168-R172 VanDerWaalsContact O-N 3.09Å; E168-R172 IonicContact OE1-CZ 3.12Å; E168-R172 VanDerWaalsContact OE1-CZ 3.28Å; E168-R172 IonicContact OE1-NE 2.7Å; E168-R172 PolarHBondContact OE1-NE 3.43Å; E168-R172 IonicContact OE1-NH2 2.62Å; E168-R172 PolarHBondContact OE1-NH2 2.87Å; E168-R172 IonicContact OE2-CZ 2.94Å; E168-R172 IonicContact OE2-NE 3.16Å; E168-R172 IonicContact OE2-NH1 2.7Å; E168-R172 IonicContact OE2-NH2 2.77Å; E168-R172 PolarHBondContact OE2-NH2 2.88Å
169	R	80.2	Confident	78.3	Confident	156 Å²	156	101.6 Å²	101.6	59%	0.589	52%	0.517	S	S	*	.	H	α-helix	trans	-61.2	-43	175.2	-177.8	175.7	177.7	-85.9	2.3	112.6	L165 L166 K167 R172 I173	L165-R169 WeakPolarHBondContact O-CB 3.37Å; L165-R169 PolarHBondContact O-N 3Å; L166-R169 PolarHBondContact O-N 3.44Å; K167-R169 VanDerWaalsContact C-N 3.31Å; K167-R169 PolarHBondContact O-N 3.02Å; R169-R172 PolarHBondContact O-N 2.85Å; R169-I173 HydrophobicContact CG-CD1 4.24Å; R169-I173 WeakPolarHBondContact O-CG1 3.31Å; R169-I173 PolarHBondContact O-N 2.62Å
170	E	82.8	Confident	79.8	Confident	55 Å²	55	101.5 Å²	101.5	26%	0.257	50%	0.495	S	S	.	.	H	α-helix	trans	-68.5	-38.8	178.9	-177.9	60.8	-163.3	0	0	111.7	L166 K167 E168 R172 I173 Q174 R213	L166-E170 PolarHBondContact O-N 3.03Å; K167-E170 PolarHBondContact O-N 2.72Å; E168-E170 PolarHBondContact O-N 2.96Å; E170-R172 PolarHBondContact O-N 2.99Å; E170-I173 WeakPolarHBondContact O-CB 3.38Å; E170-I173 PolarHBondContact O-N 3.31Å; E170-Q174 WeakPolarHBondContact O-CG 3.45Å; E170-Q174 PolarHBondContact O-N 3.19Å; E170-Q174 PolarHBondContact OE1-NE2 2.61Å; E170-R213 IonicContact OE1-CZ 2.98Å; E170-R213 VanDerWaalsContact OE1-CZ 3.24Å; E170-R213 IonicContact OE1-NH1 2.69Å; E170-R213 PolarHBondContact OE1-NH1 2.9Å; E170-R213 IonicContact OE1-NH2 2.73Å; E170-R213 PolarHBondContact OE1-NH2 2.79Å; E170-R213 IonicContact OE2-NH2 3.3Å
171	Q	83.2	Confident	80.9	Confident	124 Å²	124	96.9 Å²	96.9	58%	0.579	47%	0.47	S	S	*	.	H	α-helix	trans	-57.9	-48.8	172.5	-73.5	177.7	-14.7	0	0	111.9	K167 E168 I173 Q174 S175	K167-Q171 WeakPolarHBondContact O-CG 3.44Å; K167-Q171 PolarHBondContact O-N 3.45Å; E168-Q171 PolarHBondContact O-N 2.77Å; Q171-I173 PolarHBondContact O-N 2.83Å; Q171-Q174 PolarHBondContact O-N 2.78Å; Q171-Q174 VanDerWaalsContact O-N 3.1Å; Q171-S175 PolarHBondContact O-N 2.89Å; Q171-S175 PolarHBondContact O-OG 3.45Å
172	R	85.4	Confident	81.9	Confident	154 Å²	154	100.7 Å²	100.7	58%	0.581	48%	0.483	S	S	*	.	H	α-helix	trans	-58.9	-34.1	177.3	-67.6	171	-176.6	-179.3	0.5	112.5	E168 R169 E170 R176	E168-R172 VanDerWaalsContact CD-CZ 3.48Å; E168-R172 WeakPolarHBondContact O-CG 3.21Å; E168-R172 PolarHBondContact O-N 3.41Å; E168-R172 VanDerWaalsContact O-N 3.09Å; E168-R172 IonicContact OE1-CZ 3.12Å; E168-R172 VanDerWaalsContact OE1-CZ 3.28Å; E168-R172 IonicContact OE1-NE 2.7Å; E168-R172 PolarHBondContact OE1-NE 3.43Å; E168-R172 IonicContact OE1-NH2 2.62Å; E168-R172 PolarHBondContact OE1-NH2 2.87Å; E168-R172 IonicContact OE2-CZ 2.94Å; E168-R172 IonicContact OE2-NE 3.16Å; E168-R172 IonicContact OE2-NH1 2.7Å; E168-R172 IonicContact OE2-NH2 2.77Å; E168-R172 PolarHBondContact OE2-NH2 2.88Å; R169-R172 PolarHBondContact O-N 2.85Å; E170-R172 PolarHBondContact O-N 2.99Å; R172-R176 WeakPolarHBondContact O-CG 3.3Å; R172-R176 PolarHBondContact O-N 3.42Å
173	I	82.6	Confident	82.6	Confident	56 Å²	56	99.7 Å²	99.7	29%	0.287	47%	0.471	S	S	.	.	H	α-helix	trans	-70	-44	175	-69.8	165.9	0	0	0	110.9	R169 E170 Q171 S175 R176 I177	R169-I173 HydrophobicContact CG-CD1 4.24Å; R169-I173 WeakPolarHBondContact O-CG1 3.31Å; R169-I173 PolarHBondContact O-N 2.62Å; E170-I173 WeakPolarHBondContact O-CB 3.38Å; E170-I173 PolarHBondContact O-N 3.31Å; Q171-I173 PolarHBondContact O-N 2.83Å; I173-S175 PolarHBondContact O-N 3.24Å; I173-R176 PolarHBondContact O-N 2.77Å; I173-I177 HydrophobicContact CG2-CD1 3.81Å; I173-I177 WeakPolarHBondContact O-CG1 3.48Å; I173-I177 PolarHBondContact O-N 2.7Å; I173-I177 VanDerWaalsContact O-N 3.11Å
174	Q	84.4	Confident	82.9	Confident	104 Å²	104	96.6 Å²	96.6	49%	0.486	45%	0.452	S	S	.	.	H	α-helix	trans	-61.7	-42.5	177.7	-69.6	174.1	11.9	0	0	111.9	E170 Q171 R176 I177 A178	E170-Q174 WeakPolarHBondContact O-CG 3.45Å; E170-Q174 PolarHBondContact O-N 3.19Å; E170-Q174 PolarHBondContact OE1-NE2 2.61Å; Q171-Q174 PolarHBondContact O-N 2.78Å; Q171-Q174 VanDerWaalsContact O-N 3.1Å; Q174-R176 PolarHBondContact O-N 2.69Å; Q174-I177 PolarHBondContact O-N 2.86Å; Q174-A178 PolarHBondContact O-N 2.81Å
175	S	86.7	Confident	83.1	Confident	81 Å²	81	93.8 Å²	93.8	57%	0.566	45%	0.447	S	S	*	.	H	α-helix	trans	-61.5	-41.8	175.7	-56	0	0	0	0	113.1	Q171 I173 I177 A178 Q179	Q171-S175 PolarHBondContact O-N 2.89Å; Q171-S175 PolarHBondContact O-OG 3.45Å; I173-S175 PolarHBondContact O-N 3.24Å; S175-I177 VanDerWaalsContact C-N 3.34Å; S175-I177 PolarHBondContact O-N 2.93Å; S175-A178 PolarHBondContact O-N 2.74Å; S175-Q179 PolarHBondContact O-N 2.87Å
176	R	84.9	Confident	83.1	Confident	172 Å²	172	92.9 Å²	92.9	65%	0.649	45%	0.449	S	S	*	.	H	α-helix	trans	-59.8	-42.3	174.1	-79	-79.6	-157.3	142.1	4.8	112	R172 I173 Q174 R180	R172-R176 WeakPolarHBondContact O-CG 3.3Å; R172-R176 PolarHBondContact O-N 3.42Å; I173-R176 PolarHBondContact O-N 2.77Å; Q174-R176 PolarHBondContact O-N 2.69Å; R176-R180 PolarHBondContact O-N 3.45Å
177	I	85.5	Confident	82.6	Confident	38 Å²	38	92.4 Å²	92.4	20%	0.195	45%	0.446	C	S	.	.	H	α-helix	trans	-66.8	-44.2	178.6	-68.2	160.1	0	0	0	110.6	I173 Q174 S175 Q179 R180 I181 L206 L209	I173-I177 HydrophobicContact CG2-CD1 3.81Å; I173-I177 WeakPolarHBondContact O-CG1 3.48Å; I173-I177 PolarHBondContact O-N 2.7Å; I173-I177 VanDerWaalsContact O-N 3.11Å; Q174-I177 PolarHBondContact O-N 2.86Å; S175-I177 VanDerWaalsContact C-N 3.34Å; S175-I177 PolarHBondContact O-N 2.93Å; I177-Q179 PolarHBondContact O-N 3.49Å; I177-R180 PolarHBondContact O-N 3.02Å; I177-I181 HydrophobicContact CG2-CD1 3.87Å; I177-I181 HydrophobicContact CG2-CG1 4.46Å; I177-I181 WeakPolarHBondContact O-CG1 3.38Å; I177-I181 PolarHBondContact O-N 3.06Å; I177-L206 HydrophobicContact CG2-CD2 4.41Å; I177-L209 HydrophobicContact CD1-CD2 3.69Å
178	A	86.3	Confident	81.5	Confident	63 Å²	63	91.1 Å²	91.1	52%	0.521	45%	0.451	S	S	.	.	H	α-helix	trans	-60.4	-43	176.7	0	0	0	0	0	112.2	Q174 S175 I181 K182	Q174-A178 PolarHBondContact O-N 2.81Å; S175-A178 PolarHBondContact O-N 2.74Å; A178-I181 PolarHBondContact O-N 3.16Å; A178-K182 PolarHBondContact O-N 3.17Å; A178-K182 VanDerWaalsContact O-N 3.08Å
179	Q	86.2	Confident	80.3	Confident	110 Å²	110	93.9 Å²	93.9	51%	0.514	47%	0.472	S	S	.	.	H	α-helix	trans	-58.5	-48.7	172.6	-178.2	-172.4	-28.5	0	0	111.3	S175 I177 I181 K182 E183	S175-Q179 PolarHBondContact O-N 2.87Å; I177-Q179 PolarHBondContact O-N 3.49Å; Q179-I181 VanDerWaalsContact C-N 3.35Å; Q179-I181 PolarHBondContact O-N 3.16Å; Q179-K182 WeakPolarHBondContact O-CA 3.18Å; Q179-K182 WeakPolarHBondContact O-CB 3.47Å; Q179-K182 PolarHBondContact O-N 2.94Å; Q179-E183 PolarHBondContact NE2-OE1 2.75Å; Q179-E183 PolarHBondContact O-N 3.43Å
180	R	85.1	Confident	79.2	Confident	68 Å²	68	92.1 Å²	92.1	26%	0.257	48%	0.484	S	S	.	.	H	α-helix	trans	-65.7	-36.4	-177.3	-172.7	56.9	179.5	164	7.5	112.9	R176 I177 K182 E183 L184 E202 L206	R176-R180 PolarHBondContact O-N 3.45Å; I177-R180 PolarHBondContact O-N 3.02Å; R180-K182 VanDerWaalsContact C-N 3.31Å; R180-K182 PolarHBondContact O-N 3.35Å; R180-E183 WeakPolarHBondContact CD-OE2 3.35Å; R180-E183 IonicContact CZ-OE2 3.15Å; R180-E183 IonicContact NE-OE2 3.39Å; R180-E183 IonicContact NH1-OE2 3.16Å; R180-E183 PolarHBondContact NH1-OE2 3.44Å; R180-E183 PolarHBondContact O-N 2.66Å; R180-L184 HydrophobicContact CG-CD1 4.14Å; R180-L184 WeakPolarHBondContact O-CB 3.09Å; R180-L184 VanDerWaalsContact O-CG 3.3Å; R180-L184 WeakPolarHBondContact O-CG 3.5Å; R180-L184 PolarHBondContact O-N 2.9Å; R180-E202 IonicContact CZ-OE1 2.77Å; R180-E202 IonicContact CZ-OE2 3.73Å; R180-E202 IonicContact NE-OE1 3.52Å; R180-E202 PolarHBondContact NE-OE1 2.81Å; R180-E202 IonicContact NE-OE2 2.79Å; R180-E202 IonicContact NH2-OE1 3.67Å; R180-E202 PolarHBondContact NH2-OE1 2.95Å; R180-E202 VanDerWaalsContact NH2-OE1 3.1Å; R180-E202 IonicContact NH2-OE2 3.87Å; R180-E202 PolarHBondContact NH2-OE2 2.91Å; R180-L206 HydrophobicContact CB-CD1 4.25Å; R180-L206 HydrophobicContact CG-CD1 3.83Å
181	I	86.6	Confident	78.2	Confident	47 Å²	47	90.8 Å²	90.8	24%	0.241	48%	0.481	C	S	.	.	H	α-helix	trans	-61.7	-40.9	171.6	-68.7	169.5	0	0	0	110.5	I177 A178 Q179 L184 S185 L203 L206	I177-I181 HydrophobicContact CG2-CD1 3.87Å; I177-I181 HydrophobicContact CG2-CG1 4.46Å; I177-I181 WeakPolarHBondContact O-CG1 3.38Å; I177-I181 PolarHBondContact O-N 3.06Å; A178-I181 PolarHBondContact O-N 3.16Å; Q179-I181 VanDerWaalsContact C-N 3.35Å; Q179-I181 PolarHBondContact O-N 3.16Å; I181-L184 PolarHBondContact O-N 3.02Å; I181-S185 WeakPolarHBondContact O-CB 3.42Å; I181-S185 PolarHBondContact O-N 3.48Å; I181-S185 PolarHBondContact O-OG 3.04Å; I181-L203 HydrophobicContact CG2-CD1 4.14Å; I181-L206 HydrophobicContact CD1-CB 4.12Å; I181-L206 HydrophobicContact CG1-CB 3.85Å; I181-L206 HydrophobicContact CG1-CD1 3.99Å
182	K	86.3	Confident	77.7	Confident	161 Å²	161	88.3 Å²	88.3	70%	0.7	48%	0.475	S	S	*	.	H	α-helix	trans	-62.9	-48.5	176.5	-168.5	179.1	-178.8	-179.6	0	111.7	A178 Q179 R180 L184 S185 S186	A178-K182 PolarHBondContact O-N 3.17Å; A178-K182 VanDerWaalsContact O-N 3.08Å; Q179-K182 WeakPolarHBondContact O-CA 3.18Å; Q179-K182 WeakPolarHBondContact O-CB 3.47Å; Q179-K182 PolarHBondContact O-N 2.94Å; R180-K182 VanDerWaalsContact C-N 3.31Å; R180-K182 PolarHBondContact O-N 3.35Å; K182-L184 PolarHBondContact O-N 3.33Å; K182-S185 WeakPolarHBondContact CA-OG 3.2Å; K182-S185 PolarHBondContact O-N 3.37Å; K182-S185 PolarHBondContact O-OG 3.36Å; K182-S186 PolarHBondContact O-N 3.01Å
183	E	82.9	Confident	77.1	Confident	66 Å²	66	85.2 Å²	85.2	31%	0.308	48%	0.477	S	S	.	.	H	α-helix	trans	-53.5	-53.7	174.5	-70.5	169.2	-164.7	0	0	111.4	Q179 R180 S185 S186	Q179-E183 PolarHBondContact NE2-OE1 2.75Å; Q179-E183 PolarHBondContact O-N 3.43Å; R180-E183 WeakPolarHBondContact CD-OE2 3.35Å; R180-E183 IonicContact CZ-OE2 3.15Å; R180-E183 IonicContact NE-OE2 3.39Å; R180-E183 IonicContact NH1-OE2 3.16Å; R180-E183 PolarHBondContact NH1-OE2 3.44Å; R180-E183 PolarHBondContact O-N 2.66Å; E183-S185 VanDerWaalsContact C-N 3.28Å; E183-S185 PolarHBondContact O-N 3.11Å; E183-S186 PolarHBondContact O-N 2.95Å; E183-S186 PolarHBondContact O-OG 3.48Å
184	L	82	Confident	76.8	Confident	13 Å²	13	90.2 Å²	90.2	7%	0.068	50%	0.498	C	S	.	.	H	α-helix	trans	-63.7	-32.1	-179	-70.1	169.4	0	0	0	113.1	R180 I181 K182 S186 L187 L199 E202 L203 L206	R180-L184 HydrophobicContact CG-CD1 4.14Å; R180-L184 WeakPolarHBondContact O-CB 3.09Å; R180-L184 VanDerWaalsContact O-CG 3.3Å; R180-L184 WeakPolarHBondContact O-CG 3.5Å; R180-L184 PolarHBondContact O-N 2.9Å; I181-L184 PolarHBondContact O-N 3.02Å; K182-L184 PolarHBondContact O-N 3.33Å; L184-S186 PolarHBondContact O-N 3Å; L184-L187 HydrophobicContact CD2-CD1 4.48Å; L184-L199 HydrophobicContact CD2-CB 4.42Å; L184-L199 HydrophobicContact CD2-CD2 3.59Å; L184-E202 HydrophobicContact CD1-CB 4.02Å; L184-E202 HydrophobicContact CD1-CG 3.76Å; L184-E202 HydrophobicContact CD2-CB 4.43Å; L184-L203 HydrophobicContact CB-CB 4.31Å; L184-L203 HydrophobicContact CB-CD1 4.13Å; L184-L203 HydrophobicContact CD1-CB 4.35Å; L184-L206 HydrophobicContact CD1-CD1 3.75Å
185	S	80.2	Confident	76.4	Confident	73 Å²	73	90.2 Å²	90.2	51%	0.51	50%	0.499	S	S	.	.	H	α-helix	trans	-71.4	-16.5	175.3	70.8	0	0	0	0	114.3	I181 K182 E183	I181-S185 WeakPolarHBondContact O-CB 3.42Å; I181-S185 PolarHBondContact O-N 3.48Å; I181-S185 PolarHBondContact O-OG 3.04Å; K182-S185 WeakPolarHBondContact CA-OG 3.2Å; K182-S185 PolarHBondContact O-N 3.37Å; K182-S185 PolarHBondContact O-OG 3.36Å; E183-S185 VanDerWaalsContact C-N 3.28Å; E183-S185 PolarHBondContact O-N 3.11Å
186	S	75.8	Confident	76	Confident	82 Å²	82	91.6 Å²	91.6	57%	0.573	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-7.3	-177.4	71.4	0	0	0	0	114.8	K182 E183 L184 T188	K182-S186 PolarHBondContact O-N 3.01Å; E183-S186 PolarHBondContact O-N 2.95Å; E183-S186 PolarHBondContact O-OG 3.48Å; L184-S186 PolarHBondContact O-N 3Å; S186-T188 PolarHBondContact O-N 2.9Å; S186-T188 VanDerWaalsContact O-N 3.11Å
187	L	65.5	Low	75.8	Confident	96 Å²	96	87.6 Å²	87.6	50%	0.503	49%	0.486	S	S	.	.			trans	-84.6	83.6	-173	-78.2	168.5	0	0	0	113	L184 L199	L184-L187 HydrophobicContact CD2-CD1 4.48Å; L187-L199 HydrophobicContact CD1-CD1 4.25Å; L187-L199 HydrophobicContact CD1-CD2 4.14Å
188	T	55.1	Low	75.6	Confident	114 Å²	114	89.3 Å²	89.3	70%	0.699	50%	0.501	S	S	*	.			trans	-111	172.8	169	55.8	0	0	0	0	112.4	S186 S190	S186-T188 PolarHBondContact O-N 2.9Å; S186-T188 VanDerWaalsContact O-N 3.11Å; T188-S190 PolarHBondContact O-N 2.66Å; T188-S190 VanDerWaalsContact O-N 3.15Å
189	V	57.6	Low	75.4	Confident	138 Å²	138	88.4 Å²	88.4	84%	0.836	49%	0.488	S	S	*	.	S	Bend	trans	77.1	-41.2	170.9	-169.6	0	0	0	0	119
190	S	58.6	Low	75.4	Confident	120 Å²	120	87.2 Å²	87.2	84%	0.839	48%	0.484	S	S	*	.	S	Bend	trans	-131.8	60.3	-171.4	-155.4	0	0	0	0	116.6	T188	T188-S190 PolarHBondContact O-N 2.66Å; T188-S190 VanDerWaalsContact O-N 3.15Å
191	S	61.9	Low	75.4	Confident	27 Å²	27	89 Å²	89	19%	0.189	50%	0.497	C	S	.	.			trans	-135.9	144	173	52.3	0	0	0	0	112.9	R196	S191-R196 PolarHBondContact O-NH1 3.14Å; S191-R196 PolarHBondContact O-NH2 3.18Å
192	T	71.1	Confident	75.4	Confident	72 Å²	72	89.7 Å²	89.7	44%	0.442	50%	0.5	S	S	.	.			trans	-65.7	167.4	173.4	57.6	0	0	0	0	111.7	Q195 R196	T192-Q195 VanDerWaalsContact N-OE1 3.09Å; T192-Q195 PolarHBondContact O-N 3.41Å; T192-Q195 WeakPolarHBondContact OG1-CB 3.38Å; T192-Q195 WeakPolarHBondContact OG1-CG 3.37Å; T192-Q195 PolarHBondContact OG1-N 3.11Å; T192-Q195 PolarHBondContact OG1-OE1 2.93Å; T192-R196 VanDerWaalsContact O-CB 3.28Å; T192-R196 WeakPolarHBondContact O-CB 3.42Å; T192-R196 PolarHBondContact O-N 3.16Å; T192-R196 PolarHBondContact O-NH1 2.93Å
193	S	73.3	Confident	75.5	Confident	89 Å²	89	83.1 Å²	83.1	62%	0.622	47%	0.472	S	S	*	.	H	α-helix	trans	-56	-51.1	177	45.6	0	0	0	0	111.9	R196 V197	S193-R196 PolarHBondContact O-N 2.91Å; S193-V197 WeakPolarHBondContact O-CG2 3.39Å; S193-V197 PolarHBondContact O-N 3.19Å
194	E	76.8	Confident	75.7	Confident	160 Å²	160	88.4 Å²	88.4	75%	0.748	49%	0.489	S	S	*	.	H	α-helix	trans	-60.9	-47.2	178.8	-60.1	-174	139.9	0	0	112.4	R196 V197 S198	E194-R196 VanDerWaalsContact C-N 3.35Å; E194-R196 PolarHBondContact O-N 3.35Å; E194-V197 PolarHBondContact O-N 3.37Å; E194-S198 PolarHBondContact O-N 3.47Å
195	Q	75.5	Confident	76	Confident	105 Å²	105	90.7 Å²	90.7	49%	0.491	51%	0.51	S	S	.	.	H	α-helix	trans	-62.3	-41.3	178	-72.5	164.9	-22.9	0	0	111.8	T192 S198 L199	T192-Q195 VanDerWaalsContact N-OE1 3.09Å; T192-Q195 PolarHBondContact O-N 3.41Å; T192-Q195 WeakPolarHBondContact OG1-CB 3.38Å; T192-Q195 WeakPolarHBondContact OG1-CG 3.37Å; T192-Q195 PolarHBondContact OG1-N 3.11Å; T192-Q195 PolarHBondContact OG1-OE1 2.93Å; Q195-S198 PolarHBondContact O-N 3.27Å; Q195-L199 WeakPolarHBondContact O-CB 3.15Å; Q195-L199 VanDerWaalsContact O-CG 3.28Å; Q195-L199 WeakPolarHBondContact O-CG 3.49Å; Q195-L199 PolarHBondContact O-N 3.27Å
196	R	78.5	Confident	76.4	Confident	110 Å²	110	89.1 Å²	89.1	42%	0.415	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-40.6	176.7	-177.7	-174.8	-74.6	86.9	-2.7	111.7	S191 T192 S193 E194 L199 L200	S191-R196 PolarHBondContact O-NH1 3.14Å; S191-R196 PolarHBondContact O-NH2 3.18Å; T192-R196 VanDerWaalsContact O-CB 3.28Å; T192-R196 WeakPolarHBondContact O-CB 3.42Å; T192-R196 PolarHBondContact O-N 3.16Å; T192-R196 PolarHBondContact O-NH1 2.93Å; S193-R196 PolarHBondContact O-N 2.91Å; E194-R196 VanDerWaalsContact C-N 3.35Å; E194-R196 PolarHBondContact O-N 3.35Å; R196-L199 PolarHBondContact O-N 2.84Å; R196-L200 HydrophobicContact CG-CD1 4.14Å; R196-L200 WeakPolarHBondContact O-CB 3.39Å; R196-L200 VanDerWaalsContact O-CG 3.27Å; R196-L200 WeakPolarHBondContact O-CG 3.38Å; R196-L200 PolarHBondContact O-N 3.08Å
197	V	82	Confident	77	Confident	87 Å²	87	93.6 Å²	93.6	53%	0.527	50%	0.5	S	S	.	.	H	α-helix	trans	-62	-46.4	172.6	170.5	0	0	0	0	110.7	S193 E194 L199 L200 I201	S193-V197 WeakPolarHBondContact O-CG2 3.39Å; S193-V197 PolarHBondContact O-N 3.19Å; E194-V197 PolarHBondContact O-N 3.37Å; V197-L199 PolarHBondContact O-N 3.05Å; V197-L200 PolarHBondContact O-N 3.41Å; V197-I201 HydrophobicContact CG1-CD1 3.75Å; V197-I201 HydrophobicContact CG1-CG1 4.46Å; V197-I201 VanDerWaalsContact O-CG1 3.29Å; V197-I201 WeakPolarHBondContact O-CG1 3.3Å; V197-I201 PolarHBondContact O-N 2.97Å
198	S	80.2	Confident	78.2	Confident	75 Å²	75	94 Å²	94	52%	0.524	50%	0.502	S	S	.	.	H	α-helix	trans	-59.4	-43.2	177.3	-170.8	0	0	0	0	113	E194 Q195 I201 E202	E194-S198 PolarHBondContact O-N 3.47Å; Q195-S198 PolarHBondContact O-N 3.27Å; S198-I201 PolarHBondContact O-N 3.03Å; S198-E202 PolarHBondContact O-N 2.96Å
199	L	83	Confident	79.8	Confident	44 Å²	44	90.5 Å²	90.5	23%	0.23	48%	0.479	C	S	.	.	H	α-helix	trans	-70.1	-36.8	178.8	-68.6	166.3	0	0	0	112.2	L184 L187 Q195 R196 V197 E202 L203	L184-L199 HydrophobicContact CD2-CB 4.42Å; L184-L199 HydrophobicContact CD2-CD2 3.59Å; L187-L199 HydrophobicContact CD1-CD1 4.25Å; L187-L199 HydrophobicContact CD1-CD2 4.14Å; Q195-L199 WeakPolarHBondContact O-CB 3.15Å; Q195-L199 VanDerWaalsContact O-CG 3.28Å; Q195-L199 WeakPolarHBondContact O-CG 3.49Å; Q195-L199 PolarHBondContact O-N 3.27Å; R196-L199 PolarHBondContact O-N 2.84Å; V197-L199 PolarHBondContact O-N 3.05Å; L199-E202 PolarHBondContact O-N 3.48Å; L199-L203 WeakPolarHBondContact O-CB 3.48Å; L199-L203 PolarHBondContact O-N 3.34Å
200	L	85.1	Confident	81.1	Confident	84 Å²	84	89.6 Å²	89.6	44%	0.44	47%	0.469	S	S	.	.	H	α-helix	trans	-67.9	-34.6	173.7	-75.3	171.1	0	0	0	112.3	R196 V197 R204	R196-L200 HydrophobicContact CG-CD1 4.14Å; R196-L200 WeakPolarHBondContact O-CB 3.39Å; R196-L200 VanDerWaalsContact O-CG 3.27Å; R196-L200 WeakPolarHBondContact O-CG 3.38Å; R196-L200 PolarHBondContact O-N 3.08Å; V197-L200 PolarHBondContact O-N 3.41Å; L200-R204 WeakPolarHBondContact O-CB 3.34Å; L200-R204 VanDerWaalsContact O-CG 3.26Å; L200-R204 WeakPolarHBondContact O-CG 3.48Å; L200-R204 PolarHBondContact O-N 2.78Å
201	I	85.6	Confident	82.5	Confident	105 Å²	105	90.6 Å²	90.6	54%	0.538	46%	0.459	S	S	.	.	H	α-helix	trans	-65	-45.3	171.7	-70.4	166	0	0	0	110.1	V197 S198 L203 R204 A205	V197-I201 HydrophobicContact CG1-CD1 3.75Å; V197-I201 HydrophobicContact CG1-CG1 4.46Å; V197-I201 VanDerWaalsContact O-CG1 3.29Å; V197-I201 WeakPolarHBondContact O-CG1 3.3Å; V197-I201 PolarHBondContact O-N 2.97Å; S198-I201 PolarHBondContact O-N 3.03Å; I201-L203 PolarHBondContact O-N 3.25Å; I201-R204 PolarHBondContact O-N 3.37Å; I201-A205 VanDerWaalsContact O-CB 3.27Å; I201-A205 WeakPolarHBondContact O-CB 3.38Å; I201-A205 PolarHBondContact O-N 3.04Å
202	E	86.8	Confident	83.8	Confident	62 Å²	62	93.4 Å²	93.4	29%	0.29	47%	0.469	S	S	.	.	H	α-helix	trans	-58.8	-48	175.9	-161.5	-173.2	159.5	0	0	111.4	R180 L184 S198 L199 R204 A205 L206	R180-E202 IonicContact CZ-OE1 2.77Å; R180-E202 IonicContact CZ-OE2 3.73Å; R180-E202 IonicContact NE-OE1 3.52Å; R180-E202 PolarHBondContact NE-OE1 2.81Å; R180-E202 IonicContact NE-OE2 2.79Å; R180-E202 IonicContact NH2-OE1 3.67Å; R180-E202 PolarHBondContact NH2-OE1 2.95Å; R180-E202 VanDerWaalsContact NH2-OE1 3.1Å; R180-E202 IonicContact NH2-OE2 3.87Å; R180-E202 PolarHBondContact NH2-OE2 2.91Å; L184-E202 HydrophobicContact CD1-CB 4.02Å; L184-E202 HydrophobicContact CD1-CG 3.76Å; L184-E202 HydrophobicContact CD2-CB 4.43Å; S198-E202 PolarHBondContact O-N 2.96Å; L199-E202 PolarHBondContact O-N 3.48Å; E202-R204 PolarHBondContact O-N 3.1Å; E202-A205 PolarHBondContact O-N 2.85Å; E202-L206 WeakPolarHBondContact O-CG 3.47Å; E202-L206 PolarHBondContact O-N 2.93Å
203	L	87.3	Confident	84.6	Confident	23 Å²	23	94.7 Å²	94.7	12%	0.12	47%	0.466	C	S	.	.	H	α-helix	trans	-63.5	-41.2	179	-179.4	60.6	0	0	0	112.8	I181 L184 L199 I201 R207	I181-L203 HydrophobicContact CG2-CD1 4.14Å; L184-L203 HydrophobicContact CB-CB 4.31Å; L184-L203 HydrophobicContact CB-CD1 4.13Å; L184-L203 HydrophobicContact CD1-CB 4.35Å; L199-L203 WeakPolarHBondContact O-CB 3.48Å; L199-L203 PolarHBondContact O-N 3.34Å; I201-L203 PolarHBondContact O-N 3.25Å; L203-R207 WeakPolarHBondContact O-CG 3.21Å; L203-R207 PolarHBondContact O-N 3.13Å; L203-R207 VanDerWaalsContact O-N 3.16Å
204	R	88.2	Confident	85.1	Confident	177 Å²	177	95 Å²	95	67%	0.668	46%	0.458	S	S	*	.	H	α-helix	trans	-68	-40.9	176.2	-74.6	176	177.4	-166.7	-0.8	111.6	L200 I201 E202 R207 L208	L200-R204 WeakPolarHBondContact O-CB 3.34Å; L200-R204 VanDerWaalsContact O-CG 3.26Å; L200-R204 WeakPolarHBondContact O-CG 3.48Å; L200-R204 PolarHBondContact O-N 2.78Å; I201-R204 PolarHBondContact O-N 3.37Å; E202-R204 PolarHBondContact O-N 3.1Å; R204-R207 PolarHBondContact O-N 2.97Å; R204-L208 WeakPolarHBondContact O-CG 3.37Å; R204-L208 PolarHBondContact O-N 3.09Å
205	A	87.3	Confident	85.6	Confident	61 Å²	61	91.6 Å²	91.6	50%	0.504	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-43.4	177	0	0	0	0	0	112.2	I201 E202 L208 L209	I201-A205 VanDerWaalsContact O-CB 3.27Å; I201-A205 WeakPolarHBondContact O-CB 3.38Å; I201-A205 PolarHBondContact O-N 3.04Å; E202-A205 PolarHBondContact O-N 2.85Å; A205-L208 PolarHBondContact O-N 3.22Å; A205-L209 PolarHBondContact O-N 3.17Å
206	L	89.1	Confident	86.2	Confident	41 Å²	41	93.7 Å²	93.7	22%	0.215	45%	0.447	C	S	.	.	H	α-helix	trans	-65.8	-36.9	176.5	-68.6	175.9	0	0	0	112.6	I177 R180 I181 L184 E202 L209	I177-L206 HydrophobicContact CG2-CD2 4.41Å; R180-L206 HydrophobicContact CB-CD1 4.25Å; R180-L206 HydrophobicContact CG-CD1 3.83Å; I181-L206 HydrophobicContact CD1-CB 4.12Å; I181-L206 HydrophobicContact CG1-CB 3.85Å; I181-L206 HydrophobicContact CG1-CD1 3.99Å; L184-L206 HydrophobicContact CD1-CD1 3.75Å; E202-L206 WeakPolarHBondContact O-CG 3.47Å; E202-L206 PolarHBondContact O-N 2.93Å; L206-L209 VanDerWaalsContact O-CB 3.29Å; L206-L209 WeakPolarHBondContact O-CB 3.41Å; L206-L209 PolarHBondContact O-N 2.72Å
207	R	88.4	Confident	86.4	Confident	176 Å²	176	94.8 Å²	94.8	66%	0.664	46%	0.457	S	S	*	.	H	α-helix	trans	-68.6	-31.7	174.6	-74.1	-179.7	176.8	-169.4	-0.8	113.3	L203 R204 L209	L203-R207 WeakPolarHBondContact O-CG 3.21Å; L203-R207 PolarHBondContact O-N 3.13Å; L203-R207 VanDerWaalsContact O-N 3.16Å; R204-R207 PolarHBondContact O-N 2.97Å; R207-L209 VanDerWaalsContact C-N 3.31Å
208	L	91.3	Very high	86.5	Confident	104 Å²	104	94.3 Å²	94.3	55%	0.545	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-0.2	177.9	-69.2	169.4	0	0	0	113.9	R204 A205 N210 F211 Q212	R204-L208 WeakPolarHBondContact O-CG 3.37Å; R204-L208 PolarHBondContact O-N 3.09Å; A205-L208 PolarHBondContact O-N 3.22Å; L208-N210 VanDerWaalsContact C-N 3.32Å; L208-N210 PolarHBondContact O-N 3.49Å; L208-F211 PolarHBondContact O-N 3.14Å; L208-Q212 PolarHBondContact O-N 3.36Å
209	L	88.1	Confident	86.6	Confident	40 Å²	40	94.7 Å²	94.7	21%	0.209	45%	0.447	C	S	.	.	H	α-helix	trans	-56.4	-39.5	-174.2	-179.4	62.9	0	0	0	113.7	I177 A205 L206 R207 Q212 R213	I177-L209 HydrophobicContact CD1-CD2 3.69Å; A205-L209 PolarHBondContact O-N 3.17Å; L206-L209 VanDerWaalsContact O-CB 3.29Å; L206-L209 WeakPolarHBondContact O-CB 3.41Å; L206-L209 PolarHBondContact O-N 2.72Å; R207-L209 VanDerWaalsContact C-N 3.31Å; L209-Q212 PolarHBondContact O-N 3.25Å; L209-R213 WeakPolarHBondContact O-CB 3.39Å; L209-R213 WeakPolarHBondContact O-CG 3.46Å; L209-R213 PolarHBondContact O-N 3.14Å
210	N	85.7	Confident	86.5	Confident	119 Å²	119	95.9 Å²	95.9	64%	0.636	46%	0.456	S	S	*	.	H	α-helix	trans	-71.7	-39.4	-179.1	-72.2	-11.6	0	0	0	112.3	L208 Q212 R213 Q214	L208-N210 VanDerWaalsContact C-N 3.32Å; L208-N210 PolarHBondContact O-N 3.49Å; N210-Q212 VanDerWaalsContact C-N 3.34Å; N210-R213 PolarHBondContact O-N 3.39Å; N210-Q214 PolarHBondContact O-N 3.23Å
211	F	88.6	Confident	86.1	Confident	142 Å²	142	94.4 Å²	94.4	62%	0.623	45%	0.453	S	S	*	.	H	α-helix	trans	-63.1	-41.9	171.7	-179.9	-103.3	0	0	0	111.2	L208 R213 Q214 L215	L208-F211 PolarHBondContact O-N 3.14Å; F211-R213 PolarHBondContact O-N 3.28Å; F211-Q214 PolarHBondContact O-N 3.13Å; F211-L215 HydrophobicContact CE1-CD2 4.43Å; F211-L215 WeakPolarHBondContact O-CB 3.37Å; F211-L215 PolarHBondContact O-N 2.95Å
212	Q	88.5	Confident	85.8	Confident	85 Å²	85	91.4 Å²	91.4	40%	0.397	44%	0.444	S	S	.	.	H	α-helix	trans	-64.1	-38.4	173.9	-173.2	-175.8	83.3	0	0	112.4	L208 L209 N210 R216	L208-Q212 PolarHBondContact O-N 3.36Å; L209-Q212 PolarHBondContact O-N 3.25Å; N210-Q212 VanDerWaalsContact C-N 3.34Å; Q212-R216 HydrophobicContact CG-CG 4.39Å; Q212-R216 WeakPolarHBondContact O-CB 3.07Å; Q212-R216 WeakPolarHBondContact O-CG 3.21Å; Q212-R216 PolarHBondContact O-N 3.38Å
213	R	87.1	Confident	85.4	Confident	99 Å²	99	93.1 Å²	93.1	37%	0.374	45%	0.453	S	S	.	.	H	α-helix	trans	-61.5	-48.8	174.7	-81.1	175.9	169.5	-149.2	-3.4	111	E170 L209 N210 F211 R216 Q217	E170-R213 IonicContact OE1-CZ 2.98Å; E170-R213 VanDerWaalsContact OE1-CZ 3.24Å; E170-R213 IonicContact OE1-NH1 2.69Å; E170-R213 PolarHBondContact OE1-NH1 2.9Å; E170-R213 IonicContact OE1-NH2 2.73Å; E170-R213 PolarHBondContact OE1-NH2 2.79Å; E170-R213 IonicContact OE2-NH2 3.3Å; L209-R213 WeakPolarHBondContact O-CB 3.39Å; L209-R213 WeakPolarHBondContact O-CG 3.46Å; L209-R213 PolarHBondContact O-N 3.14Å; N210-R213 PolarHBondContact O-N 3.39Å; F211-R213 PolarHBondContact O-N 3.28Å; R213-R216 PolarHBondContact O-N 2.99Å; R213-Q217 WeakPolarHBondContact O-CB 3.23Å; R213-Q217 PolarHBondContact O-N 2.96Å
214	Q	84.3	Confident	84.5	Confident	97 Å²	97	100.9 Å²	100.9	45%	0.453	48%	0.48	S	S	.	.	H	α-helix	trans	-61.3	-55.8	178.4	-176.5	57.3	48.1	0	0	111.5	N210 F211 R216 Q217 D218	N210-Q214 PolarHBondContact O-N 3.23Å; F211-Q214 PolarHBondContact O-N 3.13Å; Q214-R216 PolarHBondContact O-N 3.34Å; Q214-Q217 WeakPolarHBondContact O-CA 3.37Å; Q214-Q217 WeakPolarHBondContact O-CB 3.32Å; Q214-Q217 PolarHBondContact O-N 3.49Å; Q214-D218 PolarHBondContact NE2-OD1 3.48Å; Q214-D218 PolarHBondContact NE2-OD2 3.06Å; Q214-D218 PolarHBondContact O-N 3.43Å
215	L	87.5	Confident	83.4	Confident	87 Å²	87	101.5 Å²	101.5	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-57.6	-37.3	179.9	-176.2	65.6	0	0	0	112.2	F211 I219	F211-L215 HydrophobicContact CE1-CD2 4.43Å; F211-L215 WeakPolarHBondContact O-CB 3.37Å; F211-L215 PolarHBondContact O-N 2.95Å; L215-I219 HydrophobicContact CD1-CD1 4.24Å; L215-I219 HydrophobicContact CG-CD1 3.95Å; L215-I219 WeakPolarHBondContact O-CB 3.32Å; L215-I219 WeakPolarHBondContact O-CD1 3.47Å; L215-I219 WeakPolarHBondContact O-CG1 3.37Å; L215-I219 PolarHBondContact O-N 3.33Å
216	R	86.9	Confident	82.4	Confident	150 Å²	150	105 Å²	105	57%	0.566	49%	0.493	S	S	*	.	H	α-helix	trans	-68.8	-36.1	172.7	-77.6	178	175.2	-177.6	0.6	112.9	Q212 R213 Q214 V220	Q212-R216 HydrophobicContact CG-CG 4.39Å; Q212-R216 WeakPolarHBondContact O-CB 3.07Å; Q212-R216 WeakPolarHBondContact O-CG 3.21Å; Q212-R216 PolarHBondContact O-N 3.38Å; R213-R216 PolarHBondContact O-N 2.99Å; Q214-R216 PolarHBondContact O-N 3.34Å; R216-V220 WeakPolarHBondContact O-CB 3.39Å; R216-V220 WeakPolarHBondContact O-CG2 3.32Å; R216-V220 PolarHBondContact O-N 2.97Å
217	Q	84.7	Confident	81.2	Confident	133 Å²	133	107.1 Å²	107.1	62%	0.621	51%	0.507	S	S	*	.	H	α-helix	trans	-66.3	-41	176.6	-177.3	165.3	-31.7	0	0	110.9	R213 Q214 V220 S221	R213-Q217 WeakPolarHBondContact O-CB 3.23Å; R213-Q217 PolarHBondContact O-N 2.96Å; Q214-Q217 WeakPolarHBondContact O-CA 3.37Å; Q214-Q217 WeakPolarHBondContact O-CB 3.32Å; Q214-Q217 PolarHBondContact O-N 3.49Å; Q217-V220 PolarHBondContact O-N 2.64Å; Q217-S221 WeakPolarHBondContact O-CB 3.35Å; Q217-S221 PolarHBondContact O-N 2.95Å
218	D	82.9	Confident	79.6	Confident	76 Å²	76	101.9 Å²	101.9	41%	0.406	50%	0.498	S	S	.	.	H	α-helix	trans	-65.8	-49.6	176.2	-60.1	-37.8	0	0	0	111	Q214 V220 S221 A222	Q214-D218 PolarHBondContact NE2-OD1 3.48Å; Q214-D218 PolarHBondContact NE2-OD2 3.06Å; Q214-D218 PolarHBondContact O-N 3.43Å; D218-V220 PolarHBondContact O-N 2.76Å; D218-S221 WeakPolarHBondContact O-CB 3.27Å; D218-S221 PolarHBondContact O-N 3.14Å; D218-S221 VanDerWaalsContact O-N 3.07Å; D218-S221 PolarHBondContact O-OG 2.75Å; D218-A222 PolarHBondContact O-N 2.94Å
219	I	83.1	Confident	77.8	Confident	84 Å²	84	102 Å²	102	43%	0.431	50%	0.499	S	S	.	.	H	α-helix	trans	-58.8	-43.5	174.2	-70.1	168	0	0	0	111.5	L215 S221 A222 M223	L215-I219 HydrophobicContact CD1-CD1 4.24Å; L215-I219 HydrophobicContact CG-CD1 3.95Å; L215-I219 WeakPolarHBondContact O-CB 3.32Å; L215-I219 WeakPolarHBondContact O-CD1 3.47Å; L215-I219 WeakPolarHBondContact O-CG1 3.37Å; L215-I219 PolarHBondContact O-N 3.33Å; I219-S221 VanDerWaalsContact C-N 3.29Å; I219-S221 PolarHBondContact O-N 3.48Å; I219-A222 PolarHBondContact O-N 3.04Å; I219-M223 HydrophobicContact CG2-CG 4.11Å; I219-M223 HydrophobicContact CG2-SD 3.83Å; I219-M223 VanDerWaalsContact O-CB 3.3Å; I219-M223 WeakPolarHBondContact O-CB 3.35Å; I219-M223 WeakPolarHBondContact O-CG 3.45Å; I219-M223 PolarHBondContact O-N 2.81Å
220	V	79.5	Confident	76.2	Confident	69 Å²	69	105.8 Å²	105.8	42%	0.418	52%	0.515	S	S	.	.	H	α-helix	trans	-67.8	-29.1	176.8	167.8	0	0	0	0	111.6	R216 Q217 D218 R224	R216-V220 WeakPolarHBondContact O-CB 3.39Å; R216-V220 WeakPolarHBondContact O-CG2 3.32Å; R216-V220 PolarHBondContact O-N 2.97Å; Q217-V220 PolarHBondContact O-N 2.64Å; D218-V220 PolarHBondContact O-N 2.76Å; V220-R224 HydrophobicContact CG1-CG 4.25Å; V220-R224 WeakPolarHBondContact O-CB 3.47Å; V220-R224 WeakPolarHBondContact O-CG 3.41Å; V220-R224 PolarHBondContact O-N 3.38Å
221	S	77.9	Confident	74.9	Confident	53 Å²	53	103.1 Å²	103.1	37%	0.371	50%	0.503	S	S	.	.	H	α-helix	trans	-71	-39	174.3	85.3	0	0	0	0	112.4	Q217 D218 I219	Q217-S221 WeakPolarHBondContact O-CB 3.35Å; Q217-S221 PolarHBondContact O-N 2.95Å; D218-S221 WeakPolarHBondContact O-CB 3.27Å; D218-S221 PolarHBondContact O-N 3.14Å; D218-S221 VanDerWaalsContact O-N 3.07Å; D218-S221 PolarHBondContact O-OG 2.75Å; I219-S221 VanDerWaalsContact C-N 3.29Å; I219-S221 PolarHBondContact O-N 3.48Å
222	A	78.9	Confident	73.4	Confident	42 Å²	42	100 Å²	100	35%	0.347	50%	0.503	S	S	.	.	H	α-helix	trans	-68.3	-56.6	172.9	0	0	0	0	0	110.5	D218 I219 R224 R225 D226	D218-A222 PolarHBondContact O-N 2.94Å; I219-A222 PolarHBondContact O-N 3.04Å; A222-R224 PolarHBondContact O-N 3.4Å; A222-R224 VanDerWaalsContact O-N 3.11Å; A222-R225 WeakPolarHBondContact O-CA 3.31Å; A222-R225 WeakPolarHBondContact O-CB 3.37Å; A222-R225 PolarHBondContact O-N 2.83Å; A222-D226 PolarHBondContact O-N 2.8Å; A222-D226 VanDerWaalsContact O-N 3.09Å
223	M	77.3	Confident	72.1	Confident	98 Å²	98	101.7 Å²	101.7	48%	0.483	52%	0.515	S	S	.	.	H	α-helix	trans	-56	-32.9	177.2	-72.1	-172.8	74.2	0	0	113	I219 R225 D226 T227	I219-M223 HydrophobicContact CG2-CG 4.11Å; I219-M223 HydrophobicContact CG2-SD 3.83Å; I219-M223 VanDerWaalsContact O-CB 3.3Å; I219-M223 WeakPolarHBondContact O-CB 3.35Å; I219-M223 WeakPolarHBondContact O-CG 3.45Å; I219-M223 PolarHBondContact O-N 2.81Å; M223-R225 VanDerWaalsContact C-N 3.29Å; M223-R225 PolarHBondContact O-N 2.93Å; M223-D226 PolarHBondContact O-N 2.88Å; M223-T227 HydrophobicContact CB-CG2 4.42Å; M223-T227 HydrophobicContact CE-CG2 4.14Å; M223-T227 WeakPolarHBondContact O-CA 3.49Å; M223-T227 VanDerWaalsContact O-CB 3.28Å; M223-T227 WeakPolarHBondContact O-CB 3.4Å; M223-T227 WeakPolarHBondContact O-CG2 3.36Å; M223-T227 PolarHBondContact O-N 3Å; M223-T227 PolarHBondContact O-OG1 2.66Å
224	R	70	Confident	70.6	Confident	185 Å²	185	99.3 Å²	99.3	70%	0.698	51%	0.509	S	S	*	.	H	α-helix	trans	-67	-27.9	174.7	-85.2	179.1	175.4	-155.5	-0	113.4	V220 A222 S228	V220-R224 HydrophobicContact CG1-CG 4.25Å; V220-R224 WeakPolarHBondContact O-CB 3.47Å; V220-R224 WeakPolarHBondContact O-CG 3.41Å; V220-R224 PolarHBondContact O-N 3.38Å; A222-R224 PolarHBondContact O-N 3.4Å; A222-R224 VanDerWaalsContact O-N 3.11Å; R224-S228 VanDerWaalsContact O-CB 3.27Å; R224-S228 WeakPolarHBondContact O-CB 3.41Å; R224-S228 PolarHBondContact O-OG 2.67Å
225	R	63.9	Low	69.3	Low	191 Å²	191	98.2 Å²	98.2	72%	0.721	51%	0.509	S	S	*	.	H	α-helix	trans	-73.8	-42.6	170	-63.9	178.8	177.6	114.4	-5.4	110.6	A222 M223 S228	A222-R225 WeakPolarHBondContact O-CA 3.31Å; A222-R225 WeakPolarHBondContact O-CB 3.37Å; A222-R225 PolarHBondContact O-N 2.83Å; M223-R225 VanDerWaalsContact C-N 3.29Å; M223-R225 PolarHBondContact O-N 2.93Å; R225-S228 PolarHBondContact O-OG 3.12Å
226	D	66.7	Low	67.8	Low	134 Å²	134	100 Å²	100	72%	0.717	51%	0.513	S	S	*	.	H	α-helix	trans	-87.5	-22.4	-170.4	-52.2	-31.8	0	0	0	114.7	A222 M223	A222-D226 PolarHBondContact O-N 2.8Å; A222-D226 VanDerWaalsContact O-N 3.09Å; M223-D226 PolarHBondContact O-N 2.88Å
227	T	63.1	Low	66.5	Low	85 Å²	85	95.4 Å²	95.4	52%	0.521	51%	0.508	S	S	.	.	S	Bend	trans	-111	2.3	-176.3	68.2	0	0	0	0	114.4	M223 L229	M223-T227 HydrophobicContact CB-CG2 4.42Å; M223-T227 HydrophobicContact CE-CG2 4.14Å; M223-T227 WeakPolarHBondContact O-CA 3.49Å; M223-T227 VanDerWaalsContact O-CB 3.28Å; M223-T227 WeakPolarHBondContact O-CB 3.4Å; M223-T227 WeakPolarHBondContact O-CG2 3.36Å; M223-T227 PolarHBondContact O-N 3Å; M223-T227 PolarHBondContact O-OG1 2.66Å; T227-L229 PolarHBondContact O-N 3.12Å
228	S	55	Low	65.4	Low	67 Å²	67	95 Å²	95	47%	0.469	50%	0.501	S	S	.	.			trans	-78.1	63.8	173.2	48.4	0	0	0	0	111.9	R224 R225 E230	R224-S228 VanDerWaalsContact O-CB 3.27Å; R224-S228 WeakPolarHBondContact O-CB 3.41Å; R224-S228 PolarHBondContact O-OG 2.67Å; R225-S228 PolarHBondContact O-OG 3.12Å; S228-E230 PolarHBondContact O-N 3.24Å
229	L	54	Low	63.8	Low	107 Å²	107	98.3 Å²	98.3	56%	0.56	51%	0.508	S	S	*	.			trans	-51.2	126.1	173	-86.9	154.5	0	0	0	111.6	T227 T231 A232 L233	T227-L229 PolarHBondContact O-N 3.12Å; L229-T231 HydrophobicContact CD2-CG2 4.16Å; L229-T231 PolarHBondContact O-N 2.83Å; L229-A232 PolarHBondContact O-N 2.98Å; L229-L233 PolarHBondContact O-N 3.13Å
230	E	53.9	Low	62.6	Low	119 Å²	119	105.5 Å²	105.5	56%	0.556	53%	0.53	S	S	*	.	H	α-helix	trans	-47.5	-29.1	165.4	-86.3	-76.7	149.8	0	0	112.3	S228 A232 N234	S228-E230 PolarHBondContact O-N 3.24Å; E230-A232 VanDerWaalsContact C-N 3.3Å; E230-A232 PolarHBondContact O-N 2.84Å; E230-N234 PolarHBondContact O-N 3.15Å
231	T	60.1	Low	61.4	Low	62 Å²	62	108 Å²	108	38%	0.38	55%	0.548	S	S	.	.	H	α-helix	trans	-72.7	-14.8	178	78.2	0	0	0	0	114.9	L229 N234 Y238	L229-T231 HydrophobicContact CD2-CG2 4.16Å; L229-T231 PolarHBondContact O-N 2.83Å; T231-N234 CarbonylContact C-O 3.33Å; T231-N234 VanDerWaalsContact O-O 3.05Å; T231-Y238 HydrophobicContact CG2-CD2 4.4Å; T231-Y238 HydrophobicContact CG2-CE1 4.28Å; T231-Y238 HydrophobicContact CG2-CE2 3.68Å
232	A	56.5	Low	60.4	Low	76 Å²	76	115.1 Å²	115.1	63%	0.628	57%	0.572	S	S	*	*	H	α-helix	trans	-103.5	-33.4	178	0	0	0	0	0	111.7	L229 E230 N234	L229-A232 PolarHBondContact O-N 2.98Å; E230-A232 VanDerWaalsContact C-N 3.3Å; E230-A232 PolarHBondContact O-N 2.84Å; A232-N234 PolarHBondContact O-N 3.07Å
233	L	60.3	Low	59.5	Low	122 Å²	122	123.2 Å²	123.2	64%	0.639	60%	0.599	S	S	*	*	H	α-helix	trans	-69.2	-18.6	170.9	-64.7	169.5	0	0	0	112.1	L229	L229-L233 PolarHBondContact O-N 3.13Å
234	N	55.4	Low	58.6	Low	48 Å²	48	123.9 Å²	123.9	26%	0.257	60%	0.601	S	S	.	*			trans	-145.1	124.8	179.3	-87.9	-49	0	0	0	112.6	G58 P59 P60 E230 T231 A232 Y238	G58-N234 WeakPolarHBondContact CA-OD1 3.36Å; G58-N234 CarbonylContact O-C 3.57Å; G58-N234 WeakPolarHBondContact O-CA 3.42Å; G58-N234 WeakPolarHBondContact O-CB 3.22Å; G58-N234 PolarHBondContact O-OD1 3.47Å; P59-N234 WeakPolarHBondContact CA-OD1 3.47Å; P59-N234 VanDerWaalsContact N-OD1 3.14Å; P60-N234 HydrophobicContact CG-CB 4.37Å; E230-N234 PolarHBondContact O-N 3.15Å; T231-N234 CarbonylContact C-O 3.33Å; T231-N234 VanDerWaalsContact O-O 3.05Å; A232-N234 PolarHBondContact O-N 3.07Å; N234-Y238 WeakPolarHBondContact O-CD2 3.32Å
235	V	57.2	Low	58.6	Low	75 Å²	75	118.8 Å²	118.8	46%	0.455	59%	0.591	S	S	.	*			trans	-113.5	-20.9	175.7	-168.8	0	0	0	0	116.4	S57 G58 A237 R239	S57-V235 WeakPolarHBondContact OG-CB 3.33Å; S57-V235 WeakPolarHBondContact OG-CG2 3.4Å; G58-V235 CarbonylContact O-C 3.54Å; G58-V235 PolarHBondContact O-N 3.09Å; V235-A237 PolarHBondContact O-N 3.21Å; V235-R239 PolarHBondContact O-N 2.77Å
236	K	56.7	Low	59.1	Low	123 Å²	123	116.5 Å²	116.5	54%	0.535	59%	0.592	S	S	.	*	S	Bend	trans	-67.2	-21.1	-169.8	-131.4	164	-98.7	177.5	0	116	S57 G58 P59 R239	S57-K236 WeakPolarHBondContact O-CA 3.45Å; S57-K236 WeakPolarHBondContact O-CB 3.36Å; S57-K236 WeakPolarHBondContact O-CD 3.36Å; S57-K236 WeakPolarHBondContact O-CE 2.95Å; S57-K236 WeakPolarHBondContact O-CG 3.41Å; S57-K236 PolarHBondContact O-N 3.31Å; S57-K236 VanDerWaalsContact O-N 3.12Å; G58-K236 VanDerWaalsContact C-N 3.26Å; G58-K236 VanDerWaalsContact CA-CB 3.43Å; G58-K236 PolarHBondContact O-N 2.77Å; P59-K236 PolarHBondContact O-N 3.5Å; K236-R239 WeakPolarHBondContact O-CB 3.46Å
237	A	58.7	Low	59.5	Low	54 Å²	54	120.6 Å²	120.6	45%	0.446	60%	0.598	S	S	.	*	S	Bend	trans	-129.6	-2.8	-177.7	0	0	0	0	0	113.9	P59 V235 R239	P59-A237 VanDerWaalsContact C-CB 3.43Å; P59-A237 HydrophobicContact CB-CB 4.05Å; P59-A237 WeakPolarHBondContact O-CA 3.32Å; P59-A237 WeakPolarHBondContact O-CB 3.33Å; P59-A237 PolarHBondContact O-N 2.72Å; V235-A237 PolarHBondContact O-N 3.21Å; A237-R239 PolarHBondContact O-N 2.68Å
238	Y	61.9	Low	59.9	Low	124 Å²	124	121.3 Å²	121.3	49%	0.486	60%	0.595	S	S	.	*	S	Bend	trans	-68.7	-6.8	141.6	-72	-67.7	0	0	0	112.2	P59 P60 T231 N234	P59-Y238 PolarHBondContact O-N 3.29Å; P60-Y238 VanDerWaalsContact CD-CD2 3.43Å; P60-Y238 HydrophobicContact CG-CD2 4.36Å; P60-Y238 HydrophobicContact CG-CE2 3.64Å; T231-Y238 HydrophobicContact CG2-CD2 4.4Å; T231-Y238 HydrophobicContact CG2-CE1 4.28Å; T231-Y238 HydrophobicContact CG2-CE2 3.68Å; N234-Y238 WeakPolarHBondContact O-CD2 3.32Å
239	R	50.2	Low	60.9	Low	146 Å²	146	120 Å²	120	55%	0.551	59%	0.588	S	S	*	*	S	Bend	trans	-80.8	119.6	172.7	-168.7	-172.4	-171.6	178.2	8.4	111.6	M56 V235 K236 A237	M56-R239 VanDerWaalsContact SD-CZ 3.59Å; M56-R239 PolarHBondContact SD-NH1 3.31Å; M56-R239 PolarHBondContact SD-NH2 2.65Å; M56-R239 VanDerWaalsContact SD-NH2 3.4Å; V235-R239 PolarHBondContact O-N 2.77Å; K236-R239 WeakPolarHBondContact O-CB 3.46Å; A237-R239 PolarHBondContact O-N 2.68Å
240	R	57.5	Low	62.3	Low	235 Å²	235	123.5 Å²	123.5	89%	0.887	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-60	132.7	173	-71.1	-174.6	173.9	-168.1	-2.1	111.9
241	P	55.1	Low	63.4	Low	123 Å²	123	124.4 Å²	124.4	80%	0.799	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-75.1	160.2	174.2	31	-34.9	0	0	0	112.5
242	K	56.2	Low	64.3	Low	201 Å²	201	124.4 Å²	124.4	87%	0.874	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-73.3	158.4	167.2	-73.8	-174.8	174.2	-175.9	0	110.3	Q244	K242-Q244 PolarHBondContact O-N 3.42Å
243	K	59.9	Low	65.5	Low	213 Å²	213	125 Å²	125	93%	0.926	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-57.8	131.7	171.4	-81.4	-170.1	173.8	-175.4	0	110.3
244	Q	59.3	Low	66.7	Low	111 Å²	111	125.4 Å²	125.4	52%	0.519	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-85.3	138.1	-170.4	-167	174.9	2.3	0	0	111.8	K242 E248 T252	K242-Q244 PolarHBondContact O-N 3.42Å; Q244-E248 HydrophobicContact CG-CB 3.54Å; Q244-E248 VanDerWaalsContact NE2-C 3.31Å; Q244-E248 PolarHBondContact NE2-O 3.36Å; Q244-E248 VanDerWaalsContact NE2-O 3.11Å; Q244-T252 VanDerWaalsContact NE2-CG2 3.3Å; Q244-T252 PolarHBondContact NE2-OG1 3.13Å
245	T	69.5	Low	68	Low	79 Å²	79	126.7 Å²	126.7	49%	0.485	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-86.8	161.4	176.6	65.1	0	0	0	0	112.3	R247 E248 A249	T245-R247 PolarHBondContact O-N 3.21Å; T245-R247 VanDerWaalsContact O-N 3.15Å; T245-E248 VanDerWaalsContact CB-OE2 3.32Å; T245-E248 WeakPolarHBondContact CB-OE2 3.37Å; T245-E248 WeakPolarHBondContact CG2-OE2 3.49Å; T245-E248 PolarHBondContact N-OE2 3.36Å; T245-E248 CarbonylContact O-C 3.51Å; T245-E248 PolarHBondContact O-N 3.12Å; T245-E248 WeakPolarHBondContact OG1-CG 3.5Å; T245-E248 PolarHBondContact OG1-OE2 3.08Å; T245-A249 PolarHBondContact O-N 2.97Å
246	L	74.8	Confident	69	Low	143 Å²	143	129.4 Å²	129.4	75%	0.749	60%	0.597	S	S	*	*	H	α-helix	trans	-59.5	-29.5	-178.5	-159.8	78.9	0	0	0	113.6	R250	L246-R250 PolarHBondContact O-N 3.08Å
247	R	73.6	Confident	70.3	Confident	220 Å²	220	129.5 Å²	129.5	83%	0.83	60%	0.597	S	S	*	*	H	α-helix	trans	-72	-41.7	175	-175.2	179.1	-73.6	-153	-0.2	111.3	T245 A249 F251	T245-R247 PolarHBondContact O-N 3.21Å; T245-R247 VanDerWaalsContact O-N 3.15Å; R247-A249 VanDerWaalsContact C-N 3.33Å; R247-F251 PolarHBondContact O-N 3.41Å
248	E	72.2	Confident	71.5	Confident	99 Å²	99	132.3 Å²	132.3	46%	0.463	60%	0.601	S	S	.	*	H	α-helix	trans	-67.5	-34.2	174.1	-67.8	162.7	128.7	0	0	111.4	Q244 T245 F251 T252	Q244-E248 HydrophobicContact CG-CB 3.54Å; Q244-E248 VanDerWaalsContact NE2-C 3.31Å; Q244-E248 PolarHBondContact NE2-O 3.36Å; Q244-E248 VanDerWaalsContact NE2-O 3.11Å; T245-E248 VanDerWaalsContact CB-OE2 3.32Å; T245-E248 WeakPolarHBondContact CB-OE2 3.37Å; T245-E248 WeakPolarHBondContact CG2-OE2 3.49Å; T245-E248 PolarHBondContact N-OE2 3.36Å; T245-E248 CarbonylContact O-C 3.51Å; T245-E248 PolarHBondContact O-N 3.12Å; T245-E248 WeakPolarHBondContact OG1-CG 3.5Å; T245-E248 PolarHBondContact OG1-OE2 3.08Å; E248-F251 PolarHBondContact O-N 2.83Å; E248-T252 PolarHBondContact O-N 3.13Å; E248-T252 PolarHBondContact O-OG1 3.12Å
249	A	77.2	Confident	72.4	Confident	39 Å²	39	132.4 Å²	132.4	32%	0.322	61%	0.607	S	S	.	*	H	α-helix	trans	-63.5	-45.9	175.7	0	0	0	0	0	112.2	T245 R247 F251 T252 E253	T245-A249 PolarHBondContact O-N 2.97Å; R247-A249 VanDerWaalsContact C-N 3.33Å; A249-F251 VanDerWaalsContact C-N 3.3Å; A249-F251 PolarHBondContact O-N 3.44Å; A249-T252 WeakPolarHBondContact CA-OG1 3.43Å; A249-T252 PolarHBondContact O-N 3.09Å; A249-T252 PolarHBondContact O-OG1 3.33Å; A249-E253 WeakPolarHBondContact O-CB 3.25Å; A249-E253 PolarHBondContact O-N 2.89Å
250	R	82.5	Confident	73.9	Confident	182 Å²	182	132.6 Å²	132.6	69%	0.687	61%	0.612	S	S	*	*	H	α-helix	trans	-66.2	-30.7	172.1	-75.7	-173.7	174.6	-176.8	-0.4	112.9	L246 K254	L246-R250 PolarHBondContact O-N 3.08Å; R250-K254 WeakPolarHBondContact O-CB 3.42Å; R250-K254 PolarHBondContact O-N 3.3Å
251	F	76.1	Confident	75	Confident	138 Å²	138	127.9 Å²	127.9	61%	0.605	60%	0.6	S	S	*	*	H	α-helix	trans	-68.9	-42.7	173.1	-171.7	-94.5	0	0	0	111.5	R247 E248 A249 K254 L255	R247-F251 PolarHBondContact O-N 3.41Å; E248-F251 PolarHBondContact O-N 2.83Å; A249-F251 VanDerWaalsContact C-N 3.3Å; A249-F251 PolarHBondContact O-N 3.44Å; F251-K254 PolarHBondContact O-N 3.28Å; F251-L255 VanDerWaalsContact O-CB 3.31Å; F251-L255 WeakPolarHBondContact O-CB 3.44Å; F251-L255 PolarHBondContact O-N 3.27Å
252	T	78.9	Confident	76.4	Confident	61 Å²	61	126.6 Å²	126.6	37%	0.374	58%	0.583	S	S	.	*	H	α-helix	trans	-67.1	-36.9	173.2	47.7	0	0	0	0	112.5	Q244 E248 A249 K254 L255 E256	Q244-T252 VanDerWaalsContact NE2-CG2 3.3Å; Q244-T252 PolarHBondContact NE2-OG1 3.13Å; E248-T252 PolarHBondContact O-N 3.13Å; E248-T252 PolarHBondContact O-OG1 3.12Å; A249-T252 WeakPolarHBondContact CA-OG1 3.43Å; A249-T252 PolarHBondContact O-N 3.09Å; A249-T252 PolarHBondContact O-OG1 3.33Å; T252-K254 VanDerWaalsContact C-N 3.32Å; T252-K254 PolarHBondContact O-N 3.07Å; T252-L255 PolarHBondContact O-N 3.26Å; T252-E256 WeakPolarHBondContact O-CB 3.44Å; T252-E256 PolarHBondContact O-N 2.95Å
253	E	82.7	Confident	77.6	Confident	88 Å²	88	122.6 Å²	122.6	41%	0.411	57%	0.568	S	S	.	*	H	α-helix	trans	-61.4	-41.1	173.5	-167.9	-152.2	146.1	0	0	111.4	A249 K257	A249-E253 WeakPolarHBondContact O-CB 3.25Å; A249-E253 PolarHBondContact O-N 2.89Å; E253-K257 HydrophobicContact CG-CD 4.5Å; E253-K257 WeakPolarHBondContact O-CB 3.29Å; E253-K257 VanDerWaalsContact O-CG 3.31Å; E253-K257 WeakPolarHBondContact O-CG 3.25Å; E253-K257 PolarHBondContact O-N 2.86Å; E253-K257 WeakPolarHBondContact OE1-CE 3.33Å; E253-K257 IonicContact OE1-NZ 3.4Å; E253-K257 PolarHBondContact OE1-NZ 2.92Å
254	K	86.2	Confident	78.7	Confident	132 Å²	132	115.6 Å²	115.6	57%	0.574	54%	0.538	S	S	*	.	H	α-helix	trans	-68.9	-41	174.6	-173.1	175	-179.7	178.5	0	112	R250 F251 T252 K257 Q258	R250-K254 WeakPolarHBondContact O-CB 3.42Å; R250-K254 PolarHBondContact O-N 3.3Å; F251-K254 PolarHBondContact O-N 3.28Å; T252-K254 VanDerWaalsContact C-N 3.32Å; T252-K254 PolarHBondContact O-N 3.07Å; K254-K257 PolarHBondContact O-N 3.26Å; K254-Q258 WeakPolarHBondContact O-CB 3.47Å; K254-Q258 WeakPolarHBondContact O-CG 3.46Å; K254-Q258 PolarHBondContact O-N 3.43Å
255	L	81.4	Confident	80	Confident	74 Å²	74	116.6 Å²	116.6	39%	0.387	54%	0.541	S	S	.	.	H	α-helix	trans	-66.5	-39.7	177.3	-170	72	0	0	0	111.2	F251 T252 Q258 M259	F251-L255 VanDerWaalsContact O-CB 3.31Å; F251-L255 WeakPolarHBondContact O-CB 3.44Å; F251-L255 PolarHBondContact O-N 3.27Å; T252-L255 PolarHBondContact O-N 3.26Å; L255-Q258 CarbonylContact O-C 3.59Å; L255-Q258 PolarHBondContact O-N 2.87Å; L255-M259 HydrophobicContact CG-SD 4.43Å; L255-M259 WeakPolarHBondContact O-CB 3.44Å; L255-M259 VanDerWaalsContact O-CG 3.31Å; L255-M259 WeakPolarHBondContact O-CG 3.17Å; L255-M259 PolarHBondContact O-N 3.13Å
256	E	79.3	Confident	80.8	Confident	132 Å²	132	120 Å²	120	62%	0.617	55%	0.545	S	S	*	.	H	α-helix	trans	-67	-42.6	174.9	-176.4	178.7	-162.7	0	0	110.8	T252 Q258 M259 K260	T252-E256 WeakPolarHBondContact O-CB 3.44Å; T252-E256 PolarHBondContact O-N 2.95Å; E256-Q258 VanDerWaalsContact C-N 3.33Å; E256-Q258 PolarHBondContact O-N 2.79Å; E256-M259 PolarHBondContact O-N 2.61Å; E256-K260 WeakPolarHBondContact O-CB 3.49Å; E256-K260 PolarHBondContact O-N 3.11Å
257	K	83.5	Confident	81.3	Confident	126 Å²	126	121.1 Å²	121.1	55%	0.548	54%	0.539	S	S	.	.	H	α-helix	trans	-61.9	-38.2	170.7	-77.7	171.4	174.5	174.3	0	112.2	E253 K254 H261	E253-K257 HydrophobicContact CG-CD 4.5Å; E253-K257 WeakPolarHBondContact O-CB 3.29Å; E253-K257 VanDerWaalsContact O-CG 3.31Å; E253-K257 WeakPolarHBondContact O-CG 3.25Å; E253-K257 PolarHBondContact O-N 2.86Å; E253-K257 WeakPolarHBondContact OE1-CE 3.33Å; E253-K257 IonicContact OE1-NZ 3.4Å; E253-K257 PolarHBondContact OE1-NZ 2.92Å; K254-K257 PolarHBondContact O-N 3.26Å; K257-H261 VanDerWaalsContact O-CB 3.23Å; K257-H261 WeakPolarHBondContact O-CB 3.41Å; K257-H261 PolarHBondContact O-N 3.14Å
258	Q	82.9	Confident	82	Confident	113 Å²	113	118.4 Å²	118.4	53%	0.528	53%	0.529	S	S	.	.	H	α-helix	trans	-68.6	-45.1	173.5	-77.7	-178.7	-46.5	0	0	112.3	K254 L255 E256 K260 H261 E262	K254-Q258 WeakPolarHBondContact O-CB 3.47Å; K254-Q258 WeakPolarHBondContact O-CG 3.46Å; K254-Q258 PolarHBondContact O-N 3.43Å; L255-Q258 CarbonylContact O-C 3.59Å; L255-Q258 PolarHBondContact O-N 2.87Å; E256-Q258 VanDerWaalsContact C-N 3.33Å; E256-Q258 PolarHBondContact O-N 2.79Å; Q258-K260 VanDerWaalsContact C-N 3.34Å; Q258-K260 PolarHBondContact O-N 3.38Å; Q258-H261 PolarHBondContact O-N 3.17Å; Q258-E262 WeakPolarHBondContact O-CB 3.47Å; Q258-E262 PolarHBondContact O-N 3.03Å
259	M	80.8	Confident	82.7	Confident	126 Å²	126	118.5 Å²	118.5	62%	0.621	53%	0.529	S	S	*	.	H	α-helix	trans	-63.4	-39.5	175.7	-75.6	-179.4	67.3	0	0	111.5	L255 E256 E262 Q263	L255-M259 HydrophobicContact CG-SD 4.43Å; L255-M259 WeakPolarHBondContact O-CB 3.44Å; L255-M259 VanDerWaalsContact O-CG 3.31Å; L255-M259 WeakPolarHBondContact O-CG 3.17Å; L255-M259 PolarHBondContact O-N 3.13Å; E256-M259 PolarHBondContact O-N 2.61Å; M259-E262 PolarHBondContact O-N 2.98Å; M259-Q263 WeakPolarHBondContact O-CB 3.46Å; M259-Q263 PolarHBondContact O-N 2.93Å
260	K	83	Confident	83.3	Confident	150 Å²	150	123.9 Å²	123.9	65%	0.652	55%	0.546	S	S	*	.	H	α-helix	trans	-68.1	-41.3	175.1	-169.4	170.2	-174.5	171.9	0	111.3	E256 Q258 E264	E256-K260 WeakPolarHBondContact O-CB 3.49Å; E256-K260 PolarHBondContact O-N 3.11Å; Q258-K260 VanDerWaalsContact C-N 3.34Å; Q258-K260 PolarHBondContact O-N 3.38Å; K260-E264 WeakPolarHBondContact O-CB 3.46Å; K260-E264 PolarHBondContact O-N 3.35Å
261	H	80.9	Confident	83.7	Confident	136 Å²	136	120.6 Å²	120.6	63%	0.63	54%	0.538	S	S	*	.	H	α-helix	trans	-69	-35.1	175.2	-170.9	73.4	0	0	0	112.5	K257 Q258 K265	K257-H261 VanDerWaalsContact O-CB 3.23Å; K257-H261 WeakPolarHBondContact O-CB 3.41Å; K257-H261 PolarHBondContact O-N 3.14Å; Q258-H261 PolarHBondContact O-N 3.17Å; H261-K265 VanDerWaalsContact O-CB 3.32Å; H261-K265 WeakPolarHBondContact O-CB 3.41Å; H261-K265 PolarHBondContact O-N 3.43Å
262	E	82.7	Confident	84.3	Confident	96 Å²	96	118.8 Å²	118.8	45%	0.449	53%	0.531	S	S	.	.	H	α-helix	trans	-77.8	-34	174.7	-159.1	-174.8	134.5	0	0	112.2	Q258 M259 E264 K265 R266	Q258-E262 WeakPolarHBondContact O-CB 3.47Å; Q258-E262 PolarHBondContact O-N 3.03Å; M259-E262 PolarHBondContact O-N 2.98Å; E262-E264 VanDerWaalsContact C-N 3.32Å; E262-K265 PolarHBondContact O-N 3.24Å; E262-R266 HydrophobicContact CG-CG 4.5Å; E262-R266 VanDerWaalsContact O-CB 3.29Å; E262-R266 WeakPolarHBondContact O-CB 3.39Å; E262-R266 WeakPolarHBondContact O-CG 3.4Å; E262-R266 PolarHBondContact O-N 3.12Å; E262-R266 IonicContact OE1-CZ 2.59Å; E262-R266 IonicContact OE1-NE 3.28Å; E262-R266 PolarHBondContact OE1-NE 2.8Å; E262-R266 IonicContact OE1-NH2 2.69Å; E262-R266 PolarHBondContact OE1-NH2 3.18Å
263	Q	82.1	Confident	84.9	Confident	116 Å²	116	120.4 Å²	120.4	54%	0.542	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-38.8	170.7	-172.4	179.4	43.5	0	0	110.7	M259 R266 R267	M259-Q263 WeakPolarHBondContact O-CB 3.46Å; M259-Q263 PolarHBondContact O-N 2.93Å; Q263-R266 PolarHBondContact O-N 3.27Å; Q263-R267 WeakPolarHBondContact O-CB 3.47Å; Q263-R267 WeakPolarHBondContact O-CG 3.48Å; Q263-R267 PolarHBondContact O-N 1.85Å
264	E	83.8	Confident	85.4	Confident	66 Å²	66	122.3 Å²	122.3	31%	0.308	54%	0.541	S	S	.	.	H	α-helix	trans	-65.1	-44.2	170.9	-179	62.7	-170	0	0	111.5	K260 E262 R266 R267 R268	K260-E264 WeakPolarHBondContact O-CB 3.46Å; K260-E264 PolarHBondContact O-N 3.35Å; E262-E264 VanDerWaalsContact C-N 3.32Å; E264-R266 PolarHBondContact O-N 3.3Å; E264-R267 WeakPolarHBondContact O-CB 3.48Å; E264-R267 PolarHBondContact O-N 2.82Å; E264-R268 WeakPolarHBondContact O-CG 3.49Å; E264-R268 PolarHBondContact O-N 3.17Å; E264-R268 IonicContact OE1-CZ 2.71Å; E264-R268 IonicContact OE1-NE 2.73Å; E264-R268 PolarHBondContact OE1-NE 2.77Å; E264-R268 IonicContact OE1-NH2 2.7Å; E264-R268 PolarHBondContact OE1-NH2 3Å
265	K	86.4	Confident	85.6	Confident	132 Å²	132	119 Å²	119	57%	0.574	53%	0.53	S	S	*	.	H	α-helix	trans	-61.4	-42.9	173.6	-173.7	-179.5	177.4	-176.8	0	111.8	H261 E262 R268 Q269	H261-K265 VanDerWaalsContact O-CB 3.32Å; H261-K265 WeakPolarHBondContact O-CB 3.41Å; H261-K265 PolarHBondContact O-N 3.43Å; E262-K265 PolarHBondContact O-N 3.24Å; K265-R268 PolarHBondContact O-N 2.79Å; K265-Q269 VanDerWaalsContact O-CB 3.22Å; K265-Q269 WeakPolarHBondContact O-CB 3.37Å; K265-Q269 PolarHBondContact O-N 2.91Å
266	R	86	Confident	86.1	Confident	151 Å²	151	119.6 Å²	119.6	57%	0.57	53%	0.533	S	S	*	.	H	α-helix	trans	-67.6	-33.8	175.3	-71.8	172.5	-173.8	-149.5	6.4	111.7	E262 Q263 E264 K270	E262-R266 HydrophobicContact CG-CG 4.5Å; E262-R266 VanDerWaalsContact O-CB 3.29Å; E262-R266 WeakPolarHBondContact O-CB 3.39Å; E262-R266 WeakPolarHBondContact O-CG 3.4Å; E262-R266 PolarHBondContact O-N 3.12Å; E262-R266 IonicContact OE1-CZ 2.59Å; E262-R266 IonicContact OE1-NE 3.28Å; E262-R266 PolarHBondContact OE1-NE 2.8Å; E262-R266 IonicContact OE1-NH2 2.69Å; E262-R266 PolarHBondContact OE1-NH2 3.18Å; Q263-R266 PolarHBondContact O-N 3.27Å; E264-R266 PolarHBondContact O-N 3.3Å; R266-K270 WeakPolarHBondContact O-CB 3.48Å; R266-K270 WeakPolarHBondContact O-CG 3.48Å; R266-K270 PolarHBondContact O-N 2.9Å
267	R	85.7	Confident	86.8	Confident	166 Å²	166	116 Å²	116	63%	0.626	53%	0.527	S	S	*	.	H	α-helix	trans	-66	-48.7	170.8	-82.9	176.3	167.8	-170.6	-4.6	111.5	Q263 E264 K270 H271	Q263-R267 WeakPolarHBondContact O-CB 3.47Å; Q263-R267 WeakPolarHBondContact O-CG 3.48Å; Q263-R267 PolarHBondContact O-N 1.85Å; E264-R267 WeakPolarHBondContact O-CB 3.48Å; E264-R267 PolarHBondContact O-N 2.82Å; R267-K270 PolarHBondContact O-N 3.16Å; R267-H271 WeakPolarHBondContact O-CB 3.49Å; R267-H271 PolarHBondContact O-N 2.94Å
268	R	87	Confident	87.3	Confident	163 Å²	163	113.6 Å²	113.6	62%	0.615	52%	0.522	S	S	*	.	H	α-helix	trans	-63.5	-39.8	176.1	-69.2	177	-167.3	-164.1	2.2	112.1	E264 K265 H271 Q272	E264-R268 WeakPolarHBondContact O-CG 3.49Å; E264-R268 PolarHBondContact O-N 3.17Å; E264-R268 IonicContact OE1-CZ 2.71Å; E264-R268 IonicContact OE1-NE 2.73Å; E264-R268 PolarHBondContact OE1-NE 2.77Å; E264-R268 IonicContact OE1-NH2 2.7Å; E264-R268 PolarHBondContact OE1-NH2 3Å; K265-R268 PolarHBondContact O-N 2.79Å; R268-H271 PolarHBondContact O-N 3.2Å; R268-Q272 WeakPolarHBondContact O-CB 3.27Å; R268-Q272 PolarHBondContact O-N 2.91Å
269	Q	87.6	Confident	87.8	Confident	102 Å²	102	113.4 Å²	113.4	48%	0.477	52%	0.524	S	S	.	.	H	α-helix	trans	-62.1	-51.5	173.3	176.1	172.4	-9.1	0	0	110.8	K265 H271 Q272 E273	K265-Q269 VanDerWaalsContact O-CB 3.22Å; K265-Q269 WeakPolarHBondContact O-CB 3.37Å; K265-Q269 PolarHBondContact O-N 2.91Å; Q269-H271 VanDerWaalsContact C-N 3.26Å; Q269-H271 PolarHBondContact O-N 2.79Å; Q269-Q272 CarbonylContact O-C 3.41Å; Q269-Q272 PolarHBondContact O-N 2.81Å; Q269-Q272 VanDerWaalsContact O-N 3.11Å; Q269-E273 HydrophobicContact CG-CG 4.32Å; Q269-E273 WeakPolarHBondContact CG-OE1 3.3Å; Q269-E273 PolarHBondContact NE2-OE1 2.84Å; Q269-E273 WeakPolarHBondContact O-CB 3.43Å; Q269-E273 VanDerWaalsContact O-CG 3.29Å; Q269-E273 WeakPolarHBondContact O-CG 3.4Å; Q269-E273 PolarHBondContact O-N 3.17Å
270	K	89.6	Confident	88.3	Confident	152 Å²	152	110.1 Å²	110.1	66%	0.661	51%	0.513	S	S	*	.	H	α-helix	trans	-59.8	-35.5	175.2	-77.9	-172.3	173.3	-161.1	0	113.1	R266 R267 F274	R266-K270 WeakPolarHBondContact O-CB 3.48Å; R266-K270 WeakPolarHBondContact O-CG 3.48Å; R266-K270 PolarHBondContact O-N 2.9Å; R267-K270 PolarHBondContact O-N 3.16Å; K270-F274 VanDerWaalsContact O-CB 3.26Å; K270-F274 WeakPolarHBondContact O-CB 3.3Å; K270-F274 PolarHBondContact O-N 3.32Å
271	H	90.6	Very high	88.8	Confident	112 Å²	112	109.1 Å²	109.1	52%	0.519	51%	0.511	S	S	.	.	H	α-helix	trans	-69.6	-40.1	175	-174.4	60.2	0	0	0	111.8	R267 R268 Q269 F274 L275	R267-H271 WeakPolarHBondContact O-CB 3.49Å; R267-H271 PolarHBondContact O-N 2.94Å; R268-H271 PolarHBondContact O-N 3.2Å; Q269-H271 VanDerWaalsContact C-N 3.26Å; Q269-H271 PolarHBondContact O-N 2.79Å; H271-F274 PolarHBondContact O-N 2.91Å; H271-L275 WeakPolarHBondContact O-CB 3.38Å; H271-L275 VanDerWaalsContact O-CG 3.31Å; H271-L275 WeakPolarHBondContact O-CG 3.26Å; H271-L275 PolarHBondContact O-N 2.98Å
272	Q	89.5	Confident	89.4	Confident	100 Å²	100	104 Å²	104	47%	0.467	49%	0.494	S	S	.	.	H	α-helix	trans	-67.6	-39.5	173.8	-170.8	65.3	60.2	0	0	111.9	R268 Q269 L275 N276	R268-Q272 WeakPolarHBondContact O-CB 3.27Å; R268-Q272 PolarHBondContact O-N 2.91Å; Q269-Q272 CarbonylContact O-C 3.41Å; Q269-Q272 PolarHBondContact O-N 2.81Å; Q269-Q272 VanDerWaalsContact O-N 3.11Å; Q272-L275 PolarHBondContact O-N 3.47Å; Q272-N276 PolarHBondContact NE2-OD1 3.28Å; Q272-N276 WeakPolarHBondContact O-CB 3.46Å; Q272-N276 PolarHBondContact O-N 3.42Å; Q272-N276 PolarHBondContact O-ND2 2.9Å; Q272-N276 PolarHBondContact O-OD1 2.82Å
273	E	90.8	Very high	89.9	Confident	96 Å²	96	106 Å²	106	45%	0.449	50%	0.502	S	S	.	.	H	α-helix	trans	-62.3	-42.9	173	-72.8	163.4	174.8	0	0	110.7	Q269 N276 A277	Q269-E273 HydrophobicContact CG-CG 4.32Å; Q269-E273 WeakPolarHBondContact CG-OE1 3.3Å; Q269-E273 PolarHBondContact NE2-OE1 2.84Å; Q269-E273 WeakPolarHBondContact O-CB 3.43Å; Q269-E273 VanDerWaalsContact O-CG 3.29Å; Q269-E273 WeakPolarHBondContact O-CG 3.4Å; Q269-E273 PolarHBondContact O-N 3.17Å; E273-N276 PolarHBondContact O-N 2.97Å; E273-A277 WeakPolarHBondContact O-CB 3.35Å; E273-A277 PolarHBondContact O-N 3.46Å
274	F	92.8	Very high	90.4	Very high	127 Å²	127	104.5 Å²	104.5	56%	0.557	50%	0.498	S	S	*	.	H	α-helix	trans	-63.5	-48.2	173	175.7	-99.6	0	0	0	112.5	K270 H271 N276 A277 V278	K270-F274 VanDerWaalsContact O-CB 3.26Å; K270-F274 WeakPolarHBondContact O-CB 3.3Å; K270-F274 PolarHBondContact O-N 3.32Å; H271-F274 PolarHBondContact O-N 2.91Å; F274-N276 VanDerWaalsContact C-N 3.33Å; F274-N276 PolarHBondContact O-N 3.45Å; F274-A277 PolarHBondContact O-N 3.17Å; F274-V278 HydrophobicContact CD1-CG2 4.38Å; F274-V278 HydrophobicContact CD2-CG2 4.46Å; F274-V278 HydrophobicContact CE1-CG2 3.99Å; F274-V278 HydrophobicContact CE2-CG2 4.07Å; F274-V278 HydrophobicContact CZ-CG2 3.82Å; F274-V278 WeakPolarHBondContact O-CG2 3.38Å; F274-V278 PolarHBondContact O-N 3.03Å
275	L	92	Very high	90.8	Very high	64 Å²	64	106.6 Å²	106.6	34%	0.335	51%	0.506	S	S	.	.	H	α-helix	trans	-61.5	-40.9	175.9	-73.1	176.1	0	0	0	111.5	H271 Q272 V278 L279	H271-L275 WeakPolarHBondContact O-CB 3.38Å; H271-L275 VanDerWaalsContact O-CG 3.31Å; H271-L275 WeakPolarHBondContact O-CG 3.26Å; H271-L275 PolarHBondContact O-N 2.98Å; Q272-L275 PolarHBondContact O-N 3.47Å; L275-V278 PolarHBondContact O-N 3.1Å; L275-L279 VanDerWaalsContact O-CB 3.3Å; L275-L279 WeakPolarHBondContact O-CB 3.39Å; L275-L279 VanDerWaalsContact O-CG 3.23Å; L275-L279 WeakPolarHBondContact O-CG 3.49Å; L275-L279 PolarHBondContact O-N 2.77Å
276	N	92.2	Very high	91	Very high	85 Å²	85	107.9 Å²	107.9	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-64.8	-39.1	175.4	-70.8	-4.3	0	0	0	111.4	Q272 E273 F274 L279 S280	Q272-N276 PolarHBondContact NE2-OD1 3.28Å; Q272-N276 WeakPolarHBondContact O-CB 3.46Å; Q272-N276 PolarHBondContact O-N 3.42Å; Q272-N276 PolarHBondContact O-ND2 2.9Å; Q272-N276 PolarHBondContact O-OD1 2.82Å; E273-N276 PolarHBondContact O-N 2.97Å; F274-N276 VanDerWaalsContact C-N 3.33Å; F274-N276 PolarHBondContact O-N 3.45Å; N276-L279 PolarHBondContact O-N 2.94Å; N276-S280 WeakPolarHBondContact O-CB 3.44Å; N276-S280 PolarHBondContact O-N 3.4Å
277	A	93.9	Very high	91.3	Very high	58 Å²	58	106.4 Å²	106.4	48%	0.479	51%	0.507	S	S	.	.	H	α-helix	trans	-66.4	-43.8	175	0	0	0	0	0	112	E273 F274 L279 S280 H281	E273-A277 WeakPolarHBondContact O-CB 3.35Å; E273-A277 PolarHBondContact O-N 3.46Å; F274-A277 PolarHBondContact O-N 3.17Å; A277-L279 VanDerWaalsContact C-N 3.34Å; A277-L279 PolarHBondContact O-N 3.17Å; A277-S280 PolarHBondContact O-N 2.98Å; A277-H281 WeakPolarHBondContact O-CB 3.41Å; A277-H281 PolarHBondContact O-N 2.8Å
278	V	93.9	Very high	91.6	Very high	74 Å²	74	104.4 Å²	104.4	45%	0.448	50%	0.503	S	S	.	.	H	α-helix	trans	-63	-39.5	174.2	171.2	0	0	0	0	111.3	F274 L275 G282	F274-V278 HydrophobicContact CD1-CG2 4.38Å; F274-V278 HydrophobicContact CD2-CG2 4.46Å; F274-V278 HydrophobicContact CE1-CG2 3.99Å; F274-V278 HydrophobicContact CE2-CG2 4.07Å; F274-V278 HydrophobicContact CZ-CG2 3.82Å; F274-V278 WeakPolarHBondContact O-CG2 3.38Å; F274-V278 PolarHBondContact O-N 3.03Å; L275-V278 PolarHBondContact O-N 3.1Å; V278-G282 PolarHBondContact O-N 2.99Å
279	L	92.2	Very high	91.9	Very high	110 Å²	110	100.5 Å²	100.5	58%	0.576	49%	0.492	S	S	*	.	H	α-helix	trans	-73.6	-30.2	176.3	-72.3	171.7	0	0	0	113.4	L275 N276 A277 K283	L275-L279 VanDerWaalsContact O-CB 3.3Å; L275-L279 WeakPolarHBondContact O-CB 3.39Å; L275-L279 VanDerWaalsContact O-CG 3.23Å; L275-L279 WeakPolarHBondContact O-CG 3.49Å; L275-L279 PolarHBondContact O-N 2.77Å; N276-L279 PolarHBondContact O-N 2.94Å; A277-L279 VanDerWaalsContact C-N 3.34Å; A277-L279 PolarHBondContact O-N 3.17Å; L279-K283 WeakPolarHBondContact O-CG 3.39Å; L279-K283 PolarHBondContact O-N 3.46Å
280	S	91.1	Very high	92.1	Very high	56 Å²	56	104.6 Å²	104.6	39%	0.392	50%	0.502	S	S	.	.	H	α-helix	trans	-65.7	-57.5	168.3	-165.5	0	0	0	0	109.2	N276 A277 G282 K283 D284	N276-S280 WeakPolarHBondContact O-CB 3.44Å; N276-S280 PolarHBondContact O-N 3.4Å; A277-S280 PolarHBondContact O-N 2.98Å; S280-G282 PolarHBondContact O-N 3.45Å; S280-G282 VanDerWaalsContact O-N 3.11Å; S280-K283 CarbonylContact O-C 2.94Å; S280-K283 WeakPolarHBondContact O-CA 3.45Å; S280-K283 WeakPolarHBondContact O-CB 3.29Å; S280-K283 PolarHBondContact O-N 2.86Å; S280-D284 PolarHBondContact O-N 2.84Å; S280-D284 PolarHBondContact OG-OD2 3.4Å
281	H	94.1	Very high	92.2	Very high	129 Å²	129	101.1 Å²	101.1	60%	0.597	49%	0.491	S	S	*	.	H	α-helix	trans	-52.9	-39.3	177.8	-174.2	-98	0	0	0	112	A277 K283 D284 F285	A277-H281 WeakPolarHBondContact O-CB 3.41Å; A277-H281 PolarHBondContact O-N 2.8Å; H281-K283 VanDerWaalsContact C-N 3.33Å; H281-K283 PolarHBondContact O-N 2.85Å; H281-D284 PolarHBondContact N-OD2 3.17Å; H281-D284 PolarHBondContact O-N 2.83Å; H281-F285 WeakPolarHBondContact O-CB 3.27Å; H281-F285 PolarHBondContact O-N 2.69Å
282	G	94.4	Very high	92.2	Very high	28 Å²	28	98.5 Å²	98.5	29%	0.289	48%	0.483	S	S	.	.	H	α-helix	trans	-71.6	-14.4	174.1	0	0	0	0	0	115.9	V278 S280 R286	V278-G282 PolarHBondContact O-N 2.99Å; S280-G282 PolarHBondContact O-N 3.45Å; S280-G282 VanDerWaalsContact O-N 3.11Å; G282-R286 PolarHBondContact O-NE 3.1Å; G282-R286 PolarHBondContact O-NH2 2.75Å
283	K	92.2	Very high	92.3	Very high	138 Å²	138	98.3 Å²	98.3	60%	0.6	49%	0.485	S	S	*	.	H	α-helix	trans	-86.4	-52	163.3	-70.7	170.9	-178.8	178.7	0	110.1	L279 S280 H281 F285 R286 E287	L279-K283 WeakPolarHBondContact O-CG 3.39Å; L279-K283 PolarHBondContact O-N 3.46Å; S280-K283 CarbonylContact O-C 2.94Å; S280-K283 WeakPolarHBondContact O-CA 3.45Å; S280-K283 WeakPolarHBondContact O-CB 3.29Å; S280-K283 PolarHBondContact O-N 2.86Å; H281-K283 VanDerWaalsContact C-N 3.33Å; H281-K283 PolarHBondContact O-N 2.85Å; K283-F285 VanDerWaalsContact C-N 3.26Å; K283-F285 PolarHBondContact O-N 3.11Å; K283-R286 CarbonylContact O-C 3.6Å; K283-R286 WeakPolarHBondContact O-CA 3.4Å; K283-R286 PolarHBondContact O-N 2.84Å; K283-E287 PolarHBondContact O-N 3.26Å
284	D	92	Very high	92.2	Very high	86 Å²	86	96.5 Å²	96.5	46%	0.46	48%	0.483	S	S	.	.	H	α-helix	trans	-56.6	-40.2	-176.2	-53.8	-32.6	0	0	0	111.1	S280 H281 E287 F288	S280-D284 PolarHBondContact O-N 2.84Å; S280-D284 PolarHBondContact OG-OD2 3.4Å; H281-D284 PolarHBondContact N-OD2 3.17Å; H281-D284 PolarHBondContact O-N 2.83Å; D284-E287 PolarHBondContact O-N 2.87Å; D284-F288 VanDerWaalsContact O-CB 3.26Å; D284-F288 WeakPolarHBondContact O-CB 3.37Å; D284-F288 PolarHBondContact O-N 2.69Å
285	F	92.8	Very high	92.2	Very high	110 Å²	110	99 Å²	99	48%	0.482	49%	0.489	S	S	.	.	H	α-helix	trans	-66	-41.8	173.7	-174.7	-101.2	0	0	0	113.2	H281 K283 F288 H289	H281-F285 WeakPolarHBondContact O-CB 3.27Å; H281-F285 PolarHBondContact O-N 2.69Å; K283-F285 VanDerWaalsContact C-N 3.26Å; K283-F285 PolarHBondContact O-N 3.11Å; F285-F288 WeakPolarHBondContact O-CB 3.06Å; F285-F288 PolarHBondContact O-N 2.86Å; F285-H289 AromaticContact CD1-CD2 3.89Å; F285-H289 AromaticContact CE1-CD2 3.6Å; F285-H289 AromaticContact CE1-NE2 3.68Å; F285-H289 AromaticContact CE2-CD2 3.91Å; F285-H289 AromaticContact CE2-NE2 3.51Å; F285-H289 AromaticContact CZ-CD2 3.61Å; F285-H289 AromaticContact CZ-NE2 3.2Å; F285-H289 WeakPolarHBondContact CZ-NE2 3Å; F285-H289 PolarHBondContact O-CD2 2.78Å; F285-H289 VanDerWaalsContact O-CD2 3.28Å; F285-H289 PolarHBondContact O-N 3.26Å
286	R	91.1	Very high	92.2	Very high	158 Å²	158	100.9 Å²	100.9	60%	0.596	50%	0.497	S	S	*	.	H	α-helix	trans	-69.6	-34.7	175.7	-78.2	-176.9	-69.1	171.2	-2.5	111.8	G282 K283 R290	G282-R286 PolarHBondContact O-NE 3.1Å; G282-R286 PolarHBondContact O-NH2 2.75Å; K283-R286 CarbonylContact O-C 3.6Å; K283-R286 WeakPolarHBondContact O-CA 3.4Å; K283-R286 PolarHBondContact O-N 2.84Å; R286-R290 WeakPolarHBondContact O-CB 3.39Å; R286-R290 VanDerWaalsContact O-CG 3.28Å; R286-R290 WeakPolarHBondContact O-CG 3.22Å; R286-R290 PolarHBondContact O-N 3.06Å
287	E	91.4	Very high	92.1	Very high	120 Å²	120	101.6 Å²	101.6	56%	0.561	50%	0.504	S	S	*	.	H	α-helix	trans	-71.9	-39.4	174.4	-175.3	154.4	178.6	0	0	111.6	K283 D284 R290 N291	K283-E287 PolarHBondContact O-N 3.26Å; D284-E287 PolarHBondContact O-N 2.87Å; E287-R290 PolarHBondContact O-N 3.27Å; E287-N291 WeakPolarHBondContact CG-ND2 3.45Å; E287-N291 VanDerWaalsContact O-CB 3.28Å; E287-N291 WeakPolarHBondContact O-CB 3.41Å; E287-N291 PolarHBondContact O-N 2.73Å; E287-N291 PolarHBondContact O-ND2 2.76Å; E287-N291 VanDerWaalsContact O-ND2 3.11Å
288	F	92.9	Very high	92	Very high	124 Å²	124	106.2 Å²	106.2	54%	0.544	51%	0.513	S	S	.	.	H	α-helix	trans	-55.1	-53.5	169	174	-97.8	0	0	0	111.3	D284 F285 R290 N291 V292	D284-F288 VanDerWaalsContact O-CB 3.26Å; D284-F288 WeakPolarHBondContact O-CB 3.37Å; D284-F288 PolarHBondContact O-N 2.69Å; F285-F288 WeakPolarHBondContact O-CB 3.06Å; F285-F288 PolarHBondContact O-N 2.86Å; F288-R290 PolarHBondContact O-N 2.9Å; F288-N291 CarbonylContact O-C 3.47Å; F288-N291 PolarHBondContact O-N 3.35Å; F288-N291 VanDerWaalsContact O-N 3.1Å; F288-V292 HydrophobicContact CD1-CG2 4.23Å; F288-V292 HydrophobicContact CD2-CG2 4.4Å; F288-V292 HydrophobicContact CE1-CG2 3.87Å; F288-V292 HydrophobicContact CE2-CG2 4.05Å; F288-V292 HydrophobicContact CG-CG2 4.49Å; F288-V292 HydrophobicContact CZ-CG2 3.77Å; F288-V292 WeakPolarHBondContact O-CG2 3.4Å; F288-V292 PolarHBondContact O-N 2.94Å
289	H	92.5	Very high	91.9	Very high	82 Å²	82	107.6 Å²	107.6	38%	0.38	52%	0.517	S	S	.	.	H	α-helix	trans	-63.6	-36.8	178.5	-82.8	-74.7	0	0	0	113.4	F285 V292 N293	F285-H289 AromaticContact CD1-CD2 3.89Å; F285-H289 AromaticContact CE1-CD2 3.6Å; F285-H289 AromaticContact CE1-NE2 3.68Å; F285-H289 AromaticContact CE2-CD2 3.91Å; F285-H289 AromaticContact CE2-NE2 3.51Å; F285-H289 AromaticContact CZ-CD2 3.61Å; F285-H289 AromaticContact CZ-NE2 3.2Å; F285-H289 WeakPolarHBondContact CZ-NE2 3Å; F285-H289 PolarHBondContact O-CD2 2.78Å; F285-H289 VanDerWaalsContact O-CD2 3.28Å; F285-H289 PolarHBondContact O-N 3.26Å; H289-V292 PolarHBondContact O-N 2.72Å; H289-N293 PolarHBondContact O-N 2.74Å
290	R	91.8	Very high	91.9	Very high	187 Å²	187	106.2 Å²	106.2	71%	0.706	51%	0.511	S	S	*	.	H	α-helix	trans	-63.4	-39.9	171.2	-77	172.3	173.9	-177.3	-3	112.3	R286 E287 F288 S294	R286-R290 WeakPolarHBondContact O-CB 3.39Å; R286-R290 VanDerWaalsContact O-CG 3.28Å; R286-R290 WeakPolarHBondContact O-CG 3.22Å; R286-R290 PolarHBondContact O-N 3.06Å; E287-R290 PolarHBondContact O-N 3.27Å; F288-R290 PolarHBondContact O-N 2.9Å; R290-S294 VanDerWaalsContact O-CB 3.28Å; R290-S294 WeakPolarHBondContact O-CB 3.29Å; R290-S294 PolarHBondContact O-N 3.04Å; R290-S294 PolarHBondContact O-OG 3.02Å
291	N	92	Very high	91.8	Very high	80 Å²	80	110.1 Å²	110.1	43%	0.428	52%	0.52	S	S	.	.	H	α-helix	trans	-71.3	-35.8	177.1	-79.7	-42.4	0	0	0	112.2	E287 F288 S294 R295	E287-N291 WeakPolarHBondContact CG-ND2 3.45Å; E287-N291 VanDerWaalsContact O-CB 3.28Å; E287-N291 WeakPolarHBondContact O-CB 3.41Å; E287-N291 PolarHBondContact O-N 2.73Å; E287-N291 PolarHBondContact O-ND2 2.76Å; E287-N291 VanDerWaalsContact O-ND2 3.11Å; F288-N291 CarbonylContact O-C 3.47Å; F288-N291 PolarHBondContact O-N 3.35Å; F288-N291 VanDerWaalsContact O-N 3.1Å; N291-S294 PolarHBondContact O-N 2.6Å; N291-R295 WeakPolarHBondContact O-CB 3.32Å; N291-R295 VanDerWaalsContact O-CG 3.29Å; N291-R295 WeakPolarHBondContact O-CG 3.31Å; N291-R295 PolarHBondContact O-N 2.8Å
292	V	91.6	Very high	91.7	Very high	56 Å²	56	106.7 Å²	106.7	34%	0.339	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-50.7	171.3	169.4	0	0	0	0	110.4	F288 H289 S294 R295 M296	F288-V292 HydrophobicContact CD1-CG2 4.23Å; F288-V292 HydrophobicContact CD2-CG2 4.4Å; F288-V292 HydrophobicContact CE1-CG2 3.87Å; F288-V292 HydrophobicContact CE2-CG2 4.05Å; F288-V292 HydrophobicContact CG-CG2 4.49Å; F288-V292 HydrophobicContact CZ-CG2 3.77Å; F288-V292 WeakPolarHBondContact O-CG2 3.4Å; F288-V292 PolarHBondContact O-N 2.94Å; H289-V292 PolarHBondContact O-N 2.72Å; V292-S294 VanDerWaalsContact C-N 3.28Å; V292-S294 PolarHBondContact O-N 3.45Å; V292-R295 PolarHBondContact O-N 2.88Å; V292-R295 VanDerWaalsContact O-N 3.12Å; V292-M296 WeakPolarHBondContact O-CB 3.3Å; V292-M296 PolarHBondContact O-N 3.49Å
293	N	90.4	Very high	91.6	Very high	96 Å²	96	108.6 Å²	108.6	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-60.5	-38.6	175.7	-72.8	3.3	0	0	0	111.9	H289 M296 V297	H289-N293 PolarHBondContact O-N 2.74Å; N293-M296 PolarHBondContact O-N 3.12Å; N293-V297 WeakPolarHBondContact O-CG2 3.43Å; N293-V297 PolarHBondContact O-N 2.83Å
294	S	89.9	Confident	91.3	Very high	58 Å²	58	107.7 Å²	107.7	41%	0.406	52%	0.522	S	S	.	.	H	α-helix	trans	-68.1	-34.6	176	-60	0	0	0	0	112.9	R290 N291 V292 K298	R290-S294 VanDerWaalsContact O-CB 3.28Å; R290-S294 WeakPolarHBondContact O-CB 3.29Å; R290-S294 PolarHBondContact O-N 3.04Å; R290-S294 PolarHBondContact O-OG 3.02Å; N291-S294 PolarHBondContact O-N 2.6Å; V292-S294 VanDerWaalsContact C-N 3.28Å; V292-S294 PolarHBondContact O-N 3.45Å; S294-K298 WeakPolarHBondContact O-CB 3.41Å; S294-K298 VanDerWaalsContact O-CG 3.25Å; S294-K298 WeakPolarHBondContact O-CG 3.22Å; S294-K298 PolarHBondContact O-N 3.01Å; S294-K298 VanDerWaalsContact O-N 3.14Å
295	R	92.8	Very high	91.1	Very high	179 Å²	179	107.9 Å²	107.9	68%	0.675	52%	0.523	S	S	*	.	H	α-helix	trans	-68.4	-45.5	170.7	-75.1	176.5	-171.4	-166.4	4.1	110.8	N291 V292 V297 K298 I299	N291-R295 WeakPolarHBondContact O-CB 3.32Å; N291-R295 VanDerWaalsContact O-CG 3.29Å; N291-R295 WeakPolarHBondContact O-CG 3.31Å; N291-R295 PolarHBondContact O-N 2.8Å; V292-R295 PolarHBondContact O-N 2.88Å; V292-R295 VanDerWaalsContact O-N 3.12Å; R295-V297 PolarHBondContact O-N 3.46Å; R295-K298 CarbonylContact O-C 3.56Å; R295-K298 WeakPolarHBondContact O-CB 3.5Å; R295-K298 PolarHBondContact O-N 3.31Å; R295-K298 VanDerWaalsContact O-N 3.14Å; R295-I299 WeakPolarHBondContact O-CB 3.36Å; R295-I299 VanDerWaalsContact O-CG1 3.28Å; R295-I299 WeakPolarHBondContact O-CG1 3.19Å; R295-I299 PolarHBondContact O-N 2.65Å
296	M	90.2	Very high	90.9	Very high	105 Å²	105	110.7 Å²	110.7	52%	0.517	53%	0.531	S	S	.	.	H	α-helix	trans	-57.8	-46.1	176.5	179.6	-175.3	171.1	0	0	111.7	V292 N293 K298 I299 N300	V292-M296 WeakPolarHBondContact O-CB 3.3Å; V292-M296 PolarHBondContact O-N 3.49Å; N293-M296 PolarHBondContact O-N 3.12Å; M296-K298 PolarHBondContact O-N 3.36Å; M296-I299 PolarHBondContact O-N 3.13Å; M296-N300 WeakPolarHBondContact O-CB 3.32Å; M296-N300 PolarHBondContact O-N 3.41Å; M296-N300 PolarHBondContact O-OD1 3.47Å
297	V	91.2	Very high	90.8	Very high	99 Å²	99	109.8 Å²	109.8	60%	0.6	53%	0.532	S	S	*	.	H	α-helix	trans	-64.8	-37.9	175.5	171.9	0	0	0	0	111.9	N293 R295 K301	N293-V297 WeakPolarHBondContact O-CG2 3.43Å; N293-V297 PolarHBondContact O-N 2.83Å; R295-V297 PolarHBondContact O-N 3.46Å; V297-K301 WeakPolarHBondContact O-CB 3.31Å; V297-K301 PolarHBondContact O-N 3.23Å
298	K	91.3	Very high	90.4	Very high	155 Å²	155	106.2 Å²	106.2	67%	0.674	52%	0.522	S	S	*	.	H	α-helix	trans	-65.4	-42	173.4	-75.9	173	-179.6	-177.6	0	112.3	S294 R295 M296 K301 A302	S294-K298 WeakPolarHBondContact O-CB 3.41Å; S294-K298 VanDerWaalsContact O-CG 3.25Å; S294-K298 WeakPolarHBondContact O-CG 3.22Å; S294-K298 PolarHBondContact O-N 3.01Å; S294-K298 VanDerWaalsContact O-N 3.14Å; R295-K298 CarbonylContact O-C 3.56Å; R295-K298 WeakPolarHBondContact O-CB 3.5Å; R295-K298 PolarHBondContact O-N 3.31Å; R295-K298 VanDerWaalsContact O-N 3.14Å; M296-K298 PolarHBondContact O-N 3.36Å; K298-K301 PolarHBondContact O-N 3.45Å; K298-A302 WeakPolarHBondContact O-CB 3.34Å; K298-A302 PolarHBondContact O-N 2.92Å
299	I	92.7	Very high	90	Very high	103 Å²	103	104.3 Å²	104.3	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-65.3	-48.4	176.6	-70.3	163.7	0	0	0	109.8	R295 M296 K301 A302 V303	R295-I299 WeakPolarHBondContact O-CB 3.36Å; R295-I299 VanDerWaalsContact O-CG1 3.28Å; R295-I299 WeakPolarHBondContact O-CG1 3.19Å; R295-I299 PolarHBondContact O-N 2.65Å; M296-I299 PolarHBondContact O-N 3.13Å; I299-K301 VanDerWaalsContact C-N 3.28Å; I299-K301 PolarHBondContact O-N 3.44Å; I299-A302 CarbonylContact O-C 3.48Å; I299-A302 WeakPolarHBondContact O-CA 3.32Å; I299-A302 WeakPolarHBondContact O-CB 3.3Å; I299-A302 PolarHBondContact O-N 3.38Å; I299-V303 HydrophobicContact CG2-CG2 4.25Å; I299-V303 WeakPolarHBondContact O-CG2 3.27Å; I299-V303 PolarHBondContact O-N 3.4Å
300	N	91.4	Very high	89.7	Confident	82 Å²	82	102.5 Å²	102.5	44%	0.439	52%	0.517	S	S	.	.	H	α-helix	trans	-58.7	-40.4	176.5	-69.9	-3.4	0	0	0	111.4	M296 V303 L304	M296-N300 WeakPolarHBondContact O-CB 3.32Å; M296-N300 PolarHBondContact O-N 3.41Å; M296-N300 PolarHBondContact O-OD1 3.47Å; N300-V303 PolarHBondContact O-N 2.79Å; N300-L304 WeakPolarHBondContact O-CB 3.35Å; N300-L304 VanDerWaalsContact O-CG 3.27Å; N300-L304 WeakPolarHBondContact O-CG 3.4Å; N300-L304 PolarHBondContact O-N 2.76Å
301	K	90	Very high	89	Confident	137 Å²	137	100.4 Å²	100.4	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-67.2	-37.8	173.3	-170.6	174.7	-178	179.6	0	112.6	V297 K298 I299 N305	V297-K301 WeakPolarHBondContact O-CB 3.31Å; V297-K301 PolarHBondContact O-N 3.23Å; K298-K301 PolarHBondContact O-N 3.45Å; I299-K301 VanDerWaalsContact C-N 3.28Å; I299-K301 PolarHBondContact O-N 3.44Å; K301-N305 WeakPolarHBondContact O-CB 3.23Å; K301-N305 VanDerWaalsContact O-CG 3.26Å; K301-N305 PolarHBondContact O-N 3.41Å; K301-N305 PolarHBondContact O-OD1 3.38Å
302	A	91.1	Very high	88.4	Confident	57 Å²	57	103.8 Å²	103.8	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-67	-39.2	175	0	0	0	0	0	112.1	K298 I299 N305 Y306	K298-A302 WeakPolarHBondContact O-CB 3.34Å; K298-A302 PolarHBondContact O-N 2.92Å; I299-A302 CarbonylContact O-C 3.48Å; I299-A302 WeakPolarHBondContact O-CA 3.32Å; I299-A302 WeakPolarHBondContact O-CB 3.3Å; I299-A302 PolarHBondContact O-N 3.38Å; A302-N305 PolarHBondContact O-N 3.11Å; A302-Y306 VanDerWaalsContact O-CB 3.27Å; A302-Y306 WeakPolarHBondContact O-CB 3.48Å; A302-Y306 PolarHBondContact O-N 2.79Å
303	V	91.9	Very high	87.8	Confident	69 Å²	69	104.7 Å²	104.7	42%	0.418	53%	0.525	S	S	.	.	H	α-helix	trans	-68.2	-40	174.9	171.3	0	0	0	0	111.2	I299 N300 Y306 K307	I299-V303 HydrophobicContact CG2-CG2 4.25Å; I299-V303 WeakPolarHBondContact O-CG2 3.27Å; I299-V303 PolarHBondContact O-N 3.4Å; N300-V303 PolarHBondContact O-N 2.79Å; V303-Y306 PolarHBondContact O-N 3.16Å; V303-K307 WeakPolarHBondContact O-CB 3.36Å; V303-K307 WeakPolarHBondContact O-CG 3.21Å; V303-K307 PolarHBondContact O-N 3.35Å
304	L	86.8	Confident	87.2	Confident	119 Å²	119	107.8 Å²	107.8	62%	0.623	53%	0.534	S	S	*	.	H	α-helix	trans	-64.2	-43.5	172.4	-74.2	168.8	0	0	0	111.7	N300 Y306 K307 A308	N300-L304 WeakPolarHBondContact O-CB 3.35Å; N300-L304 VanDerWaalsContact O-CG 3.27Å; N300-L304 WeakPolarHBondContact O-CG 3.4Å; N300-L304 PolarHBondContact O-N 2.76Å; L304-Y306 VanDerWaalsContact C-N 3.35Å; L304-K307 PolarHBondContact O-N 3.38Å; L304-A308 WeakPolarHBondContact O-CB 3.37Å; L304-A308 PolarHBondContact O-N 3.41Å
305	N	87.6	Confident	86.4	Confident	90 Å²	90	112.6 Å²	112.6	48%	0.481	54%	0.543	S	S	.	.	H	α-helix	trans	-63.7	-39.4	173.4	-75.7	5.6	0	0	0	112	K301 A302 A308 N309	K301-N305 WeakPolarHBondContact O-CB 3.23Å; K301-N305 VanDerWaalsContact O-CG 3.26Å; K301-N305 PolarHBondContact O-N 3.41Å; K301-N305 PolarHBondContact O-OD1 3.38Å; A302-N305 PolarHBondContact O-N 3.11Å; N305-A308 PolarHBondContact O-N 3.36Å; N305-N309 WeakPolarHBondContact O-CB 3.28Å; N305-N309 VanDerWaalsContact O-CG 3.27Å; N305-N309 PolarHBondContact O-N 2.89Å
306	Y	89.3	Confident	85.6	Confident	169 Å²	169	109.2 Å²	109.2	66%	0.663	53%	0.533	S	S	*	.	H	α-helix	trans	-65.2	-45.4	176.6	176.3	-96.8	0	0	0	111.1	A302 V303 L304 N309 A310	A302-Y306 VanDerWaalsContact O-CB 3.27Å; A302-Y306 WeakPolarHBondContact O-CB 3.48Å; A302-Y306 PolarHBondContact O-N 2.79Å; V303-Y306 PolarHBondContact O-N 3.16Å; L304-Y306 VanDerWaalsContact C-N 3.35Å; Y306-N309 PolarHBondContact O-N 2.9Å; Y306-A310 VanDerWaalsContact O-CB 3.31Å; Y306-A310 WeakPolarHBondContact O-CB 3.34Å; Y306-A310 PolarHBondContact O-N 3.31Å
307	K	87.7	Confident	84.8	Confident	139 Å²	139	108.4 Å²	108.4	60%	0.604	53%	0.528	S	S	*	.	H	α-helix	trans	-60	-45.8	173.2	-75.3	-169.1	175	-165.4	0	111.8	V303 L304 N309 A310 E311	V303-K307 WeakPolarHBondContact O-CB 3.36Å; V303-K307 WeakPolarHBondContact O-CG 3.21Å; V303-K307 PolarHBondContact O-N 3.35Å; L304-K307 PolarHBondContact O-N 3.38Å; K307-N309 VanDerWaalsContact C-N 3.32Å; K307-N309 PolarHBondContact O-N 3.42Å; K307-A310 PolarHBondContact O-N 3.09Å; K307-E311 VanDerWaalsContact O-CB 3.23Å; K307-E311 WeakPolarHBondContact O-CB 3.5Å; K307-E311 PolarHBondContact O-N 3.27Å
308	A	82.9	Confident	83.7	Confident	44 Å²	44	106.4 Å²	106.4	36%	0.364	51%	0.512	S	S	.	.	H	α-helix	trans	-67.3	-28.8	177.9	0	0	0	0	0	113.7	L304 N305 R312	L304-A308 WeakPolarHBondContact O-CB 3.37Å; L304-A308 PolarHBondContact O-N 3.41Å; N305-A308 PolarHBondContact O-N 3.36Å; A308-R312 WeakPolarHBondContact O-CB 3.47Å; A308-R312 PolarHBondContact O-N 2.91Å; A308-R312 VanDerWaalsContact O-N 3.12Å
309	N	84.7	Confident	82.5	Confident	85 Å²	85	102.3 Å²	102.3	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-75.2	-47.1	171.6	-76.2	-6.7	0	0	0	111	N305 Y306 K307 E311 R312 D313	N305-N309 WeakPolarHBondContact O-CB 3.28Å; N305-N309 VanDerWaalsContact O-CG 3.27Å; N305-N309 PolarHBondContact O-N 2.89Å; Y306-N309 PolarHBondContact O-N 2.9Å; K307-N309 VanDerWaalsContact C-N 3.32Å; K307-N309 PolarHBondContact O-N 3.42Å; N309-E311 VanDerWaalsContact C-N 3.28Å; N309-E311 PolarHBondContact O-N 3.08Å; N309-R312 CarbonylContact O-C 3.59Å; N309-R312 WeakPolarHBondContact O-CA 3.28Å; N309-R312 WeakPolarHBondContact O-CB 3.26Å; N309-R312 PolarHBondContact O-N 3.42Å; N309-R312 VanDerWaalsContact O-N 3.09Å; N309-D313 WeakPolarHBondContact O-CB 3.41Å; N309-D313 VanDerWaalsContact O-CG 3.25Å; N309-D313 PolarHBondContact O-N 3.11Å
310	A	85.3	Confident	81.6	Confident	43 Å²	43	104.2 Å²	104.2	36%	0.355	50%	0.496	S	S	.	.	H	α-helix	trans	-61.3	-35.1	176	0	0	0	0	0	112.4	Y306 K307 D313 K314	Y306-A310 VanDerWaalsContact O-CB 3.31Å; Y306-A310 WeakPolarHBondContact O-CB 3.34Å; Y306-A310 PolarHBondContact O-N 3.31Å; K307-A310 PolarHBondContact O-N 3.09Å; A310-D313 PolarHBondContact O-N 3.45Å; A310-K314 WeakPolarHBondContact O-CB 2.59Å; A310-K314 PolarHBondContact O-N 3.36Å
311	E	78.7	Confident	80.5	Confident	143 Å²	143	102.4 Å²	102.4	67%	0.668	49%	0.486	S	S	*	.	H	α-helix	trans	-66.6	-44.7	171.2	-177	177.5	-160.6	0	0	111.6	K307 N309 D313 R315	K307-E311 VanDerWaalsContact O-CB 3.23Å; K307-E311 WeakPolarHBondContact O-CB 3.5Å; K307-E311 PolarHBondContact O-N 3.27Å; N309-E311 VanDerWaalsContact C-N 3.28Å; N309-E311 PolarHBondContact O-N 3.08Å; E311-D313 VanDerWaalsContact C-N 3.35Å; E311-D313 PolarHBondContact O-N 3.35Å; E311-R315 WeakPolarHBondContact O-CB 3.41Å; E311-R315 PolarHBondContact O-N 2.87Å
312	R	78.6	Confident	79.1	Confident	151 Å²	151	98.5 Å²	98.5	57%	0.57	47%	0.472	S	S	*	.	H	α-helix	trans	-62.1	-39.7	172.6	164.6	175.4	-85.4	109.9	-2.5	112.3	A308 N309 R315 K316	A308-R312 WeakPolarHBondContact O-CB 3.47Å; A308-R312 PolarHBondContact O-N 2.91Å; A308-R312 VanDerWaalsContact O-N 3.12Å; N309-R312 CarbonylContact O-C 3.59Å; N309-R312 WeakPolarHBondContact O-CA 3.28Å; N309-R312 WeakPolarHBondContact O-CB 3.26Å; N309-R312 PolarHBondContact O-N 3.42Å; N309-R312 VanDerWaalsContact O-N 3.09Å; R312-R315 WeakPolarHBondContact O-CB 2.86Å; R312-R315 PolarHBondContact O-N 3.23Å; R312-K316 WeakPolarHBondContact O-CG 3.44Å; R312-K316 PolarHBondContact O-N 2.83Å
313	D	79.8	Confident	78.1	Confident	75 Å²	75	102.6 Å²	102.6	40%	0.401	48%	0.475	S	S	.	.	H	α-helix	trans	-79.8	-36.3	-176	-65.5	-30.8	0	0	0	110.8	N309 A310 E311 R315 K316 E317	N309-D313 WeakPolarHBondContact O-CB 3.41Å; N309-D313 VanDerWaalsContact O-CG 3.25Å; N309-D313 PolarHBondContact O-N 3.11Å; A310-D313 PolarHBondContact O-N 3.45Å; E311-D313 VanDerWaalsContact C-N 3.35Å; E311-D313 PolarHBondContact O-N 3.35Å; D313-R315 VanDerWaalsContact C-N 3.26Å; D313-R315 PolarHBondContact O-N 3.1Å; D313-K316 PolarHBondContact O-N 2.86Å; D313-K316 WeakPolarHBondContact OD1-CD 3.25Å; D313-K316 WeakPolarHBondContact OD1-CE 3.44Å; D313-K316 IonicContact OD1-NZ 3.36Å; D313-K316 PolarHBondContact OD1-NZ 3.3Å; D313-E317 WeakPolarHBondContact O-CB 3.15Å; D313-E317 PolarHBondContact O-N 3.39Å
314	K	77.8	Confident	76.7	Confident	161 Å²	161	102.4 Å²	102.4	70%	0.7	47%	0.47	S	S	*	.	H	α-helix	trans	-58	-38.8	163.7	-176.1	176.5	-179.9	-179.4	0	111.2	A310 E317 Q318	A310-K314 WeakPolarHBondContact O-CB 2.59Å; A310-K314 PolarHBondContact O-N 3.36Å; K314-E317 PolarHBondContact O-N 3.42Å; K314-Q318 VanDerWaalsContact O-CB 3.3Å; K314-Q318 WeakPolarHBondContact O-CB 2.44Å; K314-Q318 PolarHBondContact O-N 3.12Å
315	R	73.1	Confident	75.4	Confident	159 Å²	159	98.3 Å²	98.3	60%	0.6	45%	0.446	S	S	*	.	H	α-helix	trans	-66.8	-44	173.9	177.2	177.3	168.6	142.6	10.1	112.5	E311 R312 D313 E317 Q318 E319	E311-R315 WeakPolarHBondContact O-CB 3.41Å; E311-R315 PolarHBondContact O-N 2.87Å; R312-R315 WeakPolarHBondContact O-CB 2.86Å; R312-R315 PolarHBondContact O-N 3.23Å; D313-R315 VanDerWaalsContact C-N 3.26Å; D313-R315 PolarHBondContact O-N 3.1Å; R315-E317 VanDerWaalsContact C-N 3.28Å; R315-E317 PolarHBondContact O-N 3.19Å; R315-Q318 WeakPolarHBondContact O-CB 3.29Å; R315-Q318 PolarHBondContact O-N 2.88Å; R315-E319 HydrophobicContact CG-CG 4.46Å; R315-E319 WeakPolarHBondContact CG-OE1 3.37Å; R315-E319 IonicContact CZ-OE1 3.91Å; R315-E319 IonicContact NE-OE1 3.33Å; R315-E319 PolarHBondContact NE-OE1 3.1Å; R315-E319 IonicContact NH2-OE1 3.61Å; R315-E319 PolarHBondContact NH2-OE1 2.97Å; R315-E319 WeakPolarHBondContact O-CB 3.35Å; R315-E319 VanDerWaalsContact O-CG 3.29Å; R315-E319 WeakPolarHBondContact O-CG 3.38Å; R315-E319 PolarHBondContact O-N 3.06Å
316	K	75.9	Confident	73.8	Confident	108 Å²	108	98.5 Å²	98.5	47%	0.47	45%	0.445	S	S	.	.	H	α-helix	trans	-61.1	-38.4	174.3	-71	172.6	-170.1	161.2	0	112.2	R312 D313 E319 R320	R312-K316 WeakPolarHBondContact O-CG 3.44Å; R312-K316 PolarHBondContact O-N 2.83Å; D313-K316 PolarHBondContact O-N 2.86Å; D313-K316 WeakPolarHBondContact OD1-CD 3.25Å; D313-K316 WeakPolarHBondContact OD1-CE 3.44Å; D313-K316 IonicContact OD1-NZ 3.36Å; D313-K316 PolarHBondContact OD1-NZ 3.3Å; K316-E319 CarbonylContact O-C 3.1Å; K316-E319 PolarHBondContact O-N 3.16Å; K316-R320 WeakPolarHBondContact O-CB 3.16Å; K316-R320 PolarHBondContact O-N 2.85Å
317	E	73.5	Confident	72.5	Confident	89 Å²	89	97.5 Å²	97.5	42%	0.416	44%	0.44	S	S	.	.	H	α-helix	trans	-74.3	-35.4	179.5	-164.1	57.4	-147.9	0	0	111	D313 K314 R315 R320 I321	D313-E317 WeakPolarHBondContact O-CB 3.15Å; D313-E317 PolarHBondContact O-N 3.39Å; K314-E317 PolarHBondContact O-N 3.42Å; R315-E317 VanDerWaalsContact C-N 3.28Å; R315-E317 PolarHBondContact O-N 3.19Å; E317-R320 WeakPolarHBondContact O-CB 3.43Å; E317-R320 PolarHBondContact O-N 2.98Å; E317-R320 WeakPolarHBondContact OE1-CD 3.28Å; E317-R320 WeakPolarHBondContact OE2-CD 3.32Å; E317-R320 IonicContact OE2-NH1 2.78Å; E317-I321 HydrophobicContact CG-CD1 4.31Å; E317-I321 WeakPolarHBondContact O-CB 3.44Å; E317-I321 VanDerWaalsContact O-CG1 3.25Å; E317-I321 WeakPolarHBondContact O-CG1 3.49Å; E317-I321 PolarHBondContact O-N 2.8Å
318	Q	67.9	Low	71.3	Confident	56 Å²	56	94.9 Å²	94.9	26%	0.262	43%	0.426	S	S	.	.	H	α-helix	trans	-58.1	-53.6	165.8	-178	63.4	50.4	0	0	110.5	K314 R315 R320 I321 D322	K314-Q318 VanDerWaalsContact O-CB 3.3Å; K314-Q318 WeakPolarHBondContact O-CB 2.44Å; K314-Q318 PolarHBondContact O-N 3.12Å; R315-Q318 WeakPolarHBondContact O-CB 3.29Å; R315-Q318 PolarHBondContact O-N 2.88Å; Q318-R320 PolarHBondContact O-N 3.12Å; Q318-R320 VanDerWaalsContact O-N 3.11Å; Q318-I321 PolarHBondContact O-N 3.39Å; Q318-I321 VanDerWaalsContact O-N 3.13Å; Q318-D322 WeakPolarHBondContact CG-OD2 3.36Å; Q318-D322 PolarHBondContact NE2-OD1 3.04Å; Q318-D322 PolarHBondContact NE2-OD2 3.21Å; Q318-D322 WeakPolarHBondContact O-CB 3.3Å; Q318-D322 PolarHBondContact O-N 3.08Å; Q318-D322 VanDerWaalsContact O-OD2 3.06Å
319	E	66.4	Low	70	Confident	69 Å²	69	95.6 Å²	95.6	32%	0.322	42%	0.423	S	S	.	.	H	α-helix	trans	-59	-24.9	175.1	-68.2	166.7	-168.3	0	0	113	R315 K316 R323	R315-E319 HydrophobicContact CG-CG 4.46Å; R315-E319 WeakPolarHBondContact CG-OE1 3.37Å; R315-E319 IonicContact CZ-OE1 3.91Å; R315-E319 IonicContact NE-OE1 3.33Å; R315-E319 PolarHBondContact NE-OE1 3.1Å; R315-E319 IonicContact NH2-OE1 3.61Å; R315-E319 PolarHBondContact NH2-OE1 2.97Å; R315-E319 WeakPolarHBondContact O-CB 3.35Å; R315-E319 VanDerWaalsContact O-CG 3.29Å; R315-E319 WeakPolarHBondContact O-CG 3.38Å; R315-E319 PolarHBondContact O-N 3.06Å; K316-E319 CarbonylContact O-C 3.1Å; K316-E319 PolarHBondContact O-N 3.16Å; E319-R323 WeakPolarHBondContact O-CB 3.41Å; E319-R323 WeakPolarHBondContact O-CG 3.43Å; E319-R323 PolarHBondContact O-N 2.99Å; E319-R323 PolarHBondContact O-NE 3.01Å; E319-R323 PolarHBondContact O-NH2 2.97Å
320	R	73.8	Confident	68.2	Low	143 Å²	143	99.1 Å²	99.1	54%	0.54	44%	0.439	S	S	.	.	H	α-helix	trans	-78.4	-48.1	174.1	-174.1	-173.2	-175.7	177.3	0.4	111.6	K316 E317 Q318 D322 R323 E324	K316-R320 WeakPolarHBondContact O-CB 3.16Å; K316-R320 PolarHBondContact O-N 2.85Å; E317-R320 WeakPolarHBondContact O-CB 3.43Å; E317-R320 PolarHBondContact O-N 2.98Å; E317-R320 WeakPolarHBondContact OE1-CD 3.28Å; E317-R320 WeakPolarHBondContact OE2-CD 3.32Å; E317-R320 IonicContact OE2-NH1 2.78Å; Q318-R320 PolarHBondContact O-N 3.12Å; Q318-R320 VanDerWaalsContact O-N 3.11Å; R320-D322 VanDerWaalsContact C-N 3.27Å; R320-D322 PolarHBondContact O-N 3.37Å; R320-R323 PolarHBondContact O-N 3.25Å; R320-E324 WeakPolarHBondContact O-CB 3.36Å; R320-E324 PolarHBondContact O-N 3.27Å
321	I	68.7	Low	66.8	Low	45 Å²	45	100.4 Å²	100.4	23%	0.231	45%	0.45	C	S	.	.	H	α-helix	trans	-57.8	-43.4	174.4	-69.8	162.5	0	0	0	109.6	E317 Q318 E324 R325 L340	E317-I321 HydrophobicContact CG-CD1 4.31Å; E317-I321 WeakPolarHBondContact O-CB 3.44Å; E317-I321 VanDerWaalsContact O-CG1 3.25Å; E317-I321 WeakPolarHBondContact O-CG1 3.49Å; E317-I321 PolarHBondContact O-N 2.8Å; Q318-I321 PolarHBondContact O-N 3.39Å; Q318-I321 VanDerWaalsContact O-N 3.13Å; I321-E324 PolarHBondContact O-N 3.28Å; I321-R325 WeakPolarHBondContact O-CB 3.47Å; I321-R325 PolarHBondContact O-N 3.38Å; I321-L340 HydrophobicContact CG2-CD2 4.48Å
322	D	60.3	Low	65.3	Low	55 Å²	55	99.8 Å²	99.8	29%	0.294	45%	0.447	S	S	.	.	H	α-helix	trans	-68.1	-36.2	179.2	-61.3	-28.6	0	0	0	111.7	Q318 R320 M326	Q318-D322 WeakPolarHBondContact CG-OD2 3.36Å; Q318-D322 PolarHBondContact NE2-OD1 3.04Å; Q318-D322 PolarHBondContact NE2-OD2 3.21Å; Q318-D322 WeakPolarHBondContact O-CB 3.3Å; Q318-D322 PolarHBondContact O-N 3.08Å; Q318-D322 VanDerWaalsContact O-OD2 3.06Å; R320-D322 VanDerWaalsContact C-N 3.27Å; R320-D322 PolarHBondContact O-N 3.37Å; D322-M326 WeakPolarHBondContact O-CB 3.26Å; D322-M326 VanDerWaalsContact O-CG 3.26Å; D322-M326 WeakPolarHBondContact O-CG 3.33Å; D322-M326 PolarHBondContact O-N 2.98Å
323	R	70.3	Confident	64.2	Low	143 Å²	143	95.3 Å²	95.3	54%	0.54	43%	0.434	S	S	.	.	H	α-helix	trans	-67.6	-35.4	170.4	-86.3	179.4	-90.9	105.5	-0.6	113.4	E319 R320 R327	E319-R323 WeakPolarHBondContact O-CB 3.41Å; E319-R323 WeakPolarHBondContact O-CG 3.43Å; E319-R323 PolarHBondContact O-N 2.99Å; E319-R323 PolarHBondContact O-NE 3.01Å; E319-R323 PolarHBondContact O-NH2 2.97Å; R320-R323 PolarHBondContact O-N 3.25Å; R323-R327 PolarHBondContact O-N 3.06Å
324	E	62.4	Low	62.7	Low	65 Å²	65	97.7 Å²	97.7	30%	0.304	44%	0.443	S	S	.	.	H	α-helix	trans	-73.1	-39.5	176.4	-154.9	60.6	-116.1	0	0	111.4	R320 I321 R327 R328	R320-E324 WeakPolarHBondContact O-CB 3.36Å; R320-E324 PolarHBondContact O-N 3.27Å; I321-E324 PolarHBondContact O-N 3.28Å; E324-R327 WeakPolarHBondContact O-CB 3.44Å; E324-R327 PolarHBondContact O-N 3.07Å; E324-R327 VanDerWaalsContact O-N 3.14Å; E324-R327 IonicContact OE1-CZ 3.73Å; E324-R327 IonicContact OE1-NE 2.74Å; E324-R327 IonicContact OE1-NH1 2.63Å; E324-R327 PolarHBondContact OE1-NH1 2.85Å; E324-R327 IonicContact OE2-CZ 2.87Å; E324-R327 IonicContact OE2-NH1 2.66Å; E324-R327 PolarHBondContact OE2-NH1 3.48Å; E324-R328 PolarHBondContact O-N 2.83Å
325	R	58.5	Low	61.7	Low	32 Å²	32	97.6 Å²	97.6	12%	0.121	45%	0.445	C	S	.	.	H	α-helix	trans	-59.1	-46.9	171.6	-172.1	-179.1	-160.1	-126.7	2.4	111.3	I321 R328 L329 Y337 I341 D357	I321-R325 WeakPolarHBondContact O-CB 3.47Å; I321-R325 PolarHBondContact O-N 3.38Å; R325-R328 PolarHBondContact O-N 3.25Å; R325-L329 WeakPolarHBondContact O-CB 2.98Å; R325-L329 PolarHBondContact O-N 3.14Å; R325-Y337 HydrophobicContact CG-CD2 3.74Å; R325-Y337 HydrophobicContact CG-CE2 3.6Å; R325-Y337 PolarHBondContact NH2-OH 3.23Å; R325-I341 VanDerWaalsContact NH2-CD1 3.33Å; R325-D357 IonicContact CZ-OD1 3.17Å; R325-D357 VanDerWaalsContact CZ-OD1 3.31Å; R325-D357 IonicContact CZ-OD2 2.8Å; R325-D357 IonicContact NH1-OD1 2.74Å; R325-D357 PolarHBondContact NH1-OD1 3.48Å; R325-D357 IonicContact NH1-OD2 2.69Å; R325-D357 PolarHBondContact NH1-OD2 3.48Å; R325-D357 IonicContact NH2-OD1 2.66Å; R325-D357 PolarHBondContact NH2-OD1 3.3Å; R325-D357 IonicContact NH2-OD2 2.63Å; R325-D357 PolarHBondContact NH2-OD2 2.91Å
326	M	53.3	Low	61	Low	94 Å²	94	90.6 Å²	90.6	46%	0.463	42%	0.423	S	S	.	.	H	α-helix	trans	-64.4	-37	172.6	-72.8	-63.7	-68.4	0	0	112.2	D322 L329 M330	D322-M326 WeakPolarHBondContact O-CB 3.26Å; D322-M326 VanDerWaalsContact O-CG 3.26Å; D322-M326 WeakPolarHBondContact O-CG 3.33Å; D322-M326 PolarHBondContact O-N 2.98Å; M326-L329 PolarHBondContact O-N 3.11Å; M326-L329 HydrophobicContact SD-CD2 4.2Å; M326-M330 WeakPolarHBondContact O-CB 3.5Å; M326-M330 WeakPolarHBondContact O-CG 3.44Å; M326-M330 PolarHBondContact O-N 3.12Å
327	R	63.4	Low	59.8	Low	148 Å²	148	87.2 Å²	87.2	56%	0.558	41%	0.407	S	S	*	.	H	α-helix	trans	-63.8	-45.3	174.6	-173.2	-175.5	-66.7	131.1	0.3	111.8	R323 E324 M330 A331	R323-R327 PolarHBondContact O-N 3.06Å; E324-R327 WeakPolarHBondContact O-CB 3.44Å; E324-R327 PolarHBondContact O-N 3.07Å; E324-R327 VanDerWaalsContact O-N 3.14Å; E324-R327 IonicContact OE1-CZ 3.73Å; E324-R327 IonicContact OE1-NE 2.74Å; E324-R327 IonicContact OE1-NH1 2.63Å; E324-R327 PolarHBondContact OE1-NH1 2.85Å; E324-R327 IonicContact OE2-CZ 2.87Å; E324-R327 IonicContact OE2-NH1 2.66Å; E324-R327 PolarHBondContact OE2-NH1 3.48Å; R327-M330 CarbonylContact O-C 3.38Å; R327-M330 PolarHBondContact O-N 2.9Å; R327-A331 WeakPolarHBondContact O-CB 3.44Å; R327-A331 PolarHBondContact O-N 3.33Å
328	R	63	Low	58.9	Low	85 Å²	85	91.2 Å²	91.2	32%	0.321	42%	0.418	S	S	.	.	H	α-helix	trans	-62.2	-44	176.1	-76.7	-171.8	156.4	142.5	10.3	112.4	E324 R325 M330 A331 E332 D333 G336	E324-R328 PolarHBondContact O-N 2.83Å; R325-R328 PolarHBondContact O-N 3.25Å; R328-M330 VanDerWaalsContact C-N 3.27Å; R328-M330 PolarHBondContact O-N 2.86Å; R328-A331 CarbonylContact O-C 3.56Å; R328-A331 PolarHBondContact O-N 2.9Å; R328-E332 PolarHBondContact O-N 3.4Å; R328-E332 VanDerWaalsContact O-N 3.07Å; R328-D333 HydrophobicContact CB-CB 4.07Å; R328-D333 WeakPolarHBondContact CD-OD2 3.45Å; R328-D333 HydrophobicContact CG-CB 4.16Å; R328-D333 WeakPolarHBondContact CG-OD2 3.39Å; R328-D333 IonicContact CZ-OD2 3.24Å; R328-D333 IonicContact NE-OD2 3.23Å; R328-D333 PolarHBondContact NE-OD2 3.05Å; R328-D333 PolarHBondContact O-N 3.28Å; R328-D333 VanDerWaalsContact O-N 3.12Å; R328-G336 VanDerWaalsContact CD-C 3.43Å; R328-G336 VanDerWaalsContact CD-O 3.23Å; R328-G336 WeakPolarHBondContact CD-O 3.39Å; R328-G336 PolarHBondContact NH1-O 2.77Å
329	L	54.6	Low	58.8	Low	58 Å²	58	92.7 Å²	92.7	30%	0.304	43%	0.434	S	S	.	.	H	α-helix	trans	-58.9	-37.7	173.3	-166.6	76.2	0	0	0	112	R325 M326 A331 Y337 I360	R325-L329 WeakPolarHBondContact O-CB 2.98Å; R325-L329 PolarHBondContact O-N 3.14Å; M326-L329 PolarHBondContact O-N 3.11Å; M326-L329 HydrophobicContact SD-CD2 4.2Å; L329-A331 VanDerWaalsContact C-N 3.32Å; L329-Y337 HydrophobicContact CD1-CD2 4.39Å; L329-Y337 HydrophobicContact CD1-CE2 4.13Å; L329-I360 HydrophobicContact CD2-CG2 3.76Å
330	M	46.7	Very low	58.5	Low	159 Å²	159	91.6 Å²	91.6	78%	0.783	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-8	174.8	-68.5	178.6	79.6	0	0	114.4	M326 R327 R328	M326-M330 WeakPolarHBondContact O-CB 3.5Å; M326-M330 WeakPolarHBondContact O-CG 3.44Å; M326-M330 PolarHBondContact O-N 3.12Å; R327-M330 CarbonylContact O-C 3.38Å; R327-M330 PolarHBondContact O-N 2.9Å; R328-M330 VanDerWaalsContact C-N 3.27Å; R328-M330 PolarHBondContact O-N 2.86Å
331	A	56.5	Low	57.6	Low	70 Å²	70	86.8 Å²	86.8	58%	0.579	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	4.9	178	0	0	0	0	0	112.9	R327 R328 L329 D333	R327-A331 WeakPolarHBondContact O-CB 3.44Å; R327-A331 PolarHBondContact O-N 3.33Å; R328-A331 CarbonylContact O-C 3.56Å; R328-A331 PolarHBondContact O-N 2.9Å; L329-A331 VanDerWaalsContact C-N 3.32Å; A331-D333 PolarHBondContact O-N 3.4Å
332	E	47.3	Very low	56.9	Low	131 Å²	131	89.6 Å²	89.6	61%	0.612	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	25.2	-178	-48.3	-162.2	122.3	0	0	114.2	R328 E334 R368	R328-E332 PolarHBondContact O-N 3.4Å; R328-E332 VanDerWaalsContact O-N 3.07Å; E332-E334 PolarHBondContact O-N 3Å; E332-E334 VanDerWaalsContact O-N 3.1Å; E332-R368 IonicContact OE1-CZ 3.29Å; E332-R368 IonicContact OE1-NE 2.98Å; E332-R368 PolarHBondContact OE1-NE 2.85Å; E332-R368 IonicContact OE1-NH2 2.67Å; E332-R368 PolarHBondContact OE1-NH2 2.96Å
333	D	55.4	Low	56.8	Low	56 Å²	56	90.9 Å²	90.9	30%	0.299	45%	0.448	S	S	.	.			trans	-81.2	77	174.4	178.2	11.6	0	0	0	110.8	R328 A331 E335 G336 Y337	R328-D333 HydrophobicContact CB-CB 4.07Å; R328-D333 WeakPolarHBondContact CD-OD2 3.45Å; R328-D333 HydrophobicContact CG-CB 4.16Å; R328-D333 WeakPolarHBondContact CG-OD2 3.39Å; R328-D333 IonicContact CZ-OD2 3.24Å; R328-D333 IonicContact NE-OD2 3.23Å; R328-D333 PolarHBondContact NE-OD2 3.05Å; R328-D333 PolarHBondContact O-N 3.28Å; R328-D333 VanDerWaalsContact O-N 3.12Å; A331-D333 PolarHBondContact O-N 3.4Å; D333-E335 VanDerWaalsContact C-N 3.31Å; D333-E335 PolarHBondContact O-N 3.34Å; D333-G336 WeakPolarHBondContact OD1-CA 3.4Å; D333-G336 PolarHBondContact OD1-N 2.88Å; D333-Y337 VanDerWaalsContact O-CB 3.28Å; D333-Y337 WeakPolarHBondContact O-CB 3.27Å; D333-Y337 PolarHBondContact O-N 3.38Å
334	E	47.9	Very low	56.1	Low	126 Å²	126	86.9 Å²	86.9	59%	0.589	44%	0.435	S	S	*	.	H	α-helix	trans	-66.3	-31.3	-178.9	-61.2	-167.5	164.2	0	0	112.7	E332 R338 R368	E332-E334 PolarHBondContact O-N 3Å; E332-E334 VanDerWaalsContact O-N 3.1Å; E334-R338 WeakPolarHBondContact O-CG 3.5Å; E334-R338 PolarHBondContact O-N 3.18Å; E334-R338 VanDerWaalsContact O-N 3.12Å; E334-R368 IonicContact OE1-NH1 2.88Å
335	E	57.4	Low	55.4	Low	159 Å²	159	93.3 Å²	93.3	74%	0.743	46%	0.462	S	S	*	.	H	α-helix	trans	-78.4	-45.7	-175.9	-162.4	160.6	-129.6	0	0	111.6	D333 Y337 R338 C339	D333-E335 VanDerWaalsContact C-N 3.31Å; D333-E335 PolarHBondContact O-N 3.34Å; E335-Y337 PolarHBondContact O-N 3.34Å; E335-R338 PolarHBondContact O-N 3.29Å; E335-C339 PolarHBondContact O-N 3.05Å
336	G	58	Low	55	Low	12 Å²	12	96.4 Å²	96.4	12%	0.124	48%	0.48	C	S	.	.	H	α-helix	trans	-69	-15.1	171	0	0	0	0	0	114.3	R328 D333	R328-G336 VanDerWaalsContact CD-C 3.43Å; R328-G336 VanDerWaalsContact CD-O 3.23Å; R328-G336 WeakPolarHBondContact CD-O 3.39Å; R328-G336 PolarHBondContact NH1-O 2.77Å; D333-G336 WeakPolarHBondContact OD1-CA 3.4Å; D333-G336 PolarHBondContact OD1-N 2.88Å
337	Y	51.5	Low	55	Low	37 Å²	37	100.1 Å²	100.1	15%	0.145	50%	0.497	C	S	.	.	H	α-helix	trans	-80.1	-45.4	170.6	176.4	-96	0	0	0	111.8	R325 L329 D333 E335 L340 I341 D357	R325-Y337 HydrophobicContact CG-CD2 3.74Å; R325-Y337 HydrophobicContact CG-CE2 3.6Å; R325-Y337 PolarHBondContact NH2-OH 3.23Å; L329-Y337 HydrophobicContact CD1-CD2 4.39Å; L329-Y337 HydrophobicContact CD1-CE2 4.13Å; D333-Y337 VanDerWaalsContact O-CB 3.28Å; D333-Y337 WeakPolarHBondContact O-CB 3.27Å; D333-Y337 PolarHBondContact O-N 3.38Å; E335-Y337 PolarHBondContact O-N 3.34Å; Y337-L340 PolarHBondContact O-N 3.25Å; Y337-I341 HydrophobicContact CD1-CD1 4.06Å; Y337-I341 HydrophobicContact CE1-CD1 3.57Å; Y337-D357 PolarHBondContact OH-OD1 3.36Å
338	R	52.9	Low	54.1	Low	172 Å²	172	102.8 Å²	102.8	65%	0.649	51%	0.507	S	S	*	.	H	α-helix	trans	-59	-49.5	177.2	-75.3	175.4	63.7	-177.3	-1.8	112.4	E334 E335 L340 I341 D342	E334-R338 WeakPolarHBondContact O-CG 3.5Å; E334-R338 PolarHBondContact O-N 3.18Å; E334-R338 VanDerWaalsContact O-N 3.12Å; E335-R338 PolarHBondContact O-N 3.29Å; R338-L340 PolarHBondContact O-N 3.16Å; R338-I341 WeakPolarHBondContact O-CB 3.34Å; R338-I341 PolarHBondContact O-N 2.66Å; R338-D342 PolarHBondContact O-N 2.94Å
339	C	66.2	Low	53.3	Low	88 Å²	88	102 Å²	102	60%	0.595	51%	0.509	S	S	*	.	H	α-helix	trans	-59	-20.6	178.9	-68	0	0	0	0	114.5	E335	E335-C339 PolarHBondContact O-N 3.05Å
340	L	59.5	Low	53	Low	45 Å²	45	103.5 Å²	103.5	24%	0.236	51%	0.514	C	S	.	.	H	α-helix	trans	-82.8	-18.4	174	-78.1	171	0	0	0	113.8	I321 Y337 R338	I321-L340 HydrophobicContact CG2-CD2 4.48Å; Y337-L340 PolarHBondContact O-N 3.25Å; R338-L340 PolarHBondContact O-N 3.16Å
341	I	55.1	Low	53.3	Low	42 Å²	42	101.9 Å²	101.9	22%	0.215	50%	0.504	C	S	.	.	H	α-helix	trans	-85.6	-52.3	177.3	-62.6	175.4	0	0	0	109.6	R325 Y337 R338 A343 K344	R325-I341 VanDerWaalsContact NH2-CD1 3.33Å; Y337-I341 HydrophobicContact CD1-CD1 4.06Å; Y337-I341 HydrophobicContact CE1-CD1 3.57Å; R338-I341 WeakPolarHBondContact O-CB 3.34Å; R338-I341 PolarHBondContact O-N 2.66Å; I341-A343 PolarHBondContact O-N 2.87Å; I341-A343 VanDerWaalsContact O-N 3.09Å; I341-K344 PolarHBondContact O-N 2.8Å
342	D	55.3	Low	53	Low	105 Å²	105	103 Å²	103	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-60.5	-26.8	-174.6	-59.9	-36.7	0	0	0	112.7	R338 K344	R338-D342 PolarHBondContact O-N 2.94Å; D342-K344 VanDerWaalsContact C-N 3.27Å; D342-K344 PolarHBondContact O-N 3.44Å
343	A	57.3	Low	53.1	Low	81 Å²	81	99 Å²	99	67%	0.669	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-11.3	174.4	0	0	0	0	0	114.9	I341	I341-A343 PolarHBondContact O-N 2.87Å; I341-A343 VanDerWaalsContact O-N 3.09Å
344	K	55.5	Low	52.9	Low	59 Å²	59	99.1 Å²	99.1	26%	0.257	49%	0.485	S	S	.	.			trans	-116.3	75.4	179.7	-75.1	-174.5	-178.2	173.7	0	111.9	I341 D342 D346	I341-K344 PolarHBondContact O-N 2.8Å; D342-K344 VanDerWaalsContact C-N 3.27Å; D342-K344 PolarHBondContact O-N 3.44Å; K344-D346 PolarHBondContact O-N 3.06Å
345	K	47.6	Very low	53.1	Low	201 Å²	201	97 Å²	97	87%	0.874	48%	0.475	S	S	*	.			trans	-64.9	36.9	174.7	-61.6	-173.1	177	-177.4	0	115.5	Q347	K345-Q347 PolarHBondContact O-N 3.26Å
346	D	50.9	Low	52.8	Low	96 Å²	96	92.5 Å²	92.5	51%	0.513	46%	0.459	S	S	.	.			trans	-97.8	84.3	-179.8	-165	-13.6	0	0	0	108.8	K344 R348 L349 H350	K344-D346 PolarHBondContact O-N 3.06Å; D346-R348 PolarHBondContact O-N 2.71Å; D346-L349 HydrophobicContact CB-CB 3.95Å; D346-L349 CarbonylContact O-C 3.47Å; D346-L349 WeakPolarHBondContact O-CA 3.36Å; D346-L349 WeakPolarHBondContact O-CB 3.33Å; D346-L349 PolarHBondContact O-N 2.84Å; D346-H350 PolarHBondContact O-N 3.08Å
347	Q	52.8	Low	52.3	Low	172 Å²	172	92.9 Å²	92.9	80%	0.804	46%	0.458	S	S	*	.	H	α-helix	trans	-48.1	-37.4	-164.2	-74.8	-178.5	-22.4	0	0	115.2	K345 H350 H351	K345-Q347 PolarHBondContact O-N 3.26Å; Q347-H350 PolarHBondContact O-N 2.99Å; Q347-H351 PolarHBondContact O-N 3.11Å
348	R	44.7	Very low	52.6	Low	204 Å²	204	95.8 Å²	95.8	77%	0.77	47%	0.473	S	S	*	.	H	α-helix	trans	-74.9	-36.8	177.9	-176.5	178.7	175.7	-168.2	-0.2	112.3	D346 H350 H351 L352	D346-R348 PolarHBondContact O-N 2.71Å; R348-H350 VanDerWaalsContact C-N 3.34Å; R348-H351 PolarHBondContact O-N 2.78Å; R348-L352 PolarHBondContact O-N 2.93Å; R348-L352 VanDerWaalsContact O-N 3.14Å
349	L	46.8	Very low	52.2	Low	70 Å²	70	90.8 Å²	90.8	37%	0.366	46%	0.456	S	S	.	.	H	α-helix	trans	-68	-38.7	172	-162.7	76.1	0	0	0	110	D346 L352 L353	D346-L349 HydrophobicContact CB-CB 3.95Å; D346-L349 CarbonylContact O-C 3.47Å; D346-L349 WeakPolarHBondContact O-CA 3.36Å; D346-L349 WeakPolarHBondContact O-CB 3.33Å; D346-L349 PolarHBondContact O-N 2.84Å; L349-L352 PolarHBondContact O-N 2.84Å; L349-L353 HydrophobicContact CD2-CD1 4.06Å; L349-L353 HydrophobicContact CG-CD1 3.85Å; L349-L353 HydrophobicContact CG-CG 4.25Å; L349-L353 WeakPolarHBondContact O-CB 3.47Å; L349-L353 VanDerWaalsContact O-CG 3.23Å; L349-L353 WeakPolarHBondContact O-CG 3.42Å; L349-L353 PolarHBondContact O-N 3.36Å
350	H	48.3	Very low	51.7	Low	89 Å²	89	89 Å²	89	41%	0.412	44%	0.44	S	S	.	.	H	α-helix	trans	-60	-45.4	171.2	-173.2	-46.5	0	0	0	111.2	D346 Q347 R348 L352 L353 T354	D346-H350 PolarHBondContact O-N 3.08Å; Q347-H350 PolarHBondContact O-N 2.99Å; R348-H350 VanDerWaalsContact C-N 3.34Å; H350-L352 PolarHBondContact O-N 3.06Å; H350-L353 PolarHBondContact O-N 3.13Å; H350-T354 PolarHBondContact CE1-OG1 2.8Å; H350-T354 PolarHBondContact ND1-OG1 2.9Å; H350-T354 VanDerWaalsContact O-CB 3.27Å; H350-T354 WeakPolarHBondContact O-CB 3.43Å; H350-T354 PolarHBondContact O-N 3.45Å; H350-T354 PolarHBondContact O-OG1 2.85Å
351	H	51.9	Low	51.4	Low	125 Å²	125	89.6 Å²	89.6	58%	0.579	45%	0.448	S	S	*	.	H	α-helix	trans	-63.6	-41.1	179.2	-160.8	75.7	0	0	0	112.5	Q347 R348 Q355	Q347-H351 PolarHBondContact O-N 3.11Å; R348-H351 PolarHBondContact O-N 2.78Å; H351-Q355 WeakPolarHBondContact O-CG 3.37Å; H351-Q355 PolarHBondContact O-N 3.33Å
352	L	51.3	Low	51.4	Low	93 Å²	93	90 Å²	90	49%	0.487	45%	0.45	S	S	.	.	H	α-helix	trans	-72.4	-36.9	176.8	-118.2	143.1	0	0	0	112.8	R348 L349 H350 T356	R348-L352 PolarHBondContact O-N 2.93Å; R348-L352 VanDerWaalsContact O-N 3.14Å; L349-L352 PolarHBondContact O-N 2.84Å; H350-L352 PolarHBondContact O-N 3.06Å; L352-T356 WeakPolarHBondContact O-CB 3.42Å; L352-T356 PolarHBondContact O-N 2.79Å; L352-T356 PolarHBondContact O-OG1 2.95Å
353	L	48.1	Very low	51.2	Low	48 Å²	48	87.5 Å²	87.5	25%	0.251	44%	0.437	S	S	.	.	H	α-helix	trans	-69.2	-46.8	173.7	-75.5	172.7	0	0	0	110.2	L349 H350 Q355 T356 D357	L349-L353 HydrophobicContact CD2-CD1 4.06Å; L349-L353 HydrophobicContact CG-CD1 3.85Å; L349-L353 HydrophobicContact CG-CG 4.25Å; L349-L353 WeakPolarHBondContact O-CB 3.47Å; L349-L353 VanDerWaalsContact O-CG 3.23Å; L349-L353 WeakPolarHBondContact O-CG 3.42Å; L349-L353 PolarHBondContact O-N 3.36Å; H350-L353 PolarHBondContact O-N 3.13Å; L353-Q355 VanDerWaalsContact C-N 3.31Å; L353-Q355 PolarHBondContact O-N 3.12Å; L353-T356 CarbonylContact O-C 3.39Å; L353-T356 WeakPolarHBondContact O-CA 3.42Å; L353-T356 WeakPolarHBondContact O-CB 3.13Å; L353-T356 PolarHBondContact O-N 2.81Å; L353-D357 VanDerWaalsContact O-CB 3.22Å; L353-D357 WeakPolarHBondContact O-CB 3.26Å; L353-D357 PolarHBondContact O-N 2.88Å; L353-D357 VanDerWaalsContact O-OD2 3.05Å
354	T	52.3	Low	50.8	Low	57 Å²	57	85.8 Å²	85.8	35%	0.35	42%	0.418	S	S	.	.	H	α-helix	trans	-53.9	-46.2	172.1	-60.2	0	0	0	0	111.2	H350 T356 D357 E358	H350-T354 PolarHBondContact CE1-OG1 2.8Å; H350-T354 PolarHBondContact ND1-OG1 2.9Å; H350-T354 VanDerWaalsContact O-CB 3.27Å; H350-T354 WeakPolarHBondContact O-CB 3.43Å; H350-T354 PolarHBondContact O-N 3.45Å; H350-T354 PolarHBondContact O-OG1 2.85Å; T354-T356 VanDerWaalsContact C-N 3.29Å; T354-T356 PolarHBondContact O-N 3.17Å; T354-D357 PolarHBondContact O-N 3.15Å; T354-E358 WeakPolarHBondContact O-CA 3.42Å; T354-E358 WeakPolarHBondContact O-CB 3.44Å; T354-E358 PolarHBondContact O-N 3.37Å
355	Q	51.9	Low	51	Low	82 Å²	82	89.2 Å²	89.2	38%	0.383	43%	0.433	S	S	.	.	H	α-helix	trans	-60.7	-36.1	173.6	-75.6	176.3	-15.4	0	0	113	H351 L353 F359	H351-Q355 WeakPolarHBondContact O-CG 3.37Å; H351-Q355 PolarHBondContact O-N 3.33Å; L353-Q355 VanDerWaalsContact C-N 3.31Å; L353-Q355 PolarHBondContact O-N 3.12Å; Q355-F359 VanDerWaalsContact O-CB 3.3Å; Q355-F359 WeakPolarHBondContact O-CB 3.36Å; Q355-F359 PolarHBondContact O-N 3.05Å
356	T	50.7	Low	51.3	Low	64 Å²	64	83.7 Å²	83.7	39%	0.393	41%	0.413	S	S	.	.	H	α-helix	trans	-78.3	-31	177.9	-48.5	0	0	0	0	112.7	L352 L353 T354 F359 I360	L352-T356 WeakPolarHBondContact O-CB 3.42Å; L352-T356 PolarHBondContact O-N 2.79Å; L352-T356 PolarHBondContact O-OG1 2.95Å; L353-T356 CarbonylContact O-C 3.39Å; L353-T356 WeakPolarHBondContact O-CA 3.42Å; L353-T356 WeakPolarHBondContact O-CB 3.13Å; L353-T356 PolarHBondContact O-N 2.81Å; T354-T356 VanDerWaalsContact C-N 3.29Å; T354-T356 PolarHBondContact O-N 3.17Å; T356-F359 WeakPolarHBondContact O-CB 3.22Å; T356-I360 HydrophobicContact CG2-CD1 4.06Å; T356-I360 WeakPolarHBondContact O-CB 3.26Å; T356-I360 WeakPolarHBondContact O-CD1 3.28Å; T356-I360 WeakPolarHBondContact O-CG1 3.49Å; T356-I360 PolarHBondContact O-N 3.3Å
357	D	47.3	Very low	51.1	Low	20 Å²	20	81.3 Å²	81.3	11%	0.107	40%	0.402	C	S	.	.	H	α-helix	trans	-83.9	-31.4	-178.6	-65.4	-34	0	0	0	110.8	R325 Y337 L353 T354 S361	R325-D357 IonicContact CZ-OD1 3.17Å; R325-D357 VanDerWaalsContact CZ-OD1 3.31Å; R325-D357 IonicContact CZ-OD2 2.8Å; R325-D357 IonicContact NH1-OD1 2.74Å; R325-D357 PolarHBondContact NH1-OD1 3.48Å; R325-D357 IonicContact NH1-OD2 2.69Å; R325-D357 PolarHBondContact NH1-OD2 3.48Å; R325-D357 IonicContact NH2-OD1 2.66Å; R325-D357 PolarHBondContact NH2-OD1 3.3Å; R325-D357 IonicContact NH2-OD2 2.63Å; R325-D357 PolarHBondContact NH2-OD2 2.91Å; Y337-D357 PolarHBondContact OH-OD1 3.36Å; L353-D357 VanDerWaalsContact O-CB 3.22Å; L353-D357 WeakPolarHBondContact O-CB 3.26Å; L353-D357 PolarHBondContact O-N 2.88Å; L353-D357 VanDerWaalsContact O-OD2 3.05Å; T354-D357 PolarHBondContact O-N 3.15Å; D357-S361 WeakPolarHBondContact O-CA 3.12Å; D357-S361 WeakPolarHBondContact O-CB 3.37Å; D357-S361 PolarHBondContact O-N 2.93Å
358	E	57.3	Low	51.3	Low	99 Å²	99	78.3 Å²	78.3	46%	0.463	38%	0.383	S	S	.	.	H	α-helix	trans	-69.9	-39.6	165.8	-177	170.7	-132.1	0	0	109.9	T354 N362	T354-E358 WeakPolarHBondContact O-CA 3.42Å; T354-E358 WeakPolarHBondContact O-CB 3.44Å; T354-E358 PolarHBondContact O-N 3.37Å; E358-N362 WeakPolarHBondContact O-CB 3.21Å; E358-N362 PolarHBondContact O-N 2.71Å; E358-N362 PolarHBondContact O-ND2 3.16Å; E358-N362 VanDerWaalsContact O-ND2 3.1Å
359	F	45.7	Very low	52.2	Low	67 Å²	67	72.5 Å²	72.5	29%	0.294	36%	0.364	S	S	.	.	H	α-helix	trans	-58.8	-51.5	168.4	-159.8	-68.7	0	0	0	111	Q355 T356 L363 Y551 V791	Q355-F359 VanDerWaalsContact O-CB 3.3Å; Q355-F359 WeakPolarHBondContact O-CB 3.36Å; Q355-F359 PolarHBondContact O-N 3.05Å; T356-F359 WeakPolarHBondContact O-CB 3.22Å; F359-L363 WeakPolarHBondContact O-CB 3.27Å; F359-L363 PolarHBondContact O-N 3.33Å; F359-Y551 HydrophobicContact CB-CE1 4.39Å; F359-Y551 AromaticContact CD2-CD1 3.7Å; F359-Y551 HydrophobicContact CD2-CD1 3.7Å; F359-Y551 AromaticContact CD2-CE1 3.23Å; F359-Y551 HydrophobicContact CD2-CE1 3.23Å; F359-Y551 HydrophobicContact CD2-CE2 4.3Å; F359-Y551 HydrophobicContact CD2-CG 4.42Å; F359-Y551 AromaticContact CD2-CZ 3.57Å; F359-Y551 AromaticContact CE2-CD1 3.69Å; F359-Y551 HydrophobicContact CE2-CD1 3.69Å; F359-Y551 HydrophobicContact CE2-CD2 4.02Å; F359-Y551 AromaticContact CE2-CE1 3.53Å; F359-Y551 HydrophobicContact CE2-CE1 3.53Å; F359-Y551 AromaticContact CE2-CE2 3.87Å; F359-Y551 HydrophobicContact CE2-CE2 3.87Å; F359-Y551 AromaticContact CE2-CG 3.95Å; F359-Y551 HydrophobicContact CE2-CG 3.95Å; F359-Y551 AromaticContact CE2-CZ 3.62Å; F359-Y551 AromaticContact CG-CE1 3.87Å; F359-Y551 HydrophobicContact CG-CE1 3.87Å; F359-Y551 AromaticContact CG-CZ 3.92Å; F359-Y551 HydrophobicContact CZ-CD2 4.36Å; F359-Y551 HydrophobicContact CZ-CE1 4.38Å; F359-Y551 HydrophobicContact CZ-CE2 4Å; F359-V791 HydrophobicContact CZ-CG2 4.45Å
360	I	55.7	Low	52.4	Low	49 Å²	49	71.6 Å²	71.6	25%	0.251	36%	0.358	S	S	.	.	H	α-helix	trans	-68.5	-37.3	-179.7	-72.5	164.8	0	0	0	112.1	L329 T356 L363 T364	L329-I360 HydrophobicContact CD2-CG2 3.76Å; T356-I360 HydrophobicContact CG2-CD1 4.06Å; T356-I360 WeakPolarHBondContact O-CB 3.26Å; T356-I360 WeakPolarHBondContact O-CD1 3.28Å; T356-I360 WeakPolarHBondContact O-CG1 3.49Å; T356-I360 PolarHBondContact O-N 3.3Å; I360-L363 PolarHBondContact O-N 2.75Å; I360-T364 WeakPolarHBondContact O-CB 3.29Å; I360-T364 PolarHBondContact O-N 2.9Å; I360-T364 PolarHBondContact O-OG1 3.08Å
361	S	52.1	Low	52.9	Low	59 Å²	59	74.1 Å²	74.1	41%	0.413	37%	0.368	S	S	.	.	H	α-helix	trans	-70.1	-42.8	177.6	-178.6	0	0	0	0	111.1	D357 T364 K365	D357-S361 WeakPolarHBondContact O-CA 3.12Å; D357-S361 WeakPolarHBondContact O-CB 3.37Å; D357-S361 PolarHBondContact O-N 2.93Å; S361-T364 CarbonylContact O-C 3.56Å; S361-T364 PolarHBondContact O-N 3.07Å; S361-K365 WeakPolarHBondContact O-CB 3.41Å; S361-K365 PolarHBondContact O-N 3.5Å
362	N	55.8	Low	53.5	Low	49 Å²	49	73.9 Å²	73.9	26%	0.262	36%	0.362	S	S	.	.	H	α-helix	trans	-67	-37	172.7	-70.9	-31.9	0	0	0	111.4	E358 T364 L366	E358-N362 WeakPolarHBondContact O-CB 3.21Å; E358-N362 PolarHBondContact O-N 2.71Å; E358-N362 PolarHBondContact O-ND2 3.16Å; E358-N362 VanDerWaalsContact O-ND2 3.1Å; N362-T364 VanDerWaalsContact C-N 3.32Å; N362-T364 PolarHBondContact O-N 2.63Å; N362-L366 VanDerWaalsContact O-CB 3.29Å; N362-L366 WeakPolarHBondContact O-CB 3.24Å; N362-L366 WeakPolarHBondContact O-CG 3.29Å; N362-L366 PolarHBondContact O-N 3.49Å
363	L	50.5	Low	54	Low	53 Å²	53	72.8 Å²	72.8	28%	0.277	35%	0.354	S	S	.	.	H	α-helix	trans	-63.2	-38.3	171.1	-159.7	75.1	0	0	0	111.5	F359 I360 V367 W762	F359-L363 WeakPolarHBondContact O-CB 3.27Å; F359-L363 PolarHBondContact O-N 3.33Å; I360-L363 PolarHBondContact O-N 2.75Å; L363-V367 WeakPolarHBondContact O-CB 3.42Å; L363-V367 WeakPolarHBondContact O-CG2 3.25Å; L363-V367 PolarHBondContact O-N 2.88Å; L363-W762 HydrophobicContact CD2-CH2 3.74Å; L363-W762 HydrophobicContact CD2-CZ3 3.87Å; L363-W762 HydrophobicContact CG-CH2 4.39Å; L363-W762 HydrophobicContact CG-CZ3 4.35Å
364	T	50.6	Low	54.2	Low	46 Å²	46	72.8 Å²	72.8	28%	0.282	35%	0.353	S	S	.	.	H	α-helix	trans	-79	-34.9	-178.3	-59.3	0	0	0	0	111.6	I360 S361 N362 V367 R368	I360-T364 WeakPolarHBondContact O-CB 3.29Å; I360-T364 PolarHBondContact O-N 2.9Å; I360-T364 PolarHBondContact O-OG1 3.08Å; S361-T364 CarbonylContact O-C 3.56Å; S361-T364 PolarHBondContact O-N 3.07Å; N362-T364 VanDerWaalsContact C-N 3.32Å; N362-T364 PolarHBondContact O-N 2.63Å; T364-V367 PolarHBondContact O-N 2.78Å; T364-R368 VanDerWaalsContact O-CB 3.26Å; T364-R368 WeakPolarHBondContact O-CB 3.3Å; T364-R368 WeakPolarHBondContact O-CG 3.37Å; T364-R368 PolarHBondContact O-N 3.11Å
365	K	58.2	Low	54.7	Low	130 Å²	130	73.8 Å²	73.8	57%	0.565	36%	0.363	S	S	*	.	H	α-helix	trans	-58.9	-58.6	163.8	-80.8	-172.9	174.1	-175.9	0	109	S361 V367 R368 E369	S361-K365 WeakPolarHBondContact O-CB 3.41Å; S361-K365 PolarHBondContact O-N 3.5Å; K365-V367 PolarHBondContact O-N 2.7Å; K365-V367 VanDerWaalsContact O-N 3.09Å; K365-R368 CarbonylContact O-C 3.05Å; K365-R368 PolarHBondContact O-N 2.92Å; K365-E369 WeakPolarHBondContact O-CB 3.33Å; K365-E369 VanDerWaalsContact O-CG 3.23Å; K365-E369 WeakPolarHBondContact O-CG 3.5Å; K365-E369 PolarHBondContact O-N 3.12Å
366	L	54.5	Low	55.3	Low	86 Å²	86	74.3 Å²	74.3	45%	0.45	36%	0.364	S	S	.	.	H	α-helix	trans	-56.9	-29.6	178.4	-81.1	161	0	0	0	114.2	N362 H370	N362-L366 VanDerWaalsContact O-CB 3.29Å; N362-L366 WeakPolarHBondContact O-CB 3.24Å; N362-L366 WeakPolarHBondContact O-CG 3.29Å; N362-L366 PolarHBondContact O-N 3.49Å; L366-H370 VanDerWaalsContact O-CB 3.23Å; L366-H370 WeakPolarHBondContact O-CB 3.44Å; L366-H370 PolarHBondContact O-N 2.86Å
367	V	47.3	Very low	55.8	Low	45 Å²	45	75.9 Å²	75.9	27%	0.273	37%	0.367	S	S	.	.	H	α-helix	trans	-81.5	-39.4	174	168.3	0	0	0	0	112.5	L363 T364 K365 E369 K371	L363-V367 WeakPolarHBondContact O-CB 3.42Å; L363-V367 WeakPolarHBondContact O-CG2 3.25Å; L363-V367 PolarHBondContact O-N 2.88Å; T364-V367 PolarHBondContact O-N 2.78Å; K365-V367 PolarHBondContact O-N 2.7Å; K365-V367 VanDerWaalsContact O-N 3.09Å; V367-E369 VanDerWaalsContact C-N 3.3Å; V367-K371 WeakPolarHBondContact O-CB 3.18Å; V367-K371 WeakPolarHBondContact O-CG 3.38Å; V367-K371 PolarHBondContact O-N 3.29Å
368	R	56.4	Low	56.4	Low	109 Å²	109	83 Å²	83	41%	0.411	39%	0.392	S	S	.	.	H	α-helix	trans	-64.8	-35.9	170.6	-81.2	-179.1	172.8	159.7	-4.9	110.8	E332 E334 T364 K365 R372	E332-R368 IonicContact OE1-CZ 3.29Å; E332-R368 IonicContact OE1-NE 2.98Å; E332-R368 PolarHBondContact OE1-NE 2.85Å; E332-R368 IonicContact OE1-NH2 2.67Å; E332-R368 PolarHBondContact OE1-NH2 2.96Å; E334-R368 IonicContact OE1-NH1 2.88Å; T364-R368 VanDerWaalsContact O-CB 3.26Å; T364-R368 WeakPolarHBondContact O-CB 3.3Å; T364-R368 WeakPolarHBondContact O-CG 3.37Å; T364-R368 PolarHBondContact O-N 3.11Å; K365-R368 CarbonylContact O-C 3.05Å; K365-R368 PolarHBondContact O-N 2.92Å; R368-R372 WeakPolarHBondContact O-CB 3.5Å; R368-R372 PolarHBondContact O-N 2.8Å
369	E	63.1	Low	56.6	Low	82 Å²	82	85 Å²	85	38%	0.383	40%	0.399	S	S	.	.	H	α-helix	trans	-71.6	-46.9	175	-67	-150.2	110.4	0	0	111.3	K365 V367 K371 R372 E373	K365-E369 WeakPolarHBondContact O-CB 3.33Å; K365-E369 VanDerWaalsContact O-CG 3.23Å; K365-E369 WeakPolarHBondContact O-CG 3.5Å; K365-E369 PolarHBondContact O-N 3.12Å; V367-E369 VanDerWaalsContact C-N 3.3Å; E369-K371 VanDerWaalsContact C-N 3.29Å; E369-K371 PolarHBondContact O-N 2.93Å; E369-R372 CarbonylContact O-C 3.55Å; E369-R372 PolarHBondContact O-N 2.62Å; E369-R372 VanDerWaalsContact O-N 3.11Å; E369-R372 IonicContact OE1-CZ 3.27Å; E369-R372 VanDerWaalsContact OE1-CZ 3.28Å; E369-R372 IonicContact OE1-NH1 3.56Å; E369-R372 PolarHBondContact OE1-NH1 2.96Å; E369-R372 IonicContact OE1-NH2 3.62Å; E369-R372 PolarHBondContact OE1-NH2 2.78Å; E369-E373 WeakPolarHBondContact O-CB 3.28Å; E369-E373 PolarHBondContact O-N 2.76Å
370	H	51	Low	57.5	Low	52 Å²	52	89.3 Å²	89.3	24%	0.241	41%	0.414	C	S	.	.	H	α-helix	trans	-60.7	-38.6	173	-172.5	-128.3	0	0	0	112	L366 Q374 L783	L366-H370 VanDerWaalsContact O-CB 3.23Å; L366-H370 WeakPolarHBondContact O-CB 3.44Å; L366-H370 PolarHBondContact O-N 2.86Å; H370-Q374 PolarHBondContact CE1-NE2 2.85Å; H370-Q374 PolarHBondContact NE2-NE2 3.06Å; H370-Q374 VanDerWaalsContact O-CB 3.28Å; H370-Q374 WeakPolarHBondContact O-CB 3.21Å; H370-Q374 WeakPolarHBondContact O-CG 3.43Å; H370-Q374 PolarHBondContact O-N 3.29Å; H370-L783 VanDerWaalsContact CE1-CD2 3.5Å; H370-L783 WeakPolarHBondContact CE1-CD2 3.23Å; H370-L783 WeakPolarHBondContact NE2-CD2 3.49Å
371	K	58.9	Low	57.7	Low	142 Å²	142	91.2 Å²	91.2	62%	0.617	42%	0.421	S	S	*	.	H	α-helix	trans	-66.5	-39.7	171.9	-77.5	-177.8	174.3	-174.1	0	112.8	V367 E369 S375	V367-K371 WeakPolarHBondContact O-CB 3.18Å; V367-K371 WeakPolarHBondContact O-CG 3.38Å; V367-K371 PolarHBondContact O-N 3.29Å; E369-K371 VanDerWaalsContact C-N 3.29Å; E369-K371 PolarHBondContact O-N 2.93Å; K371-S375 WeakPolarHBondContact O-CB 3.32Å; K371-S375 PolarHBondContact O-N 2.99Å
372	R	63.8	Low	58.1	Low	120 Å²	120	98 Å²	98	45%	0.453	44%	0.438	S	S	.	.	H	α-helix	trans	-66.2	-39.8	176.3	163	159.1	51.6	73.4	-25.8	111.2	R368 E369 S375 K376	R368-R372 WeakPolarHBondContact O-CB 3.5Å; R368-R372 PolarHBondContact O-N 2.8Å; E369-R372 CarbonylContact O-C 3.55Å; E369-R372 PolarHBondContact O-N 2.62Å; E369-R372 VanDerWaalsContact O-N 3.11Å; E369-R372 IonicContact OE1-CZ 3.27Å; E369-R372 VanDerWaalsContact OE1-CZ 3.28Å; E369-R372 IonicContact OE1-NH1 3.56Å; E369-R372 PolarHBondContact OE1-NH1 2.96Å; E369-R372 IonicContact OE1-NH2 3.62Å; E369-R372 PolarHBondContact OE1-NH2 2.78Å; R372-S375 PolarHBondContact O-N 3.01Å; R372-K376 HydrophobicContact CG-CD 4.33Å; R372-K376 WeakPolarHBondContact O-CB 3.14Å; R372-K376 VanDerWaalsContact O-CG 3.29Å; R372-K376 WeakPolarHBondContact O-CG 3.5Å; R372-K376 PolarHBondContact O-N 3.33Å
373	E	63.1	Low	58.1	Low	69 Å²	69	97.7 Å²	97.7	32%	0.322	44%	0.44	S	S	.	.	H	α-helix	trans	-76.1	-43.3	178.2	-133.6	60.8	-146.2	0	0	111.2	E369 S375 K376 Q377	E369-E373 WeakPolarHBondContact O-CB 3.28Å; E369-E373 PolarHBondContact O-N 2.76Å; E373-S375 VanDerWaalsContact C-N 3.26Å; E373-S375 PolarHBondContact O-N 2.74Å; E373-K376 CarbonylContact O-C 3.52Å; E373-K376 PolarHBondContact O-N 3.11Å; E373-K376 WeakPolarHBondContact OE1-CD 3.27Å; E373-K376 IonicContact OE1-NZ 2.6Å; E373-K376 PolarHBondContact OE1-NZ 2.9Å; E373-K376 VanDerWaalsContact OE2-CD 3.31Å; E373-K376 WeakPolarHBondContact OE2-CD 3.49Å; E373-K376 WeakPolarHBondContact OE2-CE 3.48Å; E373-K376 IonicContact OE2-NZ 2.78Å; E373-K376 PolarHBondContact OE2-NZ 3.36Å; E373-Q377 WeakPolarHBondContact O-CB 3.28Å; E373-Q377 PolarHBondContact O-N 3.06Å
374	Q	53.1	Low	58.6	Low	49 Å²	49	100.4 Å²	100.4	23%	0.229	45%	0.451	C	S	.	.	H	α-helix	trans	-57.8	-37.9	168.1	-77.2	-166.4	-19.3	0	0	112.2	H370 Q377 R378 E780	H370-Q374 PolarHBondContact CE1-NE2 2.85Å; H370-Q374 PolarHBondContact NE2-NE2 3.06Å; H370-Q374 VanDerWaalsContact O-CB 3.28Å; H370-Q374 WeakPolarHBondContact O-CB 3.21Å; H370-Q374 WeakPolarHBondContact O-CG 3.43Å; H370-Q374 PolarHBondContact O-N 3.29Å; Q374-Q377 PolarHBondContact O-N 2.98Å; Q374-R378 VanDerWaalsContact O-CB 3.27Å; Q374-R378 WeakPolarHBondContact O-CB 3.4Å; Q374-R378 VanDerWaalsContact O-CG 3.24Å; Q374-R378 WeakPolarHBondContact O-CG 3.24Å; Q374-R378 PolarHBondContact O-N 2.93Å; Q374-E780 PolarHBondContact NE2-OE1 3.26Å
375	S	61.2	Low	59.1	Low	78 Å²	78	106.9 Å²	106.9	55%	0.545	47%	0.47	S	S	.	.	H	α-helix	trans	-71.7	-38.7	176.1	-166.3	0	0	0	0	112.4	K371 R372 E373 F379	K371-S375 WeakPolarHBondContact O-CB 3.32Å; K371-S375 PolarHBondContact O-N 2.99Å; R372-S375 PolarHBondContact O-N 3.01Å; E373-S375 VanDerWaalsContact C-N 3.26Å; E373-S375 PolarHBondContact O-N 2.74Å; S375-F379 WeakPolarHBondContact O-CB 3.46Å; S375-F379 PolarHBondContact O-N 2.6Å
376	K	65.2	Low	58.9	Low	93 Å²	93	106.6 Å²	106.6	40%	0.404	47%	0.466	S	S	.	.	H	α-helix	trans	-65.5	-38.1	171.2	-79.4	166.2	167.4	-179.1	0	111.9	R372 E373 F379 R380	R372-K376 HydrophobicContact CG-CD 4.33Å; R372-K376 WeakPolarHBondContact O-CB 3.14Å; R372-K376 VanDerWaalsContact O-CG 3.29Å; R372-K376 WeakPolarHBondContact O-CG 3.5Å; R372-K376 PolarHBondContact O-N 3.33Å; E373-K376 CarbonylContact O-C 3.52Å; E373-K376 PolarHBondContact O-N 3.11Å; E373-K376 WeakPolarHBondContact OE1-CD 3.27Å; E373-K376 IonicContact OE1-NZ 2.6Å; E373-K376 PolarHBondContact OE1-NZ 2.9Å; E373-K376 VanDerWaalsContact OE2-CD 3.31Å; E373-K376 WeakPolarHBondContact OE2-CD 3.49Å; E373-K376 WeakPolarHBondContact OE2-CE 3.48Å; E373-K376 IonicContact OE2-NZ 2.78Å; E373-K376 PolarHBondContact OE2-NZ 3.36Å; K376-F379 CarbonylContact O-C 3.47Å; K376-F379 PolarHBondContact O-N 3.41Å; K376-R380 WeakPolarHBondContact O-CB 3.05Å; K376-R380 WeakPolarHBondContact O-CG 3.45Å; K376-R380 PolarHBondContact O-N 2.89Å
377	Q	60.6	Low	59.1	Low	97 Å²	97	108.5 Å²	108.5	45%	0.453	47%	0.47	S	S	.	.	H	α-helix	trans	-74.1	-44.3	-177.4	-167.4	165.2	-1.5	0	0	109.6	E373 Q374 F379 R380 E381	E373-Q377 WeakPolarHBondContact O-CB 3.28Å; E373-Q377 PolarHBondContact O-N 3.06Å; Q374-Q377 PolarHBondContact O-N 2.98Å; Q377-F379 VanDerWaalsContact C-N 3.26Å; Q377-F379 PolarHBondContact O-N 2.83Å; Q377-R380 CarbonylContact O-C 3.52Å; Q377-R380 WeakPolarHBondContact O-CA 3.21Å; Q377-R380 WeakPolarHBondContact O-CB 3.42Å; Q377-R380 PolarHBondContact O-N 3.01Å; Q377-R380 VanDerWaalsContact O-N 3.1Å; Q377-E381 WeakPolarHBondContact O-CB 3.28Å; Q377-E381 WeakPolarHBondContact O-CG 3.36Å; Q377-E381 PolarHBondContact O-N 3.19Å
378	R	59.9	Low	59.5	Low	169 Å²	169	113.1 Å²	113.1	64%	0.638	49%	0.487	S	S	*	.	H	α-helix	trans	-60.6	-32.6	166.5	-71.5	174.8	179.8	-154.1	-1.5	113	Q374 E381 R382	Q374-R378 VanDerWaalsContact O-CB 3.27Å; Q374-R378 WeakPolarHBondContact O-CB 3.4Å; Q374-R378 VanDerWaalsContact O-CG 3.24Å; Q374-R378 WeakPolarHBondContact O-CG 3.24Å; Q374-R378 PolarHBondContact O-N 2.93Å; R378-E381 WeakPolarHBondContact CA-OE2 3.4Å; R378-R382 WeakPolarHBondContact O-CB 3.43Å; R378-R382 PolarHBondContact O-N 3.21Å
379	F	61.7	Low	59.2	Low	142 Å²	142	110.7 Å²	110.7	62%	0.623	49%	0.49	S	S	*	.	H	α-helix	trans	-73	-36.6	172.9	-171.4	-87.8	0	0	0	112.2	S375 K376 Q377 R382 S383	S375-F379 WeakPolarHBondContact O-CB 3.46Å; S375-F379 PolarHBondContact O-N 2.6Å; K376-F379 CarbonylContact O-C 3.47Å; K376-F379 PolarHBondContact O-N 3.41Å; Q377-F379 VanDerWaalsContact C-N 3.26Å; Q377-F379 PolarHBondContact O-N 2.83Å; F379-R382 PolarHBondContact O-N 3.32Å; F379-S383 WeakPolarHBondContact O-CB 3.44Å; F379-S383 PolarHBondContact O-N 2.81Å
380	R	65	Low	58.6	Low	157 Å²	157	112.5 Å²	112.5	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-62.1	-57.1	169.9	-81.1	-178.9	178.3	170	-1.8	109.9	K376 Q377 R382 S383 E384	K376-R380 WeakPolarHBondContact O-CB 3.05Å; K376-R380 WeakPolarHBondContact O-CG 3.45Å; K376-R380 PolarHBondContact O-N 2.89Å; Q377-R380 CarbonylContact O-C 3.52Å; Q377-R380 WeakPolarHBondContact O-CA 3.21Å; Q377-R380 WeakPolarHBondContact O-CB 3.42Å; Q377-R380 PolarHBondContact O-N 3.01Å; Q377-R380 VanDerWaalsContact O-N 3.1Å; R380-R382 VanDerWaalsContact C-N 3.25Å; R380-R382 PolarHBondContact O-N 3.19Å; R380-S383 CarbonylContact O-C 3.47Å; R380-S383 WeakPolarHBondContact O-CA 3.43Å; R380-S383 WeakPolarHBondContact O-CB 3.35Å; R380-S383 PolarHBondContact O-N 3.39Å; R380-E384 VanDerWaalsContact O-CB 3.27Å; R380-E384 WeakPolarHBondContact O-CB 3.42Å; R380-E384 VanDerWaalsContact O-CG 3.31Å; R380-E384 WeakPolarHBondContact O-CG 3.18Å; R380-E384 PolarHBondContact O-N 3.27Å
381	E	59.6	Low	58.6	Low	88 Å²	88	115.5 Å²	115.5	41%	0.411	51%	0.513	S	S	.	.	H	α-helix	trans	-51.7	-41.8	174.4	-69.8	179.3	116.7	0	0	112.4	Q377 R378 R385	Q377-E381 WeakPolarHBondContact O-CB 3.28Å; Q377-E381 WeakPolarHBondContact O-CG 3.36Å; Q377-E381 PolarHBondContact O-N 3.19Å; R378-E381 WeakPolarHBondContact CA-OE2 3.4Å; E381-R385 WeakPolarHBondContact O-CB 3.12Å; E381-R385 WeakPolarHBondContact O-CG 3.21Å; E381-R385 PolarHBondContact O-N 3.12Å
382	R	59.6	Low	58.3	Low	201 Å²	201	110.8 Å²	110.8	76%	0.758	50%	0.498	S	S	*	.	H	α-helix	trans	-74.1	-31.2	178.9	-161.9	172.9	-169.5	-170.1	0.7	112.4	R378 F379 R380 R386	R378-R382 WeakPolarHBondContact O-CB 3.43Å; R378-R382 PolarHBondContact O-N 3.21Å; F379-R382 PolarHBondContact O-N 3.32Å; R380-R382 VanDerWaalsContact C-N 3.25Å; R380-R382 PolarHBondContact O-N 3.19Å; R382-R386 WeakPolarHBondContact O-CB 3.32Å; R382-R386 PolarHBondContact O-N 3.42Å
383	S	57.5	Low	57.6	Low	44 Å²	44	108 Å²	108	31%	0.308	50%	0.5	S	S	.	.	H	α-helix	trans	-75.6	-37.3	173.2	-171.4	0	0	0	0	112.2	F379 R380 R386 K387	F379-S383 WeakPolarHBondContact O-CB 3.44Å; F379-S383 PolarHBondContact O-N 2.81Å; R380-S383 CarbonylContact O-C 3.47Å; R380-S383 WeakPolarHBondContact O-CA 3.43Å; R380-S383 WeakPolarHBondContact O-CB 3.35Å; R380-S383 PolarHBondContact O-N 3.39Å; S383-R386 PolarHBondContact O-N 3.09Å; S383-K387 WeakPolarHBondContact O-CB 3.23Å; S383-K387 WeakPolarHBondContact O-CG 3.29Å; S383-K387 PolarHBondContact O-N 3.3Å
384	E	60.7	Low	57.1	Low	109 Å²	109	110.3 Å²	110.3	51%	0.509	51%	0.514	S	S	.	.	H	α-helix	trans	-72.4	-41.3	176	-73.7	155.4	-170.2	0	0	110.4	R380 R386 K387 F388	R380-E384 VanDerWaalsContact O-CB 3.27Å; R380-E384 WeakPolarHBondContact O-CB 3.42Å; R380-E384 VanDerWaalsContact O-CG 3.31Å; R380-E384 WeakPolarHBondContact O-CG 3.18Å; R380-E384 PolarHBondContact O-N 3.27Å; E384-R386 VanDerWaalsContact C-N 3.33Å; E384-R386 PolarHBondContact O-N 2.95Å; E384-K387 PolarHBondContact O-N 2.86Å; E384-F388 WeakPolarHBondContact O-CB 3.1Å; E384-F388 PolarHBondContact O-N 3.39Å
385	R	60.4	Low	57	Low	183 Å²	183	112 Å²	112	69%	0.691	52%	0.522	S	S	*	.	H	α-helix	trans	-63	-36.5	167	-73	174.1	-169.6	-149	5.3	111.9	E381 A389	E381-R385 WeakPolarHBondContact O-CB 3.12Å; E381-R385 WeakPolarHBondContact O-CG 3.21Å; E381-R385 PolarHBondContact O-N 3.12Å; R385-A389 WeakPolarHBondContact O-CB 3.17Å; R385-A389 PolarHBondContact O-N 3.07Å
386	R	54	Low	56.5	Low	123 Å²	123	113.3 Å²	113.3	46%	0.464	52%	0.523	S	S	.	.	H	α-helix	trans	-67.3	-42.8	174.4	-164.4	173.7	86.2	-178.2	5	111.6	R382 S383 E384 Q390	R382-R386 WeakPolarHBondContact O-CB 3.32Å; R382-R386 PolarHBondContact O-N 3.42Å; S383-R386 PolarHBondContact O-N 3.09Å; E384-R386 VanDerWaalsContact C-N 3.33Å; E384-R386 PolarHBondContact O-N 2.95Å; R386-Q390 WeakPolarHBondContact O-CB 3.47Å; R386-Q390 VanDerWaalsContact O-CG 3.31Å; R386-Q390 WeakPolarHBondContact O-CG 3.42Å; R386-Q390 PolarHBondContact O-N 2.67Å
387	K	58.4	Low	55.8	Low	126 Å²	126	110.7 Å²	110.7	55%	0.548	52%	0.519	S	S	.	.	H	α-helix	trans	-61.8	-50.9	172.3	-79.3	-176.6	174.4	-171.9	0	111.6	S383 E384 A389 Q390 E391	S383-K387 WeakPolarHBondContact O-CB 3.23Å; S383-K387 WeakPolarHBondContact O-CG 3.29Å; S383-K387 PolarHBondContact O-N 3.3Å; E384-K387 PolarHBondContact O-N 2.86Å; K387-A389 VanDerWaalsContact C-N 3.32Å; K387-A389 PolarHBondContact O-N 2.98Å; K387-Q390 CarbonylContact O-C 3.59Å; K387-Q390 WeakPolarHBondContact O-CA 3.33Å; K387-Q390 WeakPolarHBondContact O-CB 3.3Å; K387-Q390 PolarHBondContact O-N 2.91Å; K387-E391 WeakPolarHBondContact O-CB 3.34Å; K387-E391 WeakPolarHBondContact O-CG 3.42Å; K387-E391 PolarHBondContact O-N 2.79Å
388	F	55.3	Low	55.4	Low	142 Å²	142	108 Å²	108	62%	0.623	51%	0.508	S	S	*	.	H	α-helix	trans	-62.6	-37.2	-179.8	-173.3	-96.6	0	0	0	111.9	E384 S392	E384-F388 WeakPolarHBondContact O-CB 3.1Å; E384-F388 PolarHBondContact O-N 3.39Å; F388-S392 WeakPolarHBondContact O-CB 3.39Å; F388-S392 PolarHBondContact O-N 2.92Å
389	A	51.4	Low	55.2	Low	58 Å²	58	104.4 Å²	104.4	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-65.9	-41.7	171.3	0	0	0	0	0	112.1	R385 K387 A393	R385-A389 WeakPolarHBondContact O-CB 3.17Å; R385-A389 PolarHBondContact O-N 3.07Å; K387-A389 VanDerWaalsContact C-N 3.32Å; K387-A389 PolarHBondContact O-N 2.98Å; A389-A393 VanDerWaalsContact O-CB 3.23Å; A389-A393 WeakPolarHBondContact O-CB 3.26Å; A389-A393 PolarHBondContact O-N 3.14Å
390	Q	49.2	Very low	55	Low	121 Å²	121	102 Å²	102	57%	0.565	50%	0.495	S	S	*	.	H	α-helix	trans	-66.6	-45.2	175	-75.1	178.1	-45	0	0	112.1	R386 K387 A393 L394	R386-Q390 WeakPolarHBondContact O-CB 3.47Å; R386-Q390 VanDerWaalsContact O-CG 3.31Å; R386-Q390 WeakPolarHBondContact O-CG 3.42Å; R386-Q390 PolarHBondContact O-N 2.67Å; K387-Q390 CarbonylContact O-C 3.59Å; K387-Q390 WeakPolarHBondContact O-CA 3.33Å; K387-Q390 WeakPolarHBondContact O-CB 3.3Å; K387-Q390 PolarHBondContact O-N 2.91Å; Q390-A393 PolarHBondContact O-N 3.34Å; Q390-L394 VanDerWaalsContact O-CB 3.23Å; Q390-L394 WeakPolarHBondContact O-CB 3.47Å; Q390-L394 PolarHBondContact O-N 2.91Å
391	E	52.4	Low	54.5	Low	115 Å²	115	98.5 Å²	98.5	54%	0.537	48%	0.482	S	S	.	.	H	α-helix	trans	-63.6	-44	175.9	-73.6	175.8	147.8	0	0	111.1	K387 L394 Q395	K387-E391 WeakPolarHBondContact O-CB 3.34Å; K387-E391 WeakPolarHBondContact O-CG 3.42Å; K387-E391 PolarHBondContact O-N 2.79Å; E391-L394 CarbonylContact O-C 3.52Å; E391-L394 PolarHBondContact O-N 2.74Å; E391-Q395 VanDerWaalsContact O-CB 3.3Å; E391-Q395 WeakPolarHBondContact O-CB 3.42Å; E391-Q395 VanDerWaalsContact O-CG 3.24Å; E391-Q395 WeakPolarHBondContact O-CG 3.31Å; E391-Q395 PolarHBondContact O-N 2.69Å; E391-Q395 PolarHBondContact O-OE1 3.34Å
392	S	51.9	Low	54.3	Low	43 Å²	43	99.4 Å²	99.4	30%	0.301	48%	0.482	S	S	.	.	H	α-helix	trans	-65.2	-42.1	176.1	-171.8	0	0	0	0	111.9	F388 L394 Q395 N396	F388-S392 WeakPolarHBondContact O-CB 3.39Å; F388-S392 PolarHBondContact O-N 2.92Å; S392-L394 VanDerWaalsContact C-N 3.35Å; S392-L394 PolarHBondContact O-N 3.43Å; S392-Q395 PolarHBondContact O-N 2.81Å; S392-N396 WeakPolarHBondContact O-CB 3.17Å; S392-N396 PolarHBondContact O-N 2.93Å; S392-N396 PolarHBondContact O-ND2 2.88Å
393	A	49.8	Very low	54.3	Low	60 Å²	60	95.7 Å²	95.7	50%	0.496	47%	0.471	S	S	.	.	H	α-helix	trans	-61.7	-42.4	172.9	0	0	0	0	0	111.8	A389 Q390 N396 A397	A389-A393 VanDerWaalsContact O-CB 3.23Å; A389-A393 WeakPolarHBondContact O-CB 3.26Å; A389-A393 PolarHBondContact O-N 3.14Å; Q390-A393 PolarHBondContact O-N 3.34Å; A393-N396 PolarHBondContact O-N 3.42Å; A393-A397 WeakPolarHBondContact O-CB 3.43Å; A393-A397 PolarHBondContact O-N 3.34Å
394	L	51.9	Low	54.3	Low	119 Å²	119	96.7 Å²	96.7	62%	0.623	47%	0.473	S	S	*	.	H	α-helix	trans	-71.7	-34	179.6	-153.9	136.8	0	0	0	111.9	Q390 E391 S392 A397 V398	Q390-L394 VanDerWaalsContact O-CB 3.23Å; Q390-L394 WeakPolarHBondContact O-CB 3.47Å; Q390-L394 PolarHBondContact O-N 2.91Å; E391-L394 CarbonylContact O-C 3.52Å; E391-L394 PolarHBondContact O-N 2.74Å; S392-L394 VanDerWaalsContact C-N 3.35Å; S392-L394 PolarHBondContact O-N 3.43Å; L394-A397 PolarHBondContact O-N 2.88Å; L394-V398 HydrophobicContact CD2-CG2 4.36Å; L394-V398 WeakPolarHBondContact O-CB 3.3Å; L394-V398 VanDerWaalsContact O-CG2 3.26Å; L394-V398 WeakPolarHBondContact O-CG2 3.41Å; L394-V398 PolarHBondContact O-N 3.46Å
395	Q	51	Low	54	Low	85 Å²	85	92 Å²	92	40%	0.397	45%	0.452	S	S	.	.	H	α-helix	trans	-68.2	-43.6	170.7	-76.4	174.8	-57.7	0	0	111.7	E391 S392 A397 V398 V399	E391-Q395 VanDerWaalsContact O-CB 3.3Å; E391-Q395 WeakPolarHBondContact O-CB 3.42Å; E391-Q395 VanDerWaalsContact O-CG 3.24Å; E391-Q395 WeakPolarHBondContact O-CG 3.31Å; E391-Q395 PolarHBondContact O-N 2.69Å; E391-Q395 PolarHBondContact O-OE1 3.34Å; S392-Q395 PolarHBondContact O-N 2.81Å; Q395-A397 VanDerWaalsContact C-N 3.29Å; Q395-A397 PolarHBondContact O-N 3.19Å; Q395-V398 PolarHBondContact O-N 2.88Å; Q395-V399 WeakPolarHBondContact O-CB 3.45Å; Q395-V399 VanDerWaalsContact O-CG2 3.29Å; Q395-V399 WeakPolarHBondContact O-CG2 3.25Å; Q395-V399 PolarHBondContact O-N 3.07Å
396	N	51.5	Low	53.9	Low	105 Å²	105	87 Å²	87	56%	0.561	44%	0.439	S	S	*	.	H	α-helix	trans	-60.8	-40.5	174	-74.1	-35.4	0	0	0	111.1	S392 A393 F400	S392-N396 WeakPolarHBondContact O-CB 3.17Å; S392-N396 PolarHBondContact O-N 2.93Å; S392-N396 PolarHBondContact O-ND2 2.88Å; A393-N396 PolarHBondContact O-N 3.42Å; N396-F400 VanDerWaalsContact O-CB 3.25Å; N396-F400 WeakPolarHBondContact O-CB 3.2Å; N396-F400 PolarHBondContact O-N 3.22Å
397	A	49.2	Very low	54.2	Low	38 Å²	38	84.1 Å²	84.1	31%	0.314	43%	0.433	S	S	.	.	H	α-helix	trans	-63.4	-47.9	171.9	0	0	0	0	0	112.2	A393 L394 Q395 V399 F400 Y401	A393-A397 WeakPolarHBondContact O-CB 3.43Å; A393-A397 PolarHBondContact O-N 3.34Å; L394-A397 PolarHBondContact O-N 2.88Å; Q395-A397 VanDerWaalsContact C-N 3.29Å; Q395-A397 PolarHBondContact O-N 3.19Å; A397-V399 VanDerWaalsContact C-N 3.34Å; A397-V399 PolarHBondContact O-N 3.34Å; A397-F400 WeakPolarHBondContact O-CB 3.47Å; A397-F400 PolarHBondContact O-N 2.94Å; A397-Y401 HydrophobicContact CB-CD2 4.36Å; A397-Y401 HydrophobicContact CB-CE2 4.4Å; A397-Y401 WeakPolarHBondContact O-CB 3.39Å; A397-Y401 WeakPolarHBondContact O-CD2 3.16Å; A397-Y401 PolarHBondContact O-N 2.9Å
398	V	53.8	Low	54.3	Low	39 Å²	39	80.5 Å²	80.5	24%	0.236	42%	0.419	C	S	.	.	H	α-helix	trans	-63.2	-38.3	178.3	167.8	0	0	0	0	112.1	L394 Q395 R402 L422	L394-V398 HydrophobicContact CD2-CG2 4.36Å; L394-V398 WeakPolarHBondContact O-CB 3.3Å; L394-V398 VanDerWaalsContact O-CG2 3.26Å; L394-V398 WeakPolarHBondContact O-CG2 3.41Å; L394-V398 PolarHBondContact O-N 3.46Å; Q395-V398 PolarHBondContact O-N 2.88Å; V398-R402 VanDerWaalsContact O-CB 3.28Å; V398-R402 WeakPolarHBondContact O-CB 3.32Å; V398-R402 PolarHBondContact O-N 2.76Å; V398-L422 HydrophobicContact CG2-CD2 4.33Å
399	V	55.1	Low	54.6	Low	95 Å²	95	78.2 Å²	78.2	58%	0.576	41%	0.413	S	S	*	.	H	α-helix	trans	-66.5	-44.8	173.9	169	0	0	0	0	110.8	Q395 A397 K403	Q395-V399 WeakPolarHBondContact O-CB 3.45Å; Q395-V399 VanDerWaalsContact O-CG2 3.29Å; Q395-V399 WeakPolarHBondContact O-CG2 3.25Å; Q395-V399 PolarHBondContact O-N 3.07Å; A397-V399 VanDerWaalsContact C-N 3.34Å; A397-V399 PolarHBondContact O-N 3.34Å; V399-K403 WeakPolarHBondContact O-CB 3.41Å; V399-K403 PolarHBondContact O-N 3.1Å
400	F	57.5	Low	55.2	Low	90 Å²	90	82.8 Å²	82.8	40%	0.395	42%	0.421	S	S	.	.	H	α-helix	trans	-58.6	-51	174.4	172.7	-96.1	0	0	0	111.5	N396 A397 K403 L404 L451	N396-F400 VanDerWaalsContact O-CB 3.25Å; N396-F400 WeakPolarHBondContact O-CB 3.2Å; N396-F400 PolarHBondContact O-N 3.22Å; A397-F400 WeakPolarHBondContact O-CB 3.47Å; A397-F400 PolarHBondContact O-N 2.94Å; F400-K403 PolarHBondContact O-N 2.97Å; F400-L404 HydrophobicContact CE1-CD1 4.08Å; F400-L404 HydrophobicContact CZ-CD1 3.92Å; F400-L404 VanDerWaalsContact O-CB 3.31Å; F400-L404 WeakPolarHBondContact O-CB 3.43Å; F400-L404 PolarHBondContact O-N 3.19Å; F400-L451 HydrophobicContact CE2-CD1 4.18Å; F400-L451 HydrophobicContact CE2-CD2 4.49Å; F400-L451 HydrophobicContact CZ-CD1 3.95Å
401	Y	53.5	Low	55.7	Low	84 Å²	84	83.8 Å²	83.8	33%	0.329	43%	0.431	S	S	.	.	H	α-helix	trans	-64.7	-42.1	180	-79.3	-58.4	0	0	0	112.4	A397 L404 A405 F419	A397-Y401 HydrophobicContact CB-CD2 4.36Å; A397-Y401 HydrophobicContact CB-CE2 4.4Å; A397-Y401 WeakPolarHBondContact O-CB 3.39Å; A397-Y401 WeakPolarHBondContact O-CD2 3.16Å; A397-Y401 PolarHBondContact O-N 2.9Å; Y401-L404 PolarHBondContact O-N 2.76Å; Y401-A405 PolarHBondContact O-N 3.03Å; Y401-F419 WeakPolarHBondContact O-CE1 3.41Å
402	R	57	Low	55.9	Low	108 Å²	108	81.8 Å²	81.8	41%	0.408	44%	0.441	S	S	.	.	H	α-helix	trans	-64.8	-41.8	175.1	-175.7	174.4	-75.5	168.3	-1	111.7	V398 L404 A405 D406	V398-R402 VanDerWaalsContact O-CB 3.28Å; V398-R402 WeakPolarHBondContact O-CB 3.32Å; V398-R402 PolarHBondContact O-N 2.76Å; R402-L404 VanDerWaalsContact C-N 3.33Å; R402-L404 PolarHBondContact O-N 3.46Å; R402-A405 WeakPolarHBondContact O-CB 3.12Å; R402-A405 PolarHBondContact O-N 2.87Å; R402-D406 PolarHBondContact O-N 3.18Å
403	K	58.9	Low	55.9	Low	123 Å²	123	81.4 Å²	81.4	54%	0.535	44%	0.444	S	S	.	.	H	α-helix	trans	-62.9	-38.9	175.3	-170.6	176.3	-175.5	179	0	112.1	V399 F400 D406 D407	V399-K403 WeakPolarHBondContact O-CB 3.41Å; V399-K403 PolarHBondContact O-N 3.1Å; F400-K403 PolarHBondContact O-N 2.97Å; K403-D406 PolarHBondContact O-N 2.65Å; K403-D407 PolarHBondContact O-N 3.33Å
404	L	56.6	Low	56.1	Low	65 Å²	65	87.3 Å²	87.3	34%	0.34	46%	0.461	S	S	.	.	H	α-helix	trans	-68.9	-33.5	175	-168.2	143.2	0	0	0	111.9	F400 Y401 R402 I408	F400-L404 HydrophobicContact CE1-CD1 4.08Å; F400-L404 HydrophobicContact CZ-CD1 3.92Å; F400-L404 VanDerWaalsContact O-CB 3.31Å; F400-L404 WeakPolarHBondContact O-CB 3.43Å; F400-L404 PolarHBondContact O-N 3.19Å; Y401-L404 PolarHBondContact O-N 2.76Å; R402-L404 VanDerWaalsContact C-N 3.33Å; R402-L404 PolarHBondContact O-N 3.46Å; L404-I408 HydrophobicContact CD2-CD1 3.73Å; L404-I408 HydrophobicContact CD2-CG1 4.48Å; L404-I408 VanDerWaalsContact O-CG1 3.27Å; L404-I408 WeakPolarHBondContact O-CG1 3.45Å; L404-I408 PolarHBondContact O-N 3.34Å
405	A	54.6	Low	56.2	Low	9 Å²	9	84.3 Å²	84.3	7%	0.074	45%	0.449	C	S	.	.	H	α-helix	trans	-67.2	-43.7	169.3	0	0	0	0	0	112.4	Y401 R402 D407 I408 I409 F419	Y401-A405 PolarHBondContact O-N 3.03Å; R402-A405 WeakPolarHBondContact O-CB 3.12Å; R402-A405 PolarHBondContact O-N 2.87Å; A405-D407 VanDerWaalsContact C-N 3.3Å; A405-D407 PolarHBondContact O-N 2.86Å; A405-I408 WeakPolarHBondContact O-CB 3.39Å; A405-I408 PolarHBondContact O-N 2.8Å; A405-I409 VanDerWaalsContact O-CG1 3.27Å; A405-I409 WeakPolarHBondContact O-CG1 3.19Å; A405-I409 PolarHBondContact O-N 3.3Å; A405-F419 HydrophobicContact CB-CD1 3.9Å; A405-F419 HydrophobicContact CB-CD2 4.29Å; A405-F419 HydrophobicContact CB-CE1 3.76Å; A405-F419 HydrophobicContact CB-CE2 4.18Å; A405-F419 HydrophobicContact CB-CG 4.17Å; A405-F419 HydrophobicContact CB-CZ 3.92Å
406	D	58.4	Low	56.4	Low	78 Å²	78	82.7 Å²	82.7	42%	0.417	45%	0.446	S	S	.	.	H	α-helix	trans	-61.7	-37.7	175.6	-72.3	-32.4	0	0	0	111.7	R402 K403 I409 K410	R402-D406 PolarHBondContact O-N 3.18Å; K403-D406 PolarHBondContact O-N 2.65Å; D406-I409 PolarHBondContact O-N 2.87Å; D406-K410 VanDerWaalsContact O-CG 3.3Å; D406-K410 WeakPolarHBondContact O-CG 3.34Å; D406-K410 PolarHBondContact O-N 2.78Å
407	D	61.3	Low	56.6	Low	64 Å²	64	82.2 Å²	82.2	34%	0.342	46%	0.457	S	S	.	.	H	α-helix	trans	-75.6	-31	175.8	-70.9	-20.3	0	0	0	112.5	K403 A405 K410 N411	K403-D407 PolarHBondContact O-N 3.33Å; A405-D407 VanDerWaalsContact C-N 3.3Å; A405-D407 PolarHBondContact O-N 2.86Å; D407-K410 IonicContact OD1-NZ 2.75Å; D407-K410 PolarHBondContact OD1-NZ 3.43Å; D407-N411 WeakPolarHBondContact O-CB 3.31Å; D407-N411 PolarHBondContact O-N 3.46Å; D407-N411 VanDerWaalsContact O-N 3.08Å; D407-N411 PolarHBondContact O-ND2 3.24Å
408	I	60.2	Low	56.9	Low	50 Å²	50	85.7 Å²	85.7	26%	0.256	46%	0.462	S	S	.	.	H	α-helix	trans	-60.4	-46.4	166.5	-75.8	167.5	0	0	0	110.3	L404 A405 N411 G412 G413	L404-I408 HydrophobicContact CD2-CD1 3.73Å; L404-I408 HydrophobicContact CD2-CG1 4.48Å; L404-I408 VanDerWaalsContact O-CG1 3.27Å; L404-I408 WeakPolarHBondContact O-CG1 3.45Å; L404-I408 PolarHBondContact O-N 3.34Å; A405-I408 WeakPolarHBondContact O-CB 3.39Å; A405-I408 PolarHBondContact O-N 2.8Å; I408-N411 CarbonylContact O-C 3.56Å; I408-N411 PolarHBondContact O-N 2.66Å; I408-G412 PolarHBondContact O-N 3.21Å; I408-G413 WeakPolarHBondContact O-CA 3.21Å; I408-G413 PolarHBondContact O-N 3.26Å
409	I	60.6	Low	56.9	Low	94 Å²	94	85.3 Å²	85.3	48%	0.482	46%	0.458	S	S	.	.	H	α-helix	trans	-63.7	-45.1	179.5	-69.4	163.7	0	0	0	111.1	A405 D406 N411 G412 P415	A405-I409 VanDerWaalsContact O-CG1 3.27Å; A405-I409 WeakPolarHBondContact O-CG1 3.19Å; A405-I409 PolarHBondContact O-N 3.3Å; D406-I409 PolarHBondContact O-N 2.87Å; I409-N411 VanDerWaalsContact C-N 3.28Å; I409-N411 PolarHBondContact O-N 3.19Å; I409-G412 PolarHBondContact O-N 3.45Å; I409-G412 VanDerWaalsContact O-N 3.11Å; I409-P415 HydrophobicContact CD1-CG 4.3Å; I409-P415 HydrophobicContact CG1-CG 4.2Å
410	K	64.2	Low	56.7	Low	153 Å²	153	85.3 Å²	85.3	67%	0.665	47%	0.467	S	S	*	.	H	α-helix	trans	-61.5	-33.9	175.7	-74.5	172.4	-155.5	151.9	0	113.3	D406 D407 G412	D406-K410 VanDerWaalsContact O-CG 3.3Å; D406-K410 WeakPolarHBondContact O-CG 3.34Å; D406-K410 PolarHBondContact O-N 2.78Å; D407-K410 IonicContact OD1-NZ 2.75Å; D407-K410 PolarHBondContact OD1-NZ 3.43Å; K410-G412 PolarHBondContact O-N 3.08Å
411	N	59.3	Low	56.3	Low	143 Å²	143	86.5 Å²	86.5	77%	0.765	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	9.6	177.8	-71.1	-63.2	0	0	0	113.4	D407 I408 I409 G413	D407-N411 WeakPolarHBondContact O-CB 3.31Å; D407-N411 PolarHBondContact O-N 3.46Å; D407-N411 VanDerWaalsContact O-N 3.08Å; D407-N411 PolarHBondContact O-ND2 3.24Å; I408-N411 CarbonylContact O-C 3.56Å; I408-N411 PolarHBondContact O-N 2.66Å; I409-N411 VanDerWaalsContact C-N 3.28Å; I409-N411 PolarHBondContact O-N 3.19Å; N411-G413 VanDerWaalsContact C-N 3.29Å; N411-G413 PolarHBondContact O-N 3.25Å
412	G	57.2	Low	56	Low	72 Å²	72	85.3 Å²	85.3	74%	0.742	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	12.6	176.7	0	0	0	0	0	114.8	I408 I409 K410	I408-G412 PolarHBondContact O-N 3.21Å; I409-G412 PolarHBondContact O-N 3.45Å; I409-G412 VanDerWaalsContact O-N 3.11Å; K410-G412 PolarHBondContact O-N 3.08Å
413	G	53.1	Low	55.4	Low	36 Å²	36	85.1 Å²	85.1	37%	0.371	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-82.2	149.7	173.6	0	0	0	0	0	112.2	I408 N411	I408-G413 WeakPolarHBondContact O-CA 3.21Å; I408-G413 PolarHBondContact O-N 3.26Å; N411-G413 VanDerWaalsContact C-N 3.29Å; N411-G413 PolarHBondContact O-N 3.25Å
414	Q	53.7	Low	54.7	Low	183 Å²	183	83.9 Å²	83.9	86%	0.855	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-84.6	123.7	174.7	-166.1	172.2	11.8	0	0	109.5
415	P	53.3	Low	54	Low	56 Å²	56	84.9 Å²	84.9	36%	0.364	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-67.4	134.5	-176.4	25.6	-33.8	0	0	0	111.7	I409 F419	I409-P415 HydrophobicContact CD1-CG 4.3Å; I409-P415 HydrophobicContact CG1-CG 4.2Å; P415-F419 HydrophobicContact CB-CD2 4.37Å
416	P	54.7	Low	53.3	Low	52 Å²	52	92.8 Å²	92.8	34%	0.338	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-50.5	140	174.2	-31.5	34.7	0	0	0	114.6	Y418 F419	P416-Y418 HydrophobicContact CB-CD1 3.68Å; P416-Y418 HydrophobicContact CB-CE1 3.44Å; P416-Y418 VanDerWaalsContact CB-CE1 3.44Å; P416-Y418 HydrophobicContact CG-CE1 4.16Å; P416-Y418 PolarHBondContact O-N 2.74Å; P416-F419 HydrophobicContact CB-CD2 3.99Å; P416-F419 HydrophobicContact CB-CE2 4.12Å; P416-F419 HydrophobicContact CG-CD2 4.26Å; P416-F419 HydrophobicContact CG-CE2 4Å; P416-F419 WeakPolarHBondContact O-CB 3.3Å; P416-F419 WeakPolarHBondContact O-CD2 3.25Å; P416-F419 PolarHBondContact O-N 3.43Å; P416-F419 VanDerWaalsContact O-N 3.1Å
417	A	56.6	Low	52.4	Low	95 Å²	95	98.4 Å²	98.4	79%	0.785	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-60.1	-22.5	-172	0	0	0	0	0	115.2	F419 A420	A417-F419 PolarHBondContact O-N 3.38Å; A417-A420 PolarHBondContact O-N 2.99Å
418	Y	55.2	Low	51.6	Low	110 Å²	110	100.5 Å²	100.5	43%	0.431	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-68.6	-20.2	178.5	70.2	-102	0	0	0	113.6	P416 A420 T421	P416-Y418 HydrophobicContact CB-CD1 3.68Å; P416-Y418 HydrophobicContact CB-CE1 3.44Å; P416-Y418 VanDerWaalsContact CB-CE1 3.44Å; P416-Y418 HydrophobicContact CG-CE1 4.16Å; P416-Y418 PolarHBondContact O-N 2.74Å; Y418-A420 PolarHBondContact O-N 3.19Å; Y418-A420 VanDerWaalsContact O-N 3.09Å; Y418-T421 PolarHBondContact O-N 3.14Å; Y418-T421 PolarHBondContact O-OG1 3.18Å
419	F	54.3	Low	50.8	Low	32 Å²	32	102.2 Å²	102.2	14%	0.14	59%	0.586	C	S	.	*	G	3₁₀ helix	trans	-60.6	-20	176.8	-79.6	-68.9	0	0	0	113.5	Y401 A405 P415 P416 A417 T421 L422	Y401-F419 WeakPolarHBondContact O-CE1 3.41Å; A405-F419 HydrophobicContact CB-CD1 3.9Å; A405-F419 HydrophobicContact CB-CD2 4.29Å; A405-F419 HydrophobicContact CB-CE1 3.76Å; A405-F419 HydrophobicContact CB-CE2 4.18Å; A405-F419 HydrophobicContact CB-CG 4.17Å; A405-F419 HydrophobicContact CB-CZ 3.92Å; P415-F419 HydrophobicContact CB-CD2 4.37Å; P416-F419 HydrophobicContact CB-CD2 3.99Å; P416-F419 HydrophobicContact CB-CE2 4.12Å; P416-F419 HydrophobicContact CG-CD2 4.26Å; P416-F419 HydrophobicContact CG-CE2 4Å; P416-F419 WeakPolarHBondContact O-CB 3.3Å; P416-F419 WeakPolarHBondContact O-CD2 3.25Å; P416-F419 PolarHBondContact O-N 3.43Å; P416-F419 VanDerWaalsContact O-N 3.1Å; A417-F419 PolarHBondContact O-N 3.38Å; F419-T421 PolarHBondContact O-N 3.24Å; F419-L422 HydrophobicContact CD1-CD1 4.15Å
420	A	51.8	Low	49.9	Very low	94 Å²	94	105.8 Å²	105.8	78%	0.777	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-75.7	-3.3	176	0	0	0	0	0	114.8	A417 Y418	A417-A420 PolarHBondContact O-N 2.99Å; Y418-A420 PolarHBondContact O-N 3.19Å; Y418-A420 VanDerWaalsContact O-N 3.09Å
421	T	49	Very low	48.9	Very low	115 Å²	115	106.3 Å²	106.3	71%	0.706	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-100.7	1.3	-177.4	63.3	0	0	0	0	114.5	Y418 F419	Y418-T421 PolarHBondContact O-N 3.14Å; Y418-T421 PolarHBondContact O-OG1 3.18Å; F419-T421 PolarHBondContact O-N 3.24Å
422	L	45.9	Very low	48	Very low	60 Å²	60	105.1 Å²	105.1	31%	0.314	60%	0.599	S	S	.	*	S	Bend	trans	-79.8	133.3	-178.3	-65.1	174.5	0	0	0	112	V398 F419	V398-L422 HydrophobicContact CG2-CD2 4.33Å; F419-L422 HydrophobicContact CD1-CD1 4.15Å
423	P	44.2	Very low	47.6	Very low	104 Å²	104	105.5 Å²	105.5	68%	0.675	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-60.8	155.5	-179.9	-25.7	35.1	0	0	0	115.6
424	S	44.5	Very low	47.3	Very low	97 Å²	97	107.7 Å²	107.7	68%	0.678	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-82.1	155.4	172.2	57.7	0	0	0	0	112.5
425	T	42.5	Very low	46.8	Very low	85 Å²	85	104.1 Å²	104.1	52%	0.521	58%	0.575	S	S	.	*			trans	-121.4	75.9	-167.6	50.6	0	0	0	0	111.7	F428	T425-F428 HydrophobicContact CG2-CE2 4.14Å
426	E	39.3	Very low	46.4	Very low	176 Å²	176	105.2 Å²	105.2	82%	0.822	58%	0.578	S	S	*	*			trans	-105	16.5	-172.8	-62.7	-172.6	152.2	0	0	114.7
427	K	40.7	Very low	46.1	Very low	195 Å²	195	109.9 Å²	109.9	85%	0.848	59%	0.589	S	S	*	*			trans	-143.3	81.4	180	-66.4	-172.7	179	-177.3	0	112.8
428	F	44	Very low	45.8	Very low	108 Å²	108	108.1 Å²	108.1	47%	0.474	57%	0.566	S	S	.	*			trans	-136	142.4	172	-75.5	-72.9	0	0	0	112.2	T425	T425-F428 HydrophobicContact CG2-CE2 4.14Å
429	P	41.9	Very low	45.2	Very low	86 Å²	86	110.4 Å²	110.4	56%	0.558	57%	0.574	S	S	*	*			trans	-67.4	155.6	-176.2	-21.5	34.3	0	0	0	115.1	E431 L432	P429-E431 PolarHBondContact O-N 3Å; P429-L432 PolarHBondContact O-N 2.98Å
430	E	42.2	Very low	44.9	Very low	170 Å²	170	115 Å²	115	79%	0.794	60%	0.599	S	S	*	*	H	α-helix	trans	-68.4	-30.2	-174.3	-65.2	-170.2	101.5	0	0	114.5	L432 N433 Q434	E430-L432 VanDerWaalsContact C-N 3.3Å; E430-L432 PolarHBondContact O-N 2.88Å; E430-N433 WeakPolarHBondContact O-CB 3.42Å; E430-N433 PolarHBondContact O-N 2.9Å; E430-N433 VanDerWaalsContact O-N 3.08Å; E430-Q434 PolarHBondContact O-N 3.39Å
431	E	43.7	Very low	44.6	Very low	164 Å²	164	114.7 Å²	114.7	77%	0.766	59%	0.591	S	S	*	*	H	α-helix	trans	-60	-39.7	178.8	-64.7	168.6	178.2	0	0	112	P429 N433 Q434 V435	P429-E431 PolarHBondContact O-N 3Å; E431-N433 VanDerWaalsContact C-N 3.3Å; E431-N433 PolarHBondContact O-N 3.4Å; E431-Q434 WeakPolarHBondContact O-CB 3.44Å; E431-Q434 PolarHBondContact O-N 3.37Å; E431-Q434 VanDerWaalsContact O-N 3.09Å; E431-V435 PolarHBondContact O-N 2.96Å
432	L	41.1	Very low	44.3	Very low	117 Å²	117	112.2 Å²	112.2	61%	0.613	59%	0.588	S	S	*	*	H	α-helix	trans	-68.6	-31.7	177.7	-145.1	77.2	0	0	0	111.7	P429 E430 Q434 N436	P429-L432 PolarHBondContact O-N 2.98Å; E430-L432 VanDerWaalsContact C-N 3.3Å; E430-L432 PolarHBondContact O-N 2.88Å; L432-Q434 VanDerWaalsContact C-N 3.26Å; L432-Q434 PolarHBondContact O-N 2.87Å; L432-N436 WeakPolarHBondContact O-CB 3.38Å; L432-N436 PolarHBondContact O-N 3.47Å; L432-N436 VanDerWaalsContact O-N 3.11Å
433	N	47	Very low	44.3	Very low	80 Å²	80	116.1 Å²	116.1	43%	0.428	60%	0.602	S	S	.	*	H	α-helix	trans	-67.9	-25.5	172.7	-71.3	-47.6	0	0	0	112.2	E430 E431 R437	E430-N433 WeakPolarHBondContact O-CB 3.42Å; E430-N433 PolarHBondContact O-N 2.9Å; E430-N433 VanDerWaalsContact O-N 3.08Å; E431-N433 VanDerWaalsContact C-N 3.3Å; E431-N433 PolarHBondContact O-N 3.4Å; N433-R437 WeakPolarHBondContact O-CB 3.33Å; N433-R437 VanDerWaalsContact O-CG 3.32Å; N433-R437 WeakPolarHBondContact O-CG 3.38Å; N433-R437 PolarHBondContact O-N 3.01Å
434	Q	46.7	Very low	44.1	Very low	83 Å²	83	118.9 Å²	118.9	39%	0.388	61%	0.608	S	S	.	*	H	α-helix	trans	-72.2	-49.5	176.7	-170.4	56.7	31.3	0	0	111.9	E430 E431 L432 N436 R437 D438	E430-Q434 PolarHBondContact O-N 3.39Å; E431-Q434 WeakPolarHBondContact O-CB 3.44Å; E431-Q434 PolarHBondContact O-N 3.37Å; E431-Q434 VanDerWaalsContact O-N 3.09Å; L432-Q434 VanDerWaalsContact C-N 3.26Å; L432-Q434 PolarHBondContact O-N 2.87Å; Q434-N436 VanDerWaalsContact C-N 3.27Å; Q434-N436 PolarHBondContact O-N 3.03Å; Q434-R437 WeakPolarHBondContact O-CB 3.3Å; Q434-R437 PolarHBondContact O-N 3.38Å; Q434-R437 VanDerWaalsContact O-N 3.13Å; Q434-D438 PolarHBondContact NE2-OD2 3.47Å; Q434-D438 VanDerWaalsContact NE2-OD2 3.12Å; Q434-D438 PolarHBondContact O-N 3.26Å
435	V	43.5	Very low	43.9	Very low	108 Å²	108	120.2 Å²	120.2	66%	0.655	62%	0.617	S	S	*	*	H	α-helix	trans	-59.4	-41.2	175.1	-178.1	0	0	0	0	111	E431 D438 W439	E431-V435 PolarHBondContact O-N 2.96Å; V435-D438 PolarHBondContact O-N 3.11Å; V435-W439 PolarHBondContact O-N 3.22Å; V435-W439 VanDerWaalsContact O-N 3.16Å
436	N	44.8	Very low	43.7	Very low	79 Å²	79	121.3 Å²	121.3	42%	0.422	63%	0.628	S	S	.	*	H	α-helix	trans	-66.5	-39.2	176.8	-157.5	4.6	0	0	0	111.8	L432 Q434 W439 L440	L432-N436 WeakPolarHBondContact O-CB 3.38Å; L432-N436 PolarHBondContact O-N 3.47Å; L432-N436 VanDerWaalsContact O-N 3.11Å; Q434-N436 VanDerWaalsContact C-N 3.27Å; Q434-N436 PolarHBondContact O-N 3.03Å; N436-W439 PolarHBondContact O-N 2.87Å; N436-L440 VanDerWaalsContact O-CB 3.32Å; N436-L440 WeakPolarHBondContact O-CB 3.5Å; N436-L440 PolarHBondContact O-N 3.47Å
437	R	49.2	Very low	43.5	Very low	149 Å²	149	118.7 Å²	118.7	56%	0.562	63%	0.63	S	S	*	*	H	α-helix	trans	-60.1	-44.1	171.7	-85.6	-165.2	-66.8	-142.3	0.9	112.2	N433 Q434 W439 L440 C441	N433-R437 WeakPolarHBondContact O-CB 3.33Å; N433-R437 VanDerWaalsContact O-CG 3.32Å; N433-R437 WeakPolarHBondContact O-CG 3.38Å; N433-R437 PolarHBondContact O-N 3.01Å; Q434-R437 WeakPolarHBondContact O-CB 3.3Å; Q434-R437 PolarHBondContact O-N 3.38Å; Q434-R437 VanDerWaalsContact O-N 3.13Å; R437-W439 VanDerWaalsContact C-N 3.3Å; R437-W439 PolarHBondContact O-N 2.78Å; R437-L440 CarbonylContact O-C 3.59Å; R437-L440 PolarHBondContact O-N 2.81Å; R437-C441 WeakPolarHBondContact O-CB 3.25Å; R437-C441 PolarHBondContact O-N 3.39Å; R437-C441 PolarHBondContact O-SG 2.75Å
438	D	50.7	Low	43.1	Very low	58 Å²	58	114.8 Å²	114.8	31%	0.31	63%	0.627	S	S	.	*	H	α-helix	trans	-67	-30.5	-179.2	-86.2	-62.7	0	0	0	113.1	Q434 V435 K443	Q434-D438 PolarHBondContact NE2-OD2 3.47Å; Q434-D438 VanDerWaalsContact NE2-OD2 3.12Å; Q434-D438 PolarHBondContact O-N 3.26Å; V435-D438 PolarHBondContact O-N 3.11Å; D438-K443 IonicContact OD1-NZ 3.63Å; D438-K443 PolarHBondContact OD1-NZ 2.77Å
439	W	42.9	Very low	42.8	Very low	159 Å²	159	117.7 Å²	117.7	60%	0.602	65%	0.645	S	S	*	*	H	α-helix	trans	-73.6	-45.9	170	-166.4	71.4	0	0	0	112.3	V435 N436 R437 C441 G442	V435-W439 PolarHBondContact O-N 3.22Å; V435-W439 VanDerWaalsContact O-N 3.16Å; N436-W439 PolarHBondContact O-N 2.87Å; R437-W439 VanDerWaalsContact C-N 3.3Å; R437-W439 PolarHBondContact O-N 2.78Å; W439-C441 PolarHBondContact O-N 3.34Å; W439-G442 PolarHBondContact O-N 3.27Å; W439-G442 VanDerWaalsContact O-N 3.12Å
440	L	47.9	Very low	42.5	Very low	127 Å²	127	122.6 Å²	122.6	67%	0.665	66%	0.661	S	S	*	*	H	α-helix	trans	-62.3	-25	174.8	-87.3	155.2	0	0	0	113.7	N436 R437 G442	N436-L440 VanDerWaalsContact O-CB 3.32Å; N436-L440 WeakPolarHBondContact O-CB 3.5Å; N436-L440 PolarHBondContact O-N 3.47Å; R437-L440 CarbonylContact O-C 3.59Å; R437-L440 PolarHBondContact O-N 2.81Å; L440-G442 PolarHBondContact O-N 3.4Å; L440-G442 VanDerWaalsContact O-N 3.13Å
441	C	45.5	Very low	42.4	Very low	89 Å²	89	120.8 Å²	120.8	60%	0.601	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	11.1	173.1	-71.8	0	0	0	0	113.9	R437 W439 K443	R437-C441 WeakPolarHBondContact O-CB 3.25Å; R437-C441 PolarHBondContact O-N 3.39Å; R437-C441 PolarHBondContact O-SG 2.75Å; W439-C441 PolarHBondContact O-N 3.34Å; C441-K443 VanDerWaalsContact C-N 3.34Å; C441-K443 HydrophobicContact CB-CG 4.49Å; C441-K443 PolarHBondContact O-N 3.42Å
442	G	42.2	Very low	42.5	Very low	62 Å²	62	117.1 Å²	117.1	64%	0.639	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.6	20.9	169.2	0	0	0	0	0	114.8	W439 L440 M444	W439-G442 PolarHBondContact O-N 3.27Å; W439-G442 VanDerWaalsContact O-N 3.12Å; L440-G442 PolarHBondContact O-N 3.4Å; L440-G442 VanDerWaalsContact O-N 3.13Å; G442-M444 VanDerWaalsContact C-N 3.28Å; G442-M444 PolarHBondContact O-N 3.44Å
443	K	46.8	Very low	43.2	Very low	142 Å²	142	118.3 Å²	118.3	62%	0.617	65%	0.653	S	S	*	*			trans	-75.5	-8.5	-175	-65.5	-179	177.1	178	0	114.5	D438 C441	D438-K443 IonicContact OD1-NZ 3.63Å; D438-K443 PolarHBondContact OD1-NZ 2.77Å; C441-K443 VanDerWaalsContact C-N 3.34Å; C441-K443 HydrophobicContact CB-CG 4.49Å; C441-K443 PolarHBondContact O-N 3.42Å
444	M	39.6	Very low	43.8	Very low	163 Å²	163	118 Å²	118	80%	0.803	65%	0.654	S	S	*	*			trans	-147	157.8	175.7	-70.7	-167.4	170.8	0	0	112.2	G442	G442-M444 VanDerWaalsContact C-N 3.28Å; G442-M444 PolarHBondContact O-N 3.44Å
445	S	40.8	Very low	45.1	Very low	125 Å²	125	118.7 Å²	118.7	87%	0.874	65%	0.653	S	S	*	*			trans	-133.2	145.9	-172.4	60.5	0	0	0	0	113.8
446	S	36.5	Very low	46.5	Very low	108 Å²	108	115.5 Å²	115.5	76%	0.755	63%	0.632	S	S	*	*			trans	-140.3	129.8	-174.9	59.2	0	0	0	0	113
447	S	34.9	Very low	48.1	Very low	121 Å²	121	112.4 Å²	112.4	85%	0.846	62%	0.616	S	S	*	*			trans	-158.2	69.5	-177.2	63.3	0	0	0	0	116.4
448	S	33	Very low	49.6	Very low	112 Å²	112	105.3 Å²	105.3	78%	0.783	59%	0.59	S	S	*	*			trans	172	138.9	153.6	52.1	0	0	0	0	111.6
449	I	37.1	Very low	51	Low	169 Å²	169	105.2 Å²	105.2	87%	0.867	59%	0.585	S	S	*	*			trans	161.9	149.1	149.7	-88.5	157.9	0	0	0	109.3
450	Q	36.9	Very low	52.9	Low	190 Å²	190	99 Å²	99	89%	0.888	56%	0.563	S	S	*	*			trans	-114.1	157.7	176.1	-64.8	169.9	-79.9	0	0	110.3
451	L	38.8	Very low	53.7	Low	131 Å²	131	95.9 Å²	95.9	69%	0.686	55%	0.549	S	S	*	.			trans	-78.9	144.6	176.6	-75.7	161.9	0	0	0	111.7	F400	F400-L451 HydrophobicContact CE2-CD1 4.18Å; F400-L451 HydrophobicContact CE2-CD2 4.49Å; F400-L451 HydrophobicContact CZ-CD1 3.95Å
452	P	45.9	Very low	54.9	Low	87 Å²	87	96.9 Å²	96.9	57%	0.565	55%	0.553	S	S	*	*			trans	-92.5	153.3	-174.5	36	-36.3	0	0	0	114.7	V454	P452-V454 HydrophobicContact CB-CG2 3.98Å; P452-V454 HydrophobicContact CG-CG2 3.8Å; P452-V454 PolarHBondContact O-N 3.33Å
453	D	56.9	Low	56.5	Low	142 Å²	142	97.3 Å²	97.3	76%	0.759	54%	0.543	S	S	*	.			trans	-75.1	79.6	173.7	-66.9	-49.4	0	0	0	111.8	L474	D453-L474 HydrophobicContact CB-CD2 4.21Å
454	V	59.3	Low	57.5	Low	73 Å²	73	97.6 Å²	97.6	44%	0.442	54%	0.544	S	S	.	.			trans	-111.4	138.3	-178.4	179	0	0	0	0	110.9	P452 L474 A475	P452-V454 HydrophobicContact CB-CG2 3.98Å; P452-V454 HydrophobicContact CG-CG2 3.8Å; P452-V454 PolarHBondContact O-N 3.33Å; V454-L474 CarbonylContact O-C 3.45Å; V454-L474 WeakPolarHBondContact O-CA 3.22Å; V454-A475 PolarHBondContact O-N 2.82Å
455	R	73.3	Confident	59.2	Low	98 Å²	98	95.2 Å²	95.2	37%	0.37	53%	0.531	S	S	.	.	B	Isolated β-bridge	trans	-82.4	136.4	173	-67.9	-82.7	-179.6	-153.2	-8.1	110	G469 A472 P473 L474 E477	R455-G469 WeakPolarHBondContact CD-O 3.27Å; R455-A472 HydrophobicContact CB-CB 4.23Å; R455-A472 WeakPolarHBondContact CD-O 3.42Å; R455-A472 PolarHBondContact NE-O 2.86Å; R455-A472 PolarHBondContact NH1-O 3.43Å; R455-P473 WeakPolarHBondContact CA-O 3.43Å; R455-L474 HydrophobicContact CG-CD2 4.5Å; R455-E477 IonicContact NH1-OE2 3.72Å; R455-E477 PolarHBondContact NH1-OE2 2.92Å
456	I	73.8	Confident	60.9	Low	42 Å²	42	92.6 Å²	92.6	22%	0.215	51%	0.507	C	S	.	.			trans	-113.7	123.6	-178.6	-52.3	-167.7	0	0	0	111	M458 A472 P473 A475 V478 I490	I456-M458 HydrophobicContact CB-CE 3.82Å; I456-M458 HydrophobicContact CG2-CE 3.65Å; I456-M458 WeakPolarHBondContact O-CE 3.32Å; I456-A472 WeakPolarHBondContact O-CB 3.48Å; I456-P473 PolarHBondContact N-O 2.88Å; I456-A475 HydrophobicContact CD1-CB 3.91Å; I456-A475 HydrophobicContact CG1-CB 4.25Å; I456-V478 HydrophobicContact CB-CG2 3.9Å; I456-V478 HydrophobicContact CD1-CG2 3.78Å; I456-V478 HydrophobicContact CG1-CG2 3.95Å; I456-I490 HydrophobicContact CG2-CG2 3.71Å
457	P	77.4	Confident	62.8	Low	14 Å²	14	88.9 Å²	88.9	9%	0.091	48%	0.479	C	S	.	.			trans	-73.3	143.9	-175.1	30.6	-36	0	0	0	113.5	V467 E468 L491 T493 V499	P457-V467 VanDerWaalsContact CA-O 3.26Å; P457-V467 WeakPolarHBondContact CA-O 3.37Å; P457-E468 HydrophobicContact CB-CG 4.18Å; P457-L491 HydrophobicContact CB-CD1 4.16Å; P457-L491 HydrophobicContact CG-CB 4.27Å; P457-L491 PolarHBondContact O-N 2.95Å; P457-L491 VanDerWaalsContact O-N 3.13Å; P457-T493 HydrophobicContact CG-CG2 3.58Å; P457-V499 HydrophobicContact CB-CG2 4.11Å; P457-V499 HydrophobicContact CG-CG2 3.83Å
458	M	82.3	Confident	64.7	Low	0 Å²	0	88.1 Å²	88.1	0%	0	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140.6	-170.4	-58.7	-74.3	133.7	0	0	112.3	I456 I466 V467 P473 V478 W481 L482 W488 E489 I490 L491	I456-M458 HydrophobicContact CB-CE 3.82Å; I456-M458 HydrophobicContact CG2-CE 3.65Å; I456-M458 WeakPolarHBondContact O-CE 3.32Å; M458-I466 CarbonylContact O-C 3.54Å; M458-I466 WeakPolarHBondContact O-CA 3.48Å; M458-V467 HydrophobicContact CB-CB 4.35Å; M458-V467 PolarHBondContact N-O 2.96Å; M458-V467 PolarHBondContact O-N 3.48Å; M458-P473 HydrophobicContact CE-CG 3.89Å; M458-P473 HydrophobicContact CG-CG 4.11Å; M458-P473 HydrophobicContact SD-CG 4.33Å; M458-V478 HydrophobicContact CE-CG1 3.83Å; M458-V478 HydrophobicContact CE-CG2 4.07Å; M458-W481 HydrophobicContact CB-CH2 3.61Å; M458-W481 HydrophobicContact CB-CZ3 3.64Å; M458-W481 HydrophobicContact CG-CE3 3.86Å; M458-W481 HydrophobicContact CG-CH2 3.69Å; M458-W481 HydrophobicContact CG-CZ2 4.4Å; M458-W481 HydrophobicContact CG-CZ3 3.38Å; M458-W481 HydrophobicContact SD-CE3 3.85Å; M458-W481 HydrophobicContact SD-CZ3 3.66Å; M458-L482 HydrophobicContact SD-CD2 3.91Å; M458-L482 HydrophobicContact SD-CG 4.38Å; M458-W488 HydrophobicContact CB-CE3 3.83Å; M458-W488 HydrophobicContact CB-CZ3 4.37Å; M458-E489 CarbonylContact C-O 3.6Å; M458-E489 WeakPolarHBondContact CA-O 3.44Å; M458-I490 HydrophobicContact CE-CG1 3.92Å; M458-I490 HydrophobicContact SD-CG1 4.22Å; M458-L491 WeakPolarHBondContact O-CD1 3.07Å
459	Y	80.3	Confident	66.7	Low	55 Å²	55	85 Å²	85	22%	0.216	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.6	-177.7	174.7	-112.4	0	0	0	111.1	T461 I466 W488 E489	Y459-T461 HydrophobicContact CD1-CG2 4.27Å; Y459-T461 HydrophobicContact CE1-CG2 4.21Å; Y459-I466 HydrophobicContact CD2-CG1 4.22Å; Y459-W488 CarbonylContact O-C 3.51Å; Y459-W488 VanDerWaalsContact O-CA 3.25Å; Y459-W488 WeakPolarHBondContact O-CA 3.31Å; Y459-E489 PolarHBondContact N-O 3.28Å; Y459-E489 PolarHBondContact O-N 3.15Å
460	Q	81	Confident	68.6	Low	30 Å²	30	84.2 Å²	84.2	14%	0.14	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.5	175.3	-162.5	174.2	22.2	0	0	111.9	T462 T463 K464 E465 W488	Q460-T462 PolarHBondContact O-N 3.01Å; Q460-T462 VanDerWaalsContact O-N 3.11Å; Q460-T463 VanDerWaalsContact CB-OG1 3.29Å; Q460-T463 WeakPolarHBondContact CB-OG1 3.5Å; Q460-T463 VanDerWaalsContact CD-OG1 3.28Å; Q460-T463 HydrophobicContact CG-CG2 4.47Å; Q460-T463 WeakPolarHBondContact CG-OG1 3.44Å; Q460-T463 PolarHBondContact O-N 2.92Å; Q460-T463 VanDerWaalsContact OE1-CG2 3.24Å; Q460-T463 PolarHBondContact OE1-OG1 3.13Å; Q460-K464 WeakPolarHBondContact O-CA 3.5Å; Q460-K464 PolarHBondContact O-N 2.82Å; Q460-E465 HydrophobicContact CB-CB 4.38Å; Q460-E465 PolarHBondContact N-O 3.22Å; Q460-W488 HydrophobicContact CB-CD2 3.56Å; Q460-W488 HydrophobicContact CB-CE3 3.66Å; Q460-W488 HydrophobicContact CB-CG 4.18Å; Q460-W488 HydrophobicContact CB-CH2 3.85Å; Q460-W488 HydrophobicContact CB-CZ2 3.76Å; Q460-W488 HydrophobicContact CB-CZ3 3.81Å; Q460-W488 VanDerWaalsContact CD-CE2 3.44Å; Q460-W488 VanDerWaalsContact CD-NE1 3.33Å; Q460-W488 HydrophobicContact CG-CD2 3.89Å; Q460-W488 HydrophobicContact CG-CE3 4.49Å; Q460-W488 HydrophobicContact CG-CG 4.12Å; Q460-W488 HydrophobicContact CG-CZ2 4.06Å; Q460-W488 VanDerWaalsContact OE1-CZ2 3.31Å
461	T	64.8	Low	70.3	Confident	61 Å²	61	78.4 Å²	78.4	37%	0.374	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.2	-176.4	56.4	0	0	0	0	114.6	Y459 G487 E489	Y459-T461 HydrophobicContact CD1-CG2 4.27Å; Y459-T461 HydrophobicContact CE1-CG2 4.21Å; T461-G487 PolarHBondContact N-O 3.47Å; T461-G487 PolarHBondContact OG1-O 3.1Å; T461-E489 VanDerWaalsContact CG2-CD 3.42Å; T461-E489 HydrophobicContact CG2-CG 3.85Å; T461-E489 WeakPolarHBondContact CG2-OE2 3.18Å
462	T	71.4	Confident	72.1	Confident	110 Å²	110	72.3 Å²	72.3	68%	0.675	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-31.3	-174.6	51.7	0	0	0	0	114.9	Q460	Q460-T462 PolarHBondContact O-N 3.01Å; Q460-T462 VanDerWaalsContact O-N 3.11Å
463	T	75.1	Confident	73.6	Confident	71 Å²	71	68.3 Å²	68.3	44%	0.436	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-20.2	-177.5	60	0	0	0	0	112.7	Q460 E465	Q460-T463 VanDerWaalsContact CB-OG1 3.29Å; Q460-T463 WeakPolarHBondContact CB-OG1 3.5Å; Q460-T463 VanDerWaalsContact CD-OG1 3.28Å; Q460-T463 HydrophobicContact CG-CG2 4.47Å; Q460-T463 WeakPolarHBondContact CG-OG1 3.44Å; Q460-T463 PolarHBondContact O-N 2.92Å; Q460-T463 VanDerWaalsContact OE1-CG2 3.24Å; Q460-T463 PolarHBondContact OE1-OG1 3.13Å; T463-E465 WeakPolarHBondContact OG1-CB 3.45Å; T463-E465 WeakPolarHBondContact OG1-CG 3.44Å; T463-E465 PolarHBondContact OG1-N 3.31Å; T463-E465 VanDerWaalsContact OG1-N 3.13Å
464	K	68.7	Low	74.5	Confident	148 Å²	148	63 Å²	63	64%	0.643	34%	0.344	S	S	*	.			trans	64.6	19.9	-165.8	-49	-177	178.6	-173	0	114.3	Q460	Q460-K464 WeakPolarHBondContact O-CA 3.5Å; Q460-K464 PolarHBondContact O-N 2.82Å
465	E	74.7	Confident	74.8	Confident	113 Å²	113	62 Å²	62	53%	0.528	34%	0.344	S	S	.	.			trans	-68.8	145.8	170.9	-70.5	-179.4	167.6	0	0	111	Q460 T463 W488	Q460-E465 HydrophobicContact CB-CB 4.38Å; Q460-E465 PolarHBondContact N-O 3.22Å; T463-E465 WeakPolarHBondContact OG1-CB 3.45Å; T463-E465 WeakPolarHBondContact OG1-CG 3.44Å; T463-E465 PolarHBondContact OG1-N 3.31Å; T463-E465 VanDerWaalsContact OG1-N 3.13Å; E465-W488 HydrophobicContact CB-CH2 3.84Å; E465-W488 HydrophobicContact CB-CZ3 4.44Å
466	I	78.1	Confident	74.4	Confident	70 Å²	70	61.8 Å²	61.8	36%	0.359	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	130.5	178.3	-57.1	176.1	0	0	0	106.7	M458 Y459 E468 L491	M458-I466 CarbonylContact O-C 3.54Å; M458-I466 WeakPolarHBondContact O-CA 3.48Å; Y459-I466 HydrophobicContact CD2-CG1 4.22Å; I466-E468 HydrophobicContact CG2-CG 3.91Å; I466-L491 HydrophobicContact CG2-CD1 4.01Å; I466-L491 HydrophobicContact CG2-CD2 4.25Å
467	V	76.2	Confident	74.5	Confident	29 Å²	29	63.7 Å²	63.7	18%	0.176	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	121.4	-178.9	163.9	0	0	0	0	109.5	P457 M458 A471 A472 W488	P457-V467 VanDerWaalsContact CA-O 3.26Å; P457-V467 WeakPolarHBondContact CA-O 3.37Å; M458-V467 HydrophobicContact CB-CB 4.35Å; M458-V467 PolarHBondContact N-O 2.96Å; M458-V467 PolarHBondContact O-N 3.48Å; V467-A471 VanDerWaalsContact CG1-C 3.46Å; V467-A471 HydrophobicContact CG1-CB 3.91Å; V467-A471 VanDerWaalsContact CG1-O 3.29Å; V467-A471 WeakPolarHBondContact CG1-O 3.33Å; V467-A472 HydrophobicContact CG1-CB 4.31Å; V467-W488 HydrophobicContact CB-CH2 4.39Å; V467-W488 HydrophobicContact CB-CZ3 3.94Å; V467-W488 HydrophobicContact CG2-CH2 3.45Å; V467-W488 VanDerWaalsContact CG2-CH2 3.45Å; V467-W488 HydrophobicContact CG2-CZ3 3.5Å; V467-W488 VanDerWaalsContact CG2-CZ3 3.5Å
468	E	74.6	Confident	74.3	Confident	105 Å²	105	63.5 Å²	63.5	49%	0.491	36%	0.363	S	S	.	.			trans	-134.9	172.1	-175.5	-53.6	-172.5	162.7	0	0	111	P457 I466 A471	P457-E468 HydrophobicContact CB-CG 4.18Å; I466-E468 HydrophobicContact CG2-CG 3.91Å; E468-A471 PolarHBondContact O-N 3.16Å
469	G	74.6	Confident	73.6	Confident	47 Å²	47	66.3 Å²	66.3	49%	0.485	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	63.6	-139.7	174.3	0	0	0	0	0	113.5	R455 A471 A472	R455-G469 WeakPolarHBondContact CD-O 3.27Å; G469-A471 PolarHBondContact O-N 2.86Å; G469-A472 WeakPolarHBondContact O-CB 3.35Å; G469-A472 PolarHBondContact O-N 3.07Å
470	D	75.9	Confident	73.4	Confident	152 Å²	152	67.4 Å²	67.4	81%	0.813	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-65.4	-17.6	-177.9	-69.6	-41.4	0	0	0	114.3
471	A	73.4	Confident	73.5	Confident	69 Å²	69	67.7 Å²	67.7	57%	0.57	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-83.5	-16.9	177.5	0	0	0	0	0	113.2	V467 E468 G469	V467-A471 VanDerWaalsContact CG1-C 3.46Å; V467-A471 HydrophobicContact CG1-CB 3.91Å; V467-A471 VanDerWaalsContact CG1-O 3.29Å; V467-A471 WeakPolarHBondContact CG1-O 3.33Å; E468-A471 PolarHBondContact O-N 3.16Å; G469-A471 PolarHBondContact O-N 2.86Å
472	A	77.2	Confident	74.1	Confident	2 Å²	2	67.3 Å²	67.3	2%	0.017	39%	0.39	C	S	.	.	S	Bend	trans	-76.2	148.2	175.7	0	0	0	0	0	111.7	R455 I456 V467 G469	R455-A472 HydrophobicContact CB-CB 4.23Å; R455-A472 WeakPolarHBondContact CD-O 3.42Å; R455-A472 PolarHBondContact NE-O 2.86Å; R455-A472 PolarHBondContact NH1-O 3.43Å; I456-A472 WeakPolarHBondContact O-CB 3.48Å; V467-A472 HydrophobicContact CG1-CB 4.31Å; G469-A472 WeakPolarHBondContact O-CB 3.35Å; G469-A472 PolarHBondContact O-N 3.07Å
473	P	77	Confident	74.3	Confident	3 Å²	3	68.6 Å²	68.6	2%	0.019	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-66.6	149.9	171.4	27.9	-35	0	0	0	112.1	R455 I456 M458 E477 V478 W481	R455-P473 WeakPolarHBondContact CA-O 3.43Å; I456-P473 PolarHBondContact N-O 2.88Å; M458-P473 HydrophobicContact CE-CG 3.89Å; M458-P473 HydrophobicContact CG-CG 4.11Å; M458-P473 HydrophobicContact SD-CG 4.33Å; P473-E477 HydrophobicContact CB-CB 4.07Å; P473-V478 HydrophobicContact CB-CG2 4.12Å; P473-V478 HydrophobicContact CG-CB 4.45Å; P473-V478 HydrophobicContact CG-CG2 3.85Å; P473-W481 HydrophobicContact CB-CB 3.67Å; P473-W481 HydrophobicContact CB-CD2 4.4Å; P473-W481 HydrophobicContact CB-CG 3.74Å; P473-W481 HydrophobicContact CG-CB 3.88Å; P473-W481 HydrophobicContact CG-CD2 3.84Å; P473-W481 HydrophobicContact CG-CE3 4.18Å; P473-W481 HydrophobicContact CG-CG 3.7Å
474	L	76.8	Confident	74.5	Confident	32 Å²	32	72.4 Å²	72.4	17%	0.168	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-65.2	157.2	165.8	-75.1	159	0	0	0	110.8	D453 V454 R455 S476 E477 V478	D453-L474 HydrophobicContact CB-CD2 4.21Å; V454-L474 CarbonylContact O-C 3.45Å; V454-L474 WeakPolarHBondContact O-CA 3.22Å; R455-L474 HydrophobicContact CG-CD2 4.5Å; L474-S476 PolarHBondContact O-N 3.27Å; L474-S476 VanDerWaalsContact O-N 3.08Å; L474-E477 HydrophobicContact CB-CB 4.29Å; L474-E477 HydrophobicContact CB-CG 3.96Å; L474-E477 WeakPolarHBondContact CB-OE2 3.43Å; L474-E477 PolarHBondContact N-OE2 2.9Å; L474-E477 CarbonylContact O-C 3.58Å; L474-E477 WeakPolarHBondContact O-CA 3.29Å; L474-E477 PolarHBondContact O-N 2.93Å; L474-V478 WeakPolarHBondContact O-CG2 3.49Å; L474-V478 PolarHBondContact O-N 3.5Å
475	A	65.3	Low	74.7	Confident	52 Å²	52	68.6 Å²	68.6	43%	0.43	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-27.4	175.6	0	0	0	0	0	113.3	V454 I456	V454-A475 PolarHBondContact O-N 2.82Å; I456-A475 HydrophobicContact CD1-CB 3.91Å; I456-A475 HydrophobicContact CG1-CB 4.25Å
476	S	63.2	Low	74.5	Confident	93 Å²	93	71.3 Å²	71.3	65%	0.65	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-21.4	172.3	46.6	0	0	0	0	114.4	L474	L474-S476 PolarHBondContact O-N 3.27Å; L474-S476 VanDerWaalsContact O-N 3.08Å
477	E	76.4	Confident	74.2	Confident	82 Å²	82	69.7 Å²	69.7	38%	0.383	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-20	-173.4	-63.2	172.4	152.7	0	0	113.4	R455 P473 L474 C479 T480 W481	R455-E477 IonicContact NH1-OE2 3.72Å; R455-E477 PolarHBondContact NH1-OE2 2.92Å; P473-E477 HydrophobicContact CB-CB 4.07Å; L474-E477 HydrophobicContact CB-CB 4.29Å; L474-E477 HydrophobicContact CB-CG 3.96Å; L474-E477 WeakPolarHBondContact CB-OE2 3.43Å; L474-E477 PolarHBondContact N-OE2 2.9Å; L474-E477 CarbonylContact O-C 3.58Å; L474-E477 WeakPolarHBondContact O-CA 3.29Å; L474-E477 PolarHBondContact O-N 2.93Å; E477-C479 VanDerWaalsContact C-N 3.3Å; E477-C479 PolarHBondContact O-N 3.37Å; E477-C479 VanDerWaalsContact O-N 3.17Å; E477-T480 PolarHBondContact O-N 2.88Å; E477-T480 PolarHBondContact O-OG1 3.49Å; E477-W481 PolarHBondContact O-N 2.9Å
478	V	72.6	Confident	74.5	Confident	9 Å²	9	70 Å²	70	6%	0.055	40%	0.397	C	S	.	.	H	α-helix	trans	-50.9	-43.3	-172.9	174	0	0	0	0	113.7	I456 M458 P473 L474 T480 W481 L482 I490	I456-V478 HydrophobicContact CB-CG2 3.9Å; I456-V478 HydrophobicContact CD1-CG2 3.78Å; I456-V478 HydrophobicContact CG1-CG2 3.95Å; M458-V478 HydrophobicContact CE-CG1 3.83Å; M458-V478 HydrophobicContact CE-CG2 4.07Å; P473-V478 HydrophobicContact CB-CG2 4.12Å; P473-V478 HydrophobicContact CG-CB 4.45Å; P473-V478 HydrophobicContact CG-CG2 3.85Å; L474-V478 WeakPolarHBondContact O-CG2 3.49Å; L474-V478 PolarHBondContact O-N 3.5Å; V478-T480 VanDerWaalsContact C-N 3.32Å; V478-T480 PolarHBondContact O-N 3.41Å; V478-W481 PolarHBondContact O-N 2.89Å; V478-L482 HydrophobicContact CG1-CD1 3.67Å; V478-L482 HydrophobicContact CG1-CG 4.2Å; V478-L482 WeakPolarHBondContact O-CB 3.41Å; V478-L482 WeakPolarHBondContact O-CG 3.31Å; V478-L482 PolarHBondContact O-N 2.94Å; V478-I490 HydrophobicContact CG1-CD1 4.04Å; V478-I490 HydrophobicContact CG1-CG1 4.49Å
479	C	68.3	Low	74.4	Confident	59 Å²	59	70.4 Å²	70.4	40%	0.399	40%	0.399	S	S	.	.	H	α-helix	trans	-65.8	-33.9	-178.2	-69.5	0	0	0	0	112.8	E477 Q483	E477-C479 VanDerWaalsContact C-N 3.3Å; E477-C479 PolarHBondContact O-N 3.37Å; E477-C479 VanDerWaalsContact O-N 3.17Å; C479-Q483 VanDerWaalsContact O-CG 3.29Å; C479-Q483 WeakPolarHBondContact O-CG 3.16Å; C479-Q483 PolarHBondContact O-NE2 2.99Å
480	T	75.8	Confident	74.4	Confident	78 Å²	78	72.3 Å²	72.3	48%	0.479	40%	0.397	S	S	.	.	H	α-helix	trans	-73.4	-44.3	171.5	16	0	0	0	0	111.1	E477 V478 L482 Q483 E484	E477-T480 PolarHBondContact O-N 2.88Å; E477-T480 PolarHBondContact O-OG1 3.49Å; V478-T480 VanDerWaalsContact C-N 3.32Å; V478-T480 PolarHBondContact O-N 3.41Å; T480-L482 PolarHBondContact O-N 2.92Å; T480-Q483 WeakPolarHBondContact O-CB 2.89Å; T480-Q483 PolarHBondContact O-N 2.79Å; T480-E484 PolarHBondContact O-N 3.41Å; T480-E484 VanDerWaalsContact O-N 3.15Å
481	W	83.2	Confident	74.1	Confident	37 Å²	37	65.2 Å²	65.2	14%	0.14	36%	0.359	C	S	.	.	H	α-helix	trans	-61.5	-42.3	-177.8	-169.9	93.5	0	0	0	112.5	M458 P473 E477 V478 Q483 E484 H485 W488	M458-W481 HydrophobicContact CB-CH2 3.61Å; M458-W481 HydrophobicContact CB-CZ3 3.64Å; M458-W481 HydrophobicContact CG-CE3 3.86Å; M458-W481 HydrophobicContact CG-CH2 3.69Å; M458-W481 HydrophobicContact CG-CZ2 4.4Å; M458-W481 HydrophobicContact CG-CZ3 3.38Å; M458-W481 HydrophobicContact SD-CE3 3.85Å; M458-W481 HydrophobicContact SD-CZ3 3.66Å; P473-W481 HydrophobicContact CB-CB 3.67Å; P473-W481 HydrophobicContact CB-CD2 4.4Å; P473-W481 HydrophobicContact CB-CG 3.74Å; P473-W481 HydrophobicContact CG-CB 3.88Å; P473-W481 HydrophobicContact CG-CD2 3.84Å; P473-W481 HydrophobicContact CG-CE3 4.18Å; P473-W481 HydrophobicContact CG-CG 3.7Å; E477-W481 PolarHBondContact O-N 2.9Å; V478-W481 PolarHBondContact O-N 2.89Å; W481-Q483 VanDerWaalsContact C-N 3.27Å; W481-Q483 PolarHBondContact O-N 3.22Å; W481-E484 PolarHBondContact O-N 3.33Å; W481-H485 AromaticContact CD1-CE1 3.83Å; W481-H485 AromaticContact CD1-ND1 3.76Å; W481-H485 HydrophobicContact CD2-CB 4.27Å; W481-H485 AromaticContact CD2-ND1 3.69Å; W481-H485 AromaticContact CE2-CE1 3.89Å; W481-H485 AromaticContact CE2-CG 3.76Å; W481-H485 AromaticContact CE2-ND1 3.57Å; W481-H485 HydrophobicContact CE3-CB 4.06Å; W481-H485 AromaticContact CG-ND1 3.83Å; W481-H485 HydrophobicContact CH2-CB 4.02Å; W481-H485 HydrophobicContact CZ2-CB 4.22Å; W481-H485 AromaticContact CZ2-CD2 3.99Å; W481-H485 AromaticContact CZ2-CG 3.85Å; W481-H485 HydrophobicContact CZ3-CB 3.93Å; W481-H485 AromaticContact NE1-CE1 3.54Å; W481-H485 AromaticContact NE1-ND1 3.61Å; W481-H485 WeakPolarHBondContact O-CB 3.14Å; W481-H485 PolarHBondContact O-N 3.01Å; W481-H485 PolarHBondContact O-ND1 3.35Å; W481-W488 HydrophobicContact CH2-CB 4.05Å; W481-W488 AromaticContact CH2-CD2 3.55Å; W481-W488 HydrophobicContact CH2-CD2 3.55Å; W481-W488 AromaticContact CH2-CE3 3.67Å; W481-W488 HydrophobicContact CH2-CE3 3.67Å; W481-W488 AromaticContact CH2-CG 3.76Å; W481-W488 HydrophobicContact CH2-CG 3.76Å; W481-W488 HydrophobicContact CH2-CZ3 4.33Å; W481-W488 HydrophobicContact CZ3-CB 3.66Å; W481-W488 HydrophobicContact CZ3-CD2 4.12Å; W481-W488 HydrophobicContact CZ3-CE3 4.34Å; W481-W488 AromaticContact CZ3-CG 3.88Å; W481-W488 HydrophobicContact CZ3-CG 3.88Å
482	L	77.1	Confident	73.3	Confident	52 Å²	52	64.8 Å²	64.8	27%	0.272	35%	0.35	S	S	.	.	H	α-helix	trans	-68.3	-19.8	175.1	-70.7	171.3	0	0	0	113.9	M458 V478 T480 W488 I490	M458-L482 HydrophobicContact SD-CD2 3.91Å; M458-L482 HydrophobicContact SD-CG 4.38Å; V478-L482 HydrophobicContact CG1-CD1 3.67Å; V478-L482 HydrophobicContact CG1-CG 4.2Å; V478-L482 WeakPolarHBondContact O-CB 3.41Å; V478-L482 WeakPolarHBondContact O-CG 3.31Å; V478-L482 PolarHBondContact O-N 2.94Å; T480-L482 PolarHBondContact O-N 2.92Å; L482-W488 HydrophobicContact CD2-CB 4.25Å; L482-W488 WeakPolarHBondContact CD2-O 3.31Å; L482-I490 HydrophobicContact CD1-CD1 4.27Å; L482-I490 HydrophobicContact CD1-CG1 4.2Å
483	Q	75.9	Confident	72.1	Confident	137 Å²	137	67.4 Å²	67.4	64%	0.64	37%	0.366	S	S	*	.	H	α-helix	trans	-80	-32.7	172.3	-71.5	171.2	21.9	0	0	111.8	C479 T480 W481	C479-Q483 VanDerWaalsContact O-CG 3.29Å; C479-Q483 WeakPolarHBondContact O-CG 3.16Å; C479-Q483 PolarHBondContact O-NE2 2.99Å; T480-Q483 WeakPolarHBondContact O-CB 2.89Å; T480-Q483 PolarHBondContact O-N 2.79Å; W481-Q483 VanDerWaalsContact C-N 3.27Å; W481-Q483 PolarHBondContact O-N 3.22Å
484	E	79.2	Confident	71	Confident	151 Å²	151	71.6 Å²	71.6	71%	0.706	39%	0.389	S	S	*	.	H	α-helix	trans	-78.4	-36.2	174.8	-65.6	179.6	161.9	0	0	112.2	T480 W481	T480-E484 PolarHBondContact O-N 3.41Å; T480-E484 VanDerWaalsContact O-N 3.15Å; W481-E484 PolarHBondContact O-N 3.33Å
485	H	73	Confident	69.6	Low	69 Å²	69	76.3 Å²	76.3	32%	0.319	42%	0.419	S	S	.	.	S	Bend	trans	-107.8	74.7	-173.3	-61.3	79.8	0	0	0	111.7	W481 W488	W481-H485 AromaticContact CD1-CE1 3.83Å; W481-H485 AromaticContact CD1-ND1 3.76Å; W481-H485 HydrophobicContact CD2-CB 4.27Å; W481-H485 AromaticContact CD2-ND1 3.69Å; W481-H485 AromaticContact CE2-CE1 3.89Å; W481-H485 AromaticContact CE2-CG 3.76Å; W481-H485 AromaticContact CE2-ND1 3.57Å; W481-H485 HydrophobicContact CE3-CB 4.06Å; W481-H485 AromaticContact CG-ND1 3.83Å; W481-H485 HydrophobicContact CH2-CB 4.02Å; W481-H485 HydrophobicContact CZ2-CB 4.22Å; W481-H485 AromaticContact CZ2-CD2 3.99Å; W481-H485 AromaticContact CZ2-CG 3.85Å; W481-H485 HydrophobicContact CZ3-CB 3.93Å; W481-H485 AromaticContact NE1-CE1 3.54Å; W481-H485 AromaticContact NE1-ND1 3.61Å; W481-H485 WeakPolarHBondContact O-CB 3.14Å; W481-H485 PolarHBondContact O-N 3.01Å; W481-H485 PolarHBondContact O-ND1 3.35Å; H485-W488 HydrophobicContact CB-CG 4.19Å; H485-W488 VanDerWaalsContact O-CD1 3.29Å; H485-W488 PolarHBondContact O-N 2.82Å
486	Q	70.4	Confident	68.5	Low	170 Å²	170	80.5 Å²	80.5	79%	0.794	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	138.3	178.1	-62.9	-175.6	8.4	0	0	112.3
487	G	72	Confident	67.8	Low	36 Å²	36	78.1 Å²	78.1	37%	0.371	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	2.2	-178.6	0	0	0	0	0	115.2	T461	T461-G487 PolarHBondContact N-O 3.47Å; T461-G487 PolarHBondContact OG1-O 3.1Å
488	W	81.9	Confident	66.7	Low	35 Å²	35	77.1 Å²	77.1	13%	0.133	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	149.2	172.2	-64.2	75.2	0	0	0	112.1	M458 Y459 Q460 E465 V467 W481 L482 H485	M458-W488 HydrophobicContact CB-CE3 3.83Å; M458-W488 HydrophobicContact CB-CZ3 4.37Å; Y459-W488 CarbonylContact O-C 3.51Å; Y459-W488 VanDerWaalsContact O-CA 3.25Å; Y459-W488 WeakPolarHBondContact O-CA 3.31Å; Q460-W488 HydrophobicContact CB-CD2 3.56Å; Q460-W488 HydrophobicContact CB-CE3 3.66Å; Q460-W488 HydrophobicContact CB-CG 4.18Å; Q460-W488 HydrophobicContact CB-CH2 3.85Å; Q460-W488 HydrophobicContact CB-CZ2 3.76Å; Q460-W488 HydrophobicContact CB-CZ3 3.81Å; Q460-W488 VanDerWaalsContact CD-CE2 3.44Å; Q460-W488 VanDerWaalsContact CD-NE1 3.33Å; Q460-W488 HydrophobicContact CG-CD2 3.89Å; Q460-W488 HydrophobicContact CG-CE3 4.49Å; Q460-W488 HydrophobicContact CG-CG 4.12Å; Q460-W488 HydrophobicContact CG-CZ2 4.06Å; Q460-W488 VanDerWaalsContact OE1-CZ2 3.31Å; E465-W488 HydrophobicContact CB-CH2 3.84Å; E465-W488 HydrophobicContact CB-CZ3 4.44Å; V467-W488 HydrophobicContact CB-CH2 4.39Å; V467-W488 HydrophobicContact CB-CZ3 3.94Å; V467-W488 HydrophobicContact CG2-CH2 3.45Å; V467-W488 VanDerWaalsContact CG2-CH2 3.45Å; V467-W488 HydrophobicContact CG2-CZ3 3.5Å; V467-W488 VanDerWaalsContact CG2-CZ3 3.5Å; W481-W488 HydrophobicContact CH2-CB 4.05Å; W481-W488 AromaticContact CH2-CD2 3.55Å; W481-W488 HydrophobicContact CH2-CD2 3.55Å; W481-W488 AromaticContact CH2-CE3 3.67Å; W481-W488 HydrophobicContact CH2-CE3 3.67Å; W481-W488 AromaticContact CH2-CG 3.76Å; W481-W488 HydrophobicContact CH2-CG 3.76Å; W481-W488 HydrophobicContact CH2-CZ3 4.33Å; W481-W488 HydrophobicContact CZ3-CB 3.66Å; W481-W488 HydrophobicContact CZ3-CD2 4.12Å; W481-W488 HydrophobicContact CZ3-CE3 4.34Å; W481-W488 AromaticContact CZ3-CG 3.88Å; W481-W488 HydrophobicContact CZ3-CG 3.88Å; L482-W488 HydrophobicContact CD2-CB 4.25Å; L482-W488 WeakPolarHBondContact CD2-O 3.31Å; H485-W488 HydrophobicContact CB-CG 4.19Å; H485-W488 VanDerWaalsContact O-CD1 3.29Å; H485-W488 PolarHBondContact O-N 2.82Å
489	E	74.1	Confident	65.9	Low	113 Å²	113	78.2 Å²	78.2	53%	0.528	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	165.2	-178.9	-63.7	-177.4	160.8	0	0	110.2	M458 Y459 T461	M458-E489 CarbonylContact C-O 3.6Å; M458-E489 WeakPolarHBondContact CA-O 3.44Å; Y459-E489 PolarHBondContact N-O 3.28Å; Y459-E489 PolarHBondContact O-N 3.15Å; T461-E489 VanDerWaalsContact CG2-CD 3.42Å; T461-E489 HydrophobicContact CG2-CG 3.85Å; T461-E489 WeakPolarHBondContact CG2-OE2 3.18Å
490	I	73.3	Confident	65.7	Low	87 Å²	87	78.3 Å²	78.3	45%	0.446	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	130.4	-179.9	-58.2	176.8	0	0	0	109.5	I456 M458 V478 L482	I456-I490 HydrophobicContact CG2-CG2 3.71Å; M458-I490 HydrophobicContact CE-CG1 3.92Å; M458-I490 HydrophobicContact SD-CG1 4.22Å; V478-I490 HydrophobicContact CG1-CD1 4.04Å; V478-I490 HydrophobicContact CG1-CG1 4.49Å; L482-I490 HydrophobicContact CD1-CD1 4.27Å; L482-I490 HydrophobicContact CD1-CG1 4.2Å
491	L	69.9	Low	64.8	Low	3 Å²	3	80.3 Å²	80.3	2%	0.016	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-72.1	142.3	172.9	-77.4	99.2	0	0	0	111.5	P457 M458 I466 T493 V499 L504	P457-L491 HydrophobicContact CB-CD1 4.16Å; P457-L491 HydrophobicContact CG-CB 4.27Å; P457-L491 PolarHBondContact O-N 2.95Å; P457-L491 VanDerWaalsContact O-N 3.13Å; M458-L491 WeakPolarHBondContact O-CD1 3.07Å; I466-L491 HydrophobicContact CG2-CD1 4.01Å; I466-L491 HydrophobicContact CG2-CD2 4.25Å; L491-T493 PolarHBondContact O-N 3.32Å; L491-V499 HydrophobicContact CB-CG2 4.3Å; L491-V499 HydrophobicContact CD2-CB 4.49Å; L491-V499 HydrophobicContact CD2-CG1 3.5Å; L491-V499 VanDerWaalsContact CD2-CG1 3.5Å; L491-V499 HydrophobicContact CD2-CG2 4.13Å; L491-L504 HydrophobicContact CD2-CD1 4.09Å; L491-L504 HydrophobicContact CD2-CD2 4.35Å
492	P	55.9	Low	63.4	Low	61 Å²	61	86.1 Å²	86.1	40%	0.396	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-61.7	123.3	167.8	-19.6	32.1	0	0	0	110.9	I500 L503	P492-I500 HydrophobicContact CB-CB 4.44Å; P492-I500 HydrophobicContact CB-CD1 4.4Å; P492-I500 PolarHBondContact O-N 2.88Å; P492-L503 HydrophobicContact CB-CD1 3.85Å; P492-L503 HydrophobicContact CG-CD1 4.02Å
493	T	53.9	Low	62.3	Low	57 Å²	57	87.6 Å²	87.6	35%	0.35	47%	0.474	S	S	.	.	B	Isolated β-bridge	trans	-114.9	151.8	175.6	46.2	0	0	0	0	112	P457 L491 G497 S498 V499	P457-T493 HydrophobicContact CG-CG2 3.58Å; L491-T493 PolarHBondContact O-N 3.32Å; T493-G497 WeakPolarHBondContact CG2-O 3.41Å; T493-S498 CarbonylContact C-O 3.53Å; T493-S498 WeakPolarHBondContact CA-O 3.17Å; T493-V499 HydrophobicContact CG2-CG2 4.39Å
494	D	52.9	Low	61.2	Low	91 Å²	91	83.7 Å²	83.7	49%	0.487	46%	0.457	S	S	.	.			trans	-76.3	177.7	172.9	-150.2	-15	0	0	0	111.4	D496 G497 S498 I500	D494-D496 PolarHBondContact O-N 3.3Å; D494-G497 PolarHBondContact O-N 3.07Å; D494-S498 WeakPolarHBondContact CB-OG 3.43Å; D494-S498 PolarHBondContact N-O 3Å; D494-I500 HydrophobicContact CB-CG1 4.42Å
495	T	46.7	Very low	59.8	Low	130 Å²	130	85.2 Å²	85.2	80%	0.798	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-22.9	177.4	52.2	0	0	0	0	114.1
496	D	43.3	Very low	58.6	Low	140 Å²	140	86.9 Å²	86.9	75%	0.749	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	1.2	-172	-61.7	18.6	0	0	0	112	D494	D494-D496 PolarHBondContact O-N 3.3Å
497	G	48.4	Very low	57.4	Low	44 Å²	44	83.5 Å²	83.5	45%	0.454	47%	0.469	S	S	.	.	S	Bend	trans	83.8	2.7	-178.2	0	0	0	0	0	115.2	T493 D494	T493-G497 WeakPolarHBondContact CG2-O 3.41Å; D494-G497 PolarHBondContact O-N 3.07Å
498	S	52.1	Low	55.9	Low	61 Å²	61	86.5 Å²	86.5	43%	0.427	47%	0.473	S	S	.	.			trans	-75.4	139	176.5	38.5	0	0	0	0	112.7	T493 D494	T493-S498 CarbonylContact C-O 3.53Å; T493-S498 WeakPolarHBondContact CA-O 3.17Å; D494-S498 WeakPolarHBondContact CB-OG 3.43Å; D494-S498 PolarHBondContact N-O 3Å
499	V	57.5	Low	53.8	Low	32 Å²	32	93.3 Å²	93.3	19%	0.194	51%	0.506	C	S	.	.	B	Isolated β-bridge	trans	-69.5	129.6	179.5	167.7	0	0	0	0	112.1	P457 L491 T493 H501	P457-V499 HydrophobicContact CB-CG2 4.11Å; P457-V499 HydrophobicContact CG-CG2 3.83Å; L491-V499 HydrophobicContact CB-CG2 4.3Å; L491-V499 HydrophobicContact CD2-CB 4.49Å; L491-V499 HydrophobicContact CD2-CG1 3.5Å; L491-V499 VanDerWaalsContact CD2-CG1 3.5Å; L491-V499 HydrophobicContact CD2-CG2 4.13Å; T493-V499 HydrophobicContact CG2-CG2 4.39Å; V499-H501 PolarHBondContact O-N 3.25Å; V499-H501 VanDerWaalsContact O-N 3.1Å
500	I	62.7	Low	52.3	Low	61 Å²	61	95.8 Å²	95.8	31%	0.313	52%	0.516	S	S	.	.			trans	-83.9	83.2	176.6	-52.2	175.4	0	0	0	109.6	P492 D494 D502 L503	P492-I500 HydrophobicContact CB-CB 4.44Å; P492-I500 HydrophobicContact CB-CD1 4.4Å; P492-I500 PolarHBondContact O-N 2.88Å; D494-I500 HydrophobicContact CB-CG1 4.42Å; I500-D502 PolarHBondContact O-N 3.13Å; I500-L503 HydrophobicContact CB-CD1 4.15Å; I500-L503 HydrophobicContact CG2-CD1 3.78Å; I500-L503 HydrophobicContact CG2-CG 3.96Å; I500-L503 PolarHBondContact O-N 3.09Å
501	H	57.8	Low	50.7	Low	120 Å²	120	97.8 Å²	97.8	56%	0.556	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-58.1	-30	-176.4	-105.1	-72.8	0	0	0	114.8	V499 L503 L504	V499-H501 PolarHBondContact O-N 3.25Å; V499-H501 VanDerWaalsContact O-N 3.1Å; H501-L503 PolarHBondContact O-N 3.29Å; H501-L504 PolarHBondContact O-N 3.07Å
502	D	54.1	Low	49.2	Very low	158 Å²	158	107.7 Å²	107.7	85%	0.845	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-61.9	-3.5	179.9	-78.5	15	0	0	0	114.8	I500	I500-D502 PolarHBondContact O-N 3.13Å
503	L	54	Low	48.6	Very low	83 Å²	83	114.3 Å²	114.3	44%	0.435	58%	0.581	S	S	.	*	G	3₁₀ helix	trans	-106	3.5	-178.8	-66.2	173.8	0	0	0	114.4	P492 I500 H501	P492-L503 HydrophobicContact CB-CD1 3.85Å; P492-L503 HydrophobicContact CG-CD1 4.02Å; I500-L503 HydrophobicContact CB-CD1 4.15Å; I500-L503 HydrophobicContact CG2-CD1 3.78Å; I500-L503 HydrophobicContact CG2-CG 3.96Å; I500-L503 PolarHBondContact O-N 3.09Å; H501-L503 PolarHBondContact O-N 3.29Å
504	L	51.5	Low	47.8	Very low	56 Å²	56	121.8 Å²	121.8	29%	0.293	60%	0.603	S	S	.	*			trans	-102.7	0.9	-168	-67.6	169.6	0	0	0	116.5	L491 H501	L491-L504 HydrophobicContact CD2-CD1 4.09Å; L491-L504 HydrophobicContact CD2-CD2 4.35Å; H501-L504 PolarHBondContact O-N 3.07Å
505	E	50.6	Low	46.8	Very low	183 Å²	183	126.4 Å²	126.4	86%	0.855	62%	0.618	S	S	*	*			trans	-88.8	131.4	-179.1	-64.5	-162.8	144.2	0	0	113.4
506	P	47.6	Very low	46.3	Very low	104 Å²	104	129.2 Å²	129.2	68%	0.675	62%	0.62	S	S	*	*			trans	-92.2	135.4	-169.7	33.8	-35.6	0	0	0	116.4	E508	P506-E508 VanDerWaalsContact C-N 3.27Å; P506-E508 PolarHBondContact O-N 2.98Å
507	D	45.2	Very low	45.8	Very low	98 Å²	98	129.7 Å²	129.7	52%	0.524	62%	0.623	S	S	.	*			trans	-64.1	16.2	-171.6	-69	-64.1	0	0	0	118.8	E509	D507-E509 PolarHBondContact O-N 3.41Å
508	E	40.1	Very low	45	Very low	100 Å²	100	135 Å²	135	47%	0.467	64%	0.641	S	S	.	*	H	α-helix	trans	-73.4	-22.4	-163.8	-87.2	-61.8	115.5	0	0	116.9	P506 K511	P506-E508 VanDerWaalsContact C-N 3.27Å; P506-E508 PolarHBondContact O-N 2.98Å; E508-K511 WeakPolarHBondContact OE1-CD 3.5Å; E508-K511 WeakPolarHBondContact OE1-CE 3.36Å; E508-K511 IonicContact OE1-NZ 3.7Å; E508-K511 PolarHBondContact OE1-NZ 2.93Å
509	E	39.1	Very low	44.3	Very low	177 Å²	177	139.8 Å²	139.8	83%	0.827	66%	0.661	S	S	*	*	H	α-helix	trans	-71	-30.3	177.5	-88.6	-161.3	142.2	0	0	113.4	D507 K511	D507-E509 PolarHBondContact O-N 3.41Å; E509-K511 PolarHBondContact O-N 3.12Å
510	F	41.8	Very low	43.4	Very low	166 Å²	166	145.8 Å²	145.8	73%	0.728	69%	0.692	S	S	*	*	H	α-helix	trans	-78.7	-20	-172.6	-90.3	-89.6	0	0	0	114.6
511	K	40.6	Very low	42.1	Very low	128 Å²	128	148.4 Å²	148.4	56%	0.557	71%	0.707	S	S	*	*	H	α-helix	trans	-74.4	-28.3	-178.4	-65.6	178.2	-166.8	159.5	0	113.5	E508 E509 K513	E508-K511 WeakPolarHBondContact OE1-CD 3.5Å; E508-K511 WeakPolarHBondContact OE1-CE 3.36Å; E508-K511 IonicContact OE1-NZ 3.7Å; E508-K511 PolarHBondContact OE1-NZ 2.93Å; E509-K511 PolarHBondContact O-N 3.12Å; K511-K513 PolarHBondContact O-N 3.06Å
512	R	38.1	Very low	41.1	Very low	212 Å²	212	150.2 Å²	150.2	80%	0.8	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-11.3	-174.7	-61.8	-173.1	-174	-170.8	1.8	114.5
513	K	42.4	Very low	40.4	Very low	200 Å²	200	150.7 Å²	150.7	87%	0.87	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	6.6	-177.3	-107.2	178.6	178.8	174.9	0	115.3	K511	K511-K513 PolarHBondContact O-N 3.06Å
514	R	38.1	Very low	39.4	Very low	214 Å²	214	152.9 Å²	152.9	81%	0.808	74%	0.735	S	S	*	*	S	Bend	trans	-122.6	32.5	-174.9	-61.7	-168.4	-179.2	-167.7	3.1	114.1
515	K	32.2	Very low	38.5	Very low	187 Å²	187	156.9 Å²	156.9	81%	0.813	76%	0.757	S	S	*	*			trans	-130.3	46.2	-165	-150.7	-178.4	-173.9	-173.2	0	113.3
516	F	35.3	Very low	37.5	Very low	190 Å²	190	153 Å²	153	83%	0.833	75%	0.75	S	S	*	*	S	Bend	trans	-143.4	-23.5	-173.5	-127.5	-87.7	0	0	0	116.2
517	D	33.3	Very low	36.7	Very low	150 Å²	150	156.1 Å²	156.1	80%	0.802	76%	0.758	S	S	*	*			trans	-136.6	73.7	-169	-48.2	-79.9	0	0	0	111.9
518	D	32	Very low	35.8	Very low	156 Å²	156	157.3 Å²	157.3	83%	0.834	77%	0.768	S	S	*	*			trans	-148.4	107.4	168.2	-96.6	-42.2	0	0	0	107.3
519	D	35.7	Very low	35.4	Very low	161 Å²	161	161.6 Å²	161.6	86%	0.861	79%	0.788	S	S	*	*			trans	-170.9	149.4	157	-96.6	-29.9	0	0	0	110.1
520	D	39.5	Very low	34.9	Very low	158 Å²	158	160 Å²	160	85%	0.845	79%	0.79	S	S	*	*			trans	62.1	120.3	170.8	-59.7	-25.1	0	0	0	121.4
521	D	34.2	Very low	34.3	Very low	116 Å²	116	154.6 Å²	154.6	62%	0.62	78%	0.781	S	S	*	*			trans	-118.4	-167.9	166.7	-106.8	-58.7	0	0	0	108.6	R540	D521-R540 IonicContact OD1-CZ 3.15Å; D521-R540 IonicContact OD1-NH2 3.69Å; D521-R540 PolarHBondContact OD1-NH2 2.8Å; D521-R540 IonicContact OD2-CZ 2.77Å; D521-R540 IonicContact OD2-NH1 2.69Å; D521-R540 IonicContact OD2-NH2 2.65Å; D521-R540 PolarHBondContact OD2-NH2 3.27Å
522	D	37	Very low	34	Very low	157 Å²	157	155.7 Å²	155.7	84%	0.84	80%	0.799	S	S	*	*			trans	72.9	110	172.1	-58	-24.8	0	0	0	119.1
523	D	40.5	Very low	33.7	Very low	168 Å²	168	153.7 Å²	153.7	90%	0.898	80%	0.799	S	S	*	*				-174.8	165	89.2	-148.9	-15.5	0	0	0	110.7
524	D	32.7	Very low	33.6	Very low	129 Å²	129	147.4 Å²	147.4	69%	0.69	77%	0.774	S	S	*	*			trans	-127.5	132	-163.4	-168	6.2	0	0	0	113.7
525	N	31.9	Very low	33.7	Very low	140 Å²	140	143.1 Å²	143.1	75%	0.749	77%	0.768	S	S	*	*			trans	172.7	128.3	133.9	-104.2	-82.1	0	0	0	117.8
526	S	30.4	Very low	34	Very low	101 Å²	101	140 Å²	140	71%	0.706	76%	0.756	S	S	*	*			trans	79.2	133.3	131.8	81.3	0	0	0	0	124.5
527	M	29.9	Very low	34.4	Very low	171 Å²	171	141.1 Å²	141.1	84%	0.842	76%	0.756	S	S	*	*			trans	107	75.6	132.8	-155.2	160.2	178.2	0	0	122.2
528	V	27.9	Very low	34.8	Very low	122 Å²	122	139.7 Å²	139.7	74%	0.739	75%	0.748	S	S	*	*			trans	51.4	102.5	133.8	-169.6	0	0	0	0	119.5
529	H	30.9	Very low	35.1	Very low	190 Å²	190	142.2 Å²	142.2	88%	0.88	75%	0.752	S	S	*	*			trans	-143.6	148.9	143.3	-131.8	55.7	0	0	0	112
530	V	28.6	Very low	35.1	Very low	143 Å²	143	143.8 Å²	143.8	87%	0.867	75%	0.746	S	S	*	*			trans	-97	109.6	-164.4	179	0	0	0	0	111.9
531	G	29	Very low	34.7	Very low	53 Å²	53	139.8 Å²	139.8	55%	0.546	74%	0.742	S	S	.	*			trans	166.1	132.7	166.4	0	0	0	0	0	115.7
532	T	34.5	Very low	34.8	Very low	152 Å²	152	143.8 Å²	143.8	93%	0.933	76%	0.757	S	S	*	*			trans	56.7	94.2	168.2	37.7	0	0	0	0	117.3
533	E	30.9	Very low	34.6	Very low	170 Å²	170	142.9 Å²	142.9	79%	0.794	76%	0.763	S	S	*	*			trans	-119.7	33	179.8	-59.4	-174.7	139.9	0	0	113.4	D535	E533-D535 VanDerWaalsContact C-N 3.33Å; E533-D535 PolarHBondContact O-N 2.86Å
534	D	40.9	Very low	34.1	Very low	68 Å²	68	137.4 Å²	137.4	36%	0.364	75%	0.746	S	S	.	*			trans	-82.8	0.4	-173.4	-133.1	12.5	0	0	0	113.9	R793 G1072	D534-R793 IonicContact OD2-CZ 3.97Å; D534-R793 IonicContact OD2-NH1 3.87Å; D534-R793 PolarHBondContact OD2-NH1 3.35Å; D534-R793 IonicContact OD2-NH2 2.72Å; D534-G1072 PolarHBondContact OD1-N 2.86Å
535	D	41.6	Very low	34.4	Very low	124 Å²	124	136.6 Å²	136.6	66%	0.663	76%	0.758	S	S	*	*			trans	-117.3	52.1	-169.8	-75.1	-48.5	0	0	0	114.4	E533 Y537 N538	E533-D535 VanDerWaalsContact C-N 3.33Å; E533-D535 PolarHBondContact O-N 2.86Å; D535-Y537 PolarHBondContact O-N 3.02Å; D535-N538 PolarHBondContact O-N 3.28Å
536	E	38.2	Very low	34.5	Very low	121 Å²	121	137 Å²	137	57%	0.565	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	24	-176.8	-154.5	-168.6	-129.5	0	0	116	R1076	E536-R1076 IonicContact OE2-CZ 2.66Å; E536-R1076 VanDerWaalsContact OE2-CZ 3.29Å; E536-R1076 IonicContact OE2-NH1 2.68Å; E536-R1076 PolarHBondContact OE2-NH1 3.27Å; E536-R1076 IonicContact OE2-NH2 2.67Å; E536-R1076 PolarHBondContact OE2-NH2 2.91Å
537	Y	43	Very low	34.8	Very low	213 Å²	213	136.2 Å²	136.2	84%	0.835	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.4	-4.9	177.2	-109.3	-95.4	0	0	0	114.8	D535	D535-Y537 PolarHBondContact O-N 3.02Å
538	N	41.8	Very low	35.2	Very low	120 Å²	120	133 Å²	133	64%	0.642	75%	0.751	S	S	*	*			trans	-97.1	22.9	-177	-74.9	-13.1	0	0	0	114.1	D535 R540	D535-N538 PolarHBondContact O-N 3.28Å; N538-R540 PolarHBondContact O-N 3.09Å; N538-R540 VanDerWaalsContact O-N 3.14Å
539	K	37.7	Very low	36.1	Very low	210 Å²	210	133.2 Å²	133.2	91%	0.913	74%	0.744	S	S	*	*			trans	-79.1	15.1	-172.4	-107.9	-175.6	-179.4	-178.6	0	116.2
540	R	36.6	Very low	37.3	Very low	194 Å²	194	127.2 Å²	127.2	73%	0.732	72%	0.723	S	S	*	*	S	Bend	trans	-129.1	106	166.2	-85.3	-167.1	164.3	-156.8	-6.9	110.8	D521 N538	D521-R540 IonicContact OD1-CZ 3.15Å; D521-R540 IonicContact OD1-NH2 3.69Å; D521-R540 PolarHBondContact OD1-NH2 2.8Å; D521-R540 IonicContact OD2-CZ 2.77Å; D521-R540 IonicContact OD2-NH1 2.69Å; D521-R540 IonicContact OD2-NH2 2.65Å; D521-R540 PolarHBondContact OD2-NH2 3.27Å; N538-R540 PolarHBondContact O-N 3.09Å; N538-R540 VanDerWaalsContact O-N 3.14Å
541	G	30.3	Very low	38.9	Very low	74 Å²	74	122.1 Å²	122.1	76%	0.763	69%	0.689	S	S	*	*			trans	43.4	97	155.6	0	0	0	0	0	120.8
542	E	37.6	Very low	40.6	Very low	200 Å²	200	121.3 Å²	121.3	94%	0.935	67%	0.669	S	S	*	*			trans	-159.2	99.9	136.9	-123.3	176.8	-144.9	0	0	111.6	G544	E542-G544 PolarHBondContact O-N 2.63Å
543	S	31	Very low	42.3	Very low	137 Å²	137	116.9 Å²	116.9	96%	0.958	64%	0.642	S	S	*	*			trans	-93.5	88.3	178.6	-71.1	0	0	0	0	111.3
544	G	31.5	Very low	44.1	Very low	54 Å²	54	111.7 Å²	111.7	56%	0.557	62%	0.619	S	S	*	*	S	Bend	trans	-177.1	85.5	178.6	0	0	0	0	0	117.4	E542 N546	E542-G544 PolarHBondContact O-N 2.63Å; G544-N546 PolarHBondContact O-N 2.73Å
545	A	37.8	Very low	45.4	Very low	112 Å²	112	109.2 Å²	109.2	93%	0.926	61%	0.609	S	S	*	*	S	Bend	trans	56.4	-19.3	158.7	0	0	0	0	0	120.7
546	N	35.1	Very low	47	Very low	149 Å²	149	103.5 Å²	103.5	80%	0.797	58%	0.578	S	S	*	*			trans	-114.6	26.5	-166	-70.3	-31.2	0	0	0	113.6	G544	G544-N546 PolarHBondContact O-N 2.73Å
547	A	36.1	Very low	48.6	Very low	83 Å²	83	101.1 Å²	101.1	69%	0.686	58%	0.579	S	S	*	*			trans	-57.8	125.8	175	0	0	0	0	0	110.2	Q549	A547-Q549 PolarHBondContact O-N 3.36Å
548	P	39.1	Very low	50.4	Low	104 Å²	104	94.5 Å²	94.5	68%	0.675	56%	0.561	S	S	*	*			trans	-68.3	101.5	-171.2	26	-34.2	0	0	0	110.7	S550	P548-S550 PolarHBondContact O-N 3.28Å
549	Q	46	Very low	51.9	Low	127 Å²	127	95 Å²	95	59%	0.593	55%	0.554	S	S	*	*			trans	-55.6	122.3	-172.4	-63.4	-179.9	6	0	0	111.1	A547 Y551 L554	A547-Q549 PolarHBondContact O-N 3.36Å; Q549-Y551 PolarHBondContact O-N 3.48Å; Q549-L554 HydrophobicContact CB-CD1 4.47Å; Q549-L554 HydrophobicContact CB-CD2 4.13Å; Q549-L554 HydrophobicContact CB-CG 4.06Å; Q549-L554 WeakPolarHBondContact O-CD1 3.41Å
550	S	55.4	Low	54.2	Low	63 Å²	63	87.3 Å²	87.3	44%	0.441	52%	0.521	S	S	.	.			trans	-49.3	134	179.3	179.7	0	0	0	0	111.1	P548 Y552 T553 L554	P548-S550 PolarHBondContact O-N 3.28Å; S550-Y552 PolarHBondContact O-N 2.83Å; S550-T553 WeakPolarHBondContact O-CA 3.29Å; S550-T553 WeakPolarHBondContact O-CB 3.38Å; S550-T553 PolarHBondContact O-N 2.86Å; S550-L554 PolarHBondContact O-N 3.45Å
551	Y	62	Low	56.4	Low	36 Å²	36	84.1 Å²	84.1	14%	0.141	51%	0.514	C	S	.	.	H	α-helix	trans	-54.5	-26.4	-175.2	-68.3	-49.1	0	0	0	113.6	F359 Q549 L554 A555 K790	F359-Y551 HydrophobicContact CB-CE1 4.39Å; F359-Y551 AromaticContact CD2-CD1 3.7Å; F359-Y551 HydrophobicContact CD2-CD1 3.7Å; F359-Y551 AromaticContact CD2-CE1 3.23Å; F359-Y551 HydrophobicContact CD2-CE1 3.23Å; F359-Y551 HydrophobicContact CD2-CE2 4.3Å; F359-Y551 HydrophobicContact CD2-CG 4.42Å; F359-Y551 AromaticContact CD2-CZ 3.57Å; F359-Y551 AromaticContact CE2-CD1 3.69Å; F359-Y551 HydrophobicContact CE2-CD1 3.69Å; F359-Y551 HydrophobicContact CE2-CD2 4.02Å; F359-Y551 AromaticContact CE2-CE1 3.53Å; F359-Y551 HydrophobicContact CE2-CE1 3.53Å; F359-Y551 AromaticContact CE2-CE2 3.87Å; F359-Y551 HydrophobicContact CE2-CE2 3.87Å; F359-Y551 AromaticContact CE2-CG 3.95Å; F359-Y551 HydrophobicContact CE2-CG 3.95Å; F359-Y551 AromaticContact CE2-CZ 3.62Å; F359-Y551 AromaticContact CG-CE1 3.87Å; F359-Y551 HydrophobicContact CG-CE1 3.87Å; F359-Y551 AromaticContact CG-CZ 3.92Å; F359-Y551 HydrophobicContact CZ-CD2 4.36Å; F359-Y551 HydrophobicContact CZ-CE1 4.38Å; F359-Y551 HydrophobicContact CZ-CE2 4Å; Q549-Y551 PolarHBondContact O-N 3.48Å; Y551-L554 HydrophobicContact CD1-CD1 4.14Å; Y551-L554 PolarHBondContact O-N 3.24Å; Y551-A555 WeakPolarHBondContact O-CB 3.07Å; Y551-A555 PolarHBondContact O-N 3.3Å; Y551-K790 HydrophobicContact CD2-CD 4.42Å; Y551-K790 HydrophobicContact CD2-CG 3.93Å; Y551-K790 HydrophobicContact CE2-CD 4.47Å; Y551-K790 HydrophobicContact CE2-CG 4.31Å
552	Y	66.7	Low	59.1	Low	36 Å²	36	81 Å²	81	14%	0.141	48%	0.481	C	S	.	.	H	α-helix	trans	-61.5	-42.3	172	-173.8	-100.8	0	0	0	112.3	S550 H556 R793 Q1068	S550-Y552 PolarHBondContact O-N 2.83Å; Y552-H556 AromaticContact CD2-CD2 3.65Å; Y552-H556 AromaticContact CE2-CD2 3.33Å; Y552-H556 WeakPolarHBondContact CE2-CD2 3.32Å; Y552-H556 AromaticContact CE2-NE2 3.55Å; Y552-H556 AromaticContact CZ-CD2 3.62Å; Y552-H556 VanDerWaalsContact O-CB 3.31Å; Y552-H556 WeakPolarHBondContact O-CB 3.41Å; Y552-H556 PolarHBondContact O-CD2 2.93Å; Y552-H556 PolarHBondContact O-N 3.03Å; Y552-R793 HydrophobicContact CD2-CG 4.45Å; Y552-Q1068 HydrophobicContact CE1-CG 4.35Å; Y552-Q1068 PolarHBondContact OH-NE2 3.43Å; Y552-Q1068 VanDerWaalsContact OH-NE2 3.11Å
553	T	70	Confident	61.1	Low	60 Å²	60	79 Å²	79	37%	0.368	47%	0.469	S	S	.	.	H	α-helix	trans	-71.6	-36.5	177.2	-55.2	0	0	0	0	112.3	S550 H556 A557 R559	S550-T553 WeakPolarHBondContact O-CA 3.29Å; S550-T553 WeakPolarHBondContact O-CB 3.38Å; S550-T553 PolarHBondContact O-N 2.86Å; T553-H556 CarbonylContact O-C 3.47Å; T553-A557 WeakPolarHBondContact O-CA 3.23Å; T553-A557 PolarHBondContact O-N 3.37Å; T553-A557 VanDerWaalsContact O-N 3.08Å; T553-R559 PolarHBondContact OG1-NH2 2.83Å
554	L	67.8	Low	63.7	Low	60 Å²	60	78.9 Å²	78.9	31%	0.314	45%	0.453	S	S	.	.	H	α-helix	trans	-66.9	-42.2	174.9	-69.8	171.2	0	0	0	112.4	Q549 S550 Y551	Q549-L554 HydrophobicContact CB-CD1 4.47Å; Q549-L554 HydrophobicContact CB-CD2 4.13Å; Q549-L554 HydrophobicContact CB-CG 4.06Å; Q549-L554 WeakPolarHBondContact O-CD1 3.41Å; S550-L554 PolarHBondContact O-N 3.45Å; Y551-L554 HydrophobicContact CD1-CD1 4.14Å; Y551-L554 PolarHBondContact O-N 3.24Å
555	A	69	Low	66.4	Low	17 Å²	17	78.6 Å²	78.6	14%	0.14	44%	0.437	C	S	.	.	H	α-helix	trans	-73.1	-35.9	177.5	0	0	0	0	0	112.9	Y551 N591 L593 P794	Y551-A555 WeakPolarHBondContact O-CB 3.07Å; Y551-A555 PolarHBondContact O-N 3.3Å; A555-N591 WeakPolarHBondContact O-CB 3.42Å; A555-N591 VanDerWaalsContact O-CG 3.25Å; A555-L593 HydrophobicContact CB-CD1 3.94Å; A555-L593 WeakPolarHBondContact O-CD1 3.3Å; A555-P794 HydrophobicContact CB-CB 3.56Å; A555-P794 HydrophobicContact CB-CG 4.06Å
556	H	73.5	Confident	68.9	Low	3 Å²	3	73.4 Å²	73.4	1%	0.014	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	48.9	173.1	-63.1	-77.3	0	0	0	111.4	Y552 T553 R559 W584 S587 P794	Y552-H556 AromaticContact CD2-CD2 3.65Å; Y552-H556 AromaticContact CE2-CD2 3.33Å; Y552-H556 WeakPolarHBondContact CE2-CD2 3.32Å; Y552-H556 AromaticContact CE2-NE2 3.55Å; Y552-H556 AromaticContact CZ-CD2 3.62Å; Y552-H556 VanDerWaalsContact O-CB 3.31Å; Y552-H556 WeakPolarHBondContact O-CB 3.41Å; Y552-H556 PolarHBondContact O-CD2 2.93Å; Y552-H556 PolarHBondContact O-N 3.03Å; T553-H556 CarbonylContact O-C 3.47Å; H556-R559 WeakPolarHBondContact O-CG 3.26Å; H556-R559 PolarHBondContact O-NE 2.92Å; H556-W584 AromaticContact CE1-CD1 3.33Å; H556-W584 AromaticContact CE1-NE1 3.25Å; H556-W584 PolarHBondContact CE1-NE1 3.45Å; H556-W584 AromaticContact NE2-CD1 3.53Å; H556-W584 AromaticContact NE2-NE1 3.17Å; H556-W584 PolarHBondContact NE2-NE1 2.79Å; H556-W584 VanDerWaalsContact NE2-NE1 3.17Å; H556-S587 PolarHBondContact ND1-OG 2.74Å; H556-P794 PolarHBondContact NE2-O 3.14Å
557	A	73	Confident	71.4	Confident	71 Å²	71	70.7 Å²	70.7	59%	0.587	39%	0.387	S	S	*	.			trans	-67.9	-45.1	178.4	0	0	0	0	0	111.3	T553 R559	T553-A557 WeakPolarHBondContact O-CA 3.23Å; T553-A557 PolarHBondContact O-N 3.37Å; T553-A557 VanDerWaalsContact O-N 3.08Å; A557-R559 PolarHBondContact O-N 2.81Å
558	V	79.9	Confident	73.9	Confident	75 Å²	75	68.5 Å²	68.5	46%	0.455	36%	0.363	S	S	.	.	S	Bend	trans	-84.6	107.7	169	-172	0	0	0	0	109.4	S587 N590 N591	V558-S587 PolarHBondContact O-OG 2.84Å; V558-N590 HydrophobicContact CB-CB 4.12Å; V558-N590 HydrophobicContact CG1-CB 3.78Å; V558-N591 WeakPolarHBondContact CB-OD1 3.36Å; V558-N591 WeakPolarHBondContact CG2-OD1 3.43Å; V558-N591 PolarHBondContact N-OD1 3.12Å; V558-N591 PolarHBondContact O-ND2 2.81Å
559	R	74.4	Confident	76.4	Confident	131 Å²	131	63.8 Å²	63.8	49%	0.494	33%	0.332	S	S	.	.			trans	-106.8	152.2	174	-57.3	-171.3	-179.2	-174.5	-1.1	110.6	T553 H556 A557	T553-R559 PolarHBondContact OG1-NH2 2.83Å; H556-R559 WeakPolarHBondContact O-CG 3.26Å; H556-R559 PolarHBondContact O-NE 2.92Å; A557-R559 PolarHBondContact O-N 2.81Å
560	E	85.4	Confident	78.5	Confident	47 Å²	47	60.8 Å²	60.8	22%	0.22	32%	0.322	C	S	.	.			trans	-152.3	103.1	-179.2	178.1	179.9	178.4	0	0	107.8	V562 V586 N590 Y615 K620	E560-V562 PolarHBondContact O-N 2.99Å; E560-V586 HydrophobicContact CB-CG1 4.22Å; E560-V586 HydrophobicContact CG-CG1 4.28Å; E560-V586 VanDerWaalsContact OE2-CG1 3.22Å; E560-V586 WeakPolarHBondContact OE2-CG1 3.25Å; E560-N590 PolarHBondContact OE2-ND2 3.41Å; E560-Y615 PolarHBondContact OE1-OH 2.99Å; E560-K620 WeakPolarHBondContact OE1-CE 3.37Å; E560-K620 IonicContact OE1-NZ 3.92Å; E560-K620 PolarHBondContact OE1-NZ 3.06Å; E560-K620 WeakPolarHBondContact OE2-CE 3.21Å; E560-K620 IonicContact OE2-NZ 2.62Å; E560-K620 PolarHBondContact OE2-NZ 3.27Å
561	E	82.8	Confident	79.7	Confident	128 Å²	128	64.2 Å²	64.2	60%	0.598	33%	0.331	S	S	*	.			trans	-67.4	117.4	-174	-60.5	-179.5	155.5	0	0	111.5	K563	E561-K563 PolarHBondContact O-N 3.1Å; E561-K563 WeakPolarHBondContact OE2-CE 3.49Å; E561-K563 IonicContact OE2-NZ 2.94Å; E561-K563 PolarHBondContact OE2-NZ 3.2Å
562	V	86.2	Confident	80.7	Confident	9 Å²	9	63.9 Å²	63.9	6%	0.055	34%	0.339	C	S	.	.			trans	-98.4	78.7	-178.5	-170.8	0	0	0	0	111	E560 E564 L582 E583 V586 Y615	E560-V562 PolarHBondContact O-N 2.99Å; V562-E564 WeakPolarHBondContact CG1-O 3.11Å; V562-L582 HydrophobicContact CG1-CD2 3.63Å; V562-L582 HydrophobicContact CG1-CG 4.01Å; V562-E583 HydrophobicContact CB-CB 4.18Å; V562-E583 HydrophobicContact CG2-CB 4.12Å; V562-V586 HydrophobicContact CG2-CB 4.38Å; V562-V586 HydrophobicContact CG2-CG1 4.47Å; V562-V586 HydrophobicContact CG2-CG2 4.36Å; V562-Y615 HydrophobicContact CG1-CD2 4.11Å; V562-Y615 HydrophobicContact CG1-CE2 3.74Å; V562-Y615 HydrophobicContact CG2-CE2 4.15Å
563	K	80.6	Confident	81.7	Confident	157 Å²	157	73 Å²	73	68%	0.683	37%	0.373	S	S	*	.			trans	-75.7	-19.6	-177.9	-67.4	175.6	-177.9	164.6	0	114.5	E561	E561-K563 PolarHBondContact O-N 3.1Å; E561-K563 WeakPolarHBondContact OE2-CE 3.49Å; E561-K563 IonicContact OE2-NZ 2.94Å; E561-K563 PolarHBondContact OE2-NZ 3.2Å
564	E	85.3	Confident	82.6	Confident	135 Å²	135	70.9 Å²	70.9	63%	0.631	36%	0.359	S	S	*	.	S	Bend	trans	-134.4	148	-177.9	-64.1	-177.4	158.6	0	0	111	V562	V562-E564 WeakPolarHBondContact CG1-O 3.11Å
565	Q	89.2	Confident	83.5	Confident	48 Å²	48	71.1 Å²	71.1	22%	0.224	36%	0.358	C	S	.	.			trans	-70.3	159.7	170.7	72.4	-168.4	49.8	0	0	111.7	L569 G572 L574	Q565-L569 HydrophobicContact CB-CD2 3.97Å; Q565-L569 HydrophobicContact CG-CB 4.4Å; Q565-L569 HydrophobicContact CG-CD2 4.32Å; Q565-L569 PolarHBondContact NE2-O 3.46Å; Q565-G572 PolarHBondContact NE2-O 3.44Å; Q565-L574 HydrophobicContact CB-CD1 3.76Å; Q565-L574 HydrophobicContact CB-CG 4.11Å
566	A	88.9	Confident	84.4	Confident	2 Å²	2	76.1 Å²	76.1	2%	0.017	38%	0.378	C	S	.	.			trans	-59.4	140.8	173.1	0	0	0	0	0	110.3	I568 L569 E618	A566-I568 PolarHBondContact O-N 2.98Å; A566-L569 WeakPolarHBondContact O-CA 3.07Å; A566-L569 VanDerWaalsContact O-CB 3.26Å; A566-L569 WeakPolarHBondContact O-CB 3.31Å; A566-L569 PolarHBondContact O-N 2.74Å; A566-E618 WeakPolarHBondContact CA-OE2 3.27Å; A566-E618 WeakPolarHBondContact CB-OE2 3.44Å
567	S	88.7	Confident	85.1	Confident	92 Å²	92	76.7 Å²	76.7	64%	0.643	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.3	175.6	64.4	0	0	0	0	112.8	L569 E618	S567-L569 PolarHBondContact O-N 3.08Å; S567-E618 WeakPolarHBondContact CB-OE1 3.38Å; S567-E618 PolarHBondContact N-OE1 2.68Å; S567-E618 VanDerWaalsContact N-OE1 3.12Å; S567-E618 PolarHBondContact N-OE2 2.97Å; S567-E618 PolarHBondContact OG-OE1 2.9Å; S567-E618 PolarHBondContact OG-OE2 3.45Å
568	I	89.1	Confident	86	Confident	37 Å²	37	73.9 Å²	73.9	19%	0.19	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.9	167.3	-63.6	174	0	0	0	112.6	A566 V570 T614 M617 E618 S648 V649	A566-I568 PolarHBondContact O-N 2.98Å; I568-V570 PolarHBondContact O-N 3.26Å; I568-T614 HydrophobicContact CB-CG2 4.14Å; I568-T614 HydrophobicContact CG2-CG2 3.48Å; I568-T614 VanDerWaalsContact CG2-CG2 3.48Å; I568-M617 HydrophobicContact CD1-CB 4.34Å; I568-E618 HydrophobicContact CD1-CB 3.92Å; I568-E618 HydrophobicContact CG1-CB 4.49Å; I568-E618 WeakPolarHBondContact CG1-OE2 3.31Å; I568-E618 PolarHBondContact N-OE2 3.28Å; I568-S648 WeakPolarHBondContact CG2-OG 3.31Å; I568-V649 HydrophobicContact CG2-CG2 4.3Å
569	L	90.6	Very high	86.5	Confident	6 Å²	6	72 Å²	72	3%	0.031	34%	0.342	C	S	.	.			trans	-87.8	104.1	-178.2	-161.3	79.8	0	0	0	110.8	Q565 A566 S567 L574 I610 A611 W645	Q565-L569 HydrophobicContact CB-CD2 3.97Å; Q565-L569 HydrophobicContact CG-CB 4.4Å; Q565-L569 HydrophobicContact CG-CD2 4.32Å; Q565-L569 PolarHBondContact NE2-O 3.46Å; A566-L569 WeakPolarHBondContact O-CA 3.07Å; A566-L569 VanDerWaalsContact O-CB 3.26Å; A566-L569 WeakPolarHBondContact O-CB 3.31Å; A566-L569 PolarHBondContact O-N 2.74Å; S567-L569 PolarHBondContact O-N 3.08Å; L569-L574 HydrophobicContact CD2-CD1 3.95Å; L569-L574 HydrophobicContact CD2-CD2 3.77Å; L569-L574 HydrophobicContact CD2-CG 3.72Å; L569-I610 HydrophobicContact CD1-CG2 3.87Å; L569-A611 HydrophobicContact CD2-CB 4.29Å; L569-W645 WeakPolarHBondContact CA-O 3.14Å; L569-W645 HydrophobicContact CD1-CB 3.91Å; L569-W645 HydrophobicContact CD1-CE3 4.27Å; L569-W645 HydrophobicContact CD2-CE3 4.29Å; L569-W645 HydrophobicContact CG-CE3 4.07Å
570	V	89.9	Confident	87.2	Confident	63 Å²	63	70.7 Å²	70.7	38%	0.382	34%	0.337	S	S	.	.			trans	-114.5	171	-171.4	-162.1	0	0	0	0	111	I568 G572 W645	I568-V570 PolarHBondContact O-N 3.26Å; V570-G572 PolarHBondContact O-N 3.42Å; V570-G572 VanDerWaalsContact O-N 3.14Å; V570-W645 PolarHBondContact N-O 2.91Å
571	H	81.8	Confident	87.4	Confident	136 Å²	136	68.4 Å²	68.4	63%	0.63	33%	0.327	S	S	*	.	S	Bend	trans	63.7	15.5	173.2	-55.3	-76.6	0	0	0	116.7	R644	H571-R644 HydrophobicContact CB-CG 4.38Å; H571-R644 PolarHBondContact CD2-O 2.94Å
572	G	82.4	Confident	87.9	Confident	29 Å²	29	62.3 Å²	62.3	30%	0.299	30%	0.298	S	S	.	.	S	Bend	trans	-172.8	173	167.7	0	0	0	0	0	112.3	Q565 V570 W645	Q565-G572 PolarHBondContact NE2-O 3.44Å; V570-G572 PolarHBondContact O-N 3.42Å; V570-G572 VanDerWaalsContact O-N 3.14Å; G572-W645 VanDerWaalsContact CA-CZ3 3.49Å
573	R	87	Confident	88.2	Confident	226 Å²	226	65 Å²	65	85%	0.853	31%	0.31	S	S	*	.			trans	-113.9	140.5	170.8	-69.8	-175.3	177.8	-173.5	-0.9	109.8
574	L	88.9	Confident	88.7	Confident	16 Å²	16	58 Å²	58	8%	0.084	28%	0.28	C	S	.	.			trans	-68.5	137.9	170.8	-65.4	-179.8	0	0	0	110.8	Q565 L569 Q578 L579 L582 I607 A611	Q565-L574 HydrophobicContact CB-CD1 3.76Å; Q565-L574 HydrophobicContact CB-CG 4.11Å; L569-L574 HydrophobicContact CD2-CD1 3.95Å; L569-L574 HydrophobicContact CD2-CD2 3.77Å; L569-L574 HydrophobicContact CD2-CG 3.72Å; L574-Q578 HydrophobicContact CB-CB 4.24Å; L574-Q578 HydrophobicContact CD2-CB 4.24Å; L574-L579 HydrophobicContact CB-CD2 3.97Å; L574-L579 HydrophobicContact CB-CG 3.95Å; L574-L579 HydrophobicContact CD1-CD2 3.75Å; L574-L579 HydrophobicContact CD1-CG 4.47Å; L574-L579 HydrophobicContact CG-CD2 4.49Å; L574-L582 HydrophobicContact CD1-CD2 4.07Å; L574-I607 HydrophobicContact CD2-CG2 3.58Å; L574-A611 HydrophobicContact CD1-CB 3.93Å; L574-A611 HydrophobicContact CD2-CB 4.44Å
575	K	87.9	Confident	89.1	Confident	65 Å²	65	51.6 Å²	51.6	28%	0.283	25%	0.25	S	C	.	.			trans	-72.9	157.7	168.8	-72.5	178.2	167.9	169.4	0	110.3	Y577 Q578 L579 E805	K575-Y577 VanDerWaalsContact C-N 3.34Å; K575-Y577 HydrophobicContact CB-CD1 3.88Å; K575-Y577 HydrophobicContact CB-CE1 3.71Å; K575-Y577 HydrophobicContact CD-CE1 3.75Å; K575-Y577 HydrophobicContact CG-CE1 4.37Å; K575-Y577 PolarHBondContact O-N 3.17Å; K575-Q578 HydrophobicContact CB-CG 4.15Å; K575-Q578 WeakPolarHBondContact O-CA 3.4Å; K575-Q578 VanDerWaalsContact O-CB 3.29Å; K575-Q578 WeakPolarHBondContact O-CB 3.3Å; K575-Q578 PolarHBondContact O-N 3.25Å; K575-L579 PolarHBondContact O-N 2.82Å; K575-E805 IonicContact NZ-OE1 2.78Å; K575-E805 PolarHBondContact NZ-OE1 3.4Å; K575-E805 IonicContact NZ-OE2 3.45Å; K575-E805 PolarHBondContact NZ-OE2 3.36Å
576	E	86.9	Confident	89.3	Confident	123 Å²	123	49.3 Å²	49.3	58%	0.575	24%	0.239	S	C	*	.	H	α-helix	trans	-56	-44.5	-174.7	-163	-155.1	137.1	0	0	112.9	Q578 L579 R580	E576-Q578 PolarHBondContact O-N 2.88Å; E576-L579 WeakPolarHBondContact O-CB 3.43Å; E576-L579 PolarHBondContact O-N 2.77Å; E576-L579 VanDerWaalsContact O-N 3.1Å; E576-R580 PolarHBondContact O-N 3.26Å; E576-R580 IonicContact OE1-CZ 3.71Å; E576-R580 IonicContact OE1-NE 2.73Å; E576-R580 PolarHBondContact OE1-NE 3.18Å; E576-R580 IonicContact OE1-NH2 2.7Å; E576-R580 PolarHBondContact OE1-NH2 2.75Å
577	Y	88.2	Confident	89.3	Confident	15 Å²	15	49.5 Å²	49.5	6%	0.059	24%	0.24	C	C	.	.	H	α-helix	trans	-63.3	-29.7	176.2	79.6	-94.2	0	0	0	112.4	K575 G581 L603 R799 V804	K575-Y577 VanDerWaalsContact C-N 3.34Å; K575-Y577 HydrophobicContact CB-CD1 3.88Å; K575-Y577 HydrophobicContact CB-CE1 3.71Å; K575-Y577 HydrophobicContact CD-CE1 3.75Å; K575-Y577 HydrophobicContact CG-CE1 4.37Å; K575-Y577 PolarHBondContact O-N 3.17Å; Y577-G581 PolarHBondContact O-N 2.96Å; Y577-L603 HydrophobicContact CE2-CB 4.08Å; Y577-L603 HydrophobicContact CE2-CD2 4.32Å; Y577-L603 VanDerWaalsContact CE2-O 3.27Å; Y577-L603 WeakPolarHBondContact CE2-O 3.36Å; Y577-L603 PolarHBondContact OH-O 3.31Å; Y577-R799 PolarHBondContact O-NH1 3.2Å; Y577-V804 HydrophobicContact CD1-CB 3.66Å; Y577-V804 HydrophobicContact CD1-CG1 4.34Å; Y577-V804 HydrophobicContact CD1-CG2 3.9Å; Y577-V804 HydrophobicContact CD2-CB 4.5Å; Y577-V804 HydrophobicContact CD2-CG1 4.47Å; Y577-V804 HydrophobicContact CD2-CG2 4.45Å; Y577-V804 HydrophobicContact CE1-CB 4.27Å; Y577-V804 HydrophobicContact CE1-CG2 4Å; Y577-V804 HydrophobicContact CG-CB 3.81Å; Y577-V804 HydrophobicContact CG-CG1 3.97Å; Y577-V804 HydrophobicContact CG-CG2 4.15Å
578	Q	91.1	Very high	89.4	Confident	11 Å²	11	45.2 Å²	45.2	5%	0.051	21%	0.21	C	C	.	.	H	α-helix	trans	-73	-33.2	175.9	-57.3	173.4	-14	0	0	111.2	L574 K575 E576 G581 L582 Q608	L574-Q578 HydrophobicContact CB-CB 4.24Å; L574-Q578 HydrophobicContact CD2-CB 4.24Å; K575-Q578 HydrophobicContact CB-CG 4.15Å; K575-Q578 WeakPolarHBondContact O-CA 3.4Å; K575-Q578 VanDerWaalsContact O-CB 3.29Å; K575-Q578 WeakPolarHBondContact O-CB 3.3Å; K575-Q578 PolarHBondContact O-N 3.25Å; E576-Q578 PolarHBondContact O-N 2.88Å; Q578-G581 PolarHBondContact O-N 3.06Å; Q578-L582 WeakPolarHBondContact O-CB 3.49Å; Q578-L582 PolarHBondContact O-N 2.92Å; Q578-Q608 HydrophobicContact CB-CG 4.02Å; Q578-Q608 HydrophobicContact CG-CG 4.26Å
579	L	90.7	Very high	89.5	Confident	36 Å²	36	45 Å²	45	19%	0.188	21%	0.207	C	C	.	.	H	α-helix	trans	-67.4	-47.8	170.7	-69.1	169.2	0	0	0	111.3	L574 K575 E576 G581 L582 E583	L574-L579 HydrophobicContact CB-CD2 3.97Å; L574-L579 HydrophobicContact CB-CG 3.95Å; L574-L579 HydrophobicContact CD1-CD2 3.75Å; L574-L579 HydrophobicContact CD1-CG 4.47Å; L574-L579 HydrophobicContact CG-CD2 4.49Å; K575-L579 PolarHBondContact O-N 2.82Å; E576-L579 WeakPolarHBondContact O-CB 3.43Å; E576-L579 PolarHBondContact O-N 2.77Å; E576-L579 VanDerWaalsContact O-N 3.1Å; L579-G581 PolarHBondContact O-N 2.87Å; L579-L582 WeakPolarHBondContact O-CB 3.35Å; L579-L582 PolarHBondContact O-N 3.02Å; L579-L582 VanDerWaalsContact O-N 3.12Å; L579-E583 WeakPolarHBondContact O-CB 3.46Å; L579-E583 PolarHBondContact O-N 3.42Å
580	R	88.9	Confident	89.5	Confident	103 Å²	103	46.1 Å²	46.1	39%	0.389	21%	0.213	S	C	.	.	H	α-helix	trans	-58.1	-36.4	173.1	-66.1	-178.8	-176.3	-127.3	2.4	112.4	E576 W584	E576-R580 PolarHBondContact O-N 3.26Å; E576-R580 IonicContact OE1-CZ 3.71Å; E576-R580 IonicContact OE1-NE 2.73Å; E576-R580 PolarHBondContact OE1-NE 3.18Å; E576-R580 IonicContact OE1-NH2 2.7Å; E576-R580 PolarHBondContact OE1-NH2 2.75Å; R580-W584 PolarHBondContact O-N 3.05Å
581	G	91.1	Very high	89.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69.4	-40.3	174.9	0	0	0	0	0	113	Y577 Q578 L579 W584 L585	Y577-G581 PolarHBondContact O-N 2.96Å; Q578-G581 PolarHBondContact O-N 3.06Å; L579-G581 PolarHBondContact O-N 2.87Å; G581-W584 PolarHBondContact O-N 3.32Å; G581-L585 VanDerWaalsContact O-CG 3.25Å; G581-L585 WeakPolarHBondContact O-CG 3.48Å; G581-L585 PolarHBondContact O-N 2.77Å
582	L	93.1	Very high	89.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-44.5	173	176.3	60.7	0	0	0	111.7	V562 L574 Q578 L579 L585 V586 A611 L612	V562-L582 HydrophobicContact CG1-CD2 3.63Å; V562-L582 HydrophobicContact CG1-CG 4.01Å; L574-L582 HydrophobicContact CD1-CD2 4.07Å; Q578-L582 WeakPolarHBondContact O-CB 3.49Å; Q578-L582 PolarHBondContact O-N 2.92Å; L579-L582 WeakPolarHBondContact O-CB 3.35Å; L579-L582 PolarHBondContact O-N 3.02Å; L579-L582 VanDerWaalsContact O-N 3.12Å; L582-L585 PolarHBondContact O-N 2.92Å; L582-V586 HydrophobicContact CD1-CG2 4.19Å; L582-V586 WeakPolarHBondContact O-CB 3.37Å; L582-V586 VanDerWaalsContact O-CG2 3.3Å; L582-V586 WeakPolarHBondContact O-CG2 3.26Å; L582-V586 PolarHBondContact O-N 3.4Å; L582-A611 HydrophobicContact CD1-CB 4.08Å; L582-A611 HydrophobicContact CD2-CB 4.02Å; L582-L612 HydrophobicContact CD1-CB 4.11Å; L582-L612 HydrophobicContact CD1-CD1 4.5Å
583	E	92.1	Very high	89.6	Confident	64 Å²	64	43.8 Å²	43.8	30%	0.299	20%	0.196	S	C	.	.	H	α-helix	trans	-58	-47.5	174.3	174.6	173.8	-158.4	0	0	112	V562 L579 L585 V586 S587	V562-E583 HydrophobicContact CB-CB 4.18Å; V562-E583 HydrophobicContact CG2-CB 4.12Å; L579-E583 WeakPolarHBondContact O-CB 3.46Å; L579-E583 PolarHBondContact O-N 3.42Å; E583-L585 PolarHBondContact O-N 3.02Å; E583-V586 PolarHBondContact O-N 3.47Å; E583-S587 WeakPolarHBondContact O-CB 3.48Å; E583-S587 PolarHBondContact O-N 2.81Å
584	W	91.5	Very high	89.8	Confident	12 Å²	12	33.8 Å²	33.8	5%	0.045	16%	0.16	C	C	.	.	H	α-helix	trans	-59.5	-45.1	175.6	-179.5	75.5	0	0	0	112.2	H556 R580 G581 V586 S587 L588 I596 L797	H556-W584 AromaticContact CE1-CD1 3.33Å; H556-W584 AromaticContact CE1-NE1 3.25Å; H556-W584 PolarHBondContact CE1-NE1 3.45Å; H556-W584 AromaticContact NE2-CD1 3.53Å; H556-W584 AromaticContact NE2-NE1 3.17Å; H556-W584 PolarHBondContact NE2-NE1 2.79Å; H556-W584 VanDerWaalsContact NE2-NE1 3.17Å; R580-W584 PolarHBondContact O-N 3.05Å; G581-W584 PolarHBondContact O-N 3.32Å; W584-V586 PolarHBondContact O-N 3.45Å; W584-S587 PolarHBondContact O-N 3.28Å; W584-L588 HydrophobicContact CD2-CD1 4.12Å; W584-L588 HydrophobicContact CD2-CG 4.49Å; W584-L588 HydrophobicContact CE3-CD1 4.04Å; W584-L588 HydrophobicContact CH2-CD1 3.63Å; W584-L588 HydrophobicContact CZ2-CD1 3.69Å; W584-L588 HydrophobicContact CZ2-CG 4.39Å; W584-L588 HydrophobicContact CZ3-CD1 3.81Å; W584-L588 PolarHBondContact O-N 3.19Å; W584-I596 WeakPolarHBondContact CH2-O 3.4Å; W584-L797 HydrophobicContact CB-CD2 4.2Å; W584-L797 HydrophobicContact CD2-CB 3.94Å; W584-L797 HydrophobicContact CD2-CD2 3.88Å; W584-L797 HydrophobicContact CE3-CB 3.78Å; W584-L797 HydrophobicContact CE3-CD2 3.69Å; W584-L797 HydrophobicContact CE3-CG 4.4Å; W584-L797 HydrophobicContact CG-CD2 4.11Å; W584-L797 HydrophobicContact CH2-CB 3.75Å; W584-L797 HydrophobicContact CZ2-CB 3.91Å; W584-L797 HydrophobicContact CZ3-CB 3.69Å; W584-L797 HydrophobicContact CZ3-CD2 4.35Å
585	L	93.1	Very high	89.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.1	-37.8	176.1	-70	169.8	0	0	0	112.9	G581 L582 E583 Y589 L612 L727	G581-L585 VanDerWaalsContact O-CG 3.25Å; G581-L585 WeakPolarHBondContact O-CG 3.48Å; G581-L585 PolarHBondContact O-N 2.77Å; L582-L585 PolarHBondContact O-N 2.92Å; E583-L585 PolarHBondContact O-N 3.02Å; L585-Y589 WeakPolarHBondContact O-CB 3.46Å; L585-Y589 PolarHBondContact O-N 3.23Å; L585-L612 HydrophobicContact CB-CD1 3.95Å; L585-L612 HydrophobicContact CB-CD2 4.1Å; L585-L612 HydrophobicContact CB-CG 4.48Å; L585-L612 HydrophobicContact CD1-CB 4.47Å; L585-L612 HydrophobicContact CD1-CD2 4.32Å; L585-L727 HydrophobicContact CD2-CD1 3.67Å; L585-L727 HydrophobicContact CD2-CD2 3.89Å; L585-L727 HydrophobicContact CD2-CG 4.44Å
586	V	92.6	Very high	90.1	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-68.8	-38.5	175	167.5	0	0	0	0	111	E560 V562 L582 E583 W584 Y589 N590 L612 Y615	E560-V586 HydrophobicContact CB-CG1 4.22Å; E560-V586 HydrophobicContact CG-CG1 4.28Å; E560-V586 VanDerWaalsContact OE2-CG1 3.22Å; E560-V586 WeakPolarHBondContact OE2-CG1 3.25Å; V562-V586 HydrophobicContact CG2-CB 4.38Å; V562-V586 HydrophobicContact CG2-CG1 4.47Å; V562-V586 HydrophobicContact CG2-CG2 4.36Å; L582-V586 HydrophobicContact CD1-CG2 4.19Å; L582-V586 WeakPolarHBondContact O-CB 3.37Å; L582-V586 VanDerWaalsContact O-CG2 3.3Å; L582-V586 WeakPolarHBondContact O-CG2 3.26Å; L582-V586 PolarHBondContact O-N 3.4Å; E583-V586 PolarHBondContact O-N 3.47Å; W584-V586 PolarHBondContact O-N 3.45Å; V586-Y589 WeakPolarHBondContact O-CB 3.36Å; V586-Y589 PolarHBondContact O-N 3.47Å; V586-N590 WeakPolarHBondContact O-CB 3.43Å; V586-N590 VanDerWaalsContact O-CG 3.25Å; V586-N590 PolarHBondContact O-N 3.43Å; V586-N590 PolarHBondContact O-ND2 2.89Å; V586-L612 HydrophobicContact CG2-CD1 4Å; V586-Y615 HydrophobicContact CG1-CD1 4.49Å; V586-Y615 HydrophobicContact CG1-CE1 3.92Å; V586-Y615 HydrophobicContact CG2-CD1 3.63Å; V586-Y615 HydrophobicContact CG2-CE1 3.83Å; V586-Y615 HydrophobicContact CG2-CG 4.29Å
587	S	89.9	Confident	90.3	Very high	6 Å²	6	24.2 Å²	24.2	4%	0.042	12%	0.115	C	C	.	.	H	α-helix	trans	-64.7	-44.6	173.5	-177.4	0	0	0	0	111.9	H556 V558 E583 W584 Y589 N590 N591	H556-S587 PolarHBondContact ND1-OG 2.74Å; V558-S587 PolarHBondContact O-OG 2.84Å; E583-S587 WeakPolarHBondContact O-CB 3.48Å; E583-S587 PolarHBondContact O-N 2.81Å; W584-S587 PolarHBondContact O-N 3.28Å; S587-Y589 VanDerWaalsContact C-N 3.31Å; S587-Y589 PolarHBondContact O-N 2.86Å; S587-N590 PolarHBondContact O-N 3.48Å; S587-N591 PolarHBondContact O-N 3.25Å; S587-N591 PolarHBondContact O-ND2 2.57Å; S587-N591 PolarHBondContact OG-ND2 3.41Å
588	L	90.4	Very high	90.4	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-56.1	-46.8	172.7	-72.3	178.7	0	0	0	111.5	W584 N590 N591 N592 L593	W584-L588 HydrophobicContact CD2-CD1 4.12Å; W584-L588 HydrophobicContact CD2-CG 4.49Å; W584-L588 HydrophobicContact CE3-CD1 4.04Å; W584-L588 HydrophobicContact CH2-CD1 3.63Å; W584-L588 HydrophobicContact CZ2-CD1 3.69Å; W584-L588 HydrophobicContact CZ2-CG 4.39Å; W584-L588 HydrophobicContact CZ3-CD1 3.81Å; W584-L588 PolarHBondContact O-N 3.19Å; L588-N590 PolarHBondContact O-N 2.91Å; L588-N591 PolarHBondContact O-N 3.05Å; L588-N592 PolarHBondContact O-N 3.41Å; L588-N592 VanDerWaalsContact O-N 3.09Å; L588-L593 HydrophobicContact CD2-CB 3.75Å; L588-L593 HydrophobicContact CD2-CD1 4.28Å; L588-L593 PolarHBondContact O-N 3.49Å
589	Y	91.4	Very high	90.3	Very high	32 Å²	32	23 Å²	23	13%	0.125	11%	0.11	C	C	.	.	H	α-helix	trans	-58.6	-46.9	176.9	177	-94.5	0	0	0	112.4	L585 V586 S587 N592 L616 K620 Y697 Y725	L585-Y589 WeakPolarHBondContact O-CB 3.46Å; L585-Y589 PolarHBondContact O-N 3.23Å; V586-Y589 WeakPolarHBondContact O-CB 3.36Å; V586-Y589 PolarHBondContact O-N 3.47Å; S587-Y589 VanDerWaalsContact C-N 3.31Å; S587-Y589 PolarHBondContact O-N 2.86Å; Y589-N592 PolarHBondContact O-N 3.46Å; Y589-L616 HydrophobicContact CD1-CD2 3.56Å; Y589-L616 HydrophobicContact CD2-CD1 4.15Å; Y589-L616 HydrophobicContact CD2-CD2 4.07Å; Y589-L616 HydrophobicContact CE1-CD2 3.59Å; Y589-L616 HydrophobicContact CE2-CD1 4.23Å; Y589-L616 HydrophobicContact CE2-CD2 4.09Å; Y589-L616 HydrophobicContact CG-CD2 3.81Å; Y589-K620 HydrophobicContact CE1-CG 4.32Å; Y589-Y697 HydrophobicContact CD2-CD2 4.31Å; Y589-Y697 AromaticContact CD2-CE2 3.92Å; Y589-Y697 HydrophobicContact CD2-CE2 3.92Å; Y589-Y725 AromaticContact CD2-CD1 3.7Å; Y589-Y725 HydrophobicContact CD2-CD1 3.7Å; Y589-Y725 HydrophobicContact CD2-CD2 4.05Å; Y589-Y725 AromaticContact CD2-CE1 3.65Å; Y589-Y725 HydrophobicContact CD2-CE1 3.65Å; Y589-Y725 HydrophobicContact CD2-CE2 4.04Å; Y589-Y725 AromaticContact CD2-CG 3.92Å; Y589-Y725 HydrophobicContact CD2-CG 3.92Å; Y589-Y725 AromaticContact CD2-CZ 3.85Å; Y589-Y725 HydrophobicContact CE2-CD1 4.1Å; Y589-Y725 AromaticContact CE2-CD2 3.68Å; Y589-Y725 HydrophobicContact CE2-CD2 3.68Å; Y589-Y725 AromaticContact CE2-CE1 3.81Å; Y589-Y725 HydrophobicContact CE2-CE1 3.81Å; Y589-Y725 AromaticContact CE2-CE2 3.4Å; Y589-Y725 HydrophobicContact CE2-CE2 3.4Å; Y589-Y725 VanDerWaalsContact CE2-CE2 3.4Å; Y589-Y725 HydrophobicContact CE2-CG 4.05Å; Y589-Y725 AromaticContact CE2-CZ 3.49Å; Y589-Y725 VanDerWaalsContact CE2-CZ 3.49Å; Y589-Y725 HydrophobicContact CG-CE1 4.35Å; Y589-Y725 WeakPolarHBondContact O-CE1 3.21Å
590	N	89.9	Confident	89.8	Confident	31 Å²	31	23.3 Å²	23.3	17%	0.166	11%	0.111	C	C	.	.	H	α-helix	trans	-63.3	-41.3	178.9	-72.4	-28.8	0	0	0	112.7	V558 E560 V586 S587 L588 N592 K620	V558-N590 HydrophobicContact CB-CB 4.12Å; V558-N590 HydrophobicContact CG1-CB 3.78Å; E560-N590 PolarHBondContact OE2-ND2 3.41Å; V586-N590 WeakPolarHBondContact O-CB 3.43Å; V586-N590 VanDerWaalsContact O-CG 3.25Å; V586-N590 PolarHBondContact O-N 3.43Å; V586-N590 PolarHBondContact O-ND2 2.89Å; S587-N590 PolarHBondContact O-N 3.48Å; L588-N590 PolarHBondContact O-N 2.91Å; N590-N592 PolarHBondContact O-N 3.47Å; N590-N592 PolarHBondContact O-ND2 2.92Å; N590-K620 PolarHBondContact OD1-NZ 2.88Å
591	N	85.3	Confident	89.5	Confident	34 Å²	34	19.4 Å²	19.4	18%	0.182	10%	0.097	C	C	.	.	H	α-helix	trans	-79.1	-1.4	178.2	-66.1	-75.3	0	0	0	113.1	A555 V558 S587 L588 L593	A555-N591 WeakPolarHBondContact O-CB 3.42Å; A555-N591 VanDerWaalsContact O-CG 3.25Å; V558-N591 WeakPolarHBondContact CB-OD1 3.36Å; V558-N591 WeakPolarHBondContact CG2-OD1 3.43Å; V558-N591 PolarHBondContact N-OD1 3.12Å; V558-N591 PolarHBondContact O-ND2 2.81Å; S587-N591 PolarHBondContact O-N 3.25Å; S587-N591 PolarHBondContact O-ND2 2.57Å; S587-N591 PolarHBondContact OG-ND2 3.41Å; L588-N591 PolarHBondContact O-N 3.05Å; N591-L593 VanDerWaalsContact C-N 3.27Å; N591-L593 HydrophobicContact CB-CD1 4.15Å; N591-L593 HydrophobicContact CB-CG 4.02Å; N591-L593 PolarHBondContact O-N 2.87Å
592	N	86.2	Confident	88.8	Confident	107 Å²	107	20.3 Å²	20.3	57%	0.572	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	32.3	-175.4	-53	-85.7	0	0	0	114.3	L588 Y589 N590 Y725	L588-N592 PolarHBondContact O-N 3.41Å; L588-N592 VanDerWaalsContact O-N 3.09Å; Y589-N592 PolarHBondContact O-N 3.46Å; N590-N592 PolarHBondContact O-N 3.47Å; N590-N592 PolarHBondContact O-ND2 2.92Å; N592-Y725 HydrophobicContact CB-CE1 4.41Å; N592-Y725 PolarHBondContact OD1-OH 3.22Å
593	L	86.1	Confident	88.4	Confident	38 Å²	38	20.4 Å²	20.4	20%	0.199	11%	0.107	C	C	.	.			trans	-96.3	160.2	175.8	-59.7	-178.4	0	0	0	111.5	A555 L588 N591 F795	A555-L593 HydrophobicContact CB-CD1 3.94Å; A555-L593 WeakPolarHBondContact O-CD1 3.3Å; L588-L593 HydrophobicContact CD2-CB 3.75Å; L588-L593 HydrophobicContact CD2-CD1 4.28Å; L588-L593 PolarHBondContact O-N 3.49Å; N591-L593 VanDerWaalsContact C-N 3.27Å; N591-L593 HydrophobicContact CB-CD1 4.15Å; N591-L593 HydrophobicContact CB-CG 4.02Å; N591-L593 PolarHBondContact O-N 2.87Å; L593-F795 HydrophobicContact CD1-CE1 4.23Å; L593-F795 HydrophobicContact CD2-CE1 4.39Å
594	N	91.1	Very high	88.1	Confident	16 Å²	16	18 Å²	18	9%	0.086	10%	0.1	C	C	.	.			trans	-112.5	155.6	175.4	-65.9	-35.3	0	0	0	108.9	P724 Y725 R726 L748	N594-P724 PolarHBondContact OD1-O 3.02Å; N594-Y725 WeakPolarHBondContact OD1-CA 3.38Å; N594-R726 WeakPolarHBondContact CA-O 3.39Å; N594-R726 HydrophobicContact CB-CB 4.19Å; N594-R726 WeakPolarHBondContact CB-O 3.47Å; N594-R726 PolarHBondContact OD1-N 3.17Å; N594-L748 HydrophobicContact CB-CB 4.14Å; N594-L748 HydrophobicContact CB-CD2 3.69Å; N594-L748 PolarHBondContact ND2-O 3.3Å
595	G	89.6	Confident	88.1	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.01	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	176	-176.2	0	0	0	0	0	116.5	R726 L728 F795	G595-R726 PolarHBondContact N-O 3.1Å; G595-L728 PolarHBondContact O-N 2.87Å; G595-F795 CarbonylContact C-O 3.53Å; G595-F795 VanDerWaalsContact CA-O 3.3Å; G595-F795 WeakPolarHBondContact CA-O 3.32Å
596	I	91.9	Very high	88.1	Confident	1 Å²	1	19.7 Å²	19.7	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	117.3	177.2	-52.2	178.2	0	0	0	108.8	W584 A598 L728 T730 L744 L748 F795 L796 L797	W584-I596 WeakPolarHBondContact CH2-O 3.4Å; I596-A598 HydrophobicContact CG2-CB 4.07Å; I596-A598 PolarHBondContact O-N 2.97Å; I596-L728 CarbonylContact C-O 3.59Å; I596-L728 WeakPolarHBondContact CA-O 3.5Å; I596-L728 HydrophobicContact CG1-CB 4.33Å; I596-L728 HydrophobicContact CG1-CD1 4.42Å; I596-L728 HydrophobicContact CG2-CB 4.44Å; I596-T730 HydrophobicContact CG2-CG2 3.95Å; I596-L744 HydrophobicContact CD1-CB 4.24Å; I596-L748 HydrophobicContact CD1-CD1 3.86Å; I596-L748 HydrophobicContact CG1-CD1 3.4Å; I596-F795 PolarHBondContact N-O 3.1Å; I596-L796 HydrophobicContact CB-CD1 4.48Å; I596-L796 HydrophobicContact CB-CG 4.42Å; I596-L796 HydrophobicContact CD1-CD1 4.32Å; I596-L796 HydrophobicContact CG2-CD1 4.49Å; I596-L797 PolarHBondContact O-N 3.17Å; I596-L797 VanDerWaalsContact O-N 3.14Å
597	L	92.8	Very high	88	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	101.8	163.8	-172.1	62.4	0	0	0	108.2	K605 Q608 L727 L728 L729 T730 L797	L597-K605 HydrophobicContact CD2-CB 3.99Å; L597-K605 HydrophobicContact CD2-CD 4.44Å; L597-K605 HydrophobicContact CD2-CG 3.81Å; L597-K605 HydrophobicContact CG-CD 4.23Å; L597-K605 HydrophobicContact CG-CG 4.04Å; L597-Q608 HydrophobicContact CD2-CB 4.17Å; L597-L727 HydrophobicContact CB-CD1 4.35Å; L597-L728 PolarHBondContact N-O 3.02Å; L597-L729 HydrophobicContact CB-CD2 3.89Å; L597-L729 HydrophobicContact CD2-CD2 4.17Å; L597-T730 PolarHBondContact O-N 3.19Å; L597-T730 VanDerWaalsContact O-N 3.07Å; L597-L797 HydrophobicContact CD1-CB 4.39Å; L597-L797 HydrophobicContact CD1-CD2 4.02Å; L597-L797 HydrophobicContact CD1-CG 4.34Å
598	A	89.6	Confident	88.2	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.113	C	C	.	.			trans	-106.7	14.7	-172.6	0	0	0	0	0	113.2	I596 T730 P733 L796 L797 R798	I596-A598 HydrophobicContact CG2-CB 4.07Å; I596-A598 PolarHBondContact O-N 2.97Å; A598-T730 HydrophobicContact CB-CG2 4.48Å; A598-P733 HydrophobicContact CB-CG 3.64Å; A598-L796 HydrophobicContact CB-CD1 4.1Å; A598-L796 HydrophobicContact CB-CD2 3.9Å; A598-L796 HydrophobicContact CB-CG 3.76Å; A598-L797 CarbonylContact C-O 3.55Å; A598-L797 VanDerWaalsContact CA-O 3.32Å; A598-L797 WeakPolarHBondContact CA-O 3.38Å; A598-L797 WeakPolarHBondContact CB-O 3.45Å; A598-L797 PolarHBondContact N-O 2.89Å; A598-R798 HydrophobicContact CB-CB 3.98Å; A598-R798 WeakPolarHBondContact O-CG 3.48Å
599	D	88.3	Confident	88.4	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.113	C	C	.	.			trans	-40.5	150.3	166.8	-79.5	-11.1	0	0	0	112.1	L603 K605 Q608 L797 R799	D599-L603 HydrophobicContact CB-CB 4.17Å; D599-L603 HydrophobicContact CB-CD1 4.05Å; D599-K605 HydrophobicContact CB-CD 4.1Å; D599-K605 HydrophobicContact CB-CG 3.91Å; D599-K605 PolarHBondContact O-NZ 3.22Å; D599-Q608 PolarHBondContact OD2-NE2 3.25Å; D599-L797 PolarHBondContact N-O 2.94Å; D599-R799 VanDerWaalsContact CG-NH2 3.26Å; D599-R799 IonicContact OD1-CZ 3.41Å; D599-R799 VanDerWaalsContact OD1-CZ 3.26Å; D599-R799 IonicContact OD1-NE 3.69Å; D599-R799 PolarHBondContact OD1-NE 2.59Å; D599-R799 IonicContact OD1-NH2 2.66Å; D599-R799 PolarHBondContact OD1-NH2 2.62Å; D599-R799 IonicContact OD2-CZ 2.65Å; D599-R799 IonicContact OD2-NE 2.62Å; D599-R799 IonicContact OD2-NH2 3.62Å; D599-R799 PolarHBondContact OD2-NH2 3.35Å
600	E	81.9	Confident	88.6	Confident	44 Å²	44	18.9 Å²	18.9	21%	0.206	11%	0.107	C	C	.	.			trans	-55.2	164	170.5	-153.3	-178	133	0	0	112.5	L603 K605 R799 L800 K801	E600-L603 HydrophobicContact CB-CD1 3.96Å; E600-L603 HydrophobicContact CB-CG 4.2Å; E600-K605 PolarHBondContact O-NZ 3.41Å; E600-R799 PolarHBondContact N-O 2.87Å; E600-L800 VanDerWaalsContact OE2-CA 3.22Å; E600-L800 WeakPolarHBondContact OE2-CA 3.17Å; E600-K801 HydrophobicContact CG-CG 4.49Å; E600-K801 WeakPolarHBondContact OE1-CD 3.27Å; E600-K801 WeakPolarHBondContact OE1-CE 3.34Å; E600-K801 WeakPolarHBondContact OE1-CG 3.28Å; E600-K801 IonicContact OE1-NZ 3.12Å; E600-K801 PolarHBondContact OE1-NZ 3.36Å; E600-K801 PolarHBondContact OE2-N 3.5Å
601	M	81.5	Confident	88.8	Confident	21 Å²	21	17.5 Å²	17.5	10%	0.103	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	154.9	172	-63.2	179.3	-75	0	0	110	L603 K801 L1016 Q1017 D1020	M601-L603 VanDerWaalsContact C-N 3.26Å; M601-L603 PolarHBondContact O-N 3.1Å; M601-L603 VanDerWaalsContact O-N 3.17Å; M601-K801 VanDerWaalsContact O-CE 3.26Å; M601-K801 WeakPolarHBondContact O-CE 3.48Å; M601-L1016 HydrophobicContact CE-CB 4.37Å; M601-Q1017 HydrophobicContact CE-CB 3.8Å; M601-Q1017 HydrophobicContact CE-CG 4.48Å; M601-Q1017 HydrophobicContact SD-CB 3.76Å; M601-Q1017 HydrophobicContact SD-CG 3.79Å; M601-Q1017 PolarHBondContact SD-NE2 3.09Å; M601-D1020 HydrophobicContact CB-CB 4.2Å; M601-D1020 WeakPolarHBondContact CB-OD2 3.44Å; M601-D1020 WeakPolarHBondContact CE-OD2 3.25Å
602	G	77.1	Confident	89.2	Confident	19 Å²	19	15.9 Å²	15.9	20%	0.196	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	-33.1	-172.7	0	0	0	0	0	115.8	G604	G602-G604 PolarHBondContact O-N 2.85Å
603	L	84	Confident	89.7	Confident	1 Å²	1	10.8 Å²	10.8	1%	0.005	6%	0.063	C	C	.	.	S	Bend	trans	-63.1	3.8	-173.2	-68.9	-171.6	0	0	0	117.3	Y577 D599 E600 M601 R799 K801 V804	Y577-L603 HydrophobicContact CE2-CB 4.08Å; Y577-L603 HydrophobicContact CE2-CD2 4.32Å; Y577-L603 VanDerWaalsContact CE2-O 3.27Å; Y577-L603 WeakPolarHBondContact CE2-O 3.36Å; Y577-L603 PolarHBondContact OH-O 3.31Å; D599-L603 HydrophobicContact CB-CB 4.17Å; D599-L603 HydrophobicContact CB-CD1 4.05Å; E600-L603 HydrophobicContact CB-CD1 3.96Å; E600-L603 HydrophobicContact CB-CG 4.2Å; M601-L603 VanDerWaalsContact C-N 3.26Å; M601-L603 PolarHBondContact O-N 3.1Å; M601-L603 VanDerWaalsContact O-N 3.17Å; L603-R799 HydrophobicContact CD1-CB 4.4Å; L603-R799 WeakPolarHBondContact CD1-O 3.25Å; L603-K801 HydrophobicContact CD2-CG 3.99Å; L603-K801 HydrophobicContact CG-CG 4.37Å; L603-V804 HydrophobicContact CD1-CG2 4.24Å; L603-V804 HydrophobicContact CD2-CG2 3.54Å
604	G	86.3	Confident	90	Very high	14 Å²	14	9 Å²	9	14%	0.144	5%	0.054	C	C	.	.			trans	83.1	32.7	170.7	0	0	0	0	0	115.2	G602 T606 I607 Q608	G602-G604 PolarHBondContact O-N 2.85Å; G604-T606 PolarHBondContact O-N 3.36Å; G604-T606 VanDerWaalsContact O-N 3.15Å; G604-I607 WeakPolarHBondContact O-CA 3.29Å; G604-I607 PolarHBondContact O-N 3.13Å; G604-Q608 PolarHBondContact O-N 3.47Å
605	K	91.2	Very high	90.2	Very high	23 Å²	23	9 Å²	9	10%	0.1	5%	0.053	C	C	.	.	H	α-helix	trans	-48.6	-37.5	172.8	-66.8	-171.2	-79.8	-88.9	0	113.3	L597 D599 E600 T609 L729 T730	L597-K605 HydrophobicContact CD2-CB 3.99Å; L597-K605 HydrophobicContact CD2-CD 4.44Å; L597-K605 HydrophobicContact CD2-CG 3.81Å; L597-K605 HydrophobicContact CG-CD 4.23Å; L597-K605 HydrophobicContact CG-CG 4.04Å; D599-K605 HydrophobicContact CB-CD 4.1Å; D599-K605 HydrophobicContact CB-CG 3.91Å; D599-K605 PolarHBondContact O-NZ 3.22Å; E600-K605 PolarHBondContact O-NZ 3.41Å; K605-T609 WeakPolarHBondContact O-CB 3.39Å; K605-T609 PolarHBondContact O-N 3.11Å; K605-T609 PolarHBondContact O-OG1 3.5Å; K605-L729 HydrophobicContact CD-CB 4.48Å; K605-T730 WeakPolarHBondContact CD-O 3.42Å; K605-T730 WeakPolarHBondContact CE-O 3.44Å; K605-T730 PolarHBondContact NZ-O 2.91Å; K605-T730 VanDerWaalsContact NZ-O 3.13Å
606	T	92	Very high	90.3	Very high	24 Å²	24	9 Å²	9	15%	0.147	5%	0.053	C	C	.	.	H	α-helix	trans	-60.6	-46.9	172.1	-55.9	0	0	0	0	112.4	G604 T609 I610 W638 E641	G604-T606 PolarHBondContact O-N 3.36Å; G604-T606 VanDerWaalsContact O-N 3.15Å; T606-T609 WeakPolarHBondContact O-CB 3.41Å; T606-T609 PolarHBondContact O-N 3.44Å; T606-I610 HydrophobicContact CG2-CD1 4.07Å; T606-I610 WeakPolarHBondContact O-CG1 3.49Å; T606-I610 PolarHBondContact O-N 3.48Å; T606-W638 HydrophobicContact CG2-CD2 3.78Å; T606-W638 HydrophobicContact CG2-CE3 3.71Å; T606-W638 HydrophobicContact CG2-CG 4.42Å; T606-W638 HydrophobicContact CG2-CH2 4.06Å; T606-W638 HydrophobicContact CG2-CZ2 4.12Å; T606-W638 HydrophobicContact CG2-CZ3 3.86Å; T606-E641 HydrophobicContact CG2-CB 4.06Å; T606-E641 HydrophobicContact CG2-CG 4.12Å
607	I	92.2	Very high	90.4	Very high	22 Å²	22	9.9 Å²	9.9	11%	0.113	6%	0.057	C	C	.	.	H	α-helix	trans	-67.8	-43.8	-179.9	-61	166.2	0	0	0	110.2	L574 G604 T609 I610 A611 W645	L574-I607 HydrophobicContact CD2-CG2 3.58Å; G604-I607 WeakPolarHBondContact O-CA 3.29Å; G604-I607 PolarHBondContact O-N 3.13Å; I607-T609 PolarHBondContact O-N 3.16Å; I607-I610 PolarHBondContact O-N 2.99Å; I607-I610 VanDerWaalsContact O-N 3.17Å; I607-A611 WeakPolarHBondContact O-CB 3.5Å; I607-A611 PolarHBondContact O-N 2.99Å; I607-W645 HydrophobicContact CD1-CH2 4.36Å; I607-W645 HydrophobicContact CD1-CZ2 3.6Å; I607-W645 HydrophobicContact CG1-CZ2 4.2Å; I607-W645 HydrophobicContact CG2-CD2 4.38Å; I607-W645 HydrophobicContact CG2-CE3 4.41Å; I607-W645 HydrophobicContact CG2-CH2 4.32Å; I607-W645 HydrophobicContact CG2-CZ2 4.32Å; I607-W645 HydrophobicContact CG2-CZ3 4.36Å
608	Q	93.6	Very high	90.3	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-58	-36.6	173	-69.3	177.9	66.9	0	0	111.7	Q578 L597 D599 G604 L612 R799	Q578-Q608 HydrophobicContact CB-CG 4.02Å; Q578-Q608 HydrophobicContact CG-CG 4.26Å; L597-Q608 HydrophobicContact CD2-CB 4.17Å; D599-Q608 PolarHBondContact OD2-NE2 3.25Å; G604-Q608 PolarHBondContact O-N 3.47Å; Q608-L612 PolarHBondContact O-N 3.29Å; Q608-R799 VanDerWaalsContact OE1-NH2 3.09Å
609	T	94.9	Very high	90.4	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-69.6	-41.9	174.9	-59.7	0	0	0	0	112.9	K605 T606 I607 A611 L612 I613 W638 I699 L729	K605-T609 WeakPolarHBondContact O-CB 3.39Å; K605-T609 PolarHBondContact O-N 3.11Å; K605-T609 PolarHBondContact O-OG1 3.5Å; T606-T609 WeakPolarHBondContact O-CB 3.41Å; T606-T609 PolarHBondContact O-N 3.44Å; I607-T609 PolarHBondContact O-N 3.16Å; T609-A611 VanDerWaalsContact C-N 3.33Å; T609-L612 PolarHBondContact O-N 2.94Å; T609-I613 HydrophobicContact CG2-CD1 4.22Å; T609-I613 WeakPolarHBondContact O-CG1 3.43Å; T609-I613 PolarHBondContact O-N 2.84Å; T609-W638 HydrophobicContact CG2-CH2 3.74Å; T609-W638 HydrophobicContact CG2-CZ3 3.87Å; T609-I699 HydrophobicContact CG2-CD1 3.57Å; T609-I699 HydrophobicContact CG2-CG2 4.1Å; T609-L729 WeakPolarHBondContact OG1-CD1 3.49Å
610	I	94.9	Very high	90.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.5	-40.6	175.2	-65.6	167.8	0	0	0	109.8	L569 T606 I607 I613 T614 E641 F642 W645	L569-I610 HydrophobicContact CD1-CG2 3.87Å; T606-I610 HydrophobicContact CG2-CD1 4.07Å; T606-I610 WeakPolarHBondContact O-CG1 3.49Å; T606-I610 PolarHBondContact O-N 3.48Å; I607-I610 PolarHBondContact O-N 2.99Å; I607-I610 VanDerWaalsContact O-N 3.17Å; I610-I613 PolarHBondContact O-N 3.2Å; I610-T614 HydrophobicContact CG2-CG2 4.27Å; I610-T614 WeakPolarHBondContact O-CB 3.5Å; I610-T614 VanDerWaalsContact O-CG2 3.3Å; I610-T614 WeakPolarHBondContact O-CG2 3.44Å; I610-T614 PolarHBondContact O-N 3.06Å; I610-T614 PolarHBondContact O-OG1 2.9Å; I610-E641 HydrophobicContact CD1-CB 3.76Å; I610-F642 HydrophobicContact CB-CE1 4.41Å; I610-F642 HydrophobicContact CD1-CD1 4.27Å; I610-F642 HydrophobicContact CD1-CD2 4.49Å; I610-F642 HydrophobicContact CD1-CG 4.23Å; I610-F642 HydrophobicContact CG1-CD1 3.97Å; I610-F642 HydrophobicContact CG1-CE1 3.77Å; I610-F642 HydrophobicContact CG1-CE2 4.31Å; I610-F642 HydrophobicContact CG1-CG 4.32Å; I610-F642 HydrophobicContact CG1-CZ 3.94Å; I610-F642 HydrophobicContact CG2-CD1 4.2Å; I610-F642 HydrophobicContact CG2-CE1 4.21Å; I610-W645 HydrophobicContact CG2-CB 4.25Å
611	A	94.4	Very high	90.8	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-42.5	174.2	0	0	0	0	0	111.9	L569 L574 L582 I607 T609 T614 Y615	L569-A611 HydrophobicContact CD2-CB 4.29Å; L574-A611 HydrophobicContact CD1-CB 3.93Å; L574-A611 HydrophobicContact CD2-CB 4.44Å; L582-A611 HydrophobicContact CD1-CB 4.08Å; L582-A611 HydrophobicContact CD2-CB 4.02Å; I607-A611 WeakPolarHBondContact O-CB 3.5Å; I607-A611 PolarHBondContact O-N 2.99Å; T609-A611 VanDerWaalsContact C-N 3.33Å; A611-T614 WeakPolarHBondContact CA-OG1 3.47Å; A611-T614 PolarHBondContact O-N 3.47Å; A611-T614 PolarHBondContact O-OG1 3.31Å; A611-T614 VanDerWaalsContact O-OG1 3.05Å; A611-Y615 WeakPolarHBondContact O-CB 3.3Å; A611-Y615 PolarHBondContact O-N 3.09Å
612	L	94.7	Very high	91.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.4	-50.7	173.3	178.1	65.4	0	0	0	111.5	L582 L585 V586 Q608 T609 T614 Y615 L616 Y697 L727	L582-L612 HydrophobicContact CD1-CB 4.11Å; L582-L612 HydrophobicContact CD1-CD1 4.5Å; L585-L612 HydrophobicContact CB-CD1 3.95Å; L585-L612 HydrophobicContact CB-CD2 4.1Å; L585-L612 HydrophobicContact CB-CG 4.48Å; L585-L612 HydrophobicContact CD1-CB 4.47Å; L585-L612 HydrophobicContact CD1-CD2 4.32Å; V586-L612 HydrophobicContact CG2-CD1 4Å; Q608-L612 PolarHBondContact O-N 3.29Å; T609-L612 PolarHBondContact O-N 2.94Å; L612-T614 VanDerWaalsContact C-N 3.34Å; L612-T614 PolarHBondContact O-N 2.84Å; L612-Y615 PolarHBondContact O-N 2.98Å; L612-L616 HydrophobicContact CD1-CD1 4.11Å; L612-L616 HydrophobicContact CD1-CG 4.11Å; L612-L616 HydrophobicContact CG-CD1 4.09Å; L612-L616 HydrophobicContact CG-CG 4.42Å; L612-L616 WeakPolarHBondContact O-CB 3.41Å; L612-L616 VanDerWaalsContact O-CG 3.25Å; L612-L616 WeakPolarHBondContact O-CG 3.43Å; L612-L616 PolarHBondContact O-N 2.93Å; L612-Y697 HydrophobicContact CD2-CE2 4.01Å; L612-L727 HydrophobicContact CD2-CD2 4.24Å
613	I	94.9	Very high	91.8	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-60.4	-44.4	-179.3	-72.8	168.6	0	0	0	111.1	T609 I610 L616 M617 F626 I628 F642 V675 I699	T609-I613 HydrophobicContact CG2-CD1 4.22Å; T609-I613 WeakPolarHBondContact O-CG1 3.43Å; T609-I613 PolarHBondContact O-N 2.84Å; I610-I613 PolarHBondContact O-N 3.2Å; I613-L616 PolarHBondContact O-N 3.31Å; I613-M617 HydrophobicContact CG2-SD 4Å; I613-M617 WeakPolarHBondContact O-CB 3.11Å; I613-M617 VanDerWaalsContact O-CG 3.26Å; I613-M617 WeakPolarHBondContact O-CG 3.34Å; I613-M617 PolarHBondContact O-N 2.77Å; I613-F626 HydrophobicContact CG2-CD2 3.88Å; I613-F626 HydrophobicContact CG2-CE2 3.88Å; I613-I628 HydrophobicContact CD1-CD1 3.73Å; I613-F642 HydrophobicContact CD1-CE1 4.5Å; I613-F642 HydrophobicContact CD1-CZ 3.98Å; I613-V675 HydrophobicContact CG2-CG2 4.2Å; I613-I699 HydrophobicContact CD1-CD1 4.09Å; I613-I699 HydrophobicContact CG1-CD1 4.38Å
614	T	93.9	Very high	91.9	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-68.5	-40.9	180	51.6	0	0	0	0	112.1	I568 I610 A611 L612 L616 M617 E618 V649	I568-T614 HydrophobicContact CB-CG2 4.14Å; I568-T614 HydrophobicContact CG2-CG2 3.48Å; I568-T614 VanDerWaalsContact CG2-CG2 3.48Å; I610-T614 HydrophobicContact CG2-CG2 4.27Å; I610-T614 WeakPolarHBondContact O-CB 3.5Å; I610-T614 VanDerWaalsContact O-CG2 3.3Å; I610-T614 WeakPolarHBondContact O-CG2 3.44Å; I610-T614 PolarHBondContact O-N 3.06Å; I610-T614 PolarHBondContact O-OG1 2.9Å; A611-T614 WeakPolarHBondContact CA-OG1 3.47Å; A611-T614 PolarHBondContact O-N 3.47Å; A611-T614 PolarHBondContact O-OG1 3.31Å; A611-T614 VanDerWaalsContact O-OG1 3.05Å; L612-T614 VanDerWaalsContact C-N 3.34Å; L612-T614 PolarHBondContact O-N 2.84Å; T614-L616 PolarHBondContact O-N 3.16Å; T614-M617 PolarHBondContact O-N 2.8Å; T614-E618 VanDerWaalsContact O-CB 3.3Å; T614-E618 WeakPolarHBondContact O-CB 3.44Å; T614-E618 PolarHBondContact O-N 3.48Å; T614-V649 HydrophobicContact CG2-CG2 4.02Å
615	Y	93.6	Very high	92.2	Very high	17 Å²	17	34.9 Å²	34.9	7%	0.067	16%	0.161	C	C	.	.	H	α-helix	trans	-61.2	-43.1	172.5	-168.6	-85.7	0	0	0	112.3	E560 V562 V586 A611 L612 E618 R619	E560-Y615 PolarHBondContact OE1-OH 2.99Å; V562-Y615 HydrophobicContact CG1-CD2 4.11Å; V562-Y615 HydrophobicContact CG1-CE2 3.74Å; V562-Y615 HydrophobicContact CG2-CE2 4.15Å; V586-Y615 HydrophobicContact CG1-CD1 4.49Å; V586-Y615 HydrophobicContact CG1-CE1 3.92Å; V586-Y615 HydrophobicContact CG2-CD1 3.63Å; V586-Y615 HydrophobicContact CG2-CE1 3.83Å; V586-Y615 HydrophobicContact CG2-CG 4.29Å; A611-Y615 WeakPolarHBondContact O-CB 3.3Å; A611-Y615 PolarHBondContact O-N 3.09Å; L612-Y615 PolarHBondContact O-N 2.98Å; Y615-E618 PolarHBondContact O-N 2.87Å; Y615-R619 HydrophobicContact CD1-CB 4.26Å; Y615-R619 HydrophobicContact CD1-CG 4.36Å; Y615-R619 HydrophobicContact CD2-CG 3.97Å; Y615-R619 HydrophobicContact CE1-CB 4Å; Y615-R619 HydrophobicContact CE1-CG 4.15Å; Y615-R619 HydrophobicContact CE2-CB 4.49Å; Y615-R619 HydrophobicContact CE2-CG 3.74Å; Y615-R619 HydrophobicContact CG-CG 4.26Å; Y615-R619 WeakPolarHBondContact O-CB 3.33Å; Y615-R619 PolarHBondContact O-N 3.05Å
616	L	93.6	Very high	92.4	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-65.2	-37.6	175.4	-69.7	-179.4	0	0	0	112.4	Y589 L612 I613 T614 K620 R621 V622 F626 Y697	Y589-L616 HydrophobicContact CD1-CD2 3.56Å; Y589-L616 HydrophobicContact CD2-CD1 4.15Å; Y589-L616 HydrophobicContact CD2-CD2 4.07Å; Y589-L616 HydrophobicContact CE1-CD2 3.59Å; Y589-L616 HydrophobicContact CE2-CD1 4.23Å; Y589-L616 HydrophobicContact CE2-CD2 4.09Å; Y589-L616 HydrophobicContact CG-CD2 3.81Å; L612-L616 HydrophobicContact CD1-CD1 4.11Å; L612-L616 HydrophobicContact CD1-CG 4.11Å; L612-L616 HydrophobicContact CG-CD1 4.09Å; L612-L616 HydrophobicContact CG-CG 4.42Å; L612-L616 WeakPolarHBondContact O-CB 3.41Å; L612-L616 VanDerWaalsContact O-CG 3.25Å; L612-L616 WeakPolarHBondContact O-CG 3.43Å; L612-L616 PolarHBondContact O-N 2.93Å; I613-L616 PolarHBondContact O-N 3.31Å; T614-L616 PolarHBondContact O-N 3.16Å; L616-K620 HydrophobicContact CD2-CB 4.19Å; L616-K620 HydrophobicContact CD2-CG 3.8Å; L616-K620 CarbonylContact O-C 3.6Å; L616-K620 WeakPolarHBondContact O-CB 3.33Å; L616-K620 PolarHBondContact O-N 2.87Å; L616-R621 PolarHBondContact O-N 2.85Å; L616-V622 PolarHBondContact O-N 3.08Å; L616-F626 HydrophobicContact CB-CZ 4.41Å; L616-Y697 HydrophobicContact CD1-CD2 3.88Å; L616-Y697 HydrophobicContact CD1-CE2 4.01Å
617	M	92.4	Very high	92.6	Very high	19 Å²	19	32.7 Å²	32.7	9%	0.094	15%	0.15	C	C	.	.	H	α-helix	trans	-68.3	-41.6	175.3	-74.5	179.9	57.5	0	0	112.4	I568 I613 T614 R621 V622 F626 V649 N674	I568-M617 HydrophobicContact CD1-CB 4.34Å; I613-M617 HydrophobicContact CG2-SD 4Å; I613-M617 WeakPolarHBondContact O-CB 3.11Å; I613-M617 VanDerWaalsContact O-CG 3.26Å; I613-M617 WeakPolarHBondContact O-CG 3.34Å; I613-M617 PolarHBondContact O-N 2.77Å; T614-M617 PolarHBondContact O-N 2.8Å; M617-R621 WeakPolarHBondContact O-CA 3.04Å; M617-V622 WeakPolarHBondContact CG-O 3.35Å; M617-F626 HydrophobicContact CG-CE2 3.94Å; M617-F626 HydrophobicContact SD-CE2 4.28Å; M617-V649 HydrophobicContact CE-CG2 4.34Å; M617-V649 HydrophobicContact SD-CG1 4.16Å; M617-V649 HydrophobicContact SD-CG2 4.09Å; M617-N674 HydrophobicContact CE-CB 4.28Å; M617-N674 HydrophobicContact SD-CB 4.23Å
618	E	91.7	Very high	92.8	Very high	47 Å²	47	31.6 Å²	31.6	22%	0.22	14%	0.144	C	C	.	.	H	α-helix	trans	-83.6	-59.7	-173.9	-173	175.8	150.8	0	0	112.8	A566 S567 I568 T614 Y615	A566-E618 WeakPolarHBondContact CA-OE2 3.27Å; A566-E618 WeakPolarHBondContact CB-OE2 3.44Å; S567-E618 WeakPolarHBondContact CB-OE1 3.38Å; S567-E618 PolarHBondContact N-OE1 2.68Å; S567-E618 VanDerWaalsContact N-OE1 3.12Å; S567-E618 PolarHBondContact N-OE2 2.97Å; S567-E618 PolarHBondContact OG-OE1 2.9Å; S567-E618 PolarHBondContact OG-OE2 3.45Å; I568-E618 HydrophobicContact CD1-CB 3.92Å; I568-E618 HydrophobicContact CG1-CB 4.49Å; I568-E618 WeakPolarHBondContact CG1-OE2 3.31Å; I568-E618 PolarHBondContact N-OE2 3.28Å; T614-E618 VanDerWaalsContact O-CB 3.3Å; T614-E618 WeakPolarHBondContact O-CB 3.44Å; T614-E618 PolarHBondContact O-N 3.48Å; Y615-E618 PolarHBondContact O-N 2.87Å
619	R	90.5	Very high	92.9	Very high	128 Å²	128	31.6 Å²	31.6	48%	0.483	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-45.8	-173.2	-56	-63.5	-174.1	159	3.8	111.6	Y615	Y615-R619 HydrophobicContact CD1-CB 4.26Å; Y615-R619 HydrophobicContact CD1-CG 4.36Å; Y615-R619 HydrophobicContact CD2-CG 3.97Å; Y615-R619 HydrophobicContact CE1-CB 4Å; Y615-R619 HydrophobicContact CE1-CG 4.15Å; Y615-R619 HydrophobicContact CE2-CB 4.49Å; Y615-R619 HydrophobicContact CE2-CG 3.74Å; Y615-R619 HydrophobicContact CG-CG 4.26Å; Y615-R619 WeakPolarHBondContact O-CB 3.33Å; Y615-R619 PolarHBondContact O-N 3.05Å
620	K	89.2	Confident	92.8	Very high	67 Å²	67	31.6 Å²	31.6	29%	0.291	14%	0.144	S	C	.	.	S	Bend	trans	-88.2	-4.9	-179.8	-52.8	-69.8	175.4	161.6	0	113.9	E560 Y589 N590 L616 V622	E560-K620 WeakPolarHBondContact OE1-CE 3.37Å; E560-K620 IonicContact OE1-NZ 3.92Å; E560-K620 PolarHBondContact OE1-NZ 3.06Å; E560-K620 WeakPolarHBondContact OE2-CE 3.21Å; E560-K620 IonicContact OE2-NZ 2.62Å; E560-K620 PolarHBondContact OE2-NZ 3.27Å; Y589-K620 HydrophobicContact CE1-CG 4.32Å; N590-K620 PolarHBondContact OD1-NZ 2.88Å; L616-K620 HydrophobicContact CD2-CB 4.19Å; L616-K620 HydrophobicContact CD2-CG 3.8Å; L616-K620 CarbonylContact O-C 3.6Å; L616-K620 WeakPolarHBondContact O-CB 3.33Å; L616-K620 PolarHBondContact O-N 2.87Å; K620-V622 HydrophobicContact CB-CG2 4.15Å; K620-V622 PolarHBondContact O-N 2.82Å
621	R	90.6	Very high	92.4	Very high	211 Å²	211	32.1 Å²	32.1	80%	0.796	15%	0.148	S	C	*	.			trans	57.3	24	-179.5	-59	-175.9	176.4	-176.6	-0.6	114.9	L616 M617 N623	L616-R621 PolarHBondContact O-N 2.85Å; M617-R621 WeakPolarHBondContact O-CA 3.04Å; R621-N623 PolarHBondContact O-N 2.72Å
622	V	90.2	Very high	91.8	Very high	27 Å²	27	37.1 Å²	37.1	16%	0.164	17%	0.174	C	C	.	.			trans	-90.4	93.5	179.5	-176.2	0	0	0	0	109.9	L616 M617 K620 G624 F626	L616-V622 PolarHBondContact O-N 3.08Å; M617-V622 WeakPolarHBondContact CG-O 3.35Å; K620-V622 HydrophobicContact CB-CG2 4.15Å; K620-V622 PolarHBondContact O-N 2.82Å; V622-G624 PolarHBondContact O-N 3.33Å; V622-G624 VanDerWaalsContact O-N 3.11Å; V622-F626 HydrophobicContact CB-CZ 4.48Å; V622-F626 HydrophobicContact CG1-CE1 4.14Å; V622-F626 HydrophobicContact CG1-CZ 3.97Å; V622-F626 WeakPolarHBondContact O-CE2 3.24Å; V622-F626 WeakPolarHBondContact O-CZ 3.43Å
623	N	89.3	Confident	90.8	Very high	93 Å²	93	39 Å²	39	50%	0.497	19%	0.187	S	C	.	.			trans	-75.7	11	-179.2	-75.5	-44.4	0	0	0	115.5	R621 N674	R621-N623 PolarHBondContact O-N 2.72Å; N623-N674 WeakPolarHBondContact O-CA 3.49Å; N623-N674 PolarHBondContact O-ND2 2.98Å
624	G	86.6	Confident	90.2	Very high	17 Å²	17	40 Å²	40	18%	0.175	19%	0.193	C	C	.	.			trans	97.6	-155.1	-176.7	0	0	0	0	0	113.9	V622 K696	V622-G624 PolarHBondContact O-N 3.33Å; V622-G624 VanDerWaalsContact O-N 3.11Å; G624-K696 WeakPolarHBondContact O-CG 3.5Å
625	P	92.7	Very high	89.7	Confident	33 Å²	33	40.3 Å²	40.3	21%	0.214	19%	0.194	C	C	.	.			cis	-75.4	134.9	2.4	31.6	-35.1	0	0	0	111.8	I673 V693 K694 W695 K696	P625-I673 HydrophobicContact CB-CD1 4.49Å; P625-I673 HydrophobicContact CB-CG1 4.23Å; P625-V693 HydrophobicContact CB-CG1 4.31Å; P625-V693 HydrophobicContact CG-CG1 3.71Å; P625-K694 WeakPolarHBondContact CG-O 3.4Å; P625-W695 HydrophobicContact CB-CE3 3.87Å; P625-W695 HydrophobicContact CB-CZ3 3.8Å; P625-W695 HydrophobicContact CG-CE3 4.21Å; P625-K696 PolarHBondContact O-N 2.71Å
626	F	95	Very high	89.2	Confident	1 Å²	1	42.9 Å²	42.9	0%	0.004	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137	177.6	-57.2	-59.8	0	0	0	110.6	I613 L616 M617 V622 N674 V675 L676 W695	I613-F626 HydrophobicContact CG2-CD2 3.88Å; I613-F626 HydrophobicContact CG2-CE2 3.88Å; L616-F626 HydrophobicContact CB-CZ 4.41Å; M617-F626 HydrophobicContact CG-CE2 3.94Å; M617-F626 HydrophobicContact SD-CE2 4.28Å; V622-F626 HydrophobicContact CB-CZ 4.48Å; V622-F626 HydrophobicContact CG1-CE1 4.14Å; V622-F626 HydrophobicContact CG1-CZ 3.97Å; V622-F626 WeakPolarHBondContact O-CE2 3.24Å; V622-F626 WeakPolarHBondContact O-CZ 3.43Å; F626-N674 WeakPolarHBondContact CD2-O 3.48Å; F626-N674 PolarHBondContact N-O 3.06Å; F626-V675 HydrophobicContact CB-CG2 4.32Å; F626-V675 HydrophobicContact CD2-CG2 4.2Å; F626-V675 WeakPolarHBondContact O-CA 3.47Å; F626-L676 PolarHBondContact O-N 2.88Å; F626-W695 WeakPolarHBondContact O-CZ3 3.22Å
627	L	95.6	Very high	88.7	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	121.3	177.6	-174.6	61	0	0	0	109.7	I629 L676 T678 I683 W695 Y697 M698 I699 Y721	L627-I629 HydrophobicContact CD2-CD1 4.17Å; L627-I629 HydrophobicContact CD2-CG1 4.3Å; L627-I629 HydrophobicContact CG-CD1 4.45Å; L627-I629 HydrophobicContact CG-CG1 4.05Å; L627-L676 HydrophobicContact CD1-CB 4.21Å; L627-L676 HydrophobicContact CD1-CD2 3.94Å; L627-L676 HydrophobicContact CD1-CG 4.34Å; L627-T678 HydrophobicContact CD1-CG2 3.77Å; L627-I683 HydrophobicContact CD1-CD1 4.28Å; L627-I683 HydrophobicContact CD2-CD1 4.01Å; L627-W695 HydrophobicContact CB-CB 4.48Å; L627-W695 HydrophobicContact CB-CD2 3.74Å; L627-W695 HydrophobicContact CB-CE3 3.6Å; L627-W695 HydrophobicContact CB-CG 4.12Å; L627-W695 HydrophobicContact CB-CZ3 4.13Å; L627-W695 HydrophobicContact CD1-CD2 4.41Å; L627-W695 HydrophobicContact CD1-CE3 4.42Å; L627-W695 HydrophobicContact CD1-CH2 4.12Å; L627-W695 HydrophobicContact CD1-CZ2 4.11Å; L627-W695 HydrophobicContact CD1-CZ3 4.26Å; L627-W695 HydrophobicContact CD2-CD2 4.2Å; L627-W695 HydrophobicContact CD2-CG 4.22Å; L627-W695 HydrophobicContact CG-CD2 4.35Å; L627-W695 HydrophobicContact CG-CE3 4.49Å; L627-Y697 PolarHBondContact N-O 2.81Å; L627-M698 HydrophobicContact CD2-CE 4.27Å; L627-M698 HydrophobicContact CD2-CG 4.34Å; L627-I699 PolarHBondContact O-N 3.29Å; L627-Y721 HydrophobicContact CD2-CD1 4.24Å; L627-Y721 HydrophobicContact CD2-CE1 4.48Å
628	I	96.3	Very high	88.7	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.8	173.7	-46.9	-179	0	0	0	108.4	I613 V630 W638 F642 V675 L676 T678 I699	I613-I628 HydrophobicContact CD1-CD1 3.73Å; I628-V630 HydrophobicContact CG2-CG1 3.73Å; I628-W638 HydrophobicContact CD1-CE3 4.42Å; I628-W638 HydrophobicContact CD1-CZ3 4.14Å; I628-W638 HydrophobicContact CG2-CE3 4.39Å; I628-W638 HydrophobicContact CG2-CH2 4.36Å; I628-W638 HydrophobicContact CG2-CZ3 4.23Å; I628-F642 HydrophobicContact CD1-CE2 3.67Å; I628-F642 HydrophobicContact CD1-CZ 3.64Å; I628-V675 HydrophobicContact CD1-CG1 3.5Å; I628-V675 VanDerWaalsContact CD1-CG1 3.5Å; I628-V675 HydrophobicContact CG1-CG1 3.77Å; I628-L676 PolarHBondContact N-O 3.35Å; I628-T678 PolarHBondContact O-N 2.78Å; I628-I699 WeakPolarHBondContact CA-O 3.5Å; I628-I699 HydrophobicContact CG1-CB 4.44Å; I628-I699 HydrophobicContact CG2-CB 4.43Å
629	I	95.3	Very high	88.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.5	-179.1	-50.1	177.5	0	0	0	107.8	L627 T678 Y680 I683 M698 I699 I700 D701 L717	L627-I629 HydrophobicContact CD2-CD1 4.17Å; L627-I629 HydrophobicContact CD2-CG1 4.3Å; L627-I629 HydrophobicContact CG-CD1 4.45Å; L627-I629 HydrophobicContact CG-CG1 4.05Å; I629-T678 CarbonylContact C-O 3.56Å; I629-T678 WeakPolarHBondContact CA-O 3.49Å; I629-T678 HydrophobicContact CG1-CG2 4.37Å; I629-Y680 HydrophobicContact CG2-CD1 3.42Å; I629-Y680 VanDerWaalsContact CG2-CD1 3.42Å; I629-Y680 HydrophobicContact CG2-CE1 3.86Å; I629-Y680 HydrophobicContact CG2-CG 4.08Å; I629-I683 HydrophobicContact CD1-CD1 3.96Å; I629-I683 HydrophobicContact CD1-CG1 3.92Å; I629-I683 HydrophobicContact CG1-CD1 4.2Å; I629-I683 HydrophobicContact CG1-CG1 4.1Å; I629-I683 HydrophobicContact CG2-CG1 4.21Å; I629-M698 HydrophobicContact CD1-CG 4.31Å; I629-M698 HydrophobicContact CD1-SD 4.31Å; I629-I699 PolarHBondContact N-O 2.91Å; I629-I700 HydrophobicContact CB-CG1 4.43Å; I629-I700 HydrophobicContact CD1-CD1 4.41Å; I629-I700 HydrophobicContact CD1-CG1 4.24Å; I629-D701 PolarHBondContact O-N 3.24Å; I629-L717 HydrophobicContact CD1-CD1 4.41Å; I629-L717 HydrophobicContact CD1-CD2 3.78Å
630	V	92.4	Very high	88.4	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.			trans	-131.5	155.9	-172	-56.9	0	0	0	0	112.6	I628 V634 M635 W638 T678 T679 D701	I628-V630 HydrophobicContact CG2-CG1 3.73Å; V630-V634 HydrophobicContact CB-CG2 4.03Å; V630-M635 HydrophobicContact CG2-CB 3.68Å; V630-M635 HydrophobicContact CG2-CG 3.68Å; V630-W638 HydrophobicContact CG1-CD2 4.24Å; V630-W638 HydrophobicContact CG1-CG 4.14Å; V630-T678 PolarHBondContact N-O 3.37Å; V630-T679 VanDerWaalsContact O-CA 3.31Å; V630-T679 WeakPolarHBondContact O-CA 3.4Å; V630-D701 HydrophobicContact CB-CB 4.34Å; V630-D701 HydrophobicContact CG1-CB 3.9Å
631	P	87.1	Confident	88.4	Confident	12 Å²	12	40 Å²	40	8%	0.078	21%	0.213	C	C	.	.			trans	-55.9	147.4	162.8	-20.5	29.3	0	0	0	112	S633 V634 M635 Y680 E702	P631-S633 PolarHBondContact O-N 3.48Å; P631-V634 HydrophobicContact CB-CG2 4.05Å; P631-V634 HydrophobicContact CG-CG2 4.03Å; P631-V634 WeakPolarHBondContact O-CG2 3.34Å; P631-V634 PolarHBondContact O-N 3.34Å; P631-M635 PolarHBondContact O-N 3.07Å; P631-Y680 HydrophobicContact CB-CE2 4.44Å; P631-Y680 WeakPolarHBondContact CD-OH 3.47Å; P631-Y680 HydrophobicContact CG-CE2 4.15Å; P631-E702 HydrophobicContact CG-CB 3.93Å; P631-E702 HydrophobicContact CG-CG 3.78Å
632	L	81.5	Confident	88.5	Confident	106 Å²	106	29.9 Å²	29.9	56%	0.555	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-32.9	-175.7	-177.4	65.3	0	0	0	113.2	M635 T679	L632-M635 HydrophobicContact CD1-CE 3.75Å; L632-M635 WeakPolarHBondContact O-CB 3.31Å; L632-T679 HydrophobicContact CB-CG2 4.11Å; L632-T679 HydrophobicContact CD1-CG2 3.84Å
633	S	74.9	Confident	88.5	Confident	40 Å²	40	33.1 Å²	33.1	28%	0.28	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-51.5	-179.3	46.4	0	0	0	0	113.4	P631 M635 S636	P631-S633 PolarHBondContact O-N 3.48Å; S633-M635 PolarHBondContact O-N 3.39Å; S633-S636 PolarHBondContact O-OG 2.81Å
634	V	80.9	Confident	88.5	Confident	20 Å²	20	35.7 Å²	35.7	12%	0.121	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-10.6	-178.6	-58.2	0	0	0	0	113.1	V630 P631 S636 N637 W638	V630-V634 HydrophobicContact CB-CG2 4.03Å; P631-V634 HydrophobicContact CB-CG2 4.05Å; P631-V634 HydrophobicContact CG-CG2 4.03Å; P631-V634 WeakPolarHBondContact O-CG2 3.34Å; P631-V634 PolarHBondContact O-N 3.34Å; V634-S636 PolarHBondContact O-N 2.89Å; V634-N637 WeakPolarHBondContact O-CA 3.17Å; V634-N637 WeakPolarHBondContact O-CB 3.04Å; V634-N637 PolarHBondContact O-N 3.2Å; V634-W638 PolarHBondContact O-N 2.82Å
635	M	85	Confident	88.7	Confident	8 Å²	8	35.9 Å²	35.9	4%	0.039	19%	0.189	C	C	.	.	H	α-helix	trans	-62.4	-28.1	-175.5	-166.4	-173.1	55.9	0	0	113.4	V630 P631 L632 S633 A639 L653 K655 T679	V630-M635 HydrophobicContact CG2-CB 3.68Å; V630-M635 HydrophobicContact CG2-CG 3.68Å; P631-M635 PolarHBondContact O-N 3.07Å; L632-M635 HydrophobicContact CD1-CE 3.75Å; L632-M635 WeakPolarHBondContact O-CB 3.31Å; S633-M635 PolarHBondContact O-N 3.39Å; M635-A639 PolarHBondContact O-N 2.9Å; M635-L653 HydrophobicContact CE-CD1 4.03Å; M635-L653 HydrophobicContact CG-CD1 3.58Å; M635-L653 HydrophobicContact SD-CD1 3.75Å; M635-K655 HydrophobicContact CE-CB 3.73Å; M635-K655 HydrophobicContact CE-CD 3.83Å; M635-K655 HydrophobicContact CE-CG 4.35Å; M635-T679 HydrophobicContact SD-CG2 3.75Å
636	S	81.9	Confident	88.6	Confident	71 Å²	71	34.3 Å²	34.3	50%	0.497	18%	0.179	S	C	.	.	H	α-helix	trans	-71.5	-46.7	169.2	48	0	0	0	0	111.5	S633 V634 W638 A639 M640	S633-S636 PolarHBondContact O-OG 2.81Å; V634-S636 PolarHBondContact O-N 2.89Å; S636-W638 PolarHBondContact O-N 3.09Å; S636-A639 WeakPolarHBondContact O-CB 3.43Å; S636-A639 PolarHBondContact O-N 3.37Å; S636-A639 VanDerWaalsContact O-N 3.08Å; S636-M640 WeakPolarHBondContact O-CG 3.41Å; S636-M640 PolarHBondContact O-N 2.77Å
637	N	84.4	Confident	88.4	Confident	42 Å²	42	37.6 Å²	37.6	23%	0.225	20%	0.2	C	C	.	.	H	α-helix	trans	-58	-47.5	176.5	-167.3	84.1	0	0	0	111.6	V634 A639 M640 E641	V634-N637 WeakPolarHBondContact O-CA 3.17Å; V634-N637 WeakPolarHBondContact O-CB 3.04Å; V634-N637 PolarHBondContact O-N 3.2Å; N637-A639 VanDerWaalsContact C-N 3.26Å; N637-A639 PolarHBondContact O-N 2.88Å; N637-M640 PolarHBondContact O-N 2.87Å; N637-M640 VanDerWaalsContact O-N 3.16Å; N637-E641 WeakPolarHBondContact ND2-CG 3.36Å; N637-E641 VanDerWaalsContact O-CG 3.25Å; N637-E641 WeakPolarHBondContact O-CG 3.48Å; N637-E641 PolarHBondContact O-N 2.96Å
638	W	90.9	Very high	88.1	Confident	1 Å²	1	41 Å²	41	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-56.2	-38.4	174.4	-86.4	91.6	0	0	0	112.9	T606 T609 I628 V630 V634 S636 F642 L677 D701 L729	T606-W638 HydrophobicContact CG2-CD2 3.78Å; T606-W638 HydrophobicContact CG2-CE3 3.71Å; T606-W638 HydrophobicContact CG2-CG 4.42Å; T606-W638 HydrophobicContact CG2-CH2 4.06Å; T606-W638 HydrophobicContact CG2-CZ2 4.12Å; T606-W638 HydrophobicContact CG2-CZ3 3.86Å; T609-W638 HydrophobicContact CG2-CH2 3.74Å; T609-W638 HydrophobicContact CG2-CZ3 3.87Å; I628-W638 HydrophobicContact CD1-CE3 4.42Å; I628-W638 HydrophobicContact CD1-CZ3 4.14Å; I628-W638 HydrophobicContact CG2-CE3 4.39Å; I628-W638 HydrophobicContact CG2-CH2 4.36Å; I628-W638 HydrophobicContact CG2-CZ3 4.23Å; V630-W638 HydrophobicContact CG1-CD2 4.24Å; V630-W638 HydrophobicContact CG1-CG 4.14Å; V634-W638 PolarHBondContact O-N 2.82Å; S636-W638 PolarHBondContact O-N 3.09Å; W638-F642 HydrophobicContact CE3-CD2 4.48Å; W638-F642 AromaticContact CE3-CE2 3.94Å; W638-F642 HydrophobicContact CE3-CE2 3.94Å; W638-F642 HydrophobicContact CZ3-CE2 4.36Å; W638-F642 VanDerWaalsContact O-CD2 3.23Å; W638-F642 WeakPolarHBondContact O-CD2 3.49Å; W638-F642 PolarHBondContact O-N 2.84Å; W638-F642 VanDerWaalsContact O-N 3.12Å; W638-L677 HydrophobicContact CB-CD2 3.71Å; W638-D701 HydrophobicContact CZ2-CB 4.21Å; W638-D701 PolarHBondContact NE1-OD2 2.93Å; W638-L729 HydrophobicContact CH2-CD1 3.74Å; W638-L729 HydrophobicContact CZ2-CD1 3.68Å
639	A	89.2	Confident	87.9	Confident	16 Å²	16	41.2 Å²	41.2	13%	0.132	23%	0.226	C	C	.	.	H	α-helix	trans	-65.3	-50.1	175.1	0	0	0	0	0	111.3	M635 S636 N637 E641 F642 D643	M635-A639 PolarHBondContact O-N 2.9Å; S636-A639 WeakPolarHBondContact O-CB 3.43Å; S636-A639 PolarHBondContact O-N 3.37Å; S636-A639 VanDerWaalsContact O-N 3.08Å; N637-A639 VanDerWaalsContact C-N 3.26Å; N637-A639 PolarHBondContact O-N 2.88Å; A639-E641 PolarHBondContact O-N 2.88Å; A639-F642 CarbonylContact O-C 3.49Å; A639-F642 PolarHBondContact O-N 3.47Å; A639-F642 VanDerWaalsContact O-N 3.11Å; A639-D643 PolarHBondContact O-N 3.29Å; A639-D643 VanDerWaalsContact O-OD2 3.06Å
640	M	87.2	Confident	87.7	Confident	116 Å²	116	48.1 Å²	48.1	57%	0.571	26%	0.256	S	S	*	.	H	α-helix	trans	-59.4	-41.1	178.2	-65.1	-172.2	-61.8	0	0	112.7	S636 N637 D643 R644	S636-M640 WeakPolarHBondContact O-CG 3.41Å; S636-M640 PolarHBondContact O-N 2.77Å; N637-M640 PolarHBondContact O-N 2.87Å; N637-M640 VanDerWaalsContact O-N 3.16Å; M640-D643 PolarHBondContact O-N 2.86Å; M640-D643 VanDerWaalsContact O-N 3.14Å; M640-R644 WeakPolarHBondContact O-CB 3.19Å; M640-R644 PolarHBondContact O-N 3.08Å
641	E	89.8	Confident	87.7	Confident	25 Å²	25	50.4 Å²	50.4	12%	0.117	27%	0.266	C	S	.	.	H	α-helix	trans	-65.9	-37.7	176	-63.2	-80.1	-154.5	0	0	111.2	T606 I610 N637 A639 D643 R644 W645	T606-E641 HydrophobicContact CG2-CB 4.06Å; T606-E641 HydrophobicContact CG2-CG 4.12Å; I610-E641 HydrophobicContact CD1-CB 3.76Å; N637-E641 WeakPolarHBondContact ND2-CG 3.36Å; N637-E641 VanDerWaalsContact O-CG 3.25Å; N637-E641 WeakPolarHBondContact O-CG 3.48Å; N637-E641 PolarHBondContact O-N 2.96Å; A639-E641 PolarHBondContact O-N 2.88Å; E641-D643 VanDerWaalsContact C-N 3.35Å; E641-R644 PolarHBondContact O-N 2.94Å; E641-W645 WeakPolarHBondContact O-CB 3.48Å; E641-W645 VanDerWaalsContact O-CD1 3.29Å; E641-W645 PolarHBondContact O-N 2.98Å; E641-W645 PolarHBondContact OE2-NE1 3.1Å
642	F	92.1	Very high	87.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-70.2	-26.3	170.9	-88.4	-67.6	0	0	0	113.8	I610 I613 I628 W638 A639 G646 V649 K651 V675 L677	I610-F642 HydrophobicContact CB-CE1 4.41Å; I610-F642 HydrophobicContact CD1-CD1 4.27Å; I610-F642 HydrophobicContact CD1-CD2 4.49Å; I610-F642 HydrophobicContact CD1-CG 4.23Å; I610-F642 HydrophobicContact CG1-CD1 3.97Å; I610-F642 HydrophobicContact CG1-CE1 3.77Å; I610-F642 HydrophobicContact CG1-CE2 4.31Å; I610-F642 HydrophobicContact CG1-CG 4.32Å; I610-F642 HydrophobicContact CG1-CZ 3.94Å; I610-F642 HydrophobicContact CG2-CD1 4.2Å; I610-F642 HydrophobicContact CG2-CE1 4.21Å; I613-F642 HydrophobicContact CD1-CE1 4.5Å; I613-F642 HydrophobicContact CD1-CZ 3.98Å; I628-F642 HydrophobicContact CD1-CE2 3.67Å; I628-F642 HydrophobicContact CD1-CZ 3.64Å; W638-F642 HydrophobicContact CE3-CD2 4.48Å; W638-F642 AromaticContact CE3-CE2 3.94Å; W638-F642 HydrophobicContact CE3-CE2 3.94Å; W638-F642 HydrophobicContact CZ3-CE2 4.36Å; W638-F642 VanDerWaalsContact O-CD2 3.23Å; W638-F642 WeakPolarHBondContact O-CD2 3.49Å; W638-F642 PolarHBondContact O-N 2.84Å; W638-F642 VanDerWaalsContact O-N 3.12Å; A639-F642 CarbonylContact O-C 3.49Å; A639-F642 PolarHBondContact O-N 3.47Å; A639-F642 VanDerWaalsContact O-N 3.11Å; F642-G646 CarbonylContact O-C 3.52Å; F642-G646 PolarHBondContact O-N 3.46Å; F642-G646 VanDerWaalsContact O-O 3.12Å; F642-V649 HydrophobicContact CD1-CB 4.49Å; F642-V649 HydrophobicContact CD1-CG1 4.44Å; F642-V649 HydrophobicContact CE1-CG1 4.27Å; F642-K651 HydrophobicContact CB-CD 3.48Å; F642-K651 VanDerWaalsContact CB-CD 3.48Å; F642-K651 HydrophobicContact CD2-CD 4.43Å; F642-K651 HydrophobicContact CG-CD 4.12Å; F642-K651 PolarHBondContact O-NZ 3.44Å; F642-V675 HydrophobicContact CE1-CG2 4.41Å; F642-V675 HydrophobicContact CE2-CG1 4.35Å; F642-V675 HydrophobicContact CZ-CG1 4.16Å; F642-V675 HydrophobicContact CZ-CG2 4.31Å; F642-L677 HydrophobicContact CD2-CD1 4.25Å; F642-L677 HydrophobicContact CD2-CD2 4.27Å; F642-L677 HydrophobicContact CE2-CD1 4.16Å; F642-L677 HydrophobicContact CE2-CD2 4.44Å
643	D	91.2	Very high	88.4	Confident	94 Å²	94	48.4 Å²	48.4	50%	0.503	25%	0.254	S	S	.	.	H	α-helix	trans	-76.8	-36.6	173.7	-74.3	-51.4	0	0	0	111.3	A639 M640 E641 K651	A639-D643 PolarHBondContact O-N 3.29Å; A639-D643 VanDerWaalsContact O-OD2 3.06Å; M640-D643 PolarHBondContact O-N 2.86Å; M640-D643 VanDerWaalsContact O-N 3.14Å; E641-D643 VanDerWaalsContact C-N 3.35Å; D643-K651 VanDerWaalsContact CG-NZ 3.29Å; D643-K651 WeakPolarHBondContact OD1-CE 3.47Å; D643-K651 IonicContact OD1-NZ 2.86Å; D643-K651 PolarHBondContact OD1-NZ 2.99Å; D643-K651 WeakPolarHBondContact OD2-CE 3.15Å; D643-K651 IonicContact OD2-NZ 2.69Å
644	R	88.7	Confident	89.2	Confident	147 Å²	147	46.5 Å²	46.5	56%	0.555	24%	0.241	S	C	*	.	H	α-helix	trans	-71.8	-54.4	175.7	-179	179.3	-178.3	165.8	4.4	113	H571 M640 E641	H571-R644 HydrophobicContact CB-CG 4.38Å; H571-R644 PolarHBondContact CD2-O 2.94Å; M640-R644 WeakPolarHBondContact O-CB 3.19Å; M640-R644 PolarHBondContact O-N 3.08Å; E641-R644 PolarHBondContact O-N 2.94Å
645	W	91.2	Very high	89.6	Confident	22 Å²	22	50.3 Å²	50.3	8%	0.083	26%	0.256	C	S	.	.	H	α-helix	trans	-94	-30	-168.2	-66.1	92.6	0	0	0	113.9	L569 V570 G572 I607 I610 E641	L569-W645 WeakPolarHBondContact CA-O 3.14Å; L569-W645 HydrophobicContact CD1-CB 3.91Å; L569-W645 HydrophobicContact CD1-CE3 4.27Å; L569-W645 HydrophobicContact CD2-CE3 4.29Å; L569-W645 HydrophobicContact CG-CE3 4.07Å; V570-W645 PolarHBondContact N-O 2.91Å; G572-W645 VanDerWaalsContact CA-CZ3 3.49Å; I607-W645 HydrophobicContact CD1-CH2 4.36Å; I607-W645 HydrophobicContact CD1-CZ2 3.6Å; I607-W645 HydrophobicContact CG1-CZ2 4.2Å; I607-W645 HydrophobicContact CG2-CD2 4.38Å; I607-W645 HydrophobicContact CG2-CE3 4.41Å; I607-W645 HydrophobicContact CG2-CH2 4.32Å; I607-W645 HydrophobicContact CG2-CZ2 4.32Å; I607-W645 HydrophobicContact CG2-CZ3 4.36Å; I610-W645 HydrophobicContact CG2-CB 4.25Å; E641-W645 WeakPolarHBondContact O-CB 3.48Å; E641-W645 VanDerWaalsContact O-CD1 3.29Å; E641-W645 PolarHBondContact O-N 2.98Å; E641-W645 PolarHBondContact OE2-NE1 3.1Å
646	G	90.1	Very high	89.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.273	C	S	.	.			trans	-135.5	53.4	-174.4	0	0	0	0	0	114.3	F642 S648 V649	F642-G646 CarbonylContact O-C 3.52Å; F642-G646 PolarHBondContact O-N 3.46Å; F642-G646 VanDerWaalsContact O-O 3.12Å; G646-S648 PolarHBondContact O-N 3.09Å; G646-V649 WeakPolarHBondContact O-CB 3.27Å; G646-V649 WeakPolarHBondContact O-CG2 3.43Å; G646-V649 PolarHBondContact O-N 3.25Å
647	P	90.3	Very high	89.9	Confident	69 Å²	69	51.4 Å²	51.4	45%	0.448	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-24	-170.5	22.1	-33.7	0	0	0	114.9	V649	P647-V649 VanDerWaalsContact C-N 3.3Å; P647-V649 PolarHBondContact O-N 2.9Å
648	S	89.5	Confident	90.1	Very high	73 Å²	73	53 Å²	53	51%	0.51	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-14.6	176.8	65	0	0	0	0	114.2	I568 G646 K650	I568-S648 WeakPolarHBondContact CG2-OG 3.31Å; G646-S648 PolarHBondContact O-N 3.09Å; S648-K650 PolarHBondContact O-N 2.99Å
649	V	92.1	Very high	90	Very high	4 Å²	4	60.1 Å²	60.1	2%	0.024	32%	0.316	C	S	.	.	S	Bend	trans	-77.6	115.5	-176.2	-178.5	0	0	0	0	110.6	I568 T614 M617 F642 G646 P647 K651 N674 V675	I568-V649 HydrophobicContact CG2-CG2 4.3Å; T614-V649 HydrophobicContact CG2-CG2 4.02Å; M617-V649 HydrophobicContact CE-CG2 4.34Å; M617-V649 HydrophobicContact SD-CG1 4.16Å; M617-V649 HydrophobicContact SD-CG2 4.09Å; F642-V649 HydrophobicContact CD1-CB 4.49Å; F642-V649 HydrophobicContact CD1-CG1 4.44Å; F642-V649 HydrophobicContact CE1-CG1 4.27Å; G646-V649 WeakPolarHBondContact O-CB 3.27Å; G646-V649 WeakPolarHBondContact O-CG2 3.43Å; G646-V649 PolarHBondContact O-N 3.25Å; P647-V649 VanDerWaalsContact C-N 3.3Å; P647-V649 PolarHBondContact O-N 2.9Å; V649-K651 PolarHBondContact O-N 3.31Å; V649-N674 HydrophobicContact CG1-CB 3.98Å; V649-V675 HydrophobicContact CG1-CB 4.48Å; V649-V675 HydrophobicContact CG1-CG2 3.49Å; V649-V675 VanDerWaalsContact CG1-CG2 3.49Å
650	K	91.3	Very high	90	Very high	145 Å²	145	61.3 Å²	61.3	63%	0.63	33%	0.326	S	S	*	.			trans	-77.4	93.1	-177.4	-60.5	-177.1	-178.8	177.4	0	111.1	S648 N674 V675	S648-K650 PolarHBondContact O-N 2.99Å; K650-N674 VanDerWaalsContact CB-OD1 3.31Å; K650-N674 WeakPolarHBondContact CB-OD1 3.49Å; K650-N674 PolarHBondContact N-OD1 2.91Å; K650-N674 PolarHBondContact O-N 3.19Å; K650-V675 PolarHBondContact O-N 3.43Å
651	K	92.2	Very high	90.2	Very high	47 Å²	47	56.9 Å²	56.9	20%	0.204	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	140.2	177.6	52.3	-176.6	171.3	-70.7	0	112.4	F642 D643 V649 V675 L677	F642-K651 HydrophobicContact CB-CD 3.48Å; F642-K651 VanDerWaalsContact CB-CD 3.48Å; F642-K651 HydrophobicContact CD2-CD 4.43Å; F642-K651 HydrophobicContact CG-CD 4.12Å; F642-K651 PolarHBondContact O-NZ 3.44Å; D643-K651 VanDerWaalsContact CG-NZ 3.29Å; D643-K651 WeakPolarHBondContact OD1-CE 3.47Å; D643-K651 IonicContact OD1-NZ 2.86Å; D643-K651 PolarHBondContact OD1-NZ 2.99Å; D643-K651 WeakPolarHBondContact OD2-CE 3.15Å; D643-K651 IonicContact OD2-NZ 2.69Å; V649-K651 PolarHBondContact O-N 3.31Å; K651-V675 CarbonylContact C-O 3.52Å; K651-V675 WeakPolarHBondContact CA-O 3.43Å; K651-L677 HydrophobicContact CB-CD1 3.84Å
652	I	92.1	Very high	90.1	Very high	20 Å²	20	63.6 Å²	63.6	10%	0.103	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	130	164.2	-68	-166.3	0	0	0	109.5	L664 Q667 I668 I673 V675 L676 L677	I652-L664 HydrophobicContact CG2-CB 4.4Å; I652-L664 HydrophobicContact CG2-CD1 4.28Å; I652-L664 HydrophobicContact CG2-CD2 4.14Å; I652-Q667 HydrophobicContact CD1-CB 3.96Å; I652-I668 HydrophobicContact CD1-CG1 4.14Å; I652-I673 HydrophobicContact CD1-CG2 3.48Å; I652-I673 VanDerWaalsContact CD1-CG2 3.48Å; I652-I673 HydrophobicContact CG1-CG2 3.93Å; I652-V675 PolarHBondContact N-O 3.45Å; I652-L676 HydrophobicContact CB-CD1 3.86Å; I652-L676 HydrophobicContact CG2-CD1 3.72Å; I652-L677 PolarHBondContact O-N 3.24Å
653	L	92.1	Very high	89.9	Confident	56 Å²	56	69.5 Å²	69.5	29%	0.293	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	101	176.8	-178.1	63.4	0	0	0	110.2	M635 K655 L664 L677	M635-L653 HydrophobicContact CE-CD1 4.03Å; M635-L653 HydrophobicContact CG-CD1 3.58Å; M635-L653 HydrophobicContact SD-CD1 3.75Å; L653-K655 VanDerWaalsContact C-N 3.35Å; L653-K655 HydrophobicContact CD2-CD 3.88Å; L653-K655 HydrophobicContact CD2-CG 4.29Å; L653-K655 HydrophobicContact CG-CD 4.15Å; L653-K655 HydrophobicContact CG-CG 4.13Å; L653-K655 PolarHBondContact O-N 2.97Å; L653-L664 WeakPolarHBondContact O-CD1 3.35Å; L653-L677 HydrophobicContact CD1-CB 4.36Å
654	Y	91.8	Very high	89.9	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.343	C	S	.	.			trans	-84.2	71.8	-171.9	-162.3	-100.4	0	0	0	112.4	R661 L664 Q665 I668 L676 L677 Y682 D686 L690	Y654-R661 HydrophobicContact CE1-CB 4.44Å; Y654-R661 HydrophobicContact CE1-CG 4.37Å; Y654-R661 HydrophobicContact CE2-CB 4.09Å; Y654-R661 HydrophobicContact CE2-CG 4.49Å; Y654-L664 HydrophobicContact CD2-CB 4.18Å; Y654-L664 HydrophobicContact CD2-CD1 4.29Å; Y654-L664 HydrophobicContact CE2-CB 4.3Å; Y654-Q665 HydrophobicContact CE2-CG 4.06Å; Y654-Q665 PolarHBondContact OH-NE2 3.35Å; Y654-I668 HydrophobicContact CD2-CD1 3.88Å; Y654-I668 HydrophobicContact CE2-CD1 4.05Å; Y654-L676 HydrophobicContact CD2-CD1 4.44Å; Y654-L677 WeakPolarHBondContact CB-O 3.44Å; Y654-L677 PolarHBondContact N-O 2.96Å; Y654-Y682 HydrophobicContact CD1-CD2 4.31Å; Y654-Y682 HydrophobicContact CD1-CG 4.08Å; Y654-Y682 HydrophobicContact CE1-CG 4.27Å; Y654-Y682 WeakPolarHBondContact O-CD2 3.44Å; Y654-Y682 VanDerWaalsContact O-CE2 3.24Å; Y654-Y682 WeakPolarHBondContact O-CE2 3.38Å; Y654-D686 HydrophobicContact CE1-CB 4.17Å; Y654-D686 VanDerWaalsContact CE1-OD2 3.23Å; Y654-D686 WeakPolarHBondContact CE1-OD2 3.18Å; Y654-D686 WeakPolarHBondContact OH-CB 3.2Å; Y654-D686 PolarHBondContact OH-OD2 3.44Å; Y654-L690 HydrophobicContact CD1-CD1 4.32Å; Y654-L690 HydrophobicContact CE1-CD1 4.08Å; Y654-L690 HydrophobicContact CE2-CD2 4.32Å
655	K	88.7	Confident	89.7	Confident	101 Å²	101	61.4 Å²	61.4	44%	0.439	33%	0.325	S	S	.	.			trans	-124.5	176.7	-179.4	78.2	174.2	-176.4	170.1	0	113.8	M635 L653 R661	M635-K655 HydrophobicContact CE-CB 3.73Å; M635-K655 HydrophobicContact CE-CD 3.83Å; M635-K655 HydrophobicContact CE-CG 4.35Å; L653-K655 VanDerWaalsContact C-N 3.35Å; L653-K655 HydrophobicContact CD2-CD 3.88Å; L653-K655 HydrophobicContact CD2-CG 4.29Å; L653-K655 HydrophobicContact CG-CD 4.15Å; L653-K655 HydrophobicContact CG-CG 4.13Å; L653-K655 PolarHBondContact O-N 2.97Å; K655-R661 VanDerWaalsContact O-CG 3.31Å; K655-R661 WeakPolarHBondContact O-CG 3.31Å
656	G	84.8	Confident	89.4	Confident	38 Å²	38	64.7 Å²	64.7	39%	0.392	35%	0.347	S	S	.	.	S	Bend	trans	85	-162.8	168.6	0	0	0	0	0	115.6	R661 Y682	G656-R661 PolarHBondContact O-NH1 3.29Å; G656-Y682 PolarHBondContact N-OH 3.13Å
657	S	88.5	Confident	89	Confident	63 Å²	63	69.8 Å²	69.8	44%	0.441	37%	0.371	S	S	.	.			trans	-63.8	156.1	-170.3	82.5	0	0	0	0	113.2	Q659 A660 R661	S657-Q659 PolarHBondContact O-N 2.99Å; S657-Q659 VanDerWaalsContact O-N 3.08Å; S657-Q659 PolarHBondContact OG-N 3.27Å; S657-A660 PolarHBondContact O-N 2.98Å; S657-A660 PolarHBondContact OG-N 3.26Å; S657-R661 WeakPolarHBondContact O-CG 3.23Å; S657-R661 PolarHBondContact O-N 3.45Å
658	P	88.3	Confident	88.8	Confident	76 Å²	76	66.8 Å²	66.8	49%	0.494	35%	0.351	S	S	.	.	H	α-helix	trans	-58.8	-21.6	176	-24.4	34.8	0	0	0	114.2	R662	P658-R662 WeakPolarHBondContact O-CD 3.38Å; P658-R662 VanDerWaalsContact O-CG 3.24Å; P658-R662 WeakPolarHBondContact O-CG 3.29Å; P658-R662 PolarHBondContact O-N 3.26Å
659	Q	88.9	Confident	88.3	Confident	150 Å²	150	69.6 Å²	69.6	70%	0.701	35%	0.354	S	S	*	.	H	α-helix	trans	-76.6	-50.5	174.5	-61.8	-175.7	7.3	0	0	111	S657 R661 R662 L663	S657-Q659 PolarHBondContact O-N 2.99Å; S657-Q659 VanDerWaalsContact O-N 3.08Å; S657-Q659 PolarHBondContact OG-N 3.27Å; Q659-R661 VanDerWaalsContact C-N 3.3Å; Q659-R661 PolarHBondContact O-N 3.28Å; Q659-R662 WeakPolarHBondContact O-CB 3.49Å; Q659-R662 PolarHBondContact O-N 2.98Å; Q659-L663 PolarHBondContact O-N 2.97Å
660	A	89.8	Confident	87.7	Confident	41 Å²	41	72.2 Å²	72.2	34%	0.339	38%	0.376	S	S	.	.	H	α-helix	trans	-56.1	-44.9	175.5	0	0	0	0	0	111.4	S657 R662 L663 L664	S657-A660 PolarHBondContact O-N 2.98Å; S657-A660 PolarHBondContact OG-N 3.26Å; A660-R662 VanDerWaalsContact C-N 3.3Å; A660-R662 PolarHBondContact O-N 2.9Å; A660-L663 WeakPolarHBondContact O-CB 3.31Å; A660-L663 PolarHBondContact O-N 3.26Å; A660-L663 VanDerWaalsContact O-N 3.09Å; A660-L664 PolarHBondContact O-N 2.83Å; A660-L664 VanDerWaalsContact O-N 3.13Å
661	R	90.9	Very high	86.7	Confident	24 Å²	24	70.1 Å²	70.1	9%	0.091	38%	0.38	C	S	.	.	H	α-helix	trans	-64.4	-28.2	177.7	-61.9	-163.8	-34.8	-88.2	2.9	113.7	Y654 K655 G656 S657 Q659 L664 Q665 D686	Y654-R661 HydrophobicContact CE1-CB 4.44Å; Y654-R661 HydrophobicContact CE1-CG 4.37Å; Y654-R661 HydrophobicContact CE2-CB 4.09Å; Y654-R661 HydrophobicContact CE2-CG 4.49Å; K655-R661 VanDerWaalsContact O-CG 3.31Å; K655-R661 WeakPolarHBondContact O-CG 3.31Å; G656-R661 PolarHBondContact O-NH1 3.29Å; S657-R661 WeakPolarHBondContact O-CG 3.23Å; S657-R661 PolarHBondContact O-N 3.45Å; Q659-R661 VanDerWaalsContact C-N 3.3Å; Q659-R661 PolarHBondContact O-N 3.28Å; R661-L664 PolarHBondContact O-N 3.4Å; R661-Q665 WeakPolarHBondContact O-CB 3.43Å; R661-Q665 VanDerWaalsContact O-CG 3.28Å; R661-Q665 WeakPolarHBondContact O-CG 3.47Å; R661-Q665 PolarHBondContact O-N 3.03Å; R661-D686 IonicContact CZ-OD2 3.21Å; R661-D686 VanDerWaalsContact CZ-OD2 3.3Å; R661-D686 IonicContact NE-OD2 2.75Å; R661-D686 PolarHBondContact NE-OD2 2.85Å; R661-D686 IonicContact NH2-OD1 2.71Å; R661-D686 PolarHBondContact NH2-OD1 3.19Å; R661-D686 VanDerWaalsContact NH2-OD1 3.12Å; R661-D686 IonicContact NH2-OD2 3.76Å; R661-D686 PolarHBondContact NH2-OD2 2.92Å
662	R	87.8	Confident	85.9	Confident	166 Å²	166	76.4 Å²	76.4	63%	0.626	41%	0.407	S	S	*	.	H	α-helix	trans	-68	-34.3	172.2	-74.9	167	-170.1	-175.5	4.6	112.6	P658 Q659 A660 T666	P658-R662 WeakPolarHBondContact O-CD 3.38Å; P658-R662 VanDerWaalsContact O-CG 3.24Å; P658-R662 WeakPolarHBondContact O-CG 3.29Å; P658-R662 PolarHBondContact O-N 3.26Å; Q659-R662 WeakPolarHBondContact O-CB 3.49Å; Q659-R662 PolarHBondContact O-N 2.98Å; A660-R662 VanDerWaalsContact C-N 3.3Å; A660-R662 PolarHBondContact O-N 2.9Å; R662-T666 PolarHBondContact O-N 2.7Å; R662-T666 PolarHBondContact O-OG1 2.78Å
663	L	88.5	Confident	85.7	Confident	124 Å²	124	76.2 Å²	76.2	65%	0.649	41%	0.406	S	S	*	.	H	α-helix	trans	-66.1	-48.3	173.2	-60	174.2	0	0	0	110	Q659 A660 Q665 T666 Q667	Q659-L663 PolarHBondContact O-N 2.97Å; A660-L663 WeakPolarHBondContact O-CB 3.31Å; A660-L663 PolarHBondContact O-N 3.26Å; A660-L663 VanDerWaalsContact O-N 3.09Å; L663-Q665 PolarHBondContact O-N 2.71Å; L663-T666 WeakPolarHBondContact O-CB 3.24Å; L663-T666 PolarHBondContact O-N 2.73Å; L663-Q667 PolarHBondContact O-N 2.69Å
664	L	89.3	Confident	85.7	Confident	36 Å²	36	74.6 Å²	74.6	19%	0.188	40%	0.398	C	S	.	.	H	α-helix	trans	-59.3	-42.4	174.9	-60.7	-179	0	0	0	112.4	I652 L653 Y654 A660 R661 T666 Q667 I668	I652-L664 HydrophobicContact CG2-CB 4.4Å; I652-L664 HydrophobicContact CG2-CD1 4.28Å; I652-L664 HydrophobicContact CG2-CD2 4.14Å; L653-L664 WeakPolarHBondContact O-CD1 3.35Å; Y654-L664 HydrophobicContact CD2-CB 4.18Å; Y654-L664 HydrophobicContact CD2-CD1 4.29Å; Y654-L664 HydrophobicContact CE2-CB 4.3Å; A660-L664 PolarHBondContact O-N 2.83Å; A660-L664 VanDerWaalsContact O-N 3.13Å; R661-L664 PolarHBondContact O-N 3.4Å; L664-T666 PolarHBondContact O-N 3.1Å; L664-T666 VanDerWaalsContact O-N 3.13Å; L664-Q667 PolarHBondContact O-N 2.79Å; L664-Q667 VanDerWaalsContact O-N 3.1Å; L664-I668 VanDerWaalsContact O-CG1 3.28Å; L664-I668 WeakPolarHBondContact O-CG1 3.12Å; L664-I668 PolarHBondContact O-N 3.3Å
665	Q	86.2	Confident	85.8	Confident	35 Å²	35	74.6 Å²	74.6	16%	0.164	40%	0.398	C	S	.	.	H	α-helix	trans	-57.3	-26.9	173.3	-78.7	178.6	24.2	0	0	113.5	Y654 R661 L663 K669 A689	Y654-Q665 HydrophobicContact CE2-CG 4.06Å; Y654-Q665 PolarHBondContact OH-NE2 3.35Å; R661-Q665 WeakPolarHBondContact O-CB 3.43Å; R661-Q665 VanDerWaalsContact O-CG 3.28Å; R661-Q665 WeakPolarHBondContact O-CG 3.47Å; R661-Q665 PolarHBondContact O-N 3.03Å; L663-Q665 PolarHBondContact O-N 2.71Å; Q665-K669 VanDerWaalsContact O-CD 3.26Å; Q665-K669 WeakPolarHBondContact O-CD 3.48Å; Q665-K669 WeakPolarHBondContact O-CE 3.31Å; Q665-K669 WeakPolarHBondContact O-CG 3.18Å; Q665-K669 PolarHBondContact O-N 2.96Å; Q665-K669 VanDerWaalsContact O-N 3.17Å; Q665-A689 VanDerWaalsContact CD-CB 3.41Å; Q665-A689 HydrophobicContact CG-CB 3.9Å
666	T	83.5	Confident	86.1	Confident	90 Å²	90	69.8 Å²	69.8	55%	0.552	38%	0.377	S	S	*	.	H	α-helix	trans	-77.7	-38.9	178.1	-55.4	0	0	0	0	110.8	R662 L663 L664 K669 A670	R662-T666 PolarHBondContact O-N 2.7Å; R662-T666 PolarHBondContact O-OG1 2.78Å; L663-T666 WeakPolarHBondContact O-CB 3.24Å; L663-T666 PolarHBondContact O-N 2.73Å; L664-T666 PolarHBondContact O-N 3.1Å; L664-T666 VanDerWaalsContact O-N 3.13Å; T666-K669 PolarHBondContact O-N 3.32Å; T666-A670 PolarHBondContact O-N 2.75Å
667	Q	83.2	Confident	86.5	Confident	107 Å²	107	68 Å²	68	50%	0.5	36%	0.358	S	S	.	.	H	α-helix	trans	-64.8	-42.9	171.1	-62	176.8	-8	0	0	112	I652 L663 L664 K669 A670	I652-Q667 HydrophobicContact CD1-CB 3.96Å; L663-Q667 PolarHBondContact O-N 2.69Å; L664-Q667 PolarHBondContact O-N 2.79Å; L664-Q667 VanDerWaalsContact O-N 3.1Å; Q667-K669 PolarHBondContact O-N 2.75Å; Q667-A670 WeakPolarHBondContact O-CB 3.34Å; Q667-A670 PolarHBondContact O-N 3.48Å; Q667-A670 VanDerWaalsContact O-N 3.1Å
668	I	84.7	Confident	86.8	Confident	6 Å²	6	65 Å²	65	3%	0.031	34%	0.337	C	S	.	.	H	α-helix	trans	-60.2	-43.3	176.9	-67.4	163.6	0	0	0	111.2	I652 Y654 L664 A670 S671 I673 L676 L690 V693	I652-I668 HydrophobicContact CD1-CG1 4.14Å; Y654-I668 HydrophobicContact CD2-CD1 3.88Å; Y654-I668 HydrophobicContact CE2-CD1 4.05Å; L664-I668 VanDerWaalsContact O-CG1 3.28Å; L664-I668 WeakPolarHBondContact O-CG1 3.12Å; L664-I668 PolarHBondContact O-N 3.3Å; I668-A670 PolarHBondContact O-N 3.02Å; I668-S671 PolarHBondContact O-N 2.88Å; I668-I673 HydrophobicContact CG1-CD1 4.25Å; I668-I673 HydrophobicContact CG2-CD1 4.17Å; I668-L676 HydrophobicContact CD1-CD1 3.68Å; I668-L676 HydrophobicContact CD1-CD2 4.22Å; I668-L676 HydrophobicContact CG1-CD1 4.24Å; I668-L690 HydrophobicContact CD1-CD2 4.11Å; I668-V693 HydrophobicContact CG2-CG2 3.85Å
669	K	80.4	Confident	87	Confident	133 Å²	133	61.8 Å²	61.8	58%	0.578	32%	0.316	S	S	*	.	H	α-helix	trans	-63.3	-25.3	176.1	-72.9	162	-162.5	159.9	0	113.6	Q665 T666 Q667 S671	Q665-K669 VanDerWaalsContact O-CD 3.26Å; Q665-K669 WeakPolarHBondContact O-CD 3.48Å; Q665-K669 WeakPolarHBondContact O-CE 3.31Å; Q665-K669 WeakPolarHBondContact O-CG 3.18Å; Q665-K669 PolarHBondContact O-N 2.96Å; Q665-K669 VanDerWaalsContact O-N 3.17Å; T666-K669 PolarHBondContact O-N 3.32Å; Q667-K669 PolarHBondContact O-N 2.75Å; K669-S671 PolarHBondContact O-N 3.35Å
670	A	79.1	Confident	87.2	Confident	59 Å²	59	56 Å²	56	49%	0.488	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-2.6	174.8	0	0	0	0	0	113.3	T666 Q667 I668 K672	T666-A670 PolarHBondContact O-N 2.75Å; Q667-A670 WeakPolarHBondContact O-CB 3.34Å; Q667-A670 PolarHBondContact O-N 3.48Å; Q667-A670 VanDerWaalsContact O-N 3.1Å; I668-A670 PolarHBondContact O-N 3.02Å; A670-K672 PolarHBondContact O-N 2.72Å; A670-K672 VanDerWaalsContact O-N 3.09Å
671	S	69.7	Low	87.2	Confident	100 Å²	100	58.7 Å²	58.7	70%	0.699	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	18.7	176.3	-53.2	0	0	0	0	115.7	I668 K669 I673	I668-S671 PolarHBondContact O-N 2.88Å; K669-S671 PolarHBondContact O-N 3.35Å; S671-I673 PolarHBondContact O-N 3.39Å
672	K	76.3	Confident	87.3	Confident	180 Å²	180	59.4 Å²	59.4	78%	0.783	30%	0.296	S	S	*	.			trans	-87.8	33.8	179.3	-63.3	-172.4	178.1	-177.1	0	113.3	A670	A670-K672 PolarHBondContact O-N 2.72Å; A670-K672 VanDerWaalsContact O-N 3.09Å
673	I	86.9	Confident	87.6	Confident	15 Å²	15	51.5 Å²	51.5	8%	0.077	27%	0.267	C	S	.	.			trans	-120.4	141.1	-174	70.7	178.6	0	0	0	110.7	P625 I652 I668 S671 L676 W695	P625-I673 HydrophobicContact CB-CD1 4.49Å; P625-I673 HydrophobicContact CB-CG1 4.23Å; I652-I673 HydrophobicContact CD1-CG2 3.48Å; I652-I673 VanDerWaalsContact CD1-CG2 3.48Å; I652-I673 HydrophobicContact CG1-CG2 3.93Å; I668-I673 HydrophobicContact CG1-CD1 4.25Å; I668-I673 HydrophobicContact CG2-CD1 4.17Å; S671-I673 PolarHBondContact O-N 3.39Å; I673-L676 HydrophobicContact CD1-CB 4.45Å; I673-W695 HydrophobicContact CD1-CH2 4.14Å; I673-W695 HydrophobicContact CD1-CZ3 4.31Å
674	N	91.7	Very high	87.7	Confident	22 Å²	22	46.9 Å²	46.9	12%	0.118	24%	0.243	C	C	.	.	S	Bend	trans	-90.4	-49.6	167.2	-60.9	116.7	0	0	0	110.1	M617 N623 F626 V649 K650	M617-N674 HydrophobicContact CE-CB 4.28Å; M617-N674 HydrophobicContact SD-CB 4.23Å; N623-N674 WeakPolarHBondContact O-CA 3.49Å; N623-N674 PolarHBondContact O-ND2 2.98Å; F626-N674 WeakPolarHBondContact CD2-O 3.48Å; F626-N674 PolarHBondContact N-O 3.06Å; V649-N674 HydrophobicContact CG1-CB 3.98Å; K650-N674 VanDerWaalsContact CB-OD1 3.31Å; K650-N674 WeakPolarHBondContact CB-OD1 3.49Å; K650-N674 PolarHBondContact N-OD1 2.91Å; K650-N674 PolarHBondContact O-N 3.19Å
675	V	94.5	Very high	87.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	135.8	-173.5	-170.9	0	0	0	0	110.6	I613 F626 I628 F642 V649 K650 K651 I652 L677	I613-V675 HydrophobicContact CG2-CG2 4.2Å; F626-V675 HydrophobicContact CB-CG2 4.32Å; F626-V675 HydrophobicContact CD2-CG2 4.2Å; F626-V675 WeakPolarHBondContact O-CA 3.47Å; I628-V675 HydrophobicContact CD1-CG1 3.5Å; I628-V675 VanDerWaalsContact CD1-CG1 3.5Å; I628-V675 HydrophobicContact CG1-CG1 3.77Å; F642-V675 HydrophobicContact CE1-CG2 4.41Å; F642-V675 HydrophobicContact CE2-CG1 4.35Å; F642-V675 HydrophobicContact CZ-CG1 4.16Å; F642-V675 HydrophobicContact CZ-CG2 4.31Å; V649-V675 HydrophobicContact CG1-CB 4.48Å; V649-V675 HydrophobicContact CG1-CG2 3.49Å; V649-V675 VanDerWaalsContact CG1-CG2 3.49Å; K650-V675 PolarHBondContact O-N 3.43Å; K651-V675 CarbonylContact C-O 3.52Å; K651-V675 WeakPolarHBondContact CA-O 3.43Å; I652-V675 PolarHBondContact N-O 3.45Å; V675-L677 HydrophobicContact CB-CD1 4.42Å; V675-L677 HydrophobicContact CG1-CD1 3.75Å
676	L	94.7	Very high	88.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	118.1	165.5	-175	69.5	0	0	0	109.5	F626 L627 I628 I652 Y654 I668 I673 L690 W695	F626-L676 PolarHBondContact O-N 2.88Å; L627-L676 HydrophobicContact CD1-CB 4.21Å; L627-L676 HydrophobicContact CD1-CD2 3.94Å; L627-L676 HydrophobicContact CD1-CG 4.34Å; I628-L676 PolarHBondContact N-O 3.35Å; I652-L676 HydrophobicContact CB-CD1 3.86Å; I652-L676 HydrophobicContact CG2-CD1 3.72Å; Y654-L676 HydrophobicContact CD2-CD1 4.44Å; I668-L676 HydrophobicContact CD1-CD1 3.68Å; I668-L676 HydrophobicContact CD1-CD2 4.22Å; I668-L676 HydrophobicContact CG1-CD1 4.24Å; I673-L676 HydrophobicContact CD1-CB 4.45Å; L676-L690 HydrophobicContact CD2-CD2 3.78Å; L676-W695 HydrophobicContact CB-CH2 3.66Å; L676-W695 HydrophobicContact CB-CZ3 3.88Å; L676-W695 HydrophobicContact CD2-CH2 3.52Å; L676-W695 HydrophobicContact CD2-CZ2 3.91Å; L676-W695 HydrophobicContact CG-CH2 4.21Å
677	L	94.5	Very high	88.4	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.5	169.6	-71.3	82	0	0	0	108.3	W638 F642 K651 I652 L653 Y654 V675	W638-L677 HydrophobicContact CB-CD2 3.71Å; F642-L677 HydrophobicContact CD2-CD1 4.25Å; F642-L677 HydrophobicContact CD2-CD2 4.27Å; F642-L677 HydrophobicContact CE2-CD1 4.16Å; F642-L677 HydrophobicContact CE2-CD2 4.44Å; K651-L677 HydrophobicContact CB-CD1 3.84Å; I652-L677 PolarHBondContact O-N 3.24Å; L653-L677 HydrophobicContact CD1-CB 4.36Å; Y654-L677 WeakPolarHBondContact CB-O 3.44Å; Y654-L677 PolarHBondContact N-O 2.96Å; V675-L677 HydrophobicContact CB-CD1 4.42Å; V675-L677 HydrophobicContact CG1-CD1 3.75Å
678	T	94.4	Very high	88.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	166	-177.4	-176.2	0	0	0	0	111	L627 I628 I629 V630 I683	L627-T678 HydrophobicContact CD1-CG2 3.77Å; I628-T678 PolarHBondContact O-N 2.78Å; I629-T678 CarbonylContact C-O 3.56Å; I629-T678 WeakPolarHBondContact CA-O 3.49Å; I629-T678 HydrophobicContact CG1-CG2 4.37Å; V630-T678 PolarHBondContact N-O 3.37Å; T678-I683 HydrophobicContact CG2-CD1 3.75Å; T678-I683 HydrophobicContact CG2-CG1 3.78Å
679	T	92.8	Very high	88.8	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.043	25%	0.253	C	S	.	.			trans	-103.1	160.1	175.6	72.2	0	0	0	0	112.3	V630 L632 M635 E681 Y682 I683	V630-T679 VanDerWaalsContact O-CA 3.31Å; V630-T679 WeakPolarHBondContact O-CA 3.4Å; L632-T679 HydrophobicContact CB-CG2 4.11Å; L632-T679 HydrophobicContact CD1-CG2 3.84Å; M635-T679 HydrophobicContact SD-CG2 3.75Å; T679-E681 PolarHBondContact O-N 2.66Å; T679-Y682 HydrophobicContact CG2-CD2 4.32Å; T679-Y682 PolarHBondContact O-N 2.87Å; T679-Y682 VanDerWaalsContact O-N 3.11Å; T679-Y682 WeakPolarHBondContact OG1-CD2 3.3Å; T679-I683 WeakPolarHBondContact O-CG1 3.28Å; T679-I683 PolarHBondContact O-N 3.23Å
680	Y	91.7	Very high	89.3	Confident	30 Å²	30	42.4 Å²	42.4	12%	0.118	23%	0.226	C	C	.	.	H	α-helix	trans	-52.2	-38.6	175.7	-40.5	-79.2	0	0	0	112.3	I629 P631 I683 I684 I700 D701 R705 L713	I629-Y680 HydrophobicContact CG2-CD1 3.42Å; I629-Y680 VanDerWaalsContact CG2-CD1 3.42Å; I629-Y680 HydrophobicContact CG2-CE1 3.86Å; I629-Y680 HydrophobicContact CG2-CG 4.08Å; P631-Y680 HydrophobicContact CB-CE2 4.44Å; P631-Y680 WeakPolarHBondContact CD-OH 3.47Å; P631-Y680 HydrophobicContact CG-CE2 4.15Å; Y680-I683 WeakPolarHBondContact O-CB 3.14Å; Y680-I683 PolarHBondContact O-N 2.88Å; Y680-I684 WeakPolarHBondContact O-CG1 3.31Å; Y680-I684 PolarHBondContact O-N 3.11Å; Y680-I684 VanDerWaalsContact O-N 3.11Å; Y680-I700 HydrophobicContact CE1-CG2 3.9Å; Y680-D701 PolarHBondContact OH-O 3.09Å; Y680-R705 HydrophobicContact CE2-CG 4.25Å; Y680-L713 HydrophobicContact CD1-CD1 4.28Å; Y680-L713 HydrophobicContact CD1-CD2 3.46Å; Y680-L713 VanDerWaalsContact CD1-CD2 3.46Å; Y680-L713 HydrophobicContact CE1-CD2 4.15Å; Y680-L713 HydrophobicContact CG-CD2 4.11Å
681	E	90.5	Very high	89.8	Confident	96 Å²	96	41 Å²	41	45%	0.449	21%	0.213	S	C	.	.	H	α-helix	trans	-64.3	-42.4	179.3	-77.5	-62.6	106.2	0	0	112.6	T679 I684 K685	T679-E681 PolarHBondContact O-N 2.66Å; E681-I684 PolarHBondContact O-N 2.89Å; E681-K685 WeakPolarHBondContact O-CB 3.47Å; E681-K685 WeakPolarHBondContact O-CD 3.41Å; E681-K685 WeakPolarHBondContact O-CG 3.21Å; E681-K685 PolarHBondContact O-N 2.99Å; E681-K685 WeakPolarHBondContact OE2-CE 3.49Å; E681-K685 IonicContact OE2-NZ 3.98Å; E681-K685 PolarHBondContact OE2-NZ 3.04Å
682	Y	92.8	Very high	90.7	Very high	39 Å²	39	44.1 Å²	44.1	15%	0.153	21%	0.214	C	C	.	.	H	α-helix	trans	-73.4	-32.7	177.2	-65.9	-51	0	0	0	112.3	Y654 G656 T679 I684 K685 D686	Y654-Y682 HydrophobicContact CD1-CD2 4.31Å; Y654-Y682 HydrophobicContact CD1-CG 4.08Å; Y654-Y682 HydrophobicContact CE1-CG 4.27Å; Y654-Y682 WeakPolarHBondContact O-CD2 3.44Å; Y654-Y682 VanDerWaalsContact O-CE2 3.24Å; Y654-Y682 WeakPolarHBondContact O-CE2 3.38Å; G656-Y682 PolarHBondContact N-OH 3.13Å; T679-Y682 HydrophobicContact CG2-CD2 4.32Å; T679-Y682 PolarHBondContact O-N 2.87Å; T679-Y682 VanDerWaalsContact O-N 3.11Å; T679-Y682 WeakPolarHBondContact OG1-CD2 3.3Å; Y682-I684 VanDerWaalsContact C-N 3.27Å; Y682-I684 PolarHBondContact O-N 2.96Å; Y682-K685 PolarHBondContact O-N 3.37Å; Y682-D686 PolarHBondContact O-N 2.92Å
683	I	93.3	Very high	91.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-58.3	-38.6	171	-74.6	-72.9	0	0	0	111.7	L627 I629 T678 T679 Y680 K687 L690 L713 V716 L717 Y721	L627-I683 HydrophobicContact CD1-CD1 4.28Å; L627-I683 HydrophobicContact CD2-CD1 4.01Å; I629-I683 HydrophobicContact CD1-CD1 3.96Å; I629-I683 HydrophobicContact CD1-CG1 3.92Å; I629-I683 HydrophobicContact CG1-CD1 4.2Å; I629-I683 HydrophobicContact CG1-CG1 4.1Å; I629-I683 HydrophobicContact CG2-CG1 4.21Å; T678-I683 HydrophobicContact CG2-CD1 3.75Å; T678-I683 HydrophobicContact CG2-CG1 3.78Å; T679-I683 WeakPolarHBondContact O-CG1 3.28Å; T679-I683 PolarHBondContact O-N 3.23Å; Y680-I683 WeakPolarHBondContact O-CB 3.14Å; Y680-I683 PolarHBondContact O-N 2.88Å; I683-K687 WeakPolarHBondContact O-CB 3.38Å; I683-L690 HydrophobicContact CD1-CD1 4.38Å; I683-L713 HydrophobicContact CG2-CD1 4.18Å; I683-V716 HydrophobicContact CG2-CG1 4.46Å; I683-L717 HydrophobicContact CG2-CD2 3.78Å; I683-Y721 HydrophobicContact CD1-CE1 3.88Å; I683-Y721 HydrophobicContact CG2-CE2 3.9Å; I683-Y721 PolarHBondContact O-OH 3.37Å
684	I	92.4	Very high	91.4	Very high	28 Å²	28	44.4 Å²	44.4	14%	0.144	22%	0.217	C	C	.	.	H	α-helix	trans	-78	-45.7	177.4	-66.9	169.4	0	0	0	111.6	Y680 E681 Y682 K712 L713	Y680-I684 WeakPolarHBondContact O-CG1 3.31Å; Y680-I684 PolarHBondContact O-N 3.11Å; Y680-I684 VanDerWaalsContact O-N 3.11Å; E681-I684 PolarHBondContact O-N 2.89Å; Y682-I684 VanDerWaalsContact C-N 3.27Å; Y682-I684 PolarHBondContact O-N 2.96Å; I684-K712 HydrophobicContact CG2-CD 4.41Å; I684-L713 HydrophobicContact CD1-CB 4.4Å
685	K	91.3	Very high	91.5	Very high	126 Å²	126	43.6 Å²	43.6	55%	0.548	21%	0.212	S	C	.	.	H	α-helix	trans	-71.7	-50	-174.6	-72	165.6	-172	165.9	0	112.7	E681 Y682	E681-K685 WeakPolarHBondContact O-CB 3.47Å; E681-K685 WeakPolarHBondContact O-CD 3.41Å; E681-K685 WeakPolarHBondContact O-CG 3.21Å; E681-K685 PolarHBondContact O-N 2.99Å; E681-K685 WeakPolarHBondContact OE2-CE 3.49Å; E681-K685 IonicContact OE2-NZ 3.98Å; E681-K685 PolarHBondContact OE2-NZ 3.04Å; Y682-K685 PolarHBondContact O-N 3.37Å
686	D	91.4	Very high	91.4	Very high	24 Å²	24	49 Å²	49	13%	0.128	24%	0.235	C	C	.	.	S	Bend	trans	-99.4	20.7	-172.3	-63.5	-13.3	0	0	0	112.7	Y654 R661 Y682 S688 A689 L690	Y654-D686 HydrophobicContact CE1-CB 4.17Å; Y654-D686 VanDerWaalsContact CE1-OD2 3.23Å; Y654-D686 WeakPolarHBondContact CE1-OD2 3.18Å; Y654-D686 WeakPolarHBondContact OH-CB 3.2Å; Y654-D686 PolarHBondContact OH-OD2 3.44Å; R661-D686 IonicContact CZ-OD2 3.21Å; R661-D686 VanDerWaalsContact CZ-OD2 3.3Å; R661-D686 IonicContact NE-OD2 2.75Å; R661-D686 PolarHBondContact NE-OD2 2.85Å; R661-D686 IonicContact NH2-OD1 2.71Å; R661-D686 PolarHBondContact NH2-OD1 3.19Å; R661-D686 VanDerWaalsContact NH2-OD1 3.12Å; R661-D686 IonicContact NH2-OD2 3.76Å; R661-D686 PolarHBondContact NH2-OD2 2.92Å; Y682-D686 PolarHBondContact O-N 2.92Å; D686-S688 PolarHBondContact O-N 2.91Å; D686-A689 PolarHBondContact O-N 2.78Å; D686-L690 PolarHBondContact O-N 2.93Å
687	K	90.8	Very high	91.4	Very high	61 Å²	61	49.1 Å²	49.1	27%	0.265	24%	0.236	S	C	.	.	H	α-helix	trans	-49.1	-36.7	-177.6	66.7	175.5	-179.2	171.7	0	114.1	I683 A689 L690 S691 V716 Y720 Y721	I683-K687 WeakPolarHBondContact O-CB 3.38Å; K687-A689 PolarHBondContact O-N 3Å; K687-A689 VanDerWaalsContact O-N 3.13Å; K687-L690 PolarHBondContact O-N 3.11Å; K687-S691 WeakPolarHBondContact O-CB 3.33Å; K687-S691 PolarHBondContact O-N 2.87Å; K687-S691 PolarHBondContact O-OG 2.93Å; K687-V716 HydrophobicContact CD-CG1 4.45Å; K687-Y720 HydrophobicContact CD-CD1 4.25Å; K687-Y720 HydrophobicContact CD-CD2 4.37Å; K687-Y720 HydrophobicContact CD-CE1 4.17Å; K687-Y720 HydrophobicContact CD-CE2 4.33Å; K687-Y720 HydrophobicContact CD-CG 4.35Å; K687-Y720 PolarHBondContact NZ-OH 3Å; K687-Y721 HydrophobicContact CB-CE2 4.36Å
688	S	88.3	Confident	91.4	Very high	85 Å²	85	49.1 Å²	49.1	59%	0.594	24%	0.236	S	C	*	.	H	α-helix	trans	-68.1	-10.5	-178.4	61.6	0	0	0	0	114.6	D686 K692	D686-S688 PolarHBondContact O-N 2.91Å; S688-K692 WeakPolarHBondContact O-CD 3.35Å; S688-K692 WeakPolarHBondContact O-CE 3.03Å; S688-K692 PolarHBondContact O-NZ 2.64Å
689	A	87.6	Confident	91.5	Very high	15 Å²	15	49.1 Å²	49.1	12%	0.124	24%	0.236	C	C	.	.	H	α-helix	trans	-104	-52	168.9	0	0	0	0	0	111.4	Q665 D686 K687 S691 K692	Q665-A689 VanDerWaalsContact CD-CB 3.41Å; Q665-A689 HydrophobicContact CG-CB 3.9Å; D686-A689 PolarHBondContact O-N 2.78Å; K687-A689 PolarHBondContact O-N 3Å; K687-A689 VanDerWaalsContact O-N 3.13Å; A689-S691 PolarHBondContact O-N 2.86Å; A689-K692 PolarHBondContact O-N 2.84Å
690	L	90.9	Very high	91.6	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-72.2	-28.2	-171.8	-60.3	-178.6	0	0	0	113.8	Y654 I668 L676 I683 D686 K687 K692 V693 W695 Y721	Y654-L690 HydrophobicContact CD1-CD1 4.32Å; Y654-L690 HydrophobicContact CE1-CD1 4.08Å; Y654-L690 HydrophobicContact CE2-CD2 4.32Å; I668-L690 HydrophobicContact CD1-CD2 4.11Å; L676-L690 HydrophobicContact CD2-CD2 3.78Å; I683-L690 HydrophobicContact CD1-CD1 4.38Å; D686-L690 PolarHBondContact O-N 2.93Å; K687-L690 PolarHBondContact O-N 3.11Å; L690-K692 PolarHBondContact O-N 2.91Å; L690-V693 PolarHBondContact O-N 2.77Å; L690-W695 PolarHBondContact O-NE1 2.95Å; L690-W695 VanDerWaalsContact O-NE1 3.13Å; L690-Y721 HydrophobicContact CB-CE1 3.87Å
691	S	90	Very high	91.6	Very high	30 Å²	30	48.1 Å²	48.1	21%	0.21	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-1.8	178.9	96.1	0	0	0	0	114.1	K687 A689 Y720	K687-S691 WeakPolarHBondContact O-CB 3.33Å; K687-S691 PolarHBondContact O-N 2.87Å; K687-S691 PolarHBondContact O-OG 2.93Å; A689-S691 PolarHBondContact O-N 2.86Å; S691-Y720 WeakPolarHBondContact CB-O 3.41Å
692	K	88.5	Confident	91.4	Very high	165 Å²	165	44.8 Å²	44.8	72%	0.717	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-17.6	174.8	-71.4	171.4	173.4	150.8	0	112.8	S688 A689 L690	S688-K692 WeakPolarHBondContact O-CD 3.35Å; S688-K692 WeakPolarHBondContact O-CE 3.03Å; S688-K692 PolarHBondContact O-NZ 2.64Å; A689-K692 PolarHBondContact O-N 2.84Å; L690-K692 PolarHBondContact O-N 2.91Å
693	V	88.6	Confident	91	Very high	26 Å²	26	43 Å²	43	16%	0.158	21%	0.21	C	C	.	.	S	Bend	trans	-81.6	131.5	172.2	179.5	0	0	0	0	107.9	P625 I668 L690 W695	P625-V693 HydrophobicContact CB-CG1 4.31Å; P625-V693 HydrophobicContact CG-CG1 3.71Å; I668-V693 HydrophobicContact CG2-CG2 3.85Å; L690-V693 PolarHBondContact O-N 2.77Å; V693-W695 HydrophobicContact CB-CD2 4.34Å; V693-W695 HydrophobicContact CB-CH2 4.4Å; V693-W695 HydrophobicContact CB-CZ2 3.7Å; V693-W695 HydrophobicContact CG1-CD2 3.87Å; V693-W695 HydrophobicContact CG1-CE3 4.13Å; V693-W695 HydrophobicContact CG1-CG 4.44Å; V693-W695 HydrophobicContact CG1-CH2 4.06Å; V693-W695 HydrophobicContact CG1-CZ2 3.77Å; V693-W695 HydrophobicContact CG1-CZ3 4.24Å; V693-W695 HydrophobicContact CG2-CZ2 4.13Å; V693-W695 PolarHBondContact O-N 3.2Å; V693-W695 PolarHBondContact O-NE1 2.61Å
694	K	89.6	Confident	90.4	Very high	176 Å²	176	43.9 Å²	43.9	77%	0.765	21%	0.214	S	C	*	.			trans	-82	110.1	167.4	-68.3	-173.3	177.5	-174	0	107.7	P625	P625-K694 WeakPolarHBondContact CG-O 3.4Å
695	W	93	Very high	89.8	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.015	23%	0.231	C	C	.	.			trans	-83.6	142.5	-176.6	-61.3	96.1	0	0	0	109.8	P625 F626 L627 I673 L676 L690 V693 Y721 T722 A723	P625-W695 HydrophobicContact CB-CE3 3.87Å; P625-W695 HydrophobicContact CB-CZ3 3.8Å; P625-W695 HydrophobicContact CG-CE3 4.21Å; F626-W695 WeakPolarHBondContact O-CZ3 3.22Å; L627-W695 HydrophobicContact CB-CB 4.48Å; L627-W695 HydrophobicContact CB-CD2 3.74Å; L627-W695 HydrophobicContact CB-CE3 3.6Å; L627-W695 HydrophobicContact CB-CG 4.12Å; L627-W695 HydrophobicContact CB-CZ3 4.13Å; L627-W695 HydrophobicContact CD1-CD2 4.41Å; L627-W695 HydrophobicContact CD1-CE3 4.42Å; L627-W695 HydrophobicContact CD1-CH2 4.12Å; L627-W695 HydrophobicContact CD1-CZ2 4.11Å; L627-W695 HydrophobicContact CD1-CZ3 4.26Å; L627-W695 HydrophobicContact CD2-CD2 4.2Å; L627-W695 HydrophobicContact CD2-CG 4.22Å; L627-W695 HydrophobicContact CG-CD2 4.35Å; L627-W695 HydrophobicContact CG-CE3 4.49Å; I673-W695 HydrophobicContact CD1-CH2 4.14Å; I673-W695 HydrophobicContact CD1-CZ3 4.31Å; L676-W695 HydrophobicContact CB-CH2 3.66Å; L676-W695 HydrophobicContact CB-CZ3 3.88Å; L676-W695 HydrophobicContact CD2-CH2 3.52Å; L676-W695 HydrophobicContact CD2-CZ2 3.91Å; L676-W695 HydrophobicContact CG-CH2 4.21Å; L690-W695 PolarHBondContact O-NE1 2.95Å; L690-W695 VanDerWaalsContact O-NE1 3.13Å; V693-W695 HydrophobicContact CB-CD2 4.34Å; V693-W695 HydrophobicContact CB-CH2 4.4Å; V693-W695 HydrophobicContact CB-CZ2 3.7Å; V693-W695 HydrophobicContact CG1-CD2 3.87Å; V693-W695 HydrophobicContact CG1-CE3 4.13Å; V693-W695 HydrophobicContact CG1-CG 4.44Å; V693-W695 HydrophobicContact CG1-CH2 4.06Å; V693-W695 HydrophobicContact CG1-CZ2 3.77Å; V693-W695 HydrophobicContact CG1-CZ3 4.24Å; V693-W695 HydrophobicContact CG2-CZ2 4.13Å; V693-W695 PolarHBondContact O-N 3.2Å; V693-W695 PolarHBondContact O-NE1 2.61Å; W695-Y721 AromaticContact NE1-CD1 3.93Å; W695-T722 PolarHBondContact N-O 2.98Å; W695-T722 VanDerWaalsContact N-O 3.1Å; W695-A723 HydrophobicContact CB-CB 4.16Å; W695-A723 WeakPolarHBondContact O-CA 3.4Å
696	K	92.4	Very high	89.3	Confident	113 Å²	113	42.9 Å²	42.9	49%	0.491	21%	0.205	S	C	.	.	S	Bend	trans	-84.8	-48.4	177.4	-78.6	-69.1	-170.7	167.4	0	111.4	G624 P625 P724 Y725	G624-K696 WeakPolarHBondContact O-CG 3.5Å; P625-K696 PolarHBondContact O-N 2.71Å; K696-P724 WeakPolarHBondContact O-CD 3.28Å; K696-P724 WeakPolarHBondContact O-CG 3.48Å; K696-Y725 WeakPolarHBondContact O-CD2 3.45Å
697	Y	94.5	Very high	88.5	Confident	3 Å²	3	44.8 Å²	44.8	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	135	177	-142.1	-53.6	0	0	0	108.1	Y589 L612 L616 L627 I699 Y725 L727	Y589-Y697 HydrophobicContact CD2-CD2 4.31Å; Y589-Y697 AromaticContact CD2-CE2 3.92Å; Y589-Y697 HydrophobicContact CD2-CE2 3.92Å; L612-Y697 HydrophobicContact CD2-CE2 4.01Å; L616-Y697 HydrophobicContact CD1-CD2 3.88Å; L616-Y697 HydrophobicContact CD1-CE2 4.01Å; L627-Y697 PolarHBondContact N-O 2.81Å; Y697-I699 HydrophobicContact CD1-CD1 4.26Å; Y697-I699 HydrophobicContact CD1-CG1 3.72Å; Y697-I699 HydrophobicContact CE1-CG1 4.15Å; Y697-I699 HydrophobicContact CG-CG1 4.45Å; Y697-Y725 HydrophobicContact CD2-CG 4.26Å; Y697-Y725 HydrophobicContact CE2-CG 4.3Å; Y697-L727 HydrophobicContact CE1-CB 3.66Å
698	M	95.1	Very high	87.9	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	122.3	168.9	-175.7	-175.6	-59.6	0	0	109.2	L627 I629 I700 L717 A723 Y725 R726 L727 F747	L627-M698 HydrophobicContact CD2-CE 4.27Å; L627-M698 HydrophobicContact CD2-CG 4.34Å; I629-M698 HydrophobicContact CD1-CG 4.31Å; I629-M698 HydrophobicContact CD1-SD 4.31Å; M698-I700 HydrophobicContact CG-CG1 4.24Å; M698-I700 HydrophobicContact SD-CD1 4.15Å; M698-L717 HydrophobicContact CE-CD2 4.08Å; M698-L717 HydrophobicContact SD-CD1 4.35Å; M698-L717 HydrophobicContact SD-CD2 3.91Å; M698-A723 HydrophobicContact CB-CB 3.7Å; M698-A723 HydrophobicContact CE-CB 4.09Å; M698-Y725 PolarHBondContact N-O 2.83Å; M698-R726 WeakPolarHBondContact O-CA 3.24Å; M698-L727 PolarHBondContact O-N 2.93Å; M698-F747 HydrophobicContact SD-CZ 4.06Å
699	I	96	Very high	87.3	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.6	179.2	-48.6	-174.2	0	0	0	107.7	T609 I613 L627 I628 I629 Y697 L727 L729	T609-I699 HydrophobicContact CG2-CD1 3.57Å; T609-I699 HydrophobicContact CG2-CG2 4.1Å; I613-I699 HydrophobicContact CD1-CD1 4.09Å; I613-I699 HydrophobicContact CG1-CD1 4.38Å; L627-I699 PolarHBondContact O-N 3.29Å; I628-I699 WeakPolarHBondContact CA-O 3.5Å; I628-I699 HydrophobicContact CG1-CB 4.44Å; I628-I699 HydrophobicContact CG2-CB 4.43Å; I629-I699 PolarHBondContact N-O 2.91Å; Y697-I699 HydrophobicContact CD1-CD1 4.26Å; Y697-I699 HydrophobicContact CD1-CG1 3.72Å; Y697-I699 HydrophobicContact CE1-CG1 4.15Å; Y697-I699 HydrophobicContact CG-CG1 4.45Å; I699-L727 WeakPolarHBondContact CA-O 3.35Å; I699-L727 HydrophobicContact CD1-CD2 4.46Å; I699-L727 HydrophobicContact CG1-CB 4.39Å; I699-L727 HydrophobicContact CG2-CB 4.26Å; I699-L727 HydrophobicContact CG2-CD2 4.14Å; I699-L727 HydrophobicContact CG2-CG 4.23Å; I699-L729 HydrophobicContact CG2-CD1 4.07Å; I699-L729 HydrophobicContact CG2-CG 4.16Å
700	I	94.5	Very high	86.8	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	111.3	-177.7	-52.1	-175.4	0	0	0	107.9	I629 Y680 M698 M706 L717 L727 L728 L729 F747	I629-I700 HydrophobicContact CB-CG1 4.43Å; I629-I700 HydrophobicContact CD1-CD1 4.41Å; I629-I700 HydrophobicContact CD1-CG1 4.24Å; Y680-I700 HydrophobicContact CE1-CG2 3.9Å; M698-I700 HydrophobicContact CG-CG1 4.24Å; M698-I700 HydrophobicContact SD-CD1 4.15Å; I700-M706 HydrophobicContact CD1-CE 3.94Å; I700-M706 HydrophobicContact CD1-SD 4.26Å; I700-L717 HydrophobicContact CD1-CD1 3.67Å; I700-L727 PolarHBondContact N-O 3.33Å; I700-L728 HydrophobicContact CB-CD2 3.79Å; I700-L728 HydrophobicContact CD1-CD2 4.1Å; I700-L728 HydrophobicContact CG1-CD2 4.21Å; I700-L728 HydrophobicContact CG2-CD2 4.49Å; I700-L729 PolarHBondContact O-N 3.03Å; I700-F747 HydrophobicContact CD1-CE1 3.63Å; I700-F747 HydrophobicContact CD1-CZ 3.64Å
701	D	92.7	Very high	86.3	Confident	15 Å²	15	51.8 Å²	51.8	8%	0.08	24%	0.24	C	C	.	.	S	Bend	trans	-76	155.6	170.7	-163.8	16.1	0	0	0	110.4	I629 V630 W638 Y680 G703 L729	I629-D701 PolarHBondContact O-N 3.24Å; V630-D701 HydrophobicContact CB-CB 4.34Å; V630-D701 HydrophobicContact CG1-CB 3.9Å; W638-D701 HydrophobicContact CZ2-CB 4.21Å; W638-D701 PolarHBondContact NE1-OD2 2.93Å; Y680-D701 PolarHBondContact OH-O 3.09Å; D701-G703 VanDerWaalsContact C-N 3.31Å; D701-G703 PolarHBondContact O-N 3.27Å; D701-L729 HydrophobicContact CB-CD1 4.44Å
702	E	87	Confident	86.2	Confident	26 Å²	26	57 Å²	57	12%	0.121	26%	0.259	C	S	.	.	S	Bend	trans	41.3	54.8	-170.9	-63.7	-69.8	-157.8	0	0	113.4	P631 H704 R705 L729 Q1017	P631-E702 HydrophobicContact CG-CB 3.93Å; P631-E702 HydrophobicContact CG-CG 3.78Å; E702-H704 PolarHBondContact O-N 3.02Å; E702-H704 IonicContact OE2-CE1 3.18Å; E702-H704 PolarHBondContact OE2-CE1 2.99Å; E702-H704 IonicContact OE2-ND1 2.74Å; E702-H704 PolarHBondContact OE2-ND1 3.04Å; E702-R705 HydrophobicContact CB-CG 4.34Å; E702-R705 WeakPolarHBondContact O-CB 3.48Å; E702-R705 VanDerWaalsContact O-CG 3.25Å; E702-R705 WeakPolarHBondContact O-CG 3.48Å; E702-R705 PolarHBondContact O-N 2.94Å; E702-L729 WeakPolarHBondContact CA-O 3.31Å; E702-L729 PolarHBondContact N-O 3.35Å; E702-L729 VanDerWaalsContact N-O 3.16Å; E702-Q1017 PolarHBondContact OE1-NE2 2.98Å
703	G	84.2	Confident	86.2	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.01	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-53.7	-24.8	-176.6	0	0	0	0	0	114.2	D701 R705 M706 L729 L744	D701-G703 VanDerWaalsContact C-N 3.31Å; D701-G703 PolarHBondContact O-N 3.27Å; G703-R705 PolarHBondContact O-N 2.79Å; G703-M706 PolarHBondContact O-N 3.37Å; G703-L729 PolarHBondContact N-O 3.2Å; G703-L744 VanDerWaalsContact O-CD2 3.28Å; G703-L744 WeakPolarHBondContact O-CD2 3.33Å
704	H	79.4	Confident	86.1	Confident	18 Å²	18	48.8 Å²	48.8	8%	0.083	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-52.9	-20.8	171.5	76.9	-109.5	0	0	0	113.4	E702 M706 K707 Q735	E702-H704 PolarHBondContact O-N 3.02Å; E702-H704 IonicContact OE2-CE1 3.18Å; E702-H704 PolarHBondContact OE2-CE1 2.99Å; E702-H704 IonicContact OE2-ND1 2.74Å; E702-H704 PolarHBondContact OE2-ND1 3.04Å; H704-M706 PolarHBondContact O-N 2.77Å; H704-K707 WeakPolarHBondContact O-CG 3.4Å; H704-K707 PolarHBondContact O-N 2.79Å; H704-Q735 PolarHBondContact CD2-NE2 3.4Å; H704-Q735 VanDerWaalsContact CD2-NE2 3.31Å; H704-Q735 VanDerWaalsContact CG-NE2 3.35Å
705	R	81	Confident	85.9	Confident	133 Å²	133	45.2 Å²	45.2	50%	0.502	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-59.8	-11.5	172.1	-68.2	-74.5	172.8	160.6	-2.8	114	Y680 E702 G703	Y680-R705 HydrophobicContact CE2-CG 4.25Å; E702-R705 HydrophobicContact CB-CG 4.34Å; E702-R705 WeakPolarHBondContact O-CB 3.48Å; E702-R705 VanDerWaalsContact O-CG 3.25Å; E702-R705 WeakPolarHBondContact O-CG 3.48Å; E702-R705 PolarHBondContact O-N 2.94Å; G703-R705 PolarHBondContact O-N 2.79Å
706	M	79.9	Confident	85.9	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-100	26.3	177.4	-62.2	-168.2	-63.3	0	0	114.6	I700 G703 H704 N708 L713 L717 L728 L744 F747	I700-M706 HydrophobicContact CD1-CE 3.94Å; I700-M706 HydrophobicContact CD1-SD 4.26Å; G703-M706 PolarHBondContact O-N 3.37Å; H704-M706 PolarHBondContact O-N 2.77Å; M706-N708 PolarHBondContact O-N 2.76Å; M706-L713 HydrophobicContact CG-CD2 3.91Å; M706-L713 HydrophobicContact SD-CD2 4.22Å; M706-L713 HydrophobicContact SD-CG 4.48Å; M706-L717 HydrophobicContact SD-CD1 4.34Å; M706-L728 HydrophobicContact CE-CD1 4.22Å; M706-L728 HydrophobicContact CE-CD2 3.57Å; M706-L744 HydrophobicContact CB-CD2 4.08Å; M706-F747 HydrophobicContact CE-CB 4.49Å; M706-F747 HydrophobicContact CE-CD1 3.7Å; M706-F747 HydrophobicContact CE-CD2 4.49Å; M706-F747 HydrophobicContact CE-CE1 4.03Å; M706-F747 HydrophobicContact CE-CG 3.94Å; M706-F747 HydrophobicContact SD-CD2 4.4Å; M706-F747 HydrophobicContact SD-CG 4.4Å
707	K	75.5	Confident	85.8	Confident	63 Å²	63	40.2 Å²	40.2	27%	0.274	19%	0.188	S	C	.	.			trans	-35	-35.1	177.7	-59.4	-165	154.3	-164.4	0	116.9	H704 Q735 N736 E740	H704-K707 WeakPolarHBondContact O-CG 3.4Å; H704-K707 PolarHBondContact O-N 2.79Å; K707-Q735 VanDerWaalsContact NZ-CB 3.31Å; K707-N736 PolarHBondContact NZ-ND2 2.92Å; K707-E740 HydrophobicContact CB-CG 4.07Å; K707-E740 VanDerWaalsContact CD-OE1 3.24Å; K707-E740 WeakPolarHBondContact CD-OE1 3.34Å; K707-E740 IonicContact NZ-OE1 2.82Å; K707-E740 WeakPolarHBondContact O-CA 3.49Å
708	N	77.3	Confident	85.4	Confident	84 Å²	84	43.3 Å²	43.3	45%	0.449	20%	0.204	S	C	.	.	S	Bend	trans	-125.1	126.7	-176.9	-174.1	-19.1	0	0	0	110.1	M706 H710 C711	M706-N708 PolarHBondContact O-N 2.76Å; N708-H710 PolarHBondContact O-N 2.89Å; N708-H710 WeakPolarHBondContact OD1-CB 3.37Å; N708-H710 PolarHBondContact OD1-N 3.12Å; N708-C711 WeakPolarHBondContact O-CB 3.42Å; N708-C711 PolarHBondContact O-N 2.9Å
709	H	74.9	Confident	85	Confident	62 Å²	62	48 Å²	48	29%	0.287	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24.5	177.1	80.7	-71.8	0	0	0	113.9	C711 W742 A743	H709-C711 PolarHBondContact O-N 2.86Å; H709-W742 HydrophobicContact CB-CH2 4.35Å; H709-W742 HydrophobicContact CB-CZ3 3.63Å; H709-W742 AromaticContact CG-CZ3 3.51Å; H709-W742 AromaticContact ND1-CZ3 3.66Å; H709-A743 HydrophobicContact CB-CB 4.29Å
710	H	77.8	Confident	84.7	Confident	123 Å²	123	53 Å²	53	57%	0.569	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-3.6	170.5	-62.5	-35.3	0	0	0	113.2	N708 K712 Q715	N708-H710 PolarHBondContact O-N 2.89Å; N708-H710 WeakPolarHBondContact OD1-CB 3.37Å; N708-H710 PolarHBondContact OD1-N 3.12Å; H710-K712 PolarHBondContact O-N 2.89Å; H710-Q715 PolarHBondContact O-NE2 3.42Å
711	C	81.3	Confident	84.6	Confident	41 Å²	41	53.1 Å²	53.1	28%	0.277	25%	0.253	S	S	.	.			trans	-59.1	133.7	179.1	-176.2	0	0	0	0	111.4	N708 H709 L713 T714 Q715	N708-C711 WeakPolarHBondContact O-CB 3.42Å; N708-C711 PolarHBondContact O-N 2.9Å; H709-C711 PolarHBondContact O-N 2.86Å; C711-L713 PolarHBondContact O-N 3.48Å; C711-L713 VanDerWaalsContact O-N 3.14Å; C711-T714 PolarHBondContact O-N 3.32Å; C711-T714 VanDerWaalsContact O-N 3.09Å; C711-Q715 PolarHBondContact O-N 3.19Å
712	K	86.4	Confident	84.3	Confident	139 Å²	139	56.5 Å²	56.5	60%	0.604	28%	0.275	S	S	*	.	H	α-helix	trans	-55	-31.1	177.6	-174.8	-178.7	178.9	-173.2	0	112.6	I684 H710 V716	I684-K712 HydrophobicContact CG2-CD 4.41Å; H710-K712 PolarHBondContact O-N 2.89Å; K712-V716 VanDerWaalsContact O-CB 3.3Å; K712-V716 WeakPolarHBondContact O-CB 3.35Å; K712-V716 WeakPolarHBondContact O-CG2 3.35Å; K712-V716 PolarHBondContact O-N 3.25Å
713	L	88.9	Confident	84.5	Confident	9 Å²	9	55.8 Å²	55.8	5%	0.047	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-57.8	173.5	176.9	62	0	0	0	110.9	Y680 I683 I684 M706 C711 Q715 V716 L717	Y680-L713 HydrophobicContact CD1-CD1 4.28Å; Y680-L713 HydrophobicContact CD1-CD2 3.46Å; Y680-L713 VanDerWaalsContact CD1-CD2 3.46Å; Y680-L713 HydrophobicContact CE1-CD2 4.15Å; Y680-L713 HydrophobicContact CG-CD2 4.11Å; I683-L713 HydrophobicContact CG2-CD1 4.18Å; I684-L713 HydrophobicContact CD1-CB 4.4Å; M706-L713 HydrophobicContact CG-CD2 3.91Å; M706-L713 HydrophobicContact SD-CD2 4.22Å; M706-L713 HydrophobicContact SD-CG 4.48Å; C711-L713 PolarHBondContact O-N 3.48Å; C711-L713 VanDerWaalsContact O-N 3.14Å; L713-Q715 VanDerWaalsContact C-N 3.3Å; L713-Q715 PolarHBondContact O-N 3.23Å; L713-V716 PolarHBondContact O-N 3.36Å; L713-L717 HydrophobicContact CD1-CD1 3.92Å; L713-L717 HydrophobicContact CD1-CG 4.11Å; L713-L717 HydrophobicContact CG-CD1 4.01Å; L713-L717 WeakPolarHBondContact O-CG 3.46Å; L713-L717 PolarHBondContact O-N 3.18Å
714	T	86.8	Confident	84.7	Confident	9 Å²	9	59.6 Å²	59.6	6%	0.055	30%	0.298	C	S	.	.	H	α-helix	trans	-55.6	-44.7	179.8	-40.3	0	0	0	0	111.4	C711 L717 N718 F747	C711-T714 PolarHBondContact O-N 3.32Å; C711-T714 VanDerWaalsContact O-N 3.09Å; T714-L717 PolarHBondContact O-N 3.23Å; T714-N718 WeakPolarHBondContact O-CB 3.44Å; T714-N718 PolarHBondContact O-N 3.31Å; T714-F747 HydrophobicContact CG2-CD2 3.92Å
715	Q	86.2	Confident	85.3	Confident	101 Å²	101	60.4 Å²	60.4	47%	0.472	30%	0.3	S	S	.	.	H	α-helix	trans	-61.6	-44.6	174.5	-68	178.9	1.3	0	0	112.8	H710 C711 L713 T719	H710-Q715 PolarHBondContact O-NE2 3.42Å; C711-Q715 PolarHBondContact O-N 3.19Å; L713-Q715 VanDerWaalsContact C-N 3.3Å; L713-Q715 PolarHBondContact O-N 3.23Å; Q715-T719 WeakPolarHBondContact O-CB 3.28Å; Q715-T719 PolarHBondContact O-N 3.49Å; Q715-T719 PolarHBondContact O-OG1 3.43Å
716	V	91.2	Very high	85.9	Confident	12 Å²	12	55.6 Å²	55.6	7%	0.073	28%	0.282	C	S	.	.	H	α-helix	trans	-67.4	-41.4	179.2	164	0	0	0	0	111.4	I683 K687 K712 L713 Y720 Y721	I683-V716 HydrophobicContact CG2-CG1 4.46Å; K687-V716 HydrophobicContact CD-CG1 4.45Å; K712-V716 VanDerWaalsContact O-CB 3.3Å; K712-V716 WeakPolarHBondContact O-CB 3.35Å; K712-V716 WeakPolarHBondContact O-CG2 3.35Å; K712-V716 PolarHBondContact O-N 3.25Å; L713-V716 PolarHBondContact O-N 3.36Å; V716-Y720 HydrophobicContact CG1-CD2 4.36Å; V716-Y720 WeakPolarHBondContact O-CB 3.38Å; V716-Y720 WeakPolarHBondContact O-CD2 3.39Å; V716-Y720 PolarHBondContact O-N 3.47Å; V716-Y721 HydrophobicContact CG1-CD2 4.35Å; V716-Y721 HydrophobicContact CG1-CE2 3.87Å
717	L	91.3	Very high	86.6	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-56	176.6	-69.3	175.7	0	0	0	110.7	I629 I683 M698 I700 M706 L713 T714 T719 Y721 F747	I629-L717 HydrophobicContact CD1-CD1 4.41Å; I629-L717 HydrophobicContact CD1-CD2 3.78Å; I683-L717 HydrophobicContact CG2-CD2 3.78Å; M698-L717 HydrophobicContact CE-CD2 4.08Å; M698-L717 HydrophobicContact SD-CD1 4.35Å; M698-L717 HydrophobicContact SD-CD2 3.91Å; I700-L717 HydrophobicContact CD1-CD1 3.67Å; M706-L717 HydrophobicContact SD-CD1 4.34Å; L713-L717 HydrophobicContact CD1-CD1 3.92Å; L713-L717 HydrophobicContact CD1-CG 4.11Å; L713-L717 HydrophobicContact CG-CD1 4.01Å; L713-L717 WeakPolarHBondContact O-CG 3.46Å; L713-L717 PolarHBondContact O-N 3.18Å; T714-L717 PolarHBondContact O-N 3.23Å; L717-T719 VanDerWaalsContact C-N 3.3Å; L717-T719 PolarHBondContact O-N 2.96Å; L717-Y721 HydrophobicContact CD2-CD2 4.08Å; L717-Y721 HydrophobicContact CD2-CG 4.31Å; L717-Y721 PolarHBondContact O-N 3.18Å; L717-F747 HydrophobicContact CB-CE2 3.89Å; L717-F747 HydrophobicContact CB-CZ 4.42Å; L717-F747 HydrophobicContact CD1-CE2 3.95Å; L717-F747 HydrophobicContact CD1-CZ 3.96Å
718	N	86.3	Confident	87.5	Confident	67 Å²	67	52.7 Å²	52.7	36%	0.358	27%	0.27	S	S	.	.	H	α-helix	trans	-65.3	-27.1	-178.8	-78.1	-16.2	0	0	0	114.2	T714 R726	T714-N718 WeakPolarHBondContact O-CB 3.44Å; T714-N718 PolarHBondContact O-N 3.31Å; N718-R726 PolarHBondContact OD1-NH1 2.97Å; N718-R726 PolarHBondContact OD1-NH2 3.48Å
719	T	87.2	Confident	88.3	Confident	101 Å²	101	48.7 Å²	48.7	62%	0.62	25%	0.248	S	C	*	.	H	α-helix	trans	-89	-34.8	-178.4	-53.8	0	0	0	0	113.8	Q715 L717	Q715-T719 WeakPolarHBondContact O-CB 3.28Å; Q715-T719 PolarHBondContact O-N 3.49Å; Q715-T719 PolarHBondContact O-OG1 3.43Å; L717-T719 VanDerWaalsContact C-N 3.3Å; L717-T719 PolarHBondContact O-N 2.96Å
720	Y	89.5	Confident	88.9	Confident	105 Å²	105	45.7 Å²	45.7	41%	0.412	24%	0.235	S	C	.	.	H	α-helix	trans	-113.9	-30.6	-169.3	-64.5	-96.6	0	0	0	114	K687 S691 V716	K687-Y720 HydrophobicContact CD-CD1 4.25Å; K687-Y720 HydrophobicContact CD-CD2 4.37Å; K687-Y720 HydrophobicContact CD-CE1 4.17Å; K687-Y720 HydrophobicContact CD-CE2 4.33Å; K687-Y720 HydrophobicContact CD-CG 4.35Å; K687-Y720 PolarHBondContact NZ-OH 3Å; S691-Y720 WeakPolarHBondContact CB-O 3.41Å; V716-Y720 HydrophobicContact CG1-CD2 4.36Å; V716-Y720 WeakPolarHBondContact O-CB 3.38Å; V716-Y720 WeakPolarHBondContact O-CD2 3.39Å; V716-Y720 PolarHBondContact O-N 3.47Å
721	Y	91.9	Very high	89.1	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.016	21%	0.212	C	C	.	.			trans	-102	133.9	-173	-67.7	-99	0	0	0	110.6	L627 I683 K687 L690 W695 V716 L717	L627-Y721 HydrophobicContact CD2-CD1 4.24Å; L627-Y721 HydrophobicContact CD2-CE1 4.48Å; I683-Y721 HydrophobicContact CD1-CE1 3.88Å; I683-Y721 HydrophobicContact CG2-CE2 3.9Å; I683-Y721 PolarHBondContact O-OH 3.37Å; K687-Y721 HydrophobicContact CB-CE2 4.36Å; L690-Y721 HydrophobicContact CB-CE1 3.87Å; W695-Y721 AromaticContact NE1-CD1 3.93Å; V716-Y721 HydrophobicContact CG1-CD2 4.35Å; V716-Y721 HydrophobicContact CG1-CE2 3.87Å; L717-Y721 HydrophobicContact CD2-CD2 4.08Å; L717-Y721 HydrophobicContact CD2-CG 4.31Å; L717-Y721 PolarHBondContact O-N 3.18Å
722	T	86.9	Confident	88.9	Confident	87 Å²	87	38.8 Å²	38.8	53%	0.534	20%	0.202	S	C	.	.			trans	-112.5	118.7	175.1	46.3	0	0	0	0	109.5	W695	W695-T722 PolarHBondContact N-O 2.98Å; W695-T722 VanDerWaalsContact N-O 3.1Å
723	A	90.1	Very high	88.2	Confident	10 Å²	10	32.3 Å²	32.3	8%	0.083	17%	0.174	C	C	.	.			trans	-145.9	127.8	170.3	0	0	0	0	0	107.9	W695 M698	W695-A723 HydrophobicContact CB-CB 4.16Å; W695-A723 WeakPolarHBondContact O-CA 3.4Å; M698-A723 HydrophobicContact CB-CB 3.7Å; M698-A723 HydrophobicContact CE-CB 4.09Å
724	P	88.6	Confident	87.5	Confident	82 Å²	82	32.1 Å²	32.1	53%	0.532	17%	0.173	S	C	.	.	S	Bend	trans	-70.5	-51.6	175.5	25.5	-31.4	0	0	0	111.5	N594 K696	N594-P724 PolarHBondContact OD1-O 3.02Å; K696-P724 WeakPolarHBondContact O-CD 3.28Å; K696-P724 WeakPolarHBondContact O-CG 3.48Å
725	Y	92.6	Very high	86.5	Confident	34 Å²	34	32.3 Å²	32.3	13%	0.133	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	131.9	-179.7	-51.4	-79.3	0	0	0	111.2	Y589 N592 N594 K696 Y697 M698	Y589-Y725 AromaticContact CD2-CD1 3.7Å; Y589-Y725 HydrophobicContact CD2-CD1 3.7Å; Y589-Y725 HydrophobicContact CD2-CD2 4.05Å; Y589-Y725 AromaticContact CD2-CE1 3.65Å; Y589-Y725 HydrophobicContact CD2-CE1 3.65Å; Y589-Y725 HydrophobicContact CD2-CE2 4.04Å; Y589-Y725 AromaticContact CD2-CG 3.92Å; Y589-Y725 HydrophobicContact CD2-CG 3.92Å; Y589-Y725 AromaticContact CD2-CZ 3.85Å; Y589-Y725 HydrophobicContact CE2-CD1 4.1Å; Y589-Y725 AromaticContact CE2-CD2 3.68Å; Y589-Y725 HydrophobicContact CE2-CD2 3.68Å; Y589-Y725 AromaticContact CE2-CE1 3.81Å; Y589-Y725 HydrophobicContact CE2-CE1 3.81Å; Y589-Y725 AromaticContact CE2-CE2 3.4Å; Y589-Y725 HydrophobicContact CE2-CE2 3.4Å; Y589-Y725 VanDerWaalsContact CE2-CE2 3.4Å; Y589-Y725 HydrophobicContact CE2-CG 4.05Å; Y589-Y725 AromaticContact CE2-CZ 3.49Å; Y589-Y725 VanDerWaalsContact CE2-CZ 3.49Å; Y589-Y725 HydrophobicContact CG-CE1 4.35Å; Y589-Y725 WeakPolarHBondContact O-CE1 3.21Å; N592-Y725 HydrophobicContact CB-CE1 4.41Å; N592-Y725 PolarHBondContact OD1-OH 3.22Å; N594-Y725 WeakPolarHBondContact OD1-CA 3.38Å; K696-Y725 WeakPolarHBondContact O-CD2 3.45Å; Y697-Y725 HydrophobicContact CD2-CG 4.26Å; Y697-Y725 HydrophobicContact CE2-CG 4.3Å; M698-Y725 PolarHBondContact N-O 2.83Å
726	R	93.6	Very high	85.6	Confident	32 Å²	32	30.5 Å²	30.5	12%	0.121	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	128.8	-179	-58.1	178.2	-177.9	-150.4	-4.4	109.5	N594 G595 M698 N718 F747 L748	N594-R726 WeakPolarHBondContact CA-O 3.39Å; N594-R726 HydrophobicContact CB-CB 4.19Å; N594-R726 WeakPolarHBondContact CB-O 3.47Å; N594-R726 PolarHBondContact OD1-N 3.17Å; G595-R726 PolarHBondContact N-O 3.1Å; M698-R726 WeakPolarHBondContact O-CA 3.24Å; N718-R726 PolarHBondContact OD1-NH1 2.97Å; N718-R726 PolarHBondContact OD1-NH2 3.48Å; R726-F747 WeakPolarHBondContact CD-O 3.43Å; R726-F747 PolarHBondContact NH1-O 2.96Å; R726-L748 HydrophobicContact CB-CD2 4.01Å
727	L	94.8	Very high	84.7	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	128.5	173.5	173.8	62	0	0	0	109.2	L585 L597 L612 Y697 M698 I699 I700 L729	L585-L727 HydrophobicContact CD2-CD1 3.67Å; L585-L727 HydrophobicContact CD2-CD2 3.89Å; L585-L727 HydrophobicContact CD2-CG 4.44Å; L597-L727 HydrophobicContact CB-CD1 4.35Å; L612-L727 HydrophobicContact CD2-CD2 4.24Å; Y697-L727 HydrophobicContact CE1-CB 3.66Å; M698-L727 PolarHBondContact O-N 2.93Å; I699-L727 WeakPolarHBondContact CA-O 3.35Å; I699-L727 HydrophobicContact CD1-CD2 4.46Å; I699-L727 HydrophobicContact CG1-CB 4.39Å; I699-L727 HydrophobicContact CG2-CB 4.26Å; I699-L727 HydrophobicContact CG2-CD2 4.14Å; I699-L727 HydrophobicContact CG2-CG 4.23Å; I700-L727 PolarHBondContact N-O 3.33Å; L727-L729 HydrophobicContact CD1-CD2 4.22Å; L727-L729 HydrophobicContact CD2-CD2 3.81Å; L727-L729 HydrophobicContact CG-CD2 3.79Å
728	L	94.2	Very high	83.9	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	134.1	168.4	-56.9	-177.1	0	0	0	109.1	G595 I596 L597 I700 M706 L744 F747 L748	G595-L728 PolarHBondContact O-N 2.87Å; I596-L728 CarbonylContact C-O 3.59Å; I596-L728 WeakPolarHBondContact CA-O 3.5Å; I596-L728 HydrophobicContact CG1-CB 4.33Å; I596-L728 HydrophobicContact CG1-CD1 4.42Å; I596-L728 HydrophobicContact CG2-CB 4.44Å; L597-L728 PolarHBondContact N-O 3.02Å; I700-L728 HydrophobicContact CB-CD2 3.79Å; I700-L728 HydrophobicContact CD1-CD2 4.1Å; I700-L728 HydrophobicContact CG1-CD2 4.21Å; I700-L728 HydrophobicContact CG2-CD2 4.49Å; M706-L728 HydrophobicContact CE-CD1 4.22Å; M706-L728 HydrophobicContact CE-CD2 3.57Å; L728-L744 HydrophobicContact CD1-CB 3.96Å; L728-L744 HydrophobicContact CD1-CD2 4.09Å; L728-L744 HydrophobicContact CD1-CG 4.47Å; L728-F747 HydrophobicContact CD1-CD1 4.4Å; L728-F747 HydrophobicContact CD2-CD1 3.94Å; L728-F747 HydrophobicContact CD2-CE1 3.97Å; L728-L748 HydrophobicContact CD1-CD1 4.01Å; L728-L748 HydrophobicContact CD1-CD2 4.43Å; L728-L748 HydrophobicContact CD1-CG 4.12Å; L728-L748 HydrophobicContact CG-CD1 4.4Å; L728-L748 HydrophobicContact CG-CD2 4.11Å; L728-L748 HydrophobicContact CG-CG 4.35Å
729	L	93.3	Very high	83.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133.7	169.3	-44.4	174.3	0	0	0	107.6	L597 K605 T609 W638 I699 I700 D701 E702 G703 L727	L597-L729 HydrophobicContact CB-CD2 3.89Å; L597-L729 HydrophobicContact CD2-CD2 4.17Å; K605-L729 HydrophobicContact CD-CB 4.48Å; T609-L729 WeakPolarHBondContact OG1-CD1 3.49Å; W638-L729 HydrophobicContact CH2-CD1 3.74Å; W638-L729 HydrophobicContact CZ2-CD1 3.68Å; I699-L729 HydrophobicContact CG2-CD1 4.07Å; I699-L729 HydrophobicContact CG2-CG 4.16Å; I700-L729 PolarHBondContact O-N 3.03Å; D701-L729 HydrophobicContact CB-CD1 4.44Å; E702-L729 WeakPolarHBondContact CA-O 3.31Å; E702-L729 PolarHBondContact N-O 3.35Å; E702-L729 VanDerWaalsContact N-O 3.16Å; G703-L729 PolarHBondContact N-O 3.2Å; L727-L729 HydrophobicContact CD1-CD2 4.22Å; L727-L729 HydrophobicContact CD2-CD2 3.81Å; L727-L729 HydrophobicContact CG-CD2 3.79Å
730	T	88.4	Confident	83.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.159	C	C	.	.			trans	-152.4	152.6	173.6	-169.8	0	0	0	0	110.4	I596 L597 A598 K605 T732 P733	I596-T730 HydrophobicContact CG2-CG2 3.95Å; L597-T730 PolarHBondContact O-N 3.19Å; L597-T730 VanDerWaalsContact O-N 3.07Å; A598-T730 HydrophobicContact CB-CG2 4.48Å; K605-T730 WeakPolarHBondContact CD-O 3.42Å; K605-T730 WeakPolarHBondContact CE-O 3.44Å; K605-T730 PolarHBondContact NZ-O 2.91Å; K605-T730 VanDerWaalsContact NZ-O 3.13Å; T730-T732 PolarHBondContact OG1-N 3.31Å; T730-T732 VanDerWaalsContact OG1-N 3.09Å; T730-T732 PolarHBondContact OG1-O 3.01Å; T730-P733 HydrophobicContact CG2-CB 4.09Å; T730-P733 HydrophobicContact CG2-CG 3.92Å
731	G	80.9	Confident	82.7	Confident	10 Å²	10	25.7 Å²	25.7	10%	0.103	14%	0.139	C	C	.	.	S	Bend	trans	-87.2	-18.4	162.6	0	0	0	0	0	113.2
732	T	77.8	Confident	82.4	Confident	9 Å²	9	25.7 Å²	25.7	6%	0.055	14%	0.14	C	C	.	.			trans	-143.3	96.4	-168	62.4	0	0	0	0	107.8	T730 L734 Q735 H1013	T730-T732 PolarHBondContact OG1-N 3.31Å; T730-T732 VanDerWaalsContact OG1-N 3.09Å; T730-T732 PolarHBondContact OG1-O 3.01Å; T732-L734 CarbonylContact C-O 3.59Å; T732-Q735 PolarHBondContact OG1-NE2 2.59Å; T732-H1013 HydrophobicContact CG2-CB 3.94Å; T732-H1013 VanDerWaalsContact CG2-ND1 3.33Å; T732-H1013 WeakPolarHBondContact CG2-ND1 3.33Å
733	P	72.7	Confident	82.3	Confident	3 Å²	3	21.7 Å²	21.7	2%	0.019	12%	0.115	C	C	.	.	S	Bend	trans	-74.3	-31.2	-174.8	-14.1	29.2	0	0	0	112.4	A598 T730 L744 L796 I1061	A598-P733 HydrophobicContact CB-CG 3.64Å; T730-P733 HydrophobicContact CG2-CB 4.09Å; T730-P733 HydrophobicContact CG2-CG 3.92Å; P733-L744 WeakPolarHBondContact O-CD1 3.28Å; P733-L796 HydrophobicContact CB-CD1 4.15Å; P733-L796 HydrophobicContact CG-CD1 4.23Å; P733-I1061 HydrophobicContact CB-CD1 3.69Å; P733-I1061 HydrophobicContact CG-CD1 3.83Å
734	L	73.9	Confident	82.1	Confident	4 Å²	4	21.3 Å²	21.3	2%	0.021	11%	0.112	C	C	.	.			trans	-103.9	154.7	167.1	-162.5	60.2	0	0	0	108.6	T732 K737 L741 V1056 V1060 I1061	T732-L734 CarbonylContact C-O 3.59Å; L734-K737 WeakPolarHBondContact CD1-O 3.39Å; L734-L741 HydrophobicContact CD1-CB 4.46Å; L734-V1056 HydrophobicContact CD2-CG1 3.85Å; L734-V1060 HydrophobicContact CD2-CB 4.04Å; L734-V1060 HydrophobicContact CD2-CG1 4.17Å; L734-V1060 HydrophobicContact CD2-CG2 4.1Å; L734-I1061 HydrophobicContact CB-CD1 3.94Å
735	Q	65.1	Low	81.9	Confident	14 Å²	14	17.6 Å²	17.6	7%	0.065	9%	0.087	C	C	.	.	S	Bend	trans	-143	-26.1	168.3	-72.1	-166	-13.9	0	0	114.8	H704 K707 T732 E740 H1013	H704-Q735 PolarHBondContact CD2-NE2 3.4Å; H704-Q735 VanDerWaalsContact CD2-NE2 3.31Å; H704-Q735 VanDerWaalsContact CG-NE2 3.35Å; K707-Q735 VanDerWaalsContact NZ-CB 3.31Å; T732-Q735 PolarHBondContact OG1-NE2 2.59Å; Q735-E740 PolarHBondContact N-OE2 2.82Å; Q735-E740 VanDerWaalsContact N-OE2 3.08Å; Q735-H1013 HydrophobicContact CG-CB 4.46Å
736	N	66.8	Low	81.5	Confident	62 Å²	62	17.2 Å²	17.2	33%	0.332	9%	0.088	S	C	.	.	S	Bend	trans	-134.2	-53.9	176	-56.2	-72.1	0	0	0	113.8	K707 E740	K707-N736 PolarHBondContact NZ-ND2 2.92Å; N736-E740 PolarHBondContact N-OE2 2.86Å; N736-E740 PolarHBondContact ND2-OE1 3.1Å
737	K	72.2	Confident	81.2	Confident	117 Å²	117	15.8 Å²	15.8	51%	0.509	8%	0.082	S	C	.	.			trans	-150.2	145.7	-168.3	-60.8	-164.3	-179.3	-122.3	0	111.2	L734 P739 E740 E1195	L734-K737 WeakPolarHBondContact CD1-O 3.39Å; K737-P739 VanDerWaalsContact C-N 3.32Å; K737-P739 WeakPolarHBondContact O-CD 3.36Å; K737-P739 VanDerWaalsContact O-N 3.07Å; K737-E740 WeakPolarHBondContact O-CB 3.44Å; K737-E740 WeakPolarHBondContact O-CG 3.23Å; K737-E740 PolarHBondContact O-N 3.33Å; K737-E1195 IonicContact NZ-OE1 2.84Å; K737-E1195 PolarHBondContact NZ-OE1 3.09Å
738	L	74.8	Confident	80.7	Confident	9 Å²	9	15.9 Å²	15.9	5%	0.047	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.3	-36.7	-176.4	-83.5	170.9	0	0	0	117	E740 L741 W742 F759 F763 F767 L788 V1060	L738-E740 PolarHBondContact O-N 3.37Å; L738-E740 VanDerWaalsContact O-N 3.1Å; L738-L741 WeakPolarHBondContact O-CB 3.4Å; L738-L741 PolarHBondContact O-N 3.04Å; L738-W742 PolarHBondContact O-N 2.91Å; L738-F759 HydrophobicContact CB-CE1 4.45Å; L738-F763 HydrophobicContact CD1-CB 4.1Å; L738-F763 WeakPolarHBondContact CD1-O 3.16Å; L738-F767 HydrophobicContact CD1-CD2 3.49Å; L738-F767 VanDerWaalsContact CD1-CD2 3.49Å; L738-F767 HydrophobicContact CD1-CE2 3.83Å; L738-F767 HydrophobicContact CD1-CG 4.37Å; L738-F767 HydrophobicContact CG-CD2 4.48Å; L738-L788 HydrophobicContact CD2-CD2 4.43Å; L738-V1060 HydrophobicContact CD2-CG1 3.78Å; L738-V1060 HydrophobicContact CD2-CG2 3.96Å
739	P	79.2	Confident	80	Confident	37 Å²	37	17 Å²	17	24%	0.24	9%	0.089	C	C	.	.	H	α-helix	trans	-60.8	-18	176.9	-27.3	37.4	0	0	0	115	K737 W742 A743 E760	K737-P739 VanDerWaalsContact C-N 3.32Å; K737-P739 WeakPolarHBondContact O-CD 3.36Å; K737-P739 VanDerWaalsContact O-N 3.07Å; P739-W742 PolarHBondContact O-N 3.48Å; P739-A743 PolarHBondContact O-N 2.89Å; P739-E760 HydrophobicContact CG-CG 4.02Å; P739-E760 WeakPolarHBondContact CG-OE1 3.41Å
740	E	79.2	Confident	79	Confident	22 Å²	22	19.5 Å²	19.5	10%	0.103	11%	0.105	C	C	.	.	H	α-helix	trans	-64.6	-42.6	171.6	-62.1	-179.1	153.6	0	0	111.1	K707 Q735 N736 K737 L738 A743 L744	K707-E740 HydrophobicContact CB-CG 4.07Å; K707-E740 VanDerWaalsContact CD-OE1 3.24Å; K707-E740 WeakPolarHBondContact CD-OE1 3.34Å; K707-E740 IonicContact NZ-OE1 2.82Å; K707-E740 WeakPolarHBondContact O-CA 3.49Å; Q735-E740 PolarHBondContact N-OE2 2.82Å; Q735-E740 VanDerWaalsContact N-OE2 3.08Å; N736-E740 PolarHBondContact N-OE2 2.86Å; N736-E740 PolarHBondContact ND2-OE1 3.1Å; K737-E740 WeakPolarHBondContact O-CB 3.44Å; K737-E740 WeakPolarHBondContact O-CG 3.23Å; K737-E740 PolarHBondContact O-N 3.33Å; L738-E740 PolarHBondContact O-N 3.37Å; L738-E740 VanDerWaalsContact O-N 3.1Å; E740-A743 WeakPolarHBondContact O-CB 3.29Å; E740-A743 PolarHBondContact O-N 3.01Å; E740-A743 VanDerWaalsContact O-N 3.17Å; E740-L744 PolarHBondContact O-N 3.32Å
741	L	80.4	Confident	78.1	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-42.5	176.2	-178.9	61.2	0	0	0	111.2	L734 L738 A743 L744 L745 L792 V1060	L734-L741 HydrophobicContact CD1-CB 4.46Å; L738-L741 WeakPolarHBondContact O-CB 3.4Å; L738-L741 PolarHBondContact O-N 3.04Å; L741-A743 VanDerWaalsContact C-N 3.29Å; L741-A743 PolarHBondContact O-N 2.69Å; L741-L744 PolarHBondContact O-N 3.09Å; L741-L745 HydrophobicContact CG-CD1 4.19Å; L741-L745 WeakPolarHBondContact O-CG 3.23Å; L741-L745 PolarHBondContact O-N 2.82Å; L741-L792 HydrophobicContact CD2-CD1 4.12Å; L741-V1060 HydrophobicContact CD2-CG1 4.42Å
742	W	84.6	Confident	77.6	Confident	5 Å²	5	29.8 Å²	29.8	2%	0.019	16%	0.161	C	C	.	.	H	α-helix	trans	-58.9	-38.3	172.8	176.5	92.5	0	0	0	112.4	H709 L738 P739 L744 L745 N746 F753 S755 V756 F759	H709-W742 HydrophobicContact CB-CH2 4.35Å; H709-W742 HydrophobicContact CB-CZ3 3.63Å; H709-W742 AromaticContact CG-CZ3 3.51Å; H709-W742 AromaticContact ND1-CZ3 3.66Å; L738-W742 PolarHBondContact O-N 2.91Å; P739-W742 PolarHBondContact O-N 3.48Å; W742-L744 VanDerWaalsContact C-N 3.31Å; W742-L744 PolarHBondContact O-N 3.35Å; W742-L745 PolarHBondContact O-N 2.74Å; W742-N746 HydrophobicContact CD2-CB 4.46Å; W742-N746 HydrophobicContact CH2-CB 4.37Å; W742-N746 WeakPolarHBondContact CH2-ND2 3.44Å; W742-N746 HydrophobicContact CZ2-CB 4.29Å; W742-N746 WeakPolarHBondContact CZ2-ND2 3.29Å; W742-N746 HydrophobicContact CZ3-CB 4.48Å; W742-N746 VanDerWaalsContact O-CB 3.29Å; W742-N746 WeakPolarHBondContact O-CB 3.14Å; W742-N746 PolarHBondContact O-N 2.69Å; W742-F753 WeakPolarHBondContact CZ2-O 3.13Å; W742-F753 PolarHBondContact NE1-O 2.83Å; W742-S755 PolarHBondContact NE1-O 3.3Å; W742-S755 VanDerWaalsContact NE1-O 3.1Å; W742-V756 HydrophobicContact CD2-CG2 4.14Å; W742-V756 HydrophobicContact CE3-CG2 3.79Å; W742-V756 HydrophobicContact CH2-CB 4.42Å; W742-V756 HydrophobicContact CH2-CG2 3.27Å; W742-V756 HydrophobicContact CZ2-CB 4.37Å; W742-V756 HydrophobicContact CZ2-CG2 3.63Å; W742-V756 HydrophobicContact CZ3-CG2 3.36Å; W742-F759 HydrophobicContact CB-CD1 3.76Å; W742-F759 HydrophobicContact CB-CD2 4.29Å; W742-F759 HydrophobicContact CB-CE1 3.95Å; W742-F759 HydrophobicContact CB-CE2 4.45Å; W742-F759 HydrophobicContact CB-CG 3.94Å; W742-F759 HydrophobicContact CB-CZ 4.29Å; W742-F759 VanDerWaalsContact CD1-CB 3.44Å; W742-F759 AromaticContact CD1-CD2 3.76Å; W742-F759 AromaticContact CD1-CG 3.56Å; W742-F759 HydrophobicContact CG-CB 4.18Å; W742-F759 HydrophobicContact CG-CD1 4.32Å; W742-F759 HydrophobicContact CG-CD2 4.43Å; W742-F759 HydrophobicContact CG-CG 4.07Å
743	A	85.1	Confident	77.2	Confident	2 Å²	2	30.6 Å²	30.6	2%	0.017	16%	0.164	C	C	.	.	H	α-helix	trans	-65.4	-34.2	178	0	0	0	0	0	112.5	H709 P739 E740 L741 F747	H709-A743 HydrophobicContact CB-CB 4.29Å; P739-A743 PolarHBondContact O-N 2.89Å; E740-A743 WeakPolarHBondContact O-CB 3.29Å; E740-A743 PolarHBondContact O-N 3.01Å; E740-A743 VanDerWaalsContact O-N 3.17Å; L741-A743 VanDerWaalsContact C-N 3.29Å; L741-A743 PolarHBondContact O-N 2.69Å; A743-F747 PolarHBondContact O-N 3.11Å
744	L	86.3	Confident	77.2	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	19%	0.194	C	C	.	.	H	α-helix	trans	-70.5	-45.4	172.4	-55.9	-176	0	0	0	111.6	I596 G703 M706 L728 P733 E740 L741 W742 F747 L748	I596-L744 HydrophobicContact CD1-CB 4.24Å; G703-L744 VanDerWaalsContact O-CD2 3.28Å; G703-L744 WeakPolarHBondContact O-CD2 3.33Å; M706-L744 HydrophobicContact CB-CD2 4.08Å; L728-L744 HydrophobicContact CD1-CB 3.96Å; L728-L744 HydrophobicContact CD1-CD2 4.09Å; L728-L744 HydrophobicContact CD1-CG 4.47Å; P733-L744 WeakPolarHBondContact O-CD1 3.28Å; E740-L744 PolarHBondContact O-N 3.32Å; L741-L744 PolarHBondContact O-N 3.09Å; W742-L744 VanDerWaalsContact C-N 3.31Å; W742-L744 PolarHBondContact O-N 3.35Å; L744-F747 PolarHBondContact O-N 3.38Å; L744-L748 WeakPolarHBondContact O-CG 3.4Å; L744-L748 PolarHBondContact O-N 3.12Å
745	L	83.6	Confident	77.2	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-62.6	-44.8	178.7	-69.6	171.4	0	0	0	112.4	L741 W742 F747 L748 L749 F753 F759 L792	L741-L745 HydrophobicContact CG-CD1 4.19Å; L741-L745 WeakPolarHBondContact O-CG 3.23Å; L741-L745 PolarHBondContact O-N 2.82Å; W742-L745 PolarHBondContact O-N 2.74Å; L745-F747 VanDerWaalsContact C-N 3.32Å; L745-F747 PolarHBondContact O-N 2.73Å; L745-L748 PolarHBondContact O-N 3.18Å; L745-L748 VanDerWaalsContact O-N 3.09Å; L745-L749 PolarHBondContact O-N 2.85Å; L745-F753 HydrophobicContact CB-CD1 4.49Å; L745-F753 HydrophobicContact CB-CD2 3.78Å; L745-F753 HydrophobicContact CB-CE2 3.97Å; L745-F753 HydrophobicContact CB-CG 4.06Å; L745-F753 HydrophobicContact CB-CZ 4.42Å; L745-F753 HydrophobicContact CD1-CE1 4.15Å; L745-F753 HydrophobicContact CD1-CE2 4.43Å; L745-F753 HydrophobicContact CD1-CZ 4.09Å; L745-F753 HydrophobicContact CD2-CE2 4.41Å; L745-F759 HydrophobicContact CD1-CE2 4Å; L745-F759 HydrophobicContact CD1-CZ 4.43Å; L745-L792 HydrophobicContact CD1-CD2 4.02Å; L745-L792 HydrophobicContact CD2-CD2 3.96Å
746	N	84.9	Confident	77.8	Confident	26 Å²	26	40 Å²	40	14%	0.139	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-39.6	174	-178.3	-26.5	0	0	0	111.3	W742 L748 P750 F753	W742-N746 HydrophobicContact CD2-CB 4.46Å; W742-N746 HydrophobicContact CH2-CB 4.37Å; W742-N746 WeakPolarHBondContact CH2-ND2 3.44Å; W742-N746 HydrophobicContact CZ2-CB 4.29Å; W742-N746 WeakPolarHBondContact CZ2-ND2 3.29Å; W742-N746 HydrophobicContact CZ3-CB 4.48Å; W742-N746 VanDerWaalsContact O-CB 3.29Å; W742-N746 WeakPolarHBondContact O-CB 3.14Å; W742-N746 PolarHBondContact O-N 2.69Å; N746-L748 PolarHBondContact O-N 2.72Å; N746-P750 VanDerWaalsContact O-CA 3.27Å; N746-P750 WeakPolarHBondContact O-CA 3.41Å; N746-P750 WeakPolarHBondContact O-CD 3.27Å; N746-P750 VanDerWaalsContact O-CG 3.22Å; N746-P750 WeakPolarHBondContact O-CG 3.24Å; N746-P750 VanDerWaalsContact O-N 3.15Å; N746-F753 HydrophobicContact CB-CB 4.14Å; N746-F753 PolarHBondContact ND2-O 2.98Å
747	F	86.7	Confident	78.2	Confident	2 Å²	2	42 Å²	42	1%	0.009	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-28.6	174.9	-179.5	-97.8	0	0	0	113.5	M698 I700 M706 T714 L717 R726 L728 A743 L744 L745	M698-F747 HydrophobicContact SD-CZ 4.06Å; I700-F747 HydrophobicContact CD1-CE1 3.63Å; I700-F747 HydrophobicContact CD1-CZ 3.64Å; M706-F747 HydrophobicContact CE-CB 4.49Å; M706-F747 HydrophobicContact CE-CD1 3.7Å; M706-F747 HydrophobicContact CE-CD2 4.49Å; M706-F747 HydrophobicContact CE-CE1 4.03Å; M706-F747 HydrophobicContact CE-CG 3.94Å; M706-F747 HydrophobicContact SD-CD2 4.4Å; M706-F747 HydrophobicContact SD-CG 4.4Å; T714-F747 HydrophobicContact CG2-CD2 3.92Å; L717-F747 HydrophobicContact CB-CE2 3.89Å; L717-F747 HydrophobicContact CB-CZ 4.42Å; L717-F747 HydrophobicContact CD1-CE2 3.95Å; L717-F747 HydrophobicContact CD1-CZ 3.96Å; R726-F747 WeakPolarHBondContact CD-O 3.43Å; R726-F747 PolarHBondContact NH1-O 2.96Å; L728-F747 HydrophobicContact CD1-CD1 4.4Å; L728-F747 HydrophobicContact CD2-CD1 3.94Å; L728-F747 HydrophobicContact CD2-CE1 3.97Å; A743-F747 PolarHBondContact O-N 3.11Å; L744-F747 PolarHBondContact O-N 3.38Å; L745-F747 VanDerWaalsContact C-N 3.32Å; L745-F747 PolarHBondContact O-N 2.73Å
748	L	85	Confident	78.2	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-85.2	-43.6	178	-69.4	163.1	0	0	0	112.9	N594 I596 R726 L728 L744 L745 N746	N594-L748 HydrophobicContact CB-CB 4.14Å; N594-L748 HydrophobicContact CB-CD2 3.69Å; N594-L748 PolarHBondContact ND2-O 3.3Å; I596-L748 HydrophobicContact CD1-CD1 3.86Å; I596-L748 HydrophobicContact CG1-CD1 3.4Å; R726-L748 HydrophobicContact CB-CD2 4.01Å; L728-L748 HydrophobicContact CD1-CD1 4.01Å; L728-L748 HydrophobicContact CD1-CD2 4.43Å; L728-L748 HydrophobicContact CD1-CG 4.12Å; L728-L748 HydrophobicContact CG-CD1 4.4Å; L728-L748 HydrophobicContact CG-CD2 4.11Å; L728-L748 HydrophobicContact CG-CG 4.35Å; L744-L748 WeakPolarHBondContact O-CG 3.4Å; L744-L748 PolarHBondContact O-N 3.12Å; L745-L748 PolarHBondContact O-N 3.18Å; L745-L748 VanDerWaalsContact O-N 3.09Å; N746-L748 PolarHBondContact O-N 2.72Å
749	L	78.2	Confident	78.1	Confident	24 Å²	24	39.8 Å²	39.8	13%	0.126	22%	0.221	C	C	.	.			trans	-136.5	70.7	-171.6	-61.1	171.7	0	0	0	110.7	L745 T751 I752 F753 F795	L745-L749 PolarHBondContact O-N 2.85Å; L749-T751 PolarHBondContact O-N 3.47Å; L749-T751 VanDerWaalsContact O-N 3.11Å; L749-I752 HydrophobicContact CB-CD1 4.31Å; L749-I752 HydrophobicContact CD1-CD1 4.18Å; L749-I752 PolarHBondContact O-N 2.86Å; L749-F753 HydrophobicContact CB-CD2 4.32Å; L749-F753 PolarHBondContact O-N 3.5Å; L749-F795 HydrophobicContact CD1-CD1 3.91Å; L749-F795 HydrophobicContact CD1-CD2 4.37Å; L749-F795 HydrophobicContact CD1-CE1 3.64Å; L749-F795 HydrophobicContact CD1-CE2 4.12Å; L749-F795 HydrophobicContact CD1-CG 4.27Å; L749-F795 HydrophobicContact CD1-CZ 3.75Å
750	P	73.6	Confident	77.8	Confident	53 Å²	53	41.1 Å²	41.1	34%	0.344	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.3	-171.6	-20.4	28.7	0	0	0	114.4	N746 E754	N746-P750 VanDerWaalsContact O-CA 3.27Å; N746-P750 WeakPolarHBondContact O-CA 3.41Å; N746-P750 WeakPolarHBondContact O-CD 3.27Å; N746-P750 VanDerWaalsContact O-CG 3.22Å; N746-P750 WeakPolarHBondContact O-CG 3.24Å; N746-P750 VanDerWaalsContact O-N 3.15Å; P750-E754 VanDerWaalsContact O-CG 3.27Å; P750-E754 WeakPolarHBondContact O-CG 3.21Å
751	T	68.3	Low	77.3	Confident	118 Å²	118	47.2 Å²	47.2	72%	0.724	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-17.3	-176.7	49.8	0	0	0	0	114.2	L749	L749-T751 PolarHBondContact O-N 3.47Å; L749-T751 VanDerWaalsContact O-N 3.11Å
752	I	70.6	Confident	76.6	Confident	108 Å²	108	53.1 Å²	53.1	55%	0.554	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-38.4	178	-58.1	178.5	0	0	0	109.7	L749	L749-I752 HydrophobicContact CB-CD1 4.31Å; L749-I752 HydrophobicContact CD1-CD1 4.18Å; L749-I752 PolarHBondContact O-N 2.86Å
753	F	71.2	Confident	75.8	Confident	25 Å²	25	53.9 Å²	53.9	11%	0.11	28%	0.278	C	S	.	.			trans	-109.2	50.3	-172.4	-61.3	-75.7	0	0	0	112.5	W742 L745 N746 L749 S755 F759 V791	W742-F753 WeakPolarHBondContact CZ2-O 3.13Å; W742-F753 PolarHBondContact NE1-O 2.83Å; L745-F753 HydrophobicContact CB-CD1 4.49Å; L745-F753 HydrophobicContact CB-CD2 3.78Å; L745-F753 HydrophobicContact CB-CE2 3.97Å; L745-F753 HydrophobicContact CB-CG 4.06Å; L745-F753 HydrophobicContact CB-CZ 4.42Å; L745-F753 HydrophobicContact CD1-CE1 4.15Å; L745-F753 HydrophobicContact CD1-CE2 4.43Å; L745-F753 HydrophobicContact CD1-CZ 4.09Å; L745-F753 HydrophobicContact CD2-CE2 4.41Å; N746-F753 HydrophobicContact CB-CB 4.14Å; N746-F753 PolarHBondContact ND2-O 2.98Å; L749-F753 HydrophobicContact CB-CD2 4.32Å; L749-F753 PolarHBondContact O-N 3.5Å; F753-S755 PolarHBondContact O-N 2.73Å; F753-F759 HydrophobicContact CD1-CD2 4.31Å; F753-F759 HydrophobicContact CE1-CD2 4.36Å; F753-F759 HydrophobicContact CE1-CE2 4.49Å; F753-V791 HydrophobicContact CZ-CG1 4.34Å
754	E	72.4	Confident	74.9	Confident	142 Å²	142	56.1 Å²	56.1	66%	0.664	29%	0.29	S	S	*	.			trans	-68.5	-30.5	-179.7	-67.1	-163.2	158.2	0	0	113.7	P750	P750-E754 VanDerWaalsContact O-CG 3.27Å; P750-E754 WeakPolarHBondContact O-CG 3.21Å
755	S	72.7	Confident	73.6	Confident	47 Å²	47	58 Å²	58	33%	0.329	31%	0.305	S	S	.	.			trans	-113.5	118.9	-170.7	176.4	0	0	0	0	113	W742 F753 T758	W742-S755 PolarHBondContact NE1-O 3.3Å; W742-S755 VanDerWaalsContact NE1-O 3.1Å; F753-S755 PolarHBondContact O-N 2.73Å; S755-T758 WeakPolarHBondContact CB-OG1 3.32Å; S755-T758 WeakPolarHBondContact OG-CB 3.48Å; S755-T758 PolarHBondContact OG-N 3.18Å; S755-T758 PolarHBondContact OG-OG1 3Å
756	V	79	Confident	72.4	Confident	31 Å²	31	58.9 Å²	58.9	19%	0.188	31%	0.312	C	S	.	.	H	α-helix	trans	-61.1	-52.7	169.2	-176.5	0	0	0	0	110	W742 T758 F759 E760	W742-V756 HydrophobicContact CD2-CG2 4.14Å; W742-V756 HydrophobicContact CE3-CG2 3.79Å; W742-V756 HydrophobicContact CH2-CB 4.42Å; W742-V756 HydrophobicContact CH2-CG2 3.27Å; W742-V756 HydrophobicContact CZ2-CB 4.37Å; W742-V756 HydrophobicContact CZ2-CG2 3.63Å; W742-V756 HydrophobicContact CZ3-CG2 3.36Å; V756-T758 PolarHBondContact O-N 2.92Å; V756-T758 VanDerWaalsContact O-N 3.15Å; V756-F759 WeakPolarHBondContact O-CB 3.46Å; V756-F759 PolarHBondContact O-N 2.92Å; V756-E760 HydrophobicContact CG1-CG 3.99Å; V756-E760 PolarHBondContact O-N 3.49Å
757	N	75	Confident	71.2	Confident	104 Å²	104	59.8 Å²	59.8	56%	0.556	31%	0.314	S	S	*	.	H	α-helix	trans	-59.3	-34.5	-170	-53.6	-14.1	0	0	0	111.9	Q761	N757-Q761 WeakPolarHBondContact O-CB 3.45Å; N757-Q761 WeakPolarHBondContact O-CG 3.43Å; N757-Q761 PolarHBondContact O-N 3.08Å
758	T	72.1	Confident	69.8	Low	66 Å²	66	63 Å²	63	41%	0.405	34%	0.342	S	S	.	.	H	α-helix	trans	-71.1	-42.1	177.8	-50.6	0	0	0	0	110.8	S755 V756 Q761 W762	S755-T758 WeakPolarHBondContact CB-OG1 3.32Å; S755-T758 WeakPolarHBondContact OG-CB 3.48Å; S755-T758 PolarHBondContact OG-N 3.18Å; S755-T758 PolarHBondContact OG-OG1 3Å; V756-T758 PolarHBondContact O-N 2.92Å; V756-T758 VanDerWaalsContact O-N 3.15Å; T758-Q761 PolarHBondContact O-N 2.83Å; T758-W762 PolarHBondContact O-N 2.69Å; T758-W762 VanDerWaalsContact O-N 3.16Å
759	F	71.9	Confident	67.8	Low	12 Å²	12	66 Å²	66	5%	0.053	37%	0.366	C	S	.	.	H	α-helix	trans	-64	-45.9	174.7	-173.3	-85.6	0	0	0	111.4	L738 W742 L745 F753 V756 Q761 W762 F763 L788	L738-F759 HydrophobicContact CB-CE1 4.45Å; W742-F759 HydrophobicContact CB-CD1 3.76Å; W742-F759 HydrophobicContact CB-CD2 4.29Å; W742-F759 HydrophobicContact CB-CE1 3.95Å; W742-F759 HydrophobicContact CB-CE2 4.45Å; W742-F759 HydrophobicContact CB-CG 3.94Å; W742-F759 HydrophobicContact CB-CZ 4.29Å; W742-F759 VanDerWaalsContact CD1-CB 3.44Å; W742-F759 AromaticContact CD1-CD2 3.76Å; W742-F759 AromaticContact CD1-CG 3.56Å; W742-F759 HydrophobicContact CG-CB 4.18Å; W742-F759 HydrophobicContact CG-CD1 4.32Å; W742-F759 HydrophobicContact CG-CD2 4.43Å; W742-F759 HydrophobicContact CG-CG 4.07Å; L745-F759 HydrophobicContact CD1-CE2 4Å; L745-F759 HydrophobicContact CD1-CZ 4.43Å; F753-F759 HydrophobicContact CD1-CD2 4.31Å; F753-F759 HydrophobicContact CE1-CD2 4.36Å; F753-F759 HydrophobicContact CE1-CE2 4.49Å; V756-F759 WeakPolarHBondContact O-CB 3.46Å; V756-F759 PolarHBondContact O-N 2.92Å; F759-Q761 PolarHBondContact O-N 3.17Å; F759-W762 PolarHBondContact O-N 2.98Å; F759-W762 VanDerWaalsContact O-N 3.16Å; F759-F763 AromaticContact CD1-CD2 3.97Å; F759-F763 HydrophobicContact CD1-CD2 3.97Å; F759-F763 AromaticContact CD2-CD2 3.61Å; F759-F763 HydrophobicContact CD2-CD2 3.61Å; F759-F763 AromaticContact CD2-CE2 3.64Å; F759-F763 HydrophobicContact CD2-CE2 3.64Å; F759-F763 AromaticContact CE1-CD2 3.95Å; F759-F763 HydrophobicContact CE1-CD2 3.95Å; F759-F763 AromaticContact CE2-CD2 3.59Å; F759-F763 HydrophobicContact CE2-CD2 3.59Å; F759-F763 AromaticContact CE2-CE2 3.63Å; F759-F763 HydrophobicContact CE2-CE2 3.63Å; F759-F763 AromaticContact CG-CD2 3.81Å; F759-F763 HydrophobicContact CG-CD2 3.81Å; F759-F763 HydrophobicContact CG-CE2 4.25Å; F759-F763 AromaticContact CZ-CD2 3.76Å; F759-F763 HydrophobicContact CZ-CD2 3.76Å; F759-F763 HydrophobicContact CZ-CE2 4.23Å; F759-F763 VanDerWaalsContact O-CD2 3.31Å; F759-F763 WeakPolarHBondContact O-CD2 3.15Å; F759-F763 PolarHBondContact O-N 3.46Å; F759-L788 HydrophobicContact CE2-CD1 4.46Å; F759-L788 HydrophobicContact CZ-CD1 4.31Å
760	E	72.9	Confident	66.3	Low	65 Å²	65	68.4 Å²	68.4	30%	0.304	38%	0.382	S	S	.	.	H	α-helix	trans	-58	-44.6	175.2	-73.9	-175.3	153.3	0	0	112.1	P739 V756 W762 F763 N764	P739-E760 HydrophobicContact CG-CG 4.02Å; P739-E760 WeakPolarHBondContact CG-OE1 3.41Å; V756-E760 HydrophobicContact CG1-CG 3.99Å; V756-E760 PolarHBondContact O-N 3.49Å; E760-W762 VanDerWaalsContact C-N 3.27Å; E760-W762 PolarHBondContact O-N 2.78Å; E760-F763 PolarHBondContact O-N 3.36Å; E760-N764 WeakPolarHBondContact CB-ND2 3.48Å; E760-N764 WeakPolarHBondContact O-CB 3.41Å; E760-N764 VanDerWaalsContact O-CG 3.28Å; E760-N764 PolarHBondContact O-N 3.04Å
761	Q	69	Low	64.6	Low	150 Å²	150	67.8 Å²	67.8	70%	0.701	39%	0.386	S	S	*	.	H	α-helix	trans	-64.2	-28.3	177.4	-78	169.4	-0.6	0	0	114	N757 T758 F759	N757-Q761 WeakPolarHBondContact O-CB 3.45Å; N757-Q761 WeakPolarHBondContact O-CG 3.43Å; N757-Q761 PolarHBondContact O-N 3.08Å; T758-Q761 PolarHBondContact O-N 2.83Å; F759-Q761 PolarHBondContact O-N 3.17Å
762	W	65.1	Low	63.3	Low	125 Å²	125	71.1 Å²	71.1	47%	0.473	39%	0.393	S	S	.	.	H	α-helix	trans	-90	-23.5	-177.4	-77	49	0	0	0	113.2	L363 T758 F759 E760	L363-W762 HydrophobicContact CD2-CH2 3.74Å; L363-W762 HydrophobicContact CD2-CZ3 3.87Å; L363-W762 HydrophobicContact CG-CH2 4.39Å; L363-W762 HydrophobicContact CG-CZ3 4.35Å; T758-W762 PolarHBondContact O-N 2.69Å; T758-W762 VanDerWaalsContact O-N 3.16Å; F759-W762 PolarHBondContact O-N 2.98Å; F759-W762 VanDerWaalsContact O-N 3.16Å; E760-W762 VanDerWaalsContact C-N 3.27Å; E760-W762 PolarHBondContact O-N 2.78Å
763	F	67.5	Low	61.8	Low	20 Å²	20	73.8 Å²	73.8	9%	0.088	40%	0.401	C	S	.	.	H	α-helix	trans	-127.3	-16	-170.4	-59	-61.1	0	0	0	115.8	L738 F759 E760 F767 I784 L788	L738-F763 HydrophobicContact CD1-CB 4.1Å; L738-F763 WeakPolarHBondContact CD1-O 3.16Å; F759-F763 AromaticContact CD1-CD2 3.97Å; F759-F763 HydrophobicContact CD1-CD2 3.97Å; F759-F763 AromaticContact CD2-CD2 3.61Å; F759-F763 HydrophobicContact CD2-CD2 3.61Å; F759-F763 AromaticContact CD2-CE2 3.64Å; F759-F763 HydrophobicContact CD2-CE2 3.64Å; F759-F763 AromaticContact CE1-CD2 3.95Å; F759-F763 HydrophobicContact CE1-CD2 3.95Å; F759-F763 AromaticContact CE2-CD2 3.59Å; F759-F763 HydrophobicContact CE2-CD2 3.59Å; F759-F763 AromaticContact CE2-CE2 3.63Å; F759-F763 HydrophobicContact CE2-CE2 3.63Å; F759-F763 AromaticContact CG-CD2 3.81Å; F759-F763 HydrophobicContact CG-CD2 3.81Å; F759-F763 HydrophobicContact CG-CE2 4.25Å; F759-F763 AromaticContact CZ-CD2 3.76Å; F759-F763 HydrophobicContact CZ-CD2 3.76Å; F759-F763 HydrophobicContact CZ-CE2 4.23Å; F759-F763 VanDerWaalsContact O-CD2 3.31Å; F759-F763 WeakPolarHBondContact O-CD2 3.15Å; F759-F763 PolarHBondContact O-N 3.46Å; E760-F763 PolarHBondContact O-N 3.36Å; F763-F767 WeakPolarHBondContact O-CD2 3.37Å; F763-I784 HydrophobicContact CD1-CG2 4.11Å; F763-L788 HydrophobicContact CD1-CB 3.84Å; F763-L788 HydrophobicContact CD1-CD1 3.97Å; F763-L788 HydrophobicContact CD1-CD2 4.37Å; F763-L788 HydrophobicContact CD1-CG 4.27Å; F763-L788 HydrophobicContact CD2-CD1 4.25Å; F763-L788 HydrophobicContact CE1-CB 3.64Å; F763-L788 HydrophobicContact CE1-CD1 3.81Å; F763-L788 HydrophobicContact CE1-CG 4.25Å; F763-L788 HydrophobicContact CE2-CD1 4.1Å; F763-L788 HydrophobicContact CG-CD1 4.19Å; F763-L788 HydrophobicContact CZ-CB 4.44Å; F763-L788 HydrophobicContact CZ-CD1 3.87Å
764	N	67	Low	60.6	Low	50 Å²	50	78.3 Å²	78.3	27%	0.267	43%	0.431	S	S	.	.	S	Bend	trans	-78.4	-19.6	180	-67.5	2.9	0	0	0	113.8	E760 F767 A768	E760-N764 WeakPolarHBondContact CB-ND2 3.48Å; E760-N764 WeakPolarHBondContact O-CB 3.41Å; E760-N764 VanDerWaalsContact O-CG 3.28Å; E760-N764 PolarHBondContact O-N 3.04Å; N764-F767 CarbonylContact O-C 3.59Å; N764-F767 PolarHBondContact O-N 3.39Å; N764-A768 PolarHBondContact O-N 3.21Å; N764-A768 VanDerWaalsContact O-N 3.09Å
765	A	59.9	Low	59.6	Low	41 Å²	41	80.4 Å²	80.4	34%	0.339	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-53.3	-46.6	-172	0	0	0	0	0	115.2	F767 A768 L776 I784	A765-F767 PolarHBondContact O-N 2.94Å; A765-A768 PolarHBondContact O-N 2.85Å; A765-L776 HydrophobicContact CB-CD2 4.16Å; A765-I784 HydrophobicContact CB-CD1 4.14Å
766	P	58.3	Low	58.8	Low	24 Å²	24	80.8 Å²	80.8	16%	0.156	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-80.3	-0.6	179.4	34.3	-36.5	0	0	0	114	L776 T781 I784	P766-L776 HydrophobicContact CB-CD2 4.27Å; P766-T781 HydrophobicContact CB-CG2 3.79Å; P766-T781 WeakPolarHBondContact CB-OG1 3.41Å; P766-I784 HydrophobicContact CG-CB 4.15Å; P766-I784 HydrophobicContact CG-CD1 4.25Å; P766-I784 HydrophobicContact CG-CG2 3.85Å
767	F	57.8	Low	58	Low	44 Å²	44	84.2 Å²	84.2	19%	0.193	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-112.2	6.7	173.6	-52	-77.8	0	0	0	111.7	L738 F763 N764 A765 A769 I785 V1056 K1059 V1060	L738-F767 HydrophobicContact CD1-CD2 3.49Å; L738-F767 VanDerWaalsContact CD1-CD2 3.49Å; L738-F767 HydrophobicContact CD1-CE2 3.83Å; L738-F767 HydrophobicContact CD1-CG 4.37Å; L738-F767 HydrophobicContact CG-CD2 4.48Å; F763-F767 WeakPolarHBondContact O-CD2 3.37Å; N764-F767 CarbonylContact O-C 3.59Å; N764-F767 PolarHBondContact O-N 3.39Å; A765-F767 PolarHBondContact O-N 2.94Å; F767-A769 VanDerWaalsContact C-N 3.25Å; F767-A769 PolarHBondContact O-N 2.99Å; F767-I785 HydrophobicContact CZ-CG1 4.42Å; F767-V1056 HydrophobicContact CD1-CG1 4.42Å; F767-V1056 HydrophobicContact CD1-CG2 4.3Å; F767-K1059 HydrophobicContact CE1-CB 4.16Å; F767-V1060 HydrophobicContact CE1-CG2 3.7Å; F767-V1060 HydrophobicContact CE2-CG2 3.86Å; F767-V1060 HydrophobicContact CZ-CG2 3.3Å
768	A	57.4	Low	57.6	Low	71 Å²	71	84.7 Å²	84.7	59%	0.587	46%	0.455	S	S	*	.			trans	-94.1	51.2	173.3	0	0	0	0	0	110.3	N764 A765	N764-A768 PolarHBondContact O-N 3.21Å; N764-A768 VanDerWaalsContact O-N 3.09Å; A765-A768 PolarHBondContact O-N 2.85Å
769	A	44.9	Very low	57.3	Low	65 Å²	65	87.6 Å²	87.6	54%	0.537	46%	0.464	S	S	.	.			trans	-56	159.4	159.7	0	0	0	0	0	109.5	F767	F767-A769 VanDerWaalsContact C-N 3.25Å; F767-A769 PolarHBondContact O-N 2.99Å
770	T	44.8	Very low	56.9	Low	75 Å²	75	89.9 Å²	89.9	46%	0.46	47%	0.474	S	S	.	.	S	Bend	trans	68.8	73.8	176	-38.7	0	0	0	0	115.4	E1196	T770-E1196 HydrophobicContact CG2-CB 3.55Å; T770-E1196 HydrophobicContact CG2-CG 3.91Å
771	G	39.3	Very low	56.6	Low	41 Å²	41	87.8 Å²	87.8	42%	0.423	47%	0.466	S	S	.	.	S	Bend	trans	158	85.9	155.5	0	0	0	0	0	119.2	K773	G771-K773 PolarHBondContact O-N 3.15Å
772	E	39.6	Very low	56.6	Low	187 Å²	187	82 Å²	82	87%	0.874	44%	0.44	S	S	*	.	S	Bend	trans	53.2	11.9	158.8	-67.6	-178	148.4	0	0	118.6
773	K	40.6	Very low	56.7	Low	164 Å²	164	78.2 Å²	78.2	71%	0.713	43%	0.428	S	S	*	.	S	Bend	trans	-135.6	100.7	-175.1	-69.7	175	-170.4	152.8	0	112.2	G771	G771-K773 PolarHBondContact O-N 3.15Å
774	V	45.9	Very low	56.7	Low	121 Å²	121	78.5 Å²	78.5	73%	0.733	43%	0.431	S	S	*	.			trans	40.2	94.9	160.6	-172	0	0	0	0	112.9	L776	V774-L776 PolarHBondContact O-N 3.25Å
775	E	51.3	Low	56.9	Low	185 Å²	185	76.3 Å²	76.3	86%	0.864	42%	0.419	S	S	*	.			trans	-44.7	115.2	161.8	-71.8	147.9	-159.8	0	0	109	N777	E775-N777 PolarHBondContact O-N 3.4Å
776	L	55.1	Low	57.4	Low	56 Å²	56	79.6 Å²	79.6	29%	0.293	42%	0.423	S	S	.	.			trans	-69.5	126.1	173.3	-88.1	78.5	0	0	0	107	A765 P766 V774 E780 I784	A765-L776 HydrophobicContact CB-CD2 4.16Å; P766-L776 HydrophobicContact CB-CD2 4.27Å; V774-L776 PolarHBondContact O-N 3.25Å; L776-E780 HydrophobicContact CB-CB 4.25Å; L776-E780 HydrophobicContact CD2-CB 4.08Å; L776-E780 HydrophobicContact CG-CB 4.28Å; L776-I784 HydrophobicContact CD2-CD1 3.9Å
777	N	62.3	Low	57.9	Low	102 Å²	102	82.1 Å²	82.1	55%	0.545	43%	0.429	S	S	.	.			trans	-51.4	146.1	169.7	-73.8	8	0	0	0	109.5	E775 E779 E780 T781	E775-N777 PolarHBondContact O-N 3.4Å; N777-E779 PolarHBondContact O-N 3.02Å; N777-E780 PolarHBondContact O-N 3.18Å; N777-T781 PolarHBondContact O-N 3.05Å
778	Q	66.5	Low	58.6	Low	115 Å²	115	80.3 Å²	80.3	54%	0.537	42%	0.421	S	S	.	.	H	α-helix	trans	-48	-38.3	175.1	-67.8	177.6	-9.3	0	0	111.3	E780 T781 L782	Q778-E780 PolarHBondContact O-N 2.94Å; Q778-T781 WeakPolarHBondContact O-CB 3.43Å; Q778-T781 PolarHBondContact O-N 2.71Å; Q778-L782 VanDerWaalsContact O-CB 3.29Å; Q778-L782 WeakPolarHBondContact O-CB 3.43Å; Q778-L782 PolarHBondContact O-N 3.33Å
779	E	65.2	Low	59.3	Low	127 Å²	127	77.4 Å²	77.4	59%	0.593	40%	0.395	S	S	*	.	H	α-helix	trans	-58.4	-40	173.3	-60.7	-165.9	126	0	0	115.4	N777 L782 L783	N777-E779 PolarHBondContact O-N 3.02Å; E779-L782 WeakPolarHBondContact O-CB 3.33Å; E779-L782 PolarHBondContact O-N 3.43Å; E779-L783 WeakPolarHBondContact O-CB 3.47Å; E779-L783 PolarHBondContact O-N 2.9Å
780	E	64.6	Low	60.4	Low	60 Å²	60	80 Å²	80	28%	0.28	40%	0.395	S	S	.	.	H	α-helix	trans	-71	-41.2	179.5	-68.8	-162.2	118.8	0	0	110.6	Q374 L776 N777 Q778 L783 I784	Q374-E780 PolarHBondContact NE2-OE1 3.26Å; L776-E780 HydrophobicContact CB-CB 4.25Å; L776-E780 HydrophobicContact CD2-CB 4.08Å; L776-E780 HydrophobicContact CG-CB 4.28Å; N777-E780 PolarHBondContact O-N 3.18Å; Q778-E780 PolarHBondContact O-N 2.94Å; E780-L783 PolarHBondContact O-N 3.1Å; E780-I784 WeakPolarHBondContact O-CG1 3.41Å; E780-I784 PolarHBondContact O-N 3.28Å
781	T	66.5	Low	61.8	Low	20 Å²	20	78.3 Å²	78.3	12%	0.123	38%	0.384	C	S	.	.	H	α-helix	trans	-57.6	-50.5	170	-70.8	0	0	0	0	110.9	P766 N777 Q778 L783 I784 I785	P766-T781 HydrophobicContact CB-CG2 3.79Å; P766-T781 WeakPolarHBondContact CB-OG1 3.41Å; N777-T781 PolarHBondContact O-N 3.05Å; Q778-T781 WeakPolarHBondContact O-CB 3.43Å; Q778-T781 PolarHBondContact O-N 2.71Å; T781-L783 VanDerWaalsContact C-N 3.27Å; T781-L783 PolarHBondContact O-N 3.34Å; T781-I784 PolarHBondContact O-N 3.35Å; T781-I785 HydrophobicContact CG2-CD1 3.69Å; T781-I785 WeakPolarHBondContact O-CB 3.45Å; T781-I785 VanDerWaalsContact O-CG1 3.27Å; T781-I785 WeakPolarHBondContact O-CG1 3.41Å; T781-I785 PolarHBondContact O-N 3.48Å
782	L	68.7	Low	63.6	Low	30 Å²	30	76.5 Å²	76.5	16%	0.157	37%	0.365	C	S	.	.	H	α-helix	trans	-53.9	-42.7	175.3	-153.2	82	0	0	0	111.7	Q778 E779 R786 L1079	Q778-L782 VanDerWaalsContact O-CB 3.29Å; Q778-L782 WeakPolarHBondContact O-CB 3.43Å; Q778-L782 PolarHBondContact O-N 3.33Å; E779-L782 WeakPolarHBondContact O-CB 3.33Å; E779-L782 PolarHBondContact O-N 3.43Å; L782-R786 WeakPolarHBondContact O-CB 3.44Å; L782-R786 WeakPolarHBondContact O-CD 3.28Å; L782-R786 WeakPolarHBondContact O-CG 3.38Å; L782-R786 PolarHBondContact O-N 3.08Å; L782-L1079 HydrophobicContact CD1-CB 4.27Å; L782-L1079 HydrophobicContact CD1-CD2 3.45Å; L782-L1079 VanDerWaalsContact CD1-CD2 3.45Å; L782-L1079 HydrophobicContact CD1-CG 3.67Å; L782-L1079 HydrophobicContact CG-CD2 4.33Å
783	L	68.6	Low	65.3	Low	44 Å²	44	69.7 Å²	69.7	23%	0.23	33%	0.331	C	S	.	.	H	α-helix	trans	-71.7	-40.3	-178.4	-173.3	68.1	0	0	0	112.8	H370 E779 E780 T781 R787	H370-L783 VanDerWaalsContact CE1-CD2 3.5Å; H370-L783 WeakPolarHBondContact CE1-CD2 3.23Å; H370-L783 WeakPolarHBondContact NE2-CD2 3.49Å; E779-L783 WeakPolarHBondContact O-CB 3.47Å; E779-L783 PolarHBondContact O-N 2.9Å; E780-L783 PolarHBondContact O-N 3.1Å; T781-L783 VanDerWaalsContact C-N 3.27Å; T781-L783 PolarHBondContact O-N 3.34Å; L783-R787 WeakPolarHBondContact O-CB 3.41Å; L783-R787 WeakPolarHBondContact O-CD 3.49Å; L783-R787 WeakPolarHBondContact O-CG 3.28Å; L783-R787 PolarHBondContact O-N 2.97Å
784	I	67.6	Low	67	Low	27 Å²	27	62.1 Å²	62.1	14%	0.138	30%	0.299	C	S	.	.	H	α-helix	trans	-66.4	-42.9	176.5	-67.5	169.7	0	0	0	110.2	F763 A765 P766 L776 E780 T781 R787 L788	F763-I784 HydrophobicContact CD1-CG2 4.11Å; A765-I784 HydrophobicContact CB-CD1 4.14Å; P766-I784 HydrophobicContact CG-CB 4.15Å; P766-I784 HydrophobicContact CG-CD1 4.25Å; P766-I784 HydrophobicContact CG-CG2 3.85Å; L776-I784 HydrophobicContact CD2-CD1 3.9Å; E780-I784 WeakPolarHBondContact O-CG1 3.41Å; E780-I784 PolarHBondContact O-N 3.28Å; T781-I784 PolarHBondContact O-N 3.35Å; I784-R787 PolarHBondContact O-N 3.3Å; I784-L788 PolarHBondContact O-N 3.4Å
785	I	70.8	Confident	68.8	Low	4 Å²	4	57.9 Å²	57.9	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-52	174.8	-71.6	174	0	0	0	110.5	F767 T781 R787 L788 H789 K1059 L1079	F767-I785 HydrophobicContact CZ-CG1 4.42Å; T781-I785 HydrophobicContact CG2-CD1 3.69Å; T781-I785 WeakPolarHBondContact O-CB 3.45Å; T781-I785 VanDerWaalsContact O-CG1 3.27Å; T781-I785 WeakPolarHBondContact O-CG1 3.41Å; T781-I785 PolarHBondContact O-N 3.48Å; I785-R787 VanDerWaalsContact C-N 3.3Å; I785-R787 PolarHBondContact O-N 3.13Å; I785-L788 WeakPolarHBondContact O-CB 3.49Å; I785-L788 PolarHBondContact O-N 2.86Å; I785-L788 VanDerWaalsContact O-N 3.13Å; I785-H789 WeakPolarHBondContact CG2-CE1 3.41Å; I785-H789 VanDerWaalsContact O-CG 3.28Å; I785-H789 PolarHBondContact O-N 3.13Å; I785-H789 PolarHBondContact O-ND1 3.3Å; I785-K1059 HydrophobicContact CD1-CB 4.37Å; I785-L1079 HydrophobicContact CB-CD2 4.5Å; I785-L1079 HydrophobicContact CD1-CD2 4.39Å; I785-L1079 HydrophobicContact CG2-CD2 3.85Å
786	R	69.1	Low	70.5	Confident	110 Å²	110	49.2 Å²	49.2	42%	0.415	23%	0.23	S	C	.	.	H	α-helix	trans	-54.6	-41.5	174.3	-76.3	168.6	-180	179.3	2.3	113.1	L782 H789 K790	L782-R786 WeakPolarHBondContact O-CB 3.44Å; L782-R786 WeakPolarHBondContact O-CD 3.28Å; L782-R786 WeakPolarHBondContact O-CG 3.38Å; L782-R786 PolarHBondContact O-N 3.08Å; R786-H789 PolarHBondContact O-N 3.09Å; R786-K790 WeakPolarHBondContact O-CB 3.28Å; R786-K790 PolarHBondContact O-N 3.37Å
787	R	70.1	Confident	72	Confident	77 Å²	77	47.3 Å²	47.3	29%	0.291	22%	0.22	S	C	.	.	H	α-helix	trans	-64.4	-43.4	177.9	-77.1	168	175.9	-163.5	-0.8	111.6	L783 I784 I785 K790 V791	L783-R787 WeakPolarHBondContact O-CB 3.41Å; L783-R787 WeakPolarHBondContact O-CD 3.49Å; L783-R787 WeakPolarHBondContact O-CG 3.28Å; L783-R787 PolarHBondContact O-N 2.97Å; I784-R787 PolarHBondContact O-N 3.3Å; I785-R787 VanDerWaalsContact C-N 3.3Å; I785-R787 PolarHBondContact O-N 3.13Å; R787-K790 PolarHBondContact O-N 2.99Å; R787-V791 WeakPolarHBondContact O-CG2 3.47Å; R787-V791 PolarHBondContact O-N 2.94Å
788	L	72.5	Confident	73.2	Confident	5 Å²	5	43.8 Å²	43.8	3%	0.026	20%	0.199	C	C	.	.	H	α-helix	trans	-60.7	-47.6	175.3	-177.9	58	0	0	0	110.9	L738 F759 F763 I784 I785 K790 V791 L792 V1060	L738-L788 HydrophobicContact CD2-CD2 4.43Å; F759-L788 HydrophobicContact CE2-CD1 4.46Å; F759-L788 HydrophobicContact CZ-CD1 4.31Å; F763-L788 HydrophobicContact CD1-CB 3.84Å; F763-L788 HydrophobicContact CD1-CD1 3.97Å; F763-L788 HydrophobicContact CD1-CD2 4.37Å; F763-L788 HydrophobicContact CD1-CG 4.27Å; F763-L788 HydrophobicContact CD2-CD1 4.25Å; F763-L788 HydrophobicContact CE1-CB 3.64Å; F763-L788 HydrophobicContact CE1-CD1 3.81Å; F763-L788 HydrophobicContact CE1-CG 4.25Å; F763-L788 HydrophobicContact CE2-CD1 4.1Å; F763-L788 HydrophobicContact CG-CD1 4.19Å; F763-L788 HydrophobicContact CZ-CB 4.44Å; F763-L788 HydrophobicContact CZ-CD1 3.87Å; I784-L788 PolarHBondContact O-N 3.4Å; I785-L788 WeakPolarHBondContact O-CB 3.49Å; I785-L788 PolarHBondContact O-N 2.86Å; I785-L788 VanDerWaalsContact O-N 3.13Å; L788-K790 PolarHBondContact O-N 3.45Å; L788-V791 PolarHBondContact O-N 3.12Å; L788-L792 HydrophobicContact CD1-CD1 3.91Å; L788-L792 HydrophobicContact CD1-CG 4.16Å; L788-L792 HydrophobicContact CD2-CD1 4.49Å; L788-L792 HydrophobicContact CG-CD1 3.77Å; L788-L792 HydrophobicContact CG-CG 4.4Å; L788-L792 WeakPolarHBondContact O-CG 3.41Å; L788-L792 PolarHBondContact O-N 2.77Å; L788-V1060 HydrophobicContact CD2-CG1 3.82Å
789	H	71.1	Confident	74.1	Confident	10 Å²	10	38.7 Å²	38.7	5%	0.046	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-41.2	178.5	-58.3	152.8	0	0	0	113.2	I785 R786 V791 L792 R793 V1060 A1063 G1064 F1066	I785-H789 WeakPolarHBondContact CG2-CE1 3.41Å; I785-H789 VanDerWaalsContact O-CG 3.28Å; I785-H789 PolarHBondContact O-N 3.13Å; I785-H789 PolarHBondContact O-ND1 3.3Å; R786-H789 PolarHBondContact O-N 3.09Å; H789-V791 PolarHBondContact O-N 2.85Å; H789-L792 PolarHBondContact O-N 3.37Å; H789-L792 VanDerWaalsContact O-N 3.09Å; H789-R793 PolarHBondContact O-N 3.02Å; H789-V1060 PolarHBondContact CD2-O 2.91Å; H789-V1060 PolarHBondContact NE2-O 3.34Å; H789-A1063 VanDerWaalsContact CE1-C 3.5Å; H789-G1064 WeakPolarHBondContact CE1-CA 3.19Å; H789-G1064 PolarHBondContact CE1-N 2.8Å; H789-G1064 VanDerWaalsContact ND1-CA 3.31Å; H789-G1064 WeakPolarHBondContact ND1-CA 3.2Å; H789-G1064 WeakPolarHBondContact NE2-CA 3.37Å; H789-F1066 HydrophobicContact CB-CZ 4.41Å; H789-F1066 AromaticContact CD2-CZ 3.74Å
790	K	69.3	Low	74.9	Confident	121 Å²	121	33.4 Å²	33.4	53%	0.526	15%	0.151	S	C	.	.	H	α-helix	trans	-62.4	-26.7	177.3	-171.8	163.1	-175	169	0	113	Y551 R786 R787 L788	Y551-K790 HydrophobicContact CD2-CD 4.42Å; Y551-K790 HydrophobicContact CD2-CG 3.93Å; Y551-K790 HydrophobicContact CE2-CD 4.47Å; Y551-K790 HydrophobicContact CE2-CG 4.31Å; R786-K790 WeakPolarHBondContact O-CB 3.28Å; R786-K790 PolarHBondContact O-N 3.37Å; R787-K790 PolarHBondContact O-N 2.99Å; L788-K790 PolarHBondContact O-N 3.45Å
791	V	72.9	Confident	75.6	Confident	39 Å²	39	31.1 Å²	31.1	24%	0.236	14%	0.14	C	C	.	.	H	α-helix	trans	-83.8	-34.1	172.4	176.2	0	0	0	0	112.2	F359 F753 R787 L788 H789	F359-V791 HydrophobicContact CZ-CG2 4.45Å; F753-V791 HydrophobicContact CZ-CG1 4.34Å; R787-V791 WeakPolarHBondContact O-CG2 3.47Å; R787-V791 PolarHBondContact O-N 2.94Å; L788-V791 PolarHBondContact O-N 3.12Å; H789-V791 PolarHBondContact O-N 2.85Å
792	L	77.5	Confident	76	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-81	-31.4	-177	-70.5	175.3	0	0	0	114.8	L741 L745 L788 H789 P794 F795 L796 F1066	L741-L792 HydrophobicContact CD2-CD1 4.12Å; L745-L792 HydrophobicContact CD1-CD2 4.02Å; L745-L792 HydrophobicContact CD2-CD2 3.96Å; L788-L792 HydrophobicContact CD1-CD1 3.91Å; L788-L792 HydrophobicContact CD1-CG 4.16Å; L788-L792 HydrophobicContact CD2-CD1 4.49Å; L788-L792 HydrophobicContact CG-CD1 3.77Å; L788-L792 HydrophobicContact CG-CG 4.4Å; L788-L792 WeakPolarHBondContact O-CG 3.41Å; L788-L792 PolarHBondContact O-N 2.77Å; H789-L792 PolarHBondContact O-N 3.37Å; H789-L792 VanDerWaalsContact O-N 3.09Å; L792-P794 VanDerWaalsContact C-N 3.3Å; L792-P794 VanDerWaalsContact O-N 3.07Å; L792-F795 PolarHBondContact O-N 3.28Å; L792-L796 PolarHBondContact O-N 3.44Å; L792-L796 VanDerWaalsContact O-N 3.1Å; L792-F1066 HydrophobicContact CB-CE1 3.67Å; L792-F1066 HydrophobicContact CB-CZ 3.8Å; L792-F1066 HydrophobicContact CD1-CZ 4.06Å
793	R	75.3	Confident	76.3	Confident	44 Å²	44	41.1 Å²	41.1	17%	0.166	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-33.2	-169.9	-156.3	178.2	-167.8	-177.7	5.5	115.1	D534 Y552 H789 F1066 D1067	D534-R793 IonicContact OD2-CZ 3.97Å; D534-R793 IonicContact OD2-NH1 3.87Å; D534-R793 PolarHBondContact OD2-NH1 3.35Å; D534-R793 IonicContact OD2-NH2 2.72Å; Y552-R793 HydrophobicContact CD2-CG 4.45Å; H789-R793 PolarHBondContact O-N 3.02Å; R793-F1066 HydrophobicContact CB-CD1 4.48Å; R793-F1066 HydrophobicContact CB-CE1 4.46Å; R793-F1066 HydrophobicContact CG-CD1 4.43Å; R793-D1067 PolarHBondContact NH2-O 2.86Å
794	P	77.3	Confident	76.7	Confident	6 Å²	6	40.9 Å²	40.9	4%	0.039	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-26	174.6	-19.2	33.9	0	0	0	115.4	A555 H556 L792	A555-P794 HydrophobicContact CB-CB 3.56Å; A555-P794 HydrophobicContact CB-CG 4.06Å; H556-P794 PolarHBondContact NE2-O 3.14Å; L792-P794 VanDerWaalsContact C-N 3.3Å; L792-P794 VanDerWaalsContact O-N 3.07Å
795	F	81.9	Confident	76.7	Confident	31 Å²	31	40.6 Å²	40.6	14%	0.136	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-14.4	-167.3	-55.7	-64	0	0	0	114	L593 G595 I596 L749 L792	L593-F795 HydrophobicContact CD1-CE1 4.23Å; L593-F795 HydrophobicContact CD2-CE1 4.39Å; G595-F795 CarbonylContact C-O 3.53Å; G595-F795 VanDerWaalsContact CA-O 3.3Å; G595-F795 WeakPolarHBondContact CA-O 3.32Å; I596-F795 PolarHBondContact N-O 3.1Å; L749-F795 HydrophobicContact CD1-CD1 3.91Å; L749-F795 HydrophobicContact CD1-CD2 4.37Å; L749-F795 HydrophobicContact CD1-CE1 3.64Å; L749-F795 HydrophobicContact CD1-CE2 4.12Å; L749-F795 HydrophobicContact CD1-CG 4.27Å; L749-F795 HydrophobicContact CD1-CZ 3.75Å; L792-F795 PolarHBondContact O-N 3.28Å
796	L	87.1	Confident	76.6	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.016	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	121.7	-177.9	-176.3	148.3	0	0	0	110.7	I596 A598 P733 L792 R798 I1061 F1066	I596-L796 HydrophobicContact CB-CD1 4.48Å; I596-L796 HydrophobicContact CB-CG 4.42Å; I596-L796 HydrophobicContact CD1-CD1 4.32Å; I596-L796 HydrophobicContact CG2-CD1 4.49Å; A598-L796 HydrophobicContact CB-CD1 4.1Å; A598-L796 HydrophobicContact CB-CD2 3.9Å; A598-L796 HydrophobicContact CB-CG 3.76Å; P733-L796 HydrophobicContact CB-CD1 4.15Å; P733-L796 HydrophobicContact CG-CD1 4.23Å; L792-L796 PolarHBondContact O-N 3.44Å; L792-L796 VanDerWaalsContact O-N 3.1Å; L796-R798 HydrophobicContact CD2-CB 3.93Å; L796-I1061 HydrophobicContact CD2-CG2 4.32Å; L796-F1066 HydrophobicContact CD2-CD1 4.15Å; L796-F1066 HydrophobicContact CD2-CD2 3.93Å; L796-F1066 HydrophobicContact CD2-CE1 4.34Å; L796-F1066 HydrophobicContact CD2-CE2 4.11Å; L796-F1066 HydrophobicContact CD2-CG 3.95Å; L796-F1066 HydrophobicContact CD2-CZ 4.31Å
797	L	87.9	Confident	76.5	Confident	16 Å²	16	48.9 Å²	48.9	8%	0.084	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	109.9	172.3	177.9	61.9	0	0	0	109.1	W584 I596 L597 A598 D599 R799	W584-L797 HydrophobicContact CB-CD2 4.2Å; W584-L797 HydrophobicContact CD2-CB 3.94Å; W584-L797 HydrophobicContact CD2-CD2 3.88Å; W584-L797 HydrophobicContact CE3-CB 3.78Å; W584-L797 HydrophobicContact CE3-CD2 3.69Å; W584-L797 HydrophobicContact CE3-CG 4.4Å; W584-L797 HydrophobicContact CG-CD2 4.11Å; W584-L797 HydrophobicContact CH2-CB 3.75Å; W584-L797 HydrophobicContact CZ2-CB 3.91Å; W584-L797 HydrophobicContact CZ3-CB 3.69Å; W584-L797 HydrophobicContact CZ3-CD2 4.35Å; I596-L797 PolarHBondContact O-N 3.17Å; I596-L797 VanDerWaalsContact O-N 3.14Å; L597-L797 HydrophobicContact CD1-CB 4.39Å; L597-L797 HydrophobicContact CD1-CD2 4.02Å; L597-L797 HydrophobicContact CD1-CG 4.34Å; A598-L797 CarbonylContact C-O 3.55Å; A598-L797 VanDerWaalsContact CA-O 3.32Å; A598-L797 WeakPolarHBondContact CA-O 3.38Å; A598-L797 WeakPolarHBondContact CB-O 3.45Å; A598-L797 PolarHBondContact N-O 2.89Å; D599-L797 PolarHBondContact N-O 2.94Å; L797-R799 HydrophobicContact CD1-CG 4.44Å
798	R	86	Confident	76.8	Confident	28 Å²	28	46.4 Å²	46.4	11%	0.106	23%	0.225	C	C	.	.			trans	-118.1	135.9	172.3	176.4	173.1	-173.5	161.9	-3	109.4	A598 L796 D1057 F1066	A598-R798 HydrophobicContact CB-CB 3.98Å; A598-R798 WeakPolarHBondContact O-CG 3.48Å; L796-R798 HydrophobicContact CD2-CB 3.93Å; R798-D1057 IonicContact CZ-OD1 2.73Å; R798-D1057 IonicContact CZ-OD2 3.61Å; R798-D1057 VanDerWaalsContact CZ-OD2 3.25Å; R798-D1057 IonicContact NH1-OD1 3.47Å; R798-D1057 PolarHBondContact NH1-OD1 2.81Å; R798-D1057 IonicContact NH1-OD2 3.59Å; R798-D1057 PolarHBondContact NH1-OD2 2.79Å; R798-D1057 IonicContact NH2-OD2 3.71Å; R798-D1057 PolarHBondContact NH2-OD2 2.92Å; R798-F1066 HydrophobicContact CB-CB 4.39Å
799	R	86	Confident	77.2	Confident	9 Å²	9	47.6 Å²	47.6	3%	0.034	23%	0.233	C	C	.	.			trans	-141.9	147.9	174.4	-66.1	167	-66.5	-167	7.6	109	Y577 D599 E600 L603 Q608 L797 E803 V804	Y577-R799 PolarHBondContact O-NH1 3.2Å; D599-R799 VanDerWaalsContact CG-NH2 3.26Å; D599-R799 IonicContact OD1-CZ 3.41Å; D599-R799 VanDerWaalsContact OD1-CZ 3.26Å; D599-R799 IonicContact OD1-NE 3.69Å; D599-R799 PolarHBondContact OD1-NE 2.59Å; D599-R799 IonicContact OD1-NH2 2.66Å; D599-R799 PolarHBondContact OD1-NH2 2.62Å; D599-R799 IonicContact OD2-CZ 2.65Å; D599-R799 IonicContact OD2-NE 2.62Å; D599-R799 IonicContact OD2-NH2 3.62Å; D599-R799 PolarHBondContact OD2-NH2 3.35Å; E600-R799 PolarHBondContact N-O 2.87Å; L603-R799 HydrophobicContact CD1-CB 4.4Å; L603-R799 WeakPolarHBondContact CD1-O 3.25Å; Q608-R799 VanDerWaalsContact OE1-NH2 3.09Å; L797-R799 HydrophobicContact CD1-CG 4.44Å; R799-E803 VanDerWaalsContact CA-OE2 3.28Å; R799-E803 WeakPolarHBondContact CA-OE2 3.35Å; R799-V804 HydrophobicContact CB-CG1 4.28Å
800	L	81.5	Confident	77.7	Confident	16 Å²	16	54.2 Å²	54.2	8%	0.084	26%	0.264	C	S	.	.			trans	-102.2	154.9	179.7	-55.1	178.2	0	0	0	111.2	E600 R802 E803	E600-L800 VanDerWaalsContact OE2-CA 3.22Å; E600-L800 WeakPolarHBondContact OE2-CA 3.17Å; L800-R802 VanDerWaalsContact C-N 3.28Å; L800-R802 HydrophobicContact CB-CG 4.06Å; L800-R802 PolarHBondContact O-N 3.41Å; L800-E803 HydrophobicContact CB-CG 4.12Å; L800-E803 WeakPolarHBondContact CD1-OE1 3.15Å; L800-E803 WeakPolarHBondContact CG-OE1 3.3Å; L800-E803 PolarHBondContact N-OE2 3.04Å; L800-E803 WeakPolarHBondContact O-CB 3.37Å; L800-E803 PolarHBondContact O-N 3.39Å; L800-E803 VanDerWaalsContact O-N 3.07Å
801	K	79.4	Confident	78.6	Confident	11 Å²	11	51.2 Å²	51.2	5%	0.048	25%	0.251	C	S	.	.	H	α-helix	trans	-55.2	-44.4	178.2	-67.1	-179	-152.8	117.1	0	111.7	E600 M601 L603 E803 V804 E805 L808 D1020 H1023	E600-K801 HydrophobicContact CG-CG 4.49Å; E600-K801 WeakPolarHBondContact OE1-CD 3.27Å; E600-K801 WeakPolarHBondContact OE1-CE 3.34Å; E600-K801 WeakPolarHBondContact OE1-CG 3.28Å; E600-K801 IonicContact OE1-NZ 3.12Å; E600-K801 PolarHBondContact OE1-NZ 3.36Å; E600-K801 PolarHBondContact OE2-N 3.5Å; M601-K801 VanDerWaalsContact O-CE 3.26Å; M601-K801 WeakPolarHBondContact O-CE 3.48Å; L603-K801 HydrophobicContact CD2-CG 3.99Å; L603-K801 HydrophobicContact CG-CG 4.37Å; K801-E803 PolarHBondContact O-N 3.11Å; K801-E803 VanDerWaalsContact O-N 3.15Å; K801-V804 PolarHBondContact O-N 3.2Å; K801-V804 VanDerWaalsContact O-N 3.13Å; K801-E805 PolarHBondContact O-N 2.93Å; K801-L808 HydrophobicContact CB-CD2 4.28Å; K801-L808 HydrophobicContact CD-CD2 3.52Å; K801-L808 HydrophobicContact CG-CD2 4.37Å; K801-D1020 IonicContact NZ-OD1 3.62Å; K801-D1020 PolarHBondContact NZ-OD1 2.91Å; K801-D1020 IonicContact NZ-OD2 2.67Å; K801-H1023 WeakPolarHBondContact CE-O 3.28Å; K801-H1023 PolarHBondContact NZ-ND1 3.14Å; K801-H1023 VanDerWaalsContact NZ-ND1 3.12Å
802	R	76.3	Confident	79.4	Confident	177 Å²	177	51.3 Å²	51.3	67%	0.668	25%	0.251	S	S	*	.	H	α-helix	trans	-58.8	-23.2	178.3	68.9	-178.3	-178	-173.7	-0.3	114.6	L800	L800-R802 VanDerWaalsContact C-N 3.28Å; L800-R802 HydrophobicContact CB-CG 4.06Å; L800-R802 PolarHBondContact O-N 3.41Å
803	E	74.9	Confident	80	Confident	83 Å²	83	54.5 Å²	54.5	39%	0.388	27%	0.266	S	S	.	.	H	α-helix	trans	-87.5	-17.3	-178.6	-63.4	161.1	-175.5	0	0	113	R799 L800 K801	R799-E803 VanDerWaalsContact CA-OE2 3.28Å; R799-E803 WeakPolarHBondContact CA-OE2 3.35Å; L800-E803 HydrophobicContact CB-CG 4.12Å; L800-E803 WeakPolarHBondContact CD1-OE1 3.15Å; L800-E803 WeakPolarHBondContact CG-OE1 3.3Å; L800-E803 PolarHBondContact N-OE2 3.04Å; L800-E803 WeakPolarHBondContact O-CB 3.37Å; L800-E803 PolarHBondContact O-N 3.39Å; L800-E803 VanDerWaalsContact O-N 3.07Å; K801-E803 PolarHBondContact O-N 3.11Å; K801-E803 VanDerWaalsContact O-N 3.15Å
804	V	76.4	Confident	80.8	Confident	40 Å²	40	55.3 Å²	55.3	24%	0.242	27%	0.27	C	S	.	.	H	α-helix	trans	-129.4	-13.1	-167.5	-55.4	0	0	0	0	115	Y577 L603 R799 K801	Y577-V804 HydrophobicContact CD1-CB 3.66Å; Y577-V804 HydrophobicContact CD1-CG1 4.34Å; Y577-V804 HydrophobicContact CD1-CG2 3.9Å; Y577-V804 HydrophobicContact CD2-CB 4.5Å; Y577-V804 HydrophobicContact CD2-CG1 4.47Å; Y577-V804 HydrophobicContact CD2-CG2 4.45Å; Y577-V804 HydrophobicContact CE1-CB 4.27Å; Y577-V804 HydrophobicContact CE1-CG2 4Å; Y577-V804 HydrophobicContact CG-CB 3.81Å; Y577-V804 HydrophobicContact CG-CG1 3.97Å; Y577-V804 HydrophobicContact CG-CG2 4.15Å; L603-V804 HydrophobicContact CD1-CG2 4.24Å; L603-V804 HydrophobicContact CD2-CG2 3.54Å; R799-V804 HydrophobicContact CB-CG1 4.28Å; K801-V804 PolarHBondContact O-N 3.2Å; K801-V804 VanDerWaalsContact O-N 3.13Å
805	E	67.2	Low	81.4	Confident	20 Å²	20	57.3 Å²	57.3	9%	0.093	28%	0.282	C	S	.	.			trans	-147.1	84.2	-174.9	-170.8	153.9	178.8	0	0	113.5	K575 K801 Q807 L808 I1025	K575-E805 IonicContact NZ-OE1 2.78Å; K575-E805 PolarHBondContact NZ-OE1 3.4Å; K575-E805 IonicContact NZ-OE2 3.45Å; K575-E805 PolarHBondContact NZ-OE2 3.36Å; K801-E805 PolarHBondContact O-N 2.93Å; E805-Q807 HydrophobicContact CG-CB 4.21Å; E805-Q807 PolarHBondContact O-N 3.11Å; E805-L808 HydrophobicContact CG-CB 4.29Å; E805-L808 PolarHBondContact O-N 3.17Å; E805-I1025 WeakPolarHBondContact OE2-CD1 3.45Å; E805-I1025 WeakPolarHBondContact OE2-CG1 3.37Å
806	S	68.3	Low	81.9	Confident	128 Å²	128	56 Å²	56	90%	0.895	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	11.2	170.8	56.6	0	0	0	0	114.8
807	Q	68	Low	82.1	Confident	160 Å²	160	58 Å²	58	75%	0.748	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-7	176.6	-67.2	-174.3	-27.3	0	0	112.9	E805	E805-Q807 HydrophobicContact CG-CB 4.21Å; E805-Q807 PolarHBondContact O-N 3.11Å
808	L	76.2	Confident	82.3	Confident	25 Å²	25	57.5 Å²	57.5	13%	0.131	28%	0.283	C	S	.	.	S	Bend	trans	-88.2	127.1	178.3	-169.7	67.4	0	0	0	108.9	K801 E805 H1023 Q1027	K801-L808 HydrophobicContact CB-CD2 4.28Å; K801-L808 HydrophobicContact CD-CD2 3.52Å; K801-L808 HydrophobicContact CG-CD2 4.37Å; E805-L808 HydrophobicContact CG-CB 4.29Å; E805-L808 PolarHBondContact O-N 3.17Å; L808-H1023 VanDerWaalsContact CD2-CE1 3.45Å; L808-H1023 WeakPolarHBondContact CD2-CE1 3.22Å; L808-H1023 WeakPolarHBondContact CD2-NE2 3.29Å; L808-Q1027 HydrophobicContact CD1-CB 4.15Å
809	P	79.7	Confident	82.6	Confident	31 Å²	31	61.2 Å²	61.2	20%	0.201	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-55.9	156.9	171.9	-25.2	34.6	0	0	0	112.1	H1023 Q1027 Q1028 N1029	P809-H1023 PolarHBondContact O-NE2 3.5Å; P809-Q1027 HydrophobicContact CG-CG 4.49Å; P809-Q1028 WeakPolarHBondContact CG-O 3.37Å; P809-N1029 WeakPolarHBondContact CB-O 3.28Å
810	E	82.9	Confident	82.8	Confident	148 Å²	148	61.3 Å²	61.3	69%	0.692	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-66.9	162.5	-179.1	-59.2	-160.3	164.8	0	0	112.2	E1030 V1031	E810-E1030 HydrophobicContact CB-CG 4.31Å; E810-E1030 WeakPolarHBondContact O-CG 3.45Å; E810-V1031 PolarHBondContact O-N 3.4Å
811	K	87.4	Confident	83.4	Confident	59 Å²	59	60.6 Å²	60.6	26%	0.257	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	101.7	176	-173.2	-149.4	72.8	165.8	0	108.7	H1023 V1031 V1033	K811-H1023 HydrophobicContact CB-CB 4.46Å; K811-H1023 HydrophobicContact CD-CB 4.17Å; K811-H1023 HydrophobicContact CG-CB 4.23Å; K811-V1031 WeakPolarHBondContact CA-O 3.28Å; K811-V1031 HydrophobicContact CB-CB 4.44Å; K811-V1031 HydrophobicContact CG-CB 4.17Å; K811-V1031 HydrophobicContact CG-CG1 4.21Å; K811-V1033 HydrophobicContact CD-CG2 4.03Å; K811-V1033 HydrophobicContact CG-CG2 3.84Å
812	V	89.9	Confident	83.9	Confident	40 Å²	40	62.6 Å²	62.6	24%	0.242	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131	178.7	-175	0	0	0	0	108.9	Y814 E1030 V1031 V1033	V812-Y814 HydrophobicContact CB-CE2 4.26Å; V812-Y814 HydrophobicContact CG1-CD1 4.45Å; V812-Y814 HydrophobicContact CG1-CD2 4.06Å; V812-Y814 HydrophobicContact CG1-CE1 3.98Å; V812-Y814 HydrophobicContact CG1-CE2 3.53Å; V812-Y814 VanDerWaalsContact CG1-CZ 3.49Å; V812-E1030 WeakPolarHBondContact CG2-OE1 3.49Å; V812-V1031 PolarHBondContact N-O 3.42Å; V812-V1033 PolarHBondContact O-N 2.83Å
813	E	90.7	Very high	84.6	Confident	70 Å²	70	54.2 Å²	54.2	33%	0.327	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	114.1	176	-177.3	167.2	170.2	0	0	110.2	Q1019 V1033 R1035	E813-Q1019 VanDerWaalsContact CD-NE2 3.32Å; E813-Q1019 PolarHBondContact OE1-NE2 2.9Å; E813-Q1019 PolarHBondContact OE2-NE2 3.33Å; E813-Q1019 PolarHBondContact OE2-OE1 2.94Å; E813-V1033 WeakPolarHBondContact CA-O 3.26Å; E813-V1033 HydrophobicContact CB-CB 4.14Å; E813-V1033 HydrophobicContact CG-CB 4.17Å; E813-V1033 HydrophobicContact CG-CG1 4.05Å; E813-R1035 IonicContact OE1-CZ 3.44Å; E813-R1035 IonicContact OE1-NE 2.74Å; E813-R1035 PolarHBondContact OE1-NE 3.19Å; E813-R1035 IonicContact OE1-NH2 3.68Å; E813-R1035 PolarHBondContact OE1-NH2 2.98Å
814	Y	91.5	Very high	85.5	Confident	61 Å²	61	50.3 Å²	50.3	24%	0.239	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133.3	175.1	-65.8	-68.5	0	0	0	110.2	V812 V1033 L1034 R1035 M1105	V812-Y814 HydrophobicContact CB-CE2 4.26Å; V812-Y814 HydrophobicContact CG1-CD1 4.45Å; V812-Y814 HydrophobicContact CG1-CD2 4.06Å; V812-Y814 HydrophobicContact CG1-CE1 3.98Å; V812-Y814 HydrophobicContact CG1-CE2 3.53Å; V812-Y814 VanDerWaalsContact CG1-CZ 3.49Å; Y814-V1033 PolarHBondContact N-O 3.12Å; Y814-L1034 HydrophobicContact CD2-CD2 4.13Å; Y814-R1035 PolarHBondContact O-N 2.74Å; Y814-M1105 HydrophobicContact CD1-CB 4.46Å; Y814-M1105 HydrophobicContact CD1-CE 4.02Å; Y814-M1105 HydrophobicContact CD1-CG 3.86Å; Y814-M1105 HydrophobicContact CD1-SD 4.4Å; Y814-M1105 HydrophobicContact CD2-CB 4.05Å; Y814-M1105 HydrophobicContact CD2-CG 4.32Å; Y814-M1105 HydrophobicContact CE1-CG 4.06Å; Y814-M1105 HydrophobicContact CE2-CB 4.16Å; Y814-M1105 WeakPolarHBondContact CE2-O 3.35Å; Y814-M1105 HydrophobicContact CG-CB 4.21Å; Y814-M1105 HydrophobicContact CG-CE 4.42Å; Y814-M1105 HydrophobicContact CG-CG 3.99Å; Y814-M1105 HydrophobicContact CG-SD 4.35Å
815	V	90.8	Very high	86.2	Confident	48 Å²	48	54.3 Å²	54.3	29%	0.291	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.7	167.8	-176.9	0	0	0	0	107.6	I1037 L1047	V815-I1037 HydrophobicContact CG1-CD1 3.79Å; V815-I1037 HydrophobicContact CG1-CG1 4.26Å; V815-L1047 HydrophobicContact CG1-CD2 3.99Å; V815-L1047 HydrophobicContact CG2-CD2 4.19Å
816	I	91.9	Very high	87.2	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	107.6	-179	-51.3	-179	0	0	0	108.8	C818 L916 L1034 R1035 L1036 I1037 P1097 M1105	I816-C818 PolarHBondContact O-SG 3.11Å; I816-L916 HydrophobicContact CB-CD2 4.1Å; I816-L916 HydrophobicContact CD1-CD2 4.41Å; I816-L916 HydrophobicContact CG2-CD1 4.46Å; I816-L916 HydrophobicContact CG2-CD2 3.49Å; I816-L916 VanDerWaalsContact CG2-CD2 3.49Å; I816-L1034 HydrophobicContact CD1-CB 4.24Å; I816-L1034 HydrophobicContact CD1-CD2 4.31Å; I816-R1035 PolarHBondContact N-O 3.22Å; I816-L1036 HydrophobicContact CB-CD2 4.16Å; I816-L1036 HydrophobicContact CD1-CD2 4.23Å; I816-I1037 PolarHBondContact O-N 3.41Å; I816-I1037 VanDerWaalsContact O-N 3.11Å; I816-P1097 HydrophobicContact CG2-CG 3.74Å; I816-M1105 HydrophobicContact CD1-SD 4.23Å; I816-M1105 HydrophobicContact CG1-SD 3.97Å
817	K	91.5	Very high	88.1	Confident	44 Å²	44	48.8 Å²	48.8	19%	0.191	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	127.5	170.4	-71.9	-171.2	-174	-177.5	0	108.9	I1037 I1039 E1092 E1093 D1094 P1097	K817-I1037 CarbonylContact C-O 3.59Å; K817-I1039 HydrophobicContact CB-CD1 3.91Å; K817-I1039 HydrophobicContact CB-CG1 3.68Å; K817-I1039 HydrophobicContact CG-CG1 4.35Å; K817-E1092 PolarHBondContact NZ-O 3.19Å; K817-E1093 PolarHBondContact NZ-O 2.9Å; K817-D1094 IonicContact NZ-OD1 2.64Å; K817-D1094 PolarHBondContact NZ-OD1 2.73Å; K817-P1097 WeakPolarHBondContact O-CD 3.17Å
818	C	92.1	Very high	89.1	Confident	6 Å²	6	42.2 Å²	42.2	4%	0.041	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.4	-174.7	-57.2	0	0	0	0	110.8	I816 L916 I1037 S1038 I1039	I816-C818 PolarHBondContact O-SG 3.11Å; C818-L916 VanDerWaalsContact SG-CD2 3.52Å; C818-I1037 WeakPolarHBondContact CB-O 3.41Å; C818-I1037 PolarHBondContact N-O 2.61Å; C818-S1038 CarbonylContact O-C 3.48Å; C818-S1038 WeakPolarHBondContact O-CA 3.31Å; C818-I1039 WeakPolarHBondContact O-CG1 3.44Å; C818-I1039 PolarHBondContact O-N 3.34Å
819	E	91.6	Very high	89.6	Confident	107 Å²	107	44.3 Å²	44.3	50%	0.5	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-70.4	144.9	176.3	-58.9	-164.3	124	0	0	112.7	G912 I1039 A1096 L1137	E819-G912 VanDerWaalsContact O-CA 3.3Å; E819-G912 WeakPolarHBondContact O-CA 3.42Å; E819-I1039 HydrophobicContact CG-CD1 4.35Å; E819-A1096 HydrophobicContact CG-CB 3.73Å; E819-L1137 HydrophobicContact CB-CD1 3.94Å
820	M	90.9	Very high	89.6	Confident	11 Å²	11	43.8 Å²	43.8	5%	0.054	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-84.1	135	168.8	-75.1	-167.6	-76.1	0	0	111.6	Q824 R825 Y828	M820-Q824 HydrophobicContact CB-CB 3.98Å; M820-Q824 HydrophobicContact CG-CB 4.23Å; M820-Q824 HydrophobicContact SD-CB 4.27Å; M820-R825 PolarHBondContact O-NE 3.49Å; M820-R825 PolarHBondContact O-NH2 3.32Å; M820-Y828 HydrophobicContact CE-CG 4.39Å; M820-Y828 HydrophobicContact SD-CD2 4.16Å; M820-Y828 HydrophobicContact SD-CG 4.36Å
821	S	93.4	Very high	89.6	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.007	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-61.5	159.6	168.3	72.1	0	0	0	0	111.1	L823 Q824 R825 S910	S821-L823 PolarHBondContact O-N 3.09Å; S821-Q824 WeakPolarHBondContact O-CB 3.36Å; S821-Q824 PolarHBondContact O-N 2.84Å; S821-Q824 WeakPolarHBondContact OG-CG 3.44Å; S821-Q824 PolarHBondContact OG-N 3.48Å; S821-Q824 PolarHBondContact OG-OE1 3.1Å; S821-R825 WeakPolarHBondContact O-CB 3.38Å; S821-R825 PolarHBondContact O-N 2.75Å; S821-S910 PolarHBondContact OG-O 2.86Å
822	D	91.2	Very high	89.2	Confident	53 Å²	53	37.8 Å²	37.8	28%	0.283	19%	0.185	S	C	.	.	H	α-helix	trans	-64.8	-31.7	-179.7	-75.7	-29.7	0	0	0	112.1	R825 V826 M1138 E1139 F1140 L1143	D822-R825 PolarHBondContact O-N 3.22Å; D822-V826 WeakPolarHBondContact O-CB 3.2Å; D822-V826 VanDerWaalsContact O-CG2 3.27Å; D822-V826 WeakPolarHBondContact O-CG2 3.13Å; D822-V826 PolarHBondContact O-N 3.24Å; D822-M1138 PolarHBondContact N-O 2.68Å; D822-M1138 VanDerWaalsContact N-O 3.17Å; D822-E1139 WeakPolarHBondContact OD2-CA 3.19Å; D822-F1140 HydrophobicContact CB-CB 4.05Å; D822-F1140 VanDerWaalsContact CB-N 3.31Å; D822-F1140 PolarHBondContact OD2-N 3.45Å; D822-L1143 HydrophobicContact CB-CD1 4.42Å
823	L	91	Very high	88.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.7	-48.6	170.3	179.6	56.6	0	0	0	111.1	S821 L827 P869 F870 I875 I879 M1138 L1143 I1147	S821-L823 PolarHBondContact O-N 3.09Å; L823-L827 HydrophobicContact CD1-CD1 3.75Å; L823-L827 HydrophobicContact CD1-CG 4.23Å; L823-L827 HydrophobicContact CG-CD1 4.03Å; L823-L827 WeakPolarHBondContact O-CB 3.22Å; L823-L827 WeakPolarHBondContact O-CD1 3.17Å; L823-L827 WeakPolarHBondContact O-CG 3.26Å; L823-L827 PolarHBondContact O-N 2.81Å; L823-P869 HydrophobicContact CD2-CB 3.83Å; L823-P869 HydrophobicContact CD2-CG 3.73Å; L823-P869 HydrophobicContact CG-CB 4.01Å; L823-P869 HydrophobicContact CG-CG 4.2Å; L823-F870 HydrophobicContact CD2-CE1 4.33Å; L823-I875 HydrophobicContact CD1-CG2 4.11Å; L823-I875 HydrophobicContact CD2-CG2 4.38Å; L823-I879 HydrophobicContact CD2-CD1 4.12Å; L823-I879 HydrophobicContact CD2-CG1 4.11Å; L823-M1138 HydrophobicContact CB-SD 4.23Å; L823-M1138 HydrophobicContact CD2-SD 4.01Å; L823-L1143 HydrophobicContact CB-CD2 3.78Å; L823-L1143 HydrophobicContact CD1-CD2 4.22Å; L823-L1143 HydrophobicContact CG-CD2 4.48Å; L823-I1147 HydrophobicContact CD1-CD1 4.09Å; L823-I1147 HydrophobicContact CD1-CG2 4.47Å
824	Q	92.7	Very high	87.4	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-46.2	175.7	-70.9	176.3	-63.6	0	0	111.3	M820 S821 V826 L827 Y828 I865 C866 P869 S911	M820-Q824 HydrophobicContact CB-CB 3.98Å; M820-Q824 HydrophobicContact CG-CB 4.23Å; M820-Q824 HydrophobicContact SD-CB 4.27Å; S821-Q824 WeakPolarHBondContact O-CB 3.36Å; S821-Q824 PolarHBondContact O-N 2.84Å; S821-Q824 WeakPolarHBondContact OG-CG 3.44Å; S821-Q824 PolarHBondContact OG-N 3.48Å; S821-Q824 PolarHBondContact OG-OE1 3.1Å; Q824-V826 PolarHBondContact O-N 3.38Å; Q824-L827 PolarHBondContact O-N 3.36Å; Q824-Y828 WeakPolarHBondContact O-CB 3.47Å; Q824-Y828 PolarHBondContact O-N 2.81Å; Q824-I865 HydrophobicContact CB-CG2 4.09Å; Q824-I865 HydrophobicContact CG-CG2 4.36Å; Q824-I865 PolarHBondContact NE2-O 2.84Å; Q824-I865 WeakPolarHBondContact O-CG2 3.35Å; Q824-C866 PolarHBondContact NE2-O 2.89Å; Q824-C866 VanDerWaalsContact NE2-O 3.13Å; Q824-P869 HydrophobicContact CG-CG 4.44Å; Q824-S911 PolarHBondContact NE2-OG 3.41Å
825	R	91	Very high	86.3	Confident	124 Å²	124	36 Å²	36	47%	0.468	19%	0.186	S	C	.	.	H	α-helix	trans	-63.7	-42.5	-174.6	-151.7	175.2	-64.4	-124.7	6.7	112	M820 S821 D822 S829	M820-R825 PolarHBondContact O-NE 3.49Å; M820-R825 PolarHBondContact O-NH2 3.32Å; S821-R825 WeakPolarHBondContact O-CB 3.38Å; S821-R825 PolarHBondContact O-N 2.75Å; D822-R825 PolarHBondContact O-N 3.22Å; R825-S829 WeakPolarHBondContact O-CB 3.3Å; R825-S829 PolarHBondContact O-N 2.83Å
826	V	88.2	Confident	85.3	Confident	21 Å²	21	34 Å²	34	13%	0.127	17%	0.174	C	C	.	.	H	α-helix	trans	-65.9	-46.1	174.8	172.1	0	0	0	0	111.6	D822 Q824 H830 F1140 L1143 I1147	D822-V826 WeakPolarHBondContact O-CB 3.2Å; D822-V826 VanDerWaalsContact O-CG2 3.27Å; D822-V826 WeakPolarHBondContact O-CG2 3.13Å; D822-V826 PolarHBondContact O-N 3.24Å; Q824-V826 PolarHBondContact O-N 3.38Å; V826-H830 PolarHBondContact O-N 3.25Å; V826-H830 VanDerWaalsContact O-N 3.16Å; V826-H830 PolarHBondContact O-ND1 2.81Å; V826-F1140 HydrophobicContact CG2-CD2 3.85Å; V826-F1140 HydrophobicContact CG2-CE2 3.76Å; V826-L1143 HydrophobicContact CG2-CD1 4.31Å; V826-I1147 HydrophobicContact CG1-CG2 3.95Å
827	L	87.7	Confident	84.1	Confident	11 Å²	11	34.4 Å²	34.4	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-65.8	-39.7	179	-68	169.8	0	0	0	112.1	L823 Q824 H830 M831 I865 P869 I875 I1147	L823-L827 HydrophobicContact CD1-CD1 3.75Å; L823-L827 HydrophobicContact CD1-CG 4.23Å; L823-L827 HydrophobicContact CG-CD1 4.03Å; L823-L827 WeakPolarHBondContact O-CB 3.22Å; L823-L827 WeakPolarHBondContact O-CD1 3.17Å; L823-L827 WeakPolarHBondContact O-CG 3.26Å; L823-L827 PolarHBondContact O-N 2.81Å; Q824-L827 PolarHBondContact O-N 3.36Å; L827-H830 PolarHBondContact O-N 3.47Å; L827-M831 WeakPolarHBondContact O-CB 3.45Å; L827-M831 PolarHBondContact O-N 2.93Å; L827-I865 HydrophobicContact CB-CD1 4.03Å; L827-I865 HydrophobicContact CB-CG1 4.29Å; L827-I865 HydrophobicContact CB-CG2 4.11Å; L827-P869 HydrophobicContact CD1-CB 4.05Å; L827-I875 HydrophobicContact CD1-CD1 3.6Å; L827-I875 HydrophobicContact CD1-CG2 4.24Å; L827-I875 HydrophobicContact CD2-CD1 3.7Å; L827-I875 HydrophobicContact CG-CD1 4.31Å; L827-I1147 HydrophobicContact CD2-CG2 4.22Å
828	Y	89.1	Confident	82.9	Confident	21 Å²	21	32.4 Å²	32.4	8%	0.082	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-47.2	178.6	-169.8	-78.7	0	0	0	110.9	M820 Q824 H830 M831 Q832 L862 S1041 V1042	M820-Y828 HydrophobicContact CE-CG 4.39Å; M820-Y828 HydrophobicContact SD-CD2 4.16Å; M820-Y828 HydrophobicContact SD-CG 4.36Å; Q824-Y828 WeakPolarHBondContact O-CB 3.47Å; Q824-Y828 PolarHBondContact O-N 2.81Å; Y828-H830 PolarHBondContact O-N 2.82Å; Y828-M831 PolarHBondContact O-N 3.29Å; Y828-Q832 WeakPolarHBondContact O-CB 3.18Å; Y828-Q832 PolarHBondContact O-N 3.43Å; Y828-L862 HydrophobicContact CD1-CD2 4.13Å; Y828-L862 HydrophobicContact CD2-CB 4.36Å; Y828-L862 HydrophobicContact CD2-CD2 3.61Å; Y828-L862 HydrophobicContact CE1-CD2 4.15Å; Y828-L862 HydrophobicContact CE2-CB 3.89Å; Y828-L862 HydrophobicContact CE2-CD1 4.41Å; Y828-L862 HydrophobicContact CE2-CD2 3.63Å; Y828-L862 HydrophobicContact CE2-CG 4.16Å; Y828-L862 HydrophobicContact CG-CD2 3.84Å; Y828-S1041 WeakPolarHBondContact OH-CA 3.4Å; Y828-V1042 PolarHBondContact OH-N 2.62Å
829	S	85.8	Confident	81.6	Confident	69 Å²	69	32.7 Å²	32.7	48%	0.483	17%	0.169	S	C	.	.	H	α-helix	trans	-59.3	-46.1	176.6	-178.5	0	0	0	0	112.5	R825 M831 Q832 S833	R825-S829 WeakPolarHBondContact O-CB 3.3Å; R825-S829 PolarHBondContact O-N 2.83Å; S829-M831 PolarHBondContact O-N 3.09Å; S829-Q832 PolarHBondContact O-N 3.25Å; S829-S833 VanDerWaalsContact O-CB 3.29Å; S829-S833 WeakPolarHBondContact O-CB 3.35Å; S829-S833 PolarHBondContact O-N 2.84Å; S829-S833 PolarHBondContact O-OG 3.42Å
830	H	80.8	Confident	80	Confident	20 Å²	20	30.9 Å²	30.9	9%	0.093	16%	0.163	C	C	.	.	H	α-helix	trans	-61.1	-43.2	175.4	-80.3	94.7	0	0	0	112.8	V826 L827 Y828 S833 K834	V826-H830 PolarHBondContact O-N 3.25Å; V826-H830 VanDerWaalsContact O-N 3.16Å; V826-H830 PolarHBondContact O-ND1 2.81Å; L827-H830 PolarHBondContact O-N 3.47Å; Y828-H830 PolarHBondContact O-N 2.82Å; H830-S833 PolarHBondContact O-OG 3.13Å; H830-K834 PolarHBondContact O-N 2.83Å; H830-K834 VanDerWaalsContact O-N 3.11Å
831	M	81.9	Confident	78.3	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-66.7	-45.5	179	178.8	51.4	56.3	0	0	112	L827 Y828 S829 G835 I837 T858 Q861 L862 I865	L827-M831 WeakPolarHBondContact O-CB 3.45Å; L827-M831 PolarHBondContact O-N 2.93Å; Y828-M831 PolarHBondContact O-N 3.29Å; S829-M831 PolarHBondContact O-N 3.09Å; M831-G835 VanDerWaalsContact O-CA 3.31Å; M831-G835 WeakPolarHBondContact O-CA 3.04Å; M831-G835 PolarHBondContact O-N 3Å; M831-I837 HydrophobicContact CE-CD1 4.01Å; M831-I837 HydrophobicContact CE-CG1 3.27Å; M831-T858 HydrophobicContact CG-CG2 3.93Å; M831-T858 HydrophobicContact SD-CG2 3.85Å; M831-Q861 HydrophobicContact CE-CB 3.83Å; M831-Q861 HydrophobicContact CE-CG 4.08Å; M831-Q861 HydrophobicContact CG-CB 4.12Å; M831-Q861 HydrophobicContact SD-CB 3.9Å; M831-Q861 HydrophobicContact SD-CG 4.24Å; M831-L862 HydrophobicContact CB-CD2 3.72Å; M831-L862 HydrophobicContact CG-CD2 3.48Å; M831-L862 VanDerWaalsContact CG-CD2 3.48Å; M831-L862 HydrophobicContact CG-CG 3.82Å; M831-I865 HydrophobicContact CB-CD1 4Å; M831-I865 HydrophobicContact CG-CD1 4.31Å
832	Q	79.8	Confident	76.5	Confident	81 Å²	81	35.7 Å²	35.7	38%	0.379	20%	0.202	S	C	.	.	H	α-helix	trans	-68	-43.8	-180	-173.2	-179.2	6.3	0	0	112.3	Y828 S829 L862 D1190	Y828-Q832 WeakPolarHBondContact O-CB 3.18Å; Y828-Q832 PolarHBondContact O-N 3.43Å; S829-Q832 PolarHBondContact O-N 3.25Å; Q832-L862 HydrophobicContact CB-CD2 4.42Å; Q832-D1190 PolarHBondContact NE2-OD2 2.89Å
833	S	77.2	Confident	74.4	Confident	67 Å²	67	38.9 Å²	38.9	47%	0.469	22%	0.215	S	C	.	.	H	α-helix	trans	-74.5	-38.5	-175.5	58.8	0	0	0	0	113.7	S829 H830	S829-S833 VanDerWaalsContact O-CB 3.29Å; S829-S833 WeakPolarHBondContact O-CB 3.35Å; S829-S833 PolarHBondContact O-N 2.84Å; S829-S833 PolarHBondContact O-OG 3.42Å; H830-S833 PolarHBondContact O-OG 3.13Å
834	K	65.9	Low	72.1	Confident	52 Å²	52	47.7 Å²	47.7	23%	0.226	25%	0.254	C	S	.	.	H	α-helix	trans	-122.5	-20.2	-168.1	-64.1	169.1	-165.1	175.3	0	114.6	H830 V836 D1151 L1154 L1158	H830-K834 PolarHBondContact O-N 2.83Å; H830-K834 VanDerWaalsContact O-N 3.11Å; K834-V836 HydrophobicContact CB-CG2 4.44Å; K834-D1151 IonicContact NZ-OD1 2.71Å; K834-D1151 PolarHBondContact NZ-OD1 3.04Å; K834-L1154 HydrophobicContact CD-CD2 3.77Å; K834-L1158 HydrophobicContact CD-CD1 4.39Å
835	G	68.9	Low	69.8	Low	13 Å²	13	52.4 Å²	52.4	13%	0.134	28%	0.279	C	S	.	.	S	Bend	trans	74.6	26.8	-179.7	0	0	0	0	0	114.4	M831 L855	M831-G835 VanDerWaalsContact O-CA 3.31Å; M831-G835 WeakPolarHBondContact O-CA 3.04Å; M831-G835 PolarHBondContact O-N 3Å; G835-L855 PolarHBondContact O-N 3.42Å; G835-L855 VanDerWaalsContact O-N 3.17Å
836	V	68.3	Low	68	Low	6 Å²	6	56.5 Å²	56.5	4%	0.036	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.3	-170.8	-175.5	0	0	0	0	110.1	K834 C852 T854 L1158	K834-V836 HydrophobicContact CB-CG2 4.44Å; V836-C852 HydrophobicContact CG1-CB 3.5Å; V836-C852 VanDerWaalsContact CG1-CB 3.5Å; V836-T854 HydrophobicContact CG2-CG2 4.21Å; V836-L1158 HydrophobicContact CG2-CD2 4.38Å
837	I	67.1	Low	66	Low	12 Å²	12	64 Å²	64	6%	0.062	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	130.7	166.7	-62.4	-169.7	0	0	0	109.6	M831 R853 L855 F872 H874	M831-I837 HydrophobicContact CE-CD1 4.01Å; M831-I837 HydrophobicContact CE-CG1 3.27Å; I837-R853 PolarHBondContact N-O 3.48Å; I837-R853 PolarHBondContact O-N 3.05Å; I837-L855 HydrophobicContact CD1-CD1 3.46Å; I837-L855 VanDerWaalsContact CD1-CD1 3.46Å; I837-L855 HydrophobicContact CG1-CD1 3.77Å; I837-F872 HydrophobicContact CD1-CD1 3.58Å; I837-F872 HydrophobicContact CD1-CE1 3.2Å; I837-F872 HydrophobicContact CD1-CG 4.39Å; I837-F872 HydrophobicContact CD1-CZ 3.74Å; I837-H874 VanDerWaalsContact CG2-NE2 3.3Å; I837-H874 WeakPolarHBondContact CG2-NE2 3.46Å
838	L	66	Low	63.9	Low	3 Å²	3	66.6 Å²	66.6	2%	0.016	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	135.6	171.1	-57.5	179.7	0	0	0	109.5	W1146 I1147 L1154	L838-W1146 HydrophobicContact CB-CE3 4.23Å; L838-W1146 HydrophobicContact CB-CZ3 3.77Å; L838-W1146 WeakPolarHBondContact O-CZ3 3.5Å; L838-I1147 HydrophobicContact CD1-CG2 4.41Å; L838-I1147 VanDerWaalsContact CD1-O 3.26Å; L838-I1147 WeakPolarHBondContact CD1-O 3.34Å; L838-L1154 HydrophobicContact CD2-CD1 3.48Å; L838-L1154 VanDerWaalsContact CD2-CD1 3.48Å; L838-L1154 HydrophobicContact CD2-CD2 3.73Å; L838-L1154 HydrophobicContact CD2-CG 4.28Å
839	T	64.2	Low	61.9	Low	11 Å²	11	71 Å²	71	7%	0.067	38%	0.38	C	S	.	.			trans	-128.8	146.7	171.5	55.4	0	0	0	0	109.2	G841 G851 R853	T839-G841 PolarHBondContact O-N 3.45Å; T839-G841 VanDerWaalsContact O-N 3.11Å; T839-G851 PolarHBondContact N-O 3.41Å; T839-G851 VanDerWaalsContact O-O 3.13Å; T839-G851 WeakPolarHBondContact OG1-CA 3.36Å; T839-G851 PolarHBondContact OG1-N 2.7Å; T839-G851 PolarHBondContact OG1-O 3.41Å; T839-R853 HydrophobicContact CG2-CG 4.01Å
840	D	58.9	Low	59.7	Low	70 Å²	70	69.8 Å²	69.8	37%	0.374	38%	0.379	S	S	.	.			trans	-54	-34.2	-176.8	175.1	62.1	0	0	0	112.9	S842 W1146	D840-S842 WeakPolarHBondContact OD2-CB 3.22Å; D840-S842 PolarHBondContact OD2-N 3.11Å; D840-S842 PolarHBondContact OD2-OG 3.4Å; D840-W1146 HydrophobicContact CB-CD2 4.15Å; D840-W1146 HydrophobicContact CB-CZ2 4.07Å; D840-W1146 VanDerWaalsContact OD1-CD1 3.25Å; D840-W1146 PolarHBondContact OD1-NE1 3.19Å
841	G	56.2	Low	58.7	Low	26 Å²	26	69.5 Å²	69.5	27%	0.268	38%	0.381	S	S	.	.	S	Bend	trans	89.8	1.2	176.2	0	0	0	0	0	114.2	T839 E843	T839-G841 PolarHBondContact O-N 3.45Å; T839-G841 VanDerWaalsContact O-N 3.11Å; G841-E843 VanDerWaalsContact C-N 3.3Å
842	S	53.8	Low	57.5	Low	87 Å²	87	71.4 Å²	71.4	61%	0.608	39%	0.394	S	S	*	.			trans	-62.3	-30.4	168.5	44.6	0	0	0	0	113.7	D840 K844	D840-S842 WeakPolarHBondContact OD2-CB 3.22Å; D840-S842 PolarHBondContact OD2-N 3.11Å; D840-S842 PolarHBondContact OD2-OG 3.4Å; S842-K844 VanDerWaalsContact C-N 3.27Å; S842-K844 PolarHBondContact O-N 2.81Å
843	E	48.7	Very low	56.6	Low	120 Å²	120	73.6 Å²	73.6	56%	0.561	40%	0.399	S	S	*	.			trans	-63.1	84	168.8	-80.7	-164.8	126.9	0	0	111.6	G841 D845 R853	G841-E843 VanDerWaalsContact C-N 3.3Å; E843-D845 PolarHBondContact O-N 3.01Å; E843-R853 IonicContact OE1-NH2 2.68Å; E843-R853 IonicContact OE2-CZ 2.79Å; E843-R853 IonicContact OE2-NH2 2.88Å; E843-R853 PolarHBondContact OE2-NH2 3.16Å
844	K	41.1	Very low	55.8	Low	184 Å²	184	74.8 Å²	74.8	80%	0.8	40%	0.404	S	S	*	.			trans	-75.6	72.6	165.3	-71.8	179.5	-178.6	170.2	0	110	S842	S842-K844 VanDerWaalsContact C-N 3.27Å; S842-K844 PolarHBondContact O-N 2.81Å
845	D	46.2	Very low	55.6	Low	101 Å²	101	75 Å²	75	54%	0.54	41%	0.406	S	S	.	.			trans	-46.8	147.7	158.1	-176.8	22.3	0	0	0	109.2	E843 K847 G848	E843-D845 PolarHBondContact O-N 3.01Å; D845-K847 PolarHBondContact O-N 2.84Å; D845-G848 PolarHBondContact O-N 3.4Å
846	K	51.4	Low	55.1	Low	211 Å²	211	83 Å²	83	92%	0.917	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	16.2	-160.3	-65.9	175.8	-179.8	169.7	0	115.2
847	K	47.9	Very low	55.5	Low	179 Å²	179	86 Å²	86	78%	0.778	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.6	7.8	177.6	-66.5	168.6	-172.5	148.1	0	113.5	D845	D845-K847 PolarHBondContact O-N 2.84Å
848	G	42.4	Very low	56.1	Low	65 Å²	65	85.8 Å²	85.8	67%	0.67	46%	0.458	S	S	*	.			trans	73.1	44.1	172.5	0	0	0	0	0	114.9	D845	D845-G848 PolarHBondContact O-N 3.4Å
849	K	46.9	Very low	57	Low	112 Å²	112	87 Å²	87	49%	0.487	46%	0.464	S	S	.	.			trans	-120.6	70.9	-173.3	-74.6	-177.4	148.3	-72.8	0	112.6	E1161 F1165	K849-E1161 IonicContact NZ-OE1 3.82Å; K849-E1161 PolarHBondContact NZ-OE1 2.7Å; K849-F1165 VanDerWaalsContact NZ-CZ 3.29Å
850	G	40.5	Very low	58	Low	45 Å²	45	90 Å²	90	46%	0.464	48%	0.478	S	S	.	.			trans	-112.8	138.1	175.4	0	0	0	0	0	112.1
851	G	58.5	Low	59.4	Low	14 Å²	14	87.8 Å²	87.8	14%	0.144	47%	0.465	C	S	.	.	S	Bend	trans	145.2	-49.6	172	0	0	0	0	0	114.3	T839	T839-G851 PolarHBondContact N-O 3.41Å; T839-G851 VanDerWaalsContact O-O 3.13Å; T839-G851 WeakPolarHBondContact OG1-CA 3.36Å; T839-G851 PolarHBondContact OG1-N 2.7Å; T839-G851 PolarHBondContact OG1-O 3.41Å
852	C	57.7	Low	61	Low	40 Å²	40	86.7 Å²	86.7	27%	0.27	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.2	-173.6	-81.5	0	0	0	0	112	V836	V836-C852 HydrophobicContact CG1-CB 3.5Å; V836-C852 VanDerWaalsContact CG1-CB 3.5Å
853	R	61.3	Low	62.8	Low	127 Å²	127	83.2 Å²	83.2	48%	0.479	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	104.6	168.5	-68.3	-173.2	-177.5	-159.7	6	110	I837 T839 E843	I837-R853 PolarHBondContact N-O 3.48Å; I837-R853 PolarHBondContact O-N 3.05Å; T839-R853 HydrophobicContact CG2-CG 4.01Å; E843-R853 IonicContact OE1-NH2 2.68Å; E843-R853 IonicContact OE2-CZ 2.79Å; E843-R853 IonicContact OE2-NH2 2.88Å; E843-R853 PolarHBondContact OE2-NH2 3.16Å
854	T	60.8	Low	64.8	Low	93 Å²	93	80.2 Å²	80.2	57%	0.571	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	134.4	176.3	-46.1	0	0	0	0	111	V836	V836-T854 HydrophobicContact CG2-CG2 4.21Å
855	L	61.6	Low	67.2	Low	55 Å²	55	71.6 Å²	71.6	29%	0.288	38%	0.375	S	S	.	.			trans	-128.6	129.6	-172.9	-63.4	176.1	0	0	0	112.5	G835 I837 N857 Q861	G835-L855 PolarHBondContact O-N 3.42Å; G835-L855 VanDerWaalsContact O-N 3.17Å; I837-L855 HydrophobicContact CD1-CD1 3.46Å; I837-L855 VanDerWaalsContact CD1-CD1 3.46Å; I837-L855 HydrophobicContact CG1-CD1 3.77Å; L855-N857 PolarHBondContact O-N 3.16Å; L855-N857 VanDerWaalsContact O-N 3.09Å; L855-Q861 HydrophobicContact CB-CG 4.37Å; L855-Q861 HydrophobicContact CD1-CG 3.81Å
856	M	57.6	Low	69.5	Low	181 Å²	181	66.8 Å²	66.8	89%	0.892	35%	0.349	S	S	*	.	S	Bend	trans	-84.3	36	-176.5	-57.9	179.4	175	0	0	113.7
857	N	76.7	Confident	71.5	Confident	71 Å²	71	56.8 Å²	56.8	38%	0.38	31%	0.306	S	S	.	.			trans	-160.6	62.1	177.1	-165.6	-21.3	0	0	0	110.5	L855 I859 M860 Q861 E1182	L855-N857 PolarHBondContact O-N 3.16Å; L855-N857 VanDerWaalsContact O-N 3.09Å; N857-I859 PolarHBondContact O-N 2.99Å; N857-M860 HydrophobicContact CB-CB 4.34Å; N857-M860 PolarHBondContact O-N 3.16Å; N857-M860 VanDerWaalsContact O-N 3.13Å; N857-M860 VanDerWaalsContact OD1-CB 3.28Å; N857-M860 WeakPolarHBondContact OD1-CB 3.21Å; N857-M860 PolarHBondContact OD1-N 2.77Å; N857-M860 VanDerWaalsContact OD1-N 3.16Å; N857-Q861 WeakPolarHBondContact O-CG 3.18Å; N857-Q861 PolarHBondContact O-N 3.43Å; N857-E1182 WeakPolarHBondContact CA-OE1 2.92Å; N857-E1182 PolarHBondContact N-OE1 3.42Å
858	T	80.3	Confident	73.7	Confident	6 Å²	6	48.2 Å²	48.2	4%	0.037	27%	0.269	C	S	.	.	H	α-helix	trans	-49.7	-43.8	-178.1	-58.5	0	0	0	0	111.3	M831 M860 Q861 L862 E1182 L1186	M831-T858 HydrophobicContact CG-CG2 3.93Å; M831-T858 HydrophobicContact SD-CG2 3.85Å; T858-M860 PolarHBondContact O-N 2.62Å; T858-Q861 PolarHBondContact O-N 3.42Å; T858-Q861 VanDerWaalsContact O-N 3.1Å; T858-L862 HydrophobicContact CG2-CD1 3.9Å; T858-L862 HydrophobicContact CG2-CG 4.1Å; T858-L862 WeakPolarHBondContact O-CG 3.33Å; T858-L862 PolarHBondContact O-N 3.03Å; T858-E1182 PolarHBondContact N-OE1 3.34Å; T858-L1186 HydrophobicContact CG2-CD1 3.95Å; T858-L1186 HydrophobicContact CG2-CD2 4.31Å
859	I	85	Confident	76.1	Confident	30 Å²	30	45.1 Å²	45.1	15%	0.154	24%	0.237	C	C	.	.	H	α-helix	trans	-58.1	-44.9	-177.9	-53.7	160.2	0	0	0	111.6	N857 Q861 R863 W1010 V1042 F1185 L1186	N857-I859 PolarHBondContact O-N 2.99Å; I859-Q861 VanDerWaalsContact C-N 3.34Å; I859-R863 WeakPolarHBondContact O-CG 3.4Å; I859-R863 PolarHBondContact O-N 3.28Å; I859-R863 VanDerWaalsContact O-N 3.09Å; I859-W1010 HydrophobicContact CG2-CH2 4.07Å; I859-W1010 HydrophobicContact CG2-CZ2 3.67Å; I859-V1042 HydrophobicContact CG2-CG2 4.19Å; I859-F1185 HydrophobicContact CD1-CD1 3.83Å; I859-F1185 HydrophobicContact CD1-CE1 3.39Å; I859-F1185 HydrophobicContact CD1-CZ 4.31Å; I859-F1185 HydrophobicContact CG1-CE1 4.4Å; I859-L1186 HydrophobicContact CG1-CD2 4.42Å
860	M	85.3	Confident	78.2	Confident	73 Å²	73	40.1 Å²	40.1	36%	0.36	22%	0.215	S	C	.	.	H	α-helix	trans	-67.2	-36.8	178.7	-171.7	63.1	71	0	0	111.7	N857 T858 R863 K864 M937	N857-M860 HydrophobicContact CB-CB 4.34Å; N857-M860 PolarHBondContact O-N 3.16Å; N857-M860 VanDerWaalsContact O-N 3.13Å; N857-M860 VanDerWaalsContact OD1-CB 3.28Å; N857-M860 WeakPolarHBondContact OD1-CB 3.21Å; N857-M860 PolarHBondContact OD1-N 2.77Å; N857-M860 VanDerWaalsContact OD1-N 3.16Å; T858-M860 PolarHBondContact O-N 2.62Å; M860-R863 PolarHBondContact O-N 2.71Å; M860-K864 PolarHBondContact O-N 3.34Å; M860-M937 HydrophobicContact SD-CE 3.86Å
861	Q	86.9	Confident	80.6	Confident	23 Å²	23	38.5 Å²	38.5	11%	0.107	20%	0.195	C	C	.	.	H	α-helix	trans	-72	-40.8	178.2	-45.8	-48.3	-22	0	0	111.7	M831 L855 N857 T858 I859 R863 K864 I865 F872	M831-Q861 HydrophobicContact CE-CB 3.83Å; M831-Q861 HydrophobicContact CE-CG 4.08Å; M831-Q861 HydrophobicContact CG-CB 4.12Å; M831-Q861 HydrophobicContact SD-CB 3.9Å; M831-Q861 HydrophobicContact SD-CG 4.24Å; L855-Q861 HydrophobicContact CB-CG 4.37Å; L855-Q861 HydrophobicContact CD1-CG 3.81Å; N857-Q861 WeakPolarHBondContact O-CG 3.18Å; N857-Q861 PolarHBondContact O-N 3.43Å; T858-Q861 PolarHBondContact O-N 3.42Å; T858-Q861 VanDerWaalsContact O-N 3.1Å; I859-Q861 VanDerWaalsContact C-N 3.34Å; Q861-R863 VanDerWaalsContact C-N 3.32Å; Q861-R863 PolarHBondContact O-N 3.01Å; Q861-K864 WeakPolarHBondContact O-CB 3.26Å; Q861-K864 PolarHBondContact O-N 3.05Å; Q861-K864 VanDerWaalsContact O-N 3.1Å; Q861-I865 VanDerWaalsContact O-CG1 3.31Å; Q861-I865 WeakPolarHBondContact O-CG1 3.35Å; Q861-I865 PolarHBondContact O-N 2.88Å; Q861-F872 HydrophobicContact CB-CZ 4.17Å
862	L	90	Very high	82	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-57.3	-44.6	172.7	-67	175.6	0	0	0	111.1	Y828 M831 Q832 T858 K864 I865 C866 V1042	Y828-L862 HydrophobicContact CD1-CD2 4.13Å; Y828-L862 HydrophobicContact CD2-CB 4.36Å; Y828-L862 HydrophobicContact CD2-CD2 3.61Å; Y828-L862 HydrophobicContact CE1-CD2 4.15Å; Y828-L862 HydrophobicContact CE2-CB 3.89Å; Y828-L862 HydrophobicContact CE2-CD1 4.41Å; Y828-L862 HydrophobicContact CE2-CD2 3.63Å; Y828-L862 HydrophobicContact CE2-CG 4.16Å; Y828-L862 HydrophobicContact CG-CD2 3.84Å; M831-L862 HydrophobicContact CB-CD2 3.72Å; M831-L862 HydrophobicContact CG-CD2 3.48Å; M831-L862 VanDerWaalsContact CG-CD2 3.48Å; M831-L862 HydrophobicContact CG-CG 3.82Å; Q832-L862 HydrophobicContact CB-CD2 4.42Å; T858-L862 HydrophobicContact CG2-CD1 3.9Å; T858-L862 HydrophobicContact CG2-CG 4.1Å; T858-L862 WeakPolarHBondContact O-CG 3.33Å; T858-L862 PolarHBondContact O-N 3.03Å; L862-K864 PolarHBondContact O-N 3.32Å; L862-I865 PolarHBondContact O-N 2.74Å; L862-C866 PolarHBondContact O-N 2.68Å; L862-C866 PolarHBondContact O-SG 2.64Å; L862-V1042 HydrophobicContact CB-CB 4.35Å; L862-V1042 HydrophobicContact CB-CG1 3.81Å; L862-V1042 HydrophobicContact CD1-CB 4.48Å
863	R	91.4	Very high	83.3	Confident	14 Å²	14	40.3 Å²	40.3	5%	0.053	20%	0.203	C	C	.	.	H	α-helix	trans	-62.9	-37.8	173.8	-69.4	-179.8	84	-129.1	4.2	113	I859 M860 Q861 N867 M937 S1008 V1042 I1046	I859-R863 WeakPolarHBondContact O-CG 3.4Å; I859-R863 PolarHBondContact O-N 3.28Å; I859-R863 VanDerWaalsContact O-N 3.09Å; M860-R863 PolarHBondContact O-N 2.71Å; Q861-R863 VanDerWaalsContact C-N 3.32Å; Q861-R863 PolarHBondContact O-N 3.01Å; R863-N867 WeakPolarHBondContact O-CB 3.45Å; R863-N867 PolarHBondContact O-N 3.19Å; R863-N867 VanDerWaalsContact O-N 3.08Å; R863-M937 HydrophobicContact CB-CE 3.71Å; R863-S1008 PolarHBondContact NH2-O 2.9Å; R863-V1042 HydrophobicContact CG-CG1 3.83Å; R863-I1046 HydrophobicContact CG-CD1 3.92Å
864	K	91.9	Very high	84.3	Confident	56 Å²	56	37.2 Å²	37.2	24%	0.243	19%	0.194	C	C	.	.	H	α-helix	trans	-60.6	-46.3	172.3	-78	-173.7	177.5	-171.7	0	111.3	M860 Q861 L862 N867 H868 M871 F872 M937	M860-K864 PolarHBondContact O-N 3.34Å; Q861-K864 WeakPolarHBondContact O-CB 3.26Å; Q861-K864 PolarHBondContact O-N 3.05Å; Q861-K864 VanDerWaalsContact O-N 3.1Å; L862-K864 PolarHBondContact O-N 3.32Å; K864-N867 PolarHBondContact O-N 2.83Å; K864-H868 CarbonylContact O-C 3.58Å; K864-H868 PolarHBondContact O-N 2.88Å; K864-M871 HydrophobicContact CB-CB 4.03Å; K864-M871 HydrophobicContact CD-CB 4.22Å; K864-M871 HydrophobicContact CG-CB 4.23Å; K864-M871 HydrophobicContact CG-CE 4.07Å; K864-F872 HydrophobicContact CB-CE2 3.69Å; K864-F872 HydrophobicContact CB-CZ 3.63Å; K864-F872 HydrophobicContact CD-CE1 3.84Å; K864-F872 HydrophobicContact CD-CE2 4.26Å; K864-F872 HydrophobicContact CD-CZ 3.59Å; K864-F872 HydrophobicContact CG-CZ 4.27Å; K864-M937 HydrophobicContact CG-CE 4.17Å; K864-M937 HydrophobicContact CG-SD 3.75Å
865	I	92	Very high	85.5	Confident	4 Å²	4	32.8 Å²	32.8	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-47.2	179.4	-63.4	162	0	0	0	111	Q824 L827 M831 Q861 L862 N867 F872	Q824-I865 HydrophobicContact CB-CG2 4.09Å; Q824-I865 HydrophobicContact CG-CG2 4.36Å; Q824-I865 PolarHBondContact NE2-O 2.84Å; Q824-I865 WeakPolarHBondContact O-CG2 3.35Å; L827-I865 HydrophobicContact CB-CD1 4.03Å; L827-I865 HydrophobicContact CB-CG1 4.29Å; L827-I865 HydrophobicContact CB-CG2 4.11Å; M831-I865 HydrophobicContact CB-CD1 4Å; M831-I865 HydrophobicContact CG-CD1 4.31Å; Q861-I865 VanDerWaalsContact O-CG1 3.31Å; Q861-I865 WeakPolarHBondContact O-CG1 3.35Å; Q861-I865 PolarHBondContact O-N 2.88Å; L862-I865 PolarHBondContact O-N 2.74Å; I865-N867 VanDerWaalsContact C-N 3.27Å; I865-N867 PolarHBondContact O-N 3.49Å; I865-F872 HydrophobicContact CG1-CE2 3.79Å; I865-F872 HydrophobicContact CG1-CZ 4.47Å
866	C	93.2	Very high	86.8	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.6	-36.4	177.5	-61.9	0	0	0	0	112.3	Q824 L862 S1038 E1043	Q824-C866 PolarHBondContact NE2-O 2.89Å; Q824-C866 VanDerWaalsContact NE2-O 3.13Å; L862-C866 PolarHBondContact O-N 2.68Å; L862-C866 PolarHBondContact O-SG 2.64Å; C866-S1038 WeakPolarHBondContact CB-OG 3.17Å; C866-S1038 PolarHBondContact O-OG 2.79Å; C866-E1043 HydrophobicContact CB-CG 3.98Å
867	N	93.9	Very high	88.1	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-71.4	-63.5	175.6	-79.8	-14.9	0	0	0	112.3	R863 K864 I865 S911 K913 L940 F1006 D1007	R863-N867 WeakPolarHBondContact O-CB 3.45Å; R863-N867 PolarHBondContact O-N 3.19Å; R863-N867 VanDerWaalsContact O-N 3.08Å; K864-N867 PolarHBondContact O-N 2.83Å; I865-N867 VanDerWaalsContact C-N 3.27Å; I865-N867 PolarHBondContact O-N 3.49Å; N867-S911 PolarHBondContact O-OG 2.9Å; N867-K913 PolarHBondContact OD1-NZ 3.15Å; N867-L940 HydrophobicContact CB-CD1 4.22Å; N867-L940 HydrophobicContact CB-CD2 4.06Å; N867-F1006 HydrophobicContact CB-CE1 4.01Å; N867-D1007 PolarHBondContact ND2-OD2 3.11Å; N867-D1007 WeakPolarHBondContact OD1-CB 3.44Å
868	H	94.1	Very high	88.4	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.126	C	C	.	.			trans	-161.6	132.8	175.7	-155.5	-80.3	0	0	0	112.5	K864 F870 M871 L907 S911 F914 L940 I943	K864-H868 CarbonylContact O-C 3.58Å; K864-H868 PolarHBondContact O-N 2.88Å; H868-F870 VanDerWaalsContact C-N 3.26Å; H868-F870 AromaticContact CE1-CD1 3.41Å; H868-F870 VanDerWaalsContact CE1-CD1 3.41Å; H868-F870 WeakPolarHBondContact CE1-CD1 3.46Å; H868-F870 AromaticContact CE1-CD2 2.44Å; H868-F870 WeakPolarHBondContact CE1-CD2 3.4Å; H868-F870 AromaticContact CE1-CE1 3.54Å; H868-F870 AromaticContact CE1-CE2 2.59Å; H868-F870 WeakPolarHBondContact CE1-CE2 3.37Å; H868-F870 AromaticContact CE1-CG 2.86Å; H868-F870 WeakPolarHBondContact CE1-CG 3.41Å; H868-F870 AromaticContact CE1-CZ 3.15Å; H868-F870 WeakPolarHBondContact CE1-CZ 3.25Å; H868-F870 WeakPolarHBondContact ND1-CB 3.13Å; H868-F870 AromaticContact ND1-CD2 3.78Å; H868-F870 AromaticContact ND1-CG 3.57Å; H868-F870 PolarHBondContact ND1-N 3.44Å; H868-F870 PolarHBondContact O-N 2.67Å; H868-M871 HydrophobicContact CB-CG 4.13Å; H868-M871 WeakPolarHBondContact O-CB 3.36Å; H868-M871 WeakPolarHBondContact O-CG 3.39Å; H868-M871 PolarHBondContact O-N 2.71Å; H868-M871 VanDerWaalsContact O-N 3.14Å; H868-L907 PolarHBondContact NE2-O 3.05Å; H868-S911 WeakPolarHBondContact CD2-CB 3.41Å; H868-F914 HydrophobicContact CB-CE2 4.22Å; H868-F914 AromaticContact CD2-CD2 3.48Å; H868-F914 VanDerWaalsContact CD2-CD2 3.48Å; H868-F914 WeakPolarHBondContact CD2-CD2 3.2Å; H868-F914 AromaticContact CD2-CE2 3.47Å; H868-F914 VanDerWaalsContact CD2-CE2 3.47Å; H868-F914 WeakPolarHBondContact CD2-CE2 3.37Å; H868-F914 AromaticContact CD2-CG 3.99Å; H868-F914 AromaticContact CD2-CZ 3.98Å; H868-L940 HydrophobicContact CB-CD1 4.26Å; H868-I943 HydrophobicContact CB-CD1 4.1Å
869	P	92.3	Very high	88.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-62.9	-26.7	178.5	24.8	-34.1	0	0	0	114	L823 Q824 L827 M871 F872 S910	L823-P869 HydrophobicContact CD2-CB 3.83Å; L823-P869 HydrophobicContact CD2-CG 3.73Å; L823-P869 HydrophobicContact CG-CB 4.01Å; L823-P869 HydrophobicContact CG-CG 4.2Å; Q824-P869 HydrophobicContact CG-CG 4.44Å; L827-P869 HydrophobicContact CD1-CB 4.05Å; P869-M871 PolarHBondContact O-N 2.78Å; P869-F872 PolarHBondContact O-N 2.78Å; P869-S910 WeakPolarHBondContact CD-O 3.27Å; P869-S910 WeakPolarHBondContact CG-O 3.22Å
870	F	92.3	Very high	88.6	Confident	6 Å²	6	23.2 Å²	23.2	3%	0.026	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-75.4	0.8	178.3	-54.2	-15.2	0	0	0	113.2	L823 H868 F872 E876 I879 V902 I906 L907 S910 I943	L823-F870 HydrophobicContact CD2-CE1 4.33Å; H868-F870 VanDerWaalsContact C-N 3.26Å; H868-F870 AromaticContact CE1-CD1 3.41Å; H868-F870 VanDerWaalsContact CE1-CD1 3.41Å; H868-F870 WeakPolarHBondContact CE1-CD1 3.46Å; H868-F870 AromaticContact CE1-CD2 2.44Å; H868-F870 WeakPolarHBondContact CE1-CD2 3.4Å; H868-F870 AromaticContact CE1-CE1 3.54Å; H868-F870 AromaticContact CE1-CE2 2.59Å; H868-F870 WeakPolarHBondContact CE1-CE2 3.37Å; H868-F870 AromaticContact CE1-CG 2.86Å; H868-F870 WeakPolarHBondContact CE1-CG 3.41Å; H868-F870 AromaticContact CE1-CZ 3.15Å; H868-F870 WeakPolarHBondContact CE1-CZ 3.25Å; H868-F870 WeakPolarHBondContact ND1-CB 3.13Å; H868-F870 AromaticContact ND1-CD2 3.78Å; H868-F870 AromaticContact ND1-CG 3.57Å; H868-F870 PolarHBondContact ND1-N 3.44Å; H868-F870 PolarHBondContact O-N 2.67Å; F870-F872 PolarHBondContact O-N 3.23Å; F870-E876 HydrophobicContact CB-CB 3.78Å; F870-E876 HydrophobicContact CB-CG 3.93Å; F870-E876 HydrophobicContact CD1-CB 3.84Å; F870-E876 HydrophobicContact CD1-CG 4.11Å; F870-E876 HydrophobicContact CD2-CB 4.48Å; F870-E876 HydrophobicContact CD2-CG 3.91Å; F870-E876 HydrophobicContact CG-CB 3.77Å; F870-E876 HydrophobicContact CG-CG 3.7Å; F870-I879 HydrophobicContact CE1-CB 4.15Å; F870-I879 HydrophobicContact CE1-CG1 4.22Å; F870-I879 HydrophobicContact CE1-CG2 4.13Å; F870-I879 HydrophobicContact CZ-CB 4.47Å; F870-I879 HydrophobicContact CZ-CG2 3.99Å; F870-V902 HydrophobicContact CD2-CB 4Å; F870-V902 HydrophobicContact CD2-CG2 4.33Å; F870-V902 HydrophobicContact CE1-CG2 4.42Å; F870-V902 HydrophobicContact CE2-CB 3.4Å; F870-V902 HydrophobicContact CE2-CG1 3.54Å; F870-V902 HydrophobicContact CE2-CG2 3.77Å; F870-V902 HydrophobicContact CZ-CB 3.93Å; F870-V902 HydrophobicContact CZ-CG1 3.86Å; F870-V902 HydrophobicContact CZ-CG2 3.83Å; F870-I906 HydrophobicContact CZ-CG2 4.21Å; F870-L907 HydrophobicContact CD2-CD1 3.9Å; F870-L907 HydrophobicContact CE2-CD1 4.08Å; F870-S910 WeakPolarHBondContact CZ-OG 3.09Å; F870-I943 HydrophobicContact CB-CD1 4.31Å
871	M	90	Very high	88.3	Confident	12 Å²	12	24.6 Å²	24.6	6%	0.059	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-61.2	-4	160.8	-64.7	-75.9	-82.8	0	0	113.4	K864 H868 P869 M937 S939 L940 I943	K864-M871 HydrophobicContact CB-CB 4.03Å; K864-M871 HydrophobicContact CD-CB 4.22Å; K864-M871 HydrophobicContact CG-CB 4.23Å; K864-M871 HydrophobicContact CG-CE 4.07Å; H868-M871 HydrophobicContact CB-CG 4.13Å; H868-M871 WeakPolarHBondContact O-CB 3.36Å; H868-M871 WeakPolarHBondContact O-CG 3.39Å; H868-M871 PolarHBondContact O-N 2.71Å; H868-M871 VanDerWaalsContact O-N 3.14Å; P869-M871 PolarHBondContact O-N 2.78Å; M871-M937 HydrophobicContact CE-CB 3.72Å; M871-M937 HydrophobicContact CE-CG 4.15Å; M871-M937 HydrophobicContact CE-SD 3.33Å; M871-M937 WeakPolarHBondContact CE-SD 3.3Å; M871-S939 WeakPolarHBondContact CE-OG 3.25Å; M871-S939 PolarHBondContact SD-OG 2.9Å; M871-L940 HydrophobicContact CE-CB 3.91Å; M871-L940 HydrophobicContact SD-CB 3.79Å; M871-L940 PolarHBondContact SD-N 3.44Å; M871-L940 VanDerWaalsContact SD-N 3.38Å; M871-I943 HydrophobicContact CG-CD1 3.86Å; M871-I943 HydrophobicContact SD-CD1 3.71Å
872	F	88.2	Confident	88	Confident	12 Å²	12	26 Å²	26	5%	0.053	13%	0.131	C	C	.	.	S	Bend	trans	-121.1	101.4	169.2	-57.2	-76.5	0	0	0	109.1	I837 Q861 K864 I865 P869 F870 H874 I875 E876	I837-F872 HydrophobicContact CD1-CD1 3.58Å; I837-F872 HydrophobicContact CD1-CE1 3.2Å; I837-F872 HydrophobicContact CD1-CG 4.39Å; I837-F872 HydrophobicContact CD1-CZ 3.74Å; Q861-F872 HydrophobicContact CB-CZ 4.17Å; K864-F872 HydrophobicContact CB-CE2 3.69Å; K864-F872 HydrophobicContact CB-CZ 3.63Å; K864-F872 HydrophobicContact CD-CE1 3.84Å; K864-F872 HydrophobicContact CD-CE2 4.26Å; K864-F872 HydrophobicContact CD-CZ 3.59Å; K864-F872 HydrophobicContact CG-CZ 4.27Å; I865-F872 HydrophobicContact CG1-CE2 3.79Å; I865-F872 HydrophobicContact CG1-CZ 4.47Å; P869-F872 PolarHBondContact O-N 2.78Å; F870-F872 PolarHBondContact O-N 3.23Å; F872-H874 VanDerWaalsContact C-N 3.25Å; F872-H874 PolarHBondContact O-N 3.05Å; F872-H874 VanDerWaalsContact O-N 3.12Å; F872-I875 HydrophobicContact CB-CB 4.29Å; F872-I875 HydrophobicContact CB-CD1 3.71Å; F872-I875 HydrophobicContact CB-CG1 3.77Å; F872-I875 HydrophobicContact CD2-CD1 4.09Å; F872-I875 HydrophobicContact CG-CD1 4.12Å; F872-I875 WeakPolarHBondContact O-CB 3.24Å; F872-I875 PolarHBondContact O-N 2.97Å; F872-E876 PolarHBondContact O-N 3.49Å
873	P	85	Confident	87.4	Confident	80 Å²	80	28.4 Å²	28.4	52%	0.519	14%	0.144	S	C	.	.	H	α-helix	trans	-57.8	-31.5	-172.4	-30.4	36.7	0	0	0	115	I875 E876 M877	P873-I875 PolarHBondContact O-N 2.86Å; P873-E876 PolarHBondContact O-N 2.88Å; P873-M877 WeakPolarHBondContact O-CB 3.48Å; P873-M877 VanDerWaalsContact O-CG 3.28Å; P873-M877 WeakPolarHBondContact O-CG 3.26Å; P873-M877 PolarHBondContact O-N 2.75Å
874	H	82	Confident	86.8	Confident	61 Å²	61	28.8 Å²	28.8	28%	0.282	15%	0.146	S	C	.	.	H	α-helix	trans	-68.2	-19.6	175.7	58.6	-93.1	0	0	0	113.8	I837 F872	I837-H874 VanDerWaalsContact CG2-NE2 3.3Å; I837-H874 WeakPolarHBondContact CG2-NE2 3.46Å; F872-H874 VanDerWaalsContact C-N 3.25Å; F872-H874 PolarHBondContact O-N 3.05Å; F872-H874 VanDerWaalsContact O-N 3.12Å
875	I	86.1	Confident	86	Confident	1 Å²	1	29 Å²	29	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-84.2	-42	172.3	-52.9	-173.9	0	0	0	109.4	L823 L827 F872 P873 A878 I879 I1147	L823-I875 HydrophobicContact CD1-CG2 4.11Å; L823-I875 HydrophobicContact CD2-CG2 4.38Å; L827-I875 HydrophobicContact CD1-CD1 3.6Å; L827-I875 HydrophobicContact CD1-CG2 4.24Å; L827-I875 HydrophobicContact CD2-CD1 3.7Å; L827-I875 HydrophobicContact CG-CD1 4.31Å; F872-I875 HydrophobicContact CB-CB 4.29Å; F872-I875 HydrophobicContact CB-CD1 3.71Å; F872-I875 HydrophobicContact CB-CG1 3.77Å; F872-I875 HydrophobicContact CD2-CD1 4.09Å; F872-I875 HydrophobicContact CG-CD1 4.12Å; F872-I875 WeakPolarHBondContact O-CB 3.24Å; F872-I875 PolarHBondContact O-N 2.97Å; P873-I875 PolarHBondContact O-N 2.86Å; I875-A878 PolarHBondContact O-N 3.11Å; I875-I879 VanDerWaalsContact O-CG1 3.29Å; I875-I879 WeakPolarHBondContact O-CG1 3.42Å; I875-I879 PolarHBondContact O-N 3.05Å; I875-I879 VanDerWaalsContact O-N 3.08Å; I875-I1147 HydrophobicContact CG2-CD1 4.24Å
876	E	88.4	Confident	85.2	Confident	25 Å²	25	33.6 Å²	33.6	12%	0.117	17%	0.174	C	C	.	.	H	α-helix	trans	-57.1	-53.9	173.4	-172.2	176.5	-173	0	0	111.6	F870 F872 P873 A878 I879 A880 Q901 V902	F870-E876 HydrophobicContact CB-CB 3.78Å; F870-E876 HydrophobicContact CB-CG 3.93Å; F870-E876 HydrophobicContact CD1-CB 3.84Å; F870-E876 HydrophobicContact CD1-CG 4.11Å; F870-E876 HydrophobicContact CD2-CB 4.48Å; F870-E876 HydrophobicContact CD2-CG 3.91Å; F870-E876 HydrophobicContact CG-CB 3.77Å; F870-E876 HydrophobicContact CG-CG 3.7Å; F872-E876 PolarHBondContact O-N 3.49Å; P873-E876 PolarHBondContact O-N 2.88Å; E876-A878 VanDerWaalsContact C-N 3.31Å; E876-A878 PolarHBondContact O-N 3.37Å; E876-I879 PolarHBondContact O-N 3.29Å; E876-I879 VanDerWaalsContact O-N 3.12Å; E876-A880 WeakPolarHBondContact O-CB 3.32Å; E876-A880 PolarHBondContact O-N 3.13Å; E876-Q901 VanDerWaalsContact OE1-CA 3.23Å; E876-Q901 WeakPolarHBondContact OE1-CA 3.33Å; E876-V902 HydrophobicContact CG-CB 4.25Å; E876-V902 HydrophobicContact CG-CG2 3.7Å; E876-V902 WeakPolarHBondContact O-CG2 3.24Å; E876-V902 PolarHBondContact OE1-N 2.98Å
877	M	84.7	Confident	84.3	Confident	97 Å²	97	38.3 Å²	38.3	48%	0.478	20%	0.203	S	C	.	.	H	α-helix	trans	-57.2	-40.9	-179.9	-70.6	173	68.6	0	0	112.6	P873 A880 E881	P873-M877 WeakPolarHBondContact O-CB 3.48Å; P873-M877 VanDerWaalsContact O-CG 3.28Å; P873-M877 WeakPolarHBondContact O-CG 3.26Å; P873-M877 PolarHBondContact O-N 2.75Å; M877-A880 PolarHBondContact O-N 2.88Å; M877-E881 WeakPolarHBondContact O-CB 3.03Å; M877-E881 PolarHBondContact O-N 2.81Å
878	A	82.9	Confident	83.3	Confident	13 Å²	13	41.1 Å²	41.1	11%	0.107	22%	0.216	C	C	.	.	H	α-helix	trans	-70.2	-33.9	178.8	0	0	0	0	0	112.9	I875 E876 Q882 P1144 W1146	I875-A878 PolarHBondContact O-N 3.11Å; E876-A878 VanDerWaalsContact C-N 3.31Å; E876-A878 PolarHBondContact O-N 3.37Å; A878-Q882 VanDerWaalsContact O-CB 3.28Å; A878-Q882 WeakPolarHBondContact O-CB 3.16Å; A878-Q882 PolarHBondContact O-N 2.84Å; A878-P1144 HydrophobicContact CB-CG 4.4Å; A878-W1146 HydrophobicContact CB-CZ2 3.61Å
879	I	86.3	Confident	82.1	Confident	3 Å²	3	48 Å²	48	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-72.9	-38.3	173.3	-66.4	-70.5	0	0	0	110.7	L823 F870 I875 E876 N883 V902 I906 M1138 P1144	L823-I879 HydrophobicContact CD2-CD1 4.12Å; L823-I879 HydrophobicContact CD2-CG1 4.11Å; F870-I879 HydrophobicContact CE1-CB 4.15Å; F870-I879 HydrophobicContact CE1-CG1 4.22Å; F870-I879 HydrophobicContact CE1-CG2 4.13Å; F870-I879 HydrophobicContact CZ-CB 4.47Å; F870-I879 HydrophobicContact CZ-CG2 3.99Å; I875-I879 VanDerWaalsContact O-CG1 3.29Å; I875-I879 WeakPolarHBondContact O-CG1 3.42Å; I875-I879 PolarHBondContact O-N 3.05Å; I875-I879 VanDerWaalsContact O-N 3.08Å; E876-I879 PolarHBondContact O-N 3.29Å; E876-I879 VanDerWaalsContact O-N 3.12Å; I879-N883 VanDerWaalsContact O-CB 3.25Å; I879-N883 WeakPolarHBondContact O-CB 3.44Å; I879-N883 PolarHBondContact O-N 2.94Å; I879-V902 HydrophobicContact CB-CG2 4.38Å; I879-V902 HydrophobicContact CG2-CG2 4.11Å; I879-I906 HydrophobicContact CG2-CG2 3.82Å; I879-M1138 HydrophobicContact CD1-CE 4.21Å; I879-M1138 HydrophobicContact CD1-SD 4.15Å; I879-M1138 HydrophobicContact CG2-CE 4.13Å; I879-P1144 HydrophobicContact CD1-CG 3.98Å
880	A	83.2	Confident	80.9	Confident	4 Å²	4	50.3 Å²	50.3	3%	0.033	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-48.3	174.7	0	0	0	0	0	111.6	E876 M877 N883 F884 P899 V902	E876-A880 WeakPolarHBondContact O-CB 3.32Å; E876-A880 PolarHBondContact O-N 3.13Å; M877-A880 PolarHBondContact O-N 2.88Å; A880-N883 PolarHBondContact O-N 2.79Å; A880-F884 VanDerWaalsContact O-CB 3.25Å; A880-F884 WeakPolarHBondContact O-CB 3.22Å; A880-F884 PolarHBondContact O-N 2.67Å; A880-P899 WeakPolarHBondContact CB-O 3Å; A880-V902 HydrophobicContact CB-CG2 3.71Å
881	E	80.7	Confident	79.9	Confident	101 Å²	101	56.3 Å²	56.3	47%	0.472	31%	0.309	S	S	.	.	H	α-helix	trans	-60.7	-49.2	175.5	-178.2	176.5	-163.2	0	0	111.4	M877 N883 F884 L885 V898	M877-E881 WeakPolarHBondContact O-CB 3.03Å; M877-E881 PolarHBondContact O-N 2.81Å; E881-N883 VanDerWaalsContact C-N 3.34Å; E881-N883 PolarHBondContact O-N 2.97Å; E881-F884 PolarHBondContact O-N 2.88Å; E881-L885 HydrophobicContact CG-CD1 3.97Å; E881-L885 HydrophobicContact CG-CG 4.43Å; E881-L885 WeakPolarHBondContact O-CB 3.43Å; E881-L885 VanDerWaalsContact O-CG 3.28Å; E881-L885 WeakPolarHBondContact O-CG 3.37Å; E881-L885 PolarHBondContact O-N 3.01Å; E881-V898 HydrophobicContact CB-CG1 3.94Å; E881-V898 HydrophobicContact CG-CG1 4.1Å
882	Q	78.7	Confident	78.8	Confident	52 Å²	52	57.8 Å²	57.8	24%	0.243	32%	0.319	C	S	.	.	H	α-helix	trans	-62.4	-40	178.6	177.6	154.5	-32.1	0	0	112.2	A878 N886 E1142 L1143	A878-Q882 VanDerWaalsContact O-CB 3.28Å; A878-Q882 WeakPolarHBondContact O-CB 3.16Å; A878-Q882 PolarHBondContact O-N 2.84Å; Q882-N886 WeakPolarHBondContact O-CB 3.36Å; Q882-N886 PolarHBondContact O-N 2.9Å; Q882-N886 PolarHBondContact O-ND2 3.39Å; Q882-E1142 PolarHBondContact NE2-O 3.14Å; Q882-L1143 PolarHBondContact NE2-O 3.32Å
883	N	78.6	Confident	78	Confident	55 Å²	55	59.5 Å²	59.5	29%	0.294	33%	0.332	S	S	.	.	H	α-helix	trans	-65.2	-45.8	174.5	-178.1	41.2	0	0	0	111.8	I879 A880 E881 L885 N886 V887 I906	I879-N883 VanDerWaalsContact O-CB 3.25Å; I879-N883 WeakPolarHBondContact O-CB 3.44Å; I879-N883 PolarHBondContact O-N 2.94Å; A880-N883 PolarHBondContact O-N 2.79Å; E881-N883 VanDerWaalsContact C-N 3.34Å; E881-N883 PolarHBondContact O-N 2.97Å; N883-L885 VanDerWaalsContact C-N 3.34Å; N883-L885 PolarHBondContact O-N 2.87Å; N883-N886 PolarHBondContact O-N 3.46Å; N883-N886 VanDerWaalsContact O-N 3.14Å; N883-V887 WeakPolarHBondContact O-CB 3.21Å; N883-V887 WeakPolarHBondContact O-CG2 3.3Å; N883-V887 PolarHBondContact O-N 3.13Å; N883-I906 HydrophobicContact CB-CD1 3.71Å
884	F	78.4	Confident	77.3	Confident	22 Å²	22	62.2 Å²	62.2	10%	0.096	35%	0.349	C	S	.	.	H	α-helix	trans	-60.1	-42.9	177.9	-177.2	-114.3	0	0	0	111.8	A880 E881 H888 P892 L896 V898 P899	A880-F884 VanDerWaalsContact O-CB 3.25Å; A880-F884 WeakPolarHBondContact O-CB 3.22Å; A880-F884 PolarHBondContact O-N 2.67Å; E881-F884 PolarHBondContact O-N 2.88Å; F884-H888 AromaticContact CD2-CD2 3.68Å; F884-H888 AromaticContact CD2-NE2 3.85Å; F884-H888 AromaticContact CE2-CD2 3.5Å; F884-H888 AromaticContact CE2-NE2 3.37Å; F884-H888 WeakPolarHBondContact CE2-NE2 3.14Å; F884-H888 AromaticContact CZ-CD2 3.88Å; F884-H888 AromaticContact CZ-NE2 3.97Å; F884-H888 WeakPolarHBondContact O-CB 3.43Å; F884-H888 PolarHBondContact O-CD2 3.13Å; F884-H888 VanDerWaalsContact O-CD2 3.27Å; F884-H888 PolarHBondContact O-N 3.48Å; F884-H888 VanDerWaalsContact O-N 3.16Å; F884-P892 HydrophobicContact CD1-CB 4.07Å; F884-P892 HydrophobicContact CE1-CB 3.42Å; F884-P892 VanDerWaalsContact CE1-CB 3.42Å; F884-P892 HydrophobicContact CE1-CG 4.23Å; F884-P892 HydrophobicContact CZ-CB 3.86Å; F884-L896 HydrophobicContact CE2-CB 4.5Å; F884-L896 HydrophobicContact CZ-CB 3.95Å; F884-V898 HydrophobicContact CD1-CB 4.34Å; F884-V898 HydrophobicContact CD1-CG1 4.13Å; F884-V898 HydrophobicContact CD1-CG2 4.11Å; F884-V898 HydrophobicContact CE1-CB 4.45Å; F884-V898 HydrophobicContact CE1-CG2 4.02Å; F884-P899 HydrophobicContact CB-CG 4.43Å; F884-P899 HydrophobicContact CD2-CG 3.9Å; F884-P899 HydrophobicContact CE2-CG 4.41Å; F884-P899 VanDerWaalsContact CG-CD 3.5Å; F884-P899 HydrophobicContact CG-CG 4.26Å
885	L	75.8	Confident	76.9	Confident	61 Å²	61	65.4 Å²	65.4	32%	0.319	37%	0.373	S	S	.	.	H	α-helix	trans	-62.7	-43.9	172.2	-70.5	171.4	0	0	0	112	E881 N883 H888 N889 G890 P892	E881-L885 HydrophobicContact CG-CD1 3.97Å; E881-L885 HydrophobicContact CG-CG 4.43Å; E881-L885 WeakPolarHBondContact O-CB 3.43Å; E881-L885 VanDerWaalsContact O-CG 3.28Å; E881-L885 WeakPolarHBondContact O-CG 3.37Å; E881-L885 PolarHBondContact O-N 3.01Å; N883-L885 VanDerWaalsContact C-N 3.34Å; N883-L885 PolarHBondContact O-N 2.87Å; L885-H888 CarbonylContact O-C 3.6Å; L885-H888 PolarHBondContact O-N 2.81Å; L885-N889 PolarHBondContact O-N 2.95Å; L885-N889 VanDerWaalsContact O-N 3.14Å; L885-G890 PolarHBondContact O-N 3.16Å; L885-P892 HydrophobicContact CD2-CG 4.05Å
886	N	74.4	Confident	76.2	Confident	101 Å²	101	69.7 Å²	69.7	54%	0.54	40%	0.395	S	S	.	.	H	α-helix	trans	-63.8	-47.6	178.5	-75.7	-20.9	0	0	0	112.2	Q882 N883 H888 N889	Q882-N886 WeakPolarHBondContact O-CB 3.36Å; Q882-N886 PolarHBondContact O-N 2.9Å; Q882-N886 PolarHBondContact O-ND2 3.39Å; N883-N886 PolarHBondContact O-N 3.46Å; N883-N886 VanDerWaalsContact O-N 3.14Å; N886-H888 PolarHBondContact O-N 2.92Å; N886-N889 PolarHBondContact O-N 3.3Å; N886-N889 VanDerWaalsContact O-N 3.08Å
887	V	74.2	Confident	75.4	Confident	99 Å²	99	73.6 Å²	73.6	60%	0.6	42%	0.423	S	S	*	.	H	α-helix	trans	-59	-33.6	177.4	168.9	0	0	0	0	111.7	N883	N883-V887 WeakPolarHBondContact O-CB 3.21Å; N883-V887 WeakPolarHBondContact O-CG2 3.3Å; N883-V887 PolarHBondContact O-N 3.13Å
888	H	73	Confident	74.7	Confident	58 Å²	58	72.4 Å²	72.4	27%	0.269	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	15.1	177.4	-68.8	-57.9	0	0	0	114.9	F884 L885 N886 G890 N891 P892	F884-H888 AromaticContact CD2-CD2 3.68Å; F884-H888 AromaticContact CD2-NE2 3.85Å; F884-H888 AromaticContact CE2-CD2 3.5Å; F884-H888 AromaticContact CE2-NE2 3.37Å; F884-H888 WeakPolarHBondContact CE2-NE2 3.14Å; F884-H888 AromaticContact CZ-CD2 3.88Å; F884-H888 AromaticContact CZ-NE2 3.97Å; F884-H888 WeakPolarHBondContact O-CB 3.43Å; F884-H888 PolarHBondContact O-CD2 3.13Å; F884-H888 VanDerWaalsContact O-CD2 3.27Å; F884-H888 PolarHBondContact O-N 3.48Å; F884-H888 VanDerWaalsContact O-N 3.16Å; L885-H888 CarbonylContact O-C 3.6Å; L885-H888 PolarHBondContact O-N 2.81Å; N886-H888 PolarHBondContact O-N 2.92Å; H888-G890 PolarHBondContact O-N 3.41Å; H888-N891 CarbonylContact O-C 3.59Å; H888-N891 PolarHBondContact O-N 3.2Å; H888-P892 HydrophobicContact CB-CB 4.21Å
889	N	68.8	Low	74.1	Confident	146 Å²	146	74.5 Å²	74.5	78%	0.781	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	42.6	-178	-73.3	-34.3	0	0	0	113.1	L885 N886 N891	L885-N889 PolarHBondContact O-N 2.95Å; L885-N889 VanDerWaalsContact O-N 3.14Å; N886-N889 PolarHBondContact O-N 3.3Å; N886-N889 VanDerWaalsContact O-N 3.08Å; N889-N891 PolarHBondContact O-N 3.04Å; N889-N891 PolarHBondContact O-ND2 2.93Å
890	G	67.9	Low	73.3	Confident	48 Å²	48	78.6 Å²	78.6	50%	0.495	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	4.5	-177.7	0	0	0	0	0	115.6	L885 H888 P892	L885-G890 PolarHBondContact O-N 3.16Å; H888-G890 PolarHBondContact O-N 3.41Å; G890-P892 VanDerWaalsContact C-CD 3.48Å; G890-P892 WeakPolarHBondContact O-CD 3.44Å
891	N	69.8	Low	72.8	Confident	132 Å²	132	83.7 Å²	83.7	71%	0.706	48%	0.482	S	S	*	.			trans	-127	65.9	-175.9	-67.6	-89.6	0	0	0	111.4	H888 N889	H888-N891 CarbonylContact O-C 3.59Å; H888-N891 PolarHBondContact O-N 3.2Å; N889-N891 PolarHBondContact O-N 3.04Å; N889-N891 PolarHBondContact O-ND2 2.93Å
892	P	68.7	Low	72.7	Confident	43 Å²	43	79.2 Å²	79.2	28%	0.279	46%	0.461	S	S	.	.			trans	-62.5	144.9	176.8	28	-35.2	0	0	0	111.4	F884 L885 H888 G890	F884-P892 HydrophobicContact CD1-CB 4.07Å; F884-P892 HydrophobicContact CE1-CB 3.42Å; F884-P892 VanDerWaalsContact CE1-CB 3.42Å; F884-P892 HydrophobicContact CE1-CG 4.23Å; F884-P892 HydrophobicContact CZ-CB 3.86Å; L885-P892 HydrophobicContact CD2-CG 4.05Å; H888-P892 HydrophobicContact CB-CB 4.21Å; G890-P892 VanDerWaalsContact C-CD 3.48Å; G890-P892 WeakPolarHBondContact O-CD 3.44Å
893	P	71.2	Confident	72.6	Confident	48 Å²	48	84.8 Å²	84.8	31%	0.312	49%	0.488	S	S	.	.			trans	-59.5	128.1	173.5	-23.9	34.6	0	0	0	110.8	T895 L896	P893-T895 PolarHBondContact O-N 3Å; P893-L896 HydrophobicContact CB-CD1 4.27Å; P893-L896 HydrophobicContact CB-CG 4.44Å; P893-L896 HydrophobicContact CG-CD1 3.97Å; P893-L896 PolarHBondContact O-N 3.18Å
894	P	69	Low	72.7	Confident	136 Å²	136	83 Å²	83	88%	0.883	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	11.8	-176.5	30.7	-37.8	0	0	0	114.1
895	T	74.9	Confident	73.1	Confident	128 Å²	128	85.2 Å²	85.2	79%	0.785	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	-6.7	178.1	46.3	0	0	0	0	112.8	P893	P893-T895 PolarHBondContact O-N 3Å
896	L	70.5	Confident	73.7	Confident	91 Å²	91	83.2 Å²	83.2	48%	0.476	48%	0.481	S	S	.	.	S	Bend	trans	-98.8	131.5	172.7	-74.5	172.6	0	0	0	109.8	F884 P893	F884-L896 HydrophobicContact CE2-CB 4.5Å; F884-L896 HydrophobicContact CZ-CB 3.95Å; P893-L896 HydrophobicContact CB-CD1 4.27Å; P893-L896 HydrophobicContact CB-CG 4.44Å; P893-L896 HydrophobicContact CG-CD1 3.97Å; P893-L896 PolarHBondContact O-N 3.18Å
897	P	72.3	Confident	74.4	Confident	108 Å²	108	78.6 Å²	78.6	70%	0.701	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-65.9	146.6	168.1	30.1	-33.8	0	0	0	109.8
898	V	68.5	Low	75.3	Confident	71 Å²	71	74.6 Å²	74.6	43%	0.43	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-65.4	128.2	169.8	-178	0	0	0	0	107.9	E881 F884 T900	E881-V898 HydrophobicContact CB-CG1 3.94Å; E881-V898 HydrophobicContact CG-CG1 4.1Å; F884-V898 HydrophobicContact CD1-CB 4.34Å; F884-V898 HydrophobicContact CD1-CG1 4.13Å; F884-V898 HydrophobicContact CD1-CG2 4.11Å; F884-V898 HydrophobicContact CE1-CB 4.45Å; F884-V898 HydrophobicContact CE1-CG2 4.02Å; V898-T900 PolarHBondContact O-N 3.04Å
899	P	71.5	Confident	76.2	Confident	57 Å²	57	72.2 Å²	72.2	37%	0.37	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-58.9	129.7	176.1	-23.7	34	0	0	0	111.1	A880 F884	A880-P899 WeakPolarHBondContact CB-O 3Å; F884-P899 HydrophobicContact CB-CG 4.43Å; F884-P899 HydrophobicContact CD2-CG 3.9Å; F884-P899 HydrophobicContact CE2-CG 4.41Å; F884-P899 VanDerWaalsContact CG-CD 3.5Å; F884-P899 HydrophobicContact CG-CG 4.26Å
900	T	69	Low	77.4	Confident	89 Å²	89	65.2 Å²	65.2	55%	0.546	38%	0.382	S	S	.	.	S	Bend	trans	-85.1	-17.9	174.3	46.7	0	0	0	0	112.9	V898	V898-T900 PolarHBondContact O-N 3.04Å
901	Q	73.6	Confident	78.6	Confident	111 Å²	111	63 Å²	63	52%	0.519	36%	0.358	S	S	.	.	S	Bend	trans	-121.6	153.9	-178.7	-61.9	-176.9	-79.2	0	0	111	E876	E876-Q901 VanDerWaalsContact OE1-CA 3.23Å; E876-Q901 WeakPolarHBondContact OE1-CA 3.33Å
902	V	77.6	Confident	79.7	Confident	7 Å²	7	56.9 Å²	56.9	4%	0.042	33%	0.326	C	S	.	.			trans	-100.1	97.8	-176.8	178.1	0	0	0	0	111.5	F870 E876 I879 A880 I906	F870-V902 HydrophobicContact CD2-CB 4Å; F870-V902 HydrophobicContact CD2-CG2 4.33Å; F870-V902 HydrophobicContact CE1-CG2 4.42Å; F870-V902 HydrophobicContact CE2-CB 3.4Å; F870-V902 HydrophobicContact CE2-CG1 3.54Å; F870-V902 HydrophobicContact CE2-CG2 3.77Å; F870-V902 HydrophobicContact CZ-CB 3.93Å; F870-V902 HydrophobicContact CZ-CG1 3.86Å; F870-V902 HydrophobicContact CZ-CG2 3.83Å; E876-V902 HydrophobicContact CG-CB 4.25Å; E876-V902 HydrophobicContact CG-CG2 3.7Å; E876-V902 WeakPolarHBondContact O-CG2 3.24Å; E876-V902 PolarHBondContact OE1-N 2.98Å; I879-V902 HydrophobicContact CB-CG2 4.38Å; I879-V902 HydrophobicContact CG2-CG2 4.11Å; A880-V902 HydrophobicContact CB-CG2 3.71Å; V902-I906 HydrophobicContact CG1-CB 3.6Å; V902-I906 HydrophobicContact CG1-CG2 3.67Å
903	E	76	Confident	80.9	Confident	170 Å²	170	54.9 Å²	54.9	79%	0.794	31%	0.313	S	S	*	.			trans	-82.8	158.8	173.9	-68.4	-174.6	-170.7	0	0	113.7
904	G	80.8	Confident	82.1	Confident	16 Å²	16	52.6 Å²	52.6	17%	0.165	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	-144.6	167	0	0	0	0	0	114.9	I906 L907	G904-I906 VanDerWaalsContact C-N 3.31Å; G904-I906 PolarHBondContact O-N 3.29Å; G904-L907 WeakPolarHBondContact O-CB 3.03Å; G904-L907 PolarHBondContact O-N 2.98Å
905	K	86.6	Confident	83.2	Confident	69 Å²	69	47.1 Å²	47.1	30%	0.3	26%	0.261	S	S	.	.	H	α-helix	trans	-56.3	-40.3	-171.8	-73.5	-177	174	-177.2	0	113.8	L907 Y908 R909 E1134	K905-L907 PolarHBondContact O-N 3.47Å; K905-Y908 HydrophobicContact CB-CE1 4.06Å; K905-Y908 HydrophobicContact CG-CE1 4.15Å; K905-Y908 VanDerWaalsContact O-CD1 3.23Å; K905-Y908 WeakPolarHBondContact O-CD1 3.03Å; K905-Y908 PolarHBondContact O-N 2.86Å; K905-R909 WeakPolarHBondContact O-CG 3.16Å; K905-R909 PolarHBondContact O-N 3.01Å; K905-R909 VanDerWaalsContact O-N 3.13Å; K905-E1134 IonicContact NZ-OE2 3.44Å; K905-E1134 PolarHBondContact NZ-OE2 3.15Å
906	I	88.4	Confident	84.1	Confident	19 Å²	19	41.4 Å²	41.4	10%	0.097	23%	0.226	C	C	.	.	H	α-helix	trans	-62.4	-32.4	-171.5	-60	-174.8	0	0	0	111.2	F870 I879 N883 V902 G904 Y908 R909 S910 M1138	F870-I906 HydrophobicContact CZ-CG2 4.21Å; I879-I906 HydrophobicContact CG2-CG2 3.82Å; N883-I906 HydrophobicContact CB-CD1 3.71Å; V902-I906 HydrophobicContact CG1-CB 3.6Å; V902-I906 HydrophobicContact CG1-CG2 3.67Å; G904-I906 VanDerWaalsContact C-N 3.31Å; G904-I906 PolarHBondContact O-N 3.29Å; I906-Y908 VanDerWaalsContact C-N 3.25Å; I906-Y908 PolarHBondContact O-N 3.34Å; I906-R909 PolarHBondContact O-N 3.09Å; I906-R909 VanDerWaalsContact O-N 3.09Å; I906-S910 WeakPolarHBondContact CG2-OG 3.3Å; I906-S910 WeakPolarHBondContact O-CB 3.48Å; I906-S910 PolarHBondContact O-N 3.02Å; I906-S910 PolarHBondContact O-OG 3.25Å; I906-M1138 HydrophobicContact CG2-CE 3.83Å
907	L	90.7	Very high	85.2	Confident	4 Å²	4	37 Å²	37	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-52.7	-39.9	176.9	-169.8	59.2	0	0	0	113.3	H868 F870 G904 K905 I943 D946	H868-L907 PolarHBondContact NE2-O 3.05Å; F870-L907 HydrophobicContact CD2-CD1 3.9Å; F870-L907 HydrophobicContact CE2-CD1 4.08Å; G904-L907 WeakPolarHBondContact O-CB 3.03Å; G904-L907 PolarHBondContact O-N 2.98Å; K905-L907 PolarHBondContact O-N 3.47Å; L907-I943 HydrophobicContact CD1-CG2 3.8Å; L907-D946 HydrophobicContact CD2-CB 4.06Å
908	Y	92.2	Very high	86.3	Confident	15 Å²	15	32 Å²	32	6%	0.059	17%	0.17	C	C	.	.	H	α-helix	trans	-89.3	-30.6	174.1	77	-102.3	0	0	0	113.8	K905 I906 S910 S911 E915 D918 Y947 Y950	K905-Y908 HydrophobicContact CB-CE1 4.06Å; K905-Y908 HydrophobicContact CG-CE1 4.15Å; K905-Y908 VanDerWaalsContact O-CD1 3.23Å; K905-Y908 WeakPolarHBondContact O-CD1 3.03Å; K905-Y908 PolarHBondContact O-N 2.86Å; I906-Y908 VanDerWaalsContact C-N 3.25Å; I906-Y908 PolarHBondContact O-N 3.34Å; Y908-S910 VanDerWaalsContact C-N 3.25Å; Y908-S910 PolarHBondContact O-N 3.4Å; Y908-S911 PolarHBondContact O-N 3.17Å; Y908-S911 VanDerWaalsContact O-O 3.09Å; Y908-E915 PolarHBondContact O-N 3.41Å; Y908-D918 HydrophobicContact CD2-CB 4.3Å; Y908-D918 HydrophobicContact CG-CB 4.28Å; Y908-Y947 HydrophobicContact CD1-CE2 4.38Å; Y908-Y950 HydrophobicContact CD1-CE1 4.45Å; Y908-Y950 HydrophobicContact CE1-CE1 4.5Å
909	R	93	Very high	87.3	Confident	8 Å²	8	30.4 Å²	30.4	3%	0.03	16%	0.156	C	C	.	.	H	α-helix	trans	-61.4	-32.5	175.8	-63.8	170	68.7	64.3	11	113	K905 I906 P1135 R1136 L1137 M1138 E1142	K905-R909 WeakPolarHBondContact O-CG 3.16Å; K905-R909 PolarHBondContact O-N 3.01Å; K905-R909 VanDerWaalsContact O-N 3.13Å; I906-R909 PolarHBondContact O-N 3.09Å; I906-R909 VanDerWaalsContact O-N 3.09Å; R909-P1135 PolarHBondContact NH1-O 2.74Å; R909-P1135 PolarHBondContact NH2-O 2.76Å; R909-R1136 WeakPolarHBondContact CA-O 3.33Å; R909-L1137 PolarHBondContact NH2-O 3.3Å; R909-M1138 HydrophobicContact CB-CB 4.31Å; R909-M1138 PolarHBondContact O-N 3.14Å; R909-E1142 IonicContact CZ-OE1 2.74Å; R909-E1142 IonicContact NE-OE1 2.77Å; R909-E1142 IonicContact NE-OE2 2.87Å; R909-E1142 IonicContact NH2-OE1 3.54Å; R909-E1142 PolarHBondContact NH2-OE1 2.96Å; R909-E1142 IonicContact NH2-OE2 3.86Å
910	S	92.3	Very high	88.4	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-12.2	-174.2	-65.8	0	0	0	0	114.5	S821 P869 F870 I906 Y908	S821-S910 PolarHBondContact OG-O 2.86Å; P869-S910 WeakPolarHBondContact CD-O 3.27Å; P869-S910 WeakPolarHBondContact CG-O 3.22Å; F870-S910 WeakPolarHBondContact CZ-OG 3.09Å; I906-S910 WeakPolarHBondContact CG2-OG 3.3Å; I906-S910 WeakPolarHBondContact O-CB 3.48Å; I906-S910 PolarHBondContact O-N 3.02Å; I906-S910 PolarHBondContact O-OG 3.25Å; Y908-S910 VanDerWaalsContact C-N 3.25Å; Y908-S910 PolarHBondContact O-N 3.4Å
911	S	93.5	Very high	89.6	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.113	C	C	.	.			trans	-139.7	125.3	175.1	176.2	0	0	0	0	112.3	Q824 N867 H868 Y908 K913 F914 E915	Q824-S911 PolarHBondContact NE2-OG 3.41Å; N867-S911 PolarHBondContact O-OG 2.9Å; H868-S911 WeakPolarHBondContact CD2-CB 3.41Å; Y908-S911 PolarHBondContact O-N 3.17Å; Y908-S911 VanDerWaalsContact O-O 3.09Å; S911-K913 PolarHBondContact O-N 2.9Å; S911-F914 WeakPolarHBondContact O-CA 3.47Å; S911-F914 PolarHBondContact O-N 3.03Å; S911-E915 PolarHBondContact O-N 2.75Å
912	G	92.6	Very high	90.6	Very high	4 Å²	4	20.4 Å²	20.4	4%	0.041	10%	0.102	C	C	.	.	H	α-helix	trans	-61.3	-25.8	-179.6	0	0	0	0	0	115.1	E819 E915 L916	E819-G912 VanDerWaalsContact O-CA 3.3Å; E819-G912 WeakPolarHBondContact O-CA 3.42Å; G912-E915 WeakPolarHBondContact O-CB 3.28Å; G912-E915 PolarHBondContact O-N 3.29Å; G912-L916 WeakPolarHBondContact O-CB 3.37Å; G912-L916 PolarHBondContact O-N 3.06Å
913	K	94.7	Very high	91.3	Very high	1 Å²	1	20.1 Å²	20.1	0%	0.004	10%	0.101	C	C	.	.	H	α-helix	trans	-68.7	-34.9	171.6	-62.2	-173.3	-177.3	-174.4	0	112.4	N867 S911 L917 F1006 L1036 S1038 E1043	N867-K913 PolarHBondContact OD1-NZ 3.15Å; S911-K913 PolarHBondContact O-N 2.9Å; K913-L917 WeakPolarHBondContact O-CG 3.36Å; K913-L917 PolarHBondContact O-N 3.26Å; K913-F1006 HydrophobicContact CB-CD2 4.33Å; K913-F1006 HydrophobicContact CB-CE1 4.19Å; K913-F1006 HydrophobicContact CB-CE2 3.44Å; K913-F1006 VanDerWaalsContact CB-CE2 3.44Å; K913-F1006 HydrophobicContact CB-CZ 3.35Å; K913-F1006 HydrophobicContact CD-CD1 3.93Å; K913-F1006 HydrophobicContact CD-CD2 4.45Å; K913-F1006 HydrophobicContact CD-CE1 3.48Å; K913-F1006 VanDerWaalsContact CD-CE1 3.48Å; K913-F1006 HydrophobicContact CD-CE2 4.05Å; K913-F1006 HydrophobicContact CD-CG 4.41Å; K913-F1006 HydrophobicContact CD-CZ 3.55Å; K913-F1006 HydrophobicContact CG-CE2 4.41Å; K913-F1006 HydrophobicContact CG-CZ 4.12Å; K913-F1006 PolarHBondContact NZ-O 2.91Å; K913-L1036 HydrophobicContact CD-CB 4.39Å; K913-L1036 HydrophobicContact CG-CB 4.43Å; K913-S1038 WeakPolarHBondContact CE-OG 3.38Å; K913-E1043 WeakPolarHBondContact CE-OE2 3.31Å; K913-E1043 IonicContact NZ-OE1 3.96Å; K913-E1043 PolarHBondContact NZ-OE1 2.83Å; K913-E1043 IonicContact NZ-OE2 2.66Å; K913-E1043 PolarHBondContact NZ-OE2 3.38Å
914	F	95.3	Very high	92.2	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-77.7	-34.2	175.4	-80.5	-113.5	0	0	0	111.7	H868 S911 L916 L917 D918 L940 I943 M944 Y947 F1006	H868-F914 HydrophobicContact CB-CE2 4.22Å; H868-F914 AromaticContact CD2-CD2 3.48Å; H868-F914 VanDerWaalsContact CD2-CD2 3.48Å; H868-F914 WeakPolarHBondContact CD2-CD2 3.2Å; H868-F914 AromaticContact CD2-CE2 3.47Å; H868-F914 VanDerWaalsContact CD2-CE2 3.47Å; H868-F914 WeakPolarHBondContact CD2-CE2 3.37Å; H868-F914 AromaticContact CD2-CG 3.99Å; H868-F914 AromaticContact CD2-CZ 3.98Å; S911-F914 WeakPolarHBondContact O-CA 3.47Å; S911-F914 PolarHBondContact O-N 3.03Å; F914-L916 VanDerWaalsContact C-N 3.32Å; F914-L916 PolarHBondContact O-N 2.77Å; F914-L917 PolarHBondContact O-N 3.24Å; F914-D918 WeakPolarHBondContact O-CB 3.33Å; F914-D918 PolarHBondContact O-N 3.49Å; F914-L940 HydrophobicContact CE2-CD1 3.85Å; F914-L940 HydrophobicContact CZ-CD1 4.02Å; F914-I943 HydrophobicContact CE1-CG2 4.01Å; F914-I943 HydrophobicContact CZ-CB 4.31Å; F914-I943 HydrophobicContact CZ-CG2 3.73Å; F914-M944 HydrophobicContact CE1-CG 4.1Å; F914-M944 HydrophobicContact CZ-CG 3.72Å; F914-Y947 HydrophobicContact CD1-CD1 4.47Å; F914-Y947 HydrophobicContact CD1-CD2 4.36Å; F914-Y947 HydrophobicContact CD1-CG 4.04Å; F914-Y947 HydrophobicContact CE1-CG 4.33Å; F914-F1006 AromaticContact CD2-CE2 3.97Å; F914-F1006 HydrophobicContact CD2-CE2 3.97Å; F914-F1006 AromaticContact CD2-CZ 3.64Å; F914-F1006 HydrophobicContact CD2-CZ 3.64Å; F914-F1006 HydrophobicContact CE2-CE1 4.35Å; F914-F1006 AromaticContact CE2-CE2 3.95Å; F914-F1006 HydrophobicContact CE2-CE2 3.95Å; F914-F1006 AromaticContact CE2-CZ 3.44Å; F914-F1006 HydrophobicContact CE2-CZ 3.44Å; F914-F1006 VanDerWaalsContact CE2-CZ 3.44Å
915	E	93.8	Very high	92.7	Very high	22 Å²	22	15.6 Å²	15.6	10%	0.103	7%	0.074	C	C	.	.	H	α-helix	trans	-52.7	-50.9	167.1	-167.8	-60.9	114.7	0	0	110.5	Y908 S911 G912 D918 R919 R1136 L1137	Y908-E915 PolarHBondContact O-N 3.41Å; S911-E915 PolarHBondContact O-N 2.75Å; G912-E915 WeakPolarHBondContact O-CB 3.28Å; G912-E915 PolarHBondContact O-N 3.29Å; E915-D918 WeakPolarHBondContact O-CA 3.5Å; E915-D918 VanDerWaalsContact O-CB 3.27Å; E915-D918 WeakPolarHBondContact O-CB 3.16Å; E915-D918 PolarHBondContact O-N 3.32Å; E915-D918 VanDerWaalsContact O-N 3.13Å; E915-R919 PolarHBondContact O-N 2.89Å; E915-R919 VanDerWaalsContact O-N 3.17Å; E915-R919 WeakPolarHBondContact OE1-CD 3.27Å; E915-R919 WeakPolarHBondContact OE1-CG 3.38Å; E915-R919 WeakPolarHBondContact OE2-CD 3.23Å; E915-R919 IonicContact OE2-NH1 3.15Å; E915-R1136 HydrophobicContact CG-CB 4.05Å; E915-R1136 PolarHBondContact O-NH2 3.35Å; E915-R1136 IonicContact OE1-CZ 3.02Å; E915-R1136 IonicContact OE1-NE 3.24Å; E915-R1136 PolarHBondContact OE1-NE 3.41Å; E915-R1136 IonicContact OE1-NH2 3.89Å; E915-R1136 PolarHBondContact OE1-NH2 2.78Å; E915-L1137 HydrophobicContact CB-CD2 3.73Å; E915-L1137 HydrophobicContact CG-CD2 3.75Å; E915-L1137 HydrophobicContact CG-CG 4.37Å
916	L	93.5	Very high	93	Very high	7 Å²	7	16 Å²	16	4%	0.037	9%	0.085	C	C	.	.	H	α-helix	trans	-65.8	-42.3	177.9	179.6	64.8	0	0	0	112.8	I816 C818 G912 F914 D918 R919 I920 L1036 I1102	I816-L916 HydrophobicContact CB-CD2 4.1Å; I816-L916 HydrophobicContact CD1-CD2 4.41Å; I816-L916 HydrophobicContact CG2-CD1 4.46Å; I816-L916 HydrophobicContact CG2-CD2 3.49Å; I816-L916 VanDerWaalsContact CG2-CD2 3.49Å; C818-L916 VanDerWaalsContact SG-CD2 3.52Å; G912-L916 WeakPolarHBondContact O-CB 3.37Å; G912-L916 PolarHBondContact O-N 3.06Å; F914-L916 VanDerWaalsContact C-N 3.32Å; F914-L916 PolarHBondContact O-N 2.77Å; L916-D918 PolarHBondContact O-N 2.99Å; L916-R919 PolarHBondContact O-N 2.77Å; L916-I920 HydrophobicContact CD1-CG2 3.93Å; L916-I920 HydrophobicContact CG-CG2 4.39Å; L916-I920 PolarHBondContact O-N 2.73Å; L916-L1036 HydrophobicContact CD2-CD1 4.35Å; L916-L1036 HydrophobicContact CD2-CD2 3.62Å; L916-L1036 HydrophobicContact CD2-CG 4.5Å; L916-I1102 HydrophobicContact CD1-CD1 3.59Å; L916-I1102 HydrophobicContact CD1-CG1 4.44Å
917	L	94.2	Very high	93.1	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-53.8	-38.2	172	-76.7	-179.6	0	0	0	111.4	K913 F914 R919 I920 L921 I1004 F1006 L1036	K913-L917 WeakPolarHBondContact O-CG 3.36Å; K913-L917 PolarHBondContact O-N 3.26Å; F914-L917 PolarHBondContact O-N 3.24Å; L917-R919 VanDerWaalsContact C-N 3.33Å; L917-R919 PolarHBondContact O-N 3.29Å; L917-I920 HydrophobicContact CD2-CD1 4.35Å; L917-I920 PolarHBondContact O-N 3.1Å; L917-L921 HydrophobicContact CB-CD1 4.16Å; L917-L921 HydrophobicContact CD2-CD1 4.27Å; L917-L921 HydrophobicContact CD2-CG 4.45Å; L917-L921 VanDerWaalsContact O-CB 3.31Å; L917-L921 WeakPolarHBondContact O-CB 3.22Å; L917-L921 WeakPolarHBondContact O-CG 3.19Å; L917-L921 PolarHBondContact O-N 3.3Å; L917-I1004 HydrophobicContact CD2-CD1 3.83Å; L917-I1004 HydrophobicContact CD2-CG2 4.41Å; L917-F1006 HydrophobicContact CD1-CD2 3.99Å; L917-F1006 HydrophobicContact CD1-CE2 3.72Å; L917-F1006 HydrophobicContact CG-CE2 4.34Å; L917-L1036 HydrophobicContact CD2-CD1 4.26Å; L917-L1036 HydrophobicContact CG-CD1 4.41Å
918	D	93.5	Very high	93	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.011	12%	0.12	C	C	.	.	H	α-helix	trans	-70.6	-24.3	178.6	-163.6	76.2	0	0	0	113.9	Y908 F914 E915 L916 P922 Y947 R951 R1136	Y908-D918 HydrophobicContact CD2-CB 4.3Å; Y908-D918 HydrophobicContact CG-CB 4.28Å; F914-D918 WeakPolarHBondContact O-CB 3.33Å; F914-D918 PolarHBondContact O-N 3.49Å; E915-D918 WeakPolarHBondContact O-CA 3.5Å; E915-D918 VanDerWaalsContact O-CB 3.27Å; E915-D918 WeakPolarHBondContact O-CB 3.16Å; E915-D918 PolarHBondContact O-N 3.32Å; E915-D918 VanDerWaalsContact O-N 3.13Å; L916-D918 PolarHBondContact O-N 2.99Å; D918-P922 VanDerWaalsContact O-CD 3.3Å; D918-P922 WeakPolarHBondContact O-CD 3.26Å; D918-P922 WeakPolarHBondContact O-CG 3.4Å; D918-Y947 WeakPolarHBondContact CA-OH 3.45Å; D918-Y947 HydrophobicContact CB-CE2 4.41Å; D918-Y947 WeakPolarHBondContact CB-OH 3.37Å; D918-Y947 PolarHBondContact OD1-OH 3.15Å; D918-R951 IonicContact OD1-CZ 3.49Å; D918-R951 IonicContact OD1-NE 3.88Å; D918-R951 PolarHBondContact OD1-NE 2.81Å; D918-R951 IonicContact OD1-NH2 2.88Å; D918-R951 PolarHBondContact OD1-NH2 3.47Å; D918-R951 IonicContact OD2-CZ 2.76Å; D918-R951 IonicContact OD2-NH2 2.64Å; D918-R951 PolarHBondContact OD2-NH2 2.77Å; D918-R1136 IonicContact OD2-CZ 3.32Å; D918-R1136 IonicContact OD2-NH1 3.61Å; D918-R1136 PolarHBondContact OD2-NH1 2.85Å; D918-R1136 IonicContact OD2-NH2 2.77Å; D918-R1136 PolarHBondContact OD2-NH2 3.35Å
919	R	91.1	Very high	93	Very high	37 Å²	37	19.4 Å²	19.4	14%	0.14	12%	0.12	C	C	.	.	H	α-helix	trans	-80.3	-38.8	170.2	-69.3	168.7	67.4	-160.3	2.5	112.5	E915 L916 L917 K923 D1099	E915-R919 PolarHBondContact O-N 2.89Å; E915-R919 VanDerWaalsContact O-N 3.17Å; E915-R919 WeakPolarHBondContact OE1-CD 3.27Å; E915-R919 WeakPolarHBondContact OE1-CG 3.38Å; E915-R919 WeakPolarHBondContact OE2-CD 3.23Å; E915-R919 IonicContact OE2-NH1 3.15Å; L916-R919 PolarHBondContact O-N 2.77Å; L917-R919 VanDerWaalsContact C-N 3.33Å; L917-R919 PolarHBondContact O-N 3.29Å; R919-K923 WeakPolarHBondContact O-CD 3.33Å; R919-K923 WeakPolarHBondContact O-CE 3.41Å; R919-D1099 IonicContact CZ-OD1 3.18Å; R919-D1099 IonicContact NE-OD1 3.77Å; R919-D1099 PolarHBondContact NE-OD1 2.95Å; R919-D1099 IonicContact NH2-OD1 3.48Å; R919-D1099 PolarHBondContact NH2-OD1 2.94Å
920	I	94	Very high	93	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-93.5	-33.1	-170.5	73.1	-176.9	0	0	0	115.1	L916 L917 K923 L924 I1004 L1034 I1102 L1106	L916-I920 HydrophobicContact CD1-CG2 3.93Å; L916-I920 HydrophobicContact CG-CG2 4.39Å; L916-I920 PolarHBondContact O-N 2.73Å; L917-I920 HydrophobicContact CD2-CD1 4.35Å; L917-I920 PolarHBondContact O-N 3.1Å; I920-K923 WeakPolarHBondContact O-CB 3.17Å; I920-K923 PolarHBondContact O-N 3.25Å; I920-L924 WeakPolarHBondContact O-CG 3.49Å; I920-L924 PolarHBondContact O-N 3.14Å; I920-L924 VanDerWaalsContact O-N 3.1Å; I920-I1004 HydrophobicContact CD1-CD1 3.91Å; I920-L1034 HydrophobicContact CD1-CD1 4Å; I920-I1102 HydrophobicContact CG2-CG2 3.88Å; I920-L1106 HydrophobicContact CB-CD1 4.01Å; I920-L1106 HydrophobicContact CB-CD2 4.36Å; I920-L1106 HydrophobicContact CG2-CD1 3.88Å
921	L	94.8	Very high	93.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-67.1	-38.3	-177.5	-69.7	173.5	0	0	0	113.9	L917 K923 L924 K925 V931 I933 Y947 F948 F953 F982 I983 I1004	L917-L921 HydrophobicContact CB-CD1 4.16Å; L917-L921 HydrophobicContact CD2-CD1 4.27Å; L917-L921 HydrophobicContact CD2-CG 4.45Å; L917-L921 VanDerWaalsContact O-CB 3.31Å; L917-L921 WeakPolarHBondContact O-CB 3.22Å; L917-L921 WeakPolarHBondContact O-CG 3.19Å; L917-L921 PolarHBondContact O-N 3.3Å; L921-K923 VanDerWaalsContact C-N 3.32Å; L921-K923 PolarHBondContact O-N 2.89Å; L921-L924 PolarHBondContact O-N 2.78Å; L921-K925 WeakPolarHBondContact O-CB 3.46Å; L921-K925 PolarHBondContact O-N 3.22Å; L921-V931 HydrophobicContact CD2-CG1 4.43Å; L921-V931 HydrophobicContact CD2-CG2 4.44Å; L921-I933 HydrophobicContact CD2-CD1 4.46Å; L921-Y947 HydrophobicContact CD1-CE1 4.09Å; L921-F948 HydrophobicContact CD1-CD1 4.44Å; L921-F948 HydrophobicContact CD1-CE1 3.88Å; L921-F953 HydrophobicContact CB-CE2 3.71Å; L921-F953 HydrophobicContact CB-CZ 3.95Å; L921-F953 HydrophobicContact CD1-CD2 4.32Å; L921-F953 HydrophobicContact CD1-CE2 3.98Å; L921-F953 HydrophobicContact CG-CE2 4.5Å; L921-F982 HydrophobicContact CB-CE1 4.35Å; L921-F982 HydrophobicContact CD2-CE1 4.15Å; L921-F982 HydrophobicContact CD2-CZ 4.17Å; L921-F982 WeakPolarHBondContact O-CZ 3.48Å; L921-I983 HydrophobicContact CD1-CD1 4.26Å; L921-I983 HydrophobicContact CD2-CD1 4.21Å; L921-I1004 HydrophobicContact CD2-CD1 4.32Å
922	P	93.1	Very high	93.2	Very high	47 Å²	47	20.4 Å²	20.4	31%	0.305	12%	0.124	S	C	.	.	H	α-helix	trans	-61.9	-38.4	173.4	-24.1	35.5	0	0	0	113.1	D918 K925 C926 F953	D918-P922 VanDerWaalsContact O-CD 3.3Å; D918-P922 WeakPolarHBondContact O-CD 3.26Å; D918-P922 WeakPolarHBondContact O-CG 3.4Å; P922-K925 PolarHBondContact O-N 2.83Å; P922-C926 PolarHBondContact O-N 3.5Å; P922-C926 VanDerWaalsContact O-N 3.13Å; P922-F953 HydrophobicContact CG-CZ 4.49Å
923	K	94.1	Very high	93.3	Very high	1 Å²	1	20.2 Å²	20.2	0%	0.004	12%	0.122	C	C	.	.	H	α-helix	trans	-59.9	-56	176.1	-68	174.1	-179	-178.4	0	110.6	R919 I920 L921 K925 C926 C927 N1103 L1106 Y1116 L1119 D1120	R919-K923 WeakPolarHBondContact O-CD 3.33Å; R919-K923 WeakPolarHBondContact O-CE 3.41Å; I920-K923 WeakPolarHBondContact O-CB 3.17Å; I920-K923 PolarHBondContact O-N 3.25Å; L921-K923 VanDerWaalsContact C-N 3.32Å; L921-K923 PolarHBondContact O-N 2.89Å; K923-K925 VanDerWaalsContact C-N 3.31Å; K923-K925 PolarHBondContact O-N 2.99Å; K923-C926 WeakPolarHBondContact O-CB 3.41Å; K923-C926 PolarHBondContact O-N 2.89Å; K923-C926 VanDerWaalsContact O-N 3.09Å; K923-C927 PolarHBondContact O-N 2.73Å; K923-N1103 WeakPolarHBondContact CE-OD1 3.29Å; K923-N1103 PolarHBondContact NZ-OD1 2.83Å; K923-L1106 HydrophobicContact CB-CD1 4.37Å; K923-L1106 HydrophobicContact CD-CD1 3.75Å; K923-Y1116 HydrophobicContact CB-CD1 3.52Å; K923-Y1116 HydrophobicContact CB-CE1 3.77Å; K923-Y1116 HydrophobicContact CB-CG 4.05Å; K923-Y1116 HydrophobicContact CD-CD1 4.45Å; K923-Y1116 HydrophobicContact CD-CG 4.16Å; K923-Y1116 HydrophobicContact CG-CD1 3.91Å; K923-Y1116 HydrophobicContact CG-CG 4.13Å; K923-Y1116 WeakPolarHBondContact O-CE1 3.44Å; K923-L1119 HydrophobicContact CG-CD1 4.21Å; K923-D1120 VanDerWaalsContact CE-CG 3.48Å; K923-D1120 WeakPolarHBondContact CE-OD1 2.94Å; K923-D1120 WeakPolarHBondContact CE-OD2 3.42Å; K923-D1120 IonicContact NZ-OD1 2.8Å; K923-D1120 PolarHBondContact NZ-OD1 3.43Å; K923-D1120 IonicContact NZ-OD2 3.31Å; K923-D1120 PolarHBondContact NZ-OD2 2.88Å
924	L	93.7	Very high	93.3	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-60.4	-36.9	180	-68.3	168	0	0	0	113.1	I920 L921 G928 H929 V931 F982 T1002 L1106	I920-L924 WeakPolarHBondContact O-CG 3.49Å; I920-L924 PolarHBondContact O-N 3.14Å; I920-L924 VanDerWaalsContact O-N 3.1Å; L921-L924 PolarHBondContact O-N 2.78Å; L924-G928 PolarHBondContact O-N 3.38Å; L924-H929 HydrophobicContact CB-CB 4.47Å; L924-H929 HydrophobicContact CD2-CB 4.13Å; L924-H929 PolarHBondContact O-N 2.82Å; L924-H929 VanDerWaalsContact O-N 3.13Å; L924-V931 HydrophobicContact CB-CG2 4.29Å; L924-V931 HydrophobicContact CD1-CG2 3.99Å; L924-F982 HydrophobicContact CB-CE2 4.16Å; L924-F982 HydrophobicContact CB-CZ 4.05Å; L924-T1002 HydrophobicContact CD1-CG2 3.9Å; L924-T1002 HydrophobicContact CD2-CG2 4.28Å; L924-L1106 HydrophobicContact CD1-CD2 4.44Å; L924-L1106 HydrophobicContact CD2-CD2 4.29Å; L924-L1106 HydrophobicContact CG-CD2 4.43Å
925	K	92.6	Very high	93.2	Very high	91 Å²	91	20.2 Å²	20.2	40%	0.396	12%	0.122	S	C	.	.	H	α-helix	trans	-67.3	-34.5	176.2	-169.2	176.3	178.9	-175	0	112.5	L921 P922 K923 G928 N952 F953 F982	L921-K925 WeakPolarHBondContact O-CB 3.46Å; L921-K925 PolarHBondContact O-N 3.22Å; P922-K925 PolarHBondContact O-N 2.83Å; K923-K925 VanDerWaalsContact C-N 3.31Å; K923-K925 PolarHBondContact O-N 2.99Å; K925-G928 PolarHBondContact O-N 2.9Å; K925-N952 PolarHBondContact NZ-O 3.23Å; K925-F953 HydrophobicContact CD-CD1 3.73Å; K925-F953 HydrophobicContact CD-CE1 3.68Å; K925-F982 HydrophobicContact CB-CD1 4.36Å; K925-F982 HydrophobicContact CB-CD2 4.35Å; K925-F982 HydrophobicContact CB-CE1 3.89Å; K925-F982 HydrophobicContact CB-CE2 3.86Å; K925-F982 HydrophobicContact CB-CZ 3.63Å; K925-F982 HydrophobicContact CD-CD1 4.32Å; K925-F982 HydrophobicContact CD-CE1 4.47Å; K925-F982 HydrophobicContact CG-CD1 4.36Å; K925-F982 HydrophobicContact CG-CD2 4.44Å; K925-F982 HydrophobicContact CG-CE1 4.37Å; K925-F982 HydrophobicContact CG-CE2 4.45Å; K925-F982 HydrophobicContact CG-CG 4.43Å; K925-F982 HydrophobicContact CG-CZ 4.43Å
926	C	91.3	Very high	93.1	Very high	78 Å²	78	20.4 Å²	20.4	53%	0.527	12%	0.123	S	C	.	.	H	α-helix	trans	-64.7	-42.8	180	-163.7	0	0	0	0	112	P922 K923 G928 I1115 L1119	P922-C926 PolarHBondContact O-N 3.5Å; P922-C926 VanDerWaalsContact O-N 3.13Å; K923-C926 WeakPolarHBondContact O-CB 3.41Å; K923-C926 PolarHBondContact O-N 2.89Å; K923-C926 VanDerWaalsContact O-N 3.09Å; C926-G928 VanDerWaalsContact C-N 3.34Å; C926-I1115 HydrophobicContact CB-CG2 4.31Å; C926-L1119 HydrophobicContact CB-CD1 3.76Å
927	C	90.5	Very high	92.9	Very high	37 Å²	37	21.1 Å²	21.1	25%	0.25	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	1.7	178.2	-62.5	0	0	0	0	114	K923 H929 E1112 Y1116	K923-C927 PolarHBondContact O-N 2.73Å; C927-H929 VanDerWaalsContact CB-NE2 3.26Å; C927-H929 WeakPolarHBondContact CB-NE2 3.29Å; C927-E1112 HydrophobicContact CB-CG 4.36Å; C927-Y1116 HydrophobicContact CB-CE1 4.33Å; C927-Y1116 WeakPolarHBondContact SG-CE1 3.45Å
928	G	89.6	Confident	92.7	Very high	59 Å²	59	24.6 Å²	24.6	61%	0.608	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.2	14.1	171.7	0	0	0	0	0	116.1	L924 K925 C926	L924-G928 PolarHBondContact O-N 3.38Å; K925-G928 PolarHBondContact O-N 2.9Å; C926-G928 VanDerWaalsContact C-N 3.34Å
929	H	92.5	Very high	92.5	Very high	12 Å²	12	27.2 Å²	27.2	6%	0.056	17%	0.166	C	C	.	.			trans	-66.5	151	177.4	-58.6	-57.9	0	0	0	111.7	L924 C927 F982 D1001 R1108 E1112 Y1116	L924-H929 HydrophobicContact CB-CB 4.47Å; L924-H929 HydrophobicContact CD2-CB 4.13Å; L924-H929 PolarHBondContact O-N 2.82Å; L924-H929 VanDerWaalsContact O-N 3.13Å; C927-H929 VanDerWaalsContact CB-NE2 3.26Å; C927-H929 WeakPolarHBondContact CB-NE2 3.29Å; H929-F982 WeakPolarHBondContact O-CD2 3.27Å; H929-F982 WeakPolarHBondContact O-CE2 3.42Å; H929-D1001 WeakPolarHBondContact CA-OD1 3.19Å; H929-D1001 WeakPolarHBondContact CB-OD1 3.46Å; H929-D1001 IonicContact CE1-OD2 3.85Å; H929-D1001 IonicContact CG-OD2 3.48Å; H929-D1001 IonicContact ND1-OD1 3.82Å; H929-D1001 IonicContact ND1-OD2 2.73Å; H929-D1001 PolarHBondContact ND1-OD2 2.75Å; H929-R1108 PolarHBondContact CD2-NH1 2.87Å; H929-R1108 PolarHBondContact CE1-NH1 2.9Å; H929-R1108 PolarHBondContact ND1-NH1 3.16Å; H929-R1108 PolarHBondContact NE2-NH1 3.2Å; H929-E1112 IonicContact CE1-OE1 3.66Å; H929-E1112 PolarHBondContact CE1-OE1 2.68Å; H929-E1112 IonicContact NE2-OE1 2.68Å; H929-E1112 PolarHBondContact NE2-OE1 3.37Å; H929-E1112 IonicContact NE2-OE2 3.79Å; H929-Y1116 PolarHBondContact NE2-OH 2.9Å
930	R	93	Very high	92.7	Very high	30 Å²	30	25.5 Å²	25.5	11%	0.113	16%	0.159	C	C	.	.			trans	-110.3	125.8	179.2	-84.4	-177	172.9	-175.1	4.7	110.1	F974 D976 E979 I981 A999 A1000 D1001 T1002	R930-F974 HydrophobicContact CB-CZ 4.15Å; R930-F974 PolarHBondContact NH1-O 2.69Å; R930-D976 PolarHBondContact NH1-O 3.02Å; R930-D976 PolarHBondContact NH2-O 3.22Å; R930-E979 PolarHBondContact NH2-O 3.29Å; R930-I981 PolarHBondContact NE-O 3.18Å; R930-A999 VanDerWaalsContact CB-O 3.25Å; R930-A999 WeakPolarHBondContact CB-O 3.35Å; R930-A999 VanDerWaalsContact CD-O 3.23Å; R930-A999 WeakPolarHBondContact CD-O 3.5Å; R930-A1000 HydrophobicContact CB-CB 4.34Å; R930-A1000 WeakPolarHBondContact O-CA 3.14Å; R930-A1000 WeakPolarHBondContact O-CB 3.44Å; R930-D1001 PolarHBondContact N-OD1 3.27Å; R930-D1001 PolarHBondContact O-N 3.18Å; R930-D1001 VanDerWaalsContact O-N 3.14Å; R930-T1002 PolarHBondContact O-N 3.22Å
931	V	94.9	Very high	92.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.1	-164.7	-168.9	0	0	0	0	111.2	L921 L924 I933 F982 I983 F984 T1002 I1004	L921-V931 HydrophobicContact CD2-CG1 4.43Å; L921-V931 HydrophobicContact CD2-CG2 4.44Å; L924-V931 HydrophobicContact CB-CG2 4.29Å; L924-V931 HydrophobicContact CD1-CG2 3.99Å; V931-I933 HydrophobicContact CG1-CD1 4.35Å; V931-I933 HydrophobicContact CG1-CG1 3.84Å; V931-F982 HydrophobicContact CG2-CD2 4.4Å; V931-F982 HydrophobicContact CG2-CE2 3.7Å; V931-F982 HydrophobicContact CG2-CZ 3.91Å; V931-F982 PolarHBondContact N-O 2.94Å; V931-I983 HydrophobicContact CB-CG1 4.44Å; V931-I983 CarbonylContact O-C 3.48Å; V931-I983 WeakPolarHBondContact O-CA 3.37Å; V931-F984 PolarHBondContact O-N 2.8Å; V931-T1002 WeakPolarHBondContact CA-O 3.43Å; V931-T1002 HydrophobicContact CG1-CG2 4.44Å; V931-I1004 HydrophobicContact CG1-CD1 3.7Å; V931-I1004 HydrophobicContact CG1-CG1 3.91Å
932	L	94.7	Very high	92.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	130.5	163.4	-51.8	-174.7	0	0	0	108.9	F934 F974 F984 L986 L997 A1000 T1002 V1003 I1004 A1022	L932-F934 HydrophobicContact CB-CE2 3.94Å; L932-F934 HydrophobicContact CB-CZ 4.25Å; L932-F934 HydrophobicContact CD1-CE2 4.1Å; L932-F934 HydrophobicContact CD1-CZ 4Å; L932-F974 HydrophobicContact CD2-CE1 3.79Å; L932-F974 HydrophobicContact CD2-CZ 3.78Å; L932-F984 HydrophobicContact CD2-CB 3.78Å; L932-L986 HydrophobicContact CB-CD1 4.17Å; L932-L986 HydrophobicContact CD1-CD1 4.49Å; L932-L986 HydrophobicContact CD2-CD1 3.94Å; L932-L986 HydrophobicContact CG-CD1 4.42Å; L932-L997 HydrophobicContact CD1-CB 3.85Å; L932-L997 HydrophobicContact CD1-CD1 3.78Å; L932-L997 HydrophobicContact CD1-CG 4.44Å; L932-L997 HydrophobicContact CD2-CB 4.21Å; L932-L997 HydrophobicContact CD2-CD1 4.1Å; L932-A1000 HydrophobicContact CD1-CB 4.1Å; L932-A1000 HydrophobicContact CD2-CB 3.55Å; L932-A1000 HydrophobicContact CG-CB 3.51Å; L932-T1002 PolarHBondContact N-O 3.45Å; L932-V1003 HydrophobicContact CB-CG2 4.38Å; L932-V1003 HydrophobicContact CD1-CG2 4.24Å; L932-V1003 HydrophobicContact CG-CG2 4.48Å; L932-V1003 CarbonylContact O-C 3.45Å; L932-V1003 WeakPolarHBondContact O-CA 3.41Å; L932-I1004 PolarHBondContact O-N 2.95Å; L932-A1022 HydrophobicContact CD1-CB 4.03Å
933	I	95.1	Very high	92.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	115.1	175.4	-56	-179.2	0	0	0	108.2	L921 V931 M944 F948 I983 F984 L985 L986 I1004	L921-I933 HydrophobicContact CD2-CD1 4.46Å; V931-I933 HydrophobicContact CG1-CD1 4.35Å; V931-I933 HydrophobicContact CG1-CG1 3.84Å; I933-M944 HydrophobicContact CG2-CE 4.31Å; I933-M944 HydrophobicContact CG2-SD 3.87Å; I933-F948 HydrophobicContact CD1-CE1 4.2Å; I933-F948 HydrophobicContact CD1-CE2 4.46Å; I933-F948 HydrophobicContact CD1-CZ 3.6Å; I933-I983 HydrophobicContact CD1-CD1 4.33Å; I933-I983 HydrophobicContact CD1-CG2 3.76Å; I933-I983 HydrophobicContact CG1-CG2 4.12Å; I933-F984 PolarHBondContact N-O 2.73Å; I933-L985 HydrophobicContact CB-CD1 4.1Å; I933-L985 HydrophobicContact CG2-CD1 4Å; I933-L986 PolarHBondContact O-N 2.93Å; I933-I1004 HydrophobicContact CD1-CD1 4.41Å; I933-I1004 HydrophobicContact CG1-CB 4.27Å; I933-I1004 HydrophobicContact CG1-CD1 4.26Å
934	F	94.1	Very high	92.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.1	-178.1	-70.6	-66.3	0	0	0	112	L932 L986 V1003 I1004 F1006 A1018	L932-F934 HydrophobicContact CB-CE2 3.94Å; L932-F934 HydrophobicContact CB-CZ 4.25Å; L932-F934 HydrophobicContact CD1-CE2 4.1Å; L932-F934 HydrophobicContact CD1-CZ 4Å; F934-L986 VanDerWaalsContact CA-O 3.32Å; F934-L986 WeakPolarHBondContact CA-O 3.48Å; F934-L986 HydrophobicContact CD1-CB 3.56Å; F934-L986 HydrophobicContact CD1-CD1 4.45Å; F934-L986 HydrophobicContact CE1-CB 3.51Å; F934-L986 HydrophobicContact CE1-CD1 3.72Å; F934-L986 HydrophobicContact CE1-CG 4.14Å; F934-L986 HydrophobicContact CZ-CD1 3.97Å; F934-V1003 HydrophobicContact CD2-CG1 3.6Å; F934-V1003 HydrophobicContact CE2-CG1 3.58Å; F934-I1004 PolarHBondContact N-O 3.32Å; F934-F1006 PolarHBondContact O-N 2.81Å; F934-F1006 VanDerWaalsContact O-N 3.11Å; F934-A1018 HydrophobicContact CD1-CB 3.97Å; F934-A1018 HydrophobicContact CD2-CB 3.92Å; F934-A1018 HydrophobicContact CE1-CB 3.8Å; F934-A1018 HydrophobicContact CE2-CB 3.75Å; F934-A1018 HydrophobicContact CG-CB 4.03Å; F934-A1018 HydrophobicContact CZ-CB 3.7Å; F934-A1018 WeakPolarHBondContact CZ-O 3.49Å
935	C	93.5	Very high	92.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	142.9	-179	-52.4	0	0	0	0	112.4	L940 M941 M944 L986 S987 T988 D1007	C935-L940 HydrophobicContact CB-CD2 4.44Å; C935-M941 HydrophobicContact CB-CG 3.76Å; C935-M941 HydrophobicContact CB-SD 4.46Å; C935-M944 VanDerWaalsContact SG-CE 3.55Å; C935-M944 VanDerWaalsContact SG-SD 3.62Å; C935-L986 PolarHBondContact N-O 3.44Å; C935-S987 CarbonylContact O-C 3.55Å; C935-S987 WeakPolarHBondContact O-CA 3.2Å; C935-S987 PolarHBondContact O-OG 2.82Å; C935-T988 PolarHBondContact O-N 3.35Å; C935-T988 PolarHBondContact O-OG1 3.2Å; C935-D1007 VanDerWaalsContact CA-OD1 3.3Å; C935-D1007 WeakPolarHBondContact CA-OD1 3.16Å
936	Q	91.8	Very high	92.5	Very high	27 Å²	27	27.1 Å²	27.1	13%	0.126	17%	0.171	C	C	.	.	S	Bend	trans	-85.8	-40.3	173.5	-63.3	-72.2	-12.7	0	0	112.1	D1007 D1009	Q936-D1007 WeakPolarHBondContact CB-OD2 3.38Å; Q936-D1007 WeakPolarHBondContact CG-O 3.5Å; Q936-D1007 PolarHBondContact N-OD1 3.26Å; Q936-D1009 VanDerWaalsContact NE2-CB 3.27Å; Q936-D1009 PolarHBondContact NE2-OD2 3.1Å; Q936-D1009 PolarHBondContact OE1-OD2 2.91Å
937	M	88.8	Confident	92.6	Very high	21 Å²	21	23.4 Å²	23.4	10%	0.103	15%	0.145	C	C	.	.			trans	-92.5	125.1	-175.4	-51	-166.1	-168.5	0	0	111.6	M860 R863 K864 M871 L940 M941	M860-M937 HydrophobicContact SD-CE 3.86Å; R863-M937 HydrophobicContact CB-CE 3.71Å; K864-M937 HydrophobicContact CG-CE 4.17Å; K864-M937 HydrophobicContact CG-SD 3.75Å; M871-M937 HydrophobicContact CE-CB 3.72Å; M871-M937 HydrophobicContact CE-CG 4.15Å; M871-M937 HydrophobicContact CE-SD 3.33Å; M871-M937 WeakPolarHBondContact CE-SD 3.3Å; M937-L940 HydrophobicContact CB-CB 4.09Å; M937-L940 WeakPolarHBondContact O-CB 3.26Å; M937-L940 PolarHBondContact O-N 3.13Å; M937-M941 PolarHBondContact O-N 2.86Å
938	T	90	Very high	92.7	Very high	73 Å²	73	21.6 Å²	21.6	45%	0.448	13%	0.134	S	C	.	.	H	α-helix	trans	-77	-19.4	-177.2	46.2	0	0	0	0	114.8	M941 R957 D959	T938-M941 HydrophobicContact CG2-SD 4.18Å; T938-R957 PolarHBondContact O-NH2 3.13Å; T938-D959 HydrophobicContact CG2-CB 4.23Å
939	S	90	Very high	92.9	Very high	58 Å²	58	23 Å²	23	41%	0.406	13%	0.127	S	C	.	.	H	α-helix	trans	-74.9	-36.5	171.2	54	0	0	0	0	111.5	M871 M941 T942 I943	M871-S939 WeakPolarHBondContact CE-OG 3.25Å; M871-S939 PolarHBondContact SD-OG 2.9Å; S939-M941 PolarHBondContact O-N 2.76Å; S939-T942 WeakPolarHBondContact O-CB 3.23Å; S939-T942 PolarHBondContact O-N 3.5Å; S939-I943 PolarHBondContact O-N 3.47Å
940	L	93.8	Very high	92.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.8	-37	171.8	172.4	68.3	0	0	0	111.3	N867 H868 M871 F914 C935 M937 T942 I943 M944 F1006	N867-L940 HydrophobicContact CB-CD1 4.22Å; N867-L940 HydrophobicContact CB-CD2 4.06Å; H868-L940 HydrophobicContact CB-CD1 4.26Å; M871-L940 HydrophobicContact CE-CB 3.91Å; M871-L940 HydrophobicContact SD-CB 3.79Å; M871-L940 PolarHBondContact SD-N 3.44Å; M871-L940 VanDerWaalsContact SD-N 3.38Å; F914-L940 HydrophobicContact CE2-CD1 3.85Å; F914-L940 HydrophobicContact CZ-CD1 4.02Å; C935-L940 HydrophobicContact CB-CD2 4.44Å; M937-L940 HydrophobicContact CB-CB 4.09Å; M937-L940 WeakPolarHBondContact O-CB 3.26Å; M937-L940 PolarHBondContact O-N 3.13Å; L940-T942 PolarHBondContact O-N 3.17Å; L940-I943 PolarHBondContact O-N 3.44Å; L940-M944 HydrophobicContact CD1-CE 4.24Å; L940-M944 HydrophobicContact CD2-CE 4.11Å; L940-M944 HydrophobicContact CG-CE 4.01Å; L940-M944 WeakPolarHBondContact O-CG 3.37Å; L940-M944 PolarHBondContact O-N 2.68Å; L940-F1006 HydrophobicContact CD1-CE1 3.9Å; L940-F1006 HydrophobicContact CD1-CZ 4.3Å; L940-F1006 HydrophobicContact CD2-CD1 3.57Å; L940-F1006 HydrophobicContact CD2-CE1 3.66Å; L940-F1006 HydrophobicContact CG-CE1 4.34Å
941	M	93.3	Very high	92.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.3	-29.3	173.8	-64.2	175.4	76.8	0	0	112.3	C935 M937 T938 S939 Q945 R957 D959 L985	C935-M941 HydrophobicContact CB-CG 3.76Å; C935-M941 HydrophobicContact CB-SD 4.46Å; M937-M941 PolarHBondContact O-N 2.86Å; T938-M941 HydrophobicContact CG2-SD 4.18Å; S939-M941 PolarHBondContact O-N 2.76Å; M941-Q945 WeakPolarHBondContact O-CG 3.26Å; M941-Q945 PolarHBondContact O-N 2.82Å; M941-R957 HydrophobicContact CE-CG 4.13Å; M941-D959 HydrophobicContact CE-CB 4.11Å; M941-D959 HydrophobicContact SD-CB 4.15Å; M941-L985 HydrophobicContact CB-CD2 3.93Å; M941-L985 HydrophobicContact CB-CG 4.35Å; M941-L985 HydrophobicContact CE-CD2 4.43Å; M941-L985 HydrophobicContact CE-CG 3.85Å; M941-L985 HydrophobicContact CG-CD1 4.45Å; M941-L985 HydrophobicContact CG-CD2 4.42Å; M941-L985 HydrophobicContact CG-CG 4.32Å; M941-L985 VanDerWaalsContact O-CD2 3.26Å; M941-L985 WeakPolarHBondContact O-CD2 3.45Å
942	T	92.7	Very high	92.5	Very high	58 Å²	58	35.6 Å²	35.6	36%	0.356	19%	0.185	S	C	.	.	H	α-helix	trans	-71.9	-49.1	173.3	-53.6	0	0	0	0	110.7	S939 L940 M944 Q945 D946 R957	S939-T942 WeakPolarHBondContact O-CB 3.23Å; S939-T942 PolarHBondContact O-N 3.5Å; L940-T942 PolarHBondContact O-N 3.17Å; T942-M944 PolarHBondContact O-N 3.2Å; T942-M944 VanDerWaalsContact O-N 3.1Å; T942-Q945 WeakPolarHBondContact O-CA 3.44Å; T942-Q945 VanDerWaalsContact O-CB 3.29Å; T942-Q945 WeakPolarHBondContact O-CB 3.24Å; T942-Q945 PolarHBondContact O-N 3.04Å; T942-D946 VanDerWaalsContact O-CG 3.31Å; T942-D946 PolarHBondContact O-N 3Å; T942-D946 VanDerWaalsContact O-N 3.12Å; T942-R957 PolarHBondContact OG1-NH1 3.1Å
943	I	92.9	Very high	92.4	Very high	14 Å²	14	36.3 Å²	36.3	7%	0.072	19%	0.187	C	C	.	.	H	α-helix	trans	-54.6	-34.5	176	-55.5	176.3	0	0	0	111.8	H868 F870 M871 L907 F914 S939 L940 D946 Y947	H868-I943 HydrophobicContact CB-CD1 4.1Å; F870-I943 HydrophobicContact CB-CD1 4.31Å; M871-I943 HydrophobicContact CG-CD1 3.86Å; M871-I943 HydrophobicContact SD-CD1 3.71Å; L907-I943 HydrophobicContact CD1-CG2 3.8Å; F914-I943 HydrophobicContact CE1-CG2 4.01Å; F914-I943 HydrophobicContact CZ-CB 4.31Å; F914-I943 HydrophobicContact CZ-CG2 3.73Å; S939-I943 PolarHBondContact O-N 3.47Å; L940-I943 PolarHBondContact O-N 3.44Å; I943-D946 WeakPolarHBondContact CA-OD2 3.41Å; I943-Y947 PolarHBondContact O-N 3.01Å
944	M	93.9	Very high	92.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-69.4	-35.5	172.9	-72.1	-169.1	-173.4	0	0	114.1	F914 I933 C935 L940 T942 Y947 F948 L985 F1006	F914-M944 HydrophobicContact CE1-CG 4.1Å; F914-M944 HydrophobicContact CZ-CG 3.72Å; I933-M944 HydrophobicContact CG2-CE 4.31Å; I933-M944 HydrophobicContact CG2-SD 3.87Å; C935-M944 VanDerWaalsContact SG-CE 3.55Å; C935-M944 VanDerWaalsContact SG-SD 3.62Å; L940-M944 HydrophobicContact CD1-CE 4.24Å; L940-M944 HydrophobicContact CD2-CE 4.11Å; L940-M944 HydrophobicContact CG-CE 4.01Å; L940-M944 WeakPolarHBondContact O-CG 3.37Å; L940-M944 PolarHBondContact O-N 2.68Å; T942-M944 PolarHBondContact O-N 3.2Å; T942-M944 VanDerWaalsContact O-N 3.1Å; M944-Y947 PolarHBondContact O-N 2.76Å; M944-F948 HydrophobicContact CB-CE2 3.91Å; M944-F948 HydrophobicContact CB-CZ 3.93Å; M944-F948 HydrophobicContact CG-CZ 4.47Å; M944-F948 WeakPolarHBondContact O-CD1 3.38Å; M944-F948 WeakPolarHBondContact O-CD2 3.44Å; M944-F948 WeakPolarHBondContact O-CG 3.21Å; M944-F948 PolarHBondContact O-N 2.99Å; M944-F948 HydrophobicContact SD-CZ 4.34Å; M944-L985 HydrophobicContact CB-CD1 4.39Å; M944-L985 HydrophobicContact CB-CD2 4.08Å; M944-L985 HydrophobicContact SD-CD1 3.52Å; M944-L985 VanDerWaalsContact SD-CD1 3.52Å; M944-F1006 HydrophobicContact CE-CB 3.85Å; M944-F1006 HydrophobicContact CE-CD1 3.71Å; M944-F1006 HydrophobicContact CE-CD2 3.24Å; M944-F1006 HydrophobicContact CE-CE1 3.98Å; M944-F1006 HydrophobicContact CE-CE2 3.54Å; M944-F1006 HydrophobicContact CE-CG 3.31Å; M944-F1006 HydrophobicContact CE-CZ 3.9Å
945	Q	93.6	Very high	92.4	Very high	43 Å²	43	44.6 Å²	44.6	20%	0.201	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-49.6	173.2	-70.5	-177	-114.9	0	0	110.3	M941 T942 Y947 F948 D949 Y955 L985	M941-Q945 WeakPolarHBondContact O-CG 3.26Å; M941-Q945 PolarHBondContact O-N 2.82Å; T942-Q945 WeakPolarHBondContact O-CA 3.44Å; T942-Q945 VanDerWaalsContact O-CB 3.29Å; T942-Q945 WeakPolarHBondContact O-CB 3.24Å; T942-Q945 PolarHBondContact O-N 3.04Å; Q945-Y947 PolarHBondContact O-N 2.72Å; Q945-F948 CarbonylContact O-C 3.55Å; Q945-F948 PolarHBondContact O-N 3.37Å; Q945-D949 WeakPolarHBondContact O-CB 3.28Å; Q945-D949 PolarHBondContact O-N 2.72Å; Q945-Y955 HydrophobicContact CB-CE2 4.34Å; Q945-Y955 WeakPolarHBondContact CB-OH 3.46Å; Q945-Y955 HydrophobicContact CG-CD2 4.43Å; Q945-Y955 HydrophobicContact CG-CE2 3.6Å; Q945-Y955 PolarHBondContact NE2-OH 3.25Å; Q945-L985 HydrophobicContact CG-CD2 4.24Å
946	D	92.1	Very high	92.4	Very high	59 Å²	59	45.7 Å²	45.7	32%	0.316	23%	0.225	S	C	.	.	H	α-helix	trans	-55.3	-39	179.9	-48.2	-36.6	0	0	0	111.1	L907 T942 I943 Y950	L907-D946 HydrophobicContact CD2-CB 4.06Å; T942-D946 VanDerWaalsContact O-CG 3.31Å; T942-D946 PolarHBondContact O-N 3Å; T942-D946 VanDerWaalsContact O-N 3.12Å; I943-D946 WeakPolarHBondContact CA-OD2 3.41Å; D946-Y950 WeakPolarHBondContact O-CB 3.34Å; D946-Y950 PolarHBondContact O-N 3.5Å; D946-Y950 VanDerWaalsContact O-N 3.1Å
947	Y	93.5	Very high	92.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-70.5	-42	173	172.6	-97.2	0	0	0	114	Y908 F914 D918 L921 I943 M944 Q945 Y950 R951 F953	Y908-Y947 HydrophobicContact CD1-CE2 4.38Å; F914-Y947 HydrophobicContact CD1-CD1 4.47Å; F914-Y947 HydrophobicContact CD1-CD2 4.36Å; F914-Y947 HydrophobicContact CD1-CG 4.04Å; F914-Y947 HydrophobicContact CE1-CG 4.33Å; D918-Y947 WeakPolarHBondContact CA-OH 3.45Å; D918-Y947 HydrophobicContact CB-CE2 4.41Å; D918-Y947 WeakPolarHBondContact CB-OH 3.37Å; D918-Y947 PolarHBondContact OD1-OH 3.15Å; L921-Y947 HydrophobicContact CD1-CE1 4.09Å; I943-Y947 PolarHBondContact O-N 3.01Å; M944-Y947 PolarHBondContact O-N 2.76Å; Q945-Y947 PolarHBondContact O-N 2.72Å; Y947-Y950 HydrophobicContact CD2-CD1 4.45Å; Y947-Y950 PolarHBondContact O-N 2.86Å; Y947-R951 HydrophobicContact CE1-CG 4.24Å; Y947-R951 HydrophobicContact CE2-CG 3.82Å; Y947-R951 PolarHBondContact O-N 2.92Å; Y947-F953 HydrophobicContact CE1-CE2 4.44Å
948	F	94.1	Very high	92.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.3	-36.3	178.1	-61.2	-26.5	0	0	0	112.5	L921 I933 M944 Q945 R951 N952 F953 Y955 I983 L985	L921-F948 HydrophobicContact CD1-CD1 4.44Å; L921-F948 HydrophobicContact CD1-CE1 3.88Å; I933-F948 HydrophobicContact CD1-CE1 4.2Å; I933-F948 HydrophobicContact CD1-CE2 4.46Å; I933-F948 HydrophobicContact CD1-CZ 3.6Å; M944-F948 HydrophobicContact CB-CE2 3.91Å; M944-F948 HydrophobicContact CB-CZ 3.93Å; M944-F948 HydrophobicContact CG-CZ 4.47Å; M944-F948 WeakPolarHBondContact O-CD1 3.38Å; M944-F948 WeakPolarHBondContact O-CD2 3.44Å; M944-F948 WeakPolarHBondContact O-CG 3.21Å; M944-F948 PolarHBondContact O-N 2.99Å; M944-F948 HydrophobicContact SD-CZ 4.34Å; Q945-F948 CarbonylContact O-C 3.55Å; Q945-F948 PolarHBondContact O-N 3.37Å; F948-R951 CarbonylContact O-C 3.51Å; F948-R951 PolarHBondContact O-N 3.38Å; F948-N952 WeakPolarHBondContact O-CA 3.39Å; F948-N952 PolarHBondContact O-N 2.68Å; F948-F953 HydrophobicContact CB-CB 4.27Å; F948-F953 HydrophobicContact CD1-CD2 4.1Å; F948-F953 PolarHBondContact O-N 2.94Å; F948-Y955 HydrophobicContact CB-CD1 3.52Å; F948-Y955 HydrophobicContact CB-CE1 3.79Å; F948-Y955 HydrophobicContact CB-CG 4.5Å; F948-Y955 AromaticContact CD2-CD1 3.77Å; F948-Y955 HydrophobicContact CD2-CD1 3.77Å; F948-Y955 HydrophobicContact CD2-CE1 4.37Å; F948-Y955 AromaticContact CD2-CG 3.95Å; F948-Y955 HydrophobicContact CD2-CG 3.95Å; F948-Y955 HydrophobicContact CG-CD1 4.11Å; F948-I983 HydrophobicContact CD1-CD1 3.88Å; F948-I983 HydrophobicContact CD2-CD1 4.41Å; F948-I983 HydrophobicContact CE1-CD1 3.81Å; F948-I983 HydrophobicContact CE2-CD1 4.33Å; F948-I983 HydrophobicContact CE2-CG2 3.94Å; F948-I983 HydrophobicContact CG-CD1 4.22Å; F948-I983 HydrophobicContact CZ-CD1 4.07Å; F948-I983 HydrophobicContact CZ-CG2 4.22Å; F948-L985 HydrophobicContact CE2-CB 4.49Å; F948-L985 HydrophobicContact CE2-CD1 4.42Å; F948-L985 HydrophobicContact CE2-CD2 4.19Å
949	D	92.1	Very high	92.4	Very high	88 Å²	88	43.1 Å²	43.1	47%	0.471	21%	0.205	S	C	.	.	H	α-helix	trans	-69.4	-42.5	175.8	-72.9	-51.7	0	0	0	110.3	Q945 R951 N952 Y955	Q945-D949 WeakPolarHBondContact O-CB 3.28Å; Q945-D949 PolarHBondContact O-N 2.72Å; D949-R951 PolarHBondContact O-N 3.31Å; D949-N952 PolarHBondContact O-N 3.49Å; D949-N952 VanDerWaalsContact O-N 3.11Å; D949-N952 PolarHBondContact O-ND2 2.9Å; D949-Y955 WeakPolarHBondContact OD2-CE1 3.45Å; D949-Y955 PolarHBondContact OD2-OH 3.17Å
950	Y	90.5	Very high	92	Very high	88 Å²	88	43.4 Å²	43.4	35%	0.345	22%	0.218	S	C	.	.	H	α-helix	trans	-55.4	-45.9	168.2	165.9	-116.5	0	0	0	112.7	Y908 D946 Y947 N952	Y908-Y950 HydrophobicContact CD1-CE1 4.45Å; Y908-Y950 HydrophobicContact CE1-CE1 4.5Å; D946-Y950 WeakPolarHBondContact O-CB 3.34Å; D946-Y950 PolarHBondContact O-N 3.5Å; D946-Y950 VanDerWaalsContact O-N 3.1Å; Y947-Y950 HydrophobicContact CD2-CD1 4.45Å; Y947-Y950 PolarHBondContact O-N 2.86Å; Y950-N952 VanDerWaalsContact C-N 3.3Å; Y950-N952 PolarHBondContact O-N 3.48Å; Y950-N952 PolarHBondContact O-ND2 3.09Å
951	R	90.1	Very high	91.5	Very high	88 Å²	88	49.2 Å²	49.2	33%	0.332	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-0.4	177.5	-74.6	-56.8	-161.3	175.3	2.8	115	D918 Y947 F948 D949 F953	D918-R951 IonicContact OD1-CZ 3.49Å; D918-R951 IonicContact OD1-NE 3.88Å; D918-R951 PolarHBondContact OD1-NE 2.81Å; D918-R951 IonicContact OD1-NH2 2.88Å; D918-R951 PolarHBondContact OD1-NH2 3.47Å; D918-R951 IonicContact OD2-CZ 2.76Å; D918-R951 IonicContact OD2-NH2 2.64Å; D918-R951 PolarHBondContact OD2-NH2 2.77Å; Y947-R951 HydrophobicContact CE1-CG 4.24Å; Y947-R951 HydrophobicContact CE2-CG 3.82Å; Y947-R951 PolarHBondContact O-N 2.92Å; F948-R951 CarbonylContact O-C 3.51Å; F948-R951 PolarHBondContact O-N 3.38Å; D949-R951 PolarHBondContact O-N 3.31Å; R951-F953 VanDerWaalsContact C-N 3.34Å; R951-F953 HydrophobicContact CB-CD2 3.71Å; R951-F953 HydrophobicContact CB-CE1 4.38Å; R951-F953 HydrophobicContact CB-CE2 3.54Å; R951-F953 HydrophobicContact CB-CG 4.2Å; R951-F953 HydrophobicContact CB-CZ 3.92Å; R951-F953 HydrophobicContact CG-CE2 4.08Å; R951-F953 HydrophobicContact CG-CZ 4.45Å; R951-F953 PolarHBondContact O-N 3.19Å
952	N	92	Very high	91	Very high	131 Å²	131	50.2 Å²	50.2	70%	0.701	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	48.5	-177.7	-68.9	-107.4	0	0	0	112.6	K925 F948 D949 Y950	K925-N952 PolarHBondContact NZ-O 3.23Å; F948-N952 WeakPolarHBondContact O-CA 3.39Å; F948-N952 PolarHBondContact O-N 2.68Å; D949-N952 PolarHBondContact O-N 3.49Å; D949-N952 VanDerWaalsContact O-N 3.11Å; D949-N952 PolarHBondContact O-ND2 2.9Å; Y950-N952 VanDerWaalsContact C-N 3.3Å; Y950-N952 PolarHBondContact O-N 3.48Å; Y950-N952 PolarHBondContact O-ND2 3.09Å
953	F	93.1	Very high	90.3	Very high	14 Å²	14	56 Å²	56	6%	0.061	27%	0.274	C	S	.	.			trans	-97.8	128.1	171.3	-63.2	-35	0	0	0	110.3	L921 P922 K925 Y947 F948 R951 Y955 F982 I983	L921-F953 HydrophobicContact CB-CE2 3.71Å; L921-F953 HydrophobicContact CB-CZ 3.95Å; L921-F953 HydrophobicContact CD1-CD2 4.32Å; L921-F953 HydrophobicContact CD1-CE2 3.98Å; L921-F953 HydrophobicContact CG-CE2 4.5Å; P922-F953 HydrophobicContact CG-CZ 4.49Å; K925-F953 HydrophobicContact CD-CD1 3.73Å; K925-F953 HydrophobicContact CD-CE1 3.68Å; Y947-F953 HydrophobicContact CE1-CE2 4.44Å; F948-F953 HydrophobicContact CB-CB 4.27Å; F948-F953 HydrophobicContact CD1-CD2 4.1Å; F948-F953 PolarHBondContact O-N 2.94Å; R951-F953 VanDerWaalsContact C-N 3.34Å; R951-F953 HydrophobicContact CB-CD2 3.71Å; R951-F953 HydrophobicContact CB-CE1 4.38Å; R951-F953 HydrophobicContact CB-CE2 3.54Å; R951-F953 HydrophobicContact CB-CG 4.2Å; R951-F953 HydrophobicContact CB-CZ 3.92Å; R951-F953 HydrophobicContact CG-CE2 4.08Å; R951-F953 HydrophobicContact CG-CZ 4.45Å; R951-F953 PolarHBondContact O-N 3.19Å; F953-Y955 WeakPolarHBondContact O-CD1 3.49Å; F953-Y955 PolarHBondContact O-N 3.12Å; F953-F982 HydrophobicContact CB-CD1 4.24Å; F953-F982 HydrophobicContact CD1-CD1 4.14Å; F953-F982 HydrophobicContact CD1-CE1 4.22Å; F953-F982 HydrophobicContact CE1-CE1 4.41Å; F953-F982 HydrophobicContact CG-CD1 4.17Å; F953-F982 HydrophobicContact CG-CE1 4.31Å; F953-I983 HydrophobicContact CB-CD1 4.07Å; F953-I983 HydrophobicContact CD2-CD1 4.16Å; F953-I983 HydrophobicContact CG-CD1 4.38Å
954	R	93.9	Very high	89.1	Confident	124 Å²	124	60 Å²	60	47%	0.468	30%	0.303	S	S	.	.			trans	-81	119.9	177.1	-59.9	-150.9	-67.6	132.8	-18.1	110.6	D980 F982 I983	R954-D980 IonicContact CZ-OD2 3.42Å; R954-D980 VanDerWaalsContact CZ-OD2 3.24Å; R954-D980 PolarHBondContact NE-O 2.95Å; R954-D980 IonicContact NE-OD2 3.82Å; R954-D980 PolarHBondContact NE-OD2 3.41Å; R954-D980 VanDerWaalsContact NH2-CG 3.34Å; R954-D980 PolarHBondContact NH2-O 3.34Å; R954-D980 IonicContact NH2-OD2 3.96Å; R954-D980 PolarHBondContact NH2-OD2 3.12Å; R954-F982 PolarHBondContact O-N 3.35Å; R954-I983 PolarHBondContact O-N 3.49Å
955	Y	94.2	Very high	88.1	Confident	50 Å²	50	66.8 Å²	66.8	20%	0.196	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	163.2	-175.2	64.5	-96.5	0	0	0	113.4	Q945 F948 D949 F953 I983	Q945-Y955 HydrophobicContact CB-CE2 4.34Å; Q945-Y955 WeakPolarHBondContact CB-OH 3.46Å; Q945-Y955 HydrophobicContact CG-CD2 4.43Å; Q945-Y955 HydrophobicContact CG-CE2 3.6Å; Q945-Y955 PolarHBondContact NE2-OH 3.25Å; F948-Y955 HydrophobicContact CB-CD1 3.52Å; F948-Y955 HydrophobicContact CB-CE1 3.79Å; F948-Y955 HydrophobicContact CB-CG 4.5Å; F948-Y955 AromaticContact CD2-CD1 3.77Å; F948-Y955 HydrophobicContact CD2-CD1 3.77Å; F948-Y955 HydrophobicContact CD2-CE1 4.37Å; F948-Y955 AromaticContact CD2-CG 3.95Å; F948-Y955 HydrophobicContact CD2-CG 3.95Å; F948-Y955 HydrophobicContact CG-CD1 4.11Å; D949-Y955 WeakPolarHBondContact OD2-CE1 3.45Å; D949-Y955 PolarHBondContact OD2-OH 3.17Å; F953-Y955 WeakPolarHBondContact O-CD1 3.49Å; F953-Y955 PolarHBondContact O-N 3.12Å; Y955-I983 CarbonylContact C-O 3.52Å; Y955-I983 WeakPolarHBondContact CA-O 3.29Å
956	L	93.6	Very high	87.5	Confident	24 Å²	24	67.6 Å²	67.6	13%	0.126	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	151.5	161.6	-63.9	179.3	0	0	0	110.4	L970 K973 F974 I981 I983 F984 L985	L956-L970 HydrophobicContact CD1-CD2 4.28Å; L956-L970 HydrophobicContact CD2-CD2 4.01Å; L956-K973 HydrophobicContact CD1-CB 4.34Å; L956-F974 HydrophobicContact CD1-CB 4.02Å; L956-I981 HydrophobicContact CD1-CD1 3.95Å; L956-I981 HydrophobicContact CD1-CG2 4.47Å; L956-I981 HydrophobicContact CD2-CD1 4.1Å; L956-I981 HydrophobicContact CG-CD1 3.98Å; L956-I981 HydrophobicContact CG-CG2 4.09Å; L956-I983 PolarHBondContact N-O 3.07Å; L956-F984 HydrophobicContact CB-CD2 3.77Å; L956-F984 HydrophobicContact CB-CE2 3.72Å; L956-F984 HydrophobicContact CB-CG 4.28Å; L956-F984 HydrophobicContact CB-CZ 4.21Å; L956-F984 HydrophobicContact CD1-CE1 4.34Å; L956-F984 HydrophobicContact CD1-CZ 4.34Å; L956-F984 WeakPolarHBondContact O-CD2 3.23Å; L956-L985 WeakPolarHBondContact O-CB 3.36Å; L956-L985 PolarHBondContact O-N 3.47Å
957	R	92.7	Very high	86.9	Confident	62 Å²	62	66.8 Å²	66.8	23%	0.234	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.2	175.6	174.5	169.5	170.8	154	4.7	111.1	T938 M941 T942 D959 L985	T938-R957 PolarHBondContact O-NH2 3.13Å; M941-R957 HydrophobicContact CE-CG 4.13Å; T942-R957 PolarHBondContact OG1-NH1 3.1Å; R957-D959 IonicContact CZ-OD2 3.57Å; R957-D959 IonicContact NE-OD2 3.35Å; R957-D959 PolarHBondContact NE-OD2 2.99Å; R957-D959 IonicContact NH2-OD2 2.82Å; R957-D959 PolarHBondContact NH2-OD2 2.93Å; R957-L985 WeakPolarHBondContact CA-O 3.47Å
958	L	89.6	Confident	86	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	118.2	173.1	-176.4	168.3	0	0	0	110.7	R967 F984 L985 L986 S987 A990 L995	L958-R967 HydrophobicContact CD1-CB 4.37Å; L958-R967 HydrophobicContact CD1-CG 4.01Å; L958-R967 HydrophobicContact CG-CG 4.18Å; L958-F984 HydrophobicContact CB-CE2 3.54Å; L958-F984 HydrophobicContact CB-CZ 3.98Å; L958-F984 HydrophobicContact CD1-CE2 4.35Å; L958-F984 HydrophobicContact CD1-CZ 3.94Å; L958-L985 PolarHBondContact N-O 3.03Å; L958-L986 HydrophobicContact CB-CD2 4.03Å; L958-L986 HydrophobicContact CD1-CD2 4.31Å; L958-L986 HydrophobicContact CD2-CD2 4.25Å; L958-L986 HydrophobicContact CG-CD2 4.43Å; L958-S987 PolarHBondContact O-N 3.01Å; L958-A990 HydrophobicContact CD2-CB 3.66Å; L958-L995 HydrophobicContact CD1-CD1 3.81Å; L958-L995 HydrophobicContact CD1-CD2 4.39Å; L958-L995 HydrophobicContact CD2-CD1 4.35Å
959	D	89.3	Confident	85.6	Confident	4 Å²	4	74.5 Å²	74.5	2%	0.021	38%	0.38	C	S	.	.			trans	-135.4	-155.1	-176.3	66.1	37.3	0	0	0	112.9	T938 M941 R957 T961 T962 R967 A990	T938-D959 HydrophobicContact CG2-CB 4.23Å; M941-D959 HydrophobicContact CE-CB 4.11Å; M941-D959 HydrophobicContact SD-CB 4.15Å; R957-D959 IonicContact CZ-OD2 3.57Å; R957-D959 IonicContact NE-OD2 3.35Å; R957-D959 PolarHBondContact NE-OD2 2.99Å; R957-D959 IonicContact NH2-OD2 2.82Å; R957-D959 PolarHBondContact NH2-OD2 2.93Å; D959-T961 VanDerWaalsContact C-N 3.34Å; D959-T961 WeakPolarHBondContact OD1-CB 3.48Å; D959-T961 PolarHBondContact OD1-N 3.41Å; D959-T961 PolarHBondContact OD1-OG1 3.37Å; D959-T962 PolarHBondContact N-OG1 3.42Å; D959-R967 PolarHBondContact O-NH2 2.77Å; D959-A990 WeakPolarHBondContact O-CB 3.42Å
960	G	81.2	Confident	85.3	Confident	65 Å²	65	71.9 Å²	71.9	67%	0.67	37%	0.365	S	S	*	.	S	Bend	trans	-71.1	-24.7	178.1	0	0	0	0	0	114.4
961	T	83.7	Confident	84.8	Confident	121 Å²	121	69.2 Å²	69.2	74%	0.742	36%	0.357	S	S	*	.	S	Bend	trans	-84.8	-32	-173.8	69.1	0	0	0	0	113.1	D959 R963	D959-T961 VanDerWaalsContact C-N 3.34Å; D959-T961 WeakPolarHBondContact OD1-CB 3.48Å; D959-T961 PolarHBondContact OD1-N 3.41Å; D959-T961 PolarHBondContact OD1-OG1 3.37Å; T961-R963 PolarHBondContact O-N 2.85Å
962	T	81.5	Confident	84.5	Confident	21 Å²	21	69.7 Å²	69.7	13%	0.129	37%	0.37	C	S	.	.	S	Bend	trans	-54.4	126	180	-39.3	0	0	0	0	111	D959 D966 R967 L970	D959-T962 PolarHBondContact N-OG1 3.42Å; T962-D966 HydrophobicContact CG2-CB 4.31Å; T962-R967 HydrophobicContact CG2-CG 3.85Å; T962-R967 VanDerWaalsContact O-CZ 3.26Å; T962-R967 PolarHBondContact O-NE 3.42Å; T962-R967 PolarHBondContact O-NH2 2.78Å; T962-L970 HydrophobicContact CG2-CD1 3.71Å
963	R	77.8	Confident	84.3	Confident	179 Å²	179	67.5 Å²	67.5	68%	0.675	35%	0.354	S	S	*	.			trans	-71.3	158.8	-174	-47.8	169.8	171.1	-177.1	0.1	110.5	T961 E965 D966 R967	T961-R963 PolarHBondContact O-N 2.85Å; R963-E965 PolarHBondContact O-N 3.33Å; R963-D966 WeakPolarHBondContact CB-OD1 3.41Å; R963-D966 WeakPolarHBondContact CB-OD2 3.4Å; R963-D966 VanDerWaalsContact CG-OD2 3.24Å; R963-D966 WeakPolarHBondContact CG-OD2 3.42Å; R963-D966 PolarHBondContact N-OD2 3.16Å; R963-D966 PolarHBondContact O-N 3.22Å; R963-R967 VanDerWaalsContact O-CG 3.28Å; R963-R967 WeakPolarHBondContact O-CG 3.49Å; R963-R967 PolarHBondContact O-N 2.93Å
964	S	68.8	Low	84.1	Confident	98 Å²	98	66.8 Å²	66.8	69%	0.685	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-15.2	-175.5	-53.1	0	0	0	0	114.6
965	E	73	Confident	83.6	Confident	144 Å²	144	63.5 Å²	63.5	67%	0.673	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-55.9	173.9	-78.2	128.7	-148.7	0	0	110.2	R963 R967 G968	R963-E965 PolarHBondContact O-N 3.33Å; E965-R967 PolarHBondContact O-N 2.73Å; E965-R967 VanDerWaalsContact O-N 3.1Å; E965-G968 PolarHBondContact O-N 3.43Å
966	D	81.2	Confident	83.2	Confident	59 Å²	59	64.2 Å²	64.2	32%	0.316	35%	0.349	S	S	.	.	H	α-helix	trans	-53.4	-34.4	178.9	-16.2	-32.3	0	0	0	113.3	T962 R963 G968 E969 L970	T962-D966 HydrophobicContact CG2-CB 4.31Å; R963-D966 WeakPolarHBondContact CB-OD1 3.41Å; R963-D966 WeakPolarHBondContact CB-OD2 3.4Å; R963-D966 VanDerWaalsContact CG-OD2 3.24Å; R963-D966 WeakPolarHBondContact CG-OD2 3.42Å; R963-D966 PolarHBondContact N-OD2 3.16Å; R963-D966 PolarHBondContact O-N 3.22Å; D966-G968 PolarHBondContact O-N 2.84Å; D966-E969 PolarHBondContact O-N 3.21Å; D966-E969 VanDerWaalsContact O-N 3.12Å; D966-L970 WeakPolarHBondContact O-CG 3.19Å; D966-L970 PolarHBondContact O-N 3.05Å
967	R	79.2	Confident	82.4	Confident	43 Å²	43	69.1 Å²	69.1	16%	0.162	38%	0.38	C	S	.	.	H	α-helix	trans	-54.4	-36.3	173.6	-73.6	171.7	-160.3	-114.8	-8.7	112.9	L958 D959 T962 R963 E965 L971	L958-R967 HydrophobicContact CD1-CB 4.37Å; L958-R967 HydrophobicContact CD1-CG 4.01Å; L958-R967 HydrophobicContact CG-CG 4.18Å; D959-R967 PolarHBondContact O-NH2 2.77Å; T962-R967 HydrophobicContact CG2-CG 3.85Å; T962-R967 VanDerWaalsContact O-CZ 3.26Å; T962-R967 PolarHBondContact O-NE 3.42Å; T962-R967 PolarHBondContact O-NH2 2.78Å; R963-R967 VanDerWaalsContact O-CG 3.28Å; R963-R967 WeakPolarHBondContact O-CG 3.49Å; R963-R967 PolarHBondContact O-N 2.93Å; E965-R967 PolarHBondContact O-N 2.73Å; E965-R967 VanDerWaalsContact O-N 3.1Å; R967-L971 WeakPolarHBondContact O-CG 3.43Å; R967-L971 PolarHBondContact O-N 3.46Å
968	G	75.4	Confident	81.9	Confident	37 Å²	37	70.8 Å²	70.8	38%	0.381	40%	0.402	S	S	.	.	H	α-helix	trans	-66.6	-41.3	178.4	0	0	0	0	0	111.9	E965 D966 L971 V972	E965-G968 PolarHBondContact O-N 3.43Å; D966-G968 PolarHBondContact O-N 2.84Å; G968-L971 PolarHBondContact O-N 3.21Å; G968-V972 WeakPolarHBondContact O-CG2 3.33Å; G968-V972 PolarHBondContact O-N 2.82Å; G968-V972 VanDerWaalsContact O-N 3.13Å
969	E	83.7	Confident	81.2	Confident	125 Å²	125	73.9 Å²	73.9	58%	0.584	42%	0.416	S	S	*	.	H	α-helix	trans	-67.8	-43.4	178.2	-59.9	-177.4	-172.6	0	0	111.6	D966 L971 V972 K973	D966-E969 PolarHBondContact O-N 3.21Å; D966-E969 VanDerWaalsContact O-N 3.12Å; E969-L971 VanDerWaalsContact C-N 3.28Å; E969-L971 PolarHBondContact O-N 3.11Å; E969-V972 PolarHBondContact O-N 3.13Å; E969-V972 VanDerWaalsContact O-N 3.11Å; E969-K973 WeakPolarHBondContact O-CG 3.48Å; E969-K973 PolarHBondContact O-N 3.44Å
970	L	86.3	Confident	81.1	Confident	33 Å²	33	78.4 Å²	78.4	17%	0.173	44%	0.44	C	S	.	.	H	α-helix	trans	-59.8	-36.6	175.2	-66.8	171.2	0	0	0	112.5	L956 T962 D966 F974 F984	L956-L970 HydrophobicContact CD1-CD2 4.28Å; L956-L970 HydrophobicContact CD2-CD2 4.01Å; T962-L970 HydrophobicContact CG2-CD1 3.71Å; D966-L970 WeakPolarHBondContact O-CG 3.19Å; D966-L970 PolarHBondContact O-N 3.05Å; L970-F974 WeakPolarHBondContact O-CB 3.48Å; L970-F974 PolarHBondContact O-N 3.21Å; L970-F984 HydrophobicContact CB-CZ 4.1Å
971	L	80.7	Confident	81.6	Confident	31 Å²	31	75.7 Å²	75.7	16%	0.162	41%	0.41	C	S	.	.	H	α-helix	trans	-67.9	-38.7	173.3	-70.5	-178.7	0	0	0	112.9	R967 G968 E969 N975 F984 L995 L997	R967-L971 WeakPolarHBondContact O-CG 3.43Å; R967-L971 PolarHBondContact O-N 3.46Å; G968-L971 PolarHBondContact O-N 3.21Å; E969-L971 VanDerWaalsContact C-N 3.28Å; E969-L971 PolarHBondContact O-N 3.11Å; L971-N975 WeakPolarHBondContact O-CB 3.23Å; L971-N975 PolarHBondContact O-N 2.86Å; L971-N975 PolarHBondContact O-ND2 2.95Å; L971-F984 HydrophobicContact CD2-CE1 4.31Å; L971-L995 HydrophobicContact CD1-CB 4.25Å; L971-L995 HydrophobicContact CD1-CD2 3.87Å; L971-L995 HydrophobicContact CD2-CB 3.93Å; L971-L995 HydrophobicContact CD2-CD1 4.23Å; L971-L995 HydrophobicContact CD2-CD2 4.23Å; L971-L995 HydrophobicContact CD2-CG 4.34Å; L971-L995 HydrophobicContact CG-CD2 4.32Å; L971-L997 HydrophobicContact CD2-CD2 3.48Å; L971-L997 VanDerWaalsContact CD2-CD2 3.48Å; L971-L997 HydrophobicContact CD2-CG 4.21Å
972	V	83.9	Confident	82	Confident	99 Å²	99	70.4 Å²	70.4	60%	0.6	38%	0.377	S	S	*	.	H	α-helix	trans	-64.2	-49.1	177.2	172.5	0	0	0	0	109.5	G968 E969 F974 N975 D976	G968-V972 WeakPolarHBondContact O-CG2 3.33Å; G968-V972 PolarHBondContact O-N 2.82Å; G968-V972 VanDerWaalsContact O-N 3.13Å; E969-V972 PolarHBondContact O-N 3.13Å; E969-V972 VanDerWaalsContact O-N 3.11Å; V972-F974 VanDerWaalsContact C-N 3.35Å; V972-F974 PolarHBondContact O-N 2.82Å; V972-N975 PolarHBondContact O-N 3.22Å; V972-D976 PolarHBondContact O-N 2.92Å
973	K	88	Confident	82.7	Confident	84 Å²	84	69.4 Å²	69.4	37%	0.365	37%	0.371	S	S	.	.	H	α-helix	trans	-55.7	-45.4	176.7	-66.9	-179.4	179.7	176.9	0	112.8	L956 E969 D976 E979 I981	L956-K973 HydrophobicContact CD1-CB 4.34Å; E969-K973 WeakPolarHBondContact O-CG 3.48Å; E969-K973 PolarHBondContact O-N 3.44Å; K973-D976 PolarHBondContact O-N 2.78Å; K973-E979 WeakPolarHBondContact CG-OE1 3.16Å; K973-I981 HydrophobicContact CB-CD1 4.32Å
974	F	88	Confident	83.4	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-70.4	-30.7	179	-171.1	-101.3	0	0	0	114.5	R930 L932 L956 L970 V972 I981 F984 L997 A999 A1000	R930-F974 HydrophobicContact CB-CZ 4.15Å; R930-F974 PolarHBondContact NH1-O 2.69Å; L932-F974 HydrophobicContact CD2-CE1 3.79Å; L932-F974 HydrophobicContact CD2-CZ 3.78Å; L956-F974 HydrophobicContact CD1-CB 4.02Å; L970-F974 WeakPolarHBondContact O-CB 3.48Å; L970-F974 PolarHBondContact O-N 3.21Å; V972-F974 VanDerWaalsContact C-N 3.35Å; V972-F974 PolarHBondContact O-N 2.82Å; F974-I981 HydrophobicContact CD2-CG2 3.86Å; F974-I981 HydrophobicContact CE2-CG2 4.21Å; F974-F984 HydrophobicContact CB-CD1 3.74Å; F974-F984 HydrophobicContact CB-CE1 3.81Å; F974-F984 AromaticContact CD1-CD1 3.84Å; F974-F984 HydrophobicContact CD1-CD1 3.84Å; F974-F984 HydrophobicContact CD2-CB 3.92Å; F974-F984 AromaticContact CD2-CD1 3.68Å; F974-F984 HydrophobicContact CD2-CD1 3.68Å; F974-F984 HydrophobicContact CD2-CG 4.15Å; F974-F984 HydrophobicContact CE1-CD1 4.4Å; F974-F984 HydrophobicContact CE2-CB 3.75Å; F974-F984 HydrophobicContact CE2-CD1 4.28Å; F974-F984 HydrophobicContact CE2-CG 4.47Å; F974-F984 HydrophobicContact CG-CB 4.44Å; F974-F984 AromaticContact CG-CD1 3.43Å; F974-F984 HydrophobicContact CG-CD1 3.43Å; F974-F984 VanDerWaalsContact CG-CD1 3.43Å; F974-F984 HydrophobicContact CG-CE1 4.04Å; F974-F984 HydrophobicContact CG-CG 4.34Å; F974-F984 HydrophobicContact CZ-CB 4.12Å; F974-L997 HydrophobicContact CD1-CD2 3.79Å; F974-L997 HydrophobicContact CE1-CD2 4.29Å; F974-A999 HydrophobicContact CE1-CB 4.41Å; F974-A1000 HydrophobicContact CE1-CB 3.87Å; F974-A1000 HydrophobicContact CZ-CB 3.93Å
975	N	84	Confident	84.6	Confident	55 Å²	55	56.2 Å²	56.2	29%	0.294	31%	0.306	S	S	.	.	H	α-helix	trans	-87.7	-9.8	177.4	-70.4	-79.8	0	0	0	112.7	L971 V972 N996 A999	L971-N975 WeakPolarHBondContact O-CB 3.23Å; L971-N975 PolarHBondContact O-N 2.86Å; L971-N975 PolarHBondContact O-ND2 2.95Å; V972-N975 PolarHBondContact O-N 3.22Å; N975-N996 PolarHBondContact ND2-O 3.33Å; N975-A999 HydrophobicContact CB-CB 4.46Å; N975-A999 PolarHBondContact OD1-N 2.86Å
976	D	85.2	Confident	85.5	Confident	64 Å²	64	49.4 Å²	49.4	34%	0.342	27%	0.274	S	S	.	.			trans	-71	134.9	169.5	-157.3	-50.1	0	0	0	109.9	R930 V972 K973 S978	R930-D976 PolarHBondContact NH1-O 3.02Å; R930-D976 PolarHBondContact NH2-O 3.22Å; V972-D976 PolarHBondContact O-N 2.92Å; K973-D976 PolarHBondContact O-N 2.78Å; D976-S978 VanDerWaalsContact OD1-CB 3.31Å; D976-S978 WeakPolarHBondContact OD1-CB 3.33Å; D976-S978 PolarHBondContact OD1-N 2.86Å; D976-S978 PolarHBondContact OD1-OG 2.96Å
977	T	78.1	Confident	86	Confident	127 Å²	127	47 Å²	47	78%	0.779	26%	0.262	S	S	*	.	S	Bend	trans	-90.8	-10.1	178.2	49.9	0	0	0	0	113
978	S	80.5	Confident	86.3	Confident	98 Å²	98	45 Å²	45	69%	0.685	26%	0.255	S	S	*	.	S	Bend	trans	-83.1	-25	173.7	69.9	0	0	0	0	113.3	D976 D980	D976-S978 VanDerWaalsContact OD1-CB 3.31Å; D976-S978 WeakPolarHBondContact OD1-CB 3.33Å; D976-S978 PolarHBondContact OD1-N 2.86Å; D976-S978 PolarHBondContact OD1-OG 2.96Å; S978-D980 PolarHBondContact O-N 3.14Å
979	E	76.2	Confident	86.6	Confident	65 Å²	65	50.9 Å²	50.9	30%	0.304	27%	0.266	S	S	.	.	S	Bend	trans	-81.7	109.8	169.1	-67.5	-164.1	-154.6	0	0	110.2	R930 K973 I981	R930-E979 PolarHBondContact NH2-O 3.29Å; K973-E979 WeakPolarHBondContact CG-OE1 3.16Å; E979-I981 HydrophobicContact CB-CD1 4.05Å; E979-I981 HydrophobicContact CB-CG1 4.2Å; E979-I981 PolarHBondContact O-N 3.31Å; E979-I981 VanDerWaalsContact OE2-CD1 3.3Å; E979-I981 WeakPolarHBondContact OE2-CD1 3.34Å
980	D	86.7	Confident	86.3	Confident	98 Å²	98	45.2 Å²	45.2	52%	0.524	24%	0.24	S	C	.	.			trans	-67.6	67.9	171.3	143.2	75.8	0	0	0	111.7	R954 S978	R954-D980 IonicContact CZ-OD2 3.42Å; R954-D980 VanDerWaalsContact CZ-OD2 3.24Å; R954-D980 PolarHBondContact NE-O 2.95Å; R954-D980 IonicContact NE-OD2 3.82Å; R954-D980 PolarHBondContact NE-OD2 3.41Å; R954-D980 VanDerWaalsContact NH2-CG 3.34Å; R954-D980 PolarHBondContact NH2-O 3.34Å; R954-D980 IonicContact NH2-OD2 3.96Å; R954-D980 PolarHBondContact NH2-OD2 3.12Å; S978-D980 PolarHBondContact O-N 3.14Å
981	I	90.9	Very high	85.4	Confident	8 Å²	8	43.6 Å²	43.6	4%	0.041	23%	0.232	C	C	.	.			trans	-101	124.6	171.8	-64.7	171.3	0	0	0	107.6	R930 L956 K973 F974 E979	R930-I981 PolarHBondContact NE-O 3.18Å; L956-I981 HydrophobicContact CD1-CD1 3.95Å; L956-I981 HydrophobicContact CD1-CG2 4.47Å; L956-I981 HydrophobicContact CD2-CD1 4.1Å; L956-I981 HydrophobicContact CG-CD1 3.98Å; L956-I981 HydrophobicContact CG-CG2 4.09Å; K973-I981 HydrophobicContact CB-CD1 4.32Å; F974-I981 HydrophobicContact CD2-CG2 3.86Å; F974-I981 HydrophobicContact CE2-CG2 4.21Å; E979-I981 HydrophobicContact CB-CD1 4.05Å; E979-I981 HydrophobicContact CB-CG1 4.2Å; E979-I981 PolarHBondContact O-N 3.31Å; E979-I981 VanDerWaalsContact OE2-CD1 3.3Å; E979-I981 WeakPolarHBondContact OE2-CD1 3.34Å
982	F	93.7	Very high	84.6	Confident	11 Å²	11	42.4 Å²	42.4	5%	0.048	23%	0.226	C	C	.	.			trans	-96.9	-40.9	-174.5	173.4	-130.8	0	0	0	112	L921 L924 K925 H929 V931 F953 R954	L921-F982 HydrophobicContact CB-CE1 4.35Å; L921-F982 HydrophobicContact CD2-CE1 4.15Å; L921-F982 HydrophobicContact CD2-CZ 4.17Å; L921-F982 WeakPolarHBondContact O-CZ 3.48Å; L924-F982 HydrophobicContact CB-CE2 4.16Å; L924-F982 HydrophobicContact CB-CZ 4.05Å; K925-F982 HydrophobicContact CB-CD1 4.36Å; K925-F982 HydrophobicContact CB-CD2 4.35Å; K925-F982 HydrophobicContact CB-CE1 3.89Å; K925-F982 HydrophobicContact CB-CE2 3.86Å; K925-F982 HydrophobicContact CB-CZ 3.63Å; K925-F982 HydrophobicContact CD-CD1 4.32Å; K925-F982 HydrophobicContact CD-CE1 4.47Å; K925-F982 HydrophobicContact CG-CD1 4.36Å; K925-F982 HydrophobicContact CG-CD2 4.44Å; K925-F982 HydrophobicContact CG-CE1 4.37Å; K925-F982 HydrophobicContact CG-CE2 4.45Å; K925-F982 HydrophobicContact CG-CG 4.43Å; K925-F982 HydrophobicContact CG-CZ 4.43Å; H929-F982 WeakPolarHBondContact O-CD2 3.27Å; H929-F982 WeakPolarHBondContact O-CE2 3.42Å; V931-F982 HydrophobicContact CG2-CD2 4.4Å; V931-F982 HydrophobicContact CG2-CE2 3.7Å; V931-F982 HydrophobicContact CG2-CZ 3.91Å; V931-F982 PolarHBondContact N-O 2.94Å; F953-F982 HydrophobicContact CB-CD1 4.24Å; F953-F982 HydrophobicContact CD1-CD1 4.14Å; F953-F982 HydrophobicContact CD1-CE1 4.22Å; F953-F982 HydrophobicContact CE1-CE1 4.41Å; F953-F982 HydrophobicContact CG-CD1 4.17Å; F953-F982 HydrophobicContact CG-CE1 4.31Å; R954-F982 PolarHBondContact O-N 3.35Å
983	I	94.9	Very high	83.6	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	138.7	-172.9	-64.7	170.7	0	0	0	111.4	L921 V931 I933 F948 F953 R954 Y955 L956	L921-I983 HydrophobicContact CD1-CD1 4.26Å; L921-I983 HydrophobicContact CD2-CD1 4.21Å; V931-I983 HydrophobicContact CB-CG1 4.44Å; V931-I983 CarbonylContact O-C 3.48Å; V931-I983 WeakPolarHBondContact O-CA 3.37Å; I933-I983 HydrophobicContact CD1-CD1 4.33Å; I933-I983 HydrophobicContact CD1-CG2 3.76Å; I933-I983 HydrophobicContact CG1-CG2 4.12Å; F948-I983 HydrophobicContact CD1-CD1 3.88Å; F948-I983 HydrophobicContact CD2-CD1 4.41Å; F948-I983 HydrophobicContact CE1-CD1 3.81Å; F948-I983 HydrophobicContact CE2-CD1 4.33Å; F948-I983 HydrophobicContact CE2-CG2 3.94Å; F948-I983 HydrophobicContact CG-CD1 4.22Å; F948-I983 HydrophobicContact CZ-CD1 4.07Å; F948-I983 HydrophobicContact CZ-CG2 4.22Å; F953-I983 HydrophobicContact CB-CD1 4.07Å; F953-I983 HydrophobicContact CD2-CD1 4.16Å; F953-I983 HydrophobicContact CG-CD1 4.38Å; R954-I983 PolarHBondContact O-N 3.49Å; Y955-I983 CarbonylContact C-O 3.52Å; Y955-I983 WeakPolarHBondContact CA-O 3.29Å; L956-I983 PolarHBondContact N-O 3.07Å
984	F	93.5	Very high	82.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	107.6	160.3	-151.3	154.7	0	0	0	110	V931 L932 I933 L956 L958 L970 L971 F974 L986 L997	V931-F984 PolarHBondContact O-N 2.8Å; L932-F984 HydrophobicContact CD2-CB 3.78Å; I933-F984 PolarHBondContact N-O 2.73Å; L956-F984 HydrophobicContact CB-CD2 3.77Å; L956-F984 HydrophobicContact CB-CE2 3.72Å; L956-F984 HydrophobicContact CB-CG 4.28Å; L956-F984 HydrophobicContact CB-CZ 4.21Å; L956-F984 HydrophobicContact CD1-CE1 4.34Å; L956-F984 HydrophobicContact CD1-CZ 4.34Å; L956-F984 WeakPolarHBondContact O-CD2 3.23Å; L958-F984 HydrophobicContact CB-CE2 3.54Å; L958-F984 HydrophobicContact CB-CZ 3.98Å; L958-F984 HydrophobicContact CD1-CE2 4.35Å; L958-F984 HydrophobicContact CD1-CZ 3.94Å; L970-F984 HydrophobicContact CB-CZ 4.1Å; L971-F984 HydrophobicContact CD2-CE1 4.31Å; F974-F984 HydrophobicContact CB-CD1 3.74Å; F974-F984 HydrophobicContact CB-CE1 3.81Å; F974-F984 AromaticContact CD1-CD1 3.84Å; F974-F984 HydrophobicContact CD1-CD1 3.84Å; F974-F984 HydrophobicContact CD2-CB 3.92Å; F974-F984 AromaticContact CD2-CD1 3.68Å; F974-F984 HydrophobicContact CD2-CD1 3.68Å; F974-F984 HydrophobicContact CD2-CG 4.15Å; F974-F984 HydrophobicContact CE1-CD1 4.4Å; F974-F984 HydrophobicContact CE2-CB 3.75Å; F974-F984 HydrophobicContact CE2-CD1 4.28Å; F974-F984 HydrophobicContact CE2-CG 4.47Å; F974-F984 HydrophobicContact CG-CB 4.44Å; F974-F984 AromaticContact CG-CD1 3.43Å; F974-F984 HydrophobicContact CG-CD1 3.43Å; F974-F984 VanDerWaalsContact CG-CD1 3.43Å; F974-F984 HydrophobicContact CG-CE1 4.04Å; F974-F984 HydrophobicContact CG-CG 4.34Å; F974-F984 HydrophobicContact CZ-CB 4.12Å; F984-L986 HydrophobicContact CB-CD1 3.95Å; F984-L986 HydrophobicContact CB-CG 4.42Å; F984-L986 HydrophobicContact CD1-CD1 4.4Å; F984-L986 HydrophobicContact CD2-CD1 4.15Å; F984-L986 HydrophobicContact CD2-CD2 4.02Å; F984-L986 HydrophobicContact CD2-CG 3.74Å; F984-L986 HydrophobicContact CE2-CD2 4Å; F984-L986 HydrophobicContact CE2-CG 4.23Å; F984-L986 HydrophobicContact CG-CD1 3.9Å; F984-L986 HydrophobicContact CG-CD2 4.4Å; F984-L986 HydrophobicContact CG-CG 4.03Å; F984-L986 HydrophobicContact CZ-CD2 4.35Å; F984-L997 HydrophobicContact CD1-CD2 3.65Å; F984-L997 HydrophobicContact CE1-CD2 3.77Å
985	L	93.9	Very high	81.6	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	113.8	174.8	-174.1	62.3	0	0	0	110.1	I933 M941 M944 Q945 F948 L956 R957 L958	I933-L985 HydrophobicContact CB-CD1 4.1Å; I933-L985 HydrophobicContact CG2-CD1 4Å; M941-L985 HydrophobicContact CB-CD2 3.93Å; M941-L985 HydrophobicContact CB-CG 4.35Å; M941-L985 HydrophobicContact CE-CD2 4.43Å; M941-L985 HydrophobicContact CE-CG 3.85Å; M941-L985 HydrophobicContact CG-CD1 4.45Å; M941-L985 HydrophobicContact CG-CD2 4.42Å; M941-L985 HydrophobicContact CG-CG 4.32Å; M941-L985 VanDerWaalsContact O-CD2 3.26Å; M941-L985 WeakPolarHBondContact O-CD2 3.45Å; M944-L985 HydrophobicContact CB-CD1 4.39Å; M944-L985 HydrophobicContact CB-CD2 4.08Å; M944-L985 HydrophobicContact SD-CD1 3.52Å; M944-L985 VanDerWaalsContact SD-CD1 3.52Å; Q945-L985 HydrophobicContact CG-CD2 4.24Å; F948-L985 HydrophobicContact CE2-CB 4.49Å; F948-L985 HydrophobicContact CE2-CD1 4.42Å; F948-L985 HydrophobicContact CE2-CD2 4.19Å; L956-L985 WeakPolarHBondContact O-CB 3.36Å; L956-L985 PolarHBondContact O-N 3.47Å; R957-L985 WeakPolarHBondContact CA-O 3.47Å; L958-L985 PolarHBondContact N-O 3.03Å
986	L	92.2	Very high	81.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.2	-167.2	-74.5	148.3	0	0	0	110	L932 I933 F934 C935 L958 F984 T988 L995 L997	L932-L986 HydrophobicContact CB-CD1 4.17Å; L932-L986 HydrophobicContact CD1-CD1 4.49Å; L932-L986 HydrophobicContact CD2-CD1 3.94Å; L932-L986 HydrophobicContact CG-CD1 4.42Å; I933-L986 PolarHBondContact O-N 2.93Å; F934-L986 VanDerWaalsContact CA-O 3.32Å; F934-L986 WeakPolarHBondContact CA-O 3.48Å; F934-L986 HydrophobicContact CD1-CB 3.56Å; F934-L986 HydrophobicContact CD1-CD1 4.45Å; F934-L986 HydrophobicContact CE1-CB 3.51Å; F934-L986 HydrophobicContact CE1-CD1 3.72Å; F934-L986 HydrophobicContact CE1-CG 4.14Å; F934-L986 HydrophobicContact CZ-CD1 3.97Å; C935-L986 PolarHBondContact N-O 3.44Å; L958-L986 HydrophobicContact CB-CD2 4.03Å; L958-L986 HydrophobicContact CD1-CD2 4.31Å; L958-L986 HydrophobicContact CD2-CD2 4.25Å; L958-L986 HydrophobicContact CG-CD2 4.43Å; F984-L986 HydrophobicContact CB-CD1 3.95Å; F984-L986 HydrophobicContact CB-CG 4.42Å; F984-L986 HydrophobicContact CD1-CD1 4.4Å; F984-L986 HydrophobicContact CD2-CD1 4.15Å; F984-L986 HydrophobicContact CD2-CD2 4.02Å; F984-L986 HydrophobicContact CD2-CG 3.74Å; F984-L986 HydrophobicContact CE2-CD2 4Å; F984-L986 HydrophobicContact CE2-CG 4.23Å; F984-L986 HydrophobicContact CG-CD1 3.9Å; F984-L986 HydrophobicContact CG-CD2 4.4Å; F984-L986 HydrophobicContact CG-CG 4.03Å; F984-L986 HydrophobicContact CZ-CD2 4.35Å; L986-T988 PolarHBondContact O-N 3.44Å; L986-L995 HydrophobicContact CD2-CD1 3.87Å; L986-L997 HydrophobicContact CD1-CD1 3.67Å; L986-L997 HydrophobicContact CD2-CD1 4.38Å
987	S	90.9	Very high	81.1	Confident	9 Å²	9	34.3 Å²	34.3	6%	0.063	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	129.1	165.5	176.7	0	0	0	0	108.6	C935 L958 R989 A990 G991	C935-S987 CarbonylContact O-C 3.55Å; C935-S987 WeakPolarHBondContact O-CA 3.2Å; C935-S987 PolarHBondContact O-OG 2.82Å; L958-S987 PolarHBondContact O-N 3.01Å; S987-R989 PolarHBondContact O-N 3.35Å; S987-R989 VanDerWaalsContact O-N 3.11Å; S987-A990 CarbonylContact O-C 3.4Å; S987-A990 WeakPolarHBondContact O-CA 3.42Å; S987-A990 PolarHBondContact O-N 3.42Å; S987-G991 PolarHBondContact O-N 3.09Å
988	T	85.7	Confident	81.2	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.012	16%	0.161	C	C	.	.	H	α-helix	trans	-51.8	-42.3	-175.3	-45.5	0	0	0	0	111.8	C935 L986 A990 G992 A1018	C935-T988 PolarHBondContact O-N 3.35Å; C935-T988 PolarHBondContact O-OG1 3.2Å; L986-T988 PolarHBondContact O-N 3.44Å; T988-A990 VanDerWaalsContact C-N 3.31Å; T988-A990 PolarHBondContact O-N 3.12Å; T988-G992 PolarHBondContact O-N 3.49Å; T988-A1018 HydrophobicContact CG2-CB 4.19Å
989	R	81.3	Confident	81.5	Confident	160 Å²	160	27.1 Å²	27.1	60%	0.604	14%	0.141	S	C	*	.	H	α-helix	trans	-69.9	-21.2	177.3	-64.4	-178.1	179.5	-167.8	-2.6	114.7	S987 L993	S987-R989 PolarHBondContact O-N 3.35Å; S987-R989 VanDerWaalsContact O-N 3.11Å; R989-L993 WeakPolarHBondContact O-CD1 3.3Å; R989-L993 VanDerWaalsContact O-CG 3.29Å; R989-L993 WeakPolarHBondContact O-CG 3.33Å
990	A	78.2	Confident	82.3	Confident	5 Å²	5	24 Å²	24	4%	0.041	13%	0.126	C	C	.	.	H	α-helix	trans	-95.4	-37	177.4	0	0	0	0	0	111.9	L958 D959 S987 T988 L993	L958-A990 HydrophobicContact CD2-CB 3.66Å; D959-A990 WeakPolarHBondContact O-CB 3.42Å; S987-A990 CarbonylContact O-C 3.4Å; S987-A990 WeakPolarHBondContact O-CA 3.42Å; S987-A990 PolarHBondContact O-N 3.42Å; T988-A990 VanDerWaalsContact C-N 3.31Å; T988-A990 PolarHBondContact O-N 3.12Å; A990-L993 PolarHBondContact O-N 3.39Å
991	G	67.5	Low	82.5	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-72.5	-37.6	178.3	0	0	0	0	0	113.9	S987 L993	S987-G991 PolarHBondContact O-N 3.09Å; G991-L993 PolarHBondContact O-N 2.81Å
992	G	63	Low	82.7	Confident	5 Å²	5	19.2 Å²	19.2	5%	0.052	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-11.4	174	0	0	0	0	0	114.5	T988 G994 Q1017 R1021	T988-G992 PolarHBondContact O-N 3.49Å; G992-G994 PolarHBondContact O-N 3.33Å; G992-Q1017 WeakPolarHBondContact O-CG 3.34Å; G992-Q1017 PolarHBondContact O-OE1 2.74Å; G992-R1021 PolarHBondContact O-NE 2.81Å; G992-R1021 PolarHBondContact O-NH2 3.47Å
993	L	63.2	Low	82.7	Confident	55 Å²	55	18.7 Å²	18.7	29%	0.288	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	70.6	-172.7	-68.1	178.3	0	0	0	114	R989 A990 G991 L995	R989-L993 WeakPolarHBondContact O-CD1 3.3Å; R989-L993 VanDerWaalsContact O-CG 3.29Å; R989-L993 WeakPolarHBondContact O-CG 3.33Å; A990-L993 PolarHBondContact O-N 3.39Å; G991-L993 PolarHBondContact O-N 2.81Å; L993-L995 VanDerWaalsContact C-N 3.32Å; L993-L995 PolarHBondContact O-N 2.91Å
994	G	60.7	Low	82.8	Confident	21 Å²	21	18.7 Å²	18.7	22%	0.216	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	10.2	161	0	0	0	0	0	116.3	G992	G992-G994 PolarHBondContact O-N 3.33Å
995	L	72.6	Confident	82.8	Confident	10 Å²	10	18.8 Å²	18.8	5%	0.052	10%	0.098	C	C	.	.			trans	-71.4	165.8	175.6	-50.7	-174	0	0	0	111.8	L958 L971 L986 L993 L997 R1021	L958-L995 HydrophobicContact CD1-CD1 3.81Å; L958-L995 HydrophobicContact CD1-CD2 4.39Å; L958-L995 HydrophobicContact CD2-CD1 4.35Å; L971-L995 HydrophobicContact CD1-CB 4.25Å; L971-L995 HydrophobicContact CD1-CD2 3.87Å; L971-L995 HydrophobicContact CD2-CB 3.93Å; L971-L995 HydrophobicContact CD2-CD1 4.23Å; L971-L995 HydrophobicContact CD2-CD2 4.23Å; L971-L995 HydrophobicContact CD2-CG 4.34Å; L971-L995 HydrophobicContact CG-CD2 4.32Å; L986-L995 HydrophobicContact CD2-CD1 3.87Å; L993-L995 VanDerWaalsContact C-N 3.32Å; L993-L995 PolarHBondContact O-N 2.91Å; L995-L997 HydrophobicContact CB-CD1 4.37Å; L995-L997 HydrophobicContact CB-CG 4.32Å; L995-L997 HydrophobicContact CD1-CD1 4.32Å; L995-R1021 VanDerWaalsContact O-CD 3.28Å; L995-R1021 WeakPolarHBondContact O-CD 3.47Å; L995-R1021 PolarHBondContact O-NH1 2.85Å
996	N	77.4	Confident	82.9	Confident	46 Å²	46	18.8 Å²	18.8	25%	0.246	10%	0.098	C	C	.	.			trans	-130.9	116.7	171	-162.4	64.6	0	0	0	108.8	N975 Q998 R1024	N975-N996 PolarHBondContact ND2-O 3.33Å; N996-Q998 PolarHBondContact ND2-OE1 3.47Å; N996-Q998 PolarHBondContact OD1-OE1 3.49Å; N996-R1024 PolarHBondContact OD1-NH1 2.77Å
997	L	81.7	Confident	82.9	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.098	C	C	.	.			trans	-131.4	41.1	-167.6	-65.3	170.6	0	0	0	110.4	L932 L971 F974 F984 L986 L995 A999 A1000 R1021	L932-L997 HydrophobicContact CD1-CB 3.85Å; L932-L997 HydrophobicContact CD1-CD1 3.78Å; L932-L997 HydrophobicContact CD1-CG 4.44Å; L932-L997 HydrophobicContact CD2-CB 4.21Å; L932-L997 HydrophobicContact CD2-CD1 4.1Å; L971-L997 HydrophobicContact CD2-CD2 3.48Å; L971-L997 VanDerWaalsContact CD2-CD2 3.48Å; L971-L997 HydrophobicContact CD2-CG 4.21Å; F974-L997 HydrophobicContact CD1-CD2 3.79Å; F974-L997 HydrophobicContact CE1-CD2 4.29Å; F984-L997 HydrophobicContact CD1-CD2 3.65Å; F984-L997 HydrophobicContact CE1-CD2 3.77Å; L986-L997 HydrophobicContact CD1-CD1 3.67Å; L986-L997 HydrophobicContact CD2-CD1 4.38Å; L995-L997 HydrophobicContact CB-CD1 4.37Å; L995-L997 HydrophobicContact CB-CG 4.32Å; L995-L997 HydrophobicContact CD1-CD1 4.32Å; L997-A999 PolarHBondContact O-N 2.88Å; L997-A1000 PolarHBondContact O-N 3.06Å; L997-A1000 VanDerWaalsContact O-N 3.14Å; L997-R1021 CarbonylContact C-O 3.58Å; L997-R1021 WeakPolarHBondContact CA-O 3.34Å; L997-R1021 HydrophobicContact CB-CB 4.26Å; L997-R1021 HydrophobicContact CD1-CB 4.06Å; L997-R1021 HydrophobicContact CG-CB 4.43Å; L997-R1021 PolarHBondContact N-O 2.89Å
998	Q	81.9	Confident	82.8	Confident	44 Å²	44	18.7 Å²	18.7	21%	0.206	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-12.9	-172	-62	179.8	-73.7	0	0	113.3	N996 A1000 R1024 I1025 Q1027	N996-Q998 PolarHBondContact ND2-OE1 3.47Å; N996-Q998 PolarHBondContact OD1-OE1 3.49Å; Q998-A1000 PolarHBondContact O-N 3.11Å; Q998-R1024 HydrophobicContact CG-CB 4.37Å; Q998-R1024 VanDerWaalsContact NE2-C 3.35Å; Q998-R1024 PolarHBondContact NE2-O 2.77Å; Q998-I1025 VanDerWaalsContact NE2-C 3.25Å; Q998-I1025 PolarHBondContact NE2-O 3.01Å; Q998-Q1027 PolarHBondContact O-NE2 3.24Å
999	A	86.6	Confident	82.9	Confident	31 Å²	31	19 Å²	19	26%	0.256	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-4.3	169.7	0	0	0	0	0	113.8	R930 F974 N975 L997	R930-A999 VanDerWaalsContact CB-O 3.25Å; R930-A999 WeakPolarHBondContact CB-O 3.35Å; R930-A999 VanDerWaalsContact CD-O 3.23Å; R930-A999 WeakPolarHBondContact CD-O 3.5Å; F974-A999 HydrophobicContact CE1-CB 4.41Å; N975-A999 HydrophobicContact CB-CB 4.46Å; N975-A999 PolarHBondContact OD1-N 2.86Å; L997-A999 PolarHBondContact O-N 2.88Å
1000	A	91.2	Very high	83	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.089	C	C	.	.			trans	-104	142.1	174.1	0	0	0	0	0	112.2	R930 L932 F974 L997 Q998 Q1027	R930-A1000 HydrophobicContact CB-CB 4.34Å; R930-A1000 WeakPolarHBondContact O-CA 3.14Å; R930-A1000 WeakPolarHBondContact O-CB 3.44Å; L932-A1000 HydrophobicContact CD1-CB 4.1Å; L932-A1000 HydrophobicContact CD2-CB 3.55Å; L932-A1000 HydrophobicContact CG-CB 3.51Å; F974-A1000 HydrophobicContact CE1-CB 3.87Å; F974-A1000 HydrophobicContact CZ-CB 3.93Å; L997-A1000 PolarHBondContact O-N 3.06Å; L997-A1000 VanDerWaalsContact O-N 3.14Å; Q998-A1000 PolarHBondContact O-N 3.11Å; A1000-Q1027 PolarHBondContact O-NE2 2.76Å
1001	D	92.4	Very high	83.2	Confident	5 Å²	5	16.8 Å²	16.8	3%	0.027	9%	0.092	C	C	.	.			trans	-129.3	-0.6	-176.2	62	-19.9	0	0	0	113.3	H929 R930 N1029 V1031 R1032 R1108	H929-D1001 WeakPolarHBondContact CA-OD1 3.19Å; H929-D1001 WeakPolarHBondContact CB-OD1 3.46Å; H929-D1001 IonicContact CE1-OD2 3.85Å; H929-D1001 IonicContact CG-OD2 3.48Å; H929-D1001 IonicContact ND1-OD1 3.82Å; H929-D1001 IonicContact ND1-OD2 2.73Å; H929-D1001 PolarHBondContact ND1-OD2 2.75Å; R930-D1001 PolarHBondContact N-OD1 3.27Å; R930-D1001 PolarHBondContact O-N 3.18Å; R930-D1001 VanDerWaalsContact O-N 3.14Å; D1001-N1029 HydrophobicContact CB-CB 3.57Å; D1001-N1029 PolarHBondContact OD2-ND2 2.82Å; D1001-V1031 WeakPolarHBondContact O-CA 3.39Å; D1001-R1032 PolarHBondContact O-N 3Å; D1001-R1032 VanDerWaalsContact O-N 3.16Å; D1001-R1108 PolarHBondContact O-NH2 3.22Å; D1001-R1108 IonicContact OD2-CZ 2.72Å; D1001-R1108 IonicContact OD2-NH2 2.96Å; D1001-R1108 PolarHBondContact OD2-NH2 2.93Å
1002	T	94.4	Very high	84	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	135.8	166.2	-56	0	0	0	0	110.7	L924 R930 V931 L932 R1032 L1034 R1108	L924-T1002 HydrophobicContact CD1-CG2 3.9Å; L924-T1002 HydrophobicContact CD2-CG2 4.28Å; R930-T1002 PolarHBondContact O-N 3.22Å; V931-T1002 WeakPolarHBondContact CA-O 3.43Å; V931-T1002 HydrophobicContact CG1-CG2 4.44Å; L932-T1002 PolarHBondContact N-O 3.45Å; T1002-R1032 CarbonylContact C-O 3.48Å; T1002-R1032 WeakPolarHBondContact CA-O 3.25Å; T1002-L1034 HydrophobicContact CG2-CD1 4.23Å; T1002-R1108 PolarHBondContact OG1-NH2 3.09Å; T1002-R1108 VanDerWaalsContact OG1-NH2 3.16Å
1003	V	94.6	Very high	84.8	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	117.9	179.8	179	0	0	0	0	109.8	L932 F934 A1022 V1031 R1032 V1033 L1034	L932-V1003 HydrophobicContact CB-CG2 4.38Å; L932-V1003 HydrophobicContact CD1-CG2 4.24Å; L932-V1003 HydrophobicContact CG-CG2 4.48Å; L932-V1003 CarbonylContact O-C 3.45Å; L932-V1003 WeakPolarHBondContact O-CA 3.41Å; F934-V1003 HydrophobicContact CD2-CG1 3.6Å; F934-V1003 HydrophobicContact CE2-CG1 3.58Å; V1003-A1022 HydrophobicContact CG2-CB 3.88Å; V1003-V1031 HydrophobicContact CG2-CG1 4.3Å; V1003-R1032 PolarHBondContact N-O 3.41Å; V1003-V1033 HydrophobicContact CB-CG1 4.4Å; V1003-V1033 HydrophobicContact CB-CG2 4.27Å; V1003-V1033 HydrophobicContact CG1-CG1 4.43Å; V1003-V1033 CarbonylContact O-C 3.4Å; V1003-V1033 VanDerWaalsContact O-CA 3.31Å; V1003-V1033 WeakPolarHBondContact O-CA 3.45Å; V1003-L1034 PolarHBondContact O-N 3.03Å
1004	I	95.5	Very high	85.8	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	123.1	174.7	-55.5	177.1	0	0	0	108.8	L917 I920 L921 V931 L932 I933 F934 L1034 L1036	L917-I1004 HydrophobicContact CD2-CD1 3.83Å; L917-I1004 HydrophobicContact CD2-CG2 4.41Å; I920-I1004 HydrophobicContact CD1-CD1 3.91Å; L921-I1004 HydrophobicContact CD2-CD1 4.32Å; V931-I1004 HydrophobicContact CG1-CD1 3.7Å; V931-I1004 HydrophobicContact CG1-CG1 3.91Å; L932-I1004 PolarHBondContact O-N 2.95Å; I933-I1004 HydrophobicContact CD1-CD1 4.41Å; I933-I1004 HydrophobicContact CG1-CB 4.27Å; I933-I1004 HydrophobicContact CG1-CD1 4.26Å; F934-I1004 PolarHBondContact N-O 3.32Å; I1004-L1034 CarbonylContact C-O 3.55Å; I1004-L1034 WeakPolarHBondContact CA-O 3.49Å; I1004-L1034 HydrophobicContact CG1-CB 4.49Å; I1004-L1034 HydrophobicContact CG1-CD1 4.39Å; I1004-L1036 HydrophobicContact CG2-CD1 3.99Å; I1004-L1036 HydrophobicContact CG2-CG 4Å
1005	I	94.8	Very high	87.1	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.005	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	105	167.1	-61.7	167.5	0	0	0	106.5	D1015 Q1019 V1033 L1034 L1036	I1005-D1015 HydrophobicContact CD1-CB 4.04Å; I1005-Q1019 HydrophobicContact CD1-CG 4.15Å; I1005-V1033 HydrophobicContact CD1-CG1 4.15Å; I1005-L1034 PolarHBondContact N-O 3.19Å; I1005-L1036 PolarHBondContact O-N 2.87Å
1006	F	95	Very high	87.6	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.088	C	C	.	.	S	Bend	trans	-80.7	-36.5	-176	-170.1	-81.7	0	0	0	112.1	N867 K913 F914 L917 F934 L940 M944 L1036	N867-F1006 HydrophobicContact CB-CE1 4.01Å; K913-F1006 HydrophobicContact CB-CD2 4.33Å; K913-F1006 HydrophobicContact CB-CE1 4.19Å; K913-F1006 HydrophobicContact CB-CE2 3.44Å; K913-F1006 VanDerWaalsContact CB-CE2 3.44Å; K913-F1006 HydrophobicContact CB-CZ 3.35Å; K913-F1006 HydrophobicContact CD-CD1 3.93Å; K913-F1006 HydrophobicContact CD-CD2 4.45Å; K913-F1006 HydrophobicContact CD-CE1 3.48Å; K913-F1006 VanDerWaalsContact CD-CE1 3.48Å; K913-F1006 HydrophobicContact CD-CE2 4.05Å; K913-F1006 HydrophobicContact CD-CG 4.41Å; K913-F1006 HydrophobicContact CD-CZ 3.55Å; K913-F1006 HydrophobicContact CG-CE2 4.41Å; K913-F1006 HydrophobicContact CG-CZ 4.12Å; K913-F1006 PolarHBondContact NZ-O 2.91Å; F914-F1006 AromaticContact CD2-CE2 3.97Å; F914-F1006 HydrophobicContact CD2-CE2 3.97Å; F914-F1006 AromaticContact CD2-CZ 3.64Å; F914-F1006 HydrophobicContact CD2-CZ 3.64Å; F914-F1006 HydrophobicContact CE2-CE1 4.35Å; F914-F1006 AromaticContact CE2-CE2 3.95Å; F914-F1006 HydrophobicContact CE2-CE2 3.95Å; F914-F1006 AromaticContact CE2-CZ 3.44Å; F914-F1006 HydrophobicContact CE2-CZ 3.44Å; F914-F1006 VanDerWaalsContact CE2-CZ 3.44Å; L917-F1006 HydrophobicContact CD1-CD2 3.99Å; L917-F1006 HydrophobicContact CD1-CE2 3.72Å; L917-F1006 HydrophobicContact CG-CE2 4.34Å; F934-F1006 PolarHBondContact O-N 2.81Å; F934-F1006 VanDerWaalsContact O-N 3.11Å; L940-F1006 HydrophobicContact CD1-CE1 3.9Å; L940-F1006 HydrophobicContact CD1-CZ 4.3Å; L940-F1006 HydrophobicContact CD2-CD1 3.57Å; L940-F1006 HydrophobicContact CD2-CE1 3.66Å; L940-F1006 HydrophobicContact CG-CE1 4.34Å; M944-F1006 HydrophobicContact CE-CB 3.85Å; M944-F1006 HydrophobicContact CE-CD1 3.71Å; M944-F1006 HydrophobicContact CE-CD2 3.24Å; M944-F1006 HydrophobicContact CE-CE1 3.98Å; M944-F1006 HydrophobicContact CE-CE2 3.54Å; M944-F1006 HydrophobicContact CE-CG 3.31Å; M944-F1006 HydrophobicContact CE-CZ 3.9Å; F1006-L1036 HydrophobicContact CD2-CD1 4.01Å; F1006-L1036 HydrophobicContact CE2-CD1 4.46Å
1007	D	91.7	Very high	87.9	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.082	C	C	.	.	S	Bend	trans	-139	113.7	171.9	61.6	-22.3	0	0	0	113	N867 C935 Q936	N867-D1007 PolarHBondContact ND2-OD2 3.11Å; N867-D1007 WeakPolarHBondContact OD1-CB 3.44Å; C935-D1007 VanDerWaalsContact CA-OD1 3.3Å; C935-D1007 WeakPolarHBondContact CA-OD1 3.16Å; Q936-D1007 WeakPolarHBondContact CB-OD2 3.38Å; Q936-D1007 WeakPolarHBondContact CG-O 3.5Å; Q936-D1007 PolarHBondContact N-OD1 3.26Å
1008	S	89.3	Confident	88.1	Confident	8 Å²	8	16.6 Å²	16.6	6%	0.056	8%	0.082	C	C	.	.			trans	-59.8	143.7	-176.1	-56.3	0	0	0	0	113	R863 R1035	R863-S1008 PolarHBondContact NH2-O 2.9Å; S1008-R1035 PolarHBondContact OG-NH1 3.45Å
1009	D	87.8	Confident	88.4	Confident	8 Å²	8	14.5 Å²	14.5	4%	0.043	7%	0.072	C	C	.	.			trans	-77.9	153.5	170.2	-157.5	-85.4	0	0	0	112.2	Q936 N1011 Q1014 D1015	Q936-D1009 VanDerWaalsContact NE2-CB 3.27Å; Q936-D1009 PolarHBondContact NE2-OD2 3.1Å; Q936-D1009 PolarHBondContact OE1-OD2 2.91Å; D1009-N1011 PolarHBondContact O-N 2.86Å; D1009-N1011 WeakPolarHBondContact OD1-CB 3.38Å; D1009-N1011 PolarHBondContact OD1-N 2.64Å; D1009-Q1014 HydrophobicContact CB-CB 4.18Å; D1009-Q1014 PolarHBondContact OD1-NE2 3.38Å; D1009-Q1014 PolarHBondContact OD2-NE2 2.74Å; D1009-D1015 VanDerWaalsContact CB-OD1 3.31Å; D1009-D1015 WeakPolarHBondContact CB-OD1 3.44Å; D1009-D1015 PolarHBondContact N-OD1 2.84Å; D1009-D1015 PolarHBondContact N-OD2 3.34Å; D1009-D1015 VanDerWaalsContact N-OD2 3.16Å
1010	W	84.2	Confident	88.3	Confident	99 Å²	99	13.5 Å²	13.5	38%	0.375	6%	0.063	S	C	.	.	S	Bend	trans	-67.5	-18.1	171.6	-69	85.5	0	0	0	113.4	I859 I1046 K1053	I859-W1010 HydrophobicContact CG2-CH2 4.07Å; I859-W1010 HydrophobicContact CG2-CZ2 3.67Å; W1010-I1046 HydrophobicContact CD2-CG1 4.21Å; W1010-I1046 HydrophobicContact CD2-CG2 4.48Å; W1010-I1046 HydrophobicContact CE3-CG1 4.18Å; W1010-I1046 HydrophobicContact CH2-CD1 4.03Å; W1010-I1046 HydrophobicContact CH2-CG1 3.57Å; W1010-I1046 HydrophobicContact CZ2-CD1 3.54Å; W1010-I1046 HydrophobicContact CZ2-CG1 3.57Å; W1010-I1046 HydrophobicContact CZ3-CG1 3.88Å; W1010-K1053 PolarHBondContact O-NZ 2.9Å
1011	N	81.4	Confident	87.9	Confident	20 Å²	20	14.9 Å²	14.9	11%	0.107	7%	0.068	C	C	.	.	S	Bend	trans	-115.5	102	174.6	173.2	18.6	0	0	0	108.9	D1009 H1013 Q1014	D1009-N1011 PolarHBondContact O-N 2.86Å; D1009-N1011 WeakPolarHBondContact OD1-CB 3.38Å; D1009-N1011 PolarHBondContact OD1-N 2.64Å; N1011-H1013 PolarHBondContact O-N 2.98Å; N1011-H1013 WeakPolarHBondContact OD1-CB 3.38Å; N1011-H1013 PolarHBondContact OD1-CD2 3.41Å; N1011-H1013 VanDerWaalsContact OD1-CD2 3.29Å; N1011-H1013 PolarHBondContact OD1-N 3.31Å; N1011-Q1014 HydrophobicContact CB-CG 4.5Å; N1011-Q1014 PolarHBondContact O-N 2.91Å
1012	P	85.3	Confident	87.6	Confident	4 Å²	4	14.6 Å²	14.6	3%	0.026	7%	0.066	C	C	.	.	H	α-helix	trans	-60.4	-21.8	-173	26.6	-37.1	0	0	0	113.3	Q1014 D1015 L1016 A1050 K1053 L1054	P1012-Q1014 PolarHBondContact O-N 3.46Å; P1012-D1015 PolarHBondContact O-N 2.92Å; P1012-D1015 VanDerWaalsContact O-N 3.15Å; P1012-L1016 PolarHBondContact O-N 2.87Å; P1012-A1050 HydrophobicContact CB-CB 4.17Å; P1012-A1050 HydrophobicContact CG-CB 4.35Å; P1012-K1053 HydrophobicContact CG-CB 4.12Å; P1012-L1054 HydrophobicContact CB-CD1 3.99Å; P1012-L1054 HydrophobicContact CB-CD2 3.75Å; P1012-L1054 HydrophobicContact CB-CG 3.73Å; P1012-L1054 HydrophobicContact CG-CD1 4.45Å; P1012-L1054 HydrophobicContact CG-CD2 3.6Å; P1012-L1054 HydrophobicContact CG-CG 3.65Å
1013	H	79.4	Confident	87.2	Confident	8 Å²	8	15.5 Å²	15.5	4%	0.037	7%	0.07	C	C	.	.	H	α-helix	trans	-65.5	-20.7	175.6	-60.9	-61.2	0	0	0	113.9	T732 Q735 N1011 Q1017	T732-H1013 HydrophobicContact CG2-CB 3.94Å; T732-H1013 VanDerWaalsContact CG2-ND1 3.33Å; T732-H1013 WeakPolarHBondContact CG2-ND1 3.33Å; Q735-H1013 HydrophobicContact CG-CB 4.46Å; N1011-H1013 PolarHBondContact O-N 2.98Å; N1011-H1013 WeakPolarHBondContact OD1-CB 3.38Å; N1011-H1013 PolarHBondContact OD1-CD2 3.41Å; N1011-H1013 VanDerWaalsContact OD1-CD2 3.29Å; N1011-H1013 PolarHBondContact OD1-N 3.31Å; H1013-Q1017 WeakPolarHBondContact O-CB 3.27Å; H1013-Q1017 PolarHBondContact O-N 3.41Å; H1013-Q1017 VanDerWaalsContact O-N 3.08Å
1014	Q	83.3	Confident	86.6	Confident	54 Å²	54	18 Å²	18	25%	0.252	8%	0.08	S	C	.	.	H	α-helix	trans	-73.2	-41.4	171	-66.8	-167.5	94.9	0	0	111.1	D1009 N1011 P1012 Q1017 A1018	D1009-Q1014 HydrophobicContact CB-CB 4.18Å; D1009-Q1014 PolarHBondContact OD1-NE2 3.38Å; D1009-Q1014 PolarHBondContact OD2-NE2 2.74Å; N1011-Q1014 HydrophobicContact CB-CG 4.5Å; N1011-Q1014 PolarHBondContact O-N 2.91Å; P1012-Q1014 PolarHBondContact O-N 3.46Å; Q1014-Q1017 PolarHBondContact O-N 2.8Å; Q1014-A1018 PolarHBondContact O-N 2.67Å
1015	D	87.8	Confident	85.7	Confident	2 Å²	2	20.5 Å²	20.5	1%	0.011	9%	0.093	C	C	.	.	H	α-helix	trans	-67.4	-46.5	177.4	-67.1	0.4	0	0	0	110.9	I1005 D1009 P1012 Q1017 A1018 Q1019 R1035	I1005-D1015 HydrophobicContact CD1-CB 4.04Å; D1009-D1015 VanDerWaalsContact CB-OD1 3.31Å; D1009-D1015 WeakPolarHBondContact CB-OD1 3.44Å; D1009-D1015 PolarHBondContact N-OD1 2.84Å; D1009-D1015 PolarHBondContact N-OD2 3.34Å; D1009-D1015 VanDerWaalsContact N-OD2 3.16Å; P1012-D1015 PolarHBondContact O-N 2.92Å; P1012-D1015 VanDerWaalsContact O-N 3.15Å; D1015-Q1017 VanDerWaalsContact C-N 3.3Å; D1015-Q1017 PolarHBondContact O-N 3.28Å; D1015-A1018 WeakPolarHBondContact O-CA 3.31Å; D1015-A1018 WeakPolarHBondContact O-CB 3.39Å; D1015-A1018 PolarHBondContact O-N 3.28Å; D1015-Q1019 WeakPolarHBondContact O-CG 3.38Å; D1015-Q1019 PolarHBondContact O-N 3.03Å; D1015-R1035 IonicContact OD2-CZ 3.95Å; D1015-R1035 IonicContact OD2-NH1 3.81Å; D1015-R1035 PolarHBondContact OD2-NH1 2.77Å; D1015-R1035 IonicContact OD2-NH2 3.79Å
1016	L	85	Confident	84.9	Confident	39 Å²	39	22.7 Å²	22.7	20%	0.204	12%	0.115	C	C	.	.	H	α-helix	trans	-57.8	-41.7	172.1	-69.7	173.2	0	0	0	111.8	M601 P1012 A1018 Q1019 D1020 L1054	M601-L1016 HydrophobicContact CE-CB 4.37Å; P1012-L1016 PolarHBondContact O-N 2.87Å; L1016-A1018 PolarHBondContact O-N 3.14Å; L1016-Q1019 PolarHBondContact O-N 3.4Å; L1016-D1020 WeakPolarHBondContact O-CB 3.45Å; L1016-D1020 PolarHBondContact O-N 2.73Å; L1016-L1054 HydrophobicContact CD1-CD2 3.64Å
1017	Q	82.9	Confident	84.4	Confident	25 Å²	25	23.2 Å²	23.2	12%	0.117	12%	0.118	C	C	.	.	H	α-helix	trans	-68.1	-16	176.3	-179.7	159.8	91.1	0	0	113.5	M601 E702 G992 H1013 Q1014 D1015 R1021	M601-Q1017 HydrophobicContact CE-CB 3.8Å; M601-Q1017 HydrophobicContact CE-CG 4.48Å; M601-Q1017 HydrophobicContact SD-CB 3.76Å; M601-Q1017 HydrophobicContact SD-CG 3.79Å; M601-Q1017 PolarHBondContact SD-NE2 3.09Å; E702-Q1017 PolarHBondContact OE1-NE2 2.98Å; G992-Q1017 WeakPolarHBondContact O-CG 3.34Å; G992-Q1017 PolarHBondContact O-OE1 2.74Å; H1013-Q1017 WeakPolarHBondContact O-CB 3.27Å; H1013-Q1017 PolarHBondContact O-N 3.41Å; H1013-Q1017 VanDerWaalsContact O-N 3.08Å; Q1014-Q1017 PolarHBondContact O-N 2.8Å; D1015-Q1017 VanDerWaalsContact C-N 3.3Å; D1015-Q1017 PolarHBondContact O-N 3.28Å; Q1017-R1021 WeakPolarHBondContact O-CG 3.46Å; Q1017-R1021 PolarHBondContact O-NE 3.29Å
1018	A	85.2	Confident	84.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-87.9	-45.7	172	0	0	0	0	0	111.7	F934 T988 Q1014 D1015 L1016 D1020 R1021	F934-A1018 HydrophobicContact CD1-CB 3.97Å; F934-A1018 HydrophobicContact CD2-CB 3.92Å; F934-A1018 HydrophobicContact CE1-CB 3.8Å; F934-A1018 HydrophobicContact CE2-CB 3.75Å; F934-A1018 HydrophobicContact CG-CB 4.03Å; F934-A1018 HydrophobicContact CZ-CB 3.7Å; F934-A1018 WeakPolarHBondContact CZ-O 3.49Å; T988-A1018 HydrophobicContact CG2-CB 4.19Å; Q1014-A1018 PolarHBondContact O-N 2.67Å; D1015-A1018 WeakPolarHBondContact O-CA 3.31Å; D1015-A1018 WeakPolarHBondContact O-CB 3.39Å; D1015-A1018 PolarHBondContact O-N 3.28Å; L1016-A1018 PolarHBondContact O-N 3.14Å; A1018-D1020 VanDerWaalsContact C-N 3.33Å; A1018-D1020 PolarHBondContact O-N 3.2Å; A1018-R1021 VanDerWaalsContact O-CB 3.3Å; A1018-R1021 WeakPolarHBondContact O-CB 3.47Å; A1018-R1021 VanDerWaalsContact O-CG 3.27Å; A1018-R1021 WeakPolarHBondContact O-CG 3.21Å; A1018-R1021 PolarHBondContact O-N 3.45Å
1019	Q	88.1	Confident	84	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-55.8	-44.5	173.3	-64.8	172.6	10.5	0	0	112.3	E813 I1005 D1015 L1016 R1021 A1022 H1023 V1033	E813-Q1019 VanDerWaalsContact CD-NE2 3.32Å; E813-Q1019 PolarHBondContact OE1-NE2 2.9Å; E813-Q1019 PolarHBondContact OE2-NE2 3.33Å; E813-Q1019 PolarHBondContact OE2-OE1 2.94Å; I1005-Q1019 HydrophobicContact CD1-CG 4.15Å; D1015-Q1019 WeakPolarHBondContact O-CG 3.38Å; D1015-Q1019 PolarHBondContact O-N 3.03Å; L1016-Q1019 PolarHBondContact O-N 3.4Å; Q1019-R1021 PolarHBondContact O-N 3.4Å; Q1019-A1022 PolarHBondContact O-N 3.36Å; Q1019-H1023 PolarHBondContact O-N 3.14Å; Q1019-H1023 VanDerWaalsContact O-N 3.12Å; Q1019-V1033 HydrophobicContact CG-CG1 3.93Å; Q1019-V1033 HydrophobicContact CG-CG2 4.17Å
1020	D	84.4	Confident	84.1	Confident	10 Å²	10	35.6 Å²	35.6	5%	0.053	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	5.3	-179.7	-77.6	-12.6	0	0	0	114.6	M601 K801 L1016 A1018	M601-D1020 HydrophobicContact CB-CB 4.2Å; M601-D1020 WeakPolarHBondContact CB-OD2 3.44Å; M601-D1020 WeakPolarHBondContact CE-OD2 3.25Å; K801-D1020 IonicContact NZ-OD1 3.62Å; K801-D1020 PolarHBondContact NZ-OD1 2.91Å; K801-D1020 IonicContact NZ-OD2 2.67Å; L1016-D1020 WeakPolarHBondContact O-CB 3.45Å; L1016-D1020 PolarHBondContact O-N 2.73Å; A1018-D1020 VanDerWaalsContact C-N 3.33Å; A1018-D1020 PolarHBondContact O-N 3.2Å
1021	R	83.4	Confident	84.4	Confident	29 Å²	29	30.9 Å²	30.9	11%	0.109	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-27.1	168.9	-53.6	-65.9	155.7	-166.5	-1.2	112.5	G992 L995 L997 Q1017 A1018 Q1019	G992-R1021 PolarHBondContact O-NE 2.81Å; G992-R1021 PolarHBondContact O-NH2 3.47Å; L995-R1021 VanDerWaalsContact O-CD 3.28Å; L995-R1021 WeakPolarHBondContact O-CD 3.47Å; L995-R1021 PolarHBondContact O-NH1 2.85Å; L997-R1021 CarbonylContact C-O 3.58Å; L997-R1021 WeakPolarHBondContact CA-O 3.34Å; L997-R1021 HydrophobicContact CB-CB 4.26Å; L997-R1021 HydrophobicContact CD1-CB 4.06Å; L997-R1021 HydrophobicContact CG-CB 4.43Å; L997-R1021 PolarHBondContact N-O 2.89Å; Q1017-R1021 WeakPolarHBondContact O-CG 3.46Å; Q1017-R1021 PolarHBondContact O-NE 3.29Å; A1018-R1021 VanDerWaalsContact O-CB 3.3Å; A1018-R1021 WeakPolarHBondContact O-CB 3.47Å; A1018-R1021 VanDerWaalsContact O-CG 3.27Å; A1018-R1021 WeakPolarHBondContact O-CG 3.21Å; A1018-R1021 PolarHBondContact O-N 3.45Å; Q1019-R1021 PolarHBondContact O-N 3.4Å
1022	A	86.4	Confident	85	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-47.2	170.9	0	0	0	0	0	111.4	L932 V1003 Q1019 R1024 Q1027 V1031	L932-A1022 HydrophobicContact CD1-CB 4.03Å; V1003-A1022 HydrophobicContact CG2-CB 3.88Å; Q1019-A1022 PolarHBondContact O-N 3.36Å; A1022-R1024 VanDerWaalsContact C-N 3.34Å; A1022-R1024 PolarHBondContact O-N 2.81Å; A1022-Q1027 PolarHBondContact O-NE2 3.01Å; A1022-V1031 HydrophobicContact CB-CG1 4.37Å
1023	H	86	Confident	85.5	Confident	18 Å²	18	30.8 Å²	30.8	8%	0.083	16%	0.157	C	C	.	.	S	Bend	trans	-79	76.9	179.8	-170.1	-120.6	0	0	0	112.4	K801 L808 P809 K811 Q1019 V1031	K801-H1023 WeakPolarHBondContact CE-O 3.28Å; K801-H1023 PolarHBondContact NZ-ND1 3.14Å; K801-H1023 VanDerWaalsContact NZ-ND1 3.12Å; L808-H1023 VanDerWaalsContact CD2-CE1 3.45Å; L808-H1023 WeakPolarHBondContact CD2-CE1 3.22Å; L808-H1023 WeakPolarHBondContact CD2-NE2 3.29Å; P809-H1023 PolarHBondContact O-NE2 3.5Å; K811-H1023 HydrophobicContact CB-CB 4.46Å; K811-H1023 HydrophobicContact CD-CB 4.17Å; K811-H1023 HydrophobicContact CG-CB 4.23Å; Q1019-H1023 PolarHBondContact O-N 3.14Å; Q1019-H1023 VanDerWaalsContact O-N 3.12Å; H1023-V1031 HydrophobicContact CB-CB 4.49Å; H1023-V1031 HydrophobicContact CB-CG1 4.42Å; H1023-V1031 HydrophobicContact CB-CG2 4.29Å
1024	R	81.5	Confident	86.2	Confident	54 Å²	54	30.4 Å²	30.4	20%	0.204	16%	0.155	C	C	.	.	S	Bend	trans	-147	146.4	-174.3	-171.8	176.2	-179.5	-162.4	0.9	112.5	N996 Q998 A1022 G1026 Q1027	N996-R1024 PolarHBondContact OD1-NH1 2.77Å; Q998-R1024 HydrophobicContact CG-CB 4.37Å; Q998-R1024 VanDerWaalsContact NE2-C 3.35Å; Q998-R1024 PolarHBondContact NE2-O 2.77Å; A1022-R1024 VanDerWaalsContact C-N 3.34Å; A1022-R1024 PolarHBondContact O-N 2.81Å; R1024-G1026 PolarHBondContact O-N 2.85Å; R1024-Q1027 WeakPolarHBondContact O-CB 3.46Å; R1024-Q1027 PolarHBondContact O-N 3.45Å
1025	I	77	Confident	86.7	Confident	51 Å²	51	28.4 Å²	28.4	26%	0.262	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-32.9	103	175	-54.7	-179.7	0	0	0	112.9	E805 Q998	E805-I1025 WeakPolarHBondContact OE2-CD1 3.45Å; E805-I1025 WeakPolarHBondContact OE2-CG1 3.37Å; Q998-I1025 VanDerWaalsContact NE2-C 3.25Å; Q998-I1025 PolarHBondContact NE2-O 3.01Å
1026	G	77.1	Confident	87.1	Confident	47 Å²	47	28.4 Å²	28.4	49%	0.485	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	124.2	-19.2	-174.8	0	0	0	0	0	114	R1024 Q1028	R1024-G1026 PolarHBondContact O-N 2.85Å; G1026-Q1028 PolarHBondContact O-NE2 3.11Å
1027	Q	85.4	Confident	87.5	Confident	11 Å²	11	26.8 Å²	26.8	5%	0.051	14%	0.137	C	C	.	.			trans	-54.3	138.8	166.2	178.8	57.8	-88.9	0	0	110.9	L808 P809 Q998 A1000 A1022 R1024 N1029 V1031	L808-Q1027 HydrophobicContact CD1-CB 4.15Å; P809-Q1027 HydrophobicContact CG-CG 4.49Å; Q998-Q1027 PolarHBondContact O-NE2 3.24Å; A1000-Q1027 PolarHBondContact O-NE2 2.76Å; A1022-Q1027 PolarHBondContact O-NE2 3.01Å; R1024-Q1027 WeakPolarHBondContact O-CB 3.46Å; R1024-Q1027 PolarHBondContact O-N 3.45Å; Q1027-N1029 WeakPolarHBondContact CG-O 3.46Å; Q1027-V1031 HydrophobicContact CG-CG2 3.78Å
1028	Q	84.6	Confident	87.9	Confident	153 Å²	153	25.7 Å²	25.7	72%	0.715	13%	0.132	S	C	*	.			trans	-112.4	-28.3	178.9	-56.4	-57.5	-70.6	0	0	112.5	P809 G1026	P809-Q1028 WeakPolarHBondContact CG-O 3.37Å; G1026-Q1028 PolarHBondContact O-NE2 3.11Å
1029	N	87.6	Confident	88.1	Confident	77 Å²	77	26.8 Å²	26.8	41%	0.412	14%	0.137	S	C	.	.	S	Bend	trans	-96	153.1	-178.5	-65.2	11.5	0	0	0	111	P809 D1001 Q1027	P809-N1029 WeakPolarHBondContact CB-O 3.28Å; D1001-N1029 HydrophobicContact CB-CB 3.57Å; D1001-N1029 PolarHBondContact OD2-ND2 2.82Å; Q1027-N1029 WeakPolarHBondContact CG-O 3.46Å
1030	E	89.7	Confident	88	Confident	46 Å²	46	32.2 Å²	32.2	22%	0.215	17%	0.167	C	C	.	.			trans	-65.9	132.7	171	-160.6	-145.5	130.7	0	0	110.8	E810 V812 R1032 R1108	E810-E1030 HydrophobicContact CB-CG 4.31Å; E810-E1030 WeakPolarHBondContact O-CG 3.45Å; V812-E1030 WeakPolarHBondContact CG2-OE1 3.49Å; E1030-R1032 PolarHBondContact O-N 2.78Å; E1030-R1032 IonicContact OE1-CZ 2.68Å; E1030-R1032 IonicContact OE1-NE 3.96Å; E1030-R1032 IonicContact OE1-NH1 3.48Å; E1030-R1032 PolarHBondContact OE1-NH1 3.33Å; E1030-R1032 IonicContact OE2-CZ 2.69Å; E1030-R1032 IonicContact OE2-NH1 3.45Å; E1030-R1108 HydrophobicContact CB-CG 4.4Å; E1030-R1108 PolarHBondContact O-NE 3.44Å
1031	V	91.7	Very high	88.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	100.6	-172.5	-176.7	0	0	0	0	110.6	E810 K811 V812 D1001 V1003 A1022 H1023 Q1027 V1033	E810-V1031 PolarHBondContact O-N 3.4Å; K811-V1031 WeakPolarHBondContact CA-O 3.28Å; K811-V1031 HydrophobicContact CB-CB 4.44Å; K811-V1031 HydrophobicContact CG-CB 4.17Å; K811-V1031 HydrophobicContact CG-CG1 4.21Å; V812-V1031 PolarHBondContact N-O 3.42Å; D1001-V1031 WeakPolarHBondContact O-CA 3.39Å; V1003-V1031 HydrophobicContact CG2-CG1 4.3Å; A1022-V1031 HydrophobicContact CB-CG1 4.37Å; H1023-V1031 HydrophobicContact CB-CB 4.49Å; H1023-V1031 HydrophobicContact CB-CG1 4.42Å; H1023-V1031 HydrophobicContact CB-CG2 4.29Å; Q1027-V1031 HydrophobicContact CG-CG2 3.78Å; V1031-V1033 HydrophobicContact CG1-CG2 4.33Å
1032	R	93.8	Very high	88.4	Confident	22 Å²	22	31 Å²	31	8%	0.083	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	122.6	171.6	-64.1	-58.6	-155.5	-165.1	15.2	110	D1001 T1002 V1003 E1030 M1105 A1107 R1108	D1001-R1032 PolarHBondContact O-N 3Å; D1001-R1032 VanDerWaalsContact O-N 3.16Å; T1002-R1032 CarbonylContact C-O 3.48Å; T1002-R1032 WeakPolarHBondContact CA-O 3.25Å; V1003-R1032 PolarHBondContact N-O 3.41Å; E1030-R1032 PolarHBondContact O-N 2.78Å; E1030-R1032 IonicContact OE1-CZ 2.68Å; E1030-R1032 IonicContact OE1-NE 3.96Å; E1030-R1032 IonicContact OE1-NH1 3.48Å; E1030-R1032 PolarHBondContact OE1-NH1 3.33Å; E1030-R1032 IonicContact OE2-CZ 2.69Å; E1030-R1032 IonicContact OE2-NH1 3.45Å; R1032-M1105 PolarHBondContact NE-O 3.1Å; R1032-A1107 PolarHBondContact NH2-O 2.8Å; R1032-R1108 HydrophobicContact CG-CG 4.44Å
1033	V	94.4	Very high	88.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.7	172.4	-174.7	0	0	0	0	109.1	K811 V812 E813 Y814 V1003 I1005 Q1019 V1031	K811-V1033 HydrophobicContact CD-CG2 4.03Å; K811-V1033 HydrophobicContact CG-CG2 3.84Å; V812-V1033 PolarHBondContact O-N 2.83Å; E813-V1033 WeakPolarHBondContact CA-O 3.26Å; E813-V1033 HydrophobicContact CB-CB 4.14Å; E813-V1033 HydrophobicContact CG-CB 4.17Å; E813-V1033 HydrophobicContact CG-CG1 4.05Å; Y814-V1033 PolarHBondContact N-O 3.12Å; V1003-V1033 HydrophobicContact CB-CG1 4.4Å; V1003-V1033 HydrophobicContact CB-CG2 4.27Å; V1003-V1033 HydrophobicContact CG1-CG1 4.43Å; V1003-V1033 CarbonylContact O-C 3.4Å; V1003-V1033 VanDerWaalsContact O-CA 3.31Å; V1003-V1033 WeakPolarHBondContact O-CA 3.45Å; I1005-V1033 HydrophobicContact CD1-CG1 4.15Å; Q1019-V1033 HydrophobicContact CG-CG1 3.93Å; Q1019-V1033 HydrophobicContact CG-CG2 4.17Å; V1031-V1033 HydrophobicContact CG1-CG2 4.33Å
1034	L	94.7	Very high	88.5	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.9	-178.1	-47.1	178.6	0	0	0	109.1	Y814 I816 I920 T1002 V1003 I1004 I1005 L1106	Y814-L1034 HydrophobicContact CD2-CD2 4.13Å; I816-L1034 HydrophobicContact CD1-CB 4.24Å; I816-L1034 HydrophobicContact CD1-CD2 4.31Å; I920-L1034 HydrophobicContact CD1-CD1 4Å; T1002-L1034 HydrophobicContact CG2-CD1 4.23Å; V1003-L1034 PolarHBondContact O-N 3.03Å; I1004-L1034 CarbonylContact C-O 3.55Å; I1004-L1034 WeakPolarHBondContact CA-O 3.49Å; I1004-L1034 HydrophobicContact CG1-CB 4.49Å; I1004-L1034 HydrophobicContact CG1-CD1 4.39Å; I1005-L1034 PolarHBondContact N-O 3.19Å; L1034-L1106 HydrophobicContact CD1-CD2 3.64Å
1035	R	95	Very high	88.6	Confident	13 Å²	13	34.4 Å²	34.4	5%	0.049	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	112.7	179.7	-177.9	-178	-63.8	-85.5	0.8	109.9	E813 Y814 I816 S1008 D1015 I1037	E813-R1035 IonicContact OE1-CZ 3.44Å; E813-R1035 IonicContact OE1-NE 2.74Å; E813-R1035 PolarHBondContact OE1-NE 3.19Å; E813-R1035 IonicContact OE1-NH2 3.68Å; E813-R1035 PolarHBondContact OE1-NH2 2.98Å; Y814-R1035 PolarHBondContact O-N 2.74Å; I816-R1035 PolarHBondContact N-O 3.22Å; S1008-R1035 PolarHBondContact OG-NH1 3.45Å; D1015-R1035 IonicContact OD2-CZ 3.95Å; D1015-R1035 IonicContact OD2-NH1 3.81Å; D1015-R1035 PolarHBondContact OD2-NH1 2.77Å; D1015-R1035 IonicContact OD2-NH2 3.79Å; R1035-I1037 HydrophobicContact CG-CD1 4.26Å; R1035-I1037 HydrophobicContact CG-CG1 4.24Å
1036	L	95	Very high	89.1	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	126.1	-174.9	-48.3	-167.8	0	0	0	110.7	I816 K913 L916 L917 I1004 I1005 F1006	I816-L1036 HydrophobicContact CB-CD2 4.16Å; I816-L1036 HydrophobicContact CD1-CD2 4.23Å; K913-L1036 HydrophobicContact CD-CB 4.39Å; K913-L1036 HydrophobicContact CG-CB 4.43Å; L916-L1036 HydrophobicContact CD2-CD1 4.35Å; L916-L1036 HydrophobicContact CD2-CD2 3.62Å; L916-L1036 HydrophobicContact CD2-CG 4.5Å; L917-L1036 HydrophobicContact CD2-CD1 4.26Å; L917-L1036 HydrophobicContact CG-CD1 4.41Å; I1004-L1036 HydrophobicContact CG2-CD1 3.99Å; I1004-L1036 HydrophobicContact CG2-CG 4Å; I1005-L1036 PolarHBondContact O-N 2.87Å; F1006-L1036 HydrophobicContact CD2-CD1 4.01Å; F1006-L1036 HydrophobicContact CE2-CD1 4.46Å
1037	I	93	Very high	89.5	Confident	5 Å²	5	30.9 Å²	30.9	3%	0.026	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	130.8	-176	-64.1	-170.3	0	0	0	109.9	V815 I816 K817 C818 R1035 E1043 E1044 L1047	V815-I1037 HydrophobicContact CG1-CD1 3.79Å; V815-I1037 HydrophobicContact CG1-CG1 4.26Å; I816-I1037 PolarHBondContact O-N 3.41Å; I816-I1037 VanDerWaalsContact O-N 3.11Å; K817-I1037 CarbonylContact C-O 3.59Å; C818-I1037 WeakPolarHBondContact CB-O 3.41Å; C818-I1037 PolarHBondContact N-O 2.61Å; R1035-I1037 HydrophobicContact CG-CD1 4.26Å; R1035-I1037 HydrophobicContact CG-CG1 4.24Å; I1037-E1043 HydrophobicContact CG2-CB 3.95Å; I1037-E1044 HydrophobicContact CG2-CG 3.62Å; I1037-L1047 HydrophobicContact CD1-CB 3.72Å; I1037-L1047 HydrophobicContact CD1-CD1 4.49Å; I1037-L1047 HydrophobicContact CD1-CD2 3.38Å; I1037-L1047 HydrophobicContact CD1-CG 4.01Å
1038	S	91.8	Very high	89.4	Confident	3 Å²	3	33 Å²	33	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	130.1	175.8	-43.8	0	0	0	0	110.8	C818 C866 K913 S1041 E1043	C818-S1038 CarbonylContact O-C 3.48Å; C818-S1038 WeakPolarHBondContact O-CA 3.31Å; C866-S1038 WeakPolarHBondContact CB-OG 3.17Å; C866-S1038 PolarHBondContact O-OG 2.79Å; K913-S1038 WeakPolarHBondContact CE-OG 3.38Å; S1038-S1041 VanDerWaalsContact O-CB 3.26Å; S1038-S1041 WeakPolarHBondContact O-CB 3.1Å; S1038-S1041 PolarHBondContact O-OG 2.98Å; S1038-E1043 PolarHBondContact N-OE2 3.11Å; S1038-E1043 PolarHBondContact OG-OE2 2.75Å
1039	I	89.7	Confident	89.2	Confident	22 Å²	22	27.5 Å²	27.5	11%	0.113	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	143.2	-180	-66.8	163	0	0	0	111	K817 C818 E819 S1041 E1044 A1096	K817-I1039 HydrophobicContact CB-CD1 3.91Å; K817-I1039 HydrophobicContact CB-CG1 3.68Å; K817-I1039 HydrophobicContact CG-CG1 4.35Å; C818-I1039 WeakPolarHBondContact O-CG1 3.44Å; C818-I1039 PolarHBondContact O-N 3.34Å; E819-I1039 HydrophobicContact CG-CD1 4.35Å; I1039-S1041 PolarHBondContact O-N 3.14Å; I1039-E1044 VanDerWaalsContact CA-OE1 3.26Å; I1039-E1044 WeakPolarHBondContact CA-OE1 3.2Å; I1039-A1096 HydrophobicContact CD1-CB 3.87Å
1040	N	85.3	Confident	89	Confident	115 Å²	115	24 Å²	24	62%	0.615	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	50.2	178.9	-86.1	-92	0	0	0	112.5	E1044	N1040-E1044 WeakPolarHBondContact CA-OE2 3.37Å; N1040-E1044 PolarHBondContact N-OE1 2.83Å; N1040-E1044 PolarHBondContact N-OE2 3.33Å
1041	S	88.1	Confident	88.7	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.014	14%	0.144	C	C	.	.	S	Bend	trans	-139.2	168.3	-170.7	87.9	0	0	0	0	115.3	Y828 S1038 I1039 E1043 E1044	Y828-S1041 WeakPolarHBondContact OH-CA 3.4Å; S1038-S1041 VanDerWaalsContact O-CB 3.26Å; S1038-S1041 WeakPolarHBondContact O-CB 3.1Å; S1038-S1041 PolarHBondContact O-OG 2.98Å; I1039-S1041 PolarHBondContact O-N 3.14Å; S1041-E1043 PolarHBondContact O-N 3.21Å; S1041-E1043 WeakPolarHBondContact OG-CB 3.25Å; S1041-E1043 PolarHBondContact OG-N 2.81Å; S1041-E1043 VanDerWaalsContact OG-N 3.11Å; S1041-E1044 PolarHBondContact N-OE2 2.82Å; S1041-E1044 PolarHBondContact O-N 3.2Å
1042	V	87.9	Confident	88	Confident	12 Å²	12	32.5 Å²	32.5	7%	0.073	17%	0.165	C	C	.	.	H	α-helix	trans	-57.7	-19.9	173.2	72.8	0	0	0	0	112.8	Y828 I859 L862 R863 I1046	Y828-V1042 PolarHBondContact OH-N 2.62Å; I859-V1042 HydrophobicContact CG2-CG2 4.19Å; L862-V1042 HydrophobicContact CB-CB 4.35Å; L862-V1042 HydrophobicContact CB-CG1 3.81Å; L862-V1042 HydrophobicContact CD1-CB 4.48Å; R863-V1042 HydrophobicContact CG-CG1 3.83Å; V1042-I1046 HydrophobicContact CG2-CD1 4.31Å; V1042-I1046 WeakPolarHBondContact O-CD1 3.28Å; V1042-I1046 WeakPolarHBondContact O-CG1 3.43Å; V1042-I1046 PolarHBondContact O-N 3.44Å
1043	E	89.6	Confident	87.3	Confident	8 Å²	8	33.4 Å²	33.4	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-75.3	-33.8	-178.5	-55.9	-163.7	118.8	0	0	113.1	C866 K913 I1037 S1038 S1041 I1046 L1047	C866-E1043 HydrophobicContact CB-CG 3.98Å; K913-E1043 WeakPolarHBondContact CE-OE2 3.31Å; K913-E1043 IonicContact NZ-OE1 3.96Å; K913-E1043 PolarHBondContact NZ-OE1 2.83Å; K913-E1043 IonicContact NZ-OE2 2.66Å; K913-E1043 PolarHBondContact NZ-OE2 3.38Å; I1037-E1043 HydrophobicContact CG2-CB 3.95Å; S1038-E1043 PolarHBondContact N-OE2 3.11Å; S1038-E1043 PolarHBondContact OG-OE2 2.75Å; S1041-E1043 PolarHBondContact O-N 3.21Å; S1041-E1043 WeakPolarHBondContact OG-CB 3.25Å; S1041-E1043 PolarHBondContact OG-N 2.81Å; S1041-E1043 VanDerWaalsContact OG-N 3.11Å; E1043-I1046 PolarHBondContact O-N 2.78Å; E1043-L1047 PolarHBondContact O-N 2.85Å
1044	E	85.9	Confident	86.6	Confident	51 Å²	51	35.9 Å²	35.9	24%	0.238	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-43.8	172.5	-63.1	159.1	149.4	0	0	109.8	I1037 I1039 N1040 S1041 I1046 L1047 A1048	I1037-E1044 HydrophobicContact CG2-CG 3.62Å; I1039-E1044 VanDerWaalsContact CA-OE1 3.26Å; I1039-E1044 WeakPolarHBondContact CA-OE1 3.2Å; N1040-E1044 WeakPolarHBondContact CA-OE2 3.37Å; N1040-E1044 PolarHBondContact N-OE1 2.83Å; N1040-E1044 PolarHBondContact N-OE2 3.33Å; S1041-E1044 PolarHBondContact N-OE2 2.82Å; S1041-E1044 PolarHBondContact O-N 3.2Å; E1044-I1046 VanDerWaalsContact C-N 3.27Å; E1044-I1046 PolarHBondContact O-N 3.44Å; E1044-L1047 CarbonylContact O-C 3.46Å; E1044-L1047 WeakPolarHBondContact O-CA 3.41Å; E1044-L1047 PolarHBondContact O-N 2.96Å; E1044-A1048 PolarHBondContact O-N 3.41Å
1045	K	83.2	Confident	85.7	Confident	83 Å²	83	37.2 Å²	37.2	36%	0.361	19%	0.19	S	C	.	.	H	α-helix	trans	-64.2	-32	175.6	-54.3	-162.7	179.9	-166.7	0	112.1	A1049 I1189 D1190	K1045-A1049 VanDerWaalsContact O-CB 3.25Å; K1045-A1049 WeakPolarHBondContact O-CB 3.29Å; K1045-A1049 PolarHBondContact O-N 3.4Å; K1045-A1049 VanDerWaalsContact O-N 3.09Å; K1045-I1189 HydrophobicContact CD-CG2 3.48Å; K1045-I1189 VanDerWaalsContact CD-CG2 3.48Å; K1045-I1189 PolarHBondContact NZ-O 2.86Å; K1045-D1190 IonicContact NZ-OD1 2.76Å; K1045-D1190 PolarHBondContact NZ-OD1 3.46Å
1046	I	87.4	Confident	84.6	Confident	4 Å²	4	37.3 Å²	37.3	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-69.9	-41.4	170.6	-70.5	162.7	0	0	0	111.1	R863 W1010 V1042 E1043 E1044 A1049 A1050	R863-I1046 HydrophobicContact CG-CD1 3.92Å; W1010-I1046 HydrophobicContact CD2-CG1 4.21Å; W1010-I1046 HydrophobicContact CD2-CG2 4.48Å; W1010-I1046 HydrophobicContact CE3-CG1 4.18Å; W1010-I1046 HydrophobicContact CH2-CD1 4.03Å; W1010-I1046 HydrophobicContact CH2-CG1 3.57Å; W1010-I1046 HydrophobicContact CZ2-CD1 3.54Å; W1010-I1046 HydrophobicContact CZ2-CG1 3.57Å; W1010-I1046 HydrophobicContact CZ3-CG1 3.88Å; V1042-I1046 HydrophobicContact CG2-CD1 4.31Å; V1042-I1046 WeakPolarHBondContact O-CD1 3.28Å; V1042-I1046 WeakPolarHBondContact O-CG1 3.43Å; V1042-I1046 PolarHBondContact O-N 3.44Å; E1043-I1046 PolarHBondContact O-N 2.78Å; E1044-I1046 VanDerWaalsContact C-N 3.27Å; E1044-I1046 PolarHBondContact O-N 3.44Å; I1046-A1049 CarbonylContact O-C 3.6Å; I1046-A1050 VanDerWaalsContact O-CB 3.3Å; I1046-A1050 WeakPolarHBondContact O-CB 3.2Å; I1046-A1050 PolarHBondContact O-N 3.28Å
1047	L	86.9	Confident	83.7	Confident	20 Å²	20	37.5 Å²	37.5	11%	0.105	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-46.4	175.4	176.8	63.8	0	0	0	111.5	V815 I1037 E1043 E1044 A1049 A1050 R1051	V815-L1047 HydrophobicContact CG1-CD2 3.99Å; V815-L1047 HydrophobicContact CG2-CD2 4.19Å; I1037-L1047 HydrophobicContact CD1-CB 3.72Å; I1037-L1047 HydrophobicContact CD1-CD1 4.49Å; I1037-L1047 HydrophobicContact CD1-CD2 3.38Å; I1037-L1047 HydrophobicContact CD1-CG 4.01Å; E1043-L1047 PolarHBondContact O-N 2.85Å; E1044-L1047 CarbonylContact O-C 3.46Å; E1044-L1047 WeakPolarHBondContact O-CA 3.41Å; E1044-L1047 PolarHBondContact O-N 2.96Å; L1047-A1049 PolarHBondContact O-N 2.96Å; L1047-A1050 CarbonylContact O-C 3.54Å; L1047-A1050 WeakPolarHBondContact O-CA 3.26Å; L1047-A1050 WeakPolarHBondContact O-CB 3.48Å; L1047-A1050 PolarHBondContact O-N 3.26Å; L1047-R1051 HydrophobicContact CD1-CG 4.14Å; L1047-R1051 HydrophobicContact CG-CG 4.24Å; L1047-R1051 PolarHBondContact O-N 3.49Å
1048	A	82.4	Confident	82.9	Confident	57 Å²	57	40 Å²	40	47%	0.471	21%	0.205	S	C	.	.	H	α-helix	trans	-58.3	-48.2	176.5	0	0	0	0	0	110.9	E1044 A1050 R1051 F1052	E1044-A1048 PolarHBondContact O-N 3.41Å; A1048-A1050 PolarHBondContact O-N 2.8Å; A1048-A1050 VanDerWaalsContact O-N 3.12Å; A1048-R1051 PolarHBondContact O-N 2.87Å; A1048-F1052 WeakPolarHBondContact O-CB 3.39Å; A1048-F1052 PolarHBondContact O-N 3.36Å
1049	A	80.5	Confident	81.9	Confident	36 Å²	36	40.9 Å²	40.9	30%	0.298	21%	0.208	S	C	.	.	H	α-helix	trans	-65.4	-11.8	173.6	0	0	0	0	0	114	K1045 I1046 L1047 K1053	K1045-A1049 VanDerWaalsContact O-CB 3.25Å; K1045-A1049 WeakPolarHBondContact O-CB 3.29Å; K1045-A1049 PolarHBondContact O-N 3.4Å; K1045-A1049 VanDerWaalsContact O-N 3.09Å; I1046-A1049 CarbonylContact O-C 3.6Å; L1047-A1049 PolarHBondContact O-N 2.96Å; A1049-K1053 WeakPolarHBondContact O-CG 3.34Å; A1049-K1053 PolarHBondContact O-NZ 3.03Å
1050	A	84.1	Confident	81.1	Confident	5 Å²	5	39.9 Å²	39.9	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-95	-43	172.4	0	0	0	0	0	111.9	P1012 I1046 L1047 A1048 F1052 K1053 L1054	P1012-A1050 HydrophobicContact CB-CB 4.17Å; P1012-A1050 HydrophobicContact CG-CB 4.35Å; I1046-A1050 VanDerWaalsContact O-CB 3.3Å; I1046-A1050 WeakPolarHBondContact O-CB 3.2Å; I1046-A1050 PolarHBondContact O-N 3.28Å; L1047-A1050 CarbonylContact O-C 3.54Å; L1047-A1050 WeakPolarHBondContact O-CA 3.26Å; L1047-A1050 WeakPolarHBondContact O-CB 3.48Å; L1047-A1050 PolarHBondContact O-N 3.26Å; A1048-A1050 PolarHBondContact O-N 2.8Å; A1048-A1050 VanDerWaalsContact O-N 3.12Å; A1050-F1052 VanDerWaalsContact C-N 3.35Å; A1050-F1052 PolarHBondContact O-N 2.94Å; A1050-K1053 PolarHBondContact O-N 2.65Å; A1050-K1053 VanDerWaalsContact O-N 3.08Å; A1050-L1054 PolarHBondContact O-N 3.44Å; A1050-L1054 VanDerWaalsContact O-N 3.1Å
1051	R	83.4	Confident	80.5	Confident	120 Å²	120	34.4 Å²	34.4	45%	0.453	17%	0.174	S	C	.	.	H	α-helix	trans	-52.5	-50.8	170.8	-77.4	-178.9	170.6	-179.4	-3.4	110.1	L1047 A1048 K1053 L1054 D1055	L1047-R1051 HydrophobicContact CD1-CG 4.14Å; L1047-R1051 HydrophobicContact CG-CG 4.24Å; L1047-R1051 PolarHBondContact O-N 3.49Å; A1048-R1051 PolarHBondContact O-N 2.87Å; R1051-K1053 VanDerWaalsContact C-N 3.28Å; R1051-K1053 PolarHBondContact O-N 2.81Å; R1051-L1054 WeakPolarHBondContact O-CA 3.34Å; R1051-L1054 WeakPolarHBondContact O-CB 3.2Å; R1051-L1054 PolarHBondContact O-N 3.23Å; R1051-D1055 PolarHBondContact O-N 3.49Å
1052	F	77.1	Confident	79.7	Confident	103 Å²	103	36 Å²	36	45%	0.452	18%	0.181	S	C	.	.	H	α-helix	trans	-55.6	-35.8	175.7	-177.9	-105.4	0	0	0	113.9	A1048 A1050 V1056	A1048-F1052 WeakPolarHBondContact O-CB 3.39Å; A1048-F1052 PolarHBondContact O-N 3.36Å; A1050-F1052 VanDerWaalsContact C-N 3.35Å; A1050-F1052 PolarHBondContact O-N 2.94Å; F1052-V1056 HydrophobicContact CE1-CG2 4.41Å; F1052-V1056 HydrophobicContact CZ-CG2 4.37Å; F1052-V1056 VanDerWaalsContact O-CG2 3.31Å; F1052-V1056 WeakPolarHBondContact O-CG2 3.41Å; F1052-V1056 PolarHBondContact O-N 3.45Å
1053	K	78	Confident	78.7	Confident	42 Å²	42	35.5 Å²	35.5	18%	0.183	18%	0.178	C	C	.	.	H	α-helix	trans	-73.4	-32.9	176	-66.6	-175.7	-164.9	88.3	0	112.7	W1010 P1012 A1049 A1050 R1051 D1057	W1010-K1053 PolarHBondContact O-NZ 2.9Å; P1012-K1053 HydrophobicContact CG-CB 4.12Å; A1049-K1053 WeakPolarHBondContact O-CG 3.34Å; A1049-K1053 PolarHBondContact O-NZ 3.03Å; A1050-K1053 PolarHBondContact O-N 2.65Å; A1050-K1053 VanDerWaalsContact O-N 3.08Å; R1051-K1053 VanDerWaalsContact C-N 3.28Å; R1051-K1053 PolarHBondContact O-N 2.81Å; K1053-D1057 PolarHBondContact O-N 3.41Å
1054	L	79	Confident	77.2	Confident	52 Å²	52	35.2 Å²	35.2	27%	0.272	18%	0.177	S	C	.	.	H	α-helix	trans	-69.5	-45	173.8	-69.3	-178.9	0	0	0	111	P1012 L1016 A1050 R1051 V1056 D1057 Q1058	P1012-L1054 HydrophobicContact CB-CD1 3.99Å; P1012-L1054 HydrophobicContact CB-CD2 3.75Å; P1012-L1054 HydrophobicContact CB-CG 3.73Å; P1012-L1054 HydrophobicContact CG-CD1 4.45Å; P1012-L1054 HydrophobicContact CG-CD2 3.6Å; P1012-L1054 HydrophobicContact CG-CG 3.65Å; L1016-L1054 HydrophobicContact CD1-CD2 3.64Å; A1050-L1054 PolarHBondContact O-N 3.44Å; A1050-L1054 VanDerWaalsContact O-N 3.1Å; R1051-L1054 WeakPolarHBondContact O-CA 3.34Å; R1051-L1054 WeakPolarHBondContact O-CB 3.2Å; R1051-L1054 PolarHBondContact O-N 3.23Å; L1054-V1056 VanDerWaalsContact C-N 3.32Å; L1054-V1056 PolarHBondContact O-N 3.17Å; L1054-D1057 CarbonylContact O-C 3.41Å; L1054-D1057 WeakPolarHBondContact O-CA 3.38Å; L1054-D1057 PolarHBondContact O-N 3.45Å; L1054-Q1058 WeakPolarHBondContact O-CB 3.13Å; L1054-Q1058 PolarHBondContact O-N 2.88Å
1055	D	76.3	Confident	75.9	Confident	27 Å²	27	35 Å²	35	14%	0.144	18%	0.176	C	C	.	.	H	α-helix	trans	-54.6	-46.8	172.6	168.5	49.5	0	0	0	111.7	R1051 D1057 Q1058 K1059	R1051-D1055 PolarHBondContact O-N 3.49Å; D1055-D1057 VanDerWaalsContact C-N 3.29Å; D1055-D1057 PolarHBondContact O-N 2.75Å; D1055-Q1058 CarbonylContact O-C 3.55Å; D1055-Q1058 VanDerWaalsContact O-CA 3.29Å; D1055-Q1058 WeakPolarHBondContact O-CA 3.08Å; D1055-Q1058 WeakPolarHBondContact O-CB 3.31Å; D1055-Q1058 PolarHBondContact O-N 3.17Å; D1055-K1059 PolarHBondContact O-N 3.26Å; D1055-K1059 WeakPolarHBondContact OD1-CD 3.5Å; D1055-K1059 WeakPolarHBondContact OD1-CE 3.26Å; D1055-K1059 WeakPolarHBondContact OD1-CG 3.07Å; D1055-K1059 IonicContact OD1-NZ 3.36Å; D1055-K1059 PolarHBondContact OD1-NZ 3.34Å; D1055-K1059 WeakPolarHBondContact OD2-CE 3.45Å; D1055-K1059 IonicContact OD2-NZ 2.69Å; D1055-K1059 PolarHBondContact OD2-NZ 3.39Å
1056	V	72.3	Confident	74.6	Confident	16 Å²	16	31.7 Å²	31.7	10%	0.097	16%	0.162	C	C	.	.	H	α-helix	trans	-61.9	-32.9	176.5	171.7	0	0	0	0	112.4	L734 F767 F1052 L1054 V1060	L734-V1056 HydrophobicContact CD2-CG1 3.85Å; F767-V1056 HydrophobicContact CD1-CG1 4.42Å; F767-V1056 HydrophobicContact CD1-CG2 4.3Å; F1052-V1056 HydrophobicContact CE1-CG2 4.41Å; F1052-V1056 HydrophobicContact CZ-CG2 4.37Å; F1052-V1056 VanDerWaalsContact O-CG2 3.31Å; F1052-V1056 WeakPolarHBondContact O-CG2 3.41Å; F1052-V1056 PolarHBondContact O-N 3.45Å; L1054-V1056 VanDerWaalsContact C-N 3.32Å; L1054-V1056 PolarHBondContact O-N 3.17Å; V1056-V1060 HydrophobicContact CG1-CG2 4.18Å; V1056-V1060 WeakPolarHBondContact O-CB 3.2Å; V1056-V1060 WeakPolarHBondContact O-CG2 3.29Å; V1056-V1060 PolarHBondContact O-N 2.61Å
1057	D	75	Confident	73.1	Confident	5 Å²	5	33 Å²	33	3%	0.027	17%	0.17	C	C	.	.	H	α-helix	trans	-71.2	-32.6	167.7	178.1	77.6	0	0	0	112.6	R798 K1053 L1054 D1055 I1061 Q1062	R798-D1057 IonicContact CZ-OD1 2.73Å; R798-D1057 IonicContact CZ-OD2 3.61Å; R798-D1057 VanDerWaalsContact CZ-OD2 3.25Å; R798-D1057 IonicContact NH1-OD1 3.47Å; R798-D1057 PolarHBondContact NH1-OD1 2.81Å; R798-D1057 IonicContact NH1-OD2 3.59Å; R798-D1057 PolarHBondContact NH1-OD2 2.79Å; R798-D1057 IonicContact NH2-OD2 3.71Å; R798-D1057 PolarHBondContact NH2-OD2 2.92Å; K1053-D1057 PolarHBondContact O-N 3.41Å; L1054-D1057 CarbonylContact O-C 3.41Å; L1054-D1057 WeakPolarHBondContact O-CA 3.38Å; L1054-D1057 PolarHBondContact O-N 3.45Å; D1055-D1057 VanDerWaalsContact C-N 3.29Å; D1055-D1057 PolarHBondContact O-N 2.75Å; D1057-I1061 WeakPolarHBondContact O-CA 3.37Å; D1057-I1061 WeakPolarHBondContact O-CB 3.3Å; D1057-I1061 PolarHBondContact O-N 3.29Å; D1057-Q1062 PolarHBondContact O-N 3.41Å
1058	Q	76.5	Confident	71.5	Confident	56 Å²	56	37.6 Å²	37.6	26%	0.262	19%	0.19	S	C	.	.	H	α-helix	trans	-65.2	-57.2	177.6	-156.8	136.4	-51.3	0	0	110.8	L1054 D1055 Q1062 A1063 L1082	L1054-Q1058 WeakPolarHBondContact O-CB 3.13Å; L1054-Q1058 PolarHBondContact O-N 2.88Å; D1055-Q1058 CarbonylContact O-C 3.55Å; D1055-Q1058 VanDerWaalsContact O-CA 3.29Å; D1055-Q1058 WeakPolarHBondContact O-CA 3.08Å; D1055-Q1058 WeakPolarHBondContact O-CB 3.31Å; D1055-Q1058 PolarHBondContact O-N 3.17Å; Q1058-Q1062 HydrophobicContact CG-CB 4.19Å; Q1058-Q1062 HydrophobicContact CG-CG 4.44Å; Q1058-Q1062 CarbonylContact O-C 3.5Å; Q1058-Q1062 WeakPolarHBondContact O-CA 3.42Å; Q1058-Q1062 WeakPolarHBondContact O-CB 3.34Å; Q1058-Q1062 PolarHBondContact O-N 3.17Å; Q1058-A1063 PolarHBondContact O-N 3.36Å; Q1058-L1082 HydrophobicContact CG-CD1 3.91Å; Q1058-L1082 HydrophobicContact CG-CD2 3.81Å
1059	K	72.3	Confident	70.3	Confident	23 Å²	23	41.3 Å²	41.3	10%	0.1	20%	0.196	C	C	.	.	H	α-helix	trans	-64.3	-40.8	176.1	-71.9	169.7	-176.1	150.4	0	113.1	F767 I785 D1055 D1086	F767-K1059 HydrophobicContact CE1-CB 4.16Å; I785-K1059 HydrophobicContact CD1-CB 4.37Å; D1055-K1059 PolarHBondContact O-N 3.26Å; D1055-K1059 WeakPolarHBondContact OD1-CD 3.5Å; D1055-K1059 WeakPolarHBondContact OD1-CE 3.26Å; D1055-K1059 WeakPolarHBondContact OD1-CG 3.07Å; D1055-K1059 IonicContact OD1-NZ 3.36Å; D1055-K1059 PolarHBondContact OD1-NZ 3.34Å; D1055-K1059 WeakPolarHBondContact OD2-CE 3.45Å; D1055-K1059 IonicContact OD2-NZ 2.69Å; D1055-K1059 PolarHBondContact OD2-NZ 3.39Å; K1059-D1086 VanDerWaalsContact CE-OD2 3.25Å; K1059-D1086 WeakPolarHBondContact CE-OD2 3.41Å; K1059-D1086 IonicContact NZ-OD1 3.64Å; K1059-D1086 PolarHBondContact NZ-OD1 3.49Å; K1059-D1086 IonicContact NZ-OD2 2.75Å; K1059-D1086 PolarHBondContact NZ-OD2 2.87Å
1060	V	71.6	Confident	69.1	Low	0 Å²	0	40 Å²	40	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-75.4	-37.4	-179.2	178	0	0	0	0	112.4	L734 L738 L741 F767 L788 H789 V1056	L734-V1060 HydrophobicContact CD2-CB 4.04Å; L734-V1060 HydrophobicContact CD2-CG1 4.17Å; L734-V1060 HydrophobicContact CD2-CG2 4.1Å; L738-V1060 HydrophobicContact CD2-CG1 3.78Å; L738-V1060 HydrophobicContact CD2-CG2 3.96Å; L741-V1060 HydrophobicContact CD2-CG1 4.42Å; F767-V1060 HydrophobicContact CE1-CG2 3.7Å; F767-V1060 HydrophobicContact CE2-CG2 3.86Å; F767-V1060 HydrophobicContact CZ-CG2 3.3Å; L788-V1060 HydrophobicContact CD2-CG1 3.82Å; H789-V1060 PolarHBondContact CD2-O 2.91Å; H789-V1060 PolarHBondContact NE2-O 3.34Å; V1056-V1060 HydrophobicContact CG1-CG2 4.18Å; V1056-V1060 WeakPolarHBondContact O-CB 3.2Å; V1056-V1060 WeakPolarHBondContact O-CG2 3.29Å; V1056-V1060 PolarHBondContact O-N 2.61Å
1061	I	73.3	Confident	68	Low	1 Å²	1	41.8 Å²	41.8	1%	0.005	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-43.3	-167.9	-46.4	-171	0	0	0	114	P733 L734 L796 D1057 G1064 F1066	P733-I1061 HydrophobicContact CB-CD1 3.69Å; P733-I1061 HydrophobicContact CG-CD1 3.83Å; L734-I1061 HydrophobicContact CB-CD1 3.94Å; L796-I1061 HydrophobicContact CD2-CG2 4.32Å; D1057-I1061 WeakPolarHBondContact O-CA 3.37Å; D1057-I1061 WeakPolarHBondContact O-CB 3.3Å; D1057-I1061 PolarHBondContact O-N 3.29Å; I1061-G1064 PolarHBondContact O-N 3.11Å; I1061-F1066 HydrophobicContact CG2-CD2 4.19Å; I1061-F1066 HydrophobicContact CG2-CE2 3.87Å; I1061-F1066 WeakPolarHBondContact O-CD2 3.46Å; I1061-F1066 VanDerWaalsContact O-CE2 3.27Å; I1061-F1066 WeakPolarHBondContact O-CE2 3.48Å
1062	Q	72.3	Confident	67.1	Low	36 Å²	36	37.2 Å²	37.2	17%	0.168	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-70.1	-43.5	-178.8	-58.4	-176.8	55.8	0	0	112.1	D1057 Q1058 G1064 M1065	D1057-Q1062 PolarHBondContact O-N 3.41Å; Q1058-Q1062 HydrophobicContact CG-CB 4.19Å; Q1058-Q1062 HydrophobicContact CG-CG 4.44Å; Q1058-Q1062 CarbonylContact O-C 3.5Å; Q1058-Q1062 WeakPolarHBondContact O-CA 3.42Å; Q1058-Q1062 WeakPolarHBondContact O-CB 3.34Å; Q1058-Q1062 PolarHBondContact O-N 3.17Å; Q1062-G1064 PolarHBondContact O-N 3.02Å; Q1062-M1065 PolarHBondContact O-N 3.42Å
1063	A	65.7	Low	66.6	Low	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-60.5	-9.4	171.9	0	0	0	0	0	113.4	H789 Q1058 M1065 R1075 L1079 L1082	H789-A1063 VanDerWaalsContact CE1-C 3.5Å; Q1058-A1063 PolarHBondContact O-N 3.36Å; A1063-M1065 VanDerWaalsContact C-N 3.31Å; A1063-R1075 VanDerWaalsContact O-CD 3.29Å; A1063-R1075 WeakPolarHBondContact O-CD 3.25Å; A1063-R1075 WeakPolarHBondContact O-CG 3.3Å; A1063-L1079 HydrophobicContact CB-CB 4.35Å; A1063-L1079 HydrophobicContact CB-CD1 3.79Å; A1063-L1079 HydrophobicContact CB-CD2 4.25Å; A1063-L1079 HydrophobicContact CB-CG 4.35Å; A1063-L1082 HydrophobicContact CB-CD1 4.25Å
1064	G	58.7	Low	66.1	Low	2 Å²	2	36.2 Å²	36.2	2%	0.021	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-74.2	-18.9	170.3	0	0	0	0	0	114.3	H789 I1061 Q1062 F1066 R1075	H789-G1064 WeakPolarHBondContact CE1-CA 3.19Å; H789-G1064 PolarHBondContact CE1-N 2.8Å; H789-G1064 VanDerWaalsContact ND1-CA 3.31Å; H789-G1064 WeakPolarHBondContact ND1-CA 3.2Å; H789-G1064 WeakPolarHBondContact NE2-CA 3.37Å; I1061-G1064 PolarHBondContact O-N 3.11Å; Q1062-G1064 PolarHBondContact O-N 3.02Å; G1064-F1066 PolarHBondContact O-N 2.85Å; G1064-R1075 VanDerWaalsContact O-CZ 3.26Å; G1064-R1075 PolarHBondContact O-NE 3.38Å; G1064-R1075 PolarHBondContact O-NH2 2.96Å
1065	M	58.4	Low	65.4	Low	46 Å²	46	35.6 Å²	35.6	23%	0.227	18%	0.18	C	C	.	.			trans	36.4	69.4	-176.9	-58.6	-177.5	81.8	0	0	110.7	Q1062 A1063 D1067 S1070 E1074 R1075 F1078	Q1062-M1065 PolarHBondContact O-N 3.42Å; A1063-M1065 VanDerWaalsContact C-N 3.31Å; M1065-D1067 PolarHBondContact O-N 3.41Å; M1065-S1070 VanDerWaalsContact CB-OG 3.27Å; M1065-S1070 WeakPolarHBondContact CB-OG 3.42Å; M1065-S1070 PolarHBondContact O-OG 3.32Å; M1065-E1074 HydrophobicContact CE-CB 4.44Å; M1065-E1074 HydrophobicContact SD-CB 4.48Å; M1065-R1075 HydrophobicContact CG-CG 4.41Å; M1065-R1075 PolarHBondContact O-NH2 2.91Å; M1065-R1075 HydrophobicContact SD-CB 4.04Å; M1065-R1075 HydrophobicContact SD-CG 4.3Å; M1065-F1078 HydrophobicContact CG-CD1 4.29Å; M1065-F1078 HydrophobicContact SD-CB 4.34Å; M1065-F1078 HydrophobicContact SD-CD1 4.27Å
1066	F	56	Low	65	Low	14 Å²	14	38.1 Å²	38.1	6%	0.061	19%	0.187	C	C	.	.			trans	-74.5	9.3	-166.4	-79.7	-80.3	0	0	0	114.6	H789 L792 R793 L796 R798 I1061 G1064	H789-F1066 HydrophobicContact CB-CZ 4.41Å; H789-F1066 AromaticContact CD2-CZ 3.74Å; L792-F1066 HydrophobicContact CB-CE1 3.67Å; L792-F1066 HydrophobicContact CB-CZ 3.8Å; L792-F1066 HydrophobicContact CD1-CZ 4.06Å; R793-F1066 HydrophobicContact CB-CD1 4.48Å; R793-F1066 HydrophobicContact CB-CE1 4.46Å; R793-F1066 HydrophobicContact CG-CD1 4.43Å; L796-F1066 HydrophobicContact CD2-CD1 4.15Å; L796-F1066 HydrophobicContact CD2-CD2 3.93Å; L796-F1066 HydrophobicContact CD2-CE1 4.34Å; L796-F1066 HydrophobicContact CD2-CE2 4.11Å; L796-F1066 HydrophobicContact CD2-CG 3.95Å; L796-F1066 HydrophobicContact CD2-CZ 4.31Å; R798-F1066 HydrophobicContact CB-CB 4.39Å; I1061-F1066 HydrophobicContact CG2-CD2 4.19Å; I1061-F1066 HydrophobicContact CG2-CE2 3.87Å; I1061-F1066 WeakPolarHBondContact O-CD2 3.46Å; I1061-F1066 VanDerWaalsContact O-CE2 3.27Å; I1061-F1066 WeakPolarHBondContact O-CE2 3.48Å; G1064-F1066 PolarHBondContact O-N 2.85Å
1067	D	54.8	Low	65	Low	33 Å²	33	43.3 Å²	43.3	18%	0.176	21%	0.21	C	C	.	.	S	Bend	trans	-77.2	169	168.2	-162.2	11.4	0	0	0	111.4	R793 M1065 K1069	R793-D1067 PolarHBondContact NH2-O 2.86Å; M1065-D1067 PolarHBondContact O-N 3.41Å; D1067-K1069 VanDerWaalsContact OD2-CD 3.29Å; D1067-K1069 WeakPolarHBondContact OD2-CD 3.38Å; D1067-K1069 VanDerWaalsContact OD2-CG 3.32Å; D1067-K1069 WeakPolarHBondContact OD2-CG 3.46Å
1068	Q	54.1	Low	64.7	Low	115 Å²	115	45.7 Å²	45.7	54%	0.537	22%	0.22	S	C	.	.	S	Bend	trans	-87.4	-5.5	174.8	-68.7	174.5	67.1	0	0	112.9	Y552	Y552-Q1068 HydrophobicContact CE1-CG 4.35Å; Y552-Q1068 PolarHBondContact OH-NE2 3.43Å; Y552-Q1068 VanDerWaalsContact OH-NE2 3.11Å
1069	K	56.7	Low	64.2	Low	136 Å²	136	43.2 Å²	43.2	59%	0.591	21%	0.209	S	C	*	.	S	Bend	trans	-88.4	-38.9	-174.8	-64.6	179.9	-171.6	171.9	0	114.9	D1067 T1071	D1067-K1069 VanDerWaalsContact OD2-CD 3.29Å; D1067-K1069 WeakPolarHBondContact OD2-CD 3.38Å; D1067-K1069 VanDerWaalsContact OD2-CG 3.32Å; D1067-K1069 WeakPolarHBondContact OD2-CG 3.46Å; K1069-T1071 PolarHBondContact O-N 2.82Å
1070	S	56.3	Low	64.1	Low	7 Å²	7	47 Å²	47	5%	0.049	23%	0.227	C	C	.	.			trans	-75.4	124.8	-167.7	60.3	0	0	0	0	112.4	M1065 E1074	M1065-S1070 VanDerWaalsContact CB-OG 3.27Å; M1065-S1070 WeakPolarHBondContact CB-OG 3.42Å; M1065-S1070 PolarHBondContact O-OG 3.32Å; S1070-E1074 VanDerWaalsContact CA-OE2 3.31Å; S1070-E1074 WeakPolarHBondContact CA-OE2 3.35Å
1071	T	61.4	Low	64.1	Low	44 Å²	44	48.9 Å²	48.9	27%	0.27	24%	0.242	S	C	.	.			trans	-66.5	158.1	175.9	60.8	0	0	0	0	112.6	K1069 T1073 E1074 R1075	K1069-T1071 PolarHBondContact O-N 2.82Å; T1071-T1073 PolarHBondContact O-N 3.49Å; T1071-T1073 VanDerWaalsContact O-N 3.09Å; T1071-T1073 PolarHBondContact OG1-N 3.44Å; T1071-E1074 VanDerWaalsContact CB-OE1 3.31Å; T1071-E1074 WeakPolarHBondContact CB-OE1 3.23Å; T1071-E1074 VanDerWaalsContact CG2-OE1 3.32Å; T1071-E1074 WeakPolarHBondContact CG2-OE1 3.3Å; T1071-E1074 PolarHBondContact N-OE1 2.94Å; T1071-E1074 PolarHBondContact O-N 2.81Å; T1071-E1074 WeakPolarHBondContact OG1-CG 3.44Å; T1071-E1074 PolarHBondContact OG1-N 2.82Å; T1071-E1074 VanDerWaalsContact OG1-N 3.13Å; T1071-E1074 PolarHBondContact OG1-OE1 3.32Å; T1071-R1075 PolarHBondContact O-N 3.11Å; T1071-R1075 VanDerWaalsContact O-N 3.12Å
1072	G	62.6	Low	63.9	Low	24 Å²	24	49.1 Å²	49.1	25%	0.247	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-14	166.9	0	0	0	0	0	115	D534 R1076	D534-G1072 PolarHBondContact OD1-N 2.86Å; G1072-R1076 PolarHBondContact O-N 3.45Å; G1072-R1076 PolarHBondContact O-NE 3.47Å
1073	T	67.7	Low	63.7	Low	45 Å²	45	48.8 Å²	48.8	28%	0.276	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-44.4	178.9	-50.3	0	0	0	0	111.8	T1071 R1075 R1076 Q1077	T1071-T1073 PolarHBondContact O-N 3.49Å; T1071-T1073 VanDerWaalsContact O-N 3.09Å; T1071-T1073 PolarHBondContact OG1-N 3.44Å; T1073-R1075 VanDerWaalsContact C-N 3.25Å; T1073-R1075 PolarHBondContact O-N 3.33Å; T1073-R1076 WeakPolarHBondContact O-CB 3.31Å; T1073-R1076 PolarHBondContact O-N 3.24Å; T1073-R1076 VanDerWaalsContact O-N 3.07Å; T1073-R1076 PolarHBondContact OG1-NH2 2.83Å; T1073-Q1077 PolarHBondContact O-N 2.82Å
1074	E	66.8	Low	63.8	Low	79 Å²	79	53.4 Å²	53.4	37%	0.369	26%	0.264	S	S	.	.	H	α-helix	trans	-55	-44.2	166.9	-71.1	153.1	-109.3	0	0	111	M1065 S1070 T1071 R1076 Q1077 F1078	M1065-E1074 HydrophobicContact CE-CB 4.44Å; M1065-E1074 HydrophobicContact SD-CB 4.48Å; S1070-E1074 VanDerWaalsContact CA-OE2 3.31Å; S1070-E1074 WeakPolarHBondContact CA-OE2 3.35Å; T1071-E1074 VanDerWaalsContact CB-OE1 3.31Å; T1071-E1074 WeakPolarHBondContact CB-OE1 3.23Å; T1071-E1074 VanDerWaalsContact CG2-OE1 3.32Å; T1071-E1074 WeakPolarHBondContact CG2-OE1 3.3Å; T1071-E1074 PolarHBondContact N-OE1 2.94Å; T1071-E1074 PolarHBondContact O-N 2.81Å; T1071-E1074 WeakPolarHBondContact OG1-CG 3.44Å; T1071-E1074 PolarHBondContact OG1-N 2.82Å; T1071-E1074 VanDerWaalsContact OG1-N 3.13Å; T1071-E1074 PolarHBondContact OG1-OE1 3.32Å; E1074-R1076 VanDerWaalsContact C-N 3.26Å; E1074-R1076 PolarHBondContact O-N 3.19Å; E1074-Q1077 PolarHBondContact O-N 2.62Å; E1074-F1078 WeakPolarHBondContact O-CB 3.33Å; E1074-F1078 PolarHBondContact O-N 3.13Å
1075	R	65.3	Low	64.1	Low	39 Å²	39	59.1 Å²	59.1	15%	0.147	29%	0.291	C	S	.	.	H	α-helix	trans	-64	-29.6	178.6	-164.4	-175.9	-73.1	113	2.8	112.8	A1063 G1064 M1065 T1071 T1073 L1079	A1063-R1075 VanDerWaalsContact O-CD 3.29Å; A1063-R1075 WeakPolarHBondContact O-CD 3.25Å; A1063-R1075 WeakPolarHBondContact O-CG 3.3Å; G1064-R1075 VanDerWaalsContact O-CZ 3.26Å; G1064-R1075 PolarHBondContact O-NE 3.38Å; G1064-R1075 PolarHBondContact O-NH2 2.96Å; M1065-R1075 HydrophobicContact CG-CG 4.41Å; M1065-R1075 PolarHBondContact O-NH2 2.91Å; M1065-R1075 HydrophobicContact SD-CB 4.04Å; M1065-R1075 HydrophobicContact SD-CG 4.3Å; T1071-R1075 PolarHBondContact O-N 3.11Å; T1071-R1075 VanDerWaalsContact O-N 3.12Å; T1073-R1075 VanDerWaalsContact C-N 3.25Å; T1073-R1075 PolarHBondContact O-N 3.33Å; R1075-L1079 VanDerWaalsContact O-CB 3.3Å; R1075-L1079 WeakPolarHBondContact O-CB 3.46Å; R1075-L1079 PolarHBondContact O-N 2.82Å
1076	R	67.5	Low	64.1	Low	80 Å²	80	60.4 Å²	60.4	30%	0.302	30%	0.298	S	S	.	.	H	α-helix	trans	-68	-54.2	171.4	-89.9	171.4	-81	-174.1	1.1	110.4	E536 G1072 T1073 E1074 F1078 L1079 Q1080	E536-R1076 IonicContact OE2-CZ 2.66Å; E536-R1076 VanDerWaalsContact OE2-CZ 3.29Å; E536-R1076 IonicContact OE2-NH1 2.68Å; E536-R1076 PolarHBondContact OE2-NH1 3.27Å; E536-R1076 IonicContact OE2-NH2 2.67Å; E536-R1076 PolarHBondContact OE2-NH2 2.91Å; G1072-R1076 PolarHBondContact O-N 3.45Å; G1072-R1076 PolarHBondContact O-NE 3.47Å; T1073-R1076 WeakPolarHBondContact O-CB 3.31Å; T1073-R1076 PolarHBondContact O-N 3.24Å; T1073-R1076 VanDerWaalsContact O-N 3.07Å; T1073-R1076 PolarHBondContact OG1-NH2 2.83Å; E1074-R1076 VanDerWaalsContact C-N 3.26Å; E1074-R1076 PolarHBondContact O-N 3.19Å; R1076-F1078 PolarHBondContact O-N 3.32Å; R1076-L1079 PolarHBondContact O-N 3.47Å; R1076-Q1080 WeakPolarHBondContact O-CB 3.36Å; R1076-Q1080 PolarHBondContact O-N 2.81Å
1077	Q	72	Confident	64	Low	124 Å²	124	67.3 Å²	67.3	58%	0.579	33%	0.331	S	S	*	.	H	α-helix	trans	-61.4	-43.7	-177.4	-69.5	168.6	-21	0	0	112.1	T1073 E1074 Q1080 A1081	T1073-Q1077 PolarHBondContact O-N 2.82Å; E1074-Q1077 PolarHBondContact O-N 2.62Å; Q1077-Q1080 PolarHBondContact O-N 2.56Å; Q1077-A1081 WeakPolarHBondContact O-CB 3.49Å; Q1077-A1081 PolarHBondContact O-N 3.46Å
1078	F	69	Low	64	Low	55 Å²	55	73.5 Å²	73.5	24%	0.241	36%	0.359	C	S	.	.	H	α-helix	trans	-64.5	-43.2	177	-178.4	-119.1	0	0	0	112.2	M1065 E1074 R1076 L1082	M1065-F1078 HydrophobicContact CG-CD1 4.29Å; M1065-F1078 HydrophobicContact SD-CB 4.34Å; M1065-F1078 HydrophobicContact SD-CD1 4.27Å; E1074-F1078 WeakPolarHBondContact O-CB 3.33Å; E1074-F1078 PolarHBondContact O-N 3.13Å; R1076-F1078 PolarHBondContact O-N 3.32Å; F1078-L1082 HydrophobicContact CD1-CD1 4.02Å; F1078-L1082 HydrophobicContact CD2-CG 4.49Å; F1078-L1082 HydrophobicContact CE1-CD1 3.61Å; F1078-L1082 HydrophobicContact CE1-CG 4.42Å; F1078-L1082 HydrophobicContact CE2-CD1 4.24Å; F1078-L1082 HydrophobicContact CE2-CD2 4.35Å; F1078-L1082 HydrophobicContact CE2-CG 4.19Å; F1078-L1082 HydrophobicContact CG-CD1 4.5Å; F1078-L1082 HydrophobicContact CZ-CD1 3.73Å; F1078-L1082 HydrophobicContact CZ-CD2 4.3Å; F1078-L1082 HydrophobicContact CZ-CG 4.15Å; F1078-L1082 WeakPolarHBondContact O-CB 3.49Å; F1078-L1082 WeakPolarHBondContact O-CG 3.49Å; F1078-L1082 PolarHBondContact O-N 3.18Å
1079	L	65.4	Low	64	Low	5 Å²	5	70.2 Å²	70.2	3%	0.026	35%	0.351	C	S	.	.	H	α-helix	trans	-74	-25.3	178.1	-177.2	51.4	0	0	0	112.9	L782 I785 A1063 R1075 R1076 L1083	L782-L1079 HydrophobicContact CD1-CB 4.27Å; L782-L1079 HydrophobicContact CD1-CD2 3.45Å; L782-L1079 VanDerWaalsContact CD1-CD2 3.45Å; L782-L1079 HydrophobicContact CD1-CG 3.67Å; L782-L1079 HydrophobicContact CG-CD2 4.33Å; I785-L1079 HydrophobicContact CB-CD2 4.5Å; I785-L1079 HydrophobicContact CD1-CD2 4.39Å; I785-L1079 HydrophobicContact CG2-CD2 3.85Å; A1063-L1079 HydrophobicContact CB-CB 4.35Å; A1063-L1079 HydrophobicContact CB-CD1 3.79Å; A1063-L1079 HydrophobicContact CB-CD2 4.25Å; A1063-L1079 HydrophobicContact CB-CG 4.35Å; R1075-L1079 VanDerWaalsContact O-CB 3.3Å; R1075-L1079 WeakPolarHBondContact O-CB 3.46Å; R1075-L1079 PolarHBondContact O-N 2.82Å; R1076-L1079 PolarHBondContact O-N 3.47Å; L1079-L1083 WeakPolarHBondContact O-CD1 3.18Å; L1079-L1083 WeakPolarHBondContact O-CG 3.42Å; L1079-L1083 PolarHBondContact O-N 2.9Å
1080	Q	70.3	Confident	63.9	Low	103 Å²	103	71.4 Å²	71.4	48%	0.481	36%	0.364	S	S	.	.	H	α-helix	trans	-69.2	-52.8	169.6	176.2	172.7	-9.2	0	0	110.8	R1076 Q1077 L1082 L1083 E1084	R1076-Q1080 WeakPolarHBondContact O-CB 3.36Å; R1076-Q1080 PolarHBondContact O-N 2.81Å; Q1077-Q1080 PolarHBondContact O-N 2.56Å; Q1080-L1082 PolarHBondContact O-N 3.36Å; Q1080-L1083 WeakPolarHBondContact O-CA 3.41Å; Q1080-L1083 PolarHBondContact O-N 3.31Å; Q1080-E1084 HydrophobicContact CG-CG 4.38Å; Q1080-E1084 WeakPolarHBondContact CG-OE1 3.26Å; Q1080-E1084 PolarHBondContact NE2-OE1 2.99Å; Q1080-E1084 WeakPolarHBondContact O-CG 3.25Å; Q1080-E1084 PolarHBondContact O-N 2.93Å
1081	A	72.8	Confident	63.6	Low	38 Å²	38	79.8 Å²	79.8	31%	0.314	40%	0.403	S	S	.	.	H	α-helix	trans	-59.2	-31.2	177.5	0	0	0	0	0	112.9	Q1077 L1083 Q1085	Q1077-A1081 WeakPolarHBondContact O-CB 3.49Å; Q1077-A1081 PolarHBondContact O-N 3.46Å; A1081-L1083 VanDerWaalsContact C-N 3.35Å; A1081-Q1085 VanDerWaalsContact O-CB 3.3Å; A1081-Q1085 WeakPolarHBondContact O-CB 3.48Å; A1081-Q1085 WeakPolarHBondContact O-CG 3.43Å; A1081-Q1085 PolarHBondContact O-N 3.44Å
1082	L	68.9	Low	63.4	Low	6 Å²	6	84.1 Å²	84.1	3%	0.031	42%	0.42	C	S	.	.	H	α-helix	trans	-69.6	-26.1	172.7	-77.5	177.6	0	0	0	114.4	Q1058 A1063 F1078 Q1080	Q1058-L1082 HydrophobicContact CG-CD1 3.91Å; Q1058-L1082 HydrophobicContact CG-CD2 3.81Å; A1063-L1082 HydrophobicContact CB-CD1 4.25Å; F1078-L1082 HydrophobicContact CD1-CD1 4.02Å; F1078-L1082 HydrophobicContact CD2-CG 4.49Å; F1078-L1082 HydrophobicContact CE1-CD1 3.61Å; F1078-L1082 HydrophobicContact CE1-CG 4.42Å; F1078-L1082 HydrophobicContact CE2-CD1 4.24Å; F1078-L1082 HydrophobicContact CE2-CD2 4.35Å; F1078-L1082 HydrophobicContact CE2-CG 4.19Å; F1078-L1082 HydrophobicContact CG-CD1 4.5Å; F1078-L1082 HydrophobicContact CZ-CD1 3.73Å; F1078-L1082 HydrophobicContact CZ-CD2 4.3Å; F1078-L1082 HydrophobicContact CZ-CG 4.15Å; F1078-L1082 WeakPolarHBondContact O-CB 3.49Å; F1078-L1082 WeakPolarHBondContact O-CG 3.49Å; F1078-L1082 PolarHBondContact O-N 3.18Å; Q1080-L1082 PolarHBondContact O-N 3.36Å
1083	L	66.9	Low	63	Low	29 Å²	29	90.9 Å²	90.9	15%	0.152	45%	0.445	C	S	.	.	H	α-helix	trans	-86.6	-36	176.5	-71.2	164.9	0	0	0	110.9	L1079 Q1080 A1081 Q1085 D1086	L1079-L1083 WeakPolarHBondContact O-CD1 3.18Å; L1079-L1083 WeakPolarHBondContact O-CG 3.42Å; L1079-L1083 PolarHBondContact O-N 2.9Å; Q1080-L1083 WeakPolarHBondContact O-CA 3.41Å; Q1080-L1083 PolarHBondContact O-N 3.31Å; A1081-L1083 VanDerWaalsContact C-N 3.35Å; L1083-Q1085 VanDerWaalsContact C-N 3.34Å; L1083-D1086 PolarHBondContact O-N 2.73Å
1084	E	67.9	Low	62.7	Low	97 Å²	97	93.4 Å²	93.4	45%	0.453	46%	0.457	S	S	.	.	H	α-helix	trans	-64.4	-38.6	173.1	-68.2	163.6	167.5	0	0	110.9	Q1080 D1086 E1087	Q1080-E1084 HydrophobicContact CG-CG 4.38Å; Q1080-E1084 WeakPolarHBondContact CG-OE1 3.26Å; Q1080-E1084 PolarHBondContact NE2-OE1 2.99Å; Q1080-E1084 WeakPolarHBondContact O-CG 3.25Å; Q1080-E1084 PolarHBondContact O-N 2.93Å; E1084-D1086 PolarHBondContact O-N 3.19Å; E1084-E1087 PolarHBondContact O-N 3Å; E1084-E1087 VanDerWaalsContact O-N 3.12Å
1085	Q	64.9	Low	62.9	Low	122 Å²	122	97.1 Å²	97.1	57%	0.57	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-16.7	175.6	-81.8	176.8	-8.3	0	0	115.5	A1081 L1083	A1081-Q1085 VanDerWaalsContact O-CB 3.3Å; A1081-Q1085 WeakPolarHBondContact O-CB 3.48Å; A1081-Q1085 WeakPolarHBondContact O-CG 3.43Å; A1081-Q1085 PolarHBondContact O-N 3.44Å; L1083-Q1085 VanDerWaalsContact C-N 3.34Å
1086	D	57.9	Low	63.6	Low	73 Å²	73	97.2 Å²	97.2	39%	0.39	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-23.7	173.9	-65.8	-56.7	0	0	0	112.3	K1059 L1083 E1084	K1059-D1086 VanDerWaalsContact CE-OD2 3.25Å; K1059-D1086 WeakPolarHBondContact CE-OD2 3.41Å; K1059-D1086 IonicContact NZ-OD1 3.64Å; K1059-D1086 PolarHBondContact NZ-OD1 3.49Å; K1059-D1086 IonicContact NZ-OD2 2.75Å; K1059-D1086 PolarHBondContact NZ-OD2 2.87Å; L1083-D1086 PolarHBondContact O-N 2.73Å; E1084-D1086 PolarHBondContact O-N 3.19Å
1087	E	54.5	Low	64.3	Low	159 Å²	159	94.6 Å²	94.6	74%	0.743	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-21.4	-173.8	-64.6	-176.6	-177.4	0	0	112.8	E1084	E1084-E1087 PolarHBondContact O-N 3Å; E1084-E1087 VanDerWaalsContact O-N 3.12Å
1088	E	54.3	Low	64.9	Low	164 Å²	164	92.5 Å²	92.5	77%	0.766	47%	0.469	S	S	*	.	S	Bend	trans	-90.6	-7.5	180	-63	-173.8	144.4	0	0	114.4	D1090	E1088-D1090 PolarHBondContact O-N 3.32Å
1089	A	55.9	Low	65.8	Low	46 Å²	46	91.2 Å²	91.2	38%	0.38	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-5.2	-162.1	0	0	0	0	0	116.7
1090	D	52.9	Low	67	Low	160 Å²	160	95.7 Å²	95.7	86%	0.856	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	7.1	-169.2	-83.5	-12	0	0	0	114.7	E1088	E1088-D1090 PolarHBondContact O-N 3.32Å
1091	E	51.2	Low	67.9	Low	184 Å²	184	93.3 Å²	93.3	86%	0.86	48%	0.478	S	S	*	.			trans	-104.5	11.1	178.8	-61.6	-161.5	154.4	0	0	115.2	E1093	E1091-E1093 PolarHBondContact O-N 3.46Å
1092	E	56.1	Low	68.8	Low	135 Å²	135	91.6 Å²	91.6	63%	0.631	46%	0.464	S	S	*	.			trans	-72	112.8	177.5	-75.7	-169.1	140.4	0	0	113.5	K817	K817-E1092 PolarHBondContact NZ-O 3.19Å
1093	E	54.7	Low	69.9	Low	166 Å²	166	91.4 Å²	91.4	78%	0.776	46%	0.463	S	S	*	.			trans	-47.9	140.9	-178.7	-62.7	-179	139	0	0	114.6	K817 E1091 E1095	K817-E1093 PolarHBondContact NZ-O 2.9Å; E1091-E1093 PolarHBondContact O-N 3.46Å; E1093-E1095 VanDerWaalsContact C-N 3.26Å; E1093-E1095 PolarHBondContact O-N 2.95Å
1094	D	62.1	Low	71.1	Confident	98 Å²	98	95.1 Å²	95.1	52%	0.524	48%	0.48	S	S	.	.			trans	-84.1	19.5	-173	-86.4	-24.4	0	0	0	115.8	K817	K817-D1094 IonicContact NZ-OD1 2.64Å; K817-D1094 PolarHBondContact NZ-OD1 2.73Å
1095	E	71.2	Confident	72	Confident	156 Å²	156	92 Å²	92	73%	0.729	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-83.5	153.3	-178.9	-54.8	-154.4	161.9	0	0	112.7	E1093	E1093-E1095 VanDerWaalsContact C-N 3.26Å; E1093-E1095 PolarHBondContact O-N 2.95Å
1096	A	78.7	Confident	73.3	Confident	41 Å²	41	86.3 Å²	86.3	34%	0.339	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-85	133.9	174.7	0	0	0	0	0	109.9	E819 I1039	E819-A1096 HydrophobicContact CG-CB 3.73Å; I1039-A1096 HydrophobicContact CD1-CB 3.87Å
1097	P	82.1	Confident	74.9	Confident	25 Å²	25	83.2 Å²	83.2	16%	0.162	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-68.3	141.9	-174.5	25.4	-31.1	0	0	0	112.7	I816 K817 T1101 I1102	I816-P1097 HydrophobicContact CG2-CG 3.74Å; K817-P1097 WeakPolarHBondContact O-CD 3.17Å; P1097-T1101 HydrophobicContact CB-CG2 3.72Å; P1097-I1102 HydrophobicContact CB-CG1 4.19Å; P1097-I1102 HydrophobicContact CG-CD1 4.25Å; P1097-I1102 HydrophobicContact CG-CG1 4.1Å; P1097-I1102 WeakPolarHBondContact O-CD1 3.46Å
1098	D	86	Confident	76.6	Confident	81 Å²	81	77.8 Å²	77.8	43%	0.433	40%	0.396	S	S	.	.			trans	-75.9	-179.7	-178.2	83.2	-51.8	0	0	0	112.3	E1100 T1101 I1102	D1098-E1100 VanDerWaalsContact C-N 3.29Å; D1098-E1100 PolarHBondContact O-N 3.15Å; D1098-E1100 WeakPolarHBondContact OD2-CB 3.49Å; D1098-E1100 PolarHBondContact OD2-N 3.08Å; D1098-T1101 WeakPolarHBondContact OD1-CB 3.35Å; D1098-T1101 PolarHBondContact OD1-N 3.46Å; D1098-T1101 PolarHBondContact OD1-OG1 3.12Å; D1098-I1102 WeakPolarHBondContact O-CB 3.43Å; D1098-I1102 WeakPolarHBondContact O-CD1 3.5Å; D1098-I1102 WeakPolarHBondContact O-CG1 3.5Å; D1098-I1102 PolarHBondContact O-N 2.94Å; D1098-I1102 VanDerWaalsContact O-N 3.11Å
1099	D	88.2	Confident	78.3	Confident	27 Å²	27	73.7 Å²	73.7	14%	0.144	38%	0.379	C	S	.	.	H	α-helix	trans	-62.2	-36.6	178	-87.5	-27.2	0	0	0	111.8	R919 N1103 R1123 Q1124	R919-D1099 IonicContact CZ-OD1 3.18Å; R919-D1099 IonicContact NE-OD1 3.77Å; R919-D1099 PolarHBondContact NE-OD1 2.95Å; R919-D1099 IonicContact NH2-OD1 3.48Å; R919-D1099 PolarHBondContact NH2-OD1 2.94Å; D1099-N1103 WeakPolarHBondContact O-CB 3.32Å; D1099-N1103 PolarHBondContact O-N 3.41Å; D1099-N1103 PolarHBondContact O-ND2 2.82Å; D1099-N1103 VanDerWaalsContact O-ND2 3.15Å; D1099-N1103 PolarHBondContact O-OD1 3.43Å; D1099-R1123 IonicContact OD1-CZ 3.66Å; D1099-R1123 IonicContact OD1-NH1 2.79Å; D1099-R1123 IonicContact OD1-NH2 3.67Å; D1099-R1123 PolarHBondContact OD1-NH2 3.45Å; D1099-R1123 IonicContact OD2-CZ 3.31Å; D1099-R1123 IonicContact OD2-NH2 3.47Å; D1099-R1123 PolarHBondContact OD2-NH2 2.64Å; D1099-Q1124 PolarHBondContact OD2-NE2 3.24Å
1100	E	89.4	Confident	80	Confident	99 Å²	99	79 Å²	79	46%	0.463	40%	0.397	S	S	.	.	H	α-helix	trans	-71.7	-47.1	-178.9	-158.5	-176.1	137.9	0	0	111.8	D1098 I1102 N1103 Q1104 F1113	D1098-E1100 VanDerWaalsContact C-N 3.29Å; D1098-E1100 PolarHBondContact O-N 3.15Å; D1098-E1100 WeakPolarHBondContact OD2-CB 3.49Å; D1098-E1100 PolarHBondContact OD2-N 3.08Å; E1100-I1102 VanDerWaalsContact C-N 3.31Å; E1100-I1102 PolarHBondContact O-N 3.21Å; E1100-N1103 CarbonylContact O-C 3.48Å; E1100-N1103 WeakPolarHBondContact O-CA 3.46Å; E1100-N1103 WeakPolarHBondContact O-CB 3.3Å; E1100-N1103 PolarHBondContact O-N 2.82Å; E1100-Q1104 WeakPolarHBondContact O-CG 3.33Å; E1100-Q1104 PolarHBondContact O-N 3.38Å; E1100-Q1104 PolarHBondContact OE1-NE2 2.91Å; E1100-Q1104 VanDerWaalsContact OE1-NE2 3.13Å; E1100-F1113 HydrophobicContact CG-CE2 4.29Å; E1100-F1113 HydrophobicContact CG-CZ 3.93Å
1101	T	90.4	Very high	81.8	Confident	54 Å²	54	78.4 Å²	78.4	33%	0.331	39%	0.388	S	S	.	.	H	α-helix	trans	-59.2	-42.3	176.2	-56.5	0	0	0	0	111.4	P1097 D1098 N1103 Q1104 M1105	P1097-T1101 HydrophobicContact CB-CG2 3.72Å; D1098-T1101 WeakPolarHBondContact OD1-CB 3.35Å; D1098-T1101 PolarHBondContact OD1-N 3.46Å; D1098-T1101 PolarHBondContact OD1-OG1 3.12Å; T1101-N1103 VanDerWaalsContact C-N 3.3Å; T1101-N1103 PolarHBondContact O-N 3.11Å; T1101-Q1104 PolarHBondContact O-N 2.89Å; T1101-M1105 HydrophobicContact CG2-CE 4.5Å; T1101-M1105 WeakPolarHBondContact O-CG 3.5Å; T1101-M1105 PolarHBondContact O-N 3.25Å
1102	I	90.7	Very high	83.8	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-63.3	-36.2	174.4	-76.9	164.1	0	0	0	111.4	L916 I920 P1097 D1098 E1100 M1105 L1106	L916-I1102 HydrophobicContact CD1-CD1 3.59Å; L916-I1102 HydrophobicContact CD1-CG1 4.44Å; I920-I1102 HydrophobicContact CG2-CG2 3.88Å; P1097-I1102 HydrophobicContact CB-CG1 4.19Å; P1097-I1102 HydrophobicContact CG-CD1 4.25Å; P1097-I1102 HydrophobicContact CG-CG1 4.1Å; P1097-I1102 WeakPolarHBondContact O-CD1 3.46Å; D1098-I1102 WeakPolarHBondContact O-CB 3.43Å; D1098-I1102 WeakPolarHBondContact O-CD1 3.5Å; D1098-I1102 WeakPolarHBondContact O-CG1 3.5Å; D1098-I1102 PolarHBondContact O-N 2.94Å; D1098-I1102 VanDerWaalsContact O-N 3.11Å; E1100-I1102 VanDerWaalsContact C-N 3.31Å; E1100-I1102 PolarHBondContact O-N 3.21Å; I1102-M1105 PolarHBondContact O-N 3.45Å; I1102-L1106 HydrophobicContact CG2-CD1 3.78Å; I1102-L1106 HydrophobicContact CG2-CG 4.37Å; I1102-L1106 WeakPolarHBondContact O-CB 3.44Å; I1102-L1106 WeakPolarHBondContact O-CG 3.35Å; I1102-L1106 PolarHBondContact O-N 3.45Å
1103	N	92.6	Very high	85.5	Confident	2 Å²	2	66 Å²	66	1%	0.011	33%	0.33	C	S	.	.	H	α-helix	trans	-67.6	-40.3	174.4	-69.8	-21	0	0	0	112.4	K923 D1099 E1100 T1101 L1106 A1107 F1113 Y1116 D1120	K923-N1103 WeakPolarHBondContact CE-OD1 3.29Å; K923-N1103 PolarHBondContact NZ-OD1 2.83Å; D1099-N1103 WeakPolarHBondContact O-CB 3.32Å; D1099-N1103 PolarHBondContact O-N 3.41Å; D1099-N1103 PolarHBondContact O-ND2 2.82Å; D1099-N1103 VanDerWaalsContact O-ND2 3.15Å; D1099-N1103 PolarHBondContact O-OD1 3.43Å; E1100-N1103 CarbonylContact O-C 3.48Å; E1100-N1103 WeakPolarHBondContact O-CA 3.46Å; E1100-N1103 WeakPolarHBondContact O-CB 3.3Å; E1100-N1103 PolarHBondContact O-N 2.82Å; T1101-N1103 VanDerWaalsContact C-N 3.3Å; T1101-N1103 PolarHBondContact O-N 3.11Å; N1103-L1106 PolarHBondContact O-N 2.9Å; N1103-A1107 VanDerWaalsContact O-CB 3.22Å; N1103-A1107 WeakPolarHBondContact O-CB 3.38Å; N1103-A1107 PolarHBondContact O-N 3.45Å; N1103-F1113 HydrophobicContact CB-CD2 3.62Å; N1103-F1113 HydrophobicContact CB-CE2 3.52Å; N1103-Y1116 VanDerWaalsContact OD1-CB 3.26Å; N1103-Y1116 WeakPolarHBondContact OD1-CB 3.31Å; N1103-D1120 PolarHBondContact ND2-OD2 3.39Å; N1103-D1120 PolarHBondContact OD1-OD2 3.31Å
1104	Q	90.6	Very high	87.3	Confident	107 Å²	107	63.5 Å²	63.5	50%	0.5	32%	0.318	S	S	.	.	H	α-helix	trans	-64.5	-38.7	175.6	-64.7	176.6	20.5	0	0	111.7	E1100 T1101 F1113	E1100-Q1104 WeakPolarHBondContact O-CG 3.33Å; E1100-Q1104 PolarHBondContact O-N 3.38Å; E1100-Q1104 PolarHBondContact OE1-NE2 2.91Å; E1100-Q1104 VanDerWaalsContact OE1-NE2 3.13Å; T1101-Q1104 PolarHBondContact O-N 2.89Å; Q1104-F1113 HydrophobicContact CB-CE2 4.48Å; Q1104-F1113 HydrophobicContact CG-CD2 4.45Å; Q1104-F1113 HydrophobicContact CG-CE2 3.59Å; Q1104-F1113 HydrophobicContact CG-CZ 3.97Å
1105	M	88.4	Confident	88.7	Confident	31 Å²	31	61.1 Å²	61.1	15%	0.153	31%	0.305	C	S	.	.	H	α-helix	trans	-66.9	-37.8	173.6	-72.9	180	161.2	0	0	113.4	Y814 I816 R1032 T1101 I1102	Y814-M1105 HydrophobicContact CD1-CB 4.46Å; Y814-M1105 HydrophobicContact CD1-CE 4.02Å; Y814-M1105 HydrophobicContact CD1-CG 3.86Å; Y814-M1105 HydrophobicContact CD1-SD 4.4Å; Y814-M1105 HydrophobicContact CD2-CB 4.05Å; Y814-M1105 HydrophobicContact CD2-CG 4.32Å; Y814-M1105 HydrophobicContact CE1-CG 4.06Å; Y814-M1105 HydrophobicContact CE2-CB 4.16Å; Y814-M1105 WeakPolarHBondContact CE2-O 3.35Å; Y814-M1105 HydrophobicContact CG-CB 4.21Å; Y814-M1105 HydrophobicContact CG-CE 4.42Å; Y814-M1105 HydrophobicContact CG-CG 3.99Å; Y814-M1105 HydrophobicContact CG-SD 4.35Å; I816-M1105 HydrophobicContact CD1-SD 4.23Å; I816-M1105 HydrophobicContact CG1-SD 3.97Å; R1032-M1105 PolarHBondContact NE-O 3.1Å; T1101-M1105 HydrophobicContact CG2-CE 4.5Å; T1101-M1105 WeakPolarHBondContact O-CG 3.5Å; T1101-M1105 PolarHBondContact O-N 3.25Å; I1102-M1105 PolarHBondContact O-N 3.45Å
1106	L	91.6	Very high	89.8	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-79.4	-45.3	-176.9	-72.6	172.2	0	0	0	112.8	I920 K923 L924 L1034 I1102 N1103 Y1116	I920-L1106 HydrophobicContact CB-CD1 4.01Å; I920-L1106 HydrophobicContact CB-CD2 4.36Å; I920-L1106 HydrophobicContact CG2-CD1 3.88Å; K923-L1106 HydrophobicContact CB-CD1 4.37Å; K923-L1106 HydrophobicContact CD-CD1 3.75Å; L924-L1106 HydrophobicContact CD1-CD2 4.44Å; L924-L1106 HydrophobicContact CD2-CD2 4.29Å; L924-L1106 HydrophobicContact CG-CD2 4.43Å; L1034-L1106 HydrophobicContact CD1-CD2 3.64Å; I1102-L1106 HydrophobicContact CG2-CD1 3.78Å; I1102-L1106 HydrophobicContact CG2-CG 4.37Å; I1102-L1106 WeakPolarHBondContact O-CB 3.44Å; I1102-L1106 WeakPolarHBondContact O-CG 3.35Å; I1102-L1106 PolarHBondContact O-N 3.45Å; N1103-L1106 PolarHBondContact O-N 2.9Å; L1106-Y1116 HydrophobicContact CB-CD2 4.01Å; L1106-Y1116 HydrophobicContact CB-CE2 3.7Å
1107	A	91.3	Very high	90.4	Very high	8 Å²	8	56 Å²	56	7%	0.066	27%	0.274	C	S	.	.			trans	-70.7	135.7	-169.3	0	0	0	0	0	112.2	R1032 N1103 E1112 F1113 Y1116	R1032-A1107 PolarHBondContact NH2-O 2.8Å; N1103-A1107 VanDerWaalsContact O-CB 3.22Å; N1103-A1107 WeakPolarHBondContact O-CB 3.38Å; N1103-A1107 PolarHBondContact O-N 3.45Å; A1107-E1112 WeakPolarHBondContact CA-OE2 3.16Å; A1107-E1112 HydrophobicContact CB-CB 3.89Å; A1107-F1113 HydrophobicContact CB-CB 3.81Å; A1107-F1113 HydrophobicContact CB-CD2 4.38Å; A1107-Y1116 HydrophobicContact CB-CD2 4.05Å; A1107-Y1116 HydrophobicContact CB-CE2 3.9Å
1108	R	90.2	Very high	90.9	Very high	46 Å²	46	60.8 Å²	60.8	17%	0.174	29%	0.289	C	S	.	.	S	Bend	trans	-93.7	-15.3	171.9	-60.5	171.4	-170.2	80.2	-9.8	113.1	H929 D1001 T1002 E1030 R1032 E1112	H929-R1108 PolarHBondContact CD2-NH1 2.87Å; H929-R1108 PolarHBondContact CE1-NH1 2.9Å; H929-R1108 PolarHBondContact ND1-NH1 3.16Å; H929-R1108 PolarHBondContact NE2-NH1 3.2Å; D1001-R1108 PolarHBondContact O-NH2 3.22Å; D1001-R1108 IonicContact OD2-CZ 2.72Å; D1001-R1108 IonicContact OD2-NH2 2.96Å; D1001-R1108 PolarHBondContact OD2-NH2 2.93Å; T1002-R1108 PolarHBondContact OG1-NH2 3.09Å; T1002-R1108 VanDerWaalsContact OG1-NH2 3.16Å; E1030-R1108 HydrophobicContact CB-CG 4.4Å; E1030-R1108 PolarHBondContact O-NE 3.44Å; R1032-R1108 HydrophobicContact CG-CG 4.44Å; R1108-E1112 PolarHBondContact N-OE2 3.25Å; R1108-E1112 IonicContact NH1-OE1 3.53Å; R1108-E1112 IonicContact NH1-OE2 3.29Å; R1108-E1112 PolarHBondContact NH1-OE2 3.39Å
1109	N	90.3	Very high	91.2	Very high	78 Å²	78	58.9 Å²	58.9	42%	0.417	28%	0.279	S	S	.	.	S	Bend	trans	-151.5	172	178.3	62.4	40	0	0	0	110.8	E1111 E1112 F1113	N1109-E1111 VanDerWaalsContact C-N 3.3Å; N1109-E1111 PolarHBondContact O-N 3.05Å; N1109-E1111 PolarHBondContact OD1-N 3.14Å; N1109-E1112 PolarHBondContact O-N 3.08Å; N1109-E1112 WeakPolarHBondContact OD1-CB 3.21Å; N1109-E1112 PolarHBondContact OD1-N 3Å; N1109-F1113 PolarHBondContact O-N 3.17Å
1110	E	91	Very high	91.4	Very high	158 Å²	158	57.9 Å²	57.9	74%	0.738	27%	0.273	S	S	*	.	H	α-helix	trans	-66.6	-29.3	-177.8	-162.2	166.9	-161.8	0	0	112.7	F1113 E1114	E1110-F1113 WeakPolarHBondContact O-CB 3.26Å; E1110-F1113 PolarHBondContact O-N 2.72Å; E1110-E1114 PolarHBondContact O-N 3.04Å
1111	E	91.2	Very high	91.4	Very high	146 Å²	146	55.9 Å²	55.9	68%	0.682	27%	0.274	S	S	*	.	H	α-helix	trans	-69.1	-44.4	177.1	-58.9	-177.1	177.1	0	0	112.2	N1109 F1113 E1114 I1115	N1109-E1111 VanDerWaalsContact C-N 3.3Å; N1109-E1111 PolarHBondContact O-N 3.05Å; N1109-E1111 PolarHBondContact OD1-N 3.14Å; E1111-F1113 VanDerWaalsContact C-N 3.29Å; E1111-F1113 PolarHBondContact O-N 2.89Å; E1111-E1114 PolarHBondContact O-N 3.39Å; E1111-I1115 WeakPolarHBondContact O-CD1 3.4Å; E1111-I1115 VanDerWaalsContact O-CG1 3.26Å; E1111-I1115 WeakPolarHBondContact O-CG1 3.25Å; E1111-I1115 PolarHBondContact O-N 3.49Å
1112	E	93.2	Very high	91.4	Very high	18 Å²	18	58.6 Å²	58.6	8%	0.084	28%	0.283	C	S	.	.	H	α-helix	trans	-58.5	-42.9	170.9	-78	-178.1	-147	0	0	110.3	C927 H929 A1107 R1108 N1109 I1115 Y1116	C927-E1112 HydrophobicContact CB-CG 4.36Å; H929-E1112 IonicContact CE1-OE1 3.66Å; H929-E1112 PolarHBondContact CE1-OE1 2.68Å; H929-E1112 IonicContact NE2-OE1 2.68Å; H929-E1112 PolarHBondContact NE2-OE1 3.37Å; H929-E1112 IonicContact NE2-OE2 3.79Å; A1107-E1112 WeakPolarHBondContact CA-OE2 3.16Å; A1107-E1112 HydrophobicContact CB-CB 3.89Å; R1108-E1112 PolarHBondContact N-OE2 3.25Å; R1108-E1112 IonicContact NH1-OE1 3.53Å; R1108-E1112 IonicContact NH1-OE2 3.29Å; R1108-E1112 PolarHBondContact NH1-OE2 3.39Å; N1109-E1112 PolarHBondContact O-N 3.08Å; N1109-E1112 WeakPolarHBondContact OD1-CB 3.21Å; N1109-E1112 PolarHBondContact OD1-N 3Å; E1112-I1115 PolarHBondContact O-N 3.46Å; E1112-Y1116 HydrophobicContact CB-CE2 3.94Å; E1112-Y1116 WeakPolarHBondContact O-CD1 3.33Å; E1112-Y1116 WeakPolarHBondContact O-CD2 3.46Å; E1112-Y1116 PolarHBondContact O-N 3.21Å; E1112-Y1116 PolarHBondContact OE2-OH 3.41Å; E1112-Y1116 VanDerWaalsContact OE2-OH 3.09Å
1113	F	92.2	Very high	91.3	Very high	41 Å²	41	60.5 Å²	60.5	18%	0.18	29%	0.29	C	S	.	.	H	α-helix	trans	-63.4	-45.2	179.8	-173.5	-118.5	0	0	0	112.4	E1100 N1103 Q1104 A1107 N1109 E1110 E1111 I1115 Y1116 Q1117	E1100-F1113 HydrophobicContact CG-CE2 4.29Å; E1100-F1113 HydrophobicContact CG-CZ 3.93Å; N1103-F1113 HydrophobicContact CB-CD2 3.62Å; N1103-F1113 HydrophobicContact CB-CE2 3.52Å; Q1104-F1113 HydrophobicContact CB-CE2 4.48Å; Q1104-F1113 HydrophobicContact CG-CD2 4.45Å; Q1104-F1113 HydrophobicContact CG-CE2 3.59Å; Q1104-F1113 HydrophobicContact CG-CZ 3.97Å; A1107-F1113 HydrophobicContact CB-CB 3.81Å; A1107-F1113 HydrophobicContact CB-CD2 4.38Å; N1109-F1113 PolarHBondContact O-N 3.17Å; E1110-F1113 WeakPolarHBondContact O-CB 3.26Å; E1110-F1113 PolarHBondContact O-N 2.72Å; E1111-F1113 VanDerWaalsContact C-N 3.29Å; E1111-F1113 PolarHBondContact O-N 2.89Å; F1113-I1115 VanDerWaalsContact C-N 3.35Å; F1113-I1115 PolarHBondContact O-N 3.07Å; F1113-Y1116 PolarHBondContact O-N 3.42Å; F1113-Q1117 PolarHBondContact O-N 2.96Å
1114	E	92	Very high	91	Very high	114 Å²	114	65.3 Å²	65.3	53%	0.533	31%	0.312	S	S	.	.	H	α-helix	trans	-60.1	-41.6	172.3	-79.4	-163.5	-173.1	0	0	112.7	E1110 E1111 R1118	E1110-E1114 PolarHBondContact O-N 3.04Å; E1111-E1114 PolarHBondContact O-N 3.39Å; E1114-R1118 WeakPolarHBondContact O-CB 3.41Å; E1114-R1118 PolarHBondContact O-N 3.07Å; E1114-R1118 IonicContact OE2-NH2 3.74Å
1115	I	92.3	Very high	90.9	Very high	47 Å²	47	66.3 Å²	66.3	24%	0.241	32%	0.315	C	S	.	.	H	α-helix	trans	-64.4	-42.3	178.1	-69.6	163.7	0	0	0	110.3	C926 E1111 E1112 F1113 R1118 L1119	C926-I1115 HydrophobicContact CB-CG2 4.31Å; E1111-I1115 WeakPolarHBondContact O-CD1 3.4Å; E1111-I1115 VanDerWaalsContact O-CG1 3.26Å; E1111-I1115 WeakPolarHBondContact O-CG1 3.25Å; E1111-I1115 PolarHBondContact O-N 3.49Å; E1112-I1115 PolarHBondContact O-N 3.46Å; F1113-I1115 VanDerWaalsContact C-N 3.35Å; F1113-I1115 PolarHBondContact O-N 3.07Å; I1115-R1118 WeakPolarHBondContact O-CB 3.16Å; I1115-R1118 PolarHBondContact O-N 3.47Å; I1115-L1119 HydrophobicContact CG2-CD1 4.17Å; I1115-L1119 WeakPolarHBondContact O-CG 3.41Å; I1115-L1119 PolarHBondContact O-N 3.43Å
1116	Y	94	Very high	90.7	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-70	-40.7	-179.8	-57.3	-20.9	0	0	0	112.5	K923 C927 H929 N1103 L1106 A1107 E1112 F1113 R1118 L1119 D1120	K923-Y1116 HydrophobicContact CB-CD1 3.52Å; K923-Y1116 HydrophobicContact CB-CE1 3.77Å; K923-Y1116 HydrophobicContact CB-CG 4.05Å; K923-Y1116 HydrophobicContact CD-CD1 4.45Å; K923-Y1116 HydrophobicContact CD-CG 4.16Å; K923-Y1116 HydrophobicContact CG-CD1 3.91Å; K923-Y1116 HydrophobicContact CG-CG 4.13Å; K923-Y1116 WeakPolarHBondContact O-CE1 3.44Å; C927-Y1116 HydrophobicContact CB-CE1 4.33Å; C927-Y1116 WeakPolarHBondContact SG-CE1 3.45Å; H929-Y1116 PolarHBondContact NE2-OH 2.9Å; N1103-Y1116 VanDerWaalsContact OD1-CB 3.26Å; N1103-Y1116 WeakPolarHBondContact OD1-CB 3.31Å; L1106-Y1116 HydrophobicContact CB-CD2 4.01Å; L1106-Y1116 HydrophobicContact CB-CE2 3.7Å; A1107-Y1116 HydrophobicContact CB-CD2 4.05Å; A1107-Y1116 HydrophobicContact CB-CE2 3.9Å; E1112-Y1116 HydrophobicContact CB-CE2 3.94Å; E1112-Y1116 WeakPolarHBondContact O-CD1 3.33Å; E1112-Y1116 WeakPolarHBondContact O-CD2 3.46Å; E1112-Y1116 PolarHBondContact O-N 3.21Å; E1112-Y1116 PolarHBondContact OE2-OH 3.41Å; E1112-Y1116 VanDerWaalsContact OE2-OH 3.09Å; F1113-Y1116 PolarHBondContact O-N 3.42Å; Y1116-R1118 VanDerWaalsContact C-N 3.3Å; Y1116-R1118 PolarHBondContact O-N 3.31Å; Y1116-L1119 PolarHBondContact O-N 3.44Å; Y1116-D1120 PolarHBondContact O-N 2.82Å
1117	Q	91.6	Very high	90.3	Very high	89 Å²	89	69.7 Å²	69.7	42%	0.416	34%	0.339	S	S	.	.	H	α-helix	trans	-58.2	-41.6	170.7	-77	-170.8	44.3	0	0	112	F1113 D1120 A1121	F1113-Q1117 PolarHBondContact O-N 2.96Å; Q1117-D1120 PolarHBondContact O-N 3.26Å; Q1117-A1121 WeakPolarHBondContact O-CB 3.4Å; Q1117-A1121 PolarHBondContact O-N 3.16Å
1118	R	92.5	Very high	89.7	Confident	126 Å²	126	71.8 Å²	71.8	48%	0.475	35%	0.354	S	S	.	.	H	α-helix	trans	-62.9	-43.2	177.5	-168	-178.9	-56	124.7	11.3	111.6	E1114 I1115 Y1116 D1120 A1121 E1122	E1114-R1118 WeakPolarHBondContact O-CB 3.41Å; E1114-R1118 PolarHBondContact O-N 3.07Å; E1114-R1118 IonicContact OE2-NH2 3.74Å; I1115-R1118 WeakPolarHBondContact O-CB 3.16Å; I1115-R1118 PolarHBondContact O-N 3.47Å; Y1116-R1118 VanDerWaalsContact C-N 3.3Å; Y1116-R1118 PolarHBondContact O-N 3.31Å; R1118-D1120 VanDerWaalsContact C-N 3.35Å; R1118-A1121 PolarHBondContact O-N 3.49Å; R1118-E1122 WeakPolarHBondContact O-CB 3.31Å; R1118-E1122 WeakPolarHBondContact O-CG 3.49Å; R1118-E1122 PolarHBondContact O-N 3.22Å
1119	L	91.4	Very high	89.2	Confident	42 Å²	42	76 Å²	76	22%	0.22	38%	0.375	C	S	.	.	H	α-helix	trans	-65.5	-34.8	175.7	-70.3	170.5	0	0	0	112.7	K923 C926 I1115 Y1116 R1123	K923-L1119 HydrophobicContact CG-CD1 4.21Å; C926-L1119 HydrophobicContact CB-CD1 3.76Å; I1115-L1119 HydrophobicContact CG2-CD1 4.17Å; I1115-L1119 WeakPolarHBondContact O-CG 3.41Å; I1115-L1119 PolarHBondContact O-N 3.43Å; Y1116-L1119 PolarHBondContact O-N 3.44Å; L1119-R1123 WeakPolarHBondContact O-CB 3.5Å; L1119-R1123 PolarHBondContact O-N 3.19Å
1120	D	91.6	Very high	88.4	Confident	5 Å²	5	75.7 Å²	75.7	3%	0.027	37%	0.371	C	S	.	.	H	α-helix	trans	-67.4	-46.1	172.6	-72.4	-33.8	0	0	0	111.6	K923 N1103 Y1116 Q1117 R1118 E1122 R1123 Q1124	K923-D1120 VanDerWaalsContact CE-CG 3.48Å; K923-D1120 WeakPolarHBondContact CE-OD1 2.94Å; K923-D1120 WeakPolarHBondContact CE-OD2 3.42Å; K923-D1120 IonicContact NZ-OD1 2.8Å; K923-D1120 PolarHBondContact NZ-OD1 3.43Å; K923-D1120 IonicContact NZ-OD2 3.31Å; K923-D1120 PolarHBondContact NZ-OD2 2.88Å; N1103-D1120 PolarHBondContact ND2-OD2 3.39Å; N1103-D1120 PolarHBondContact OD1-OD2 3.31Å; Y1116-D1120 PolarHBondContact O-N 2.82Å; Q1117-D1120 PolarHBondContact O-N 3.26Å; R1118-D1120 VanDerWaalsContact C-N 3.35Å; D1120-E1122 VanDerWaalsContact C-N 3.33Å; D1120-E1122 PolarHBondContact O-N 3.31Å; D1120-R1123 PolarHBondContact O-N 3.48Å; D1120-R1123 IonicContact OD1-CZ 3.88Å; D1120-R1123 IonicContact OD1-NH1 2.72Å; D1120-R1123 PolarHBondContact OD1-NH1 3.22Å; D1120-R1123 IonicContact OD1-NH2 3.63Å; D1120-R1123 PolarHBondContact OD1-NH2 3.24Å; D1120-Q1124 WeakPolarHBondContact O-CB 3.24Å; D1120-Q1124 VanDerWaalsContact O-CG 3.23Å; D1120-Q1124 WeakPolarHBondContact O-CG 3.17Å; D1120-Q1124 PolarHBondContact O-N 3.25Å
1121	A	89.7	Confident	87	Confident	58 Å²	58	73.8 Å²	73.8	48%	0.479	38%	0.383	S	S	.	.	H	α-helix	trans	-60.5	-41.6	175.5	0	0	0	0	0	112	Q1117 R1118 F1125	Q1117-A1121 WeakPolarHBondContact O-CB 3.4Å; Q1117-A1121 PolarHBondContact O-N 3.16Å; R1118-A1121 PolarHBondContact O-N 3.49Å; A1121-F1125 WeakPolarHBondContact O-CB 3.46Å; A1121-F1125 PolarHBondContact O-N 2.91Å
1122	E	90.2	Very high	86	Confident	111 Å²	111	73.3 Å²	73.3	52%	0.519	38%	0.378	S	S	.	.	H	α-helix	trans	-63.9	-42	173.9	-75.6	174.5	-162.4	0	0	112.1	R1118 D1120 F1125 A1126	R1118-E1122 WeakPolarHBondContact O-CB 3.31Å; R1118-E1122 WeakPolarHBondContact O-CG 3.49Å; R1118-E1122 PolarHBondContact O-N 3.22Å; D1120-E1122 VanDerWaalsContact C-N 3.33Å; D1120-E1122 PolarHBondContact O-N 3.31Å; E1122-F1125 PolarHBondContact O-N 2.97Å; E1122-A1126 WeakPolarHBondContact O-CB 3.28Å; E1122-A1126 PolarHBondContact O-N 3.34Å
1123	R	89.9	Confident	84.8	Confident	42 Å²	42	81.8 Å²	81.8	16%	0.158	41%	0.41	C	S	.	.	H	α-helix	trans	-64.9	-52.2	176	-172.9	-172.6	72.2	-120.2	-2.9	111.4	D1099 L1119 D1120 F1125 A1126 E1127	D1099-R1123 IonicContact OD1-CZ 3.66Å; D1099-R1123 IonicContact OD1-NH1 2.79Å; D1099-R1123 IonicContact OD1-NH2 3.67Å; D1099-R1123 PolarHBondContact OD1-NH2 3.45Å; D1099-R1123 IonicContact OD2-CZ 3.31Å; D1099-R1123 IonicContact OD2-NH2 3.47Å; D1099-R1123 PolarHBondContact OD2-NH2 2.64Å; L1119-R1123 WeakPolarHBondContact O-CB 3.5Å; L1119-R1123 PolarHBondContact O-N 3.19Å; D1120-R1123 PolarHBondContact O-N 3.48Å; D1120-R1123 IonicContact OD1-CZ 3.88Å; D1120-R1123 IonicContact OD1-NH1 2.72Å; D1120-R1123 PolarHBondContact OD1-NH1 3.22Å; D1120-R1123 IonicContact OD1-NH2 3.63Å; D1120-R1123 PolarHBondContact OD1-NH2 3.24Å; R1123-F1125 VanDerWaalsContact C-N 3.25Å; R1123-F1125 PolarHBondContact O-N 3.2Å; R1123-A1126 CarbonylContact O-C 3.2Å; R1123-A1126 PolarHBondContact O-N 3.38Å; R1123-A1126 VanDerWaalsContact O-N 3.14Å; R1123-E1127 HydrophobicContact CG-CG 4.48Å; R1123-E1127 IonicContact NE-OE2 3.97Å; R1123-E1127 WeakPolarHBondContact O-CB 3.27Å; R1123-E1127 WeakPolarHBondContact O-CG 3.4Å; R1123-E1127 PolarHBondContact O-N 2.87Å
1124	Q	86.2	Confident	83.9	Confident	102 Å²	102	82.9 Å²	82.9	48%	0.477	42%	0.415	S	S	.	.	H	α-helix	trans	-59.2	-38	178.3	-69.1	174.9	14.3	0	0	110.9	D1099 D1120 E1127 S1128	D1099-Q1124 PolarHBondContact OD2-NE2 3.24Å; D1120-Q1124 WeakPolarHBondContact O-CB 3.24Å; D1120-Q1124 VanDerWaalsContact O-CG 3.23Å; D1120-Q1124 WeakPolarHBondContact O-CG 3.17Å; D1120-Q1124 PolarHBondContact O-N 3.25Å; Q1124-E1127 PolarHBondContact O-N 3.18Å; Q1124-S1128 VanDerWaalsContact O-CB 3.29Å; Q1124-S1128 WeakPolarHBondContact O-CB 3.49Å; Q1124-S1128 PolarHBondContact O-N 3.49Å
1125	F	87.5	Confident	83.5	Confident	128 Å²	128	80.3 Å²	80.3	56%	0.561	41%	0.409	S	S	*	.	H	α-helix	trans	-64.7	-48.2	173.1	-178.3	-115.3	0	0	0	112.1	A1121 E1122 R1123 E1127 S1128 Q1129	A1121-F1125 WeakPolarHBondContact O-CB 3.46Å; A1121-F1125 PolarHBondContact O-N 2.91Å; E1122-F1125 PolarHBondContact O-N 2.97Å; R1123-F1125 VanDerWaalsContact C-N 3.25Å; R1123-F1125 PolarHBondContact O-N 3.2Å; F1125-E1127 VanDerWaalsContact C-N 3.28Å; F1125-E1127 PolarHBondContact O-N 3.24Å; F1125-S1128 PolarHBondContact O-N 2.69Å; F1125-S1128 VanDerWaalsContact O-N 3.14Å; F1125-S1128 PolarHBondContact O-OG 3.36Å; F1125-Q1129 PolarHBondContact O-N 2.9Å; F1125-Q1129 VanDerWaalsContact O-N 3.15Å
1126	A	85.1	Confident	83.2	Confident	53 Å²	53	80 Å²	80	44%	0.438	41%	0.405	S	S	.	.	H	α-helix	trans	-65.1	-28.4	176.9	0	0	0	0	0	113.5	E1122 R1123 Q1130	E1122-A1126 WeakPolarHBondContact O-CB 3.28Å; E1122-A1126 PolarHBondContact O-N 3.34Å; R1123-A1126 CarbonylContact O-C 3.2Å; R1123-A1126 PolarHBondContact O-N 3.38Å; R1123-A1126 VanDerWaalsContact O-N 3.14Å; A1126-Q1130 PolarHBondContact O-NE2 3.46Å
1127	E	82.1	Confident	83	Confident	51 Å²	51	81.6 Å²	81.6	24%	0.238	41%	0.413	C	S	.	.	H	α-helix	trans	-75.2	-39.3	170.7	-72.2	171.6	168.3	0	0	111.2	R1123 Q1124 F1125 Q1129 Q1130 R1136	R1123-E1127 HydrophobicContact CG-CG 4.48Å; R1123-E1127 IonicContact NE-OE2 3.97Å; R1123-E1127 WeakPolarHBondContact O-CB 3.27Å; R1123-E1127 WeakPolarHBondContact O-CG 3.4Å; R1123-E1127 PolarHBondContact O-N 2.87Å; Q1124-E1127 PolarHBondContact O-N 3.18Å; F1125-E1127 VanDerWaalsContact C-N 3.28Å; F1125-E1127 PolarHBondContact O-N 3.24Å; E1127-Q1129 VanDerWaalsContact C-N 3.27Å; E1127-Q1129 PolarHBondContact O-N 2.91Å; E1127-Q1130 PolarHBondContact O-N 2.96Å; E1127-R1136 WeakPolarHBondContact OE1-CD 3.34Å; E1127-R1136 IonicContact OE1-CZ 2.77Å; E1127-R1136 IonicContact OE1-NE 2.9Å; E1127-R1136 IonicContact OE1-NH1 2.75Å; E1127-R1136 PolarHBondContact OE1-NH1 3.35Å
1128	S	80	Confident	82.8	Confident	53 Å²	53	77.6 Å²	77.6	37%	0.371	39%	0.394	S	S	.	.	H	α-helix	trans	-64.8	-27	178.4	81.4	0	0	0	0	114.3	Q1124 F1125	Q1124-S1128 VanDerWaalsContact O-CB 3.29Å; Q1124-S1128 WeakPolarHBondContact O-CB 3.49Å; Q1124-S1128 PolarHBondContact O-N 3.49Å; F1125-S1128 PolarHBondContact O-N 2.69Å; F1125-S1128 VanDerWaalsContact O-N 3.14Å; F1125-S1128 PolarHBondContact O-OG 3.36Å
1129	Q	79.2	Confident	82.5	Confident	133 Å²	133	75.8 Å²	75.8	62%	0.621	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-13	177.1	-71.6	-167.1	24.5	0	0	114	F1125 E1127 A1131	F1125-Q1129 PolarHBondContact O-N 2.9Å; F1125-Q1129 VanDerWaalsContact O-N 3.15Å; E1127-Q1129 VanDerWaalsContact C-N 3.27Å; E1127-Q1129 PolarHBondContact O-N 2.91Å; Q1129-A1131 PolarHBondContact O-N 3.41Å
1130	Q	72.6	Confident	82.2	Confident	72 Å²	72	79 Å²	79	34%	0.336	40%	0.403	S	S	.	.	S	Bend	trans	-73.4	123.5	-177.3	-71.8	169.4	59.4	0	0	110.3	A1126 E1127 K1132	A1126-Q1130 PolarHBondContact O-NE2 3.46Å; E1127-Q1130 PolarHBondContact O-N 2.96Å; Q1130-K1132 CarbonylContact O-C 3.54Å; Q1130-K1132 PolarHBondContact O-N 3.35Å
1131	A	63	Low	81.8	Confident	119 Å²	119	83 Å²	83	98%	0.983	43%	0.432	S	S	*	.	S	Bend	trans	-60	-22.2	-171	0	0	0	0	0	114.3	Q1129	Q1129-A1131 PolarHBondContact O-N 3.41Å
1132	K	68.7	Low	81.4	Confident	135 Å²	135	82 Å²	82	59%	0.587	42%	0.417	S	S	*	.	S	Bend	trans	-116.8	118.7	162.2	-178.5	-171	169.4	-149.8	0	106.5	Q1130 E1134	Q1130-K1132 CarbonylContact O-C 3.54Å; Q1130-K1132 PolarHBondContact O-N 3.35Å; K1132-E1134 HydrophobicContact CD-CG 3.87Å; K1132-E1134 WeakPolarHBondContact CD-OE1 3.46Å; K1132-E1134 WeakPolarHBondContact CE-OE1 3.44Å; K1132-E1134 HydrophobicContact CG-CG 3.93Å; K1132-E1134 IonicContact NZ-OE1 3.38Å; K1132-E1134 PolarHBondContact NZ-OE1 3.29Å; K1132-E1134 PolarHBondContact O-N 2.92Å
1133	R	69.3	Low	81.1	Confident	196 Å²	196	77.2 Å²	77.2	74%	0.74	40%	0.395	S	S	*	.			trans	-77.8	111.6	171.3	-69.2	-177.6	178.8	-175.7	-2.4	108.2
1134	E	73.6	Confident	80.6	Confident	65 Å²	65	75.4 Å²	75.4	30%	0.304	39%	0.389	S	S	.	.			trans	-105.9	118.1	178.7	-59.8	179.2	138.4	0	0	107.5	K905 K1132	K905-E1134 IonicContact NZ-OE2 3.44Å; K905-E1134 PolarHBondContact NZ-OE2 3.15Å; K1132-E1134 HydrophobicContact CD-CG 3.87Å; K1132-E1134 WeakPolarHBondContact CD-OE1 3.46Å; K1132-E1134 WeakPolarHBondContact CE-OE1 3.44Å; K1132-E1134 HydrophobicContact CG-CG 3.93Å; K1132-E1134 IonicContact NZ-OE1 3.38Å; K1132-E1134 PolarHBondContact NZ-OE1 3.29Å; K1132-E1134 PolarHBondContact O-N 2.92Å
1135	P	82.9	Confident	80.2	Confident	60 Å²	60	79.8 Å²	79.8	39%	0.39	41%	0.406	S	S	.	.			trans	-61.1	146.1	-176.5	27.4	-35.2	0	0	0	109.9	R909 L1137 E1139	R909-P1135 PolarHBondContact NH1-O 2.74Å; R909-P1135 PolarHBondContact NH2-O 2.76Å; P1135-L1137 PolarHBondContact O-N 2.78Å; P1135-E1139 HydrophobicContact CG-CG 3.7Å
1136	R	85.1	Confident	79.6	Confident	41 Å²	41	75 Å²	75	16%	0.155	39%	0.385	C	S	.	.	S	Bend	trans	-63.9	-19.7	-166.2	-75.5	-177.7	58.2	84.7	6.6	114.8	R909 E915 D918 E1127	R909-R1136 WeakPolarHBondContact CA-O 3.33Å; E915-R1136 HydrophobicContact CG-CB 4.05Å; E915-R1136 PolarHBondContact O-NH2 3.35Å; E915-R1136 IonicContact OE1-CZ 3.02Å; E915-R1136 IonicContact OE1-NE 3.24Å; E915-R1136 PolarHBondContact OE1-NE 3.41Å; E915-R1136 IonicContact OE1-NH2 3.89Å; E915-R1136 PolarHBondContact OE1-NH2 2.78Å; D918-R1136 IonicContact OD2-CZ 3.32Å; D918-R1136 IonicContact OD2-NH1 3.61Å; D918-R1136 PolarHBondContact OD2-NH1 2.85Å; D918-R1136 IonicContact OD2-NH2 2.77Å; D918-R1136 PolarHBondContact OD2-NH2 3.35Å; E1127-R1136 WeakPolarHBondContact OE1-CD 3.34Å; E1127-R1136 IonicContact OE1-CZ 2.77Å; E1127-R1136 IonicContact OE1-NE 2.9Å; E1127-R1136 IonicContact OE1-NH1 2.75Å; E1127-R1136 PolarHBondContact OE1-NH1 3.35Å
1137	L	90.4	Very high	79.2	Confident	32 Å²	32	72.5 Å²	72.5	17%	0.168	36%	0.364	C	S	.	.	S	Bend	trans	-99	154.2	167.5	-62.1	177.5	0	0	0	112.2	E819 R909 E915 P1135 E1139	E819-L1137 HydrophobicContact CB-CD1 3.94Å; R909-L1137 PolarHBondContact NH2-O 3.3Å; E915-L1137 HydrophobicContact CB-CD2 3.73Å; E915-L1137 HydrophobicContact CG-CD2 3.75Å; E915-L1137 HydrophobicContact CG-CG 4.37Å; P1135-L1137 PolarHBondContact O-N 2.78Å; L1137-E1139 PolarHBondContact O-N 2.78Å
1138	M	87.4	Confident	78.7	Confident	6 Å²	6	72.3 Å²	72.3	3%	0.03	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-71.1	121.4	173.9	175.2	169.8	-104.1	0	0	111.4	D822 L823 I879 I906 R909 E1142 L1143	D822-M1138 PolarHBondContact N-O 2.68Å; D822-M1138 VanDerWaalsContact N-O 3.17Å; L823-M1138 HydrophobicContact CB-SD 4.23Å; L823-M1138 HydrophobicContact CD2-SD 4.01Å; I879-M1138 HydrophobicContact CD1-CE 4.21Å; I879-M1138 HydrophobicContact CD1-SD 4.15Å; I879-M1138 HydrophobicContact CG2-CE 4.13Å; I906-M1138 HydrophobicContact CG2-CE 3.83Å; R909-M1138 HydrophobicContact CB-CB 4.31Å; R909-M1138 PolarHBondContact O-N 3.14Å; M1138-E1142 HydrophobicContact CE-CB 4.06Å; M1138-E1142 WeakPolarHBondContact CE-OE2 3.44Å; M1138-E1142 HydrophobicContact CG-CB 4.03Å; M1138-L1143 HydrophobicContact CG-CD2 3.89Å; M1138-L1143 HydrophobicContact SD-CD2 3.82Å
1139	E	87.1	Confident	77.9	Confident	87 Å²	87	73.4 Å²	73.4	41%	0.407	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-78.7	157.6	177.1	-67	-171.7	161.8	0	0	113.3	D822 P1135 L1137 S1141 E1142	D822-E1139 WeakPolarHBondContact OD2-CA 3.19Å; P1135-E1139 HydrophobicContact CG-CG 3.7Å; L1137-E1139 PolarHBondContact O-N 2.78Å; E1139-S1141 PolarHBondContact O-N 2.66Å; E1139-S1141 VanDerWaalsContact O-N 3.1Å; E1139-S1141 PolarHBondContact OE2-OG 3.4Å; E1139-E1142 WeakPolarHBondContact O-CB 3.46Å; E1139-E1142 PolarHBondContact O-N 3.13Å
1140	F	84.7	Confident	76.8	Confident	110 Å²	110	73 Å²	73	48%	0.482	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-52.1	-28.6	168.4	-166.7	-94.9	0	0	0	113.5	D822 V826 E1142 L1143 V1148	D822-F1140 HydrophobicContact CB-CB 4.05Å; D822-F1140 VanDerWaalsContact CB-N 3.31Å; D822-F1140 PolarHBondContact OD2-N 3.45Å; V826-F1140 HydrophobicContact CG2-CD2 3.85Å; V826-F1140 HydrophobicContact CG2-CE2 3.76Å; F1140-E1142 VanDerWaalsContact C-N 3.3Å; F1140-E1142 PolarHBondContact O-N 2.93Å; F1140-L1143 HydrophobicContact CD2-CD1 4.24Å; F1140-L1143 PolarHBondContact O-N 2.81Å; F1140-V1148 HydrophobicContact CE1-CG1 3.73Å; F1140-V1148 HydrophobicContact CE2-CG1 4.1Å; F1140-V1148 HydrophobicContact CE2-CG2 4.43Å; F1140-V1148 HydrophobicContact CZ-CG1 3.35Å; F1140-V1148 HydrophobicContact CZ-CG2 4.38Å
1141	S	82.6	Confident	76.1	Confident	89 Å²	89	74.1 Å²	74.1	62%	0.622	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-69.5	-24	177.8	73.6	0	0	0	0	113.6	E1139	E1139-S1141 PolarHBondContact O-N 2.66Å; E1139-S1141 VanDerWaalsContact O-N 3.1Å; E1139-S1141 PolarHBondContact OE2-OG 3.4Å
1142	E	82.6	Confident	75.6	Confident	38 Å²	38	73 Å²	73	18%	0.178	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-86.5	-6.5	-179.3	-62.5	-178.8	-162.1	0	0	113.1	Q882 R909 M1138 E1139 F1140	Q882-E1142 PolarHBondContact NE2-O 3.14Å; R909-E1142 IonicContact CZ-OE1 2.74Å; R909-E1142 IonicContact NE-OE1 2.77Å; R909-E1142 IonicContact NE-OE2 2.87Å; R909-E1142 IonicContact NH2-OE1 3.54Å; R909-E1142 PolarHBondContact NH2-OE1 2.96Å; R909-E1142 IonicContact NH2-OE2 3.86Å; M1138-E1142 HydrophobicContact CE-CB 4.06Å; M1138-E1142 WeakPolarHBondContact CE-OE2 3.44Å; M1138-E1142 HydrophobicContact CG-CB 4.03Å; E1139-E1142 WeakPolarHBondContact O-CB 3.46Å; E1139-E1142 PolarHBondContact O-N 3.13Å; F1140-E1142 VanDerWaalsContact C-N 3.3Å; F1140-E1142 PolarHBondContact O-N 2.93Å
1143	L	84	Confident	75	Confident	10 Å²	10	71.5 Å²	71.5	5%	0.052	34%	0.344	C	S	.	.	S	Bend	trans	-85	151.6	-166.2	-53.9	-173.5	0	0	0	114.6	D822 L823 V826 Q882 M1138 F1140 K1145 V1148	D822-L1143 HydrophobicContact CB-CD1 4.42Å; L823-L1143 HydrophobicContact CB-CD2 3.78Å; L823-L1143 HydrophobicContact CD1-CD2 4.22Å; L823-L1143 HydrophobicContact CG-CD2 4.48Å; V826-L1143 HydrophobicContact CG2-CD1 4.31Å; Q882-L1143 PolarHBondContact NE2-O 3.32Å; M1138-L1143 HydrophobicContact CG-CD2 3.89Å; M1138-L1143 HydrophobicContact SD-CD2 3.82Å; F1140-L1143 HydrophobicContact CD2-CD1 4.24Å; F1140-L1143 PolarHBondContact O-N 2.81Å; L1143-K1145 PolarHBondContact O-N 2.92Å; L1143-V1148 HydrophobicContact CB-CG2 3.9Å; L1143-V1148 HydrophobicContact CD1-CG2 4.31Å
1144	P	79.2	Confident	74.4	Confident	4 Å²	4	62.4 Å²	62.4	3%	0.026	31%	0.31	C	S	.	.			trans	-62.2	130	169.8	-22.6	31.5	0	0	0	113	A878 I879 W1146 I1147 V1148	A878-P1144 HydrophobicContact CB-CG 4.4Å; I879-P1144 HydrophobicContact CD1-CG 3.98Å; P1144-W1146 HydrophobicContact CB-CG 4.42Å; P1144-W1146 PolarHBondContact O-N 3.12Å; P1144-I1147 HydrophobicContact CB-CD1 4.27Å; P1144-I1147 HydrophobicContact CB-CG1 4.23Å; P1144-I1147 HydrophobicContact CG-CD1 3.97Å; P1144-I1147 HydrophobicContact CG-CG1 4.47Å; P1144-I1147 WeakPolarHBondContact O-CB 3.05Å; P1144-I1147 PolarHBondContact O-N 3.34Å; P1144-V1148 PolarHBondContact O-N 2.81Å
1145	K	76.7	Confident	73.5	Confident	194 Å²	194	65 Å²	65	84%	0.843	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-24.4	-178.5	-64.7	-177.6	-179.1	178.4	0	114.3	L1143 V1148	L1143-K1145 PolarHBondContact O-N 2.92Å; K1145-V1148 CarbonylContact O-C 3.5Å; K1145-V1148 PolarHBondContact O-N 3.47Å
1146	W	74.3	Confident	72.1	Confident	28 Å²	28	70 Å²	70	11%	0.106	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-24.4	177.1	69.3	-105.7	0	0	0	113.5	L838 D840 A878 P1144 V1148 R1149	L838-W1146 HydrophobicContact CB-CE3 4.23Å; L838-W1146 HydrophobicContact CB-CZ3 3.77Å; L838-W1146 WeakPolarHBondContact O-CZ3 3.5Å; D840-W1146 HydrophobicContact CB-CD2 4.15Å; D840-W1146 HydrophobicContact CB-CZ2 4.07Å; D840-W1146 VanDerWaalsContact OD1-CD1 3.25Å; D840-W1146 PolarHBondContact OD1-NE1 3.19Å; A878-W1146 HydrophobicContact CB-CZ2 3.61Å; P1144-W1146 HydrophobicContact CB-CG 4.42Å; P1144-W1146 PolarHBondContact O-N 3.12Å; W1146-V1148 VanDerWaalsContact C-N 3.29Å; W1146-R1149 WeakPolarHBondContact O-CG 3.33Å
1147	I	77.8	Confident	70.5	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-26	170.5	-61.3	-177.2	0	0	0	110.2	L823 V826 L827 L838 I875 P1144	L823-I1147 HydrophobicContact CD1-CD1 4.09Å; L823-I1147 HydrophobicContact CD1-CG2 4.47Å; V826-I1147 HydrophobicContact CG1-CG2 3.95Å; L827-I1147 HydrophobicContact CD2-CG2 4.22Å; L838-I1147 HydrophobicContact CD1-CG2 4.41Å; L838-I1147 VanDerWaalsContact CD1-O 3.26Å; L838-I1147 WeakPolarHBondContact CD1-O 3.34Å; I875-I1147 HydrophobicContact CG2-CD1 4.24Å; P1144-I1147 HydrophobicContact CB-CD1 4.27Å; P1144-I1147 HydrophobicContact CB-CG1 4.23Å; P1144-I1147 HydrophobicContact CG-CD1 3.97Å; P1144-I1147 HydrophobicContact CG-CG1 4.47Å; P1144-I1147 WeakPolarHBondContact O-CB 3.05Å; P1144-I1147 PolarHBondContact O-N 3.34Å
1148	V	71.2	Confident	68.6	Low	47 Å²	47	71.4 Å²	71.4	29%	0.285	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	18	-176.3	-176.4	0	0	0	0	112.4	F1140 L1143 P1144 K1145 W1146 D1150	F1140-V1148 HydrophobicContact CE1-CG1 3.73Å; F1140-V1148 HydrophobicContact CE2-CG1 4.1Å; F1140-V1148 HydrophobicContact CE2-CG2 4.43Å; F1140-V1148 HydrophobicContact CZ-CG1 3.35Å; F1140-V1148 HydrophobicContact CZ-CG2 4.38Å; L1143-V1148 HydrophobicContact CB-CG2 3.9Å; L1143-V1148 HydrophobicContact CD1-CG2 4.31Å; P1144-V1148 PolarHBondContact O-N 2.81Å; K1145-V1148 CarbonylContact O-C 3.5Å; K1145-V1148 PolarHBondContact O-N 3.47Å; W1146-V1148 VanDerWaalsContact C-N 3.29Å; V1148-D1150 PolarHBondContact O-N 3.21Å
1149	R	62.6	Low	66.6	Low	76 Å²	76	74.1 Å²	74.1	29%	0.287	37%	0.368	S	S	.	.			trans	-61.7	133	-179.9	-78.6	178.6	-178.4	133.4	3.7	111.8	W1146 E1153	W1146-R1149 WeakPolarHBondContact O-CG 3.33Å; R1149-E1153 IonicContact NE-OE2 2.74Å
1150	D	56.2	Low	64.9	Low	125 Å²	125	76.4 Å²	76.4	67%	0.668	38%	0.382	S	S	*	.			trans	-52.1	140.7	176.6	-74.5	-37.8	0	0	0	112	V1148 I1152 E1153 L1154	V1148-D1150 PolarHBondContact O-N 3.21Å; D1150-I1152 PolarHBondContact O-N 2.9Å; D1150-E1153 PolarHBondContact O-N 3.5Å; D1150-L1154 PolarHBondContact O-N 3.02Å
1151	D	58.6	Low	63	Low	94 Å²	94	74.4 Å²	74.4	50%	0.503	37%	0.374	S	S	.	.	H	α-helix	trans	-46.8	-39.2	177	-81.9	-55.3	0	0	0	112.8	K834 L1154 E1155	K834-D1151 IonicContact NZ-OD1 2.71Å; K834-D1151 PolarHBondContact NZ-OD1 3.04Å; D1151-L1154 PolarHBondContact O-N 2.84Å; D1151-E1155 WeakPolarHBondContact O-CB 3.36Å; D1151-E1155 WeakPolarHBondContact O-CG 3.26Å; D1151-E1155 PolarHBondContact O-N 3.04Å
1152	I	53.4	Low	61	Low	96 Å²	96	76.9 Å²	76.9	49%	0.492	38%	0.381	S	S	.	.	H	α-helix	trans	-66.8	-36.6	-177.6	-56.9	171.8	0	0	0	112.3	D1150 R1156	D1150-I1152 PolarHBondContact O-N 2.9Å; I1152-R1156 WeakPolarHBondContact O-CB 3.42Å; I1152-R1156 WeakPolarHBondContact O-CD 3.41Å; I1152-R1156 WeakPolarHBondContact O-CG 3.39Å; I1152-R1156 PolarHBondContact O-N 3.42Å
1153	E	56	Low	58.8	Low	103 Å²	103	82.1 Å²	82.1	48%	0.481	41%	0.41	S	S	.	.	H	α-helix	trans	-73.4	-36.1	176.9	-173.4	169.5	-116.6	0	0	110.7	R1149 D1150 S1157	R1149-E1153 IonicContact NE-OE2 2.74Å; D1150-E1153 PolarHBondContact O-N 3.5Å; E1153-S1157 WeakPolarHBondContact O-CB 3.19Å; E1153-S1157 PolarHBondContact O-N 3.44Å; E1153-S1157 PolarHBondContact O-OG 3.05Å
1154	L	56.1	Low	56.7	Low	6 Å²	6	87.2 Å²	87.2	3%	0.031	44%	0.441	C	S	.	.	H	α-helix	trans	-69.3	-42.7	174.8	-150.2	74.2	0	0	0	112	K834 L838 D1150 D1151 S1157 L1158	K834-L1154 HydrophobicContact CD-CD2 3.77Å; L838-L1154 HydrophobicContact CD2-CD1 3.48Å; L838-L1154 VanDerWaalsContact CD2-CD1 3.48Å; L838-L1154 HydrophobicContact CD2-CD2 3.73Å; L838-L1154 HydrophobicContact CD2-CG 4.28Å; D1150-L1154 PolarHBondContact O-N 3.02Å; D1151-L1154 PolarHBondContact O-N 2.84Å; L1154-S1157 WeakPolarHBondContact O-CB 3.28Å; L1154-S1157 PolarHBondContact O-N 2.92Å; L1154-L1158 VanDerWaalsContact O-CG 3.3Å; L1154-L1158 WeakPolarHBondContact O-CG 3.28Å; L1154-L1158 PolarHBondContact O-N 3.18Å
1155	E	54	Low	54.6	Low	119 Å²	119	93.2 Å²	93.2	56%	0.556	47%	0.467	S	S	*	.	H	α-helix	trans	-63	-39.7	173.8	-78.7	-171.5	161	0	0	112.6	D1151 S1157 L1158 S1159	D1151-E1155 WeakPolarHBondContact O-CB 3.36Å; D1151-E1155 WeakPolarHBondContact O-CG 3.26Å; D1151-E1155 PolarHBondContact O-N 3.04Å; E1155-S1157 VanDerWaalsContact C-N 3.33Å; E1155-S1157 PolarHBondContact O-N 3.02Å; E1155-L1158 PolarHBondContact O-N 3.29Å; E1155-S1159 VanDerWaalsContact O-CB 3.28Å; E1155-S1159 WeakPolarHBondContact O-CB 3.37Å; E1155-S1159 PolarHBondContact O-N 2.7Å; E1155-S1159 PolarHBondContact O-OG 2.66Å
1156	R	53.7	Low	52.5	Low	166 Å²	166	87.5 Å²	87.5	63%	0.626	46%	0.463	S	S	*	.	H	α-helix	trans	-60.7	-43.2	171.1	-77.1	169.8	-177.8	165.5	4.5	111.7	I1152 L1158 S1159 L1160	I1152-R1156 WeakPolarHBondContact O-CB 3.42Å; I1152-R1156 WeakPolarHBondContact O-CD 3.41Å; I1152-R1156 WeakPolarHBondContact O-CG 3.39Å; I1152-R1156 PolarHBondContact O-N 3.42Å; R1156-L1158 VanDerWaalsContact C-N 3.35Å; R1156-L1158 PolarHBondContact O-N 2.89Å; R1156-S1159 WeakPolarHBondContact CA-OG 3.46Å; R1156-S1159 PolarHBondContact O-OG 3.02Å; R1156-S1159 VanDerWaalsContact O-OG 3.11Å; R1156-L1160 WeakPolarHBondContact O-CG 3.29Å; R1156-L1160 PolarHBondContact O-N 3.32Å
1157	S	51.9	Low	50.3	Low	58 Å²	58	94.2 Å²	94.2	41%	0.406	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-41.1	178.1	-57.9	0	0	0	0	112	E1153 L1154 E1155	E1153-S1157 WeakPolarHBondContact O-CB 3.19Å; E1153-S1157 PolarHBondContact O-N 3.44Å; E1153-S1157 PolarHBondContact O-OG 3.05Å; L1154-S1157 WeakPolarHBondContact O-CB 3.28Å; L1154-S1157 PolarHBondContact O-N 2.92Å; E1155-S1157 VanDerWaalsContact C-N 3.33Å; E1155-S1157 PolarHBondContact O-N 3.02Å
1158	L	50.2	Low	48.1	Very low	44 Å²	44	104 Å²	104	23%	0.23	54%	0.541	C	S	.	.	H	α-helix	trans	-73.6	-43.9	178.8	-67.6	166	0	0	0	112.6	K834 V836 L1154 E1155 R1156 L1160 E1161	K834-L1158 HydrophobicContact CD-CD1 4.39Å; V836-L1158 HydrophobicContact CG2-CD2 4.38Å; L1154-L1158 VanDerWaalsContact O-CG 3.3Å; L1154-L1158 WeakPolarHBondContact O-CG 3.28Å; L1154-L1158 PolarHBondContact O-N 3.18Å; E1155-L1158 PolarHBondContact O-N 3.29Å; R1156-L1158 VanDerWaalsContact C-N 3.35Å; R1156-L1158 PolarHBondContact O-N 2.89Å; L1158-L1160 PolarHBondContact O-N 3.4Å; L1158-E1161 PolarHBondContact O-N 2.97Å
1159	S	46.7	Very low	46.2	Very low	63 Å²	63	113.6 Å²	113.6	44%	0.441	57%	0.572	S	S	.	*	H	α-helix	trans	-65	-19.2	-179.5	56.8	0	0	0	0	114.3	E1155 R1156	E1155-S1159 VanDerWaalsContact O-CB 3.28Å; E1155-S1159 WeakPolarHBondContact O-CB 3.37Å; E1155-S1159 PolarHBondContact O-N 2.7Å; E1155-S1159 PolarHBondContact O-OG 2.66Å; R1156-S1159 WeakPolarHBondContact CA-OG 3.46Å; R1156-S1159 PolarHBondContact O-OG 3.02Å; R1156-S1159 VanDerWaalsContact O-OG 3.11Å
1160	L	51	Low	44.6	Very low	134 Å²	134	119.3 Å²	119.3	70%	0.702	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-22.4	170.3	-75	166.4	0	0	0	113.3	R1156 L1158	R1156-L1160 WeakPolarHBondContact O-CG 3.29Å; R1156-L1160 PolarHBondContact O-N 3.32Å; L1158-L1160 PolarHBondContact O-N 3.4Å
1161	E	44.3	Very low	43.5	Very low	68 Å²	68	124.6 Å²	124.6	32%	0.318	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.6	-34.7	178.8	-64.4	-149.7	113	0	0	113.1	K849 L1158 N1163 V1164 F1165	K849-E1161 IonicContact NZ-OE1 3.82Å; K849-E1161 PolarHBondContact NZ-OE1 2.7Å; L1158-E1161 PolarHBondContact O-N 2.97Å; E1161-N1163 PolarHBondContact O-N 3.05Å; E1161-V1164 PolarHBondContact O-N 2.85Å; E1161-F1165 HydrophobicContact CB-CD2 4.17Å; E1161-F1165 HydrophobicContact CB-CE2 3.98Å; E1161-F1165 HydrophobicContact CG-CE2 4.23Å; E1161-F1165 WeakPolarHBondContact O-CD2 3.3Å; E1161-F1165 WeakPolarHBondContact OE1-CE2 3.46Å
1162	D	40.1	Very low	42.2	Very low	142 Å²	142	126.6 Å²	126.6	76%	0.759	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	-29.7	-175.8	-89.4	-31.4	0	0	0	114.2
1163	N	36.2	Very low	41.2	Very low	148 Å²	148	130.5 Å²	130.5	79%	0.791	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-3.4	-176.9	-74	-72.9	0	0	0	115.1	E1161	E1161-N1163 PolarHBondContact O-N 3.05Å
1164	V	40.5	Very low	40	Very low	116 Å²	116	129.3 Å²	129.3	70%	0.703	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	-22.5	-167.7	-173.4	0	0	0	0	114.3	E1161 G1166	E1161-V1164 PolarHBondContact O-N 2.85Å; V1164-G1166 PolarHBondContact O-N 2.82Å
1165	F	35.4	Very low	38.8	Very low	130 Å²	130	135.9 Å²	135.9	57%	0.57	67%	0.667	S	S	*	*			trans	-84	1.3	-170.4	-85.8	-90.3	0	0	0	116.9	K849 E1161 M1167	K849-F1165 VanDerWaalsContact NZ-CZ 3.29Å; E1161-F1165 HydrophobicContact CB-CD2 4.17Å; E1161-F1165 HydrophobicContact CB-CE2 3.98Å; E1161-F1165 HydrophobicContact CG-CE2 4.23Å; E1161-F1165 WeakPolarHBondContact O-CD2 3.3Å; E1161-F1165 WeakPolarHBondContact OE1-CE2 3.46Å; F1165-M1167 PolarHBondContact O-N 3.3Å
1166	G	32.5	Very low	37.8	Very low	75 Å²	75	138.5 Å²	138.5	77%	0.773	67%	0.673	S	S	*	*	S	Bend	trans	-64.1	-2.8	-171.3	0	0	0	0	0	118.1	V1164	V1164-G1166 PolarHBondContact O-N 2.82Å
1167	M	28	Very low	36.7	Very low	169 Å²	169	135.3 Å²	135.3	83%	0.833	68%	0.676	S	S	*	*			trans	-139	70.9	-169.8	-75.9	-69.9	-176	0	0	114.9	F1165	F1165-M1167 PolarHBondContact O-N 3.3Å
1168	K	32.5	Very low	36.3	Very low	206 Å²	206	138.4 Å²	138.4	90%	0.896	69%	0.688	S	S	*	*	S	Bend	trans	-156.7	122	153.1	-105.5	126.7	-166.4	167	0	114	Q1170	K1168-Q1170 PolarHBondContact O-N 3.23Å
1169	R	29.6	Very low	36.6	Very low	248 Å²	248	136.9 Å²	136.9	94%	0.936	68%	0.682	S	S	*	*			trans	1.8	101.9	170.6	-69.3	179.4	171.5	176.8	-3.3	116.5	R1171	R1169-R1171 PolarHBondContact O-N 3.49Å
1170	Q	29.8	Very low	37	Very low	196 Å²	196	135 Å²	135	92%	0.916	67%	0.667	S	S	*	*			trans	-52	110.3	164.1	-75	-178.4	-23	0	0	111	K1168 K1172	K1168-Q1170 PolarHBondContact O-N 3.23Å; Q1170-K1172 PolarHBondContact O-N 2.82Å; Q1170-K1172 VanDerWaalsContact O-N 3.13Å
1171	R	32.5	Very low	37.3	Very low	235 Å²	235	132.7 Å²	132.7	89%	0.887	66%	0.658	S	S	*	*			trans	-64.9	112.5	160.7	-100.6	-178	169	175.8	-5.1	106.6	R1169 E1173	R1169-R1171 PolarHBondContact O-N 3.49Å; R1171-E1173 PolarHBondContact O-N 2.83Å
1172	K	31.6	Very low	37.7	Very low	136 Å²	136	132.7 Å²	132.7	59%	0.591	66%	0.659	S	S	*	*			trans	-51.8	109.7	-177.8	174.2	-167.5	170.1	-162.7	0	110.6	Q1170	Q1170-K1172 PolarHBondContact O-N 2.82Å; Q1170-K1172 VanDerWaalsContact O-N 3.13Å
1173	E	33.8	Very low	38.5	Very low	178 Å²	178	136 Å²	136	83%	0.832	66%	0.66	S	S	*	*			trans	-44.9	137	177.8	-63.8	160.6	145.6	0	0	111.9	R1171 D1175	R1171-E1173 PolarHBondContact O-N 2.83Å; E1173-D1175 PolarHBondContact O-N 2.92Å
1174	V	29.8	Very low	39.5	Very low	79 Å²	79	133.3 Å²	133.3	48%	0.479	64%	0.643	S	S	.	*			trans	-85.3	103.9	165.5	-178	0	0	0	0	106.1	Y1176 A1486	V1174-Y1176 HydrophobicContact CB-CD2 4.2Å; V1174-Y1176 HydrophobicContact CB-CE2 3.87Å; V1174-Y1176 HydrophobicContact CG1-CD1 4.35Å; V1174-Y1176 HydrophobicContact CG1-CD2 3.92Å; V1174-Y1176 HydrophobicContact CG1-CE1 3.98Å; V1174-Y1176 HydrophobicContact CG1-CE2 3.54Å; V1174-Y1176 HydrophobicContact CG1-CG 4.32Å; V1174-Y1176 WeakPolarHBondContact O-CD2 3.42Å; V1174-Y1176 PolarHBondContact O-N 3.47Å; V1174-A1486 HydrophobicContact CG2-CB 4.47Å
1175	D	30.5	Very low	40.4	Very low	144 Å²	144	130.2 Å²	130.2	77%	0.77	62%	0.62	S	S	*	*			trans	-65.9	70.8	178.3	-171.8	8.7	0	0	0	110.5	E1173	E1173-D1175 PolarHBondContact O-N 2.92Å
1176	Y	34	Very low	41.4	Very low	174 Å²	174	125.4 Å²	125.4	68%	0.682	60%	0.6	S	S	*	*			trans	-70.2	123.6	157.1	-60.8	-66.9	0	0	0	106.5	V1174 D1178	V1174-Y1176 HydrophobicContact CB-CD2 4.2Å; V1174-Y1176 HydrophobicContact CB-CE2 3.87Å; V1174-Y1176 HydrophobicContact CG1-CD1 4.35Å; V1174-Y1176 HydrophobicContact CG1-CD2 3.92Å; V1174-Y1176 HydrophobicContact CG1-CE1 3.98Å; V1174-Y1176 HydrophobicContact CG1-CE2 3.54Å; V1174-Y1176 HydrophobicContact CG1-CG 4.32Å; V1174-Y1176 WeakPolarHBondContact O-CD2 3.42Å; V1174-Y1176 PolarHBondContact O-N 3.47Å; Y1176-D1178 PolarHBondContact O-N 2.75Å
1177	S	29.4	Very low	43.1	Very low	98 Å²	98	127.4 Å²	127.4	69%	0.685	59%	0.587	S	S	*	*			trans	-86.4	51.1	-158.3	66.7	0	0	0	0	114.3
1178	D	44.2	Very low	44.8	Very low	123 Å²	123	119.5 Å²	119.5	66%	0.658	55%	0.549	S	S	*	.			trans	-66.2	149.2	165	-63.3	-43.3	0	0	0	109.6	Y1176 R1205	Y1176-D1178 PolarHBondContact O-N 2.75Å; D1178-R1205 PolarHBondContact O-NH1 2.78Å; D1178-R1205 PolarHBondContact O-NH2 3.04Å; D1178-R1205 VanDerWaalsContact O-NH2 3.15Å
1179	A	57.1	Low	46.2	Very low	12 Å²	12	111.1 Å²	111.1	10%	0.099	51%	0.514	C	S	.	.	S	Bend	trans	-82	-37.5	-169.1	0	0	0	0	0	112.7	E1198 Q1201 R1205	A1179-E1198 HydrophobicContact CB-CB 4.37Å; A1179-E1198 HydrophobicContact CB-CG 4.06Å; A1179-Q1201 WeakPolarHBondContact O-CG 3.43Å; A1179-Q1201 PolarHBondContact O-NE2 3.06Å; A1179-Q1201 PolarHBondContact O-OE1 3.5Å; A1179-R1205 PolarHBondContact O-NH2 3.34Å
1180	L	53.9	Low	47.5	Very low	25 Å²	25	103.3 Å²	103.3	13%	0.131	49%	0.491	C	S	.	.	S	Bend	trans	-107.3	156.1	-167.2	-68.2	148.2	0	0	0	110.7	Q1184 F1185 L1194 A1197 E1198	L1180-Q1184 HydrophobicContact CB-CB 4.2Å; L1180-Q1184 HydrophobicContact CD2-CB 3.72Å; L1180-F1185 HydrophobicContact CB-CB 4.03Å; L1180-F1185 HydrophobicContact CD1-CB 4.47Å; L1180-F1185 HydrophobicContact CD1-CD2 4.04Å; L1180-L1194 HydrophobicContact CD1-CD1 3.83Å; L1180-A1197 HydrophobicContact CD1-CB 4.3Å; L1180-A1197 HydrophobicContact CD2-CB 3.84Å; L1180-E1198 HydrophobicContact CD1-CG 4Å
1181	T	58	Low	48.9	Very low	84 Å²	84	99.3 Å²	99.3	52%	0.515	47%	0.472	S	S	.	.			trans	-78.2	154.1	160.1	40.9	0	0	0	0	109.6	R1183 Q1184 F1185	T1181-R1183 VanDerWaalsContact C-N 3.26Å; T1181-R1183 PolarHBondContact O-N 2.82Å; T1181-R1183 VanDerWaalsContact O-N 3.13Å; T1181-Q1184 CarbonylContact O-C 3.55Å; T1181-Q1184 WeakPolarHBondContact O-CA 3.35Å; T1181-Q1184 WeakPolarHBondContact O-CB 3.43Å; T1181-Q1184 PolarHBondContact O-N 3.43Å; T1181-Q1184 VanDerWaalsContact OG1-CG 3.24Å; T1181-Q1184 WeakPolarHBondContact OG1-CG 3.39Å; T1181-Q1184 PolarHBondContact OG1-OE1 3.27Å; T1181-F1185 PolarHBondContact O-N 2.89Å
1182	E	53	Low	49.8	Very low	69 Å²	69	91.5 Å²	91.5	32%	0.322	47%	0.465	S	S	.	.	H	α-helix	trans	-50.5	-42	-176.9	-175.4	165.9	-146.8	0	0	113.4	N857 T858 Q1184 F1185 L1186	N857-E1182 WeakPolarHBondContact CA-OE1 2.92Å; N857-E1182 PolarHBondContact N-OE1 3.42Å; T858-E1182 PolarHBondContact N-OE1 3.34Å; E1182-Q1184 PolarHBondContact O-N 2.81Å; E1182-F1185 WeakPolarHBondContact O-CB 3.34Å; E1182-F1185 PolarHBondContact O-N 3.15Å; E1182-L1186 HydrophobicContact CG-CD1 4.23Å; E1182-L1186 WeakPolarHBondContact O-CB 3.11Å; E1182-L1186 WeakPolarHBondContact O-CG 3.34Å; E1182-L1186 PolarHBondContact O-N 2.98Å
1183	R	55.7	Low	51.1	Low	212 Å²	212	86.3 Å²	86.3	80%	0.8	45%	0.445	S	S	*	.	H	α-helix	trans	-70.3	-27.2	175.4	-161.6	174.2	-171.6	171.3	5	114.2	T1181 K1187	T1181-R1183 VanDerWaalsContact C-N 3.26Å; T1181-R1183 PolarHBondContact O-N 2.82Å; T1181-R1183 VanDerWaalsContact O-N 3.13Å; R1183-K1187 VanDerWaalsContact O-CB 3.3Å; R1183-K1187 WeakPolarHBondContact O-CB 3.28Å; R1183-K1187 PolarHBondContact O-N 2.8Å
1184	Q	58.4	Low	52.1	Low	91 Å²	91	80.2 Å²	80.2	43%	0.425	42%	0.418	S	S	.	.	H	α-helix	trans	-78	-33.4	170.6	-70.2	173.4	-21.2	0	0	111.7	L1180 T1181 E1182 A1188	L1180-Q1184 HydrophobicContact CB-CB 4.2Å; L1180-Q1184 HydrophobicContact CD2-CB 3.72Å; T1181-Q1184 CarbonylContact O-C 3.55Å; T1181-Q1184 WeakPolarHBondContact O-CA 3.35Å; T1181-Q1184 WeakPolarHBondContact O-CB 3.43Å; T1181-Q1184 PolarHBondContact O-N 3.43Å; T1181-Q1184 VanDerWaalsContact OG1-CG 3.24Å; T1181-Q1184 WeakPolarHBondContact OG1-CG 3.39Å; T1181-Q1184 PolarHBondContact OG1-OE1 3.27Å; E1182-Q1184 PolarHBondContact O-N 2.81Å; Q1184-A1188 VanDerWaalsContact O-CB 3.28Å; Q1184-A1188 WeakPolarHBondContact O-CB 3.32Å; Q1184-A1188 PolarHBondContact O-N 3.38Å
1185	F	59.3	Low	53.3	Low	51 Å²	51	79.7 Å²	79.7	22%	0.224	41%	0.411	C	S	.	.	H	α-helix	trans	-68	-49.9	176.2	-176.4	-87.6	0	0	0	110.9	I859 L1180 T1181 E1182 K1187 A1188 I1189 L1194	I859-F1185 HydrophobicContact CD1-CD1 3.83Å; I859-F1185 HydrophobicContact CD1-CE1 3.39Å; I859-F1185 HydrophobicContact CD1-CZ 4.31Å; I859-F1185 HydrophobicContact CG1-CE1 4.4Å; L1180-F1185 HydrophobicContact CB-CB 4.03Å; L1180-F1185 HydrophobicContact CD1-CB 4.47Å; L1180-F1185 HydrophobicContact CD1-CD2 4.04Å; T1181-F1185 PolarHBondContact O-N 2.89Å; E1182-F1185 WeakPolarHBondContact O-CB 3.34Å; E1182-F1185 PolarHBondContact O-N 3.15Å; F1185-K1187 PolarHBondContact O-N 3.05Å; F1185-A1188 PolarHBondContact O-N 3.43Å; F1185-I1189 HydrophobicContact CD1-CD1 3.83Å; F1185-I1189 HydrophobicContact CD1-CG1 4.46Å; F1185-I1189 HydrophobicContact CE1-CD1 3.24Å; F1185-I1189 HydrophobicContact CE1-CG1 4.2Å; F1185-I1189 HydrophobicContact CZ-CD1 3.79Å; F1185-I1189 WeakPolarHBondContact O-CB 3.33Å; F1185-I1189 PolarHBondContact O-N 3.3Å; F1185-L1194 HydrophobicContact CD2-CD1 3.77Å; F1185-L1194 HydrophobicContact CE2-CD1 3.83Å; F1185-L1194 HydrophobicContact CE2-CD2 4.2Å; F1185-L1194 HydrophobicContact CG-CD1 4.34Å; F1185-L1194 HydrophobicContact CZ-CD1 4.45Å; F1185-L1194 HydrophobicContact CZ-CD2 4.29Å
1186	L	56.6	Low	54.7	Low	29 Å²	29	75 Å²	75	15%	0.152	38%	0.384	C	S	.	.	H	α-helix	trans	-57.4	-47.5	172.8	-70.8	166.5	0	0	0	111.3	T858 I859 E1182 A1188 I1189 D1190	T858-L1186 HydrophobicContact CG2-CD1 3.95Å; T858-L1186 HydrophobicContact CG2-CD2 4.31Å; I859-L1186 HydrophobicContact CG1-CD2 4.42Å; E1182-L1186 HydrophobicContact CG-CD1 4.23Å; E1182-L1186 WeakPolarHBondContact O-CB 3.11Å; E1182-L1186 WeakPolarHBondContact O-CG 3.34Å; E1182-L1186 PolarHBondContact O-N 2.98Å; L1186-A1188 PolarHBondContact O-N 3.46Å; L1186-I1189 CarbonylContact O-C 3.58Å; L1186-I1189 WeakPolarHBondContact O-CA 3.3Å; L1186-I1189 WeakPolarHBondContact O-CB 3.34Å; L1186-I1189 PolarHBondContact O-N 3.14Å; L1186-I1189 VanDerWaalsContact O-N 3.12Å; L1186-D1190 PolarHBondContact O-N 2.88Å
1187	K	66.7	Low	56.1	Low	116 Å²	116	67.6 Å²	67.6	50%	0.504	36%	0.359	S	S	.	.	H	α-helix	trans	-62.3	-39.7	176.8	178.6	172.1	164.9	75.5	0	112.9	R1183 F1185 I1189 D1190 E1191	R1183-K1187 VanDerWaalsContact O-CB 3.3Å; R1183-K1187 WeakPolarHBondContact O-CB 3.28Å; R1183-K1187 PolarHBondContact O-N 2.8Å; F1185-K1187 PolarHBondContact O-N 3.05Å; K1187-I1189 VanDerWaalsContact C-N 3.3Å; K1187-I1189 PolarHBondContact O-N 2.63Å; K1187-D1190 PolarHBondContact O-N 3.28Å; K1187-E1191 VanDerWaalsContact CE-OE1 3.31Å; K1187-E1191 WeakPolarHBondContact CE-OE1 3.14Å; K1187-E1191 WeakPolarHBondContact CE-OE2 3.48Å; K1187-E1191 HydrophobicContact CG-CG 4.26Å; K1187-E1191 WeakPolarHBondContact CG-OE2 3.24Å; K1187-E1191 IonicContact NZ-OE1 3.5Å; K1187-E1191 PolarHBondContact NZ-OE1 2.76Å; K1187-E1191 IonicContact NZ-OE2 3.43Å; K1187-E1191 PolarHBondContact NZ-OE2 3.48Å; K1187-E1191 WeakPolarHBondContact O-CB 3.49Å; K1187-E1191 WeakPolarHBondContact O-CG 3.43Å; K1187-E1191 PolarHBondContact O-N 3.42Å
1188	A	65	Low	57.4	Low	3 Å²	3	65.9 Å²	65.9	3%	0.025	34%	0.34	C	S	.	.	H	α-helix	trans	-73.5	-20.5	175.8	0	0	0	0	0	113.3	Q1184 F1185 L1186 G1192 S1193 L1194 A1197	Q1184-A1188 VanDerWaalsContact O-CB 3.28Å; Q1184-A1188 WeakPolarHBondContact O-CB 3.32Å; Q1184-A1188 PolarHBondContact O-N 3.38Å; F1185-A1188 PolarHBondContact O-N 3.43Å; L1186-A1188 PolarHBondContact O-N 3.46Å; A1188-G1192 CarbonylContact O-C 3.57Å; A1188-G1192 PolarHBondContact O-N 3.3Å; A1188-S1193 PolarHBondContact O-N 2.97Å; A1188-L1194 HydrophobicContact CB-CD1 4Å; A1188-L1194 PolarHBondContact O-N 3.47Å; A1188-A1197 HydrophobicContact CB-CB 3.69Å
1189	I	61.2	Low	58.1	Low	31 Å²	31	63.2 Å²	63.2	16%	0.159	32%	0.324	C	S	.	.	H	α-helix	trans	-76.2	-30.1	167.3	-83.4	-172.6	0	0	0	112.1	K1045 F1185 L1186 K1187 L1194	K1045-I1189 HydrophobicContact CD-CG2 3.48Å; K1045-I1189 VanDerWaalsContact CD-CG2 3.48Å; K1045-I1189 PolarHBondContact NZ-O 2.86Å; F1185-I1189 HydrophobicContact CD1-CD1 3.83Å; F1185-I1189 HydrophobicContact CD1-CG1 4.46Å; F1185-I1189 HydrophobicContact CE1-CD1 3.24Å; F1185-I1189 HydrophobicContact CE1-CG1 4.2Å; F1185-I1189 HydrophobicContact CZ-CD1 3.79Å; F1185-I1189 WeakPolarHBondContact O-CB 3.33Å; F1185-I1189 PolarHBondContact O-N 3.3Å; L1186-I1189 CarbonylContact O-C 3.58Å; L1186-I1189 WeakPolarHBondContact O-CA 3.3Å; L1186-I1189 WeakPolarHBondContact O-CB 3.34Å; L1186-I1189 PolarHBondContact O-N 3.14Å; L1186-I1189 VanDerWaalsContact O-N 3.12Å; K1187-I1189 VanDerWaalsContact C-N 3.3Å; K1187-I1189 PolarHBondContact O-N 2.63Å; I1189-L1194 HydrophobicContact CD1-CD2 4.32Å; I1189-L1194 HydrophobicContact CG1-CD1 4.15Å; I1189-L1194 HydrophobicContact CG1-CD2 3.92Å; I1189-L1194 HydrophobicContact CG1-CG 4.47Å
1190	D	57.1	Low	58.5	Low	83 Å²	83	67.7 Å²	67.7	44%	0.444	34%	0.338	S	S	.	.	H	α-helix	trans	-85.9	-27.2	176.1	-70.5	-17.5	0	0	0	112.7	Q832 K1045 L1186 K1187	Q832-D1190 PolarHBondContact NE2-OD2 2.89Å; K1045-D1190 IonicContact NZ-OD1 2.76Å; K1045-D1190 PolarHBondContact NZ-OD1 3.46Å; L1186-D1190 PolarHBondContact O-N 2.88Å; K1187-D1190 PolarHBondContact O-N 3.28Å
1191	E	58.5	Low	58.9	Low	113 Å²	113	68.9 Å²	68.9	53%	0.528	34%	0.343	S	S	.	.	S	Bend	trans	-91.5	7.9	173.4	-67.3	-179.4	142.1	0	0	113.6	K1187 S1193	K1187-E1191 VanDerWaalsContact CE-OE1 3.31Å; K1187-E1191 WeakPolarHBondContact CE-OE1 3.14Å; K1187-E1191 WeakPolarHBondContact CE-OE2 3.48Å; K1187-E1191 HydrophobicContact CG-CG 4.26Å; K1187-E1191 WeakPolarHBondContact CG-OE2 3.24Å; K1187-E1191 IonicContact NZ-OE1 3.5Å; K1187-E1191 PolarHBondContact NZ-OE1 2.76Å; K1187-E1191 IonicContact NZ-OE2 3.43Å; K1187-E1191 PolarHBondContact NZ-OE2 3.48Å; K1187-E1191 WeakPolarHBondContact O-CB 3.49Å; K1187-E1191 WeakPolarHBondContact O-CG 3.43Å; K1187-E1191 PolarHBondContact O-N 3.42Å; E1191-S1193 PolarHBondContact O-N 2.92Å
1192	G	51.5	Low	59.1	Low	71 Å²	71	72.3 Å²	72.3	73%	0.732	35%	0.346	S	S	*	.	S	Bend	trans	63.6	-5.8	-177.6	0	0	0	0	0	116	A1188 L1194	A1188-G1192 CarbonylContact O-C 3.57Å; A1188-G1192 PolarHBondContact O-N 3.3Å; G1192-L1194 VanDerWaalsContact C-N 3.35Å; G1192-L1194 PolarHBondContact O-N 3.36Å
1193	S	59.5	Low	59.6	Low	26 Å²	26	73.5 Å²	73.5	18%	0.182	35%	0.352	C	S	.	.			trans	-92	24.7	-166.4	61.8	0	0	0	0	114.4	A1188 E1191 E1195 E1196 A1197	A1188-S1193 PolarHBondContact O-N 2.97Å; E1191-S1193 PolarHBondContact O-N 2.92Å; S1193-E1195 PolarHBondContact O-N 3.3Å; S1193-E1196 CarbonylContact O-C 3.59Å; S1193-E1196 WeakPolarHBondContact O-CA 3.36Å; S1193-E1196 WeakPolarHBondContact O-CB 3.29Å; S1193-E1196 PolarHBondContact O-N 2.74Å; S1193-A1197 WeakPolarHBondContact O-CB 3.21Å; S1193-A1197 PolarHBondContact O-N 2.75Å
1194	L	55.5	Low	60.3	Low	50 Å²	50	70.4 Å²	70.4	26%	0.262	34%	0.344	S	S	.	.	H	α-helix	trans	-55.6	-47.4	-170.3	-171.9	63	0	0	0	113.7	L1180 F1185 A1188 I1189 G1192 A1197 E1198	L1180-L1194 HydrophobicContact CD1-CD1 3.83Å; F1185-L1194 HydrophobicContact CD2-CD1 3.77Å; F1185-L1194 HydrophobicContact CE2-CD1 3.83Å; F1185-L1194 HydrophobicContact CE2-CD2 4.2Å; F1185-L1194 HydrophobicContact CG-CD1 4.34Å; F1185-L1194 HydrophobicContact CZ-CD1 4.45Å; F1185-L1194 HydrophobicContact CZ-CD2 4.29Å; A1188-L1194 HydrophobicContact CB-CD1 4Å; A1188-L1194 PolarHBondContact O-N 3.47Å; I1189-L1194 HydrophobicContact CD1-CD2 4.32Å; I1189-L1194 HydrophobicContact CG1-CD1 4.15Å; I1189-L1194 HydrophobicContact CG1-CD2 3.92Å; I1189-L1194 HydrophobicContact CG1-CG 4.47Å; G1192-L1194 VanDerWaalsContact C-N 3.35Å; G1192-L1194 PolarHBondContact O-N 3.36Å; L1194-A1197 PolarHBondContact O-N 3.48Å; L1194-E1198 PolarHBondContact O-N 2.78Å
1195	E	55.2	Low	60.5	Low	69 Å²	69	71.8 Å²	71.8	32%	0.322	35%	0.346	S	S	.	.	H	α-helix	trans	-69.7	-35.2	175.7	-68.2	-150.8	125	0	0	112.1	K737 S1193 A1197 E1198 E1199	K737-E1195 IonicContact NZ-OE1 2.84Å; K737-E1195 PolarHBondContact NZ-OE1 3.09Å; S1193-E1195 PolarHBondContact O-N 3.3Å; E1195-A1197 VanDerWaalsContact C-N 3.29Å; E1195-A1197 PolarHBondContact O-N 2.88Å; E1195-E1198 PolarHBondContact O-N 2.85Å; E1195-E1199 WeakPolarHBondContact O-CB 3.41Å; E1195-E1199 PolarHBondContact O-N 3.18Å
1196	E	59.3	Low	60.7	Low	44 Å²	44	72 Å²	72	21%	0.206	36%	0.357	C	S	.	.	H	α-helix	trans	-63.5	-37.1	174.8	-144.7	-172.7	-158.5	0	0	112	T770 S1193 R1200	T770-E1196 HydrophobicContact CG2-CB 3.55Å; T770-E1196 HydrophobicContact CG2-CG 3.91Å; S1193-E1196 CarbonylContact O-C 3.59Å; S1193-E1196 WeakPolarHBondContact O-CA 3.36Å; S1193-E1196 WeakPolarHBondContact O-CB 3.29Å; S1193-E1196 PolarHBondContact O-N 2.74Å; E1196-R1200 VanDerWaalsContact O-CB 3.22Å; E1196-R1200 WeakPolarHBondContact O-CB 3.17Å; E1196-R1200 VanDerWaalsContact O-CG 3.26Å; E1196-R1200 WeakPolarHBondContact O-CG 3.22Å; E1196-R1200 PolarHBondContact O-N 2.66Å; E1196-R1200 IonicContact OE1-CZ 3.26Å; E1196-R1200 IonicContact OE1-NH1 3.79Å; E1196-R1200 IonicContact OE1-NH2 2.78Å; E1196-R1200 PolarHBondContact OE1-NH2 3.11Å; E1196-R1200 IonicContact OE2-CZ 2.8Å; E1196-R1200 IonicContact OE2-NH1 2.74Å; E1196-R1200 PolarHBondContact OE2-NH1 3.17Å; E1196-R1200 IonicContact OE2-NH2 2.93Å; E1196-R1200 PolarHBondContact OE2-NH2 2.74Å; E1196-R1200 VanDerWaalsContact OE2-NH2 3.16Å
1197	A	62.7	Low	61.3	Low	20 Å²	20	73 Å²	73	17%	0.165	37%	0.37	C	S	.	.	H	α-helix	trans	-70.6	-47.5	177.7	0	0	0	0	0	110.9	L1180 A1188 S1193 L1194 E1195 E1199 Q1201	L1180-A1197 HydrophobicContact CD1-CB 4.3Å; L1180-A1197 HydrophobicContact CD2-CB 3.84Å; A1188-A1197 HydrophobicContact CB-CB 3.69Å; S1193-A1197 WeakPolarHBondContact O-CB 3.21Å; S1193-A1197 PolarHBondContact O-N 2.75Å; L1194-A1197 PolarHBondContact O-N 3.48Å; E1195-A1197 VanDerWaalsContact C-N 3.29Å; E1195-A1197 PolarHBondContact O-N 2.88Å; A1197-E1199 VanDerWaalsContact C-N 3.33Å; A1197-E1199 PolarHBondContact O-N 3.41Å; A1197-Q1201 VanDerWaalsContact O-CB 3.22Å; A1197-Q1201 WeakPolarHBondContact O-CB 3.38Å; A1197-Q1201 PolarHBondContact O-N 3.1Å
1198	E	56.8	Low	61.2	Low	61 Å²	61	77.4 Å²	77.4	29%	0.285	38%	0.383	S	S	.	.	H	α-helix	trans	-57.1	-45.7	171.3	-74.6	-144	155.6	0	0	111.9	A1179 L1180 L1194 E1195 Q1201 R1202	A1179-E1198 HydrophobicContact CB-CB 4.37Å; A1179-E1198 HydrophobicContact CB-CG 4.06Å; L1180-E1198 HydrophobicContact CD1-CG 4Å; L1194-E1198 PolarHBondContact O-N 2.78Å; E1195-E1198 PolarHBondContact O-N 2.85Å; E1198-Q1201 CarbonylContact O-C 3.59Å; E1198-Q1201 PolarHBondContact O-N 3.02Å; E1198-R1202 WeakPolarHBondContact O-CB 3.31Å; E1198-R1202 WeakPolarHBondContact O-CG 3.34Å; E1198-R1202 PolarHBondContact O-N 3.04Å
1199	E	60.3	Low	60.9	Low	68 Å²	68	84.8 Å²	84.8	32%	0.318	41%	0.414	S	S	.	.	H	α-helix	trans	-72.9	-42.5	-174.4	-174.9	51.1	-148.4	0	0	111.4	E1195 A1197 Q1201 R1202 Q1203	E1195-E1199 WeakPolarHBondContact O-CB 3.41Å; E1195-E1199 PolarHBondContact O-N 3.18Å; A1197-E1199 VanDerWaalsContact C-N 3.33Å; A1197-E1199 PolarHBondContact O-N 3.41Å; E1199-Q1201 PolarHBondContact O-N 3Å; E1199-R1202 WeakPolarHBondContact O-CB 3.23Å; E1199-R1202 PolarHBondContact O-N 3.23Å; E1199-R1202 VanDerWaalsContact OE2-CD 3.3Å; E1199-R1202 WeakPolarHBondContact OE2-CD 3.16Å; E1199-R1202 IonicContact OE2-NH1 2.81Å; E1199-Q1203 WeakPolarHBondContact O-CB 3.46Å; E1199-Q1203 VanDerWaalsContact O-CG 3.28Å; E1199-Q1203 WeakPolarHBondContact O-CG 3.49Å; E1199-Q1203 PolarHBondContact O-N 2.73Å; E1199-Q1203 WeakPolarHBondContact OE1-CG 3.1Å; E1199-Q1203 PolarHBondContact OE1-NE2 3.26Å
1200	R	64.4	Low	60.8	Low	106 Å²	106	90.5 Å²	90.5	40%	0.4	44%	0.438	S	S	.	.	H	α-helix	trans	-59.6	-35.4	169	-76.9	178.8	176.9	133.4	9.9	111.8	E1196 K1204	E1196-R1200 VanDerWaalsContact O-CB 3.22Å; E1196-R1200 WeakPolarHBondContact O-CB 3.17Å; E1196-R1200 VanDerWaalsContact O-CG 3.26Å; E1196-R1200 WeakPolarHBondContact O-CG 3.22Å; E1196-R1200 PolarHBondContact O-N 2.66Å; E1196-R1200 IonicContact OE1-CZ 3.26Å; E1196-R1200 IonicContact OE1-NH1 3.79Å; E1196-R1200 IonicContact OE1-NH2 2.78Å; E1196-R1200 PolarHBondContact OE1-NH2 3.11Å; E1196-R1200 IonicContact OE2-CZ 2.8Å; E1196-R1200 IonicContact OE2-NH1 2.74Å; E1196-R1200 PolarHBondContact OE2-NH1 3.17Å; E1196-R1200 IonicContact OE2-NH2 2.93Å; E1196-R1200 PolarHBondContact OE2-NH2 2.74Å; E1196-R1200 VanDerWaalsContact OE2-NH2 3.16Å; R1200-K1204 VanDerWaalsContact O-CB 3.31Å; R1200-K1204 WeakPolarHBondContact O-CB 3.26Å; R1200-K1204 WeakPolarHBondContact O-CD 3.4Å; R1200-K1204 WeakPolarHBondContact O-CG 3.49Å; R1200-K1204 PolarHBondContact O-N 2.88Å
1201	Q	61.9	Low	60.6	Low	49 Å²	49	96 Å²	96	23%	0.229	45%	0.453	C	S	.	.	H	α-helix	trans	-79.4	-32.6	180	-151.3	151.3	11.9	0	0	111.9	A1179 A1197 E1198 E1199 R1205	A1179-Q1201 WeakPolarHBondContact O-CG 3.43Å; A1179-Q1201 PolarHBondContact O-NE2 3.06Å; A1179-Q1201 PolarHBondContact O-OE1 3.5Å; A1197-Q1201 VanDerWaalsContact O-CB 3.22Å; A1197-Q1201 WeakPolarHBondContact O-CB 3.38Å; A1197-Q1201 PolarHBondContact O-N 3.1Å; E1198-Q1201 CarbonylContact O-C 3.59Å; E1198-Q1201 PolarHBondContact O-N 3.02Å; E1199-Q1201 PolarHBondContact O-N 3Å; Q1201-R1205 VanDerWaalsContact O-CB 3.3Å; Q1201-R1205 WeakPolarHBondContact O-CB 3.37Å; Q1201-R1205 VanDerWaalsContact O-CG 3.26Å; Q1201-R1205 WeakPolarHBondContact O-CG 3.34Å; Q1201-R1205 PolarHBondContact O-N 3.44Å
1202	R	62.9	Low	60	Low	157 Å²	157	98.1 Å²	98.1	59%	0.592	46%	0.46	S	S	*	.	H	α-helix	trans	-60.6	-51	164.5	-84.8	174.9	158.6	-151.1	-2.2	111.2	E1198 E1199 K1204 R1205 A1206	E1198-R1202 WeakPolarHBondContact O-CB 3.31Å; E1198-R1202 WeakPolarHBondContact O-CG 3.34Å; E1198-R1202 PolarHBondContact O-N 3.04Å; E1199-R1202 WeakPolarHBondContact O-CB 3.23Å; E1199-R1202 PolarHBondContact O-N 3.23Å; E1199-R1202 VanDerWaalsContact OE2-CD 3.3Å; E1199-R1202 WeakPolarHBondContact OE2-CD 3.16Å; E1199-R1202 IonicContact OE2-NH1 2.81Å; R1202-K1204 PolarHBondContact O-N 2.81Å; R1202-R1205 CarbonylContact O-C 3.54Å; R1202-R1205 PolarHBondContact O-N 2.96Å; R1202-A1206 VanDerWaalsContact O-CB 3.25Å; R1202-A1206 WeakPolarHBondContact O-CB 3.27Å; R1202-A1206 PolarHBondContact O-N 3.17Å
1203	Q	64	Low	59.7	Low	93 Å²	93	104 Å²	104	44%	0.435	46%	0.46	S	S	.	.	H	α-helix	trans	-63.7	-41.3	178.9	-70.8	180	27.3	0	0	111.4	E1199 A1206 A1207	E1199-Q1203 WeakPolarHBondContact O-CB 3.46Å; E1199-Q1203 VanDerWaalsContact O-CG 3.28Å; E1199-Q1203 WeakPolarHBondContact O-CG 3.49Å; E1199-Q1203 PolarHBondContact O-N 2.73Å; E1199-Q1203 WeakPolarHBondContact OE1-CG 3.1Å; E1199-Q1203 PolarHBondContact OE1-NE2 3.26Å; Q1203-A1206 PolarHBondContact O-N 2.91Å; Q1203-A1207 VanDerWaalsContact O-CB 3.24Å; Q1203-A1207 WeakPolarHBondContact O-CB 3.42Å; Q1203-A1207 PolarHBondContact O-N 3.46Å
1204	K	70.3	Confident	58.9	Low	148 Å²	148	108 Å²	108	64%	0.643	48%	0.479	S	S	*	.	H	α-helix	trans	-60.6	-45.9	170.1	-75.5	166.3	-176.9	170.2	0	111.8	R1200 R1202 A1206 R1208	R1200-K1204 VanDerWaalsContact O-CB 3.31Å; R1200-K1204 WeakPolarHBondContact O-CB 3.26Å; R1200-K1204 WeakPolarHBondContact O-CD 3.4Å; R1200-K1204 WeakPolarHBondContact O-CG 3.49Å; R1200-K1204 PolarHBondContact O-N 2.88Å; R1202-K1204 PolarHBondContact O-N 2.81Å; K1204-A1206 PolarHBondContact O-N 2.86Å; K1204-R1208 VanDerWaalsContact O-CB 3.23Å; K1204-R1208 WeakPolarHBondContact O-CB 3.41Å; K1204-R1208 PolarHBondContact O-N 2.83Å
1205	R	61.4	Low	58	Low	119 Å²	119	112.2 Å²	112.2	45%	0.449	50%	0.502	S	S	.	.	H	α-helix	trans	-63.4	-38	175.3	-77	175.8	177.4	-173.2	3.6	111.7	D1178 A1179 Q1201 R1202 K1209	D1178-R1205 PolarHBondContact O-NH1 2.78Å; D1178-R1205 PolarHBondContact O-NH2 3.04Å; D1178-R1205 VanDerWaalsContact O-NH2 3.15Å; A1179-R1205 PolarHBondContact O-NH2 3.34Å; Q1201-R1205 VanDerWaalsContact O-CB 3.3Å; Q1201-R1205 WeakPolarHBondContact O-CB 3.37Å; Q1201-R1205 VanDerWaalsContact O-CG 3.26Å; Q1201-R1205 WeakPolarHBondContact O-CG 3.34Å; Q1201-R1205 PolarHBondContact O-N 3.44Å; R1202-R1205 CarbonylContact O-C 3.54Å; R1202-R1205 PolarHBondContact O-N 2.96Å; R1205-K1209 WeakPolarHBondContact O-CB 3.16Å; R1205-K1209 PolarHBondContact O-N 3.02Å
1206	A	65.1	Low	57.1	Low	55 Å²	55	115.9 Å²	115.9	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-70.4	-47.6	178.1	0	0	0	0	0	111.6	R1202 Q1203 K1204 R1208 K1209 K1210	R1202-A1206 VanDerWaalsContact O-CB 3.25Å; R1202-A1206 WeakPolarHBondContact O-CB 3.27Å; R1202-A1206 PolarHBondContact O-N 3.17Å; Q1203-A1206 PolarHBondContact O-N 2.91Å; K1204-A1206 PolarHBondContact O-N 2.86Å; A1206-R1208 VanDerWaalsContact C-N 3.31Å; A1206-R1208 PolarHBondContact O-N 3.32Å; A1206-K1209 CarbonylContact O-C 3.59Å; A1206-K1209 WeakPolarHBondContact O-CA 3.44Å; A1206-K1209 WeakPolarHBondContact O-CB 3.38Å; A1206-K1209 PolarHBondContact O-N 3.25Å; A1206-K1209 VanDerWaalsContact O-N 3.16Å; A1206-K1210 WeakPolarHBondContact O-CB 3.47Å; A1206-K1210 PolarHBondContact O-N 3.02Å
1207	A	67.3	Low	55.7	Low	52 Å²	52	117.8 Å²	117.8	43%	0.43	54%	0.542	S	S	.	.	H	α-helix	trans	-61.4	-38	173.6	0	0	0	0	0	111.9	Q1203 K1210 R1211	Q1203-A1207 VanDerWaalsContact O-CB 3.24Å; Q1203-A1207 WeakPolarHBondContact O-CB 3.42Å; Q1203-A1207 PolarHBondContact O-N 3.46Å; A1207-K1210 PolarHBondContact O-N 3.15Å; A1207-R1211 WeakPolarHBondContact O-CB 3.46Å; A1207-R1211 PolarHBondContact O-N 2.86Å
1208	R	64.7	Low	54.2	Low	208 Å²	208	121.4 Å²	121.4	79%	0.785	57%	0.566	S	S	*	*	H	α-helix	trans	-68.6	-35.8	174.1	-153.4	173.2	-167.3	-175.1	4.8	112	K1204 A1206 K1212	K1204-R1208 VanDerWaalsContact O-CB 3.23Å; K1204-R1208 WeakPolarHBondContact O-CB 3.41Å; K1204-R1208 PolarHBondContact O-N 2.83Å; A1206-R1208 VanDerWaalsContact C-N 3.31Å; A1206-R1208 PolarHBondContact O-N 3.32Å; R1208-K1212 WeakPolarHBondContact O-CB 3.45Å; R1208-K1212 PolarHBondContact O-N 3Å
1209	K	59.4	Low	52.9	Low	157 Å²	157	125.8 Å²	125.8	68%	0.683	58%	0.584	S	S	*	*	H	α-helix	trans	-69	-32.5	167.6	-87.7	-179.5	176.6	172.6	0	113.1	R1205 A1206 R1213	R1205-K1209 WeakPolarHBondContact O-CB 3.16Å; R1205-K1209 PolarHBondContact O-N 3.02Å; A1206-K1209 CarbonylContact O-C 3.59Å; A1206-K1209 WeakPolarHBondContact O-CA 3.44Å; A1206-K1209 WeakPolarHBondContact O-CB 3.38Å; A1206-K1209 PolarHBondContact O-N 3.25Å; A1206-K1209 VanDerWaalsContact O-N 3.16Å; K1209-R1213 WeakPolarHBondContact O-CB 3.31Å; K1209-R1213 WeakPolarHBondContact O-CG 3.38Å; K1209-R1213 PolarHBondContact O-N 3.03Å
1210	K	59.1	Low	51.7	Low	152 Å²	152	130.3 Å²	130.3	66%	0.661	61%	0.61	S	S	*	*	H	α-helix	trans	-71.7	-53	178.6	-147.3	176.9	-175	-177.1	0	109.6	A1206 A1207 K1212 R1213 L1214	A1206-K1210 WeakPolarHBondContact O-CB 3.47Å; A1206-K1210 PolarHBondContact O-N 3.02Å; A1207-K1210 PolarHBondContact O-N 3.15Å; K1210-K1212 PolarHBondContact O-N 2.79Å; K1210-R1213 PolarHBondContact O-N 3.15Å; K1210-L1214 HydrophobicContact CG-CD1 4.18Å; K1210-L1214 WeakPolarHBondContact O-CD1 3.4Å; K1210-L1214 PolarHBondContact O-N 2.9Å
1211	R	52.8	Low	50	Low	197 Å²	197	131.6 Å²	131.6	74%	0.743	63%	0.625	S	S	*	*	H	α-helix	trans	-52.4	-51.2	170.9	-77	-175.5	169.6	178.8	-3.2	111.6	A1207 R1213 L1214 D1215	A1207-R1211 WeakPolarHBondContact O-CB 3.46Å; A1207-R1211 PolarHBondContact O-N 2.86Å; R1211-R1213 PolarHBondContact O-N 2.64Å; R1211-R1213 VanDerWaalsContact O-N 3.11Å; R1211-L1214 PolarHBondContact O-N 3.11Å; R1211-L1214 VanDerWaalsContact O-N 3.11Å; R1211-D1215 PolarHBondContact O-N 2.84Å
1212	K	46.1	Very low	48.4	Very low	159 Å²	159	136.6 Å²	136.6	69%	0.691	65%	0.653	S	S	*	*	H	α-helix	trans	-71.5	-0.9	177.9	-163.2	168.6	-178.8	178.5	0	115.2	R1208 K1210	R1208-K1212 WeakPolarHBondContact O-CB 3.45Å; R1208-K1212 PolarHBondContact O-N 3Å; K1210-K1212 PolarHBondContact O-N 2.79Å
1213	R	44.9	Very low	46.8	Very low	193 Å²	193	132.5 Å²	132.5	73%	0.728	66%	0.66	S	S	*	*	H	α-helix	trans	-103.5	-32.9	166.2	-82.5	-179.4	167.1	-170	-5.3	111.9	K1209 K1210 R1211 D1216 S1217	K1209-R1213 WeakPolarHBondContact O-CB 3.31Å; K1209-R1213 WeakPolarHBondContact O-CG 3.38Å; K1209-R1213 PolarHBondContact O-N 3.03Å; K1210-R1213 PolarHBondContact O-N 3.15Å; R1211-R1213 PolarHBondContact O-N 2.64Å; R1211-R1213 VanDerWaalsContact O-N 3.11Å; R1213-D1216 CarbonylContact O-C 3.58Å; R1213-D1216 PolarHBondContact O-N 3.39Å; R1213-D1216 VanDerWaalsContact O-N 3.14Å; R1213-S1217 WeakPolarHBondContact O-CB 3.45Å; R1213-S1217 PolarHBondContact O-N 3.33Å; R1213-S1217 PolarHBondContact O-OG 2.75Å
1214	L	42.8	Very low	45.1	Very low	111 Å²	111	133 Å²	133	58%	0.581	67%	0.673	S	S	*	*	H	α-helix	trans	-66	-38	171.8	-85	142	0	0	0	112	K1210 R1211 D1216	K1210-L1214 HydrophobicContact CG-CD1 4.18Å; K1210-L1214 WeakPolarHBondContact O-CD1 3.4Å; K1210-L1214 PolarHBondContact O-N 2.9Å; R1211-L1214 PolarHBondContact O-N 3.11Å; R1211-L1214 VanDerWaalsContact O-N 3.11Å; L1214-D1216 PolarHBondContact O-N 3.43Å
1215	D	37.2	Very low	43.1	Very low	138 Å²	138	131.2 Å²	131.2	74%	0.738	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-16.6	170.1	-76.6	-30.4	0	0	0	113.5	R1211	R1211-D1215 PolarHBondContact O-N 2.84Å
1216	D	35.3	Very low	41.5	Very low	147 Å²	147	133.6 Å²	133.6	79%	0.786	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	8.8	-172.4	-145.6	21.6	0	0	0	111.5	R1213 L1214	R1213-D1216 CarbonylContact O-C 3.58Å; R1213-D1216 PolarHBondContact O-N 3.39Å; R1213-D1216 VanDerWaalsContact O-N 3.14Å; L1214-D1216 PolarHBondContact O-N 3.43Å
1217	S	31.3	Very low	39.7	Very low	83 Å²	83	137.7 Å²	137.7	58%	0.58	72%	0.715	S	S	*	*			trans	-127.3	16.4	-178.2	77.8	0	0	0	0	113.8	R1213 F1219	R1213-S1217 WeakPolarHBondContact O-CB 3.45Å; R1213-S1217 PolarHBondContact O-N 3.33Å; R1213-S1217 PolarHBondContact O-OG 2.75Å; S1217-F1219 PolarHBondContact O-N 3.43Å
1218	S	30.9	Very low	37.8	Very low	96 Å²	96	138.7 Å²	138.7	67%	0.671	73%	0.731	S	S	*	*			trans	-96	38	-178.3	73.5	0	0	0	0	113.3
1219	F	29.5	Very low	36	Very low	154 Å²	154	133.9 Å²	133.9	68%	0.675	73%	0.729	S	S	*	*	S	Bend	trans	-154.1	144.5	170.2	-135.8	-96.6	0	0	0	111.9	S1217	S1217-F1219 PolarHBondContact O-N 3.43Å
1220	L	34.5	Very low	34.5	Very low	163 Å²	163	132.6 Å²	132.6	85%	0.853	73%	0.734	S	S	*	*			trans	73.6	97.1	-176.5	-51.4	-176.8	0	0	0	115.8
1221	D	28.5	Very low	33.2	Very low	132 Å²	132	132.6 Å²	132.6	71%	0.706	74%	0.74	S	S	*	*			trans	-130.6	142	159.3	-178.4	33	0	0	0	108.8	R1298	D1221-R1298 PolarHBondContact O-NH1 3.26Å
1222	D	29	Very low	32	Very low	154 Å²	154	131.9 Å²	131.9	82%	0.824	75%	0.747	S	S	*	*			trans	49.7	154	-178.8	-153.2	11.3	0	0	0	119.5
1223	G	29	Very low	31.2	Very low	71 Å²	71	129.1 Å²	129.1	73%	0.732	75%	0.754	S	S	*	*			trans	146.1	76.2	178.2	0	0	0	0	0	115.2
1224	S	29.1	Very low	30.4	Very low	104 Å²	104	124.2 Å²	124.2	73%	0.727	76%	0.755	S	S	*	*			trans	-48	164	-177.5	57.8	0	0	0	0	120.1
1225	S	27.6	Very low	30	Very low	111 Å²	111	123.9 Å²	123.9	78%	0.776	76%	0.759	S	S	*	*			trans	99.1	128.7	148.9	76.4	0	0	0	0	122.2
1226	E	27.3	Very low	29.5	Very low	169 Å²	169	126.2 Å²	126.2	79%	0.79	77%	0.766	S	S	*	*			trans	61.8	121.2	146.2	-66.3	-154.9	132.3	0	0	125.4
1227	T	28.5	Very low	29.1	Very low	140 Å²	140	124.2 Å²	124.2	86%	0.859	77%	0.77	S	S	*	*			trans	70.2	150.1	149.7	66.9	0	0	0	0	120.4
1228	G	26.5	Very low	28.8	Very low	74 Å²	74	124.6 Å²	124.6	76%	0.763	78%	0.777	S	S	*	*			trans	154.2	-6.4	134.7	0	0	0	0	0	123.9
1229	S	27.2	Very low	28.7	Very low	107 Å²	107	130 Å²	130	75%	0.748	79%	0.789	S	S	*	*			trans	61.2	102.8	159.3	174.6	0	0	0	0	121.6
1230	V	27.1	Very low	28.7	Very low	130 Å²	130	134.6 Å²	134.6	79%	0.788	80%	0.802	S	S	*	*				76.2	164.4	128	-178.6	0	0	0	0	119.8
1231	I	31.5	Very low	28.4	Very low	152 Å²	152	136.7 Å²	136.7	78%	0.779	80%	0.798	S	S	*	*			trans	87.1	81.5	-179.6	-47.7	-179.2	0	0	0	113.2
1232	M	28	Very low	28.4	Very low	182 Å²	182	142.6 Å²	142.6	90%	0.897	81%	0.811	S	S	*	*				56.4	81.4	70.1	-72	-76.5	-167	0	0	115.6
1233	A	29	Very low	28.4	Very low	101 Å²	101	138.9 Å²	138.9	84%	0.835	81%	0.809	S	S	*	*			trans	-147.4	131.7	150.3	0	0	0	0	0	110.9
1234	A	28.6	Very low	28.5	Very low	90 Å²	90	146.3 Å²	146.3	74%	0.744	82%	0.815	S	S	*	*			trans	-78.6	172.8	157.9	0	0	0	0	0	108.1
1235	P	33.9	Very low	29.2	Very low	103 Å²	103	145.1 Å²	145.1	67%	0.669	80%	0.804	S	S	*	*			cis	-157.9	-156.5	37.4	44	-19.7	0	0	0	116.7
1236	Q	28.3	Very low	29.5	Very low	188 Å²	188	142.3 Å²	142.3	88%	0.879	78%	0.784	S	S	*	*			trans	70.8	124.8	151.5	-74	168.2	26.9	0	0	119.6
1237	A	25.6	Very low	29.6	Very low	105 Å²	105	141.1 Å²	141.1	87%	0.868	78%	0.778	S	S	*	*			trans	-98.8	125.1	165.6	0	0	0	0	0	110.7
1238	A	26.4	Very low	29.6	Very low	90 Å²	90	135.2 Å²	135.2	74%	0.744	74%	0.744	S	S	*	*			trans	-163	115.4	152.8	0	0	0	0	0	113.4
1239	K	28	Very low	29.7	Very low	210 Å²	210	135.5 Å²	135.5	91%	0.913	74%	0.735	S	S	*	*			trans	20.3	118.5	137.6	-58.9	168.4	-178.6	173.7	0	118.1
1240	R	28.6	Very low	29.8	Very low	250 Å²	250	133.7 Å²	133.7	94%	0.943	72%	0.722	S	S	*	*			trans	-123.1	127.7	148.8	-61.4	-169.9	89.7	-179.6	7.5	110.6
1241	R	28.1	Very low	29.8	Very low	207 Å²	207	133.3 Å²	133.3	78%	0.781	72%	0.72	S	S	*	*			trans	-115.3	156.8	162	-144.6	-174.8	-166.1	-142.6	10	106.3
1242	R	28.3	Very low	29.7	Very low	256 Å²	256	129.3 Å²	129.3	97%	0.966	72%	0.717	S	S	*	*			trans	-81.1	147.7	-170.7	-75.1	179.8	167.8	-179.3	-5.2	114.2
1243	G	30.3	Very low	29.8	Very low	76 Å²	76	125.9 Å²	125.9	78%	0.784	71%	0.711	S	S	*	*			trans	87.2	136.5	155.5	0	0	0	0	0	116.3
1244	R	31.5	Very low	30	Very low	228 Å²	228	127.7 Å²	127.7	86%	0.86	71%	0.711	S	S	*	*			cis	-148.7	168.4	-17.8	-119.2	-155.4	110.6	-179.7	-0.5	108.2
1245	P	43.2	Very low	30.1	Very low	78 Å²	78	128.2 Å²	128.2	51%	0.506	71%	0.71	S	S	.	*			trans	-114.1	174.8	-164.3	44.7	-37.2	0	0	0	114.4
1246	P	33	Very low	29.9	Very low	53 Å²	53	134.7 Å²	134.7	34%	0.344	72%	0.721	S	S	.	*				-113.1	-110.4	125.6	-12.6	33.1	0	0	0	117.2	Q1410	P1246-Q1410 VanDerWaalsContact CB-O 3.25Å; P1246-Q1410 WeakPolarHBondContact CB-O 3.49Å; P1246-Q1410 WeakPolarHBondContact CD-O 3.44Å; P1246-Q1410 HydrophobicContact CG-CB 3.89Å; P1246-Q1410 WeakPolarHBondContact CG-O 3.45Å
1247	H	29.7	Very low	30.2	Very low	144 Å²	144	131.2 Å²	131.2	67%	0.667	72%	0.717	S	S	*	*			trans	-129.2	-159.9	-143.8	-79.9	173	0	0	0	113.7	D1411 D1412	H1247-D1411 CarbonylContact C-O 3.59Å; H1247-D1411 WeakPolarHBondContact CA-O 3.4Å; H1247-D1411 VanDerWaalsContact CB-O 3.29Å; H1247-D1411 WeakPolarHBondContact CB-O 3.43Å; H1247-D1411 PolarHBondContact N-O 3.05Å; H1247-D1411 CarbonylContact O-C 3.45Å; H1247-D1411 VanDerWaalsContact O-CB 3.26Å; H1247-D1411 WeakPolarHBondContact O-CB 3.5Å; H1247-D1412 WeakPolarHBondContact CB-OD1 3.47Å
1248	G	29	Very low	30.6	Very low	15 Å²	15	129.9 Å²	129.9	16%	0.155	70%	0.702	C	S	.	*			cis	158.8	151	-23	0	0	0	0	0	116.7	D1412 E1413	G1248-D1412 WeakPolarHBondContact CA-OD1 3.3Å; G1248-D1412 PolarHBondContact N-OD1 2.96Å; G1248-E1413 VanDerWaalsContact C-CG 3.41Å; G1248-E1413 WeakPolarHBondContact CA-OE1 3.31Å; G1248-E1413 PolarHBondContact N-OE1 3.44Å; G1248-E1413 WeakPolarHBondContact O-CB 3.17Å; G1248-E1413 VanDerWaalsContact O-CG 3.31Å; G1248-E1413 WeakPolarHBondContact O-CG 3.47Å; G1248-E1413 PolarHBondContact O-N 3.36Å
1249	S	27.9	Very low	30.9	Very low	81 Å²	81	133.2 Å²	133.2	57%	0.566	71%	0.707	S	S	*	*			trans	91.7	43.5	159.8	80.8	0	0	0	0	123.7	E1413	S1249-E1413 VanDerWaalsContact N-CD 3.3Å; S1249-E1413 PolarHBondContact N-OE1 3.1Å
1250	S	29.3	Very low	31.9	Very low	69 Å²	69	130.6 Å²	130.6	48%	0.483	70%	0.698	S	S	.	*			trans	70.8	136.1	130.4	72.7	0	0	0	0	120.7	E1413	S1250-E1413 VanDerWaalsContact N-CD 3.34Å; S1250-E1413 PolarHBondContact N-OE2 2.94Å
1251	T	28.3	Very low	32.8	Very low	122 Å²	122	124.5 Å²	124.5	75%	0.748	69%	0.694	S	S	*	*				-172.6	153.7	81.4	35.1	0	0	0	0	113.1	D1414	T1251-D1414 PolarHBondContact N-OD2 3.42Å
1252	G	28.8	Very low	34.2	Very low	68 Å²	68	116.3 Å²	116.3	70%	0.701	67%	0.667	S	S	*	*			trans	168	-21.3	171.2	0	0	0	0	0	119.6
1253	S	29.2	Very low	35.8	Very low	110 Å²	110	107.1 Å²	107.1	77%	0.769	64%	0.641	S	S	*	*			trans	45.2	117.7	160.3	67.9	0	0	0	0	121.1
1254	T	33.7	Very low	37.8	Very low	138 Å²	138	108.5 Å²	108.5	85%	0.847	64%	0.636	S	S	*	*				-158.8	104.9	127.5	14.5	0	0	0	0	111.8
1255	S	30.9	Very low	39.8	Very low	102 Å²	102	106.4 Å²	106.4	71%	0.713	63%	0.634	S	S	*	*			trans	36.6	134.2	152.5	57.7	0	0	0	0	121.6
1256	R	30.6	Very low	41.7	Very low	239 Å²	239	104.5 Å²	104.5	90%	0.902	62%	0.619	S	S	*	*			cis	-169.8	143.3	6.5	-120.1	171.4	178.2	164.4	-2.4	111.1
1257	S	34.5	Very low	43.8	Very low	114 Å²	114	103.8 Å²	103.8	80%	0.797	62%	0.618	S	S	*	*			trans	67.2	142.5	153.6	-166.6	0	0	0	0	120.2
1258	S	32.9	Very low	46.4	Very low	78 Å²	78	104.3 Å²	104.3	55%	0.545	62%	0.618	S	S	.	*				-178.8	115.6	-51.3	44.4	0	0	0	0	110.9
1259	N	34	Very low	49	Very low	159 Å²	159	105.5 Å²	105.5	85%	0.85	62%	0.619	S	S	*	*			trans	-108.4	116.3	166.2	-100.9	-6.2	0	0	0	109.8
1260	Q	48	Very low	51.9	Low	156 Å²	156	101.9 Å²	101.9	73%	0.729	59%	0.593	S	S	*	*			trans	-104.2	141.8	171.4	-75.9	173.2	-46.1	0	0	108.9
1261	S	48.3	Very low	54.7	Low	122 Å²	122	101.1 Å²	101.1	85%	0.853	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-76.8	137.1	179.5	49.2	0	0	0	0	112.6
1262	V	57.6	Low	57.5	Low	35 Å²	35	103.8 Å²	103.8	21%	0.212	58%	0.578	C	S	.	*	P	Polyproline II helix	trans	-65	142.8	175.6	176.8	0	0	0	0	111.1	L1266 G1324 Y1326	V1262-L1266 HydrophobicContact CG1-CB 4.09Å; V1262-L1266 HydrophobicContact CG1-CD2 3.97Å; V1262-L1266 HydrophobicContact CG1-CG 3.99Å; V1262-G1324 WeakPolarHBondContact CG2-O 3.42Å; V1262-Y1326 WeakPolarHBondContact CG2-O 3.3Å
1263	S	62.2	Low	60.4	Low	62 Å²	62	100.6 Å²	100.6	43%	0.434	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-71.7	146.2	-177.9	81.7	0	0	0	0	112.3	K1265 L1266 A1267	S1263-K1265 PolarHBondContact O-N 3.33Å; S1263-K1265 VanDerWaalsContact O-N 3.17Å; S1263-L1266 PolarHBondContact O-N 3.43Å; S1263-L1266 VanDerWaalsContact O-N 3.09Å; S1263-L1266 WeakPolarHBondContact OG-CB 3.47Å; S1263-L1266 PolarHBondContact OG-N 3.01Å; S1263-A1267 PolarHBondContact O-N 2.7Å
1264	P	71.1	Confident	63.3	Low	105 Å²	105	95.3 Å²	95.3	68%	0.682	51%	0.508	S	S	*	.	H	α-helix	trans	-60.3	-27	178.4	-26.2	35.2	0	0	0	114.2	K1268	P1264-K1268 WeakPolarHBondContact O-CG 3.31Å; P1264-K1268 PolarHBondContact O-N 3.29Å
1265	K	74.7	Confident	65.9	Low	185 Å²	185	90.4 Å²	90.4	80%	0.804	48%	0.477	S	S	*	.	H	α-helix	trans	-69.3	-46.8	174.1	-68.1	-175.3	178.6	-179	0	111	S1263 K1268 K1269	S1263-K1265 PolarHBondContact O-N 3.33Å; S1263-K1265 VanDerWaalsContact O-N 3.17Å; K1265-K1268 PolarHBondContact O-N 3.42Å; K1265-K1269 PolarHBondContact O-N 3.27Å
1266	L	81.1	Confident	68.7	Low	38 Å²	38	89.4 Å²	89.4	20%	0.199	46%	0.463	C	S	.	.	H	α-helix	trans	-65.9	-43.4	177.2	178.7	55.7	0	0	0	111.3	V1262 S1263 K1268 K1269 L1270 R1327 V1329	V1262-L1266 HydrophobicContact CG1-CB 4.09Å; V1262-L1266 HydrophobicContact CG1-CD2 3.97Å; V1262-L1266 HydrophobicContact CG1-CG 3.99Å; S1263-L1266 PolarHBondContact O-N 3.43Å; S1263-L1266 VanDerWaalsContact O-N 3.09Å; S1263-L1266 WeakPolarHBondContact OG-CB 3.47Å; S1263-L1266 PolarHBondContact OG-N 3.01Å; L1266-K1268 VanDerWaalsContact C-N 3.31Å; L1266-K1268 PolarHBondContact O-N 2.7Å; L1266-K1269 PolarHBondContact O-N 3.09Å; L1266-L1270 HydrophobicContact CD1-CD1 4.1Å; L1266-L1270 HydrophobicContact CD1-CD2 4.26Å; L1266-L1270 HydrophobicContact CD1-CG 3.88Å; L1266-L1270 HydrophobicContact CG-CD1 3.91Å; L1266-L1270 HydrophobicContact CG-CG 4.21Å; L1266-L1270 VanDerWaalsContact O-CG 3.31Å; L1266-L1270 WeakPolarHBondContact O-CG 3.45Å; L1266-L1270 PolarHBondContact O-N 3.42Å; L1266-R1327 VanDerWaalsContact CD2-O 3.25Å; L1266-R1327 WeakPolarHBondContact CD2-O 3.35Å; L1266-V1329 HydrophobicContact CD1-CG2 4.25Å
1267	A	77.9	Confident	71.6	Confident	38 Å²	38	78 Å²	78	31%	0.314	42%	0.42	S	S	.	.	H	α-helix	trans	-55.3	-44.7	175	0	0	0	0	0	112.2	S1263 Q1271	S1263-A1267 PolarHBondContact O-N 2.7Å; A1267-Q1271 VanDerWaalsContact O-CB 3.26Å; A1267-Q1271 WeakPolarHBondContact O-CB 3.35Å; A1267-Q1271 PolarHBondContact O-N 2.88Å
1268	K	83.5	Confident	74.3	Confident	154 Å²	154	73.2 Å²	73.2	67%	0.67	39%	0.385	S	S	*	.	H	α-helix	trans	-66.3	-33.8	174.6	-74.8	-178.9	177.3	-177.2	0	113.6	P1264 K1265 L1266 R1272	P1264-K1268 WeakPolarHBondContact O-CG 3.31Å; P1264-K1268 PolarHBondContact O-N 3.29Å; K1265-K1268 PolarHBondContact O-N 3.42Å; L1266-K1268 VanDerWaalsContact C-N 3.31Å; L1266-K1268 PolarHBondContact O-N 2.7Å; K1268-R1272 WeakPolarHBondContact O-CG 3.31Å; K1268-R1272 PolarHBondContact O-N 2.77Å; K1268-R1272 VanDerWaalsContact O-N 3.14Å
1269	K	85.6	Confident	76.9	Confident	41 Å²	41	76 Å²	76	18%	0.178	39%	0.39	C	S	.	.	H	α-helix	trans	-68.2	-46.8	175.6	-173.1	174.5	-178	174.4	0	111.6	K1265 L1266 R1272 L1273 V1329 E1375	K1265-K1269 PolarHBondContact O-N 3.27Å; L1266-K1269 PolarHBondContact O-N 3.09Å; K1269-R1272 PolarHBondContact O-N 2.73Å; K1269-L1273 HydrophobicContact CG-CD1 4.43Å; K1269-L1273 PolarHBondContact O-N 3.12Å; K1269-L1273 VanDerWaalsContact O-N 3.08Å; K1269-V1329 HydrophobicContact CD-CG2 4.17Å; K1269-E1375 WeakPolarHBondContact CD-OE1 3.33Å; K1269-E1375 VanDerWaalsContact CE-OE1 3.3Å; K1269-E1375 WeakPolarHBondContact CE-OE1 3.43Å; K1269-E1375 IonicContact NZ-OE1 3.28Å; K1269-E1375 PolarHBondContact NZ-OE1 2.98Å; K1269-E1375 IonicContact NZ-OE2 3.65Å; K1269-E1375 PolarHBondContact NZ-OE2 3.43Å
1270	L	88.4	Confident	79.7	Confident	4 Å²	4	72.5 Å²	72.5	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-61.2	-45.1	175.9	-65.9	169.4	0	0	0	111.8	L1266 L1273 L1274 V1321 V1329 L1332	L1266-L1270 HydrophobicContact CD1-CD1 4.1Å; L1266-L1270 HydrophobicContact CD1-CD2 4.26Å; L1266-L1270 HydrophobicContact CD1-CG 3.88Å; L1266-L1270 HydrophobicContact CG-CD1 3.91Å; L1266-L1270 HydrophobicContact CG-CG 4.21Å; L1266-L1270 VanDerWaalsContact O-CG 3.31Å; L1266-L1270 WeakPolarHBondContact O-CG 3.45Å; L1266-L1270 PolarHBondContact O-N 3.42Å; L1270-L1273 PolarHBondContact O-N 2.57Å; L1270-L1274 WeakPolarHBondContact O-CB 3.36Å; L1270-L1274 PolarHBondContact O-N 2.85Å; L1270-V1321 HydrophobicContact CB-CG1 4.18Å; L1270-V1321 HydrophobicContact CB-CG2 4.48Å; L1270-V1329 HydrophobicContact CD2-CG2 4.37Å; L1270-L1332 HydrophobicContact CB-CD2 4.1Å; L1270-L1332 HydrophobicContact CD2-CB 3.83Å; L1270-L1332 HydrophobicContact CD2-CD2 3.59Å; L1270-L1332 HydrophobicContact CD2-CG 4.36Å; L1270-L1332 HydrophobicContact CG-CD2 4.46Å
1271	Q	87.2	Confident	81.6	Confident	53 Å²	53	69.6 Å²	69.6	25%	0.248	35%	0.35	C	S	.	.	H	α-helix	trans	-59.7	-48.9	178.2	-168.7	63.3	60.8	0	0	111.2	A1267 L1273 L1274 D1275 V1321	A1267-Q1271 VanDerWaalsContact O-CB 3.26Å; A1267-Q1271 WeakPolarHBondContact O-CB 3.35Å; A1267-Q1271 PolarHBondContact O-N 2.88Å; Q1271-L1273 PolarHBondContact O-N 3.34Å; Q1271-L1274 PolarHBondContact O-N 3.01Å; Q1271-D1275 WeakPolarHBondContact CG-OD2 3.45Å; Q1271-D1275 PolarHBondContact NE2-OD1 3.32Å; Q1271-D1275 PolarHBondContact NE2-OD2 3.28Å; Q1271-D1275 VanDerWaalsContact O-CG 3.31Å; Q1271-D1275 PolarHBondContact O-N 2.74Å; Q1271-D1275 VanDerWaalsContact O-OD2 3.06Å; Q1271-V1321 HydrophobicContact CB-CG1 4.46Å
1272	R	87.4	Confident	83.4	Confident	178 Å²	178	66 Å²	66	67%	0.672	32%	0.321	S	S	*	.	H	α-helix	trans	-59	-45.8	176.2	-78.5	177.3	171.2	179.6	-4.1	113.4	K1268 K1269 L1274 D1275 I1276	K1268-R1272 WeakPolarHBondContact O-CG 3.31Å; K1268-R1272 PolarHBondContact O-N 2.77Å; K1268-R1272 VanDerWaalsContact O-N 3.14Å; K1269-R1272 PolarHBondContact O-N 2.73Å; R1272-L1274 VanDerWaalsContact C-N 3.32Å; R1272-L1274 PolarHBondContact O-N 3.39Å; R1272-D1275 PolarHBondContact O-N 2.59Å; R1272-I1276 WeakPolarHBondContact O-CD1 3.37Å; R1272-I1276 VanDerWaalsContact O-CG1 3.24Å; R1272-I1276 WeakPolarHBondContact O-CG1 3.27Å; R1272-I1276 PolarHBondContact O-N 2.82Å
1273	L	89.1	Confident	84.6	Confident	1 Å²	1	73.1 Å²	73.1	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-40.6	178	-80.7	168.4	0	0	0	111.9	K1269 L1270 Q1271 V1277 V1329 W1364 A1367 L1371	K1269-L1273 HydrophobicContact CG-CD1 4.43Å; K1269-L1273 PolarHBondContact O-N 3.12Å; K1269-L1273 VanDerWaalsContact O-N 3.08Å; L1270-L1273 PolarHBondContact O-N 2.57Å; Q1271-L1273 PolarHBondContact O-N 3.34Å; L1273-V1277 PolarHBondContact O-N 2.99Å; L1273-V1329 HydrophobicContact CD1-CG1 3.72Å; L1273-V1329 HydrophobicContact CD1-CG2 4.4Å; L1273-W1364 HydrophobicContact CB-CH2 4.05Å; L1273-W1364 HydrophobicContact CB-CZ3 3.73Å; L1273-W1364 HydrophobicContact CD1-CH2 4.03Å; L1273-W1364 HydrophobicContact CG-CH2 4.48Å; L1273-W1364 HydrophobicContact CG-CZ3 4.48Å; L1273-A1367 HydrophobicContact CD2-CB 4.03Å; L1273-L1371 HydrophobicContact CD1-CD1 4.21Å; L1273-L1371 HydrophobicContact CD2-CD1 3.6Å; L1273-L1371 HydrophobicContact CG-CD1 3.63Å
1274	L	90.3	Very high	85.5	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-67.3	-46.1	177.6	-177.1	64.9	0	0	0	112.1	L1270 Q1271 R1272 I1276 V1277 I1278 F1314 I1317 R1318 V1321 I1336	L1270-L1274 WeakPolarHBondContact O-CB 3.36Å; L1270-L1274 PolarHBondContact O-N 2.85Å; Q1271-L1274 PolarHBondContact O-N 3.01Å; R1272-L1274 VanDerWaalsContact C-N 3.32Å; R1272-L1274 PolarHBondContact O-N 3.39Å; L1274-I1276 VanDerWaalsContact C-N 3.34Å; L1274-I1276 PolarHBondContact O-N 3.19Å; L1274-V1277 PolarHBondContact O-N 2.88Å; L1274-I1278 HydrophobicContact CD1-CD1 4.01Å; L1274-I1278 HydrophobicContact CD1-CG1 4.37Å; L1274-I1278 HydrophobicContact CD2-CD1 4.3Å; L1274-I1278 HydrophobicContact CG-CD1 3.79Å; L1274-I1278 HydrophobicContact CG-CG1 4.44Å; L1274-I1278 WeakPolarHBondContact O-CG1 3.33Å; L1274-I1278 PolarHBondContact O-N 3.31Å; L1274-F1314 HydrophobicContact CD1-CD1 3.99Å; L1274-F1314 HydrophobicContact CD1-CE1 4.3Å; L1274-I1317 HydrophobicContact CD1-CG2 3.66Å; L1274-I1317 HydrophobicContact CD2-CG2 4.23Å; L1274-R1318 HydrophobicContact CD2-CB 3.93Å; L1274-R1318 HydrophobicContact CD2-CG 3.89Å; L1274-V1321 HydrophobicContact CD2-CG2 3.99Å; L1274-I1336 HydrophobicContact CD1-CD1 4.44Å
1275	D	89.6	Confident	86	Confident	34 Å²	34	77.7 Å²	77.7	18%	0.182	36%	0.359	C	S	.	.	H	α-helix	trans	-68	-33.2	-177.6	-63.8	-40	0	0	0	111.4	Q1271 R1272 V1277 I1278 E1279 R1318	Q1271-D1275 WeakPolarHBondContact CG-OD2 3.45Å; Q1271-D1275 PolarHBondContact NE2-OD1 3.32Å; Q1271-D1275 PolarHBondContact NE2-OD2 3.28Å; Q1271-D1275 VanDerWaalsContact O-CG 3.31Å; Q1271-D1275 PolarHBondContact O-N 2.74Å; Q1271-D1275 VanDerWaalsContact O-OD2 3.06Å; R1272-D1275 PolarHBondContact O-N 2.59Å; D1275-V1277 VanDerWaalsContact C-N 3.31Å; D1275-V1277 PolarHBondContact O-N 2.9Å; D1275-I1278 PolarHBondContact O-N 3.11Å; D1275-E1279 WeakPolarHBondContact O-CB 3.47Å; D1275-E1279 WeakPolarHBondContact O-CG 3.45Å; D1275-E1279 PolarHBondContact O-N 2.8Å; D1275-R1318 IonicContact OD1-CZ 2.81Å; D1275-R1318 IonicContact OD1-NE 2.92Å; D1275-R1318 IonicContact OD1-NH2 3.99Å; D1275-R1318 PolarHBondContact OD1-NH2 3.41Å
1276	I	89.8	Confident	86.6	Confident	82 Å²	82	72.7 Å²	72.7	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-58.2	-39.3	170.7	-71.8	163.5	0	0	0	112.4	R1272 L1274 Y1280 A1367	R1272-I1276 WeakPolarHBondContact O-CD1 3.37Å; R1272-I1276 VanDerWaalsContact O-CG1 3.24Å; R1272-I1276 WeakPolarHBondContact O-CG1 3.27Å; R1272-I1276 PolarHBondContact O-N 2.82Å; L1274-I1276 VanDerWaalsContact C-N 3.34Å; L1274-I1276 PolarHBondContact O-N 3.19Å; I1276-Y1280 PolarHBondContact O-N 3.45Å; I1276-A1367 HydrophobicContact CG2-CB 3.82Å
1277	V	90.2	Very high	87	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-78.5	-35.4	179.5	174.9	0	0	0	0	111.7	L1273 L1274 D1275 F1314 L1360 V1363 W1364	L1273-V1277 PolarHBondContact O-N 2.99Å; L1274-V1277 PolarHBondContact O-N 2.88Å; D1275-V1277 VanDerWaalsContact C-N 3.31Å; D1275-V1277 PolarHBondContact O-N 2.9Å; V1277-F1314 HydrophobicContact CG1-CE1 4Å; V1277-F1314 HydrophobicContact CG1-CZ 3.72Å; V1277-L1360 HydrophobicContact CG1-CD2 3.8Å; V1277-V1363 HydrophobicContact CG2-CG1 4.29Å; V1277-W1364 HydrophobicContact CG2-CB 4.33Å; V1277-W1364 HydrophobicContact CG2-CE3 4.03Å
1278	I	91.1	Very high	87.5	Confident	13 Å²	13	72.4 Å²	72.4	7%	0.067	33%	0.328	C	S	.	.	H	α-helix	trans	-70.4	-38.7	177.9	-69.2	175.5	0	0	0	111.5	L1274 D1275 Y1280 I1287 S1289 F1314	L1274-I1278 HydrophobicContact CD1-CD1 4.01Å; L1274-I1278 HydrophobicContact CD1-CG1 4.37Å; L1274-I1278 HydrophobicContact CD2-CD1 4.3Å; L1274-I1278 HydrophobicContact CG-CD1 3.79Å; L1274-I1278 HydrophobicContact CG-CG1 4.44Å; L1274-I1278 WeakPolarHBondContact O-CG1 3.33Å; L1274-I1278 PolarHBondContact O-N 3.31Å; D1275-I1278 PolarHBondContact O-N 3.11Å; I1278-Y1280 VanDerWaalsContact C-N 3.34Å; I1278-I1287 WeakPolarHBondContact O-CG2 3.44Å; I1278-S1289 PolarHBondContact O-OG 3.42Å; I1278-F1314 HydrophobicContact CD1-CB 4.38Å; I1278-F1314 HydrophobicContact CD1-CD1 4.41Å; I1278-F1314 HydrophobicContact CG1-CD1 4.11Å; I1278-F1314 HydrophobicContact CG1-CG 4.23Å
1279	E	89	Confident	87.8	Confident	137 Å²	137	65.3 Å²	65.3	64%	0.64	30%	0.297	S	S	*	.	S	Bend	trans	-89.2	3.2	-176.3	-63.2	178.5	-178.7	0	0	113.5	D1275	D1275-E1279 WeakPolarHBondContact O-CB 3.47Å; D1275-E1279 WeakPolarHBondContact O-CG 3.45Å; D1275-E1279 PolarHBondContact O-N 2.8Å
1280	Y	90.8	Very high	87.9	Confident	85 Å²	85	70 Å²	70	33%	0.333	32%	0.32	S	S	.	.			trans	-68.9	132.9	179.8	-172.6	-97.9	0	0	0	112.5	I1276 I1278 L1288 V1359 V1363	I1276-Y1280 PolarHBondContact O-N 3.45Å; I1278-Y1280 VanDerWaalsContact C-N 3.34Å; Y1280-L1288 HydrophobicContact CD1-CB 4.49Å; Y1280-L1288 HydrophobicContact CD1-CD1 3.46Å; Y1280-L1288 VanDerWaalsContact CD1-CD1 3.46Å; Y1280-L1288 HydrophobicContact CE1-CD1 3.45Å; Y1280-L1288 VanDerWaalsContact CE1-CD1 3.45Å; Y1280-L1288 PolarHBondContact O-N 2.94Å; Y1280-V1359 HydrophobicContact CD1-CG1 4.49Å; Y1280-V1359 HydrophobicContact CE1-CG1 3.76Å; Y1280-V1363 HydrophobicContact CD1-CG2 3.62Å; Y1280-V1363 HydrophobicContact CD2-CB 4.49Å; Y1280-V1363 HydrophobicContact CD2-CG1 3.82Å; Y1280-V1363 HydrophobicContact CD2-CG2 3.75Å; Y1280-V1363 HydrophobicContact CE1-CG2 3.54Å; Y1280-V1363 HydrophobicContact CE2-CG1 4.41Å; Y1280-V1363 HydrophobicContact CE2-CG2 3.67Å; Y1280-V1363 HydrophobicContact CG-CB 4.44Å; Y1280-V1363 HydrophobicContact CG-CG1 3.92Å; Y1280-V1363 HydrophobicContact CG-CG2 3.73Å
1281	K	89.1	Confident	87.8	Confident	95 Å²	95	72.9 Å²	72.9	41%	0.413	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-120.8	143.2	-180	-68.1	-179.1	168.2	-171.7	0	111.4	Q1285 R1286 I1287	K1281-Q1285 WeakPolarHBondContact CD-O 3.32Å; K1281-Q1285 VanDerWaalsContact CD-OE1 3.3Å; K1281-R1286 VanDerWaalsContact CA-O 3.32Å; K1281-R1286 WeakPolarHBondContact CA-O 3.42Å; K1281-I1287 HydrophobicContact CG-CG1 4.06Å
1282	D	85.7	Confident	88.1	Confident	47 Å²	47	71.1 Å²	71.1	25%	0.251	33%	0.33	S	S	.	.			trans	-79.7	176.9	168.1	-158.8	3.9	0	0	0	111.7	D1284 Q1285 R1286 L1288	D1282-D1284 PolarHBondContact O-N 3.43Å; D1282-D1284 VanDerWaalsContact O-N 3.15Å; D1282-Q1285 WeakPolarHBondContact O-CA 3.32Å; D1282-Q1285 PolarHBondContact O-N 2.87Å; D1282-R1286 PolarHBondContact N-O 2.97Å; D1282-R1286 VanDerWaalsContact N-O 3.12Å; D1282-L1288 HydrophobicContact CB-CD1 3.93Å; D1282-L1288 HydrophobicContact CB-CG 4.39Å
1283	K	82.1	Confident	88.2	Confident	184 Å²	184	65 Å²	65	80%	0.8	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-40.6	174.9	-61.4	156.6	-167.7	156.8	0	112.5	Q1285	K1283-Q1285 PolarHBondContact O-N 3.07Å
1284	D	82.5	Confident	88.2	Confident	139 Å²	139	72.6 Å²	72.6	74%	0.743	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	16.9	-178	-56.6	-27.2	0	0	0	113.2	D1282 R1286	D1282-D1284 PolarHBondContact O-N 3.43Å; D1282-D1284 VanDerWaalsContact O-N 3.15Å; D1284-R1286 PolarHBondContact O-N 2.98Å
1285	Q	81.3	Confident	88.1	Confident	123 Å²	123	73.9 Å²	73.9	58%	0.575	35%	0.35	S	S	*	.			trans	61.8	-1.9	-177.6	-65.6	-71	-41.1	0	0	116.2	K1281 D1282 K1283	K1281-Q1285 WeakPolarHBondContact CD-O 3.32Å; K1281-Q1285 VanDerWaalsContact CD-OE1 3.3Å; D1282-Q1285 WeakPolarHBondContact O-CA 3.32Å; D1282-Q1285 PolarHBondContact O-N 2.87Å; K1283-Q1285 PolarHBondContact O-N 3.07Å
1286	R	88.1	Confident	87.8	Confident	80 Å²	80	74.2 Å²	74.2	30%	0.302	35%	0.354	S	S	.	.			trans	-60.6	132.2	175	-173.9	170	67.2	96	-1.3	111	K1281 D1282 D1284 L1288 D1356	K1281-R1286 VanDerWaalsContact CA-O 3.32Å; K1281-R1286 WeakPolarHBondContact CA-O 3.42Å; D1282-R1286 PolarHBondContact N-O 2.97Å; D1282-R1286 VanDerWaalsContact N-O 3.12Å; D1284-R1286 PolarHBondContact O-N 2.98Å; R1286-L1288 PolarHBondContact O-N 2.86Å; R1286-D1356 IonicContact CZ-OD1 2.64Å; R1286-D1356 IonicContact CZ-OD2 3.35Å; R1286-D1356 IonicContact NH1-OD1 3.79Å; R1286-D1356 PolarHBondContact NH1-OD1 3.49Å; R1286-D1356 IonicContact NH1-OD2 2.9Å; R1286-D1356 PolarHBondContact NH1-OD2 3.14Å; R1286-D1356 IonicContact NH2-OD1 4Å; R1286-D1356 PolarHBondContact NH2-OD1 3.04Å; R1286-D1356 IonicContact NH2-OD2 3.28Å
1287	I	89.3	Confident	87.5	Confident	70 Å²	70	73.4 Å²	73.4	36%	0.359	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-80.9	114	176.4	-62.9	171.7	0	0	0	108.3	I1278 K1281 S1289 E1290	I1278-I1287 WeakPolarHBondContact O-CG2 3.44Å; K1281-I1287 HydrophobicContact CG-CG1 4.06Å; I1287-S1289 VanDerWaalsContact C-N 3.27Å; I1287-S1289 WeakPolarHBondContact CG2-OG 3.41Å; I1287-S1289 PolarHBondContact O-N 3.4Å; I1287-E1290 PolarHBondContact O-N 3.28Å
1288	L	88.5	Confident	87.1	Confident	1 Å²	1	81 Å²	81	1%	0.005	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-18.9	-171.6	-78.5	159	0	0	0	113.6	Y1280 D1282 R1286 F1292 D1356 V1359 L1360	Y1280-L1288 HydrophobicContact CD1-CB 4.49Å; Y1280-L1288 HydrophobicContact CD1-CD1 3.46Å; Y1280-L1288 VanDerWaalsContact CD1-CD1 3.46Å; Y1280-L1288 HydrophobicContact CE1-CD1 3.45Å; Y1280-L1288 VanDerWaalsContact CE1-CD1 3.45Å; Y1280-L1288 PolarHBondContact O-N 2.94Å; D1282-L1288 HydrophobicContact CB-CD1 3.93Å; D1282-L1288 HydrophobicContact CB-CG 4.39Å; R1286-L1288 PolarHBondContact O-N 2.86Å; L1288-F1292 WeakPolarHBondContact O-CD2 3.15Å; L1288-F1292 WeakPolarHBondContact O-CE2 2.92Å; L1288-D1356 HydrophobicContact CD2-CB 3.92Å; L1288-D1356 VanDerWaalsContact CD2-CG 3.46Å; L1288-D1356 WeakPolarHBondContact CD2-OD1 3.27Å; L1288-V1359 HydrophobicContact CD1-CB 4.38Å; L1288-V1359 HydrophobicContact CD1-CG1 3.67Å; L1288-L1360 HydrophobicContact CB-CD2 4.12Å; L1288-L1360 HydrophobicContact CB-CG 4.31Å
1289	S	88.8	Confident	86.4	Confident	4 Å²	4	90 Å²	90	3%	0.028	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-13.8	178.7	70	0	0	0	0	114.5	I1278 I1287 F1292 M1293	I1278-S1289 PolarHBondContact O-OG 3.42Å; I1287-S1289 VanDerWaalsContact C-N 3.27Å; I1287-S1289 WeakPolarHBondContact CG2-OG 3.41Å; I1287-S1289 PolarHBondContact O-N 3.4Å; S1289-F1292 WeakPolarHBondContact O-CA 2.92Å; S1289-F1292 WeakPolarHBondContact O-CB 2.85Å; S1289-F1292 PolarHBondContact O-N 3.19Å; S1289-M1293 PolarHBondContact O-N 3.43Å
1290	E	88.2	Confident	86	Confident	139 Å²	139	89.8 Å²	89.8	65%	0.65	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-59.4	-46.5	-167.9	-171.6	172.6	-125	0	0	114.1	I1287 F1292 M1293	I1287-E1290 PolarHBondContact O-N 3.28Å; E1290-F1292 PolarHBondContact O-N 2.98Å; E1290-F1292 VanDerWaalsContact O-N 3.11Å; E1290-M1293 PolarHBondContact O-N 2.91Å
1291	P	86.7	Confident	85.6	Confident	65 Å²	65	88.7 Å²	88.7	42%	0.422	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-62.9	-18.8	176	-21.7	34.2	0	0	0	114.2
1292	F	91.9	Very high	85.2	Confident	16 Å²	16	87.7 Å²	87.7	7%	0.07	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-101.3	0.9	-173	-53.3	-95.3	0	0	0	112.8	L1288 S1289 E1290 D1313 F1314 L1339 A1343 I1353 D1356 L1360	L1288-F1292 WeakPolarHBondContact O-CD2 3.15Å; L1288-F1292 WeakPolarHBondContact O-CE2 2.92Å; S1289-F1292 WeakPolarHBondContact O-CA 2.92Å; S1289-F1292 WeakPolarHBondContact O-CB 2.85Å; S1289-F1292 PolarHBondContact O-N 3.19Å; E1290-F1292 PolarHBondContact O-N 2.98Å; E1290-F1292 VanDerWaalsContact O-N 3.11Å; F1292-D1313 WeakPolarHBondContact O-CB 3.41Å; F1292-F1314 HydrophobicContact CB-CD2 3.57Å; F1292-F1314 HydrophobicContact CB-CE2 3.61Å; F1292-F1314 HydrophobicContact CG-CE2 4.32Å; F1292-F1314 PolarHBondContact O-N 2.93Å; F1292-L1339 HydrophobicContact CB-CD1 4.34Å; F1292-L1339 HydrophobicContact CB-CD2 4.09Å; F1292-L1339 HydrophobicContact CD1-CD2 3.61Å; F1292-L1339 HydrophobicContact CD1-CG 4.29Å; F1292-L1339 HydrophobicContact CE1-CD2 4.37Å; F1292-L1339 HydrophobicContact CG-CD2 4.1Å; F1292-A1343 HydrophobicContact CE1-CB 3.71Å; F1292-I1353 HydrophobicContact CE1-CG2 4.15Å; F1292-I1353 HydrophobicContact CZ-CG2 3.93Å; F1292-D1356 HydrophobicContact CE2-CB 3.79Å; F1292-D1356 HydrophobicContact CZ-CB 3.91Å; F1292-L1360 HydrophobicContact CD2-CD1 3.69Å; F1292-L1360 HydrophobicContact CE2-CD1 3.58Å; F1292-L1360 HydrophobicContact CG-CD1 4.25Å; F1292-L1360 HydrophobicContact CZ-CD1 4.02Å
1293	M	91.1	Very high	85.3	Confident	51 Å²	51	88.5 Å²	88.5	25%	0.251	43%	0.426	S	S	.	.	S	Bend	trans	-70.1	-31.9	-176.9	-77.8	-68.5	-76.9	0	0	113.4	S1289 E1290 F1314 N1315	S1289-M1293 PolarHBondContact O-N 3.43Å; E1290-M1293 PolarHBondContact O-N 2.91Å; M1293-F1314 HydrophobicContact SD-CB 3.86Å; M1293-N1315 WeakPolarHBondContact O-CB 3.37Å; M1293-N1315 PolarHBondContact O-N 3.24Å; M1293-N1315 PolarHBondContact O-ND2 3.02Å
1294	K	88.2	Confident	85.7	Confident	160 Å²	160	81 Å²	81	70%	0.696	39%	0.393	S	S	*	.	S	Bend	trans	-147	130.2	-171.6	-168.7	-174.4	-179.7	-167.2	0	110.7	D1313	K1294-D1313 WeakPolarHBondContact CA-OD2 3.46Å
1295	L	87.9	Confident	86	Confident	27 Å²	27	77.5 Å²	77.5	14%	0.141	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-60.3	137.7	174.8	-76.8	161.2	0	0	0	112.2	Y1304 P1311 D1313	L1295-Y1304 HydrophobicContact CD2-CE1 3.9Å; L1295-P1311 HydrophobicContact CD1-CB 3.93Å; L1295-P1311 HydrophobicContact CD2-CB 3.56Å; L1295-P1311 HydrophobicContact CG-CB 4.41Å; L1295-D1313 HydrophobicContact CG-CB 4.04Å; L1295-D1313 WeakPolarHBondContact CG-OD2 3.2Å; L1295-D1313 PolarHBondContact N-OD2 3.4Å
1296	P	83.2	Confident	86.2	Confident	41 Å²	41	79.2 Å²	79.2	27%	0.266	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-57.7	147.7	168.9	-22.7	33.2	0	0	0	111.5	L1301 Y1305	P1296-L1301 HydrophobicContact CB-CB 4.1Å; P1296-L1301 HydrophobicContact CB-CD1 3.87Å; P1296-L1301 HydrophobicContact CB-CG 4.44Å; P1296-L1301 HydrophobicContact CG-CD1 3.9Å; P1296-Y1305 WeakPolarHBondContact O-CE2 3.03Å; P1296-Y1305 PolarHBondContact O-OH 3.11Å
1297	T	83.3	Confident	86.2	Confident	65 Å²	65	79 Å²	79	40%	0.399	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-75.1	153.3	176.9	70.6	0	0	0	0	111.4	K1299 E1300 L1301	T1297-K1299 PolarHBondContact O-N 3.21Å; T1297-K1299 PolarHBondContact OG1-N 3.48Å; T1297-E1300 WeakPolarHBondContact CA-OE2 3.48Å; T1297-E1300 WeakPolarHBondContact CB-OE2 3.02Å; T1297-E1300 VanDerWaalsContact CG2-OE2 3.26Å; T1297-E1300 WeakPolarHBondContact CG2-OE2 3.37Å; T1297-E1300 PolarHBondContact N-OE2 2.88Å; T1297-E1300 PolarHBondContact O-N 2.95Å; T1297-E1300 WeakPolarHBondContact OG1-CG 3.47Å; T1297-E1300 PolarHBondContact OG1-N 2.99Å; T1297-E1300 PolarHBondContact OG1-OE2 3.5Å; T1297-L1301 PolarHBondContact O-N 3.39Å; T1297-L1301 VanDerWaalsContact O-N 3.14Å
1298	R	81.4	Confident	86.2	Confident	159 Å²	159	76 Å²	76	60%	0.6	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-11.4	170.8	-85.7	-177.8	167.2	-177.3	-6.6	114.3	D1221 Y1305	D1221-R1298 PolarHBondContact O-NH1 3.26Å; R1298-Y1305 HydrophobicContact CG-CD1 4.49Å; R1298-Y1305 HydrophobicContact CG-CD2 3.75Å; R1298-Y1305 HydrophobicContact CG-CE2 3.9Å; R1298-Y1305 HydrophobicContact CG-CG 4.07Å
1299	K	78	Confident	86.1	Confident	201 Å²	201	85.2 Å²	85.2	87%	0.874	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-26.1	173.5	-84.2	-165.3	170.2	-166.4	0	113.8	T1297	T1297-K1299 PolarHBondContact O-N 3.21Å; T1297-K1299 PolarHBondContact OG1-N 3.48Å
1300	E	80.8	Confident	86	Confident	134 Å²	134	92 Å²	92	63%	0.626	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-42.1	-177.6	-68.3	152.2	148.2	0	0	111.2	T1297	T1297-E1300 WeakPolarHBondContact CA-OE2 3.48Å; T1297-E1300 WeakPolarHBondContact CB-OE2 3.02Å; T1297-E1300 VanDerWaalsContact CG2-OE2 3.26Å; T1297-E1300 WeakPolarHBondContact CG2-OE2 3.37Å; T1297-E1300 PolarHBondContact N-OE2 2.88Å; T1297-E1300 PolarHBondContact O-N 2.95Å; T1297-E1300 WeakPolarHBondContact OG1-CG 3.47Å; T1297-E1300 PolarHBondContact OG1-N 2.99Å; T1297-E1300 PolarHBondContact OG1-OE2 3.5Å
1301	L	82.2	Confident	86.1	Confident	61 Å²	61	86.6 Å²	86.6	32%	0.319	42%	0.416	S	S	.	.			trans	-139.6	81.7	-178.2	-76.5	169	0	0	0	109.7	P1296 T1297 Y1305	P1296-L1301 HydrophobicContact CB-CB 4.1Å; P1296-L1301 HydrophobicContact CB-CD1 3.87Å; P1296-L1301 HydrophobicContact CB-CG 4.44Å; P1296-L1301 HydrophobicContact CG-CD1 3.9Å; T1297-L1301 PolarHBondContact O-N 3.39Å; T1297-L1301 VanDerWaalsContact O-N 3.14Å; L1301-Y1305 WeakPolarHBondContact O-CD2 3.46Å
1302	P	80.7	Confident	86.3	Confident	74 Å²	74	84 Å²	84	48%	0.481	40%	0.399	S	S	.	.	S	Bend	trans	-70.3	-39.3	180	27.5	-32.8	0	0	0	112.4	Y1304 Y1305	P1302-Y1304 VanDerWaalsContact C-N 3.33Å; P1302-Y1304 PolarHBondContact O-N 2.84Å; P1302-Y1305 WeakPolarHBondContact O-CB 3.28Å; P1302-Y1305 PolarHBondContact O-N 3.21Å
1303	D	86.9	Confident	86.4	Confident	65 Å²	65	84 Å²	84	35%	0.348	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-34.9	179.4	63.3	-46.5	0	0	0	113.2	Y1305 E1306 V1307 Y1346	D1303-Y1305 PolarHBondContact O-N 3.06Å; D1303-Y1305 VanDerWaalsContact O-N 3.17Å; D1303-E1306 WeakPolarHBondContact O-CB 3.19Å; D1303-E1306 PolarHBondContact O-N 3.31Å; D1303-V1307 PolarHBondContact O-N 2.97Å; D1303-V1307 VanDerWaalsContact O-N 3.08Å; D1303-Y1346 PolarHBondContact OD2-OH 2.91Å
1304	Y	90.5	Very high	86.6	Confident	25 Å²	25	81.7 Å²	81.7	10%	0.098	39%	0.388	C	S	.	.	H	α-helix	trans	-52.2	-37.2	170.1	176.7	-92.7	0	0	0	112.3	L1295 P1302 I1308 P1311 Y1346	L1295-Y1304 HydrophobicContact CD2-CE1 3.9Å; P1302-Y1304 VanDerWaalsContact C-N 3.33Å; P1302-Y1304 PolarHBondContact O-N 2.84Å; Y1304-I1308 HydrophobicContact CD2-CG1 4.05Å; Y1304-I1308 HydrophobicContact CE1-CB 4.27Å; Y1304-I1308 HydrophobicContact CE1-CG2 4.43Å; Y1304-I1308 HydrophobicContact CE2-CB 4.33Å; Y1304-I1308 HydrophobicContact CE2-CG1 3.74Å; Y1304-I1308 VanDerWaalsContact O-CB 3.3Å; Y1304-I1308 WeakPolarHBondContact O-CB 3.18Å; Y1304-I1308 PolarHBondContact O-N 3.15Å; Y1304-P1311 HydrophobicContact CE1-CB 4.14Å; Y1304-Y1346 AromaticContact CD2-CD1 3.84Å; Y1304-Y1346 HydrophobicContact CD2-CD1 3.84Å; Y1304-Y1346 AromaticContact CD2-CD2 3.88Å; Y1304-Y1346 HydrophobicContact CD2-CD2 3.88Å; Y1304-Y1346 HydrophobicContact CD2-CE1 4.1Å; Y1304-Y1346 HydrophobicContact CD2-CE2 4.14Å; Y1304-Y1346 AromaticContact CD2-CG 3.72Å; Y1304-Y1346 HydrophobicContact CD2-CG 3.72Å; Y1304-Y1346 HydrophobicContact CE2-CD1 4.41Å; Y1304-Y1346 HydrophobicContact CE2-CG 4.27Å
1305	Y	89.9	Confident	86.7	Confident	66 Å²	66	77.7 Å²	77.7	26%	0.259	38%	0.375	S	S	.	.	H	α-helix	trans	-80.5	-13.6	179	-70.2	-85.4	0	0	0	114.1	P1296 R1298 L1301 P1302 D1303 P1311	P1296-Y1305 WeakPolarHBondContact O-CE2 3.03Å; P1296-Y1305 PolarHBondContact O-OH 3.11Å; R1298-Y1305 HydrophobicContact CG-CD1 4.49Å; R1298-Y1305 HydrophobicContact CG-CD2 3.75Å; R1298-Y1305 HydrophobicContact CG-CE2 3.9Å; R1298-Y1305 HydrophobicContact CG-CG 4.07Å; L1301-Y1305 WeakPolarHBondContact O-CD2 3.46Å; P1302-Y1305 WeakPolarHBondContact O-CB 3.28Å; P1302-Y1305 PolarHBondContact O-N 3.21Å; D1303-Y1305 PolarHBondContact O-N 3.06Å; D1303-Y1305 VanDerWaalsContact O-N 3.17Å; Y1305-P1311 HydrophobicContact CD1-CG 4.29Å; Y1305-P1311 HydrophobicContact CE1-CB 4.26Å; Y1305-P1311 HydrophobicContact CE1-CG 4.03Å
1306	E	85.3	Confident	86.7	Confident	160 Å²	160	80.5 Å²	80.5	75%	0.748	38%	0.383	S	S	*	.	H	α-helix	trans	-82.7	-41.1	171.3	-56.4	-172.8	161.2	0	0	110.8	D1303	D1303-E1306 WeakPolarHBondContact O-CB 3.19Å; D1303-E1306 PolarHBondContact O-N 3.31Å
1307	V	86.9	Confident	87.1	Confident	75 Å²	75	78.5 Å²	78.5	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-75.7	-48.6	178.4	-178.3	0	0	0	0	111.7	D1303 K1309 T1345 Y1346	D1303-V1307 PolarHBondContact O-N 2.97Å; D1303-V1307 VanDerWaalsContact O-N 3.08Å; V1307-K1309 PolarHBondContact O-N 2.74Å; V1307-T1345 HydrophobicContact CG1-CG2 4.48Å; V1307-Y1346 HydrophobicContact CB-CD2 4.3Å; V1307-Y1346 HydrophobicContact CG1-CD2 4.45Å; V1307-Y1346 HydrophobicContact CG2-CD2 4.49Å
1308	I	89.8	Confident	87.5	Confident	6 Å²	6	78.7 Å²	78.7	3%	0.031	36%	0.364	C	S	.	.			trans	-94.9	96.7	-170.5	-58.4	-58.3	0	0	0	112	Y1304 K1310 P1311 N1342 T1345	Y1304-I1308 HydrophobicContact CD2-CG1 4.05Å; Y1304-I1308 HydrophobicContact CE1-CB 4.27Å; Y1304-I1308 HydrophobicContact CE1-CG2 4.43Å; Y1304-I1308 HydrophobicContact CE2-CB 4.33Å; Y1304-I1308 HydrophobicContact CE2-CG1 3.74Å; Y1304-I1308 VanDerWaalsContact O-CB 3.3Å; Y1304-I1308 WeakPolarHBondContact O-CB 3.18Å; Y1304-I1308 PolarHBondContact O-N 3.15Å; I1308-K1310 VanDerWaalsContact C-N 3.25Å; I1308-K1310 PolarHBondContact O-N 3.32Å; I1308-P1311 WeakPolarHBondContact O-CD 3.3Å; I1308-N1342 HydrophobicContact CD1-CB 4.29Å; I1308-N1342 WeakPolarHBondContact CD1-O 3.33Å; I1308-N1342 HydrophobicContact CG2-CB 4.03Å; I1308-N1342 WeakPolarHBondContact CG2-OD1 3.47Å; I1308-T1345 HydrophobicContact CD1-CG2 4.14Å
1309	K	86	Confident	87.7	Confident	195 Å²	195	76.4 Å²	76.4	85%	0.848	36%	0.36	S	S	*	.	S	Bend	trans	-66.5	-15	-178.2	-61.2	-178.1	-179	179.2	0	115.7	V1307	V1307-K1309 PolarHBondContact O-N 2.74Å
1310	K	87.5	Confident	88.2	Confident	146 Å²	146	70.8 Å²	70.8	64%	0.635	33%	0.333	S	S	*	.	S	Bend	trans	-141.8	73.9	-179.3	-71.9	-169.9	176.1	-178.2	0	111.9	I1308 V1312 L1338 N1342	I1308-K1310 VanDerWaalsContact C-N 3.25Å; I1308-K1310 PolarHBondContact O-N 3.32Å; K1310-V1312 PolarHBondContact O-N 2.82Å; K1310-L1338 HydrophobicContact CB-CD1 4.45Å; K1310-L1338 HydrophobicContact CB-CD2 4.08Å; K1310-L1338 HydrophobicContact CD-CD2 4.4Å; K1310-N1342 PolarHBondContact O-ND2 2.78Å
1311	P	90.4	Very high	88.6	Confident	27 Å²	27	64.9 Å²	64.9	18%	0.175	31%	0.307	C	S	.	.			trans	-66.7	130	-179.9	25.9	-33.7	0	0	0	112.5	L1295 Y1304 Y1305 I1308 R1316	L1295-P1311 HydrophobicContact CD1-CB 3.93Å; L1295-P1311 HydrophobicContact CD2-CB 3.56Å; L1295-P1311 HydrophobicContact CG-CB 4.41Å; Y1304-P1311 HydrophobicContact CE1-CB 4.14Å; Y1305-P1311 HydrophobicContact CD1-CG 4.29Å; Y1305-P1311 HydrophobicContact CE1-CB 4.26Å; Y1305-P1311 HydrophobicContact CE1-CG 4.03Å; I1308-P1311 WeakPolarHBondContact O-CD 3.3Å; P1311-R1316 PolarHBondContact O-NH1 3.23Å
1312	V	91.1	Very high	88.7	Confident	11 Å²	11	69.2 Å²	69.2	7%	0.067	32%	0.323	C	S	.	.			trans	-141.4	140	-178.8	175.9	0	0	0	0	108.7	K1310 I1317 L1338	K1310-V1312 PolarHBondContact O-N 2.82Å; V1312-I1317 HydrophobicContact CG1-CD1 3.84Å; V1312-I1317 HydrophobicContact CG1-CG1 3.76Å; V1312-L1338 HydrophobicContact CG2-CD2 3.95Å
1313	D	93.4	Very high	88.7	Confident	16 Å²	16	69.4 Å²	69.4	9%	0.086	32%	0.32	C	S	.	.			trans	-128.3	165	172.9	52.2	23.4	0	0	0	111	F1292 K1294 L1295 N1315 R1316 I1317	F1292-D1313 WeakPolarHBondContact O-CB 3.41Å; K1294-D1313 WeakPolarHBondContact CA-OD2 3.46Å; L1295-D1313 HydrophobicContact CG-CB 4.04Å; L1295-D1313 WeakPolarHBondContact CG-OD2 3.2Å; L1295-D1313 PolarHBondContact N-OD2 3.4Å; D1313-N1315 PolarHBondContact O-N 3.4Å; D1313-R1316 PolarHBondContact O-N 3.3Å; D1313-R1316 VanDerWaalsContact O-N 3.17Å; D1313-R1316 WeakPolarHBondContact OD1-CB 3.46Å; D1313-R1316 WeakPolarHBondContact OD1-CG 3.39Å; D1313-R1316 PolarHBondContact OD1-N 3.43Å; D1313-I1317 WeakPolarHBondContact O-CG1 3.14Å; D1313-I1317 PolarHBondContact O-N 3.06Å; D1313-I1317 VanDerWaalsContact O-N 3.13Å
1314	F	94.4	Very high	88.5	Confident	1 Å²	1	68 Å²	68	0%	0.004	32%	0.32	C	S	.	.	H	α-helix	trans	-61.5	-28.8	177.3	-79.3	-60.8	0	0	0	112.5	L1274 V1277 I1278 F1292 M1293 I1317 R1318 L1339 L1360	L1274-F1314 HydrophobicContact CD1-CD1 3.99Å; L1274-F1314 HydrophobicContact CD1-CE1 4.3Å; V1277-F1314 HydrophobicContact CG1-CE1 4Å; V1277-F1314 HydrophobicContact CG1-CZ 3.72Å; I1278-F1314 HydrophobicContact CD1-CB 4.38Å; I1278-F1314 HydrophobicContact CD1-CD1 4.41Å; I1278-F1314 HydrophobicContact CG1-CD1 4.11Å; I1278-F1314 HydrophobicContact CG1-CG 4.23Å; F1292-F1314 HydrophobicContact CB-CD2 3.57Å; F1292-F1314 HydrophobicContact CB-CE2 3.61Å; F1292-F1314 HydrophobicContact CG-CE2 4.32Å; F1292-F1314 PolarHBondContact O-N 2.93Å; M1293-F1314 HydrophobicContact SD-CB 3.86Å; F1314-I1317 HydrophobicContact CD1-CD1 4.27Å; F1314-I1317 PolarHBondContact O-N 3.45Å; F1314-R1318 VanDerWaalsContact O-CB 3.25Å; F1314-R1318 WeakPolarHBondContact O-CB 3.18Å; F1314-R1318 PolarHBondContact O-N 3.17Å; F1314-L1339 HydrophobicContact CD1-CD1 4.33Å; F1314-L1339 HydrophobicContact CD2-CD1 4.23Å; F1314-L1339 HydrophobicContact CE1-CD1 4.45Å; F1314-L1339 HydrophobicContact CE2-CD1 4.34Å; F1314-L1339 HydrophobicContact CE2-CD2 4.09Å; F1314-L1339 HydrophobicContact CG-CD1 4.21Å; F1314-L1339 HydrophobicContact CZ-CD1 4.44Å; F1314-L1339 HydrophobicContact CZ-CD2 4.04Å; F1314-L1360 HydrophobicContact CE2-CD1 4.39Å
1315	N	90.7	Very high	88.1	Confident	77 Å²	77	72.7 Å²	72.7	41%	0.412	34%	0.341	S	S	.	.	H	α-helix	trans	-63.1	-45.2	173.3	-88.5	-49.9	0	0	0	112.3	M1293 D1313 I1317 R1318 Q1319	M1293-N1315 WeakPolarHBondContact O-CB 3.37Å; M1293-N1315 PolarHBondContact O-N 3.24Å; M1293-N1315 PolarHBondContact O-ND2 3.02Å; D1313-N1315 PolarHBondContact O-N 3.4Å; N1315-I1317 VanDerWaalsContact C-N 3.33Å; N1315-I1317 PolarHBondContact O-N 3.27Å; N1315-R1318 PolarHBondContact O-N 3.3Å; N1315-Q1319 WeakPolarHBondContact O-CB 3.19Å; N1315-Q1319 PolarHBondContact O-N 3.01Å
1316	R	88.8	Confident	87.9	Confident	85 Å²	85	70 Å²	70	32%	0.321	33%	0.33	S	S	.	.	H	α-helix	trans	-60.8	-40.2	172.7	-81.8	173.7	162.6	-162.6	-4.9	112.2	P1311 D1313 Q1319 R1320	P1311-R1316 PolarHBondContact O-NH1 3.23Å; D1313-R1316 PolarHBondContact O-N 3.3Å; D1313-R1316 VanDerWaalsContact O-N 3.17Å; D1313-R1316 WeakPolarHBondContact OD1-CB 3.46Å; D1313-R1316 WeakPolarHBondContact OD1-CG 3.39Å; D1313-R1316 PolarHBondContact OD1-N 3.43Å; R1316-Q1319 PolarHBondContact O-N 3.49Å; R1316-R1320 WeakPolarHBondContact O-CB 3.42Å; R1316-R1320 VanDerWaalsContact O-CG 3.3Å; R1316-R1320 WeakPolarHBondContact O-CG 3.48Å; R1316-R1320 PolarHBondContact O-N 3.2Å
1317	I	91.8	Very high	87.6	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.8	-47.8	177.6	-63.8	173.3	0	0	0	110.4	L1274 V1312 D1313 F1314 N1315 Q1319 R1320 V1321 Y1326 L1332 D1335 I1336 L1339	L1274-I1317 HydrophobicContact CD1-CG2 3.66Å; L1274-I1317 HydrophobicContact CD2-CG2 4.23Å; V1312-I1317 HydrophobicContact CG1-CD1 3.84Å; V1312-I1317 HydrophobicContact CG1-CG1 3.76Å; D1313-I1317 WeakPolarHBondContact O-CG1 3.14Å; D1313-I1317 PolarHBondContact O-N 3.06Å; D1313-I1317 VanDerWaalsContact O-N 3.13Å; F1314-I1317 HydrophobicContact CD1-CD1 4.27Å; F1314-I1317 PolarHBondContact O-N 3.45Å; N1315-I1317 VanDerWaalsContact C-N 3.33Å; N1315-I1317 PolarHBondContact O-N 3.27Å; I1317-Q1319 VanDerWaalsContact C-N 3.27Å; I1317-Q1319 PolarHBondContact O-N 3.2Å; I1317-R1320 WeakPolarHBondContact O-CA 3.21Å; I1317-R1320 WeakPolarHBondContact O-CB 3.38Å; I1317-R1320 PolarHBondContact O-N 3.48Å; I1317-V1321 PolarHBondContact O-N 3.09Å; I1317-Y1326 HydrophobicContact CG2-CE2 4.35Å; I1317-L1332 HydrophobicContact CG2-CD1 3.36Å; I1317-D1335 HydrophobicContact CD1-CB 4.12Å; I1317-D1335 HydrophobicContact CG1-CB 4.09Å; I1317-I1336 HydrophobicContact CD1-CG1 3.96Å; I1317-L1339 HydrophobicContact CD1-CD1 4.02Å
1318	R	90.4	Very high	87.6	Confident	68 Å²	68	66.3 Å²	66.3	26%	0.257	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-34.5	177.2	-153.2	170.3	-146	-176.8	7.6	112	L1274 D1275 F1314 N1315 K1322	L1274-R1318 HydrophobicContact CD2-CB 3.93Å; L1274-R1318 HydrophobicContact CD2-CG 3.89Å; D1275-R1318 IonicContact OD1-CZ 2.81Å; D1275-R1318 IonicContact OD1-NE 2.92Å; D1275-R1318 IonicContact OD1-NH2 3.99Å; D1275-R1318 PolarHBondContact OD1-NH2 3.41Å; F1314-R1318 VanDerWaalsContact O-CB 3.25Å; F1314-R1318 WeakPolarHBondContact O-CB 3.18Å; F1314-R1318 PolarHBondContact O-N 3.17Å; N1315-R1318 PolarHBondContact O-N 3.3Å; R1318-K1322 WeakPolarHBondContact O-CG 3.39Å; R1318-K1322 PolarHBondContact O-N 3.33Å
1319	Q	85.9	Confident	87.5	Confident	112 Å²	112	66.8 Å²	66.8	52%	0.523	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-45.2	170.1	-159.9	79.2	12.4	0	0	111.5	N1315 R1316 I1317 V1321 K1322 D1323	N1315-Q1319 WeakPolarHBondContact O-CB 3.19Å; N1315-Q1319 PolarHBondContact O-N 3.01Å; R1316-Q1319 PolarHBondContact O-N 3.49Å; I1317-Q1319 VanDerWaalsContact C-N 3.27Å; I1317-Q1319 PolarHBondContact O-N 3.2Å; Q1319-V1321 PolarHBondContact O-N 2.96Å; Q1319-K1322 PolarHBondContact O-N 3.49Å; Q1319-D1323 VanDerWaalsContact O-CB 3.3Å; Q1319-D1323 WeakPolarHBondContact O-CB 3.28Å; Q1319-D1323 PolarHBondContact O-N 3.32Å
1320	R	89.2	Confident	87.7	Confident	82 Å²	82	61.1 Å²	61.1	31%	0.309	29%	0.289	S	S	.	.	H	α-helix	trans	-63.5	-35.6	177.8	-74.7	173.3	-174.9	-165.3	8.7	113.2	R1316 I1317 G1324 K1325 Y1326 D1335	R1316-R1320 WeakPolarHBondContact O-CB 3.42Å; R1316-R1320 VanDerWaalsContact O-CG 3.3Å; R1316-R1320 WeakPolarHBondContact O-CG 3.48Å; R1316-R1320 PolarHBondContact O-N 3.2Å; I1317-R1320 WeakPolarHBondContact O-CA 3.21Å; I1317-R1320 WeakPolarHBondContact O-CB 3.38Å; I1317-R1320 PolarHBondContact O-N 3.48Å; R1320-G1324 PolarHBondContact O-N 2.9Å; R1320-K1325 HydrophobicContact CB-CB 4.19Å; R1320-K1325 HydrophobicContact CB-CD 4.44Å; R1320-K1325 HydrophobicContact CG-CB 4.4Å; R1320-K1325 HydrophobicContact CG-CD 4.02Å; R1320-K1325 PolarHBondContact O-N 3.28Å; R1320-Y1326 HydrophobicContact CB-CD2 4.07Å; R1320-Y1326 HydrophobicContact CB-CE1 4.42Å; R1320-Y1326 HydrophobicContact CB-CE2 3.32Å; R1320-Y1326 VanDerWaalsContact CD-OH 3.25Å; R1320-Y1326 WeakPolarHBondContact CD-OH 3.37Å; R1320-D1335 WeakPolarHBondContact CD-OD2 3.42Å; R1320-D1335 IonicContact CZ-OD1 2.75Å; R1320-D1335 IonicContact CZ-OD2 2.92Å; R1320-D1335 IonicContact NE-OD2 2.98Å; R1320-D1335 IonicContact NH1-OD1 3.83Å; R1320-D1335 PolarHBondContact NH1-OD1 3.4Å; R1320-D1335 IonicContact NH1-OD2 3.09Å; R1320-D1335 PolarHBondContact NH1-OD2 3.02Å
1321	V	88.1	Confident	87.7	Confident	11 Å²	11	58 Å²	58	7%	0.067	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-50.2	170.9	178.3	0	0	0	0	110.5	L1270 Q1271 L1274 I1317 Q1319 D1323 G1324 Y1326 L1332	L1270-V1321 HydrophobicContact CB-CG1 4.18Å; L1270-V1321 HydrophobicContact CB-CG2 4.48Å; Q1271-V1321 HydrophobicContact CB-CG1 4.46Å; L1274-V1321 HydrophobicContact CD2-CG2 3.99Å; I1317-V1321 PolarHBondContact O-N 3.09Å; Q1319-V1321 PolarHBondContact O-N 2.96Å; V1321-D1323 VanDerWaalsContact C-N 3.34Å; V1321-D1323 PolarHBondContact O-N 3.16Å; V1321-G1324 PolarHBondContact O-N 2.64Å; V1321-G1324 VanDerWaalsContact O-N 3.11Å; V1321-Y1326 HydrophobicContact CB-CD2 4.49Å; V1321-Y1326 HydrophobicContact CG2-CD2 3.74Å; V1321-Y1326 HydrophobicContact CG2-CE2 3.71Å; V1321-L1332 HydrophobicContact CG2-CD1 4.35Å
1322	K	84	Confident	87.8	Confident	151 Å²	151	56.7 Å²	56.7	66%	0.657	27%	0.269	S	S	*	.	H	α-helix	trans	-62.3	-36.8	178.4	-75.8	178.8	177	178.7	0	113.8	R1318 Q1319 G1324	R1318-K1322 WeakPolarHBondContact O-CG 3.39Å; R1318-K1322 PolarHBondContact O-N 3.33Å; Q1319-K1322 PolarHBondContact O-N 3.49Å; K1322-G1324 PolarHBondContact O-N 2.87Å
1323	D	81.9	Confident	87.9	Confident	79 Å²	79	58.2 Å²	58.2	42%	0.422	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-5.9	177.5	-69.8	-18.2	0	0	0	113	Q1319 V1321 K1325	Q1319-D1323 VanDerWaalsContact O-CB 3.3Å; Q1319-D1323 WeakPolarHBondContact O-CB 3.28Å; Q1319-D1323 PolarHBondContact O-N 3.32Å; V1321-D1323 VanDerWaalsContact C-N 3.34Å; V1321-D1323 PolarHBondContact O-N 3.16Å; D1323-K1325 VanDerWaalsContact C-N 3.35Å; D1323-K1325 HydrophobicContact CB-CD 3.77Å; D1323-K1325 HydrophobicContact CB-CG 3.86Å; D1323-K1325 PolarHBondContact O-N 3Å; D1323-K1325 WeakPolarHBondContact OD2-CE 3.18Å; D1323-K1325 IonicContact OD2-NZ 3.25Å; D1323-K1325 PolarHBondContact OD2-NZ 3.25Å
1324	G	81.8	Confident	87.8	Confident	34 Å²	34	60.2 Å²	60.2	35%	0.351	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	35.2	-176.5	0	0	0	0	0	113.4	V1262 R1320 V1321 K1322	V1262-G1324 WeakPolarHBondContact CG2-O 3.42Å; R1320-G1324 PolarHBondContact O-N 2.9Å; V1321-G1324 PolarHBondContact O-N 2.64Å; V1321-G1324 VanDerWaalsContact O-N 3.11Å; K1322-G1324 PolarHBondContact O-N 2.87Å
1325	K	82.5	Confident	87.7	Confident	125 Å²	125	61 Å²	61	54%	0.543	30%	0.298	S	S	.	.			trans	-83.8	-20.4	-176.3	-74.1	169.4	177.4	159.8	0	114.1	R1320 D1323	R1320-K1325 HydrophobicContact CB-CB 4.19Å; R1320-K1325 HydrophobicContact CB-CD 4.44Å; R1320-K1325 HydrophobicContact CG-CB 4.4Å; R1320-K1325 HydrophobicContact CG-CD 4.02Å; R1320-K1325 PolarHBondContact O-N 3.28Å; D1323-K1325 VanDerWaalsContact C-N 3.35Å; D1323-K1325 HydrophobicContact CB-CD 3.77Å; D1323-K1325 HydrophobicContact CB-CG 3.86Å; D1323-K1325 PolarHBondContact O-N 3Å; D1323-K1325 WeakPolarHBondContact OD2-CE 3.18Å; D1323-K1325 IonicContact OD2-NZ 3.25Å; D1323-K1325 PolarHBondContact OD2-NZ 3.25Å
1326	Y	86.5	Confident	87.8	Confident	8 Å²	8	57.4 Å²	57.4	3%	0.031	28%	0.279	C	S	.	.			trans	-92.1	123.7	178.7	-60.8	-63.5	0	0	0	112.4	V1262 I1317 R1320 V1321 E1331 L1332 D1335	V1262-Y1326 WeakPolarHBondContact CG2-O 3.3Å; I1317-Y1326 HydrophobicContact CG2-CE2 4.35Å; R1320-Y1326 HydrophobicContact CB-CD2 4.07Å; R1320-Y1326 HydrophobicContact CB-CE1 4.42Å; R1320-Y1326 HydrophobicContact CB-CE2 3.32Å; R1320-Y1326 VanDerWaalsContact CD-OH 3.25Å; R1320-Y1326 WeakPolarHBondContact CD-OH 3.37Å; V1321-Y1326 HydrophobicContact CB-CD2 4.49Å; V1321-Y1326 HydrophobicContact CG2-CD2 3.74Å; V1321-Y1326 HydrophobicContact CG2-CE2 3.71Å; Y1326-E1331 WeakPolarHBondContact CA-OE2 3.45Å; Y1326-E1331 HydrophobicContact CD1-CB 3.81Å; Y1326-E1331 VanDerWaalsContact CE1-O 3.31Å; Y1326-E1331 WeakPolarHBondContact CE1-O 3.34Å; Y1326-L1332 HydrophobicContact CD1-CB 4.31Å; Y1326-L1332 HydrophobicContact CD2-CB 4.41Å; Y1326-L1332 HydrophobicContact CD2-CD1 4.31Å; Y1326-L1332 HydrophobicContact CE1-CB 4.46Å; Y1326-L1332 HydrophobicContact CE2-CD1 3.79Å; Y1326-L1332 HydrophobicContact CG-CB 4.28Å; Y1326-D1335 WeakPolarHBondContact CE1-OD2 3.5Å; Y1326-D1335 VanDerWaalsContact CZ-OD2 3.26Å; Y1326-D1335 PolarHBondContact OH-OD2 3.3Å
1327	R	78.8	Confident	88	Confident	122 Å²	122	56.2 Å²	56.2	46%	0.46	28%	0.279	S	S	.	.	S	Bend	trans	-96.1	-17.8	-177.4	-59.4	176.9	175.9	-120.5	3	113.8	L1266 E1331	L1266-R1327 VanDerWaalsContact CD2-O 3.25Å; L1266-R1327 WeakPolarHBondContact CD2-O 3.35Å; R1327-E1331 PolarHBondContact N-OE2 2.99Å
1328	S	87.2	Confident	88	Confident	36 Å²	36	58.3 Å²	58.3	25%	0.252	29%	0.289	S	S	.	.	S	Bend	trans	-142.2	175.6	170.4	81.8	0	0	0	0	111.2	D1330 E1331	S1328-D1330 VanDerWaalsContact C-N 3.27Å; S1328-D1330 VanDerWaalsContact CB-OD2 3.28Å; S1328-D1330 WeakPolarHBondContact CB-OD2 3.41Å; S1328-D1330 PolarHBondContact OG-N 3.1Å; S1328-D1330 VanDerWaalsContact OG-N 3.13Å; S1328-D1330 PolarHBondContact OG-OD2 3.25Å; S1328-E1331 PolarHBondContact OG-N 3.47Å
1329	V	87.8	Confident	88.2	Confident	16 Å²	16	55.3 Å²	55.3	10%	0.097	28%	0.278	C	S	.	.	H	α-helix	trans	-67.6	-32.1	171.8	177.4	0	0	0	0	110.9	L1266 K1269 L1270 L1273 E1331 L1332 E1333 W1364	L1266-V1329 HydrophobicContact CD1-CG2 4.25Å; K1269-V1329 HydrophobicContact CD-CG2 4.17Å; L1270-V1329 HydrophobicContact CD2-CG2 4.37Å; L1273-V1329 HydrophobicContact CD1-CG1 3.72Å; L1273-V1329 HydrophobicContact CD1-CG2 4.4Å; V1329-E1331 VanDerWaalsContact C-N 3.34Å; V1329-E1331 PolarHBondContact O-N 3.31Å; V1329-L1332 WeakPolarHBondContact O-CB 3.48Å; V1329-L1332 PolarHBondContact O-N 3.47Å; V1329-L1332 VanDerWaalsContact O-N 3.14Å; V1329-E1333 PolarHBondContact O-N 3.23Å; V1329-W1364 HydrophobicContact CG1-CH2 4.27Å; V1329-W1364 HydrophobicContact CG1-CZ2 4.05Å
1330	D	88.8	Confident	88.5	Confident	76 Å²	76	50 Å²	50	41%	0.406	25%	0.254	S	S	.	.	H	α-helix	trans	-71.4	-27.4	-176.6	-29.1	-83.6	0	0	0	112.2	S1328 A1334 R1368	S1328-D1330 VanDerWaalsContact C-N 3.27Å; S1328-D1330 VanDerWaalsContact CB-OD2 3.28Å; S1328-D1330 WeakPolarHBondContact CB-OD2 3.41Å; S1328-D1330 PolarHBondContact OG-N 3.1Å; S1328-D1330 VanDerWaalsContact OG-N 3.13Å; S1328-D1330 PolarHBondContact OG-OD2 3.25Å; D1330-A1334 WeakPolarHBondContact O-CB 3.38Å; D1330-A1334 PolarHBondContact O-N 3.48Å; D1330-R1368 IonicContact OD1-CZ 3.79Å; D1330-R1368 IonicContact OD1-NH1 2.83Å; D1330-R1368 PolarHBondContact OD1-NH1 3.11Å; D1330-R1368 IonicContact OD1-NH2 3.72Å; D1330-R1368 PolarHBondContact OD1-NH2 2.83Å
1331	E	88.8	Confident	88.7	Confident	80 Å²	80	52.4 Å²	52.4	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-70.8	-30.8	170.9	-65.3	-174.2	172.9	0	0	112.4	Y1326 R1327 S1328 V1329	Y1326-E1331 WeakPolarHBondContact CA-OE2 3.45Å; Y1326-E1331 HydrophobicContact CD1-CB 3.81Å; Y1326-E1331 VanDerWaalsContact CE1-O 3.31Å; Y1326-E1331 WeakPolarHBondContact CE1-O 3.34Å; R1327-E1331 PolarHBondContact N-OE2 2.99Å; S1328-E1331 PolarHBondContact OG-N 3.47Å; V1329-E1331 VanDerWaalsContact C-N 3.34Å; V1329-E1331 PolarHBondContact O-N 3.31Å
1332	L	92.2	Very high	88.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-75.3	-42	172.9	173.1	61.4	0	0	0	110.9	L1270 I1317 V1321 Y1326 V1329 A1334 D1335 I1336 W1364	L1270-L1332 HydrophobicContact CB-CD2 4.1Å; L1270-L1332 HydrophobicContact CD2-CB 3.83Å; L1270-L1332 HydrophobicContact CD2-CD2 3.59Å; L1270-L1332 HydrophobicContact CD2-CG 4.36Å; L1270-L1332 HydrophobicContact CG-CD2 4.46Å; I1317-L1332 HydrophobicContact CG2-CD1 3.36Å; V1321-L1332 HydrophobicContact CG2-CD1 4.35Å; Y1326-L1332 HydrophobicContact CD1-CB 4.31Å; Y1326-L1332 HydrophobicContact CD2-CB 4.41Å; Y1326-L1332 HydrophobicContact CD2-CD1 4.31Å; Y1326-L1332 HydrophobicContact CE1-CB 4.46Å; Y1326-L1332 HydrophobicContact CE2-CD1 3.79Å; Y1326-L1332 HydrophobicContact CG-CB 4.28Å; V1329-L1332 WeakPolarHBondContact O-CB 3.48Å; V1329-L1332 PolarHBondContact O-N 3.47Å; V1329-L1332 VanDerWaalsContact O-N 3.14Å; L1332-A1334 VanDerWaalsContact C-N 3.28Å; L1332-A1334 PolarHBondContact O-N 2.98Å; L1332-D1335 PolarHBondContact O-N 2.94Å; L1332-I1336 HydrophobicContact CD1-CD1 3.86Å; L1332-I1336 HydrophobicContact CD1-CG1 4.29Å; L1332-I1336 HydrophobicContact CG-CD1 3.93Å; L1332-I1336 WeakPolarHBondContact O-CG1 3.37Å; L1332-I1336 PolarHBondContact O-N 3.37Å; L1332-W1364 HydrophobicContact CB-CH2 4.44Å; L1332-W1364 HydrophobicContact CD2-CH2 3.81Å; L1332-W1364 HydrophobicContact CD2-CZ3 4.08Å; L1332-W1364 HydrophobicContact CG-CH2 3.82Å; L1332-W1364 HydrophobicContact CG-CZ3 4.2Å
1333	E	92.2	Very high	89.2	Confident	43 Å²	43	45.8 Å²	45.8	20%	0.201	24%	0.24	C	C	.	.	H	α-helix	trans	-54.7	-43.4	171.3	-178.8	165.2	-87.5	0	0	111.8	V1329 D1335 I1336 L1337 W1364 R1368	V1329-E1333 PolarHBondContact O-N 3.23Å; E1333-D1335 VanDerWaalsContact C-N 3.34Å; E1333-D1335 PolarHBondContact O-N 3.48Å; E1333-I1336 PolarHBondContact O-N 3.35Å; E1333-L1337 HydrophobicContact CG-CD1 3.66Å; E1333-L1337 HydrophobicContact CG-CG 4.03Å; E1333-L1337 WeakPolarHBondContact O-CB 3.29Å; E1333-L1337 WeakPolarHBondContact O-CG 3.39Å; E1333-L1337 PolarHBondContact O-N 3.42Å; E1333-W1364 HydrophobicContact CB-CZ2 3.71Å; E1333-W1364 HydrophobicContact CG-CZ2 4.34Å; E1333-W1364 PolarHBondContact OE1-NE1 2.98Å; E1333-R1368 WeakPolarHBondContact OE1-CD 3.49Å; E1333-R1368 IonicContact OE1-CZ 2.61Å; E1333-R1368 IonicContact OE1-NH1 2.96Å; E1333-R1368 PolarHBondContact OE1-NH1 3.16Å; E1333-R1368 IonicContact OE2-NH1 3.69Å; E1333-R1368 PolarHBondContact OE2-NH1 3.42Å
1334	A	91.4	Very high	89.6	Confident	59 Å²	59	44.6 Å²	44.6	49%	0.488	23%	0.231	S	C	.	.	H	α-helix	trans	-60.9	-37.4	179.6	0	0	0	0	0	113.5	D1330 L1332 L1338	D1330-A1334 WeakPolarHBondContact O-CB 3.38Å; D1330-A1334 PolarHBondContact O-N 3.48Å; L1332-A1334 VanDerWaalsContact C-N 3.28Å; L1332-A1334 PolarHBondContact O-N 2.98Å; A1334-L1338 WeakPolarHBondContact O-CB 3.27Å; A1334-L1338 PolarHBondContact O-N 3.47Å; A1334-L1338 VanDerWaalsContact O-N 3.12Å
1335	D	93.2	Very high	90	Very high	17 Å²	17	46.8 Å²	46.8	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-76.4	-34.3	174.6	-85	-36.2	0	0	0	112.6	I1317 R1320 Y1326 L1332 E1333 L1338 L1339	I1317-D1335 HydrophobicContact CD1-CB 4.12Å; I1317-D1335 HydrophobicContact CG1-CB 4.09Å; R1320-D1335 WeakPolarHBondContact CD-OD2 3.42Å; R1320-D1335 IonicContact CZ-OD1 2.75Å; R1320-D1335 IonicContact CZ-OD2 2.92Å; R1320-D1335 IonicContact NE-OD2 2.98Å; R1320-D1335 IonicContact NH1-OD1 3.83Å; R1320-D1335 PolarHBondContact NH1-OD1 3.4Å; R1320-D1335 IonicContact NH1-OD2 3.09Å; R1320-D1335 PolarHBondContact NH1-OD2 3.02Å; Y1326-D1335 WeakPolarHBondContact CE1-OD2 3.5Å; Y1326-D1335 VanDerWaalsContact CZ-OD2 3.26Å; Y1326-D1335 PolarHBondContact OH-OD2 3.3Å; L1332-D1335 PolarHBondContact O-N 2.94Å; E1333-D1335 VanDerWaalsContact C-N 3.34Å; E1333-D1335 PolarHBondContact O-N 3.48Å; D1335-L1338 PolarHBondContact O-N 2.95Å; D1335-L1339 WeakPolarHBondContact O-CB 3.35Å; D1335-L1339 PolarHBondContact O-N 3.47Å
1336	I	92.1	Very high	90.5	Very high	1 Å²	1	44 Å²	44	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-71.2	-44.8	178.1	-70.8	172.9	0	0	0	110.9	L1274 I1317 L1332 E1333 L1338 L1339 C1340 W1364	L1274-I1336 HydrophobicContact CD1-CD1 4.44Å; I1317-I1336 HydrophobicContact CD1-CG1 3.96Å; L1332-I1336 HydrophobicContact CD1-CD1 3.86Å; L1332-I1336 HydrophobicContact CD1-CG1 4.29Å; L1332-I1336 HydrophobicContact CG-CD1 3.93Å; L1332-I1336 WeakPolarHBondContact O-CG1 3.37Å; L1332-I1336 PolarHBondContact O-N 3.37Å; E1333-I1336 PolarHBondContact O-N 3.35Å; I1336-L1338 VanDerWaalsContact C-N 3.27Å; I1336-L1338 PolarHBondContact O-N 3.03Å; I1336-L1339 WeakPolarHBondContact O-CB 3.35Å; I1336-L1339 PolarHBondContact O-N 3.37Å; I1336-L1339 VanDerWaalsContact O-N 3.16Å; I1336-C1340 PolarHBondContact O-N 2.94Å; I1336-W1364 HydrophobicContact CD1-CD2 4.2Å; I1336-W1364 HydrophobicContact CD1-CE3 3.44Å; I1336-W1364 VanDerWaalsContact CD1-CE3 3.44Å; I1336-W1364 HydrophobicContact CD1-CH2 4.06Å; I1336-W1364 HydrophobicContact CD1-CZ3 3.34Å; I1336-W1364 HydrophobicContact CG2-CB 4.43Å; I1336-W1364 HydrophobicContact CG2-CD2 4.38Å; I1336-W1364 HydrophobicContact CG2-CE3 4.45Å; I1336-W1364 HydrophobicContact CG2-CG 4.34Å
1337	L	92.6	Very high	90.6	Very high	61 Å²	61	45.1 Å²	45.1	32%	0.319	23%	0.231	S	C	.	.	H	α-helix	trans	-63.8	-33.2	172.2	-68.3	178.8	0	0	0	111.8	E1333 K1341 Q1361	E1333-L1337 HydrophobicContact CG-CD1 3.66Å; E1333-L1337 HydrophobicContact CG-CG 4.03Å; E1333-L1337 WeakPolarHBondContact O-CB 3.29Å; E1333-L1337 WeakPolarHBondContact O-CG 3.39Å; E1333-L1337 PolarHBondContact O-N 3.42Å; L1337-K1341 WeakPolarHBondContact O-CB 3.33Å; L1337-K1341 PolarHBondContact O-N 2.96Å; L1337-Q1361 HydrophobicContact CD2-CG 3.91Å
1338	L	93.4	Very high	90.8	Very high	43 Å²	43	46.8 Å²	46.8	23%	0.225	25%	0.246	C	C	.	.	H	α-helix	trans	-67.2	-39.5	171.9	177.1	61.3	0	0	0	111.9	K1310 V1312 A1334 D1335 I1336 K1341 N1342	K1310-L1338 HydrophobicContact CB-CD1 4.45Å; K1310-L1338 HydrophobicContact CB-CD2 4.08Å; K1310-L1338 HydrophobicContact CD-CD2 4.4Å; V1312-L1338 HydrophobicContact CG2-CD2 3.95Å; A1334-L1338 WeakPolarHBondContact O-CB 3.27Å; A1334-L1338 PolarHBondContact O-N 3.47Å; A1334-L1338 VanDerWaalsContact O-N 3.12Å; D1335-L1338 PolarHBondContact O-N 2.95Å; I1336-L1338 VanDerWaalsContact C-N 3.27Å; I1336-L1338 PolarHBondContact O-N 3.03Å; L1338-K1341 PolarHBondContact O-N 3.19Å; L1338-N1342 WeakPolarHBondContact CD1-OD1 3.4Å; L1338-N1342 VanDerWaalsContact O-CB 3.28Å; L1338-N1342 WeakPolarHBondContact O-CB 3.42Å; L1338-N1342 PolarHBondContact O-N 3.46Å; L1338-N1342 PolarHBondContact O-ND2 2.83Å; L1338-N1342 PolarHBondContact O-OD1 3.1Å
1339	L	94.1	Very high	90.5	Very high	5 Å²	5	51.6 Å²	51.6	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-49.2	175.1	176.1	149.2	0	0	0	111.4	F1292 F1314 I1317 D1335 I1336 K1341 N1342 A1343	F1292-L1339 HydrophobicContact CB-CD1 4.34Å; F1292-L1339 HydrophobicContact CB-CD2 4.09Å; F1292-L1339 HydrophobicContact CD1-CD2 3.61Å; F1292-L1339 HydrophobicContact CD1-CG 4.29Å; F1292-L1339 HydrophobicContact CE1-CD2 4.37Å; F1292-L1339 HydrophobicContact CG-CD2 4.1Å; F1314-L1339 HydrophobicContact CD1-CD1 4.33Å; F1314-L1339 HydrophobicContact CD2-CD1 4.23Å; F1314-L1339 HydrophobicContact CE1-CD1 4.45Å; F1314-L1339 HydrophobicContact CE2-CD1 4.34Å; F1314-L1339 HydrophobicContact CE2-CD2 4.09Å; F1314-L1339 HydrophobicContact CG-CD1 4.21Å; F1314-L1339 HydrophobicContact CZ-CD1 4.44Å; F1314-L1339 HydrophobicContact CZ-CD2 4.04Å; I1317-L1339 HydrophobicContact CD1-CD1 4.02Å; D1335-L1339 WeakPolarHBondContact O-CB 3.35Å; D1335-L1339 PolarHBondContact O-N 3.47Å; I1336-L1339 WeakPolarHBondContact O-CB 3.35Å; I1336-L1339 PolarHBondContact O-N 3.37Å; I1336-L1339 VanDerWaalsContact O-N 3.16Å; L1339-K1341 PolarHBondContact O-N 3.08Å; L1339-N1342 PolarHBondContact O-N 3.3Å; L1339-A1343 PolarHBondContact O-N 3.42Å
1340	C	92.5	Very high	90.2	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.007	29%	0.292	C	S	.	.	H	α-helix	trans	-59.7	-46.9	173.7	-68.4	0	0	0	0	111.5	I1336 N1342 A1343 Q1344 S1357 Q1361	I1336-C1340 PolarHBondContact O-N 2.94Å; C1340-N1342 PolarHBondContact O-N 3.05Å; C1340-A1343 WeakPolarHBondContact O-CB 3.4Å; C1340-A1343 PolarHBondContact O-N 2.73Å; C1340-Q1344 WeakPolarHBondContact O-CG 3.26Å; C1340-Q1344 PolarHBondContact O-N 3.49Å; C1340-S1357 PolarHBondContact SG-O 2.92Å; C1340-Q1361 HydrophobicContact CB-CB 4.43Å
1341	K	92.3	Very high	90.1	Very high	132 Å²	132	51.7 Å²	51.7	57%	0.574	29%	0.285	S	S	*	.	H	α-helix	trans	-65.9	-36.8	-179.1	-174.8	166.6	-174.9	166.4	0	113.2	L1337 L1338 L1339 A1343 Q1344 T1345	L1337-K1341 WeakPolarHBondContact O-CB 3.33Å; L1337-K1341 PolarHBondContact O-N 2.96Å; L1338-K1341 PolarHBondContact O-N 3.19Å; L1339-K1341 PolarHBondContact O-N 3.08Å; K1341-A1343 VanDerWaalsContact C-N 3.3Å; K1341-A1343 PolarHBondContact O-N 3.44Å; K1341-Q1344 PolarHBondContact O-N 3.02Å; K1341-T1345 WeakPolarHBondContact O-CB 3.36Å; K1341-T1345 PolarHBondContact O-N 2.95Å; K1341-T1345 PolarHBondContact O-OG1 3.33Å
1342	N	92.3	Very high	90.1	Very high	13 Å²	13	52.8 Å²	52.8	7%	0.07	29%	0.293	C	S	.	.	H	α-helix	trans	-60.3	-42.9	174	-75.9	-18.9	0	0	0	110.5	I1308 K1310 L1338 L1339 C1340 T1345 Y1346	I1308-N1342 HydrophobicContact CD1-CB 4.29Å; I1308-N1342 WeakPolarHBondContact CD1-O 3.33Å; I1308-N1342 HydrophobicContact CG2-CB 4.03Å; I1308-N1342 WeakPolarHBondContact CG2-OD1 3.47Å; K1310-N1342 PolarHBondContact O-ND2 2.78Å; L1338-N1342 WeakPolarHBondContact CD1-OD1 3.4Å; L1338-N1342 VanDerWaalsContact O-CB 3.28Å; L1338-N1342 WeakPolarHBondContact O-CB 3.42Å; L1338-N1342 PolarHBondContact O-N 3.46Å; L1338-N1342 PolarHBondContact O-ND2 2.83Å; L1338-N1342 PolarHBondContact O-OD1 3.1Å; L1339-N1342 PolarHBondContact O-N 3.3Å; C1340-N1342 PolarHBondContact O-N 3.05Å; N1342-T1345 PolarHBondContact O-N 3.06Å; N1342-Y1346 PolarHBondContact O-N 3.41Å
1343	A	91.1	Very high	90	Very high	11 Å²	11	55.9 Å²	55.9	9%	0.091	31%	0.309	C	S	.	.	H	α-helix	trans	-64.3	-45.1	175.8	0	0	0	0	0	112.2	F1292 L1339 C1340 K1341 T1345 Y1346 N1347 I1353	F1292-A1343 HydrophobicContact CE1-CB 3.71Å; L1339-A1343 PolarHBondContact O-N 3.42Å; C1340-A1343 WeakPolarHBondContact O-CB 3.4Å; C1340-A1343 PolarHBondContact O-N 2.73Å; K1341-A1343 VanDerWaalsContact C-N 3.3Å; K1341-A1343 PolarHBondContact O-N 3.44Å; A1343-T1345 PolarHBondContact O-N 2.99Å; A1343-Y1346 PolarHBondContact O-N 3.27Å; A1343-N1347 WeakPolarHBondContact O-CB 3.29Å; A1343-N1347 PolarHBondContact O-N 3.27Å; A1343-N1347 PolarHBondContact O-ND2 2.96Å; A1343-I1353 HydrophobicContact CB-CG2 4.24Å
1344	Q	91	Very high	90	Very high	53 Å²	53	55.7 Å²	55.7	25%	0.248	31%	0.308	C	S	.	.	H	α-helix	trans	-66	-19.7	175.6	-65.5	163.2	5	0	0	114	C1340 K1341 F1354 S1357 Q1361	C1340-Q1344 WeakPolarHBondContact O-CG 3.26Å; C1340-Q1344 PolarHBondContact O-N 3.49Å; K1341-Q1344 PolarHBondContact O-N 3.02Å; Q1344-F1354 HydrophobicContact CB-CD2 4.27Å; Q1344-F1354 HydrophobicContact CB-CE2 3.99Å; Q1344-F1354 HydrophobicContact CG-CD2 4.27Å; Q1344-F1354 HydrophobicContact CG-CE2 4.11Å; Q1344-F1354 HydrophobicContact CG-CZ 4.49Å; Q1344-S1357 WeakPolarHBondContact CG-OG 3.48Å; Q1344-S1357 PolarHBondContact NE2-OG 3.45Å; Q1344-Q1361 VanDerWaalsContact NE2-OE1 3.14Å
1345	T	90.3	Very high	90	Very high	80 Å²	80	58 Å²	58	49%	0.491	31%	0.309	S	S	.	.	H	α-helix	trans	-89.9	-24.6	179.4	-54.9	0	0	0	0	112.2	V1307 I1308 K1341 N1342 A1343	V1307-T1345 HydrophobicContact CG1-CG2 4.48Å; I1308-T1345 HydrophobicContact CD1-CG2 4.14Å; K1341-T1345 WeakPolarHBondContact O-CB 3.36Å; K1341-T1345 PolarHBondContact O-N 2.95Å; K1341-T1345 PolarHBondContact O-OG1 3.33Å; N1342-T1345 PolarHBondContact O-N 3.06Å; A1343-T1345 PolarHBondContact O-N 2.99Å
1346	Y	91.4	Very high	90	Very high	66 Å²	66	57.5 Å²	57.5	26%	0.259	31%	0.306	S	S	.	.	H	α-helix	trans	-104.1	-32.5	-177.2	-178.7	-96.7	0	0	0	113.4	D1303 Y1304 V1307 N1342 A1343	D1303-Y1346 PolarHBondContact OD2-OH 2.91Å; Y1304-Y1346 AromaticContact CD2-CD1 3.84Å; Y1304-Y1346 HydrophobicContact CD2-CD1 3.84Å; Y1304-Y1346 AromaticContact CD2-CD2 3.88Å; Y1304-Y1346 HydrophobicContact CD2-CD2 3.88Å; Y1304-Y1346 HydrophobicContact CD2-CE1 4.1Å; Y1304-Y1346 HydrophobicContact CD2-CE2 4.14Å; Y1304-Y1346 AromaticContact CD2-CG 3.72Å; Y1304-Y1346 HydrophobicContact CD2-CG 3.72Å; Y1304-Y1346 HydrophobicContact CE2-CD1 4.41Å; Y1304-Y1346 HydrophobicContact CE2-CG 4.27Å; V1307-Y1346 HydrophobicContact CB-CD2 4.3Å; V1307-Y1346 HydrophobicContact CG1-CD2 4.45Å; V1307-Y1346 HydrophobicContact CG2-CD2 4.49Å; N1342-Y1346 PolarHBondContact O-N 3.41Å; A1343-Y1346 PolarHBondContact O-N 3.27Å
1347	N	88.4	Confident	90	Very high	32 Å²	32	57.4 Å²	57.4	17%	0.171	31%	0.305	C	S	.	.	S	Bend	trans	-91.7	145.1	176.3	-64.3	-92.5	0	0	0	110.5	A1343 S1351 F1354	A1343-N1347 WeakPolarHBondContact O-CB 3.29Å; A1343-N1347 PolarHBondContact O-N 3.27Å; A1343-N1347 PolarHBondContact O-ND2 2.96Å; N1347-S1351 PolarHBondContact OD1-OG 3.47Å; N1347-F1354 HydrophobicContact CB-CB 4.17Å
1348	M	83.9	Confident	89.9	Confident	158 Å²	158	57.8 Å²	57.8	78%	0.778	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-68.5	146.9	171.5	-64.2	174.8	63.6	0	0	111.5	G1350 S1351 F1354	M1348-G1350 PolarHBondContact O-N 3.44Å; M1348-S1351 WeakPolarHBondContact O-CB 3.3Å; M1348-S1351 PolarHBondContact O-N 2.94Å; M1348-F1354 WeakPolarHBondContact O-CB 3.47Å
1349	D	81.4	Confident	89.8	Confident	136 Å²	136	58 Å²	58	73%	0.727	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	124.8	165.7	-62.8	24.3	0	0	0	110.1	F1354	D1349-F1354 HydrophobicContact CB-CE1 4.49Å; D1349-F1354 HydrophobicContact CB-CE2 4.47Å; D1349-F1354 HydrophobicContact CB-CZ 4.28Å; D1349-F1354 VanDerWaalsContact OD1-CE2 3.24Å; D1349-F1354 WeakPolarHBondContact OD1-CE2 3.37Å; D1349-F1354 WeakPolarHBondContact OD1-CZ 3.47Å
1350	G	80.9	Confident	89.7	Confident	57 Å²	57	57.8 Å²	57.8	59%	0.588	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	1.6	-175.1	0	0	0	0	0	115.6	M1348	M1348-G1350 PolarHBondContact O-N 3.44Å
1351	S	87.5	Confident	89.7	Confident	37 Å²	37	61 Å²	61	26%	0.259	33%	0.327	S	S	.	.			trans	-68.3	144.2	161.9	173.8	0	0	0	0	110.5	N1347 M1348 I1353 F1354 E1355	N1347-S1351 PolarHBondContact OD1-OG 3.47Å; M1348-S1351 WeakPolarHBondContact O-CB 3.3Å; M1348-S1351 PolarHBondContact O-N 2.94Å; S1351-I1353 PolarHBondContact O-N 3.32Å; S1351-I1353 PolarHBondContact OG-N 3.23Å; S1351-F1354 WeakPolarHBondContact O-CA 3.18Å; S1351-F1354 VanDerWaalsContact O-CB 3.26Å; S1351-F1354 WeakPolarHBondContact O-CB 3.47Å; S1351-F1354 PolarHBondContact O-N 3.41Å; S1351-E1355 PolarHBondContact O-N 2.91Å
1352	L	88.1	Confident	89.6	Confident	104 Å²	104	57.3 Å²	57.3	55%	0.545	32%	0.318	S	S	.	.	H	α-helix	trans	-53.7	-42.1	175.9	-150	83.1	0	0	0	111.6	F1354 E1355 D1356	L1352-F1354 VanDerWaalsContact C-N 3.29Å; L1352-F1354 PolarHBondContact O-N 3.47Å; L1352-E1355 PolarHBondContact O-N 2.72Å; L1352-D1356 WeakPolarHBondContact O-CB 3.43Å; L1352-D1356 PolarHBondContact O-N 3.32Å; L1352-D1356 VanDerWaalsContact O-OD1 3.13Å
1353	I	90.1	Very high	89.5	Confident	65 Å²	65	57.3 Å²	57.3	33%	0.333	32%	0.318	S	S	.	.	H	α-helix	trans	-69.7	-28.3	178.9	-58.6	173.1	0	0	0	111.4	F1292 A1343 S1351 S1357	F1292-I1353 HydrophobicContact CE1-CG2 4.15Å; F1292-I1353 HydrophobicContact CZ-CG2 3.93Å; A1343-I1353 HydrophobicContact CB-CG2 4.24Å; S1351-I1353 PolarHBondContact O-N 3.32Å; S1351-I1353 PolarHBondContact OG-N 3.23Å; I1353-S1357 WeakPolarHBondContact O-CB 3.28Å; I1353-S1357 PolarHBondContact O-N 2.94Å
1354	F	92.6	Very high	89.6	Confident	38 Å²	38	56.8 Å²	56.8	17%	0.167	31%	0.314	C	S	.	.	H	α-helix	trans	-69.9	-50.7	173.1	-175.3	-77.6	0	0	0	110.2	Q1344 N1347 M1348 D1349 S1351 L1352 D1356 S1357 V1358	Q1344-F1354 HydrophobicContact CB-CD2 4.27Å; Q1344-F1354 HydrophobicContact CB-CE2 3.99Å; Q1344-F1354 HydrophobicContact CG-CD2 4.27Å; Q1344-F1354 HydrophobicContact CG-CE2 4.11Å; Q1344-F1354 HydrophobicContact CG-CZ 4.49Å; N1347-F1354 HydrophobicContact CB-CB 4.17Å; M1348-F1354 WeakPolarHBondContact O-CB 3.47Å; D1349-F1354 HydrophobicContact CB-CE1 4.49Å; D1349-F1354 HydrophobicContact CB-CE2 4.47Å; D1349-F1354 HydrophobicContact CB-CZ 4.28Å; D1349-F1354 VanDerWaalsContact OD1-CE2 3.24Å; D1349-F1354 WeakPolarHBondContact OD1-CE2 3.37Å; D1349-F1354 WeakPolarHBondContact OD1-CZ 3.47Å; S1351-F1354 WeakPolarHBondContact O-CA 3.18Å; S1351-F1354 VanDerWaalsContact O-CB 3.26Å; S1351-F1354 WeakPolarHBondContact O-CB 3.47Å; S1351-F1354 PolarHBondContact O-N 3.41Å; L1352-F1354 VanDerWaalsContact C-N 3.29Å; L1352-F1354 PolarHBondContact O-N 3.47Å; F1354-D1356 PolarHBondContact O-N 3.5Å; F1354-S1357 WeakPolarHBondContact O-CB 3.5Å; F1354-S1357 PolarHBondContact O-N 2.71Å; F1354-S1357 PolarHBondContact O-OG 2.83Å; F1354-V1358 HydrophobicContact CD1-CG2 4.33Å; F1354-V1358 HydrophobicContact CE1-CG2 4.1Å; F1354-V1358 PolarHBondContact O-N 3.05Å
1355	E	91	Very high	89.5	Confident	109 Å²	109	57.6 Å²	57.6	51%	0.509	32%	0.322	S	S	.	.	H	α-helix	trans	-60.5	-46.1	177.9	-64	-168.8	155.3	0	0	111.6	S1351 L1352 S1357 V1358 V1359	S1351-E1355 PolarHBondContact O-N 2.91Å; L1352-E1355 PolarHBondContact O-N 2.72Å; E1355-S1357 PolarHBondContact O-N 2.85Å; E1355-V1358 PolarHBondContact O-N 2.97Å; E1355-V1359 WeakPolarHBondContact O-CG2 3.33Å; E1355-V1359 PolarHBondContact O-N 3.45Å
1356	D	92.2	Very high	89.3	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.027	32%	0.318	C	S	.	.	H	α-helix	trans	-54	-41.5	175.2	-68.7	-6	0	0	0	111.8	R1286 L1288 F1292 L1352 F1354 V1358 V1359 L1360	R1286-D1356 IonicContact CZ-OD1 2.64Å; R1286-D1356 IonicContact CZ-OD2 3.35Å; R1286-D1356 IonicContact NH1-OD1 3.79Å; R1286-D1356 PolarHBondContact NH1-OD1 3.49Å; R1286-D1356 IonicContact NH1-OD2 2.9Å; R1286-D1356 PolarHBondContact NH1-OD2 3.14Å; R1286-D1356 IonicContact NH2-OD1 4Å; R1286-D1356 PolarHBondContact NH2-OD1 3.04Å; R1286-D1356 IonicContact NH2-OD2 3.28Å; L1288-D1356 HydrophobicContact CD2-CB 3.92Å; L1288-D1356 VanDerWaalsContact CD2-CG 3.46Å; L1288-D1356 WeakPolarHBondContact CD2-OD1 3.27Å; F1292-D1356 HydrophobicContact CE2-CB 3.79Å; F1292-D1356 HydrophobicContact CZ-CB 3.91Å; L1352-D1356 WeakPolarHBondContact O-CB 3.43Å; L1352-D1356 PolarHBondContact O-N 3.32Å; L1352-D1356 VanDerWaalsContact O-OD1 3.13Å; F1354-D1356 PolarHBondContact O-N 3.5Å; D1356-V1358 VanDerWaalsContact C-N 3.35Å; D1356-V1358 PolarHBondContact O-N 3.27Å; D1356-V1359 PolarHBondContact O-N 3.28Å; D1356-L1360 WeakPolarHBondContact O-CB 3.28Å; D1356-L1360 VanDerWaalsContact O-CG 3.27Å; D1356-L1360 WeakPolarHBondContact O-CG 3.12Å; D1356-L1360 PolarHBondContact O-N 3.1Å
1357	S	92.6	Very high	89	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-66.1	-35	179.4	81.3	0	0	0	0	113.1	C1340 Q1344 I1353 F1354 E1355 Q1361	C1340-S1357 PolarHBondContact SG-O 2.92Å; Q1344-S1357 WeakPolarHBondContact CG-OG 3.48Å; Q1344-S1357 PolarHBondContact NE2-OG 3.45Å; I1353-S1357 WeakPolarHBondContact O-CB 3.28Å; I1353-S1357 PolarHBondContact O-N 2.94Å; F1354-S1357 WeakPolarHBondContact O-CB 3.5Å; F1354-S1357 PolarHBondContact O-N 2.71Å; F1354-S1357 PolarHBondContact O-OG 2.83Å; E1355-S1357 PolarHBondContact O-N 2.85Å; S1357-Q1361 VanDerWaalsContact O-CB 3.3Å; S1357-Q1361 WeakPolarHBondContact O-CB 3.32Å; S1357-Q1361 PolarHBondContact O-N 3.23Å
1358	V	91.8	Very high	88.9	Confident	69 Å²	69	55.7 Å²	55.7	42%	0.418	31%	0.311	S	S	.	.	H	α-helix	trans	-73.1	-40.9	177.4	175.7	0	0	0	0	110	F1354 E1355 D1356 Q1361 S1362	F1354-V1358 HydrophobicContact CD1-CG2 4.33Å; F1354-V1358 HydrophobicContact CE1-CG2 4.1Å; F1354-V1358 PolarHBondContact O-N 3.05Å; E1355-V1358 PolarHBondContact O-N 2.97Å; D1356-V1358 VanDerWaalsContact C-N 3.35Å; D1356-V1358 PolarHBondContact O-N 3.27Å; V1358-Q1361 PolarHBondContact O-N 2.82Å; V1358-S1362 PolarHBondContact O-N 3.4Å
1359	V	91.3	Very high	88.9	Confident	46 Å²	46	54.2 Å²	54.2	28%	0.279	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-51.2	173.8	179.4	0	0	0	0	110.4	Y1280 L1288 E1355 D1356 Q1361 S1362 V1363	Y1280-V1359 HydrophobicContact CD1-CG1 4.49Å; Y1280-V1359 HydrophobicContact CE1-CG1 3.76Å; L1288-V1359 HydrophobicContact CD1-CB 4.38Å; L1288-V1359 HydrophobicContact CD1-CG1 3.67Å; E1355-V1359 WeakPolarHBondContact O-CG2 3.33Å; E1355-V1359 PolarHBondContact O-N 3.45Å; D1356-V1359 PolarHBondContact O-N 3.28Å; V1359-Q1361 VanDerWaalsContact C-N 3.28Å; V1359-Q1361 PolarHBondContact O-N 2.79Å; V1359-S1362 PolarHBondContact O-N 3.46Å; V1359-S1362 PolarHBondContact O-OG 3.04Å; V1359-V1363 HydrophobicContact CG1-CG2 4.31Å; V1359-V1363 WeakPolarHBondContact O-CG2 3.36Å; V1359-V1363 PolarHBondContact O-N 2.78Å
1360	L	91.6	Very high	88.8	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-56.5	-39.6	176.8	-73.6	168.3	0	0	0	112.7	V1277 L1288 F1292 F1314 D1356 V1363 W1364	V1277-L1360 HydrophobicContact CG1-CD2 3.8Å; L1288-L1360 HydrophobicContact CB-CD2 4.12Å; L1288-L1360 HydrophobicContact CB-CG 4.31Å; F1292-L1360 HydrophobicContact CD2-CD1 3.69Å; F1292-L1360 HydrophobicContact CE2-CD1 3.58Å; F1292-L1360 HydrophobicContact CG-CD1 4.25Å; F1292-L1360 HydrophobicContact CZ-CD1 4.02Å; F1314-L1360 HydrophobicContact CE2-CD1 4.39Å; D1356-L1360 WeakPolarHBondContact O-CB 3.28Å; D1356-L1360 VanDerWaalsContact O-CG 3.27Å; D1356-L1360 WeakPolarHBondContact O-CG 3.12Å; D1356-L1360 PolarHBondContact O-N 3.1Å; L1360-V1363 PolarHBondContact O-N 3.15Å; L1360-W1364 PolarHBondContact O-N 2.87Å
1361	Q	91	Very high	88.5	Confident	70 Å²	70	54 Å²	54	33%	0.327	28%	0.276	S	S	.	.	H	α-helix	trans	-62.4	-41.4	175.1	-175.1	172.7	2.2	0	0	111.9	L1337 C1340 Q1344 S1357 V1358 V1359 W1364 T1365	L1337-Q1361 HydrophobicContact CD2-CG 3.91Å; C1340-Q1361 HydrophobicContact CB-CB 4.43Å; Q1344-Q1361 VanDerWaalsContact NE2-OE1 3.14Å; S1357-Q1361 VanDerWaalsContact O-CB 3.3Å; S1357-Q1361 WeakPolarHBondContact O-CB 3.32Å; S1357-Q1361 PolarHBondContact O-N 3.23Å; V1358-Q1361 PolarHBondContact O-N 2.82Å; V1359-Q1361 VanDerWaalsContact C-N 3.28Å; V1359-Q1361 PolarHBondContact O-N 2.79Å; Q1361-W1364 PolarHBondContact O-N 3.45Å; Q1361-T1365 PolarHBondContact O-N 3.08Å; Q1361-T1365 PolarHBondContact O-OG1 3.46Å
1362	S	90.4	Very high	87.9	Confident	54 Å²	54	56.6 Å²	56.6	38%	0.378	28%	0.284	S	S	.	.	H	α-helix	trans	-70.6	-31.4	176.2	78.2	0	0	0	0	113.5	V1358 V1359 T1365 N1366	V1358-S1362 PolarHBondContact O-N 3.4Å; V1359-S1362 PolarHBondContact O-N 3.46Å; V1359-S1362 PolarHBondContact O-OG 3.04Å; S1362-T1365 PolarHBondContact O-OG1 2.8Å; S1362-N1366 PolarHBondContact O-N 3.19Å; S1362-N1366 PolarHBondContact O-ND2 3.19Å
1363	V	90.7	Very high	87.2	Confident	12 Å²	12	56 Å²	56	7%	0.073	28%	0.278	C	S	.	.	H	α-helix	trans	-68.3	-42	175.2	172.8	0	0	0	0	110.3	V1277 Y1280 V1359 L1360 N1366 A1367	V1277-V1363 HydrophobicContact CG2-CG1 4.29Å; Y1280-V1363 HydrophobicContact CD1-CG2 3.62Å; Y1280-V1363 HydrophobicContact CD2-CB 4.49Å; Y1280-V1363 HydrophobicContact CD2-CG1 3.82Å; Y1280-V1363 HydrophobicContact CD2-CG2 3.75Å; Y1280-V1363 HydrophobicContact CE1-CG2 3.54Å; Y1280-V1363 HydrophobicContact CE2-CG1 4.41Å; Y1280-V1363 HydrophobicContact CE2-CG2 3.67Å; Y1280-V1363 HydrophobicContact CG-CB 4.44Å; Y1280-V1363 HydrophobicContact CG-CG1 3.92Å; Y1280-V1363 HydrophobicContact CG-CG2 3.73Å; V1359-V1363 HydrophobicContact CG1-CG2 4.31Å; V1359-V1363 WeakPolarHBondContact O-CG2 3.36Å; V1359-V1363 PolarHBondContact O-N 2.78Å; L1360-V1363 PolarHBondContact O-N 3.15Å; V1363-N1366 PolarHBondContact O-N 3.11Å; V1363-A1367 VanDerWaalsContact O-CB 3.28Å; V1363-A1367 WeakPolarHBondContact O-CB 3.47Å; V1363-A1367 PolarHBondContact O-N 3.02Å
1364	W	92.6	Very high	86.1	Confident	1 Å²	1	57.1 Å²	57.1	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-58.3	-49.5	175.3	172.8	-95.4	0	0	0	112.2	L1273 V1277 V1329 L1332 E1333 I1336 L1360 Q1361 N1366 A1367 R1368	L1273-W1364 HydrophobicContact CB-CH2 4.05Å; L1273-W1364 HydrophobicContact CB-CZ3 3.73Å; L1273-W1364 HydrophobicContact CD1-CH2 4.03Å; L1273-W1364 HydrophobicContact CG-CH2 4.48Å; L1273-W1364 HydrophobicContact CG-CZ3 4.48Å; V1277-W1364 HydrophobicContact CG2-CB 4.33Å; V1277-W1364 HydrophobicContact CG2-CE3 4.03Å; V1329-W1364 HydrophobicContact CG1-CH2 4.27Å; V1329-W1364 HydrophobicContact CG1-CZ2 4.05Å; L1332-W1364 HydrophobicContact CB-CH2 4.44Å; L1332-W1364 HydrophobicContact CD2-CH2 3.81Å; L1332-W1364 HydrophobicContact CD2-CZ3 4.08Å; L1332-W1364 HydrophobicContact CG-CH2 3.82Å; L1332-W1364 HydrophobicContact CG-CZ3 4.2Å; E1333-W1364 HydrophobicContact CB-CZ2 3.71Å; E1333-W1364 HydrophobicContact CG-CZ2 4.34Å; E1333-W1364 PolarHBondContact OE1-NE1 2.98Å; I1336-W1364 HydrophobicContact CD1-CD2 4.2Å; I1336-W1364 HydrophobicContact CD1-CE3 3.44Å; I1336-W1364 VanDerWaalsContact CD1-CE3 3.44Å; I1336-W1364 HydrophobicContact CD1-CH2 4.06Å; I1336-W1364 HydrophobicContact CD1-CZ3 3.34Å; I1336-W1364 HydrophobicContact CG2-CB 4.43Å; I1336-W1364 HydrophobicContact CG2-CD2 4.38Å; I1336-W1364 HydrophobicContact CG2-CE3 4.45Å; I1336-W1364 HydrophobicContact CG2-CG 4.34Å; L1360-W1364 PolarHBondContact O-N 2.87Å; Q1361-W1364 PolarHBondContact O-N 3.45Å; W1364-N1366 PolarHBondContact O-N 2.77Å; W1364-A1367 PolarHBondContact O-N 3.42Å; W1364-R1368 PolarHBondContact O-N 2.87Å
1365	T	88.9	Confident	84.6	Confident	69 Å²	69	59 Å²	59	42%	0.423	29%	0.293	S	S	.	.	H	α-helix	trans	-63.1	-43.4	-179.9	47.2	0	0	0	0	112.1	Q1361 S1362 A1367 R1368 E1369	Q1361-T1365 PolarHBondContact O-N 3.08Å; Q1361-T1365 PolarHBondContact O-OG1 3.46Å; S1362-T1365 PolarHBondContact O-OG1 2.8Å; T1365-A1367 VanDerWaalsContact C-N 3.33Å; T1365-A1367 PolarHBondContact O-N 3.26Å; T1365-R1368 PolarHBondContact O-N 3.36Å; T1365-E1369 WeakPolarHBondContact O-CB 3.42Å; T1365-E1369 PolarHBondContact O-N 3.35Å
1366	N	87.5	Confident	83	Confident	76 Å²	76	57.1 Å²	57.1	41%	0.406	29%	0.292	S	S	.	.	H	α-helix	trans	-62.5	-37.1	174.8	-84.9	-92.4	0	0	0	112.7	S1362 V1363 W1364 R1370	S1362-N1366 PolarHBondContact O-N 3.19Å; S1362-N1366 PolarHBondContact O-ND2 3.19Å; V1363-N1366 PolarHBondContact O-N 3.11Å; W1364-N1366 PolarHBondContact O-N 2.77Å; N1366-R1370 WeakPolarHBondContact O-CG 3.39Å; N1366-R1370 PolarHBondContact O-N 3.27Å
1367	A	85.6	Confident	81.2	Confident	12 Å²	12	64.6 Å²	64.6	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-70.8	-36.7	178.1	0	0	0	0	0	112.3	L1273 I1276 V1363 W1364 T1365 L1371	L1273-A1367 HydrophobicContact CD2-CB 4.03Å; I1276-A1367 HydrophobicContact CG2-CB 3.82Å; V1363-A1367 VanDerWaalsContact O-CB 3.28Å; V1363-A1367 WeakPolarHBondContact O-CB 3.47Å; V1363-A1367 PolarHBondContact O-N 3.02Å; W1364-A1367 PolarHBondContact O-N 3.42Å; T1365-A1367 VanDerWaalsContact C-N 3.33Å; T1365-A1367 PolarHBondContact O-N 3.26Å; A1367-L1371 PolarHBondContact O-N 3.05Å
1368	R	86.1	Confident	79	Confident	50 Å²	50	71.4 Å²	71.4	19%	0.189	35%	0.352	C	S	.	.	H	α-helix	trans	-65.3	-53.3	173.7	-178.4	178.8	-178.6	143.9	8.4	111.4	D1330 E1333 W1364 T1365 R1370 L1371 E1372	D1330-R1368 IonicContact OD1-CZ 3.79Å; D1330-R1368 IonicContact OD1-NH1 2.83Å; D1330-R1368 PolarHBondContact OD1-NH1 3.11Å; D1330-R1368 IonicContact OD1-NH2 3.72Å; D1330-R1368 PolarHBondContact OD1-NH2 2.83Å; E1333-R1368 WeakPolarHBondContact OE1-CD 3.49Å; E1333-R1368 IonicContact OE1-CZ 2.61Å; E1333-R1368 IonicContact OE1-NH1 2.96Å; E1333-R1368 PolarHBondContact OE1-NH1 3.16Å; E1333-R1368 IonicContact OE2-NH1 3.69Å; E1333-R1368 PolarHBondContact OE2-NH1 3.42Å; W1364-R1368 PolarHBondContact O-N 2.87Å; T1365-R1368 PolarHBondContact O-N 3.36Å; R1368-R1370 PolarHBondContact O-N 3.38Å; R1368-L1371 WeakPolarHBondContact O-CA 3.37Å; R1368-L1371 WeakPolarHBondContact O-CB 3.44Å; R1368-L1371 PolarHBondContact O-N 3.11Å; R1368-E1372 WeakPolarHBondContact CG-OE1 3.19Å; R1368-E1372 IonicContact CZ-OE1 3.89Å; R1368-E1372 IonicContact NE-OE1 3.35Å; R1368-E1372 PolarHBondContact NE-OE1 2.98Å; R1368-E1372 IonicContact NH2-OE1 2.66Å; R1368-E1372 PolarHBondContact NH2-OE1 3.14Å; R1368-E1372 PolarHBondContact O-N 3.2Å
1369	E	84.1	Confident	76.6	Confident	127 Å²	127	73.2 Å²	73.2	59%	0.593	36%	0.356	S	S	*	.	H	α-helix	trans	-58.7	-44.8	-175	-170.7	168.9	-145	0	0	111.9	T1365 L1371 E1372 E1373	T1365-E1369 WeakPolarHBondContact O-CB 3.42Å; T1365-E1369 PolarHBondContact O-N 3.35Å; E1369-L1371 VanDerWaalsContact C-N 3.28Å; E1369-L1371 PolarHBondContact O-N 3.41Å; E1369-E1372 PolarHBondContact O-N 3.39Å; E1369-E1372 VanDerWaalsContact O-N 3.15Å; E1369-E1373 PolarHBondContact O-N 3.14Å
1370	R	79.4	Confident	74.2	Confident	159 Å²	159	74.1 Å²	74.1	60%	0.6	36%	0.364	S	S	*	.	H	α-helix	trans	-62.1	-30.6	174.2	-72.7	176.5	178.8	163.8	3.2	113.9	N1366 R1368 I1374	N1366-R1370 WeakPolarHBondContact O-CG 3.39Å; N1366-R1370 PolarHBondContact O-N 3.27Å; R1368-R1370 PolarHBondContact O-N 3.38Å; R1370-I1374 WeakPolarHBondContact O-CD1 3.35Å; R1370-I1374 VanDerWaalsContact O-CG1 3.26Å; R1370-I1374 WeakPolarHBondContact O-CG1 3.4Å; R1370-I1374 PolarHBondContact O-N 3.38Å; R1370-I1374 VanDerWaalsContact O-N 3.14Å
1371	L	74	Confident	71.7	Confident	31 Å²	31	81.3 Å²	81.3	16%	0.162	40%	0.403	C	S	.	.	H	α-helix	trans	-75.5	-33.6	176.3	-109.1	163.1	0	0	0	111.8	L1273 A1367 R1368 E1369 I1374 E1375	L1273-L1371 HydrophobicContact CD1-CD1 4.21Å; L1273-L1371 HydrophobicContact CD2-CD1 3.6Å; L1273-L1371 HydrophobicContact CG-CD1 3.63Å; A1367-L1371 PolarHBondContact O-N 3.05Å; R1368-L1371 WeakPolarHBondContact O-CA 3.37Å; R1368-L1371 WeakPolarHBondContact O-CB 3.44Å; R1368-L1371 PolarHBondContact O-N 3.11Å; E1369-L1371 VanDerWaalsContact C-N 3.28Å; E1369-L1371 PolarHBondContact O-N 3.41Å; L1371-I1374 PolarHBondContact O-N 3.16Å; L1371-E1375 PolarHBondContact O-N 3.38Å
1372	E	74.4	Confident	69	Low	90 Å²	90	82.4 Å²	82.4	42%	0.421	42%	0.418	S	S	.	.	H	α-helix	trans	-72.6	-33.9	173.1	-65.5	179.2	-170.3	0	0	111.5	R1368 E1369 S1376	R1368-E1372 WeakPolarHBondContact CG-OE1 3.19Å; R1368-E1372 IonicContact CZ-OE1 3.89Å; R1368-E1372 IonicContact NE-OE1 3.35Å; R1368-E1372 PolarHBondContact NE-OE1 2.98Å; R1368-E1372 IonicContact NH2-OE1 2.66Å; R1368-E1372 PolarHBondContact NH2-OE1 3.14Å; R1368-E1372 PolarHBondContact O-N 3.2Å; E1369-E1372 PolarHBondContact O-N 3.39Å; E1369-E1372 VanDerWaalsContact O-N 3.15Å; E1372-S1376 WeakPolarHBondContact O-CB 3.45Å; E1372-S1376 PolarHBondContact O-N 3.09Å; E1372-S1376 PolarHBondContact O-OG 3.34Å
1373	E	72.9	Confident	66.2	Low	91 Å²	91	88.6 Å²	88.6	43%	0.425	43%	0.433	S	S	.	.	H	α-helix	trans	-61	-42.2	166.9	-80.7	-155.2	99.9	0	0	113	E1369 S1376 R1377	E1369-E1373 PolarHBondContact O-N 3.14Å; E1373-S1376 WeakPolarHBondContact CA-OG 3.49Å; E1373-S1376 PolarHBondContact O-OG 3.26Å; E1373-R1377 WeakPolarHBondContact O-CB 3.41Å; E1373-R1377 VanDerWaalsContact O-CG 3.27Å; E1373-R1377 WeakPolarHBondContact O-CG 3.49Å; E1373-R1377 PolarHBondContact O-N 3.4Å; E1373-R1377 IonicContact OE1-NH2 3.1Å; E1373-R1377 PolarHBondContact OE1-NH2 3Å
1374	I	67.2	Low	63.4	Low	89 Å²	89	97.3 Å²	97.3	46%	0.456	47%	0.473	S	S	.	.	H	α-helix	trans	-70.8	-41.9	-179.3	-70.2	165	0	0	0	111	R1370 L1371 S1376 R1377 Q1378	R1370-I1374 WeakPolarHBondContact O-CD1 3.35Å; R1370-I1374 VanDerWaalsContact O-CG1 3.26Å; R1370-I1374 WeakPolarHBondContact O-CG1 3.4Å; R1370-I1374 PolarHBondContact O-N 3.38Å; R1370-I1374 VanDerWaalsContact O-N 3.14Å; L1371-I1374 PolarHBondContact O-N 3.16Å; I1374-S1376 VanDerWaalsContact C-N 3.34Å; I1374-R1377 PolarHBondContact O-N 3.36Å; I1374-Q1378 WeakPolarHBondContact O-CG 3.4Å; I1374-Q1378 PolarHBondContact O-N 3.12Å
1375	E	60.9	Low	60.4	Low	78 Å²	78	102.3 Å²	102.3	36%	0.364	51%	0.509	S	S	.	.	H	α-helix	trans	-69.1	-30.4	177.2	-75.8	179.1	177.4	0	0	112.9	K1269 L1371 Q1379	K1269-E1375 WeakPolarHBondContact CD-OE1 3.33Å; K1269-E1375 VanDerWaalsContact CE-OE1 3.3Å; K1269-E1375 WeakPolarHBondContact CE-OE1 3.43Å; K1269-E1375 IonicContact NZ-OE1 3.28Å; K1269-E1375 PolarHBondContact NZ-OE1 2.98Å; K1269-E1375 IonicContact NZ-OE2 3.65Å; K1269-E1375 PolarHBondContact NZ-OE2 3.43Å; L1371-E1375 PolarHBondContact O-N 3.38Å; E1375-Q1379 WeakPolarHBondContact O-CG 3.19Å
1376	S	57.5	Low	57.5	Low	70 Å²	70	104.3 Å²	104.3	49%	0.49	53%	0.525	S	S	.	.	H	α-helix	trans	-75.3	-38.9	174.3	52.3	0	0	0	0	112.8	E1372 E1373 I1374 Q1379 S1380	E1372-S1376 WeakPolarHBondContact O-CB 3.45Å; E1372-S1376 PolarHBondContact O-N 3.09Å; E1372-S1376 PolarHBondContact O-OG 3.34Å; E1373-S1376 WeakPolarHBondContact CA-OG 3.49Å; E1373-S1376 PolarHBondContact O-OG 3.26Å; I1374-S1376 VanDerWaalsContact C-N 3.34Å; S1376-Q1379 PolarHBondContact O-N 3.38Å; S1376-Q1379 VanDerWaalsContact O-N 3.11Å; S1376-S1380 PolarHBondContact O-N 2.85Å
1377	R	54.5	Low	54.7	Low	161 Å²	161	109.6 Å²	109.6	61%	0.608	55%	0.547	S	S	*	.	H	α-helix	trans	-64	-37.6	172.2	-71	173.4	-168.4	-126.2	7.4	112.7	E1373 I1374 Q1379 S1380	E1373-R1377 WeakPolarHBondContact O-CB 3.41Å; E1373-R1377 VanDerWaalsContact O-CG 3.27Å; E1373-R1377 WeakPolarHBondContact O-CG 3.49Å; E1373-R1377 PolarHBondContact O-N 3.4Å; E1373-R1377 IonicContact OE1-NH2 3.1Å; E1373-R1377 PolarHBondContact OE1-NH2 3Å; I1374-R1377 PolarHBondContact O-N 3.36Å; R1377-Q1379 PolarHBondContact O-N 3.44Å; R1377-S1380 PolarHBondContact O-N 3Å; R1377-S1380 PolarHBondContact O-OG 3Å
1378	Q	46.9	Very low	52	Low	143 Å²	143	120.1 Å²	120.1	67%	0.668	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-11.3	174.5	-70.5	179.2	12.6	0	0	113.6	I1374	I1374-Q1378 WeakPolarHBondContact O-CG 3.4Å; I1374-Q1378 PolarHBondContact O-N 3.12Å
1379	Q	40.8	Very low	49.3	Very low	107 Å²	107	124.9 Å²	124.9	50%	0.5	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.8	-7.2	173.1	-71.1	-178.2	40.3	0	0	114.5	E1375 S1376 R1377 R1383	E1375-Q1379 WeakPolarHBondContact O-CG 3.19Å; S1376-Q1379 PolarHBondContact O-N 3.38Å; S1376-Q1379 VanDerWaalsContact O-N 3.11Å; R1377-Q1379 PolarHBondContact O-N 3.44Å; Q1379-R1383 WeakPolarHBondContact O-CD 3.43Å; Q1379-R1383 WeakPolarHBondContact O-CG 3.46Å; Q1379-R1383 PolarHBondContact O-NE 3.34Å
1380	S	40.5	Very low	46.5	Very low	66 Å²	66	122.9 Å²	122.9	46%	0.462	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.5	-38.9	176.1	52.9	0	0	0	0	112.9	S1376 R1377 S1382	S1376-S1380 PolarHBondContact O-N 2.85Å; R1377-S1380 PolarHBondContact O-N 3Å; R1377-S1380 PolarHBondContact O-OG 3Å; S1380-S1382 PolarHBondContact O-N 3.3Å; S1380-S1382 VanDerWaalsContact O-N 3.1Å
1381	D	40.1	Very low	44	Very low	152 Å²	152	125.6 Å²	125.6	81%	0.813	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	3.9	-167.8	-62.7	-5.8	0	0	0	114.4
1382	S	34.8	Very low	41.7	Very low	93 Å²	93	129 Å²	129	65%	0.65	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	10.3	-177.5	47.7	0	0	0	0	114.4	S1380	S1380-S1382 PolarHBondContact O-N 3.3Å; S1380-S1382 VanDerWaalsContact O-N 3.1Å
1383	R	31.3	Very low	39.4	Very low	183 Å²	183	130.1 Å²	130.1	69%	0.691	67%	0.672	S	S	*	*			trans	-103.7	19.5	-168.6	-64.8	-172.2	-178.2	-166	-1	116.6	Q1379	Q1379-R1383 WeakPolarHBondContact O-CD 3.43Å; Q1379-R1383 WeakPolarHBondContact O-CG 3.46Å; Q1379-R1383 PolarHBondContact O-NE 3.34Å
1384	Q	31.7	Very low	37.1	Very low	195 Å²	195	134 Å²	134	91%	0.911	69%	0.69	S	S	*	*			trans	-105.8	60.9	178	-67.2	-166.6	10.4	0	0	114.3
1385	S	29.8	Very low	35.1	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	71%	0.708	S	S	*	*	S	Bend	trans	-168.3	139.2	154.2	6	0	0	0	0	112.1
1386	S	27.7	Very low	33.3	Very low	111 Å²	111	146.3 Å²	146.3	78%	0.776	74%	0.735	S	S	*	*			trans	20.1	105.9	159.4	53.4	0	0	0	0	117.6
1387	Q	29.6	Very low	31.7	Very low	186 Å²	186	150.6 Å²	150.6	87%	0.869	75%	0.746	S	S	*	*			cis	62.2	80.7	30.9	-160.9	-174	48.7	0	0	114.7
1388	Y	28.6	Very low	30.3	Very low	234 Å²	234	147.9 Å²	147.9	92%	0.918	75%	0.747	S	S	*	*			trans	-148.2	165.8	147.1	-115.3	-81.2	0	0	0	111.1
1389	N	28.4	Very low	29.4	Very low	150 Å²	150	146.7 Å²	146.7	80%	0.802	75%	0.75	S	S	*	*			trans	-88.4	123.2	-154.2	-93.8	-39.6	0	0	0	117.3
1390	S	25.9	Very low	28.9	Very low	85 Å²	85	147.8 Å²	147.8	59%	0.594	76%	0.758	S	S	*	*				60.6	147.4	108.9	-150.3	0	0	0	0	122.7
1391	Y	26.4	Very low	28.3	Very low	215 Å²	215	150.7 Å²	150.7	84%	0.843	77%	0.768	S	S	*	*			trans	71.3	109.8	169.5	-65.6	-69	0	0	0	120.3
1392	S	26.5	Very low	28	Very low	103 Å²	103	149.8 Å²	149.8	72%	0.72	76%	0.764	S	S	*	*			trans	68.8	56.5	143.5	-157.1	0	0	0	0	118.2	Q1394	S1392-Q1394 PolarHBondContact O-NE2 3.42Å
1393	S	26.2	Very low	27.8	Very low	114 Å²	114	153.3 Å²	153.3	80%	0.797	77%	0.77	S	S	*	*			trans	-84.7	132.9	162.3	-59.5	0	0	0	0	109.8
1394	Q	24.7	Very low	27.8	Very low	171 Å²	171	152.2 Å²	152.2	80%	0.799	78%	0.778	S	S	*	*			cis	70.4	110.7	38.9	-54.2	174.1	60.4	0	0	111.2	S1392	S1392-Q1394 PolarHBondContact O-NE2 3.42Å
1395	H	25.3	Very low	27.8	Very low	181 Å²	181	150.6 Å²	150.6	84%	0.838	78%	0.775	S	S	*	*			cis	86.8	41	19	-149.2	-47.3	0	0	0	116.2
1396	R	21.7	Very low	27.8	Very low	246 Å²	246	153.5 Å²	153.5	93%	0.928	78%	0.777	S	S	*	*			trans	-172	161.4	160.6	-101.3	158.5	-164.1	-152.8	3.7	106.4
1397	H	24.5	Very low	27.8	Very low	159 Å²	159	156.3 Å²	156.3	74%	0.736	78%	0.778	S	S	*	*			cis	156.6	122.6	-12.6	164	-92.4	0	0	0	105.4
1398	V	25.5	Very low	27.6	Very low	104 Å²	104	154.4 Å²	154.4	63%	0.63	77%	0.774	S	S	*	*			trans	83.1	119	157	146	0	0	0	0	120.8
1399	T	26.9	Very low	27.6	Very low	119 Å²	119	151 Å²	151	73%	0.73	77%	0.766	S	S	*	*			trans	69.1	155.4	144.8	63.1	0	0	0	0	119.5
1400	I	30.8	Very low	27.7	Very low	130 Å²	130	149.1 Å²	149.1	67%	0.667	75%	0.752	S	S	*	*			cis	-156.7	158.9	11	-137.9	157.4	0	0	0	111.7
1401	D	27.7	Very low	27.8	Very low	126 Å²	126	149.5 Å²	149.5	67%	0.674	75%	0.748	S	S	*	*			trans	58.5	156.3	156.8	-54.5	-19.2	0	0	0	120
1402	D	33.2	Very low	27.9	Very low	133 Å²	133	145 Å²	145	71%	0.711	74%	0.738	S	S	*	*			cis	-144.8	162.5	7.4	-94.2	-45	0	0	0	112.8
1403	E	31.9	Very low	27.9	Very low	167 Å²	167	145.1 Å²	145.1	78%	0.78	73%	0.728	S	S	*	*			trans	10.5	143.5	146.6	-57.2	174.2	157.4	0	0	121.3
1404	D	31.5	Very low	28	Very low	160 Å²	160	144.9 Å²	144.9	86%	0.856	72%	0.717	S	S	*	*			cis	-113.2	-122.5	5.6	-65.6	-73.1	0	0	0	114.5
1405	D	31.4	Very low	28.4	Very low	161 Å²	161	144.3 Å²	144.3	86%	0.861	72%	0.715	S	S	*	*			cis	-149.5	174.9	18	-170.9	7.5	0	0	0	111
1406	E	30.1	Very low	28.5	Very low	169 Å²	169	141.2 Å²	141.2	79%	0.79	71%	0.711	S	S	*	*			trans	-83.3	146.8	-164.4	-84.6	-179.4	163.4	0	0	120.3
1407	E	26.7	Very low	28.7	Very low	170 Å²	170	133.3 Å²	133.3	79%	0.794	69%	0.693	S	S	*	*			trans	75.7	124.8	148	-70.1	-171.2	166.7	0	0	126
1408	D	26.3	Very low	28.7	Very low	145 Å²	145	134 Å²	134	78%	0.775	70%	0.697	S	S	*	*			trans	72.9	97.6	148.5	-80	11.9	0	0	0	125.2
1409	E	29.1	Very low	28.7	Very low	162 Å²	162	135.7 Å²	135.7	76%	0.757	71%	0.707	S	S	*	*			trans	55.8	123.5	142.6	-65.4	-158.5	156.5	0	0	122
1410	Q	28.9	Very low	28.7	Very low	111 Å²	111	134.7 Å²	134.7	52%	0.519	71%	0.705	S	S	.	*				144.3	158.5	109.9	-175.6	166.5	114	0	0	112.8	P1246	P1246-Q1410 VanDerWaalsContact CB-O 3.25Å; P1246-Q1410 WeakPolarHBondContact CB-O 3.49Å; P1246-Q1410 WeakPolarHBondContact CD-O 3.44Å; P1246-Q1410 HydrophobicContact CG-CB 3.89Å; P1246-Q1410 WeakPolarHBondContact CG-O 3.45Å
1411	D	29.4	Very low	28.5	Very low	93 Å²	93	135.3 Å²	135.3	50%	0.497	70%	0.703	S	S	.	*			trans	37.4	113.2	174.4	-56.6	-13.6	0	0	0	119.8	H1247	H1247-D1411 CarbonylContact C-O 3.59Å; H1247-D1411 WeakPolarHBondContact CA-O 3.4Å; H1247-D1411 VanDerWaalsContact CB-O 3.29Å; H1247-D1411 WeakPolarHBondContact CB-O 3.43Å; H1247-D1411 PolarHBondContact N-O 3.05Å; H1247-D1411 CarbonylContact O-C 3.45Å; H1247-D1411 VanDerWaalsContact O-CB 3.26Å; H1247-D1411 WeakPolarHBondContact O-CB 3.5Å
1412	D	27	Very low	28.5	Very low	121 Å²	121	138.2 Å²	138.2	65%	0.647	71%	0.712	S	S	*	*			trans	-150.4	168.3	160.7	-103.5	-29.4	0	0	0	110.6	H1247 G1248	H1247-D1412 WeakPolarHBondContact CB-OD1 3.47Å; G1248-D1412 WeakPolarHBondContact CA-OD1 3.3Å; G1248-D1412 PolarHBondContact N-OD1 2.96Å
1413	E	27.9	Very low	28.3	Very low	105 Å²	105	136.3 Å²	136.3	49%	0.491	72%	0.715	S	S	.	*			trans	-109.5	159.5	-164.1	-63.1	170.9	-131.5	0	0	116.9	G1248 S1249 S1250	G1248-E1413 VanDerWaalsContact C-CG 3.41Å; G1248-E1413 WeakPolarHBondContact CA-OE1 3.31Å; G1248-E1413 PolarHBondContact N-OE1 3.44Å; G1248-E1413 WeakPolarHBondContact O-CB 3.17Å; G1248-E1413 VanDerWaalsContact O-CG 3.31Å; G1248-E1413 WeakPolarHBondContact O-CG 3.47Å; G1248-E1413 PolarHBondContact O-N 3.36Å; S1249-E1413 VanDerWaalsContact N-CD 3.3Å; S1249-E1413 PolarHBondContact N-OE1 3.1Å; S1250-E1413 VanDerWaalsContact N-CD 3.34Å; S1250-E1413 PolarHBondContact N-OE2 2.94Å
1414	D	27.8	Very low	28.6	Very low	109 Å²	109	133.6 Å²	133.6	58%	0.583	71%	0.712	S	S	*	*			trans	68.3	168	152.3	-84.8	-13.2	0	0	0	125.2	T1251	T1251-D1414 PolarHBondContact N-OD2 3.42Å
1415	E	32.1	Very low	28.6	Very low	160 Å²	160	133.9 Å²	133.9	75%	0.748	71%	0.712	S	S	*	*			trans	-51.6	151.7	-167.9	-92.5	-105.9	163.9	0	0	118.1	S1417	E1415-S1417 PolarHBondContact OE2-N 3.28Å
1416	P	28.2	Very low	28.6	Very low	115 Å²	115	130.2 Å²	130.2	75%	0.747	70%	0.699	S	S	*	*				-145.8	132.1	94.6	37.4	-21.4	0	0	0	118.3
1417	S	25.9	Very low	28.7	Very low	80 Å²	80	128.1 Å²	128.1	56%	0.559	70%	0.697	S	S	*	*			trans	25.5	130.9	130.1	71.1	0	0	0	0	122.7	E1415	E1415-S1417 PolarHBondContact OE2-N 3.28Å
1418	E	24.3	Very low	29.5	Very low	175 Å²	175	123.9 Å²	123.9	82%	0.818	70%	0.699	S	S	*	*			trans	73	129.4	143.2	-68.2	-167.6	173.8	0	0	122.3
1419	T	26	Very low	30.1	Very low	138 Å²	138	120.5 Å²	120.5	85%	0.847	69%	0.686	S	S	*	*			trans	67.8	154.4	167.5	73.1	0	0	0	0	118
1420	S	26.2	Very low	30	Very low	98 Å²	98	121.5 Å²	121.5	69%	0.685	68%	0.682	S	S	*	*			cis	-155.9	174.2	-39.4	72.5	0	0	0	0	110.9
1421	K	25.9	Very low	30.1	Very low	144 Å²	144	127 Å²	127	63%	0.626	70%	0.7	S	S	*	*			trans	42.3	118.3	157	-68.3	-176.9	178.4	178.3	0	121.3	D1440	K1421-D1440 IonicContact NZ-OD1 3.65Å; K1421-D1440 PolarHBondContact NZ-OD1 3.06Å
1422	H	29.3	Very low	30.2	Very low	186 Å²	186	127.3 Å²	127.3	86%	0.861	71%	0.705	S	S	*	*				53.1	141.9	127.1	-75.2	-95.4	0	0	0	124.6
1423	A	27.7	Very low	30.5	Very low	94 Å²	94	125.5 Å²	125.5	78%	0.777	70%	0.698	S	S	*	*			trans	95	155.2	143.7	0	0	0	0	0	120
1424	P	38.9	Very low	30.8	Very low	110 Å²	110	124.4 Å²	124.4	71%	0.714	70%	0.701	S	S	*	*			trans	-117.7	-154.1	-174.9	37.7	-17.4	0	0	0	112
1425	I	31.9	Very low	31.1	Very low	165 Å²	165	125.7 Å²	125.7	85%	0.846	71%	0.708	S	S	*	*			trans	74.4	143.7	171.9	-62.5	163.9	0	0	0	113.2
1426	S	32	Very low	31.5	Very low	84 Å²	84	123.7 Å²	123.7	59%	0.587	71%	0.707	S	S	*	*			cis	-170.7	162.5	-22.4	179.5	0	0	0	0	109.6
1427	T	30.7	Very low	31.8	Very low	125 Å²	125	123.4 Å²	123.4	77%	0.767	71%	0.708	S	S	*	*			trans	42.4	89.6	150.4	46	0	0	0	0	120.2
1428	G	43.1	Very low	32.2	Very low	81 Å²	81	123.9 Å²	123.9	84%	0.835	72%	0.716	S	S	*	*			trans	47.5	-139.4	147.3	0	0	0	0	0	116.9
1429	P	39.1	Very low	32.8	Very low	75 Å²	75	122.2 Å²	122.2	49%	0.487	72%	0.718	S	S	.	*			cis	-120.2	145.4	-34.2	35.3	-24.5	0	0	0	111.4
1430	R	26.8	Very low	32.9	Very low	182 Å²	182	120.9 Å²	120.9	69%	0.687	71%	0.706	S	S	*	*	S	Bend	trans	-157.6	127.8	149.4	-106.5	-104.5	157.1	67.3	-9.4	110.5	V1433	R1430-V1433 VanDerWaalsContact CZ-N 3.28Å; R1430-V1433 VanDerWaalsContact NH2-CG2 3.28Å
1431	Y	31.3	Very low	33.3	Very low	228 Å²	228	123 Å²	123	89%	0.894	71%	0.714	S	S	*	*	S	Bend	cis	-37.3	119.1	5.2	-77.2	-93	0	0	0	117.1
1432	V	32.4	Very low	33.5	Very low	98 Å²	98	122.7 Å²	122.7	59%	0.594	73%	0.725	S	S	*	*	S	Bend	trans	83.8	85.7	164.1	-165.4	0	0	0	0	121.5
1433	V	34	Very low	33.6	Very low	83 Å²	83	117.4 Å²	117.4	50%	0.503	72%	0.72	S	S	.	*			trans	66.3	110.8	148.5	37.9	0	0	0	0	127.3	R1430	R1430-V1433 VanDerWaalsContact CZ-N 3.28Å; R1430-V1433 VanDerWaalsContact NH2-CG2 3.28Å
1434	C	33	Very low	33.8	Very low	82 Å²	82	120 Å²	120	55%	0.554	72%	0.721	S	S	*	*				69.8	116.4	110.1	-72.5	0	0	0	0	127.6
1435	N	35.4	Very low	33.4	Very low	136 Å²	136	121.2 Å²	121.2	73%	0.727	73%	0.727	S	S	*	*				89.2	122	116.8	-68.1	20	0	0	0	125.5
1436	T	38.8	Very low	33.3	Very low	119 Å²	119	116.9 Å²	116.9	73%	0.73	72%	0.723	S	S	*	*			trans	82.9	94.8	131.1	52.3	0	0	0	0	125.6
1437	S	34.9	Very low	33.3	Very low	109 Å²	109	116.2 Å²	116.2	76%	0.762	73%	0.729	S	S	*	*				74.6	114.4	111.3	70.8	0	0	0	0	126.4
1438	A	34.5	Very low	33.3	Very low	89 Å²	89	118.4 Å²	118.4	74%	0.736	74%	0.737	S	S	*	*				99.8	154.3	108.6	0	0	0	0	0	126.2
1439	T	36.1	Very low	32.8	Very low	140 Å²	140	117.3 Å²	117.3	86%	0.859	73%	0.725	S	S	*	*			trans	96.5	144.7	153.7	35	0	0	0	0	124.8
1440	D	29.4	Very low	32.3	Very low	110 Å²	110	119.4 Å²	119.4	59%	0.588	73%	0.728	S	S	*	*			trans	-82.3	176.6	-165.9	-55.3	-108.5	0	0	0	117.6	K1421	K1421-D1440 IonicContact NZ-OD1 3.65Å; K1421-D1440 PolarHBondContact NZ-OD1 3.06Å
1441	V	34.3	Very low	32.4	Very low	143 Å²	143	116.9 Å²	116.9	87%	0.867	72%	0.724	S	S	*	*				-174	175.7	119.2	146.1	0	0	0	0	111.8
1442	T	30.5	Very low	32.4	Very low	138 Å²	138	111.7 Å²	111.7	85%	0.847	71%	0.712	S	S	*	*			trans	-126.4	161.8	-160.1	60.9	0	0	0	0	115.8
1443	G	31.8	Very low	32.5	Very low	74 Å²	74	113.8 Å²	113.8	76%	0.763	72%	0.718	S	S	*	*			trans	139.2	124.3	168.7	0	0	0	0	0	111.6
1444	N	30.2	Very low	32.5	Very low	149 Å²	149	115.5 Å²	115.5	80%	0.797	73%	0.731	S	S	*	*			cis	96.6	134.9	23.4	-165.3	36	0	0	0	114.9
1445	T	31.4	Very low	32.3	Very low	135 Å²	135	118 Å²	118	83%	0.828	74%	0.739	S	S	*	*			trans	66.1	153.9	-174.7	73.1	0	0	0	0	115.7
1446	G	29.5	Very low	32.2	Very low	75 Å²	75	119.5 Å²	119.5	77%	0.773	75%	0.747	S	S	*	*			cis	166.5	146.8	-11.1	0	0	0	0	0	113.6
1447	G	32.4	Very low	31.8	Very low	70 Å²	70	118.8 Å²	118.8	72%	0.722	75%	0.747	S	S	*	*			trans	75.5	178.8	178.6	0	0	0	0	0	114.9
1448	D	30.9	Very low	32	Very low	171 Å²	171	122 Å²	122	91%	0.914	75%	0.752	S	S	*	*			cis	-167.4	161.1	-29.9	-118.4	-36.2	0	0	0	109.6
1449	G	31.4	Very low	32.1	Very low	57 Å²	57	123.7 Å²	123.7	59%	0.588	75%	0.749	S	S	*	*			trans	82.8	154.9	174.7	0	0	0	0	0	116.1
1450	Q	29.8	Very low	31.8	Very low	120 Å²	120	124.5 Å²	124.5	56%	0.561	74%	0.743	S	S	*	*			cis	72.3	136.5	24	-58.2	-179.6	-104.5	0	0	114.2
1451	Q	29.6	Very low	32	Very low	128 Å²	128	126.2 Å²	126.2	60%	0.598	75%	0.752	S	S	*	*			cis	-169.1	165	-6.7	-123.4	170.7	-31.4	0	0	110.9
1452	N	30.2	Very low	32	Very low	119 Å²	119	124 Å²	124	64%	0.636	74%	0.743	S	S	*	*			trans	69.9	141	157.6	-56.4	-9.2	0	0	0	116.6
1453	I	33.8	Very low	32	Very low	143 Å²	143	125.8 Å²	125.8	73%	0.733	75%	0.746	S	S	*	*			cis	71.3	113.3	43.6	-56.9	165.1	0	0	0	109.5
1454	P	34.4	Very low	31.9	Very low	119 Å²	119	125.7 Å²	125.7	77%	0.773	75%	0.745	S	S	*	*				-144	174	83.8	41.6	-25.8	0	0	0	117.1
1455	D	28.6	Very low	31.9	Very low	135 Å²	135	122 Å²	122	72%	0.722	74%	0.742	S	S	*	*			trans	-63.7	153.4	173.7	-39.9	-98.7	0	0	0	113.5
1456	N	33.6	Very low	31.9	Very low	166 Å²	166	122.7 Å²	122.7	89%	0.888	74%	0.74	S	S	*	*				-167.8	156.1	117.7	-106.2	-37.7	0	0	0	112.8
1457	S	30.7	Very low	32	Very low	104 Å²	104	125.2 Å²	125.2	73%	0.727	74%	0.736	S	S	*	*			trans	-91.2	119.4	168	55.2	0	0	0	0	110.8
1458	M	39.4	Very low	32.2	Very low	176 Å²	176	128 Å²	128	87%	0.867	73%	0.734	S	S	*	*			trans	-174.4	148.6	150	-105.5	167.3	-178.9	0	0	110.2
1459	N	35.5	Very low	32.4	Very low	126 Å²	126	126.5 Å²	126.5	67%	0.674	73%	0.726	S	S	*	*			trans	25.5	139	143.7	-60	54	0	0	0	118.7
1460	E	31.2	Very low	32.6	Very low	156 Å²	156	129.6 Å²	129.6	73%	0.729	73%	0.728	S	S	*	*			cis	172.6	-169.6	-4.7	-121.7	170.1	151	0	0	104.4
1461	D	33.9	Very low	32.7	Very low	147 Å²	147	130.5 Å²	130.5	79%	0.786	74%	0.737	S	S	*	*			trans	67.5	122.2	163.8	-68.8	-28.9	0	0	0	122
1462	S	33.1	Very low	33.1	Very low	96 Å²	96	132.7 Å²	132.7	67%	0.671	75%	0.747	S	S	*	*			trans	64.5	121.4	143.4	-72.6	0	0	0	0	119.8
1463	L	31.4	Very low	33.1	Very low	176 Å²	176	135.4 Å²	135.4	92%	0.921	76%	0.756	S	S	*	*				62.4	123.6	67.7	-62	168.1	0	0	0	112.3
1464	G	29.5	Very low	33.2	Very low	71 Å²	71	135.7 Å²	135.7	73%	0.732	76%	0.759	S	S	*	*			cis	157.8	166.1	-3.5	0	0	0	0	0	112
1465	G	30.4	Very low	33.1	Very low	72 Å²	72	135.2 Å²	135.2	74%	0.742	75%	0.754	S	S	*	*			trans	70.4	-179.4	176.6	0	0	0	0	0	114.7
1466	L	31.6	Very low	33.7	Very low	149 Å²	149	136.4 Å²	136.4	78%	0.78	76%	0.758	S	S	*	*			cis	-160.1	-179.7	-18.8	-147.9	67	0	0	0	107.4
1467	D	31.6	Very low	33.6	Very low	129 Å²	129	135 Å²	135	69%	0.69	75%	0.75	S	S	*	*			trans	68	144.3	160.4	-47.4	-27.6	0	0	0	115.4
1468	D	35.5	Very low	33.6	Very low	128 Å²	128	137 Å²	137	68%	0.684	75%	0.752	S	S	*	*			cis	-142.2	139.8	9.2	-99.3	-32.2	0	0	0	107.5
1469	L	35.5	Very low	33.6	Very low	140 Å²	140	133 Å²	133	73%	0.733	74%	0.74	S	S	*	*				64.8	137.5	95.9	-63.3	-174.4	0	0	0	114.4
1470	D	35	Very low	33.5	Very low	121 Å²	121	133.9 Å²	133.9	65%	0.647	74%	0.741	S	S	*	*			cis	-148.6	158.3	17.8	-75.6	-58.6	0	0	0	112.1
1471	D	33.4	Very low	33.5	Very low	139 Å²	139	133.9 Å²	133.9	74%	0.743	74%	0.741	S	S	*	*				47.4	148.9	126.7	-55.4	-7.3	0	0	0	123
1472	E	36.9	Very low	33.4	Very low	174 Å²	174	133.8 Å²	133.8	81%	0.813	74%	0.741	S	S	*	*			cis	-134	150.7	-7.1	-65.4	-165.8	120.2	0	0	108.7
1473	E	31	Very low	33.2	Very low	177 Å²	177	136.3 Å²	136.3	83%	0.827	75%	0.747	S	S	*	*				33.6	106.1	91.9	-59.7	-162.1	155.2	0	0	118
1474	D	34.4	Very low	33.1	Very low	149 Å²	149	134.9 Å²	134.9	80%	0.797	74%	0.74	S	S	*	*				-179.8	124	123.8	-103	-18.5	0	0	0	109.3
1475	T	33.4	Very low	33.1	Very low	108 Å²	108	135.6 Å²	135.6	66%	0.663	73%	0.734	S	S	*	*				73.7	83.3	56.6	-44.4	0	0	0	0	113.5
1476	M	40.3	Very low	33.1	Very low	161 Å²	161	135.2 Å²	135.2	79%	0.793	72%	0.724	S	S	*	*			trans	-167.4	118.6	149.7	-86.6	-47.6	169	0	0	109.9
1477	D	31.1	Very low	32.9	Very low	135 Å²	135	133.1 Å²	133.1	72%	0.722	72%	0.722	S	S	*	*				35.9	134	102.6	-55.3	4.3	0	0	0	118.1
1478	D	32.2	Very low	32.7	Very low	146 Å²	146	137.3 Å²	137.3	78%	0.781	73%	0.728	S	S	*	*			cis	-153.1	-140.3	-9	-162.4	6.3	0	0	0	109.2
1479	P	38.2	Very low	32.3	Very low	94 Å²	94	135.9 Å²	135.9	61%	0.61	73%	0.728	S	S	*	*			trans	-113.9	-136.8	-145.2	38.7	-16.6	0	0	0	112.8
1480	M	34.7	Very low	31.8	Very low	143 Å²	143	134.3 Å²	134.3	70%	0.704	73%	0.728	S	S	*	*			trans	75.7	149.6	172.9	-45.3	-78.9	-92.2	0	0	114.4
1481	E	30.6	Very low	31.6	Very low	156 Å²	156	139 Å²	139	73%	0.729	74%	0.744	S	S	*	*			cis	-156.8	-174.7	-11	-125.4	174.9	167.1	0	0	110.6
1482	D	31.4	Very low	31.3	Very low	146 Å²	146	137.2 Å²	137.2	78%	0.781	74%	0.742	S	S	*	*			trans	-66.3	-166.7	-179.2	-73.5	-66.6	0	0	0	116.8
1483	D	29.3	Very low	31	Very low	149 Å²	149	133.9 Å²	133.9	80%	0.797	74%	0.738	S	S	*	*			trans	77.8	93.4	153.9	-75.2	-4.7	0	0	0	120.9
1484	D	29.6	Very low	30.9	Very low	145 Å²	145	135.5 Å²	135.5	78%	0.775	74%	0.742	S	S	*	*				58.2	165.9	101.3	-148.1	23.5	0	0	0	121.7
1485	S	28.2	Very low	30.7	Very low	87 Å²	87	132.9 Å²	132.9	61%	0.608	74%	0.741	S	S	*	*			trans	59.6	86	159.9	-75.7	0	0	0	0	120.4
1486	A	30.3	Very low	30.5	Very low	63 Å²	63	138.3 Å²	138.3	52%	0.521	75%	0.749	S	S	.	*				76.7	109.3	122	0	0	0	0	0	121.8	V1174	V1174-A1486 HydrophobicContact CG2-CB 4.47Å
1487	S	28.5	Very low	29.9	Very low	105 Å²	105	139.9 Å²	139.9	73%	0.734	75%	0.747	S	S	*	*				106.7	161	112.6	80.9	0	0	0	0	121.5
1488	R	26.9	Very low	30.1	Very low	217 Å²	217	140.5 Å²	140.5	82%	0.819	75%	0.747	S	S	*	*			trans	81.9	101.9	163.3	-63.2	-179.6	75.7	160.1	-0.1	119.3
1489	S	26.5	Very low	30.2	Very low	98 Å²	98	138 Å²	138	69%	0.685	74%	0.741	S	S	*	*			trans	64.4	121.9	131.8	52.9	0	0	0	0	121.6
1490	S	25.9	Very low	30	Very low	107 Å²	107	144.4 Å²	144.4	75%	0.748	75%	0.753	S	S	*	*			trans	54.8	92.1	140.9	58.3	0	0	0	0	119
1491	F	29.8	Very low	29.7	Very low	221 Å²	221	146.5 Å²	146.5	97%	0.969	76%	0.758	S	S	*	*			trans	-121.6	133.9	133.3	-111.8	-93.3	0	0	0	109.8
1492	S	28.1	Very low	30	Very low	101 Å²	101	144.6 Å²	144.6	71%	0.706	76%	0.759	S	S	*	*			trans	-131.6	128.1	-179	179.7	0	0	0	0	110.8
1493	S	30.9	Very low	29.9	Very low	103 Å²	103	142.9 Å²	142.9	72%	0.72	75%	0.754	S	S	*	*			trans	63.5	109.8	154.7	-54.2	0	0	0	0	119.2
1494	K	27.6	Very low	30.2	Very low	211 Å²	211	146.6 Å²	146.6	92%	0.917	76%	0.758	S	S	*	*				-175.2	98.7	118.8	-100.3	157.9	-174.9	169.6	0	114.8
1495	A	30.6	Very low	30.1	Very low	94 Å²	94	144.6 Å²	144.6	78%	0.777	75%	0.754	S	S	*	*			trans	-177.4	111.6	140.2	0	0	0	0	0	107.5
1496	R	29	Very low	30.3	Very low	222 Å²	222	148.5 Å²	148.5	84%	0.838	77%	0.767	S	S	*	*				68.9	131.3	70.8	-71.2	-173.8	170.7	-169.5	0.7	112.4
1497	R	29.3	Very low	30.2	Very low	195 Å²	195	149.8 Å²	149.8	74%	0.736	78%	0.777	S	S	*	*			cis	-159.8	175.2	12.2	-144.2	177.1	-179.2	179.4	-0.2	113.1
1498	M	34.3	Very low	30.1	Very low	147 Å²	147	155.6 Å²	155.6	72%	0.724	78%	0.783	S	S	*	*			trans	81.6	132.6	168.6	-48.8	-46.3	-169.6	0	0	117
1499	S	34.6	Very low	30.2	Very low	93 Å²	93	150.9 Å²	150.9	65%	0.65	78%	0.778	S	S	*	*			cis	-156.9	139.7	-10.5	61.9	0	0	0	0	114.5
1500	R	33.2	Very low	30.3	Very low	230 Å²	230	152.5 Å²	152.5	87%	0.868	79%	0.785	S	S	*	*			trans	48.5	149.5	131.9	-61.6	174.2	179	-176.4	-1.4	120.3
1501	K	29.1	Very low	30.4	Very low	187 Å²	187	154.6 Å²	154.6	81%	0.813	79%	0.787	S	S	*	*			cis	172.6	179.7	-24.2	-115.5	-164	176.1	-169	0	105.3
1502	P	37.2	Very low	30.4	Very low	115 Å²	115	148.9 Å²	148.9	75%	0.747	78%	0.775	S	S	*	*			cis	-127.9	-175.1	9.6	43.3	-26.9	0	0	0	115.6
1503	T	28.5	Very low	30.4	Very low	110 Å²	110	148.4 Å²	148.4	68%	0.675	77%	0.771	S	S	*	*			trans	-127.1	156.4	174.8	-44.4	0	0	0	0	108
1504	Y	36.5	Very low	30.4	Very low	227 Å²	227	149.3 Å²	149.3	89%	0.89	77%	0.773	S	S	*	*			trans	-143	146.9	154.7	-115.3	-82.3	0	0	0	111.2
1505	C	26.9	Very low	30.3	Very low	103 Å²	103	144.2 Å²	144.2	70%	0.696	76%	0.763	S	S	*	*			trans	-123.7	158.9	-179	-49.7	0	0	0	0	109.5
1506	I	33.1	Very low	30.2	Very low	170 Å²	170	145.4 Å²	145.4	87%	0.872	76%	0.761	S	S	*	*			trans	-164	155.2	150.7	-102	149.3	0	0	0	107.4
1507	A	27.8	Very low	30.3	Very low	89 Å²	89	142.2 Å²	142.2	74%	0.736	76%	0.759	S	S	*	*			trans	-136.3	-171.4	-167.2	0	0	0	0	0	112.7
1508	R	26.2	Very low	30.1	Very low	228 Å²	228	136.7 Å²	136.7	86%	0.86	75%	0.75	S	S	*	*			trans	87.9	88.7	163	-64	-172.4	177.3	-174.8	-0.7	119.5
1509	T	28.4	Very low	29.8	Very low	117 Å²	117	138.7 Å²	138.7	72%	0.718	75%	0.754	S	S	*	*				61.3	152.7	113.4	56.8	0	0	0	0	123.1
1510	T	29.2	Very low	29.5	Very low	133 Å²	133	139.3 Å²	139.3	82%	0.816	76%	0.755	S	S	*	*			trans	86.5	147.6	159.2	71.6	0	0	0	0	118.9
1511	N	28.6	Very low	29.3	Very low	150 Å²	150	135.8 Å²	135.8	80%	0.802	75%	0.747	S	S	*	*			cis	-165.8	178.3	-39.5	-152.6	-7.1	0	0	0	109.6
1512	S	28.6	Very low	29.2	Very low	101 Å²	101	133.6 Å²	133.6	71%	0.706	74%	0.743	S	S	*	*			trans	76.5	151.9	160.1	120	0	0	0	0	116.5
1513	S	28.4	Very low	29	Very low	91 Å²	91	133.5 Å²	133.5	64%	0.636	74%	0.743	S	S	*	*			cis	-170.9	177.8	-5.3	37	0	0	0	0	111.8
1514	V	31	Very low	29.5	Very low	123 Å²	123	134 Å²	134	75%	0.745	75%	0.748	S	S	*	*			trans	79.6	108.8	166	-168.8	0	0	0	0	112.8
1515	S	27	Very low	29.1	Very low	104 Å²	104	126.5 Å²	126.5	73%	0.727	74%	0.74	S	S	*	*				71	150.8	62.7	102.4	0	0	0	0	113.3
1516	V	27.5	Very low	29.1	Very low	119 Å²	119	126.4 Å²	126.4	72%	0.721	74%	0.74	S	S	*	*			cis	-162.3	175.4	-1.6	92.4	0	0	0	0	108.6
1517	I	30.6	Very low	29	Very low	155 Å²	155	125.4 Å²	125.4	80%	0.795	73%	0.731	S	S	*	*			trans	70.1	158.7	168.4	-88.3	159.9	0	0	0	116.2
1518	S	26.5	Very low	29	Very low	78 Å²	78	127 Å²	127	55%	0.545	73%	0.728	S	S	.	*				-177.3	158.3	-61.8	62.3	0	0	0	0	110
1519	K	26.9	Very low	29.1	Very low	189 Å²	189	123.4 Å²	123.4	82%	0.822	72%	0.72	S	S	*	*			trans	68.6	160.3	162.4	-60	-178.6	178.3	179.6	0	116.3
1520	T	27.7	Very low	29.1	Very low	107 Å²	107	123.6 Å²	123.6	66%	0.656	72%	0.722	S	S	*	*			cis	-171.2	167.7	-30.1	37.9	0	0	0	0	108.9
1521	H	29.7	Very low	29.1	Very low	155 Å²	155	128.3 Å²	128.3	72%	0.718	72%	0.724	S	S	*	*			trans	73.7	147.1	160.8	-74.5	-80.5	0	0	0	117.3
1522	I	27.8	Very low	29	Very low	141 Å²	141	126.3 Å²	126.3	72%	0.723	72%	0.722	S	S	*	*			cis	119.5	133.4	10.1	-82.4	168.2	0	0	0	111.5
1523	P	33	Very low	29.2	Very low	114 Å²	114	129 Å²	129	74%	0.74	73%	0.728	S	S	*	*				-130.5	-92.5	-61.3	21.5	5.9	0	0	0	115.4
1524	P	37.5	Very low	29.3	Very low	120 Å²	120	129.7 Å²	129.7	78%	0.779	73%	0.732	S	S	*	*			trans	-124.9	-177.2	-151.5	43.3	-24.5	0	0	0	115.5
1525	G	28.9	Very low	29.1	Very low	70 Å²	70	127.5 Å²	127.5	72%	0.722	73%	0.728	S	S	*	*			trans	132.4	113.4	142.7	0	0	0	0	0	119
1526	S	27.2	Very low	29.3	Very low	100 Å²	100	128.5 Å²	128.5	70%	0.699	73%	0.729	S	S	*	*			trans	69.6	160.8	138	-142	0	0	0	0	122.7
1527	H	31	Very low	29.3	Very low	149 Å²	149	130.2 Å²	130.2	69%	0.69	73%	0.73	S	S	*	*			trans	65.6	98.7	159.5	-62.4	-50.5	0	0	0	121.8
1528	N	27.3	Very low	29.4	Very low	123 Å²	123	127.7 Å²	127.7	66%	0.658	73%	0.726	S	S	*	*				67.3	135.1	107.3	-65.2	7.3	0	0	0	122.3
1529	H	28.5	Very low	29.6	Very low	153 Å²	153	135 Å²	135	71%	0.708	74%	0.741	S	S	*	*			trans	76	112	139.4	-70.9	-40.1	0	0	0	122.2
1530	T	27.6	Very low	29.9	Very low	121 Å²	121	129.8 Å²	129.8	74%	0.742	74%	0.741	S	S	*	*				87.6	148.3	124.9	62.7	0	0	0	0	121.9
1531	R	29.3	Very low	30	Very low	231 Å²	231	131 Å²	131	87%	0.872	75%	0.749	S	S	*	*			trans	66.2	115.6	170.3	-70	177.3	172.5	174.7	-3	115
1532	S	27.1	Very low	30.1	Very low	109 Å²	109	130.1 Å²	130.1	76%	0.762	75%	0.754	S	S	*	*			cis	70.2	106.9	29.2	96.5	0	0	0	0	115.3
1533	L	32.3	Very low	30.1	Very low	158 Å²	158	126.5 Å²	126.5	83%	0.827	75%	0.751	S	S	*	*			trans	-161.4	103.8	158.5	-86.4	172.7	0	0	0	102.9
1534	S	30.4	Very low	30	Very low	104 Å²	104	127.5 Å²	127.5	73%	0.727	76%	0.755	S	S	*	*				53.2	135.8	90	72.7	0	0	0	0	113.8
1535	A	28.2	Very low	29.5	Very low	78 Å²	78	127.6 Å²	127.6	65%	0.645	75%	0.753	S	S	*	*			cis	163.2	-174	-5.2	0	0	0	0	0	104.2
1536	T	31.2	Very low	29.5	Very low	125 Å²	125	132.8 Å²	132.8	77%	0.767	76%	0.758	S	S	*	*			trans	68.4	140.6	164.1	68	0	0	0	0	117.1
1537	E	27.4	Very low	29.5	Very low	155 Å²	155	132.7 Å²	132.7	72%	0.724	76%	0.758	S	S	*	*			cis	-167.1	176.2	-20.3	-131.5	177.6	-142.7	0	0	111.6
1538	S	33	Very low	29.5	Very low	102 Å²	102	133 Å²	133	71%	0.713	76%	0.763	S	S	*	*			trans	78.4	149.5	151.9	85.5	0	0	0	0	119
1539	R	30.1	Very low	29.6	Very low	231 Å²	231	138 Å²	138	87%	0.872	77%	0.773	S	S	*	*			cis	-164.9	151.4	-22.2	-115.2	171.5	-178.7	167.6	0.9	107.4
1540	G	33.1	Very low	29.6	Very low	79 Å²	79	136.8 Å²	136.8	81%	0.814	77%	0.77	S	S	*	*			trans	174.9	64.3	178	0	0	0	0	0	115.6
1541	T	30	Very low	29.6	Very low	133 Å²	133	137.2 Å²	137.2	82%	0.816	77%	0.768	S	S	*	*			trans	-88.9	175.6	-179.4	-25.5	0	0	0	0	112.5
1542	V	32	Very low	29.7	Very low	137 Å²	137	132.2 Å²	132.2	83%	0.83	76%	0.763	S	S	*	*			trans	94	131.2	171.1	-170.8	0	0	0	0	114.8
1543	G	27.9	Very low	29.8	Very low	65 Å²	65	131.3 Å²	131.3	67%	0.67	76%	0.757	S	S	*	*			trans	-111.7	-115.5	-178.1	0	0	0	0	0	113.3
1544	V	30.9	Very low	29.7	Very low	134 Å²	134	129 Å²	129	81%	0.812	75%	0.754	S	S	*	*			trans	80.3	105.4	-159.8	-174.3	0	0	0	0	109.9
1545	V	27.1	Very low	29.9	Very low	123 Å²	123	129 Å²	129	75%	0.745	75%	0.75	S	S	*	*				92.9	145.4	53.3	166.4	0	0	0	0	112.1
1546	E	28.7	Very low	30	Very low	178 Å²	178	133.6 Å²	133.6	83%	0.832	76%	0.758	S	S	*	*			trans	70.9	152.4	176.9	-79.2	172.6	172.7	0	0	117.9
1547	S	27	Very low	30.1	Very low	99 Å²	99	132.6 Å²	132.6	69%	0.692	76%	0.755	S	S	*	*			cis	-176	-178.5	-30.5	-106.6	0	0	0	0	109
1548	I	31.3	Very low	30.6	Very low	155 Å²	155	132.5 Å²	132.5	80%	0.795	76%	0.758	S	S	*	*			trans	70.5	99.1	169.9	-48.8	168.6	0	0	0	113
1549	R	28	Very low	30.7	Very low	228 Å²	228	135 Å²	135	86%	0.86	76%	0.763	S	S	*	*			cis	77.7	150.3	31.2	-141.6	-168.1	-157.3	-177.7	8.2	113.8
1550	I	29.6	Very low	31.3	Very low	127 Å²	127	129 Å²	129	65%	0.651	75%	0.754	S	S	*	*			trans	90.2	90.6	160.9	-61.7	174.1	0	0	0	118.2
1551	N	27.6	Very low	31.6	Very low	131 Å²	131	129.8 Å²	129.8	70%	0.701	74%	0.744	S	S	*	*				87.8	140	116.6	-71.1	13.6	0	0	0	124.9
1552	T	30	Very low	31.8	Very low	126 Å²	126	133.8 Å²	133.8	77%	0.773	75%	0.745	S	S	*	*			trans	68.7	145.6	138.8	52.9	0	0	0	0	119.8
1553	S	30	Very low	31.8	Very low	90 Å²	90	131.6 Å²	131.6	63%	0.629	72%	0.724	S	S	*	*			cis	-173.3	176.4	-17	56.6	0	0	0	0	109.4
1554	S	30.6	Very low	32.1	Very low	108 Å²	108	132.4 Å²	132.4	76%	0.755	72%	0.724	S	S	*	*			trans	75.1	147.5	149	-54.7	0	0	0	0	116.1
1555	V	33.4	Very low	32.2	Very low	106 Å²	106	132.2 Å²	132.2	64%	0.642	71%	0.709	S	S	*	*			cis	-162.4	148.3	-5.5	109.4	0	0	0	0	109.4
1556	E	31.7	Very low	32.6	Very low	174 Å²	174	130.1 Å²	130.1	81%	0.813	70%	0.7	S	S	*	*			trans	55	154.7	158.3	-70.9	159.6	-161.5	0	0	119.1
1557	S	33.1	Very low	32.8	Very low	103 Å²	103	129.5 Å²	129.5	72%	0.72	70%	0.696	S	S	*	*			cis	-157	-178.8	-10.4	48.1	0	0	0	0	106.4
1558	I	37.4	Very low	33	Very low	154 Å²	154	133.2 Å²	133.2	79%	0.79	70%	0.7	S	S	*	*			cis	-135.7	161.4	18.4	-60.3	171.2	0	0	0	109.2
1559	L	35.2	Very low	33	Very low	153 Å²	153	136.6 Å²	136.6	80%	0.801	70%	0.703	S	S	*	*			trans	-143.7	-172	-175.8	-95.2	176.1	0	0	0	107.9
1560	P	43	Very low	33.1	Very low	106 Å²	106	131.8 Å²	131.8	69%	0.688	70%	0.699	S	S	*	*			cis	-125.9	-130.6	-27.8	28.7	-2.9	0	0	0	107.4
1561	P	39.8	Very low	33.3	Very low	95 Å²	95	133.2 Å²	133.2	62%	0.617	70%	0.704	S	S	*	*			cis	-140	148.5	-18.6	28.7	-4.9	0	0	0	119.6
1562	R	34.1	Very low	33.5	Very low	218 Å²	218	134.2 Å²	134.2	82%	0.823	71%	0.707	S	S	*	*				67.4	160	128.2	-68	179.8	168.7	162.5	-4.6	121.8
1563	K	32.2	Very low	33.7	Very low	91 Å²	91	133.3 Å²	133.3	40%	0.396	70%	0.701	S	S	.	*			cis	-180	-176.1	-38.9	-113.9	-174.2	-175	-144.3	0	109	E1596 D1597	K1563-E1596 VanDerWaalsContact CD-OE1 3.28Å; K1563-E1596 WeakPolarHBondContact CD-OE1 3.45Å; K1563-E1596 IonicContact NZ-OE1 3.41Å; K1563-E1596 PolarHBondContact NZ-OE1 3.42Å; K1563-E1596 IonicContact NZ-OE2 2.88Å; K1563-E1596 PolarHBondContact NZ-OE2 3.15Å; K1563-D1597 WeakPolarHBondContact CD-OD2 3.29Å; K1563-D1597 WeakPolarHBondContact CE-OD2 3.49Å; K1563-D1597 PolarHBondContact NZ-O 3.19Å; K1563-D1597 IonicContact NZ-OD2 2.6Å; K1563-D1597 PolarHBondContact NZ-OD2 3.49Å
1564	A	33.9	Very low	34.1	Very low	81 Å²	81	135.5 Å²	135.5	67%	0.669	71%	0.706	S	S	*	*			trans	82.1	122.1	171.3	0	0	0	0	0	115.6
1565	R	33.4	Very low	34.2	Very low	130 Å²	130	137.2 Å²	137.2	49%	0.491	71%	0.706	S	S	.	*			cis	91.5	148.9	42.8	-79.9	175.6	143.2	-176.6	-8.4	112	D1595	R1565-D1595 IonicContact CZ-OD1 2.81Å; R1565-D1595 IonicContact NH1-OD1 3.8Å; R1565-D1595 PolarHBondContact NH1-OD1 2.91Å; R1565-D1595 VanDerWaalsContact NH2-N 3.18Å; R1565-D1595 IonicContact NH2-OD1 3.79Å; R1565-D1595 PolarHBondContact NH2-OD1 3.01Å
1566	S	33.9	Very low	34.5	Very low	79 Å²	79	136.9 Å²	136.9	55%	0.552	71%	0.708	S	S	*	*			cis	-167.2	174.1	-11.3	44.8	0	0	0	0	107
1567	H	33	Very low	34.6	Very low	165 Å²	165	137 Å²	137	76%	0.764	71%	0.709	S	S	*	*			cis	-122.8	-151.6	1.6	-58.1	-109.6	0	0	0	107.3
1568	K	31.9	Very low	34.8	Very low	178 Å²	178	139.8 Å²	139.8	77%	0.774	71%	0.711	S	S	*	*			cis	-145.4	-178.7	-8.8	-154.1	176.3	174	175.2	0	108.1
1569	R	30.7	Very low	34.7	Very low	225 Å²	225	141.2 Å²	141.2	85%	0.849	71%	0.714	S	S	*	*			trans	-137.7	155.2	176.7	174.4	-164.1	-69.3	171.6	-2.9	107.6
1570	V	31.2	Very low	34.8	Very low	127 Å²	127	141.2 Å²	141.2	77%	0.77	72%	0.715	S	S	*	*			trans	161.8	132.5	157.7	142.8	0	0	0	0	106.9
1571	M	32.5	Very low	34.5	Very low	157 Å²	157	144.4 Å²	144.4	77%	0.773	72%	0.72	S	S	*	*			cis	-142.9	163.9	-9.4	-93.3	-87.7	-94.8	0	0	109
1572	M	33.5	Very low	34.3	Very low	153 Å²	153	148.5 Å²	148.5	75%	0.754	73%	0.731	S	S	*	*			trans	-107	158.9	151.7	-61	-144.3	-53.1	0	0	108
1573	V	33.1	Very low	34.5	Very low	107 Å²	107	146 Å²	146	65%	0.648	74%	0.735	S	S	*	*			trans	-120.9	117.1	161.8	-178.9	0	0	0	0	106.6
1574	D	38.3	Very low	35.2	Very low	136 Å²	136	147.4 Å²	147.4	73%	0.727	76%	0.756	S	S	*	*			trans	-102.7	128.5	154.3	-71.9	-62.9	0	0	0	104.8
1575	D	32.8	Very low	35.8	Very low	144 Å²	144	150.4 Å²	150.4	77%	0.77	76%	0.761	S	S	*	*			trans	-102.4	145.3	168.7	-67.8	-50.8	0	0	0	109.4
1576	S	39	Very low	36.4	Very low	98 Å²	98	150.1 Å²	150.1	69%	0.685	77%	0.769	S	S	*	*			trans	-159.8	155.9	-178.1	-70.2	0	0	0	0	108.7
1577	E	35.6	Very low	37.1	Very low	176 Å²	176	153.5 Å²	153.5	82%	0.822	78%	0.78	S	S	*	*			trans	69	155.7	-178.8	-55.9	159.8	-163.5	0	0	112.6
1578	E	36.9	Very low	37.8	Very low	163 Å²	163	149.9 Å²	149.9	76%	0.762	78%	0.779	S	S	*	*			cis	-156.5	148.7	-26	-114.4	176.3	-179.1	0	0	109
1579	E	35.3	Very low	38.4	Very low	184 Å²	184	145.6 Å²	145.6	86%	0.86	78%	0.777	S	S	*	*			trans	52.9	166.8	159.6	-52.9	-163.7	150	0	0	121.4
1580	D	37.1	Very low	39.1	Very low	152 Å²	152	142.3 Å²	142.3	81%	0.813	78%	0.776	S	S	*	*			trans	-75.3	151.8	179.1	-43.8	-71.4	0	0	0	110.4
1581	E	35.3	Very low	39.8	Very low	173 Å²	173	143.9 Å²	143.9	81%	0.808	78%	0.781	S	S	*	*			cis	-162	159.4	10.7	-128.3	165.8	-171.8	0	0	108.1
1582	E	36.4	Very low	40.2	Very low	181 Å²	181	142.5 Å²	142.5	85%	0.846	78%	0.776	S	S	*	*			trans	66.8	104.4	167.8	-57.8	-174.5	161.6	0	0	121.3
1583	D	38.4	Very low	40.7	Very low	167 Å²	167	140.2 Å²	140.2	89%	0.893	77%	0.773	S	S	*	*			trans	40.9	98.6	144.4	-57.2	-11.3	0	0	0	122.6
1584	S	46.7	Very low	41.2	Very low	120 Å²	120	141 Å²	141	84%	0.839	77%	0.774	S	S	*	*			trans	-153.8	151.1	153.1	55.4	0	0	0	0	111.7
1585	D	46.2	Very low	41.4	Very low	144 Å²	144	140 Å²	140	77%	0.77	77%	0.768	S	S	*	*			cis	110.7	88.9	18.6	-104.3	9	0	0	0	115.8
1586	N	47.5	Very low	41.7	Very low	124 Å²	124	138.7 Å²	138.7	66%	0.663	76%	0.757	S	S	*	*			trans	69.5	133	136.2	-54.2	-41.6	0	0	0	124.7
1587	D	47.1	Very low	41.8	Very low	149 Å²	149	137.6 Å²	137.6	80%	0.797	74%	0.744	S	S	*	*			trans	85	114.3	132.9	-71.3	-20.5	0	0	0	125.1
1588	A	47.7	Very low	41.7	Very low	90 Å²	90	142.5 Å²	142.5	74%	0.744	76%	0.763	S	S	*	*				87.2	102.8	117.9	0	0	0	0	0	123.5
1589	A	44.6	Very low	41.9	Very low	88 Å²	88	141.5 Å²	141.5	73%	0.727	76%	0.763	S	S	*	*				94.4	143	105.3	0	0	0	0	0	124.2
1590	D	45.1	Very low	42.3	Very low	156 Å²	156	139.3 Å²	139.3	83%	0.834	76%	0.758	S	S	*	*			trans	84.9	156.1	144.3	-65.6	-22.2	0	0	0	125.5
1591	D	46	Very low	42.6	Very low	160 Å²	160	138.6 Å²	138.6	86%	0.856	76%	0.755	S	S	*	*			trans	76.7	96.5	171.4	-65.8	-21.9	0	0	0	122.8
1592	D	41.1	Very low	43	Very low	128 Å²	128	136.5 Å²	136.5	68%	0.684	75%	0.752	S	S	*	*			trans	-58.7	162.3	147.1	-112.1	-44.9	0	0	0	110.3
1593	P	44.7	Very low	43.4	Very low	104 Å²	104	133.8 Å²	133.8	68%	0.675	75%	0.746	S	S	*	*				-157	174.8	54.8	44	-22.7	0	0	0	119.9
1594	D	43.4	Very low	43.7	Very low	125 Å²	125	131.5 Å²	131.5	67%	0.668	74%	0.736	S	S	*	*			trans	66.3	146.2	146.1	-71.4	-33	0	0	0	123.7
1595	D	43	Very low	43.5	Very low	115 Å²	115	132.4 Å²	132.4	62%	0.615	73%	0.729	S	S	*	*			trans	50	133.7	159.8	-66.9	-2.2	0	0	0	121.4	R1565	R1565-D1595 IonicContact CZ-OD1 2.81Å; R1565-D1595 IonicContact NH1-OD1 3.8Å; R1565-D1595 PolarHBondContact NH1-OD1 2.91Å; R1565-D1595 VanDerWaalsContact NH2-N 3.18Å; R1565-D1595 IonicContact NH2-OD1 3.79Å; R1565-D1595 PolarHBondContact NH2-OD1 3.01Å
1596	E	39.4	Very low	43.3	Very low	115 Å²	115	131.5 Å²	131.5	54%	0.537	73%	0.725	S	S	.	*			cis	-153.7	161.9	-1.8	-116.7	-141.5	147.1	0	0	109.6	K1563	K1563-E1596 VanDerWaalsContact CD-OE1 3.28Å; K1563-E1596 WeakPolarHBondContact CD-OE1 3.45Å; K1563-E1596 IonicContact NZ-OE1 3.41Å; K1563-E1596 PolarHBondContact NZ-OE1 3.42Å; K1563-E1596 IonicContact NZ-OE2 2.88Å; K1563-E1596 PolarHBondContact NZ-OE2 3.15Å
1597	D	39.5	Very low	43	Very low	75 Å²	75	132.1 Å²	132.1	40%	0.401	73%	0.731	S	S	.	*			trans	-61.7	144.8	-168.4	-26.9	-116.1	0	0	0	117.9	K1563	K1563-D1597 WeakPolarHBondContact CD-OD2 3.29Å; K1563-D1597 WeakPolarHBondContact CE-OD2 3.49Å; K1563-D1597 PolarHBondContact NZ-O 3.19Å; K1563-D1597 IonicContact NZ-OD2 2.6Å; K1563-D1597 PolarHBondContact NZ-OD2 3.49Å
1598	F	33.9	Very low	42.6	Very low	280 Å²	280	130.5 Å²	130.5	100%	1.228	73%	0.725	S	S	*	*			trans	-143.8	0	135.3	-146	-74.8	0	0	0	111.2

Retrieved 1,598 of 1,598 residues in 2546.3 ms (Link to these results)

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