A0A5K4F097_SCHMA Loading...

PH domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F097, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,477 aa.

						>A0A5K4F097_SCHMA|A0A5K4F097
MSSWQRLSGYLNSKPTGPPLVNNASDIAAYFESAFKRLKGIQRHWYVFEESTLKLMAYRNQMDAAIPDKEPLKTINIHGAVFHIDPAEHNQFSIISDGKEHILQAETEDAMLLWLHVLQTRRNEAVQTSESDNSSPNDDSLTDYKLFRQNSLMKMQMSIPTRASPIISSDSNESSFNNNGSLRSRKSSSHQNLNKLIKQLSIDQMNDHQSYNNNHLLIDHTSLWISPIDHSMNTSSSSSTTSTTNYDLMRRLSYNRSNSYDSDIIKQHVNDLNIINDKSIKLLSKSNNYLINQSSSSSSSNNKIYHRNRIMNLPIEEEENEDYSILNEKLSNQINGENRSHLRTTMKVLDNLSENKCQVNNQKEELMQNNLIGNDSYLVGEINGESREVSNTDSTESDEFNQTEKENYNVISRSDNKFFNDSEISEGPQDSSERQCTGQQMSTGEYLTSQLSAKYQSSIILQNPRTFSDSDIDLENELSPNDYIRELKAQLQSALDREAYLRQMLSNREAGMREIDQKVENIENIEMKDNSSFKLPKNISPNKLRDMIEDYEQKQRILYRKNQFLITEIRELASIKYMFTDHSNKMSKYIQRLNMEGFKWRREYVKLLQACLGATQTDPHHRLMFSDYGKDRYKNLISELLDEARRKDPSLPSMIKPKTADYHVDFYGFKHSYLNETSIIHYSCQQLYDFYTRQLSGGDENFYRWTELLTQANRELTRADLEVLCRSGVPIQYREGVWRMLIHGELHQLMQIKGPLYYNGLLEEFSENTLAAQHRRQISLDLLRTMPNNVQFDNIDAPGVQKLQEVLQAYSIHNSKIGYCQGMNFIAAVALLFLRKEDAFWCLIAILERFLPENYFNSGLIDAQVDQLVLKEIVHEKLPRLSSHLKRLGIDISAVTLNWFLAVFYDSVPFETLIRIWDVFLLEGSETLFRFAVAILKRNQDMLLEQSDTISFWKCLKAATRLTNDVDGLIKTAFEELRPFPKPQLIATRRAYHYEILSKKMSIKKGYWQNVMKESPDEFIENQNHVQHKRSTKENQAVIQAITFYDNEHLWICYGDKLYSQISEVVVTSNCMQSIGYELESRVSCICAFSNEIILLGMMSKQLCAYSVIRNSKIWQIPIHDSVSDITFAYFLHDHTNKVYAGLTNGELVVIENIGFEEPRDSIYYITISFIPISSVLLAKSQLWCASGSSIFIFHAKTMDYYKQISISNNPLDVILKICLGDNGVWIAVRGSSVIELWDPDRLIRILLFNIVNETYLSRRPEEEYTFNPQRVTVILPYDNTLWIGTGMGEVLVYQIHTYQKTEKKKSLEGTIQMTRHKRSTSLKDELQLIGETTRKTLLKSTRCPSNPDVSHIPDKDPEPLFYPLRQNSLILEHAINSNYIYELQKIVRSKVAETPIRFLVMKKITDSHILIISCSTYFNDDDAVLKWKRDNNNGSIWTNEPIYVFDRESHSLRLPAYMRNSLCLQMHNKKSIIMNN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.2	Very low	61.3	Low	172 Å²	172	94.6 Å²	94.6	85%	0.847	48%	0.476	S	S	*	.				0	19.6	0	-69.8	-174.3	83.1	0	0	112.7
2	S	33.4	Very low	63.5	Low	112 Å²	112	90.9 Å²	90.9	78%	0.783	46%	0.459	S	S	*	.			trans	-100.2	2.5	-163.2	47	0	0	0	0	117
3	S	32.5	Very low	65.1	Low	84 Å²	84	84.3 Å²	84.3	59%	0.587	43%	0.426	S	S	*	.	S	Bend	trans	-104.7	-17.1	-178.3	50.7	0	0	0	0	115.8
4	W	28.7	Very low	65.9	Low	221 Å²	221	82.7 Å²	82.7	84%	0.837	42%	0.415	S	S	*	.	S	Bend	trans	-103	10.1	-169.7	-73.7	100.2	0	0	0	116.7
5	Q	50	Low	65.7	Low	179 Å²	179	80.8 Å²	80.8	84%	0.836	41%	0.411	S	S	*	.			trans	-112	8.4	176.6	-80.8	-171.4	-26.5	0	0	114.9	L7	Q5-L7 PolarHBondContact O-N 2.89Å
6	R	63.5	Low	65	Low	95 Å²	95	79.4 Å²	79.4	36%	0.358	41%	0.408	S	S	.	.	S	Bend	trans	-73.6	127.2	176.5	-67.5	179.2	-179.1	-163	-8.3	110	S8 V47 E49	R6-S8 PolarHBondContact O-N 3.34Å; R6-S8 PolarHBondContact O-OG 3.21Å; R6-V47 HydrophobicContact CB-CG1 4.3Å; R6-E49 IonicContact CZ-OE1 2.65Å; R6-E49 IonicContact NH1-OE1 3.73Å; R6-E49 PolarHBondContact NH1-OE1 3.1Å; R6-E49 IonicContact NH2-OE1 2.65Å; R6-E49 PolarHBondContact NH2-OE1 2.84Å; R6-E49 VanDerWaalsContact NH2-OE1 3.15Å
7	L	84.3	Confident	63.9	Low	29 Å²	29	76.6 Å²	76.6	15%	0.152	40%	0.403	C	S	.	.			trans	-53.6	114.6	173.9	178.8	74.2	0	0	0	109.3	Q5 F48 L113 W114 V117	Q5-L7 PolarHBondContact O-N 2.89Å; L7-F48 HydrophobicContact CB-CB 4.26Å; L7-F48 PolarHBondContact O-N 3.35Å; L7-L113 HydrophobicContact CD1-CD2 4.33Å; L7-L113 HydrophobicContact CD1-CG 4.42Å; L7-W114 HydrophobicContact CD2-CD2 3.93Å; L7-W114 HydrophobicContact CD2-CE3 3.33Å; L7-W114 HydrophobicContact CD2-CH2 4.26Å; L7-W114 HydrophobicContact CD2-CZ3 3.52Å; L7-W114 HydrophobicContact CG-CD2 4.27Å; L7-W114 HydrophobicContact CG-CE3 3.92Å; L7-W114 HydrophobicContact CG-CH2 4Å; L7-W114 HydrophobicContact CG-CZ2 4.35Å; L7-W114 HydrophobicContact CG-CZ3 3.76Å; L7-V117 HydrophobicContact CD2-CB 3.79Å; L7-V117 HydrophobicContact CD2-CG1 3.77Å; L7-V117 HydrophobicContact CD2-CG2 4.33Å
8	S	87.6	Confident	62.7	Low	56 Å²	56	77.9 Å²	77.9	39%	0.392	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	153.6	-178.7	57.1	0	0	0	0	112.1	R6 Y46	R6-S8 PolarHBondContact O-N 3.34Å; R6-S8 PolarHBondContact O-OG 3.21Å; S8-Y46 CarbonylContact C-O 3.59Å; S8-Y46 WeakPolarHBondContact CA-O 3.28Å; S8-Y46 VanDerWaalsContact CB-O 3.28Å; S8-Y46 WeakPolarHBondContact CB-O 3.25Å
9	G	88.8	Confident	61.4	Low	12 Å²	12	79.3 Å²	79.3	12%	0.124	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167	170.7	-178.8	0	0	0	0	0	113.2	Y46	G9-Y46 PolarHBondContact N-O 3.2Å; G9-Y46 PolarHBondContact O-N 3.06Å
10	Y	90.1	Very high	60	Low	80 Å²	80	83.3 Å²	83.3	31%	0.314	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	132.4	175.7	-77.2	-68.8	0	0	0	111.6	R43 H44 W45	Y10-R43 HydrophobicContact CD1-CG 3.75Å; Y10-R43 HydrophobicContact CG-CG 4.2Å; Y10-H44 WeakPolarHBondContact CA-O 3.49Å; Y10-W45 HydrophobicContact CD1-CB 4.36Å; Y10-W45 AromaticContact CD1-CE3 3.91Å; Y10-W45 HydrophobicContact CD1-CE3 3.91Å; Y10-W45 AromaticContact CD2-CE3 3.4Å; Y10-W45 HydrophobicContact CD2-CE3 3.4Å; Y10-W45 VanDerWaalsContact CD2-CE3 3.4Å; Y10-W45 AromaticContact CD2-CZ3 3.42Å; Y10-W45 HydrophobicContact CD2-CZ3 3.42Å; Y10-W45 VanDerWaalsContact CD2-CZ3 3.42Å; Y10-W45 HydrophobicContact CE1-CB 4.11Å; Y10-W45 AromaticContact CE1-CE3 3.89Å; Y10-W45 HydrophobicContact CE1-CE3 3.89Å; Y10-W45 AromaticContact CE2-CE3 3.36Å; Y10-W45 HydrophobicContact CE2-CE3 3.36Å; Y10-W45 AromaticContact CE2-CZ3 3.47Å; Y10-W45 HydrophobicContact CE2-CZ3 3.47Å; Y10-W45 VanDerWaalsContact CE2-CZ3 3.47Å; Y10-W45 AromaticContact CG-CE3 3.67Å; Y10-W45 HydrophobicContact CG-CE3 3.67Å; Y10-W45 HydrophobicContact CG-CZ3 4.08Å; Y10-W45 AromaticContact CZ-CE3 3.6Å
11	L	90.9	Very high	58.9	Low	1 Å²	1	84.9 Å²	84.9	1%	0.005	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	143	166.7	-62.4	170.6	0	0	0	110	H44 Y46 F92 L103 A105 W114	L11-H44 PolarHBondContact N-O 2.79Å; L11-H44 PolarHBondContact O-N 3.37Å; L11-H44 VanDerWaalsContact O-N 3.11Å; L11-Y46 HydrophobicContact CB-CD2 3.59Å; L11-Y46 HydrophobicContact CB-CE2 3.75Å; L11-Y46 HydrophobicContact CB-CG 4.48Å; L11-Y46 HydrophobicContact CD1-CD2 3.99Å; L11-Y46 HydrophobicContact CD1-CG 4.06Å; L11-Y46 HydrophobicContact CG-CD2 4.07Å; L11-F92 HydrophobicContact CD1-CZ 4.15Å; L11-F92 HydrophobicContact CD2-CE1 4.33Å; L11-L103 HydrophobicContact CD1-CB 4.41Å; L11-L103 HydrophobicContact CD1-CD1 3.99Å; L11-A105 HydrophobicContact CD2-CB 3.86Å; L11-W114 HydrophobicContact CD1-CD2 4.1Å; L11-W114 HydrophobicContact CD1-CE3 4.49Å; L11-W114 HydrophobicContact CD1-CZ2 4.11Å; L11-W114 HydrophobicContact CG-CZ2 4.4Å
12	N	88.4	Confident	59.7	Low	50 Å²	50	83.9 Å²	83.9	27%	0.267	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	113.8	175.5	-77.6	-16.6	0	0	0	109.1	I41 R43 L103 Q104	N12-I41 HydrophobicContact CB-CG2 3.56Å; N12-R43 VanDerWaalsContact OD1-CB 3.31Å; N12-R43 WeakPolarHBondContact OD1-CB 3.18Å; N12-R43 WeakPolarHBondContact OD1-CG 3.35Å; N12-L103 CarbonylContact O-C 3.6Å; N12-L103 WeakPolarHBondContact O-CA 3.34Å; N12-Q104 HydrophobicContact CB-CB 4.11Å; N12-Q104 PolarHBondContact N-O 3.47Å; N12-Q104 PolarHBondContact O-N 3.4Å
13	S	84	Confident	59.7	Low	5 Å²	5	84.2 Å²	84.2	4%	0.035	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	121.4	177.1	62.8	0	0	0	0	111.1	Q42 H44 Y46	S13-Q42 PolarHBondContact N-O 3.37Å; S13-Q42 PolarHBondContact O-N 3.26Å; S13-Q42 VanDerWaalsContact O-N 3.08Å; S13-Q42 PolarHBondContact OG-O 3.02Å; S13-Q42 VanDerWaalsContact OG-O 3.05Å; S13-H44 PolarHBondContact OG-ND1 3.36Å; S13-Y46 WeakPolarHBondContact CB-OH 3.36Å
14	K	75.8	Confident	60.2	Low	62 Å²	62	85 Å²	85	27%	0.27	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	130.3	169.1	-77.8	177.4	179.1	170.5	0	108.4	T16 I41 E88 I102	K14-T16 PolarHBondContact O-N 3.34Å; K14-I41 HydrophobicContact CG-CG1 4.1Å; K14-E88 IonicContact NZ-OE2 3.12Å; K14-E88 PolarHBondContact NZ-OE2 3.39Å; K14-I102 HydrophobicContact CB-CB 4.3Å; K14-I102 HydrophobicContact CB-CG2 4.25Å; K14-I102 HydrophobicContact CD-CG2 4.3Å; K14-I102 PolarHBondContact N-O 2.88Å; K14-I102 VanDerWaalsContact N-O 3.16Å
15	P	63.5	Low	60.8	Low	54 Å²	54	79.1 Å²	79.1	35%	0.351	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-66.3	119.3	177.7	25.2	-31.6	0	0	0	110.7	K39	P15-K39 WeakPolarHBondContact CG-O 3.45Å
16	T	54.4	Low	60.4	Low	59 Å²	59	75.9 Å²	75.9	36%	0.362	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-89.6	123.8	173.7	46.6	0	0	0	0	109.7	K14 E100 I102	K14-T16 PolarHBondContact O-N 3.34Å; T16-E100 VanDerWaalsContact CB-O 3.26Å; T16-E100 WeakPolarHBondContact CB-O 3.22Å; T16-E100 VanDerWaalsContact CG2-O 3.24Å; T16-E100 WeakPolarHBondContact CG2-O 2.94Å; T16-E100 PolarHBondContact OG1-O 2.78Å; T16-I102 HydrophobicContact CG2-CB 4.25Å; T16-I102 HydrophobicContact CG2-CD1 3.68Å; T16-I102 HydrophobicContact CG2-CG1 3.69Å
17	G	46.1	Very low	59.3	Low	32 Å²	32	76.6 Å²	76.6	33%	0.33	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-74.2	157	173.6	0	0	0	0	0	111.3
18	P	42.5	Very low	57.4	Low	99 Å²	99	79.1 Å²	79.1	64%	0.643	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-61.5	149.9	175.8	-3.1	14.7	0	0	0	110.7
19	P	37.9	Very low	55.5	Low	105 Å²	105	79 Å²	79	68%	0.682	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-60.2	141.7	178.2	24.1	-31.9	0	0	0	110.8	V21	P19-V21 WeakPolarHBondContact O-CG2 3.44Å; P19-V21 PolarHBondContact O-N 3.34Å
20	L	33.2	Very low	53.1	Low	159 Å²	159	85.6 Å²	85.6	83%	0.832	51%	0.506	S	S	*	.			trans	-53.5	104.3	179	-74.2	155.2	0	0	0	110.3
21	V	37.3	Very low	50.7	Low	116 Å²	116	88 Å²	88	70%	0.703	52%	0.518	S	S	*	.			trans	-89.6	119.9	172.4	-173.9	0	0	0	0	107.7	P19 N23	P19-V21 WeakPolarHBondContact O-CG2 3.44Å; P19-V21 PolarHBondContact O-N 3.34Å; V21-N23 PolarHBondContact O-N 3.06Å
22	N	40.1	Very low	48.5	Very low	151 Å²	151	94.4 Å²	94.4	81%	0.807	55%	0.548	S	S	*	.			trans	-71.8	19.9	-169.6	-77.4	-13.8	0	0	0	115.9
23	N	35.1	Very low	46.7	Very low	120 Å²	120	93.3 Å²	93.3	64%	0.642	54%	0.544	S	S	*	.			trans	-105	121.1	-177.1	-70	-6.3	0	0	0	110.7	V21 S25	V21-N23 PolarHBondContact O-N 3.06Å; N23-S25 PolarHBondContact O-N 2.72Å
24	A	42.4	Very low	44.6	Very low	100 Å²	100	95.1 Å²	95.1	83%	0.826	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	6.5	-171.4	0	0	0	0	0	115.7
25	S	41.5	Very low	43.2	Very low	97 Å²	97	99.2 Å²	99.2	68%	0.678	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-9.8	-175.1	56.2	0	0	0	0	115.8	N23	N23-S25 PolarHBondContact O-N 2.72Å
26	D	40.6	Very low	42.4	Very low	111 Å²	111	103.4 Å²	103.4	59%	0.594	59%	0.59	S	S	*	*			trans	-116.6	45.3	-173.2	-69.1	-25.8	0	0	0	114.4	A28 A29 Y30	D26-A28 PolarHBondContact O-N 3.45Å; D26-A28 VanDerWaalsContact O-N 3.15Å; D26-A29 HydrophobicContact CB-CB 4.12Å; D26-A29 WeakPolarHBondContact O-CB 3.45Å; D26-A29 PolarHBondContact O-N 3.18Å; D26-Y30 PolarHBondContact O-N 3.3Å
27	I	41.3	Very low	41.9	Very low	110 Å²	110	109.3 Å²	109.3	56%	0.564	61%	0.606	S	S	*	*	H	α-helix	trans	-57.1	-27.7	172.7	-62.4	173.1	0	0	0	111.4	Y30 F31	I27-Y30 WeakPolarHBondContact O-CB 3.47Å; I27-Y30 PolarHBondContact O-N 3.12Å; I27-F31 HydrophobicContact CG2-CD2 4.09Å; I27-F31 HydrophobicContact CG2-CE2 3.95Å; I27-F31 WeakPolarHBondContact O-CD2 3.23Å; I27-F31 PolarHBondContact O-N 2.89Å
28	A	44.2	Very low	41.7	Very low	82 Å²	82	114.1 Å²	114.1	68%	0.678	62%	0.623	S	S	*	*	H	α-helix	trans	-63.5	-40.2	173.1	0	0	0	0	0	112.7	D26 Y30 F31 E32	D26-A28 PolarHBondContact O-N 3.45Å; D26-A28 VanDerWaalsContact O-N 3.15Å; A28-Y30 VanDerWaalsContact C-N 3.31Å; A28-Y30 PolarHBondContact O-N 3.26Å; A28-F31 PolarHBondContact O-N 3.43Å; A28-E32 PolarHBondContact O-N 3.19Å
29	A	46.5	Very low	41.9	Very low	54 Å²	54	116 Å²	116	45%	0.446	62%	0.621	S	S	.	*	H	α-helix	trans	-70	-29.6	175.8	0	0	0	0	0	112	D26 E32 S33	D26-A29 HydrophobicContact CB-CB 4.12Å; D26-A29 WeakPolarHBondContact O-CB 3.45Å; D26-A29 PolarHBondContact O-N 3.18Å; A29-E32 PolarHBondContact O-N 2.82Å; A29-S33 WeakPolarHBondContact O-CB 3.19Å; A29-S33 PolarHBondContact O-N 2.7Å; A29-S33 PolarHBondContact O-OG 3.43Å
30	Y	40.2	Very low	42.6	Very low	151 Å²	151	113.5 Å²	113.5	59%	0.592	62%	0.615	S	S	*	*	H	α-helix	trans	-62.1	-47.6	173.8	-176.7	-95.4	0	0	0	111.6	D26 I27 A28 S33 A34	D26-Y30 PolarHBondContact O-N 3.3Å; I27-Y30 WeakPolarHBondContact O-CB 3.47Å; I27-Y30 PolarHBondContact O-N 3.12Å; A28-Y30 VanDerWaalsContact C-N 3.31Å; A28-Y30 PolarHBondContact O-N 3.26Å; Y30-S33 PolarHBondContact O-N 3.27Å; Y30-S33 PolarHBondContact O-OG 3.41Å; Y30-A34 PolarHBondContact O-N 2.89Å
31	F	39.9	Very low	44.4	Very low	129 Å²	129	110.5 Å²	110.5	57%	0.566	60%	0.599	S	S	*	*	H	α-helix	trans	-65.3	-40	177.6	-83.5	-75.6	0	0	0	112.6	I27 A28 S33 A34 F35	I27-F31 HydrophobicContact CG2-CD2 4.09Å; I27-F31 HydrophobicContact CG2-CE2 3.95Å; I27-F31 WeakPolarHBondContact O-CD2 3.23Å; I27-F31 PolarHBondContact O-N 2.89Å; A28-F31 PolarHBondContact O-N 3.43Å; F31-S33 VanDerWaalsContact C-N 3.28Å; F31-S33 PolarHBondContact O-N 3.42Å; F31-A34 PolarHBondContact O-N 2.81Å; F31-F35 WeakPolarHBondContact O-CD2 3.31Å; F31-F35 PolarHBondContact O-N 3.36Å
32	E	44.5	Very low	46.4	Very low	137 Å²	137	108.5 Å²	108.5	64%	0.64	58%	0.582	S	S	*	*	H	α-helix	trans	-65.9	-32.4	176.1	-144.7	178.6	-176.1	0	0	112	A28 A29 K36	A28-E32 PolarHBondContact O-N 3.19Å; A29-E32 PolarHBondContact O-N 2.82Å; E32-K36 PolarHBondContact O-N 2.87Å
33	S	49.2	Very low	48.7	Very low	27 Å²	27	107.6 Å²	107.6	19%	0.189	57%	0.567	C	S	.	*	H	α-helix	trans	-72.4	-35.9	173.9	81.8	0	0	0	0	113.3	A29 Y30 F31 F35 K36 R37	A29-S33 WeakPolarHBondContact O-CB 3.19Å; A29-S33 PolarHBondContact O-N 2.7Å; A29-S33 PolarHBondContact O-OG 3.43Å; Y30-S33 PolarHBondContact O-N 3.27Å; Y30-S33 PolarHBondContact O-OG 3.41Å; F31-S33 VanDerWaalsContact C-N 3.28Å; F31-S33 PolarHBondContact O-N 3.42Å; S33-F35 VanDerWaalsContact C-N 3.34Å; S33-K36 PolarHBondContact O-N 3.03Å; S33-R37 PolarHBondContact O-N 3.35Å
34	A	40.5	Very low	51.4	Low	42 Å²	42	103 Å²	103	35%	0.347	54%	0.541	S	S	.	.	H	α-helix	trans	-64.9	-40	174.1	0	0	0	0	0	110.9	Y30 F31 K36 R37	Y30-A34 PolarHBondContact O-N 2.89Å; F31-A34 PolarHBondContact O-N 2.81Å; A34-K36 VanDerWaalsContact C-N 3.32Å; A34-K36 PolarHBondContact O-N 3.13Å; A34-R37 PolarHBondContact O-N 3.34Å
35	F	46.3	Very low	53.7	Low	148 Å²	148	99.8 Å²	99.8	65%	0.649	51%	0.508	S	S	*	.	H	α-helix	trans	-65.7	-29.7	173.4	-92	-77.9	0	0	0	113.6	F31 S33 L38	F31-F35 WeakPolarHBondContact O-CD2 3.31Å; F31-F35 PolarHBondContact O-N 3.36Å; S33-F35 VanDerWaalsContact C-N 3.34Å; F35-L38 HydrophobicContact CD1-CD1 4.09Å; F35-L38 HydrophobicContact CE1-CD1 4.36Å; F35-L38 PolarHBondContact O-N 2.79Å
36	K	46.3	Very low	56.2	Low	143 Å²	143	95.3 Å²	95.3	62%	0.622	48%	0.476	S	S	*	.	H	α-helix	trans	-73.4	-27.4	173.3	-79.8	-178.8	-179.8	170.8	0	113.7	E32 S33 A34 L38 K39	E32-K36 PolarHBondContact O-N 2.87Å; S33-K36 PolarHBondContact O-N 3.03Å; A34-K36 VanDerWaalsContact C-N 3.32Å; A34-K36 PolarHBondContact O-N 3.13Å; K36-L38 VanDerWaalsContact C-N 3.25Å; K36-L38 PolarHBondContact O-N 3.5Å; K36-K39 PolarHBondContact O-N 3.09Å
37	R	44.8	Very low	58.7	Low	182 Å²	182	90.9 Å²	90.9	69%	0.687	45%	0.453	S	S	*	.	H	α-helix	trans	-69.9	-20.6	172.3	-70.2	-173.1	-168.2	-160.5	2	113.3	S33 A34 K39	S33-R37 PolarHBondContact O-N 3.35Å; A34-R37 PolarHBondContact O-N 3.34Å; R37-K39 VanDerWaalsContact C-N 3.26Å; R37-K39 PolarHBondContact O-N 3.37Å
38	L	41.2	Very low	61.1	Low	134 Å²	134	85.7 Å²	85.7	70%	0.702	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-14.1	173.5	-78.6	161.6	0	0	0	113.4	F35 K36 G40	F35-L38 HydrophobicContact CD1-CD1 4.09Å; F35-L38 HydrophobicContact CE1-CD1 4.36Å; F35-L38 PolarHBondContact O-N 2.79Å; K36-L38 VanDerWaalsContact C-N 3.25Å; K36-L38 PolarHBondContact O-N 3.5Å; L38-G40 PolarHBondContact O-N 3.42Å
39	K	46.8	Very low	63.1	Low	137 Å²	137	83.6 Å²	83.6	60%	0.596	40%	0.403	S	S	*	.	S	Bend	trans	-76.9	108.4	168.8	-73.2	-171.7	175.7	-176.6	0	108	P15 K36 R37	P15-K39 WeakPolarHBondContact CG-O 3.45Å; K36-K39 PolarHBondContact O-N 3.09Å; R37-K39 VanDerWaalsContact C-N 3.26Å; R37-K39 PolarHBondContact O-N 3.37Å
40	G	52.4	Low	64.9	Low	54 Å²	54	84.5 Å²	84.5	56%	0.557	40%	0.398	S	S	*	.			trans	-56.7	176.7	179.1	0	0	0	0	0	114.4	L38 Q42	L38-G40 PolarHBondContact O-N 3.42Å; G40-Q42 WeakPolarHBondContact O-CG 3.42Å; G40-Q42 PolarHBondContact O-N 2.78Å
41	I	72.4	Confident	66.7	Low	96 Å²	96	81.7 Å²	81.7	49%	0.492	40%	0.4	S	S	.	.			trans	-50	123.5	179.8	-62.4	172.1	0	0	0	110.1	N12 K14	N12-I41 HydrophobicContact CB-CG2 3.56Å; K14-I41 HydrophobicContact CG-CG1 4.1Å
42	Q	79	Confident	68.8	Low	73 Å²	73	78.3 Å²	78.3	34%	0.341	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	116.8	-178.1	-58.9	-172.1	-35.5	0	0	110.8	S13 G40 H44	S13-Q42 PolarHBondContact N-O 3.37Å; S13-Q42 PolarHBondContact O-N 3.26Å; S13-Q42 VanDerWaalsContact O-N 3.08Å; S13-Q42 PolarHBondContact OG-O 3.02Å; S13-Q42 VanDerWaalsContact OG-O 3.05Å; G40-Q42 WeakPolarHBondContact O-CG 3.42Å; G40-Q42 PolarHBondContact O-N 2.78Å; Q42-H44 WeakPolarHBondContact CB-CE1 3.39Å; Q42-H44 PolarHBondContact OE1-CE1 3.14Å
43	R	87.6	Confident	70.9	Confident	133 Å²	133	73.1 Å²	73.1	50%	0.502	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	118.7	174.8	-168	175.5	-170.5	-176.4	7.2	109.7	Y10 N12 E106	Y10-R43 HydrophobicContact CD1-CG 3.75Å; Y10-R43 HydrophobicContact CG-CG 4.2Å; N12-R43 VanDerWaalsContact OD1-CB 3.31Å; N12-R43 WeakPolarHBondContact OD1-CB 3.18Å; N12-R43 WeakPolarHBondContact OD1-CG 3.35Å; R43-E106 IonicContact NH2-OE2 3.96Å
44	H	91.3	Very high	72.8	Confident	22 Å²	22	76.1 Å²	76.1	10%	0.102	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	153.8	178.7	-64.7	112.5	0	0	0	110.5	Y10 L11 S13 Q42 Y46 A57 Y58 L72	Y10-H44 WeakPolarHBondContact CA-O 3.49Å; L11-H44 PolarHBondContact N-O 2.79Å; L11-H44 PolarHBondContact O-N 3.37Å; L11-H44 VanDerWaalsContact O-N 3.11Å; S13-H44 PolarHBondContact OG-ND1 3.36Å; Q42-H44 WeakPolarHBondContact CB-CE1 3.39Å; Q42-H44 PolarHBondContact OE1-CE1 3.14Å; H44-Y46 HydrophobicContact CB-CD2 4.32Å; H44-Y46 HydrophobicContact CB-CE2 3.82Å; H44-Y46 WeakPolarHBondContact O-CD2 3.39Å; H44-A57 HydrophobicContact CB-CB 4.31Å; H44-Y58 WeakPolarHBondContact CB-O 3.39Å; H44-L72 VanDerWaalsContact CD2-CD1 3.48Å; H44-L72 WeakPolarHBondContact CD2-CD1 3.39Å
45	W	92.2	Very high	75.3	Confident	34 Å²	34	74.1 Å²	74.1	13%	0.129	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	114	174.1	-171.6	-95.8	0	0	0	109.8	Y10 A57 Y58 Q61	Y10-W45 HydrophobicContact CD1-CB 4.36Å; Y10-W45 AromaticContact CD1-CE3 3.91Å; Y10-W45 HydrophobicContact CD1-CE3 3.91Å; Y10-W45 AromaticContact CD2-CE3 3.4Å; Y10-W45 HydrophobicContact CD2-CE3 3.4Å; Y10-W45 VanDerWaalsContact CD2-CE3 3.4Å; Y10-W45 AromaticContact CD2-CZ3 3.42Å; Y10-W45 HydrophobicContact CD2-CZ3 3.42Å; Y10-W45 VanDerWaalsContact CD2-CZ3 3.42Å; Y10-W45 HydrophobicContact CE1-CB 4.11Å; Y10-W45 AromaticContact CE1-CE3 3.89Å; Y10-W45 HydrophobicContact CE1-CE3 3.89Å; Y10-W45 AromaticContact CE2-CE3 3.36Å; Y10-W45 HydrophobicContact CE2-CE3 3.36Å; Y10-W45 AromaticContact CE2-CZ3 3.47Å; Y10-W45 HydrophobicContact CE2-CZ3 3.47Å; Y10-W45 VanDerWaalsContact CE2-CZ3 3.47Å; Y10-W45 AromaticContact CG-CE3 3.67Å; Y10-W45 HydrophobicContact CG-CE3 3.67Å; Y10-W45 HydrophobicContact CG-CZ3 4.08Å; Y10-W45 AromaticContact CZ-CE3 3.6Å; W45-A57 CarbonylContact O-C 3.53Å; W45-Y58 PolarHBondContact N-O 3.15Å; W45-Y58 PolarHBondContact O-N 3.19Å; W45-Q61 HydrophobicContact CD2-CB 3.87Å; W45-Q61 HydrophobicContact CD2-CG 4.28Å; W45-Q61 HydrophobicContact CE3-CB 4.1Å; W45-Q61 HydrophobicContact CG-CB 4.28Å; W45-Q61 HydrophobicContact CH2-CB 4.46Å; W45-Q61 HydrophobicContact CH2-CG 4.24Å; W45-Q61 HydrophobicContact CZ2-CB 4.28Å; W45-Q61 HydrophobicContact CZ2-CG 3.83Å; W45-Q61 HydrophobicContact CZ3-CB 4.38Å
46	Y	94	Very high	77.4	Confident	3 Å²	3	68.1 Å²	68.1	1%	0.012	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	140.4	179.4	-75.2	-97.4	0	0	0	110.6	S8 G9 L11 S13 H44 L55 M56 A57 L103	S8-Y46 CarbonylContact C-O 3.59Å; S8-Y46 WeakPolarHBondContact CA-O 3.28Å; S8-Y46 VanDerWaalsContact CB-O 3.28Å; S8-Y46 WeakPolarHBondContact CB-O 3.25Å; G9-Y46 PolarHBondContact N-O 3.2Å; G9-Y46 PolarHBondContact O-N 3.06Å; L11-Y46 HydrophobicContact CB-CD2 3.59Å; L11-Y46 HydrophobicContact CB-CE2 3.75Å; L11-Y46 HydrophobicContact CB-CG 4.48Å; L11-Y46 HydrophobicContact CD1-CD2 3.99Å; L11-Y46 HydrophobicContact CD1-CG 4.06Å; L11-Y46 HydrophobicContact CG-CD2 4.07Å; S13-Y46 WeakPolarHBondContact CB-OH 3.36Å; H44-Y46 HydrophobicContact CB-CD2 4.32Å; H44-Y46 HydrophobicContact CB-CE2 3.82Å; H44-Y46 WeakPolarHBondContact O-CD2 3.39Å; Y46-L55 HydrophobicContact CD1-CD1 4.18Å; Y46-L55 HydrophobicContact CD1-CD2 4.17Å; Y46-L55 HydrophobicContact CD1-CG 3.88Å; Y46-M56 CarbonylContact C-O 3.47Å; Y46-M56 VanDerWaalsContact CA-O 3.3Å; Y46-M56 WeakPolarHBondContact CA-O 3.47Å; Y46-A57 HydrophobicContact CD1-CB 3.86Å; Y46-A57 HydrophobicContact CE1-CB 3.53Å; Y46-A57 HydrophobicContact CE2-CB 4.28Å; Y46-A57 HydrophobicContact CG-CB 4.4Å; Y46-L103 HydrophobicContact CE1-CD2 4.26Å; Y46-L103 HydrophobicContact CE2-CD2 4.18Å; Y46-L103 WeakPolarHBondContact OH-CD2 3.33Å
47	V	91.4	Very high	79.6	Confident	18 Å²	18	61.3 Å²	61.3	11%	0.109	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	122.7	174.2	-176.7	0	0	0	0	108.2	R6 M56 Y58 A64	R6-V47 HydrophobicContact CB-CG1 4.3Å; V47-M56 PolarHBondContact N-O 2.95Å; V47-M56 PolarHBondContact O-N 2.59Å; V47-Y58 HydrophobicContact CB-CE2 4.27Å; V47-Y58 HydrophobicContact CG2-CD2 4.11Å; V47-Y58 HydrophobicContact CG2-CE2 4.12Å; V47-A64 HydrophobicContact CG2-CB 3.91Å
48	F	91.9	Very high	81.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	117.6	173.4	179.3	-118.6	0	0	0	110	L7 E50 L53 L55 I77 W114 V117 L118 R121	L7-F48 HydrophobicContact CB-CB 4.26Å; L7-F48 PolarHBondContact O-N 3.35Å; F48-E50 HydrophobicContact CD1-CG 3.98Å; F48-E50 HydrophobicContact CE1-CB 4.5Å; F48-E50 HydrophobicContact CE1-CG 3.86Å; F48-L53 HydrophobicContact CZ-CD2 4.14Å; F48-L55 HydrophobicContact CB-CD1 3.97Å; F48-L55 HydrophobicContact CD2-CB 4.41Å; F48-I77 HydrophobicContact CD2-CG1 4.33Å; F48-I77 HydrophobicContact CE2-CB 4.22Å; F48-I77 HydrophobicContact CE2-CG1 3.85Å; F48-I77 HydrophobicContact CE2-CG2 4.49Å; F48-W114 HydrophobicContact CB-CZ3 4.33Å; F48-V117 HydrophobicContact CD1-CG1 4.49Å; F48-L118 HydrophobicContact CB-CD2 4.28Å; F48-L118 HydrophobicContact CD1-CD2 4.16Å; F48-L118 HydrophobicContact CD2-CD2 3.39Å; F48-L118 HydrophobicContact CE1-CD2 4.35Å; F48-L118 HydrophobicContact CE2-CD2 3.65Å; F48-L118 HydrophobicContact CG-CD2 3.67Å; F48-L118 HydrophobicContact CZ-CD2 4.11Å; F48-R121 HydrophobicContact CE1-CB 3.97Å; F48-R121 HydrophobicContact CE1-CG 3.86Å; F48-R121 HydrophobicContact CZ-CB 3.88Å; F48-R121 HydrophobicContact CZ-CG 4.31Å
49	E	88	Confident	83.9	Confident	39 Å²	39	56.1 Å²	56.1	18%	0.182	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	107.6	175.2	-178.4	169.4	-120.1	0	0	110.3	R6 S51 T52 L53 K54 M56	R6-E49 IonicContact CZ-OE1 2.65Å; R6-E49 IonicContact NH1-OE1 3.73Å; R6-E49 PolarHBondContact NH1-OE1 3.1Å; R6-E49 IonicContact NH2-OE1 2.65Å; R6-E49 PolarHBondContact NH2-OE1 2.84Å; R6-E49 VanDerWaalsContact NH2-OE1 3.15Å; E49-S51 VanDerWaalsContact C-N 3.3Å; E49-S51 VanDerWaalsContact CG-OG 3.29Å; E49-S51 WeakPolarHBondContact CG-OG 3.12Å; E49-S51 PolarHBondContact O-N 2.93Å; E49-T52 HydrophobicContact CG-CG2 4.41Å; E49-T52 WeakPolarHBondContact CG-OG1 3.35Å; E49-T52 PolarHBondContact O-N 3.49Å; E49-T52 VanDerWaalsContact OE2-CG2 3.3Å; E49-T52 WeakPolarHBondContact OE2-CG2 3.39Å; E49-T52 PolarHBondContact OE2-OG1 2.96Å; E49-L53 WeakPolarHBondContact O-CA 3.11Å; E49-L53 PolarHBondContact O-N 2.65Å; E49-K54 PolarHBondContact N-O 2.92Å; E49-K54 PolarHBondContact O-N 2.78Å; E49-M56 HydrophobicContact CB-CE 3.65Å; E49-M56 HydrophobicContact CG-CE 4.49Å
50	E	82.9	Confident	85.8	Confident	72 Å²	72	52.2 Å²	52.2	34%	0.336	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-32.7	-174.9	-57.3	-175.8	166.3	0	0	112.9	F48 T52 R121	F48-E50 HydrophobicContact CD1-CG 3.98Å; F48-E50 HydrophobicContact CE1-CB 4.5Å; F48-E50 HydrophobicContact CE1-CG 3.86Å; E50-T52 VanDerWaalsContact C-N 3.33Å; E50-T52 PolarHBondContact O-N 2.77Å; E50-R121 IonicContact OE1-CZ 2.62Å; E50-R121 VanDerWaalsContact OE1-CZ 3.31Å; E50-R121 IonicContact OE1-NH1 2.92Å; E50-R121 PolarHBondContact OE1-NH1 2.86Å; E50-R121 IonicContact OE1-NH2 2.9Å; E50-R121 PolarHBondContact OE1-NH2 3.3Å; E50-R121 IonicContact OE2-CZ 3.96Å; E50-R121 IonicContact OE2-NH1 3.29Å; E50-R121 PolarHBondContact OE2-NH1 2.89Å; E50-R121 IonicContact OE2-NH2 2.69Å; E50-R121 PolarHBondContact OE2-NH2 2.48Å
51	S	78.1	Confident	87.3	Confident	93 Å²	93	54.3 Å²	54.3	65%	0.65	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-29.5	-179.3	50.7	0	0	0	0	113.3	E49	E49-S51 VanDerWaalsContact C-N 3.3Å; E49-S51 VanDerWaalsContact CG-OG 3.29Å; E49-S51 WeakPolarHBondContact CG-OG 3.12Å; E49-S51 PolarHBondContact O-N 2.93Å
52	T	84	Confident	87.7	Confident	58 Å²	58	55.1 Å²	55.1	36%	0.356	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-5.9	-178.9	60.2	0	0	0	0	112.9	E49 E50 K54	E49-T52 HydrophobicContact CG-CG2 4.41Å; E49-T52 WeakPolarHBondContact CG-OG1 3.35Å; E49-T52 PolarHBondContact O-N 3.49Å; E49-T52 VanDerWaalsContact OE2-CG2 3.3Å; E49-T52 WeakPolarHBondContact OE2-CG2 3.39Å; E49-T52 PolarHBondContact OE2-OG1 2.96Å; E50-T52 VanDerWaalsContact C-N 3.33Å; E50-T52 PolarHBondContact O-N 2.77Å; T52-K54 PolarHBondContact O-N 2.79Å
53	L	88.6	Confident	87.9	Confident	27 Å²	27	53 Å²	53	14%	0.141	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	35.4	-171.7	-72.8	145.3	0	0	0	112.4	F48 E49 I77 R121 A125	F48-L53 HydrophobicContact CZ-CD2 4.14Å; E49-L53 WeakPolarHBondContact O-CA 3.11Å; E49-L53 PolarHBondContact O-N 2.65Å; L53-I77 VanDerWaalsContact O-CB 3.27Å; L53-I77 WeakPolarHBondContact O-CB 3.44Å; L53-I77 PolarHBondContact O-N 3.31Å; L53-R121 HydrophobicContact CD2-CB 4.09Å; L53-A125 HydrophobicContact CD1-CB 3.31Å; L53-A125 HydrophobicContact CD2-CB 4.11Å; L53-A125 HydrophobicContact CG-CB 4.36Å
54	K	89.7	Confident	87.6	Confident	91 Å²	91	48 Å²	48	40%	0.396	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	132.2	179.7	-74	172.3	178.8	-176.9	0	110.3	E49 T52 M56 T74	E49-K54 PolarHBondContact N-O 2.92Å; E49-K54 PolarHBondContact O-N 2.78Å; T52-K54 PolarHBondContact O-N 2.79Å; K54-M56 HydrophobicContact CB-CG 4.45Å; K54-T74 HydrophobicContact CB-CG2 3.81Å; K54-T74 HydrophobicContact CD-CG2 3.81Å; K54-T74 HydrophobicContact CG-CG2 3.89Å
55	L	92.6	Very high	87	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	111.6	171.5	-178.8	64	0	0	0	108.6	Y46 F48 T74 I75 I77 I94 L103 W114 L118	Y46-L55 HydrophobicContact CD1-CD1 4.18Å; Y46-L55 HydrophobicContact CD1-CD2 4.17Å; Y46-L55 HydrophobicContact CD1-CG 3.88Å; F48-L55 HydrophobicContact CB-CD1 3.97Å; F48-L55 HydrophobicContact CD2-CB 4.41Å; L55-T74 CarbonylContact O-C 3.58Å; L55-T74 WeakPolarHBondContact O-CA 3.28Å; L55-I75 HydrophobicContact CB-CB 4.26Å; L55-I75 HydrophobicContact CD2-CD1 4.41Å; L55-I75 PolarHBondContact N-O 2.83Å; L55-I75 PolarHBondContact O-N 3.41Å; L55-I77 HydrophobicContact CB-CD1 4.11Å; L55-I77 HydrophobicContact CB-CG1 4.18Å; L55-I94 HydrophobicContact CD2-CD1 3.83Å; L55-L103 HydrophobicContact CD2-CD1 4.32Å; L55-W114 HydrophobicContact CD1-CE3 4.48Å; L55-W114 HydrophobicContact CD1-CH2 4.07Å; L55-W114 HydrophobicContact CD1-CZ3 3.53Å; L55-L118 HydrophobicContact CD2-CD1 4.23Å
56	M	91.3	Very high	86.4	Confident	21 Å²	21	53.2 Å²	53.2	10%	0.103	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	130.4	-171.7	-67	-177.2	-70	0	0	111.1	Y46 V47 E49 K54 Y58 P71 K73 T74	Y46-M56 CarbonylContact C-O 3.47Å; Y46-M56 VanDerWaalsContact CA-O 3.3Å; Y46-M56 WeakPolarHBondContact CA-O 3.47Å; V47-M56 PolarHBondContact N-O 2.95Å; V47-M56 PolarHBondContact O-N 2.59Å; E49-M56 HydrophobicContact CB-CE 3.65Å; E49-M56 HydrophobicContact CG-CE 4.49Å; K54-M56 HydrophobicContact CB-CG 4.45Å; M56-Y58 HydrophobicContact CB-CE2 3.74Å; M56-P71 HydrophobicContact CB-CB 3.82Å; M56-P71 HydrophobicContact CB-CG 4.32Å; M56-P71 HydrophobicContact CG-CB 4.19Å; M56-P71 HydrophobicContact CG-CG 4.13Å; M56-P71 HydrophobicContact SD-CB 4.5Å; M56-P71 HydrophobicContact SD-CG 4.11Å; M56-K73 CarbonylContact C-O 3.53Å; M56-K73 WeakPolarHBondContact CA-O 3.45Å; M56-T74 HydrophobicContact CG-CG2 4.15Å
57	A	91	Very high	85.6	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	134.2	178.1	0	0	0	0	0	111	H44 W45 Y46 P71 L72 K73	H44-A57 HydrophobicContact CB-CB 4.31Å; W45-A57 CarbonylContact O-C 3.53Å; Y46-A57 HydrophobicContact CD1-CB 3.86Å; Y46-A57 HydrophobicContact CE1-CB 3.53Å; Y46-A57 HydrophobicContact CE2-CB 4.28Å; Y46-A57 HydrophobicContact CG-CB 4.4Å; A57-P71 CarbonylContact O-C 3.5Å; A57-P71 WeakPolarHBondContact O-CA 3.37Å; A57-L72 WeakPolarHBondContact O-CB 3.4Å; A57-L72 PolarHBondContact O-N 3.4Å; A57-K73 HydrophobicContact CB-CB 3.97Å; A57-K73 PolarHBondContact N-O 2.8Å
58	Y	92.4	Very high	84.9	Confident	25 Å²	25	65.3 Å²	65.3	10%	0.098	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	160.8	176.1	-62.8	-90.5	0	0	0	109.8	H44 W45 V47 M56 N60 D63 A64 K69 P71	H44-Y58 WeakPolarHBondContact CB-O 3.39Å; W45-Y58 PolarHBondContact N-O 3.15Å; W45-Y58 PolarHBondContact O-N 3.19Å; V47-Y58 HydrophobicContact CB-CE2 4.27Å; V47-Y58 HydrophobicContact CG2-CD2 4.11Å; V47-Y58 HydrophobicContact CG2-CE2 4.12Å; M56-Y58 HydrophobicContact CB-CE2 3.74Å; Y58-N60 VanDerWaalsContact C-N 3.31Å; Y58-N60 PolarHBondContact O-N 3.43Å; Y58-D63 HydrophobicContact CD1-CB 4.44Å; Y58-A64 HydrophobicContact CD1-CB 4.22Å; Y58-A64 HydrophobicContact CD2-CB 3.55Å; Y58-A64 HydrophobicContact CE2-CB 4.06Å; Y58-A64 HydrophobicContact CG-CB 3.65Å; Y58-K69 WeakPolarHBondContact CE1-O 3.32Å; Y58-P71 HydrophobicContact CE1-CB 4.05Å; Y58-P71 HydrophobicContact CE2-CB 4.33Å
59	R	84.3	Confident	84.4	Confident	182 Å²	182	69.1 Å²	69.1	69%	0.687	37%	0.366	S	S	*	.	S	Bend	trans	-64.4	-40.4	-177.7	-162.8	178	177.7	-179.6	-2.4	111.7	D63 L72	R59-D63 WeakPolarHBondContact CB-OD2 3.31Å; R59-L72 HydrophobicContact CB-CD1 4.02Å
60	N	85.8	Confident	84.2	Confident	56 Å²	56	75.8 Å²	75.8	30%	0.299	40%	0.397	S	S	.	.	S	Bend	trans	-152.8	175.8	178.8	57.8	24.1	0	0	0	109.6	Y58 M62 D63 A64	Y58-N60 VanDerWaalsContact C-N 3.31Å; Y58-N60 PolarHBondContact O-N 3.43Å; N60-M62 VanDerWaalsContact C-N 3.3Å; N60-M62 PolarHBondContact O-N 2.78Å; N60-M62 PolarHBondContact OD1-N 2.93Å; N60-D63 PolarHBondContact O-N 3.12Å; N60-D63 VanDerWaalsContact OD1-CB 3.31Å; N60-D63 WeakPolarHBondContact OD1-CB 3.45Å; N60-D63 PolarHBondContact OD1-N 3.35Å; N60-D63 PolarHBondContact OD1-OD1 3.03Å; N60-A64 PolarHBondContact O-N 3.2Å
61	Q	84.8	Confident	84.4	Confident	97 Å²	97	74.3 Å²	74.3	45%	0.453	39%	0.394	S	S	.	.	H	α-helix	trans	-62.1	-35.5	179.6	-175.8	179.2	3.9	0	0	113	W45 A64 A65	W45-Q61 HydrophobicContact CD2-CB 3.87Å; W45-Q61 HydrophobicContact CD2-CG 4.28Å; W45-Q61 HydrophobicContact CE3-CB 4.1Å; W45-Q61 HydrophobicContact CG-CB 4.28Å; W45-Q61 HydrophobicContact CH2-CB 4.46Å; W45-Q61 HydrophobicContact CH2-CG 4.24Å; W45-Q61 HydrophobicContact CZ2-CB 4.28Å; W45-Q61 HydrophobicContact CZ2-CG 3.83Å; W45-Q61 HydrophobicContact CZ3-CB 4.38Å; Q61-A64 PolarHBondContact O-N 2.65Å; Q61-A65 PolarHBondContact O-N 2.64Å
62	M	80.8	Confident	84.7	Confident	114 Å²	114	74.6 Å²	74.6	56%	0.562	39%	0.387	S	S	*	.	H	α-helix	trans	-65.4	-40.5	179.6	-63.2	-169.9	-168	0	0	111.6	N60 A64 A65 I66 S431	N60-M62 VanDerWaalsContact C-N 3.3Å; N60-M62 PolarHBondContact O-N 2.78Å; N60-M62 PolarHBondContact OD1-N 2.93Å; M62-A64 VanDerWaalsContact C-N 3.26Å; M62-A64 PolarHBondContact O-N 3.03Å; M62-A65 WeakPolarHBondContact O-CB 3.29Å; M62-A65 PolarHBondContact O-N 2.89Å; M62-I66 PolarHBondContact O-N 2.66Å; M62-S431 VanDerWaalsContact CE-OG 3.23Å; M62-S431 WeakPolarHBondContact CE-OG 3.39Å
63	D	83.7	Confident	84.8	Confident	28 Å²	28	75.3 Å²	75.3	15%	0.15	39%	0.386	C	S	.	.	H	α-helix	trans	-61.4	-36	176.2	-78.6	-1.4	0	0	0	112.3	Y58 R59 N60 A65 K69	Y58-D63 HydrophobicContact CD1-CB 4.44Å; R59-D63 WeakPolarHBondContact CB-OD2 3.31Å; N60-D63 PolarHBondContact O-N 3.12Å; N60-D63 VanDerWaalsContact OD1-CB 3.31Å; N60-D63 WeakPolarHBondContact OD1-CB 3.45Å; N60-D63 PolarHBondContact OD1-N 3.35Å; N60-D63 PolarHBondContact OD1-OD1 3.03Å; D63-A65 VanDerWaalsContact C-N 3.27Å; D63-A65 PolarHBondContact O-N 2.98Å; D63-K69 HydrophobicContact CB-CD 4.04Å; D63-K69 VanDerWaalsContact CG-CE 3.48Å; D63-K69 WeakPolarHBondContact O-CD 3.44Å; D63-K69 IonicContact OD1-NZ 3.34Å; D63-K69 PolarHBondContact OD1-NZ 3.47Å; D63-K69 IonicContact OD2-NZ 3.86Å; D63-K69 PolarHBondContact OD2-NZ 3.06Å
64	A	80.6	Confident	84.8	Confident	29 Å²	29	77.3 Å²	77.3	24%	0.24	40%	0.399	C	S	.	.	H	α-helix	trans	-73.2	-19.6	176.6	0	0	0	0	0	113.4	V47 Y58 N60 Q61 M62	V47-A64 HydrophobicContact CG2-CB 3.91Å; Y58-A64 HydrophobicContact CD1-CB 4.22Å; Y58-A64 HydrophobicContact CD2-CB 3.55Å; Y58-A64 HydrophobicContact CE2-CB 4.06Å; Y58-A64 HydrophobicContact CG-CB 3.65Å; N60-A64 PolarHBondContact O-N 3.2Å; Q61-A64 PolarHBondContact O-N 2.65Å; M62-A64 VanDerWaalsContact C-N 3.26Å; M62-A64 PolarHBondContact O-N 3.03Å
65	A	78.8	Confident	84.8	Confident	79 Å²	79	73.1 Å²	73.1	65%	0.653	38%	0.381	S	S	*	.	H	α-helix	trans	-86.1	-18.2	179.3	0	0	0	0	0	112.9	Q61 M62 D63 P67	Q61-A65 PolarHBondContact O-N 2.64Å; M62-A65 WeakPolarHBondContact O-CB 3.29Å; M62-A65 PolarHBondContact O-N 2.89Å; D63-A65 VanDerWaalsContact C-N 3.27Å; D63-A65 PolarHBondContact O-N 2.98Å; A65-P67 WeakPolarHBondContact O-CD 3.4Å
66	I	79.7	Confident	84.7	Confident	85 Å²	85	75.6 Å²	75.6	44%	0.436	39%	0.394	S	S	.	.	S	Bend	trans	-73.8	117.7	177.5	-62.8	166.9	0	0	0	108.7	M62 D68 K69	M62-I66 PolarHBondContact O-N 2.66Å; I66-D68 PolarHBondContact O-N 3.49Å; I66-K69 HydrophobicContact CB-CB 4.07Å; I66-K69 HydrophobicContact CB-CD 4.15Å; I66-K69 HydrophobicContact CD1-CD 3.86Å; I66-K69 HydrophobicContact CG2-CB 4.14Å; I66-K69 HydrophobicContact CG2-CD 4.44Å; I66-K69 PolarHBondContact O-N 3.14Å
67	P	76.5	Confident	84.6	Confident	109 Å²	109	74.6 Å²	74.6	71%	0.708	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	138.1	174.1	-19	30.9	0	0	0	110.4	A65 K69	A65-P67 WeakPolarHBondContact O-CD 3.4Å; P67-K69 VanDerWaalsContact C-N 3.27Å; P67-K69 PolarHBondContact O-N 3.09Å
68	D	77.4	Confident	84.1	Confident	167 Å²	167	78.6 Å²	78.6	89%	0.893	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	12.3	178.4	-50	-37.6	0	0	0	116.8	I66 E70	I66-D68 PolarHBondContact O-N 3.49Å; D68-E70 PolarHBondContact O-N 3.12Å
69	K	80.7	Confident	83.5	Confident	79 Å²	79	80.3 Å²	80.3	34%	0.343	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-72.9	126.2	172.8	-168.9	151	-177.6	171.2	0	111.1	Y58 D63 I66 P67	Y58-K69 WeakPolarHBondContact CE1-O 3.32Å; D63-K69 HydrophobicContact CB-CD 4.04Å; D63-K69 VanDerWaalsContact CG-CE 3.48Å; D63-K69 WeakPolarHBondContact O-CD 3.44Å; D63-K69 IonicContact OD1-NZ 3.34Å; D63-K69 PolarHBondContact OD1-NZ 3.47Å; D63-K69 IonicContact OD2-NZ 3.86Å; D63-K69 PolarHBondContact OD2-NZ 3.06Å; I66-K69 HydrophobicContact CB-CB 4.07Å; I66-K69 HydrophobicContact CB-CD 4.15Å; I66-K69 HydrophobicContact CD1-CD 3.86Å; I66-K69 HydrophobicContact CG2-CB 4.14Å; I66-K69 HydrophobicContact CG2-CD 4.44Å; I66-K69 PolarHBondContact O-N 3.14Å; P67-K69 VanDerWaalsContact C-N 3.27Å; P67-K69 PolarHBondContact O-N 3.09Å
70	E	84.5	Confident	83.7	Confident	180 Å²	180	71.7 Å²	71.7	84%	0.841	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-66.7	132.1	178.8	-70.3	-168.9	160.7	0	0	111.8	D68	D68-E70 PolarHBondContact O-N 3.12Å
71	P	87.5	Confident	83.6	Confident	40 Å²	40	72.9 Å²	72.9	26%	0.26	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-72.8	144.1	177.4	29.9	-35.3	0	0	0	111.8	M56 A57 Y58 K73 T74	M56-P71 HydrophobicContact CB-CB 3.82Å; M56-P71 HydrophobicContact CB-CG 4.32Å; M56-P71 HydrophobicContact CG-CB 4.19Å; M56-P71 HydrophobicContact CG-CG 4.13Å; M56-P71 HydrophobicContact SD-CB 4.5Å; M56-P71 HydrophobicContact SD-CG 4.11Å; A57-P71 CarbonylContact O-C 3.5Å; A57-P71 WeakPolarHBondContact O-CA 3.37Å; Y58-P71 HydrophobicContact CE1-CB 4.05Å; Y58-P71 HydrophobicContact CE2-CB 4.33Å; P71-K73 VanDerWaalsContact C-N 3.31Å; P71-K73 PolarHBondContact O-N 3.36Å; P71-T74 WeakPolarHBondContact CG-OG1 3.12Å
72	L	84.9	Confident	83.9	Confident	99 Å²	99	69.4 Å²	69.4	52%	0.518	39%	0.393	S	S	.	.	S	Bend	trans	-62.5	-36.7	176.6	-67	171.3	0	0	0	112.9	H44 A57 R59	H44-L72 VanDerWaalsContact CD2-CD1 3.48Å; H44-L72 WeakPolarHBondContact CD2-CD1 3.39Å; A57-L72 WeakPolarHBondContact O-CB 3.4Å; A57-L72 PolarHBondContact O-N 3.4Å; R59-L72 HydrophobicContact CB-CD1 4.02Å
73	K	86.2	Confident	84.1	Confident	73 Å²	73	69 Å²	69	32%	0.317	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	143	176.5	-66.8	179.6	-175.7	167.6	0	109	M56 A57 P71	M56-K73 CarbonylContact C-O 3.53Å; M56-K73 WeakPolarHBondContact CA-O 3.45Å; A57-K73 HydrophobicContact CB-CB 3.97Å; A57-K73 PolarHBondContact N-O 2.8Å; P71-K73 VanDerWaalsContact C-N 3.31Å; P71-K73 PolarHBondContact O-N 3.36Å
74	T	88.5	Confident	84	Confident	70 Å²	70	71 Å²	71	43%	0.429	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	124.2	173.2	-52	0	0	0	0	108.4	K54 L55 M56 P71	K54-T74 HydrophobicContact CB-CG2 3.81Å; K54-T74 HydrophobicContact CD-CG2 3.81Å; K54-T74 HydrophobicContact CG-CG2 3.89Å; L55-T74 CarbonylContact O-C 3.58Å; L55-T74 WeakPolarHBondContact O-CA 3.28Å; M56-T74 HydrophobicContact CG-CG2 4.15Å; P71-T74 WeakPolarHBondContact CG-OG1 3.12Å
75	I	89.6	Confident	83.7	Confident	2 Å²	2	73.1 Å²	73.1	1%	0.01	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.2	178.3	-54.6	171.1	0	0	0	107.1	L55 I77 I94 H101	L55-I75 HydrophobicContact CB-CB 4.26Å; L55-I75 HydrophobicContact CD2-CD1 4.41Å; L55-I75 PolarHBondContact N-O 2.83Å; L55-I75 PolarHBondContact O-N 3.41Å; I75-I77 HydrophobicContact CG2-CD1 4.25Å; I75-I94 HydrophobicContact CG2-CG2 4.07Å; I75-H101 HydrophobicContact CD1-CB 3.83Å
76	N	89.2	Confident	83.3	Confident	52 Å²	52	75.5 Å²	75.5	28%	0.278	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	127.4	176.7	-172.4	-9.6	0	0	0	109.8	H78 S96	N76-H78 WeakPolarHBondContact OD1-CB 3.26Å; N76-H78 PolarHBondContact OD1-N 3.47Å; N76-S96 VanDerWaalsContact O-CB 3.3Å; N76-S96 WeakPolarHBondContact O-CB 3.1Å; N76-S96 PolarHBondContact O-OG 2.85Å
77	I	90.7	Very high	82.7	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	42%	0.423	C	S	.	.			trans	-93.7	-17.2	-176.9	-58.4	-59.3	0	0	0	112.3	F48 L53 L55 I75 G79 A80 F82 I94 L118 R122	F48-I77 HydrophobicContact CD2-CG1 4.33Å; F48-I77 HydrophobicContact CE2-CB 4.22Å; F48-I77 HydrophobicContact CE2-CG1 3.85Å; F48-I77 HydrophobicContact CE2-CG2 4.49Å; L53-I77 VanDerWaalsContact O-CB 3.27Å; L53-I77 WeakPolarHBondContact O-CB 3.44Å; L53-I77 PolarHBondContact O-N 3.31Å; L55-I77 HydrophobicContact CB-CD1 4.11Å; L55-I77 HydrophobicContact CB-CG1 4.18Å; I75-I77 HydrophobicContact CG2-CD1 4.25Å; I77-G79 PolarHBondContact O-N 3.04Å; I77-A80 HydrophobicContact CD1-CB 4.32Å; I77-A80 PolarHBondContact O-N 2.71Å; I77-F82 HydrophobicContact CG2-CZ 4.02Å; I77-I94 HydrophobicContact CD1-CG2 4.31Å; I77-L118 HydrophobicContact CD1-CD2 4.35Å; I77-L118 HydrophobicContact CG1-CD2 4.23Å; I77-R122 HydrophobicContact CG2-CB 3.96Å; I77-R122 WeakPolarHBondContact O-CG 3.16Å
78	H	80.8	Confident	82.6	Confident	85 Å²	85	73.7 Å²	73.7	39%	0.394	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-33.6	-172.5	-165.2	-50.8	0	0	0	114	N76	N76-H78 WeakPolarHBondContact OD1-CB 3.26Å; N76-H78 PolarHBondContact OD1-N 3.47Å
79	G	79.7	Confident	82.4	Confident	61 Å²	61	73 Å²	73	63%	0.629	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	12.9	177.2	0	0	0	0	0	114.4	I77	I77-G79 PolarHBondContact O-N 3.04Å
80	A	87.1	Confident	82.6	Confident	0 Å²	0	71 Å²	71	0%	0	39%	0.393	C	S	.	.			trans	-73.1	141.4	-170.7	0	0	0	0	0	112.9	I77 F82 I94 I95 R122	I77-A80 HydrophobicContact CD1-CB 4.32Å; I77-A80 PolarHBondContact O-N 2.71Å; A80-F82 HydrophobicContact CB-CE2 4.47Å; A80-F82 HydrophobicContact CB-CZ 4.22Å; A80-I94 HydrophobicContact CB-CG2 3.74Å; A80-I95 CarbonylContact C-O 3.57Å; A80-I95 VanDerWaalsContact CA-O 3.29Å; A80-I95 WeakPolarHBondContact CA-O 3.39Å; A80-R122 WeakPolarHBondContact O-CD 3.48Å; A80-R122 PolarHBondContact O-NH1 3.29Å
81	V	84.3	Confident	82.8	Confident	82 Å²	82	63.4 Å²	63.4	50%	0.497	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.1	171.9	-177.7	0	0	0	0	108.7	I95	V81-I95 HydrophobicContact CB-CB 4.41Å; V81-I95 PolarHBondContact N-O 3.3Å; V81-I95 PolarHBondContact O-N 3.12Å
82	F	90.4	Very high	83	Confident	24 Å²	24	61.5 Å²	61.5	11%	0.105	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.3	-177.4	-55.5	-88.1	0	0	0	110	I77 A80 S93 I94 L115 L118 Q119	I77-F82 HydrophobicContact CG2-CZ 4.02Å; A80-F82 HydrophobicContact CB-CE2 4.47Å; A80-F82 HydrophobicContact CB-CZ 4.22Å; F82-S93 CarbonylContact C-O 3.58Å; F82-S93 WeakPolarHBondContact CA-O 3.38Å; F82-I94 HydrophobicContact CD1-CD1 4.49Å; F82-I94 HydrophobicContact CD1-CG1 3.93Å; F82-I94 HydrophobicContact CD1-CG2 4.33Å; F82-I94 HydrophobicContact CE1-CD1 4.13Å; F82-I94 HydrophobicContact CE1-CG1 4.02Å; F82-I94 HydrophobicContact CE1-CG2 4.05Å; F82-L115 HydrophobicContact CB-CD2 3.83Å; F82-L115 HydrophobicContact CD1-CD2 4.01Å; F82-L115 HydrophobicContact CG-CD2 4.19Å; F82-L118 HydrophobicContact CE1-CB 3.72Å; F82-L118 HydrophobicContact CE1-CD1 4.02Å; F82-L118 HydrophobicContact CZ-CB 3.66Å; F82-Q119 HydrophobicContact CB-CG 4.47Å; F82-Q119 HydrophobicContact CD2-CG 3.39Å; F82-Q119 HydrophobicContact CE2-CB 4.46Å; F82-Q119 HydrophobicContact CE2-CG 3.67Å; F82-Q119 HydrophobicContact CG-CG 3.94Å; F82-Q119 HydrophobicContact CZ-CG 4.44Å
83	H	85	Confident	83.2	Confident	104 Å²	104	57.2 Å²	57.2	48%	0.481	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	148.2	177.3	-176.6	62.6	0	0	0	110.7	F92 S93	H83-F92 CarbonylContact O-C 3.57Å; H83-F92 WeakPolarHBondContact O-CA 3.07Å; H83-S93 PolarHBondContact N-O 3.04Å; H83-S93 PolarHBondContact O-N 3.36Å
84	I	81.3	Confident	83.4	Confident	72 Å²	72	53.7 Å²	53.7	37%	0.369	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	124.5	175.9	-52.8	174.3	0	0	0	105.8	P86 F92 M111 L115	I84-P86 WeakPolarHBondContact O-CD 3.38Å; I84-F92 HydrophobicContact CG1-CB 4.47Å; I84-M111 HydrophobicContact CG2-CE 4.49Å; I84-M111 HydrophobicContact CG2-SD 4.49Å; I84-L115 HydrophobicContact CD1-CD1 3.4Å; I84-L115 VanDerWaalsContact CD1-CD1 3.4Å; I84-L115 HydrophobicContact CG1-CD1 3.69Å
85	D	74.7	Confident	83.3	Confident	73 Å²	73	53.6 Å²	53.6	39%	0.39	30%	0.304	S	S	.	.			trans	-89.3	112.9	170.3	-171.4	-18.4	0	0	0	108	A87 E88	D85-A87 PolarHBondContact O-N 2.58Å; D85-A87 VanDerWaalsContact O-N 3.07Å; D85-A87 WeakPolarHBondContact OD1-CB 3.3Å; D85-A87 PolarHBondContact OD1-N 3.49Å; D85-E88 HydrophobicContact CB-CB 4.5Å; D85-E88 PolarHBondContact O-N 3.46Å; D85-E88 VanDerWaalsContact O-N 3.11Å
86	P	70.2	Confident	83.1	Confident	128 Å²	128	53.8 Å²	53.8	83%	0.831	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-12.8	-178.3	25.1	-32.8	0	0	0	113.7	I84	I84-P86 WeakPolarHBondContact O-CD 3.38Å
87	A	67.6	Low	82.7	Confident	72 Å²	72	57.5 Å²	57.5	60%	0.595	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-24.9	175.1	0	0	0	0	0	113.5	D85	D85-A87 PolarHBondContact O-N 2.58Å; D85-A87 VanDerWaalsContact O-N 3.07Å; D85-A87 WeakPolarHBondContact OD1-CB 3.3Å; D85-A87 PolarHBondContact OD1-N 3.49Å
88	E	74.5	Confident	82	Confident	85 Å²	85	60.9 Å²	60.9	40%	0.397	36%	0.36	S	S	.	.	S	Bend	trans	-107.1	112.8	-172.2	-68.1	-78.5	152.6	0	0	111	K14 D85 N90 Q91	K14-E88 IonicContact NZ-OE2 3.12Å; K14-E88 PolarHBondContact NZ-OE2 3.39Å; D85-E88 HydrophobicContact CB-CB 4.5Å; D85-E88 PolarHBondContact O-N 3.46Å; D85-E88 VanDerWaalsContact O-N 3.11Å; E88-N90 PolarHBondContact O-N 2.85Å; E88-Q91 HydrophobicContact CB-CB 3.87Å; E88-Q91 HydrophobicContact CB-CG 4.47Å; E88-Q91 PolarHBondContact O-N 2.87Å; E88-Q91 PolarHBondContact OE2-OE1 3.29Å
89	H	74.1	Confident	82	Confident	151 Å²	151	63.6 Å²	63.6	70%	0.699	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	130.9	-172.2	-70	64.6	0	0	0	112.3	Q91 Q104	H89-Q91 PolarHBondContact O-N 3.36Å; H89-Q104 PolarHBondContact O-NE2 2.72Å; H89-Q104 VanDerWaalsContact O-NE2 3.11Å
90	N	84.7	Confident	82.3	Confident	38 Å²	38	64.6 Å²	64.6	20%	0.203	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	59	20.4	179.7	-50.5	-21.9	0	0	0	114.4	E88 Q104 A105 E106 E108	E88-N90 PolarHBondContact O-N 2.85Å; N90-Q104 HydrophobicContact CB-CG 4.42Å; N90-Q104 CarbonylContact O-C 3.56Å; N90-Q104 WeakPolarHBondContact O-CA 3.32Å; N90-A105 VanDerWaalsContact CB-O 3.24Å; N90-A105 WeakPolarHBondContact CB-O 3.38Å; N90-A105 PolarHBondContact O-N 3.07Å; N90-E106 PolarHBondContact ND2-O 2.84Å; N90-E108 VanDerWaalsContact OD1-CA 3.29Å; N90-E108 WeakPolarHBondContact OD1-CA 3.34Å; N90-E108 WeakPolarHBondContact OD1-CB 3.26Å; N90-E108 PolarHBondContact OD1-N 3Å; N90-E108 VanDerWaalsContact OD1-N 3.15Å
91	Q	87.9	Confident	82.3	Confident	20 Å²	20	66.5 Å²	66.5	9%	0.093	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.9	-176.6	-167.3	-179.1	-75.6	0	0	112	E88 H89 I102 L103 Q104	E88-Q91 HydrophobicContact CB-CB 3.87Å; E88-Q91 HydrophobicContact CB-CG 4.47Å; E88-Q91 PolarHBondContact O-N 2.87Å; E88-Q91 PolarHBondContact OE2-OE1 3.29Å; H89-Q91 PolarHBondContact O-N 3.36Å; Q91-I102 HydrophobicContact CG-CG2 3.6Å; Q91-I102 VanDerWaalsContact NE2-CG2 3.28Å; Q91-L103 WeakPolarHBondContact CA-O 3.39Å; Q91-Q104 HydrophobicContact CB-CB 4.48Å; Q91-Q104 HydrophobicContact CB-CG 4.45Å; Q91-Q104 HydrophobicContact CG-CB 4.44Å
92	F	91.5	Very high	82.6	Confident	1 Å²	1	64.4 Å²	64.4	0%	0.004	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	148.2	174.8	65	-76.3	0	0	0	110.3	L11 H83 I84 I94 L103 M111 W114 L115	L11-F92 HydrophobicContact CD1-CZ 4.15Å; L11-F92 HydrophobicContact CD2-CE1 4.33Å; H83-F92 CarbonylContact O-C 3.57Å; H83-F92 WeakPolarHBondContact O-CA 3.07Å; I84-F92 HydrophobicContact CG1-CB 4.47Å; F92-I94 HydrophobicContact CD2-CG1 4.1Å; F92-I94 HydrophobicContact CE2-CD1 3.97Å; F92-I94 HydrophobicContact CE2-CG1 3.99Å; F92-L103 HydrophobicContact CD1-CB 4.37Å; F92-L103 WeakPolarHBondContact CD1-O 3.25Å; F92-L103 HydrophobicContact CE1-CB 3.91Å; F92-L103 HydrophobicContact CE2-CB 4.24Å; F92-L103 HydrophobicContact CE2-CD1 4.13Å; F92-L103 HydrophobicContact CZ-CB 3.84Å; F92-L103 HydrophobicContact CZ-CD1 4.09Å; F92-L103 PolarHBondContact N-O 3.45Å; F92-L103 PolarHBondContact O-N 2.87Å; F92-M111 HydrophobicContact CB-CG 4.39Å; F92-M111 HydrophobicContact CB-SD 4.47Å; F92-M111 HydrophobicContact CD1-CG 3.7Å; F92-M111 HydrophobicContact CD1-SD 4.49Å; F92-M111 HydrophobicContact CE1-CG 4.36Å; F92-M111 HydrophobicContact CG-CG 4.33Å; F92-W114 HydrophobicContact CE1-CB 4.49Å; F92-W114 HydrophobicContact CZ-CB 4Å; F92-W114 HydrophobicContact CZ-CG 4.41Å; F92-L115 HydrophobicContact CB-CD1 4.15Å; F92-L115 HydrophobicContact CB-CD2 4.18Å; F92-L115 HydrophobicContact CB-CG 4.37Å; F92-L115 HydrophobicContact CD2-CD2 3.81Å; F92-L115 HydrophobicContact CD2-CG 4.15Å; F92-L115 HydrophobicContact CG-CD1 4.46Å; F92-L115 HydrophobicContact CG-CD2 4.22Å; F92-L115 HydrophobicContact CG-CG 4.26Å
93	S	89.1	Confident	82.6	Confident	8 Å²	8	63.3 Å²	63.3	6%	0.056	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	139	172.7	67.2	0	0	0	0	112.5	F82 H83 E100 H101	F82-S93 CarbonylContact C-O 3.58Å; F82-S93 WeakPolarHBondContact CA-O 3.38Å; H83-S93 PolarHBondContact N-O 3.04Å; H83-S93 PolarHBondContact O-N 3.36Å; S93-E100 WeakPolarHBondContact CB-OE1 3.2Å; S93-E100 PolarHBondContact OG-OE1 2.8Å; S93-H101 CarbonylContact C-O 3.19Å; S93-H101 VanDerWaalsContact CA-O 3.29Å; S93-H101 WeakPolarHBondContact CA-O 3.24Å
94	I	91.3	Very high	82.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	113.9	172.5	-50.7	-179.2	0	0	0	107.3	L55 I75 I77 A80 F82 F92 H101 L103 L118	L55-I94 HydrophobicContact CD2-CD1 3.83Å; I75-I94 HydrophobicContact CG2-CG2 4.07Å; I77-I94 HydrophobicContact CD1-CG2 4.31Å; A80-I94 HydrophobicContact CB-CG2 3.74Å; F82-I94 HydrophobicContact CD1-CD1 4.49Å; F82-I94 HydrophobicContact CD1-CG1 3.93Å; F82-I94 HydrophobicContact CD1-CG2 4.33Å; F82-I94 HydrophobicContact CE1-CD1 4.13Å; F82-I94 HydrophobicContact CE1-CG1 4.02Å; F82-I94 HydrophobicContact CE1-CG2 4.05Å; F92-I94 HydrophobicContact CD2-CG1 4.1Å; F92-I94 HydrophobicContact CE2-CD1 3.97Å; F92-I94 HydrophobicContact CE2-CG1 3.99Å; I94-H101 HydrophobicContact CB-CB 4.45Å; I94-H101 PolarHBondContact N-O 2.83Å; I94-H101 WeakPolarHBondContact O-CB 3.29Å; I94-H101 PolarHBondContact O-N 2.74Å; I94-L103 HydrophobicContact CD1-CD1 3.73Å; I94-L103 HydrophobicContact CG1-CD1 4.33Å; I94-L118 HydrophobicContact CD1-CD1 4.07Å
95	I	85.9	Confident	83.2	Confident	68 Å²	68	57.5 Å²	57.5	35%	0.349	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	111.6	173.9	-55.8	171.9	0	0	0	107.6	A80 V81 K99 E100	A80-I95 CarbonylContact C-O 3.57Å; A80-I95 VanDerWaalsContact CA-O 3.29Å; A80-I95 WeakPolarHBondContact CA-O 3.39Å; V81-I95 HydrophobicContact CB-CB 4.41Å; V81-I95 PolarHBondContact N-O 3.3Å; V81-I95 PolarHBondContact O-N 3.12Å; I95-K99 WeakPolarHBondContact CA-O 2.98Å; I95-E100 HydrophobicContact CG1-CB 4.15Å; I95-E100 HydrophobicContact CG1-CG 3.97Å
96	S	86.1	Confident	83.5	Confident	5 Å²	5	60.9 Å²	60.9	4%	0.035	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	140.7	179.2	-175.6	0	0	0	0	110.7	N76 G98 K99	N76-S96 VanDerWaalsContact O-CB 3.3Å; N76-S96 WeakPolarHBondContact O-CB 3.1Å; N76-S96 PolarHBondContact O-OG 2.85Å; S96-G98 PolarHBondContact O-N 3.36Å; S96-G98 VanDerWaalsContact O-N 3.08Å; S96-K99 PolarHBondContact N-O 2.82Å; S96-K99 PolarHBondContact O-N 2.98Å; S96-K99 VanDerWaalsContact O-O 3.09Å
97	D	79.8	Confident	84	Confident	130 Å²	130	58.1 Å²	58.1	70%	0.695	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	36.1	-178.8	-57.6	-32.4	0	0	0	113.5	K99	D97-K99 PolarHBondContact O-N 3.48Å
98	G	76.6	Confident	84.5	Confident	72 Å²	72	60.3 Å²	60.3	74%	0.742	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	3.3	-178.3	0	0	0	0	0	115.5	S96	S96-G98 PolarHBondContact O-N 3.36Å; S96-G98 VanDerWaalsContact O-N 3.08Å
99	K	79.4	Confident	84.6	Confident	142 Å²	142	62.4 Å²	62.4	62%	0.617	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	131.1	177.3	-67.4	177	-176.9	170	0	110.5	I95 S96 D97	I95-K99 WeakPolarHBondContact CA-O 2.98Å; S96-K99 PolarHBondContact N-O 2.82Å; S96-K99 PolarHBondContact O-N 2.98Å; S96-K99 VanDerWaalsContact O-O 3.09Å; D97-K99 PolarHBondContact O-N 3.48Å
100	E	86.8	Confident	85	Confident	82 Å²	82	56.6 Å²	56.6	38%	0.383	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	128.2	171.5	-175	172.2	-156.5	0	0	109.7	T16 S93 I95 I102	T16-E100 VanDerWaalsContact CB-O 3.26Å; T16-E100 WeakPolarHBondContact CB-O 3.22Å; T16-E100 VanDerWaalsContact CG2-O 3.24Å; T16-E100 WeakPolarHBondContact CG2-O 2.94Å; T16-E100 PolarHBondContact OG1-O 2.78Å; S93-E100 WeakPolarHBondContact CB-OE1 3.2Å; S93-E100 PolarHBondContact OG-OE1 2.8Å; I95-E100 HydrophobicContact CG1-CB 4.15Å; I95-E100 HydrophobicContact CG1-CG 3.97Å; E100-I102 HydrophobicContact CG-CG1 4.33Å
101	H	87.6	Confident	85.3	Confident	40 Å²	40	55.3 Å²	55.3	19%	0.185	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	108.6	176.7	-63.2	-80.5	0	0	0	109.1	I75 S93 I94	I75-H101 HydrophobicContact CD1-CB 3.83Å; S93-H101 CarbonylContact C-O 3.19Å; S93-H101 VanDerWaalsContact CA-O 3.29Å; S93-H101 WeakPolarHBondContact CA-O 3.24Å; I94-H101 HydrophobicContact CB-CB 4.45Å; I94-H101 PolarHBondContact N-O 2.83Å; I94-H101 WeakPolarHBondContact O-CB 3.29Å; I94-H101 PolarHBondContact O-N 2.74Å
102	I	89.2	Confident	85.1	Confident	37 Å²	37	58.4 Å²	58.4	19%	0.19	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	118.7	178.2	-59.9	172.4	0	0	0	109.1	K14 T16 Q91 E100	K14-I102 HydrophobicContact CB-CB 4.3Å; K14-I102 HydrophobicContact CB-CG2 4.25Å; K14-I102 HydrophobicContact CD-CG2 4.3Å; K14-I102 PolarHBondContact N-O 2.88Å; K14-I102 VanDerWaalsContact N-O 3.16Å; T16-I102 HydrophobicContact CG2-CB 4.25Å; T16-I102 HydrophobicContact CG2-CD1 3.68Å; T16-I102 HydrophobicContact CG2-CG1 3.69Å; Q91-I102 HydrophobicContact CG-CG2 3.6Å; Q91-I102 VanDerWaalsContact NE2-CG2 3.28Å; E100-I102 HydrophobicContact CG-CG1 4.33Å
103	L	91.9	Very high	84.8	Confident	1 Å²	1	63 Å²	63	1%	0.005	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.6	-178.3	-59.2	176.2	0	0	0	109.9	L11 N12 Y46 L55 Q91 F92 I94	L11-L103 HydrophobicContact CD1-CB 4.41Å; L11-L103 HydrophobicContact CD1-CD1 3.99Å; N12-L103 CarbonylContact O-C 3.6Å; N12-L103 WeakPolarHBondContact O-CA 3.34Å; Y46-L103 HydrophobicContact CE1-CD2 4.26Å; Y46-L103 HydrophobicContact CE2-CD2 4.18Å; Y46-L103 WeakPolarHBondContact OH-CD2 3.33Å; L55-L103 HydrophobicContact CD2-CD1 4.32Å; Q91-L103 WeakPolarHBondContact CA-O 3.39Å; F92-L103 HydrophobicContact CD1-CB 4.37Å; F92-L103 WeakPolarHBondContact CD1-O 3.25Å; F92-L103 HydrophobicContact CE1-CB 3.91Å; F92-L103 HydrophobicContact CE2-CB 4.24Å; F92-L103 HydrophobicContact CE2-CD1 4.13Å; F92-L103 HydrophobicContact CZ-CB 3.84Å; F92-L103 HydrophobicContact CZ-CD1 4.09Å; F92-L103 PolarHBondContact N-O 3.45Å; F92-L103 PolarHBondContact O-N 2.87Å; I94-L103 HydrophobicContact CD1-CD1 3.73Å; I94-L103 HydrophobicContact CG1-CD1 4.33Å
104	Q	89.9	Confident	85	Confident	49 Å²	49	63.2 Å²	63.2	23%	0.229	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	127.2	176.4	-173.9	-177.9	18.5	0	0	110	N12 H89 N90 Q91	N12-Q104 HydrophobicContact CB-CB 4.11Å; N12-Q104 PolarHBondContact N-O 3.47Å; N12-Q104 PolarHBondContact O-N 3.4Å; H89-Q104 PolarHBondContact O-NE2 2.72Å; H89-Q104 VanDerWaalsContact O-NE2 3.11Å; N90-Q104 HydrophobicContact CB-CG 4.42Å; N90-Q104 CarbonylContact O-C 3.56Å; N90-Q104 WeakPolarHBondContact O-CA 3.32Å; Q91-Q104 HydrophobicContact CB-CB 4.48Å; Q91-Q104 HydrophobicContact CB-CG 4.45Å; Q91-Q104 HydrophobicContact CG-CB 4.44Å
105	A	89.6	Confident	84.9	Confident	5 Å²	5	63.5 Å²	63.5	4%	0.041	34%	0.34	C	S	.	.			trans	-89.8	161.8	175.8	0	0	0	0	0	111.2	L11 N90 A110 M111	L11-A105 HydrophobicContact CD2-CB 3.86Å; N90-A105 VanDerWaalsContact CB-O 3.24Å; N90-A105 WeakPolarHBondContact CB-O 3.38Å; N90-A105 PolarHBondContact O-N 3.07Å; A105-A110 HydrophobicContact CB-CB 4.1Å; A105-M111 HydrophobicContact CB-CB 3.9Å
106	E	81	Confident	84.9	Confident	145 Å²	145	66.1 Å²	66.1	68%	0.678	35%	0.351	S	S	*	.	S	Bend	trans	-71.6	-35	-178.3	-167.4	162.4	-165.2	0	0	112.3	R43 N90	R43-E106 IonicContact NH2-OE2 3.96Å; N90-E106 PolarHBondContact ND2-O 2.84Å
107	T	80	Confident	85	Confident	69 Å²	69	67.3 Å²	67.3	42%	0.423	36%	0.358	S	S	.	.	S	Bend	trans	-132	159.3	177.1	64.5	0	0	0	0	111	D109 A110 M111	T107-D109 VanDerWaalsContact C-N 3.33Å; T107-A110 PolarHBondContact O-N 2.75Å; T107-A110 WeakPolarHBondContact OG1-CB 3.47Å; T107-A110 PolarHBondContact OG1-N 3.01Å; T107-M111 PolarHBondContact O-N 2.84Å
108	E	77.7	Confident	85.6	Confident	119 Å²	119	61.1 Å²	61.1	56%	0.556	32%	0.324	S	S	*	.	H	α-helix	trans	-61.7	-42.7	175.7	-170.3	178.4	178.9	0	0	111.1	N90 A110 M111 L112	N90-E108 VanDerWaalsContact OD1-CA 3.29Å; N90-E108 WeakPolarHBondContact OD1-CA 3.34Å; N90-E108 WeakPolarHBondContact OD1-CB 3.26Å; N90-E108 PolarHBondContact OD1-N 3Å; N90-E108 VanDerWaalsContact OD1-N 3.15Å; E108-A110 VanDerWaalsContact C-N 3.28Å; E108-A110 PolarHBondContact O-N 3.39Å; E108-M111 HydrophobicContact CG-CE 4.21Å; E108-M111 WeakPolarHBondContact O-CB 3.38Å; E108-M111 PolarHBondContact O-N 2.8Å; E108-M111 VanDerWaalsContact O-N 3.11Å; E108-L112 HydrophobicContact CG-CD1 4.29Å; E108-L112 WeakPolarHBondContact O-CG 3.44Å; E108-L112 PolarHBondContact O-N 3.21Å
109	D	77.1	Confident	86.1	Confident	129 Å²	129	61.1 Å²	61.1	69%	0.69	31%	0.305	S	S	*	.	H	α-helix	trans	-58	-40.9	175.6	-67.7	-28.8	0	0	0	111.9	T107 L112 L113	T107-D109 VanDerWaalsContact C-N 3.33Å; D109-L112 PolarHBondContact O-N 3.37Å; D109-L113 WeakPolarHBondContact O-CB 3.33Å; D109-L113 PolarHBondContact O-N 2.79Å
110	A	82.3	Confident	86.4	Confident	29 Å²	29	56.6 Å²	56.6	24%	0.24	29%	0.289	C	S	.	.	H	α-helix	trans	-66.4	-42.6	176.1	0	0	0	0	0	111.4	A105 T107 E108 L112 L113 W114	A105-A110 HydrophobicContact CB-CB 4.1Å; T107-A110 PolarHBondContact O-N 2.75Å; T107-A110 WeakPolarHBondContact OG1-CB 3.47Å; T107-A110 PolarHBondContact OG1-N 3.01Å; E108-A110 VanDerWaalsContact C-N 3.28Å; E108-A110 PolarHBondContact O-N 3.39Å; A110-L112 PolarHBondContact O-N 3.49Å; A110-L113 PolarHBondContact O-N 2.87Å; A110-W114 PolarHBondContact O-N 2.96Å
111	M	89.9	Confident	86.3	Confident	11 Å²	11	56.2 Å²	56.2	5%	0.054	29%	0.285	C	S	.	.	H	α-helix	trans	-57.9	-48.5	174.5	177.6	-173.9	70.3	0	0	111.3	I84 F92 A105 T107 E108 L113 W114 L115	I84-M111 HydrophobicContact CG2-CE 4.49Å; I84-M111 HydrophobicContact CG2-SD 4.49Å; F92-M111 HydrophobicContact CB-CG 4.39Å; F92-M111 HydrophobicContact CB-SD 4.47Å; F92-M111 HydrophobicContact CD1-CG 3.7Å; F92-M111 HydrophobicContact CD1-SD 4.49Å; F92-M111 HydrophobicContact CE1-CG 4.36Å; F92-M111 HydrophobicContact CG-CG 4.33Å; A105-M111 HydrophobicContact CB-CB 3.9Å; T107-M111 PolarHBondContact O-N 2.84Å; E108-M111 HydrophobicContact CG-CE 4.21Å; E108-M111 WeakPolarHBondContact O-CB 3.38Å; E108-M111 PolarHBondContact O-N 2.8Å; E108-M111 VanDerWaalsContact O-N 3.11Å; M111-L113 VanDerWaalsContact C-N 3.33Å; M111-L113 PolarHBondContact O-N 2.81Å; M111-W114 PolarHBondContact O-N 3.24Å; M111-L115 HydrophobicContact CG-CD1 3.97Å; M111-L115 WeakPolarHBondContact O-CG 3.42Å; M111-L115 PolarHBondContact O-N 2.92Å
112	L	84.5	Confident	86.3	Confident	85 Å²	85	56.9 Å²	56.9	45%	0.445	29%	0.286	S	S	.	.	H	α-helix	trans	-64.2	-38.5	-179.9	-69	174.2	0	0	0	111.7	E108 D109 A110 L115 H116	E108-L112 HydrophobicContact CG-CD1 4.29Å; E108-L112 WeakPolarHBondContact O-CG 3.44Å; E108-L112 PolarHBondContact O-N 3.21Å; D109-L112 PolarHBondContact O-N 3.37Å; A110-L112 PolarHBondContact O-N 3.49Å; L112-L115 PolarHBondContact O-N 2.83Å; L112-H116 VanDerWaalsContact O-CB 3.24Å; L112-H116 WeakPolarHBondContact O-CB 2.94Å; L112-H116 PolarHBondContact O-N 2.77Å
113	L	85.2	Confident	86	Confident	96 Å²	96	58.4 Å²	58.4	50%	0.503	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-47.6	174.3	-176.4	69	0	0	0	111.7	L7 D109 A110 M111 L115 H116 V117	L7-L113 HydrophobicContact CD1-CD2 4.33Å; L7-L113 HydrophobicContact CD1-CG 4.42Å; D109-L113 WeakPolarHBondContact O-CB 3.33Å; D109-L113 PolarHBondContact O-N 2.79Å; A110-L113 PolarHBondContact O-N 2.87Å; M111-L113 VanDerWaalsContact C-N 3.33Å; M111-L113 PolarHBondContact O-N 2.81Å; L113-L115 PolarHBondContact O-N 3.1Å; L113-H116 PolarHBondContact O-N 2.88Å; L113-V117 HydrophobicContact CD1-CG2 4.36Å; L113-V117 WeakPolarHBondContact O-CG2 3.33Å; L113-V117 PolarHBondContact O-N 2.87Å
114	W	92.7	Very high	85.4	Confident	13 Å²	13	62.7 Å²	62.7	5%	0.049	31%	0.314	C	S	.	.	H	α-helix	trans	-57.7	-49.2	176.3	-86.1	106.3	0	0	0	111.5	L7 L11 F48 L55 F92 A110 M111 L118	L7-W114 HydrophobicContact CD2-CD2 3.93Å; L7-W114 HydrophobicContact CD2-CE3 3.33Å; L7-W114 HydrophobicContact CD2-CH2 4.26Å; L7-W114 HydrophobicContact CD2-CZ3 3.52Å; L7-W114 HydrophobicContact CG-CD2 4.27Å; L7-W114 HydrophobicContact CG-CE3 3.92Å; L7-W114 HydrophobicContact CG-CH2 4Å; L7-W114 HydrophobicContact CG-CZ2 4.35Å; L7-W114 HydrophobicContact CG-CZ3 3.76Å; L11-W114 HydrophobicContact CD1-CD2 4.1Å; L11-W114 HydrophobicContact CD1-CE3 4.49Å; L11-W114 HydrophobicContact CD1-CZ2 4.11Å; L11-W114 HydrophobicContact CG-CZ2 4.4Å; F48-W114 HydrophobicContact CB-CZ3 4.33Å; L55-W114 HydrophobicContact CD1-CE3 4.48Å; L55-W114 HydrophobicContact CD1-CH2 4.07Å; L55-W114 HydrophobicContact CD1-CZ3 3.53Å; F92-W114 HydrophobicContact CE1-CB 4.49Å; F92-W114 HydrophobicContact CZ-CB 4Å; F92-W114 HydrophobicContact CZ-CG 4.41Å; A110-W114 PolarHBondContact O-N 2.96Å; M111-W114 PolarHBondContact O-N 3.24Å; W114-L118 HydrophobicContact CE3-CD1 4.03Å; W114-L118 HydrophobicContact CE3-CG 4.34Å; W114-L118 WeakPolarHBondContact O-CB 3.3Å; W114-L118 WeakPolarHBondContact O-CG 3.49Å; W114-L118 PolarHBondContact O-N 3.47Å
115	L	90.6	Very high	84.8	Confident	7 Å²	7	60.8 Å²	60.8	4%	0.037	31%	0.307	C	S	.	.	H	α-helix	trans	-62.7	-45.8	179.4	-77.5	165.5	0	0	0	112.2	F82 I84 F92 M111 L112 L113 V117 Q119	F82-L115 HydrophobicContact CB-CD2 3.83Å; F82-L115 HydrophobicContact CD1-CD2 4.01Å; F82-L115 HydrophobicContact CG-CD2 4.19Å; I84-L115 HydrophobicContact CD1-CD1 3.4Å; I84-L115 VanDerWaalsContact CD1-CD1 3.4Å; I84-L115 HydrophobicContact CG1-CD1 3.69Å; F92-L115 HydrophobicContact CB-CD1 4.15Å; F92-L115 HydrophobicContact CB-CD2 4.18Å; F92-L115 HydrophobicContact CB-CG 4.37Å; F92-L115 HydrophobicContact CD2-CD2 3.81Å; F92-L115 HydrophobicContact CD2-CG 4.15Å; F92-L115 HydrophobicContact CG-CD1 4.46Å; F92-L115 HydrophobicContact CG-CD2 4.22Å; F92-L115 HydrophobicContact CG-CG 4.26Å; M111-L115 HydrophobicContact CG-CD1 3.97Å; M111-L115 WeakPolarHBondContact O-CG 3.42Å; M111-L115 PolarHBondContact O-N 2.92Å; L112-L115 PolarHBondContact O-N 2.83Å; L113-L115 PolarHBondContact O-N 3.1Å; L115-V117 PolarHBondContact O-N 2.92Å; L115-Q119 WeakPolarHBondContact O-CB 3.45Å; L115-Q119 WeakPolarHBondContact O-CG 3.25Å; L115-Q119 PolarHBondContact O-N 3.26Å
116	H	86	Confident	84	Confident	122 Å²	122	63.5 Å²	63.5	57%	0.565	32%	0.322	S	S	*	.	H	α-helix	trans	-60.2	-48.9	-178.9	179.8	64.9	0	0	0	111.7	L112 L113 T120	L112-H116 VanDerWaalsContact O-CB 3.24Å; L112-H116 WeakPolarHBondContact O-CB 2.94Å; L112-H116 PolarHBondContact O-N 2.77Å; L113-H116 PolarHBondContact O-N 2.88Å; H116-T120 VanDerWaalsContact O-CB 3.25Å; H116-T120 WeakPolarHBondContact O-CB 3.34Å; H116-T120 PolarHBondContact O-N 2.92Å; H116-T120 PolarHBondContact O-OG1 3.45Å
117	V	87.6	Confident	83.2	Confident	30 Å²	30	62.8 Å²	62.8	18%	0.182	32%	0.319	C	S	.	.	H	α-helix	trans	-67.8	-47.9	-178.3	176.3	0	0	0	0	111.2	L7 F48 L113 L115 Q119 T120 R121	L7-V117 HydrophobicContact CD2-CB 3.79Å; L7-V117 HydrophobicContact CD2-CG1 3.77Å; L7-V117 HydrophobicContact CD2-CG2 4.33Å; F48-V117 HydrophobicContact CD1-CG1 4.49Å; L113-V117 HydrophobicContact CD1-CG2 4.36Å; L113-V117 WeakPolarHBondContact O-CG2 3.33Å; L113-V117 PolarHBondContact O-N 2.87Å; L115-V117 PolarHBondContact O-N 2.92Å; V117-Q119 PolarHBondContact O-N 2.91Å; V117-T120 PolarHBondContact O-N 2.79Å; V117-R121 HydrophobicContact CG1-CG 4.43Å; V117-R121 WeakPolarHBondContact O-CG 3.47Å; V117-R121 PolarHBondContact O-N 2.82Å
118	L	91.3	Very high	82.4	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.5	-40.9	-178.3	-67.3	175.4	0	0	0	112.2	F48 L55 I77 F82 I94 W114 R122	F48-L118 HydrophobicContact CB-CD2 4.28Å; F48-L118 HydrophobicContact CD1-CD2 4.16Å; F48-L118 HydrophobicContact CD2-CD2 3.39Å; F48-L118 HydrophobicContact CE1-CD2 4.35Å; F48-L118 HydrophobicContact CE2-CD2 3.65Å; F48-L118 HydrophobicContact CG-CD2 3.67Å; F48-L118 HydrophobicContact CZ-CD2 4.11Å; L55-L118 HydrophobicContact CD2-CD1 4.23Å; I77-L118 HydrophobicContact CD1-CD2 4.35Å; I77-L118 HydrophobicContact CG1-CD2 4.23Å; F82-L118 HydrophobicContact CE1-CB 3.72Å; F82-L118 HydrophobicContact CE1-CD1 4.02Å; F82-L118 HydrophobicContact CZ-CB 3.66Å; I94-L118 HydrophobicContact CD1-CD1 4.07Å; W114-L118 HydrophobicContact CE3-CD1 4.03Å; W114-L118 HydrophobicContact CE3-CG 4.34Å; W114-L118 WeakPolarHBondContact O-CB 3.3Å; W114-L118 WeakPolarHBondContact O-CG 3.49Å; W114-L118 PolarHBondContact O-N 3.47Å; L118-R122 WeakPolarHBondContact O-CB 3.32Å; L118-R122 PolarHBondContact O-N 2.72Å
119	Q	88.7	Confident	81.4	Confident	72 Å²	72	60.2 Å²	60.2	34%	0.336	31%	0.314	S	S	.	.	H	α-helix	trans	-67.2	-43.7	176.3	-73.9	176.3	-3.5	0	0	112.1	F82 L115 V117 R122 N123	F82-Q119 HydrophobicContact CB-CG 4.47Å; F82-Q119 HydrophobicContact CD2-CG 3.39Å; F82-Q119 HydrophobicContact CE2-CB 4.46Å; F82-Q119 HydrophobicContact CE2-CG 3.67Å; F82-Q119 HydrophobicContact CG-CG 3.94Å; F82-Q119 HydrophobicContact CZ-CG 4.44Å; L115-Q119 WeakPolarHBondContact O-CB 3.45Å; L115-Q119 WeakPolarHBondContact O-CG 3.25Å; L115-Q119 PolarHBondContact O-N 3.26Å; V117-Q119 PolarHBondContact O-N 2.91Å; Q119-R122 PolarHBondContact O-N 2.66Å; Q119-N123 WeakPolarHBondContact O-CB 3.41Å; Q119-N123 PolarHBondContact O-N 2.82Å; Q119-N123 PolarHBondContact O-ND2 2.91Å; Q119-N123 PolarHBondContact O-OD1 3.45Å
120	T	84.7	Confident	80	Confident	47 Å²	47	60.7 Å²	60.7	29%	0.288	31%	0.312	S	S	.	.	H	α-helix	trans	-61.4	-49	-179.5	-59.2	0	0	0	0	110.4	H116 V117 R122 N123 E124	H116-T120 VanDerWaalsContact O-CB 3.25Å; H116-T120 WeakPolarHBondContact O-CB 3.34Å; H116-T120 PolarHBondContact O-N 2.92Å; H116-T120 PolarHBondContact O-OG1 3.45Å; V117-T120 PolarHBondContact O-N 2.79Å; T120-R122 PolarHBondContact O-N 2.91Å; T120-N123 PolarHBondContact O-N 3.46Å; T120-N123 VanDerWaalsContact O-N 3.15Å; T120-E124 WeakPolarHBondContact O-CG 3.06Å; T120-E124 PolarHBondContact O-N 3.46Å
121	R	84	Confident	78.2	Confident	74 Å²	74	63 Å²	63	28%	0.279	33%	0.327	S	S	.	.	H	α-helix	trans	-68	-35.2	179.6	-62.6	-48	-171.1	89.2	10.1	113.3	F48 E50 L53 V117 E124 A125	F48-R121 HydrophobicContact CE1-CB 3.97Å; F48-R121 HydrophobicContact CE1-CG 3.86Å; F48-R121 HydrophobicContact CZ-CB 3.88Å; F48-R121 HydrophobicContact CZ-CG 4.31Å; E50-R121 IonicContact OE1-CZ 2.62Å; E50-R121 VanDerWaalsContact OE1-CZ 3.31Å; E50-R121 IonicContact OE1-NH1 2.92Å; E50-R121 PolarHBondContact OE1-NH1 2.86Å; E50-R121 IonicContact OE1-NH2 2.9Å; E50-R121 PolarHBondContact OE1-NH2 3.3Å; E50-R121 IonicContact OE2-CZ 3.96Å; E50-R121 IonicContact OE2-NH1 3.29Å; E50-R121 PolarHBondContact OE2-NH1 2.89Å; E50-R121 IonicContact OE2-NH2 2.69Å; E50-R121 PolarHBondContact OE2-NH2 2.48Å; L53-R121 HydrophobicContact CD2-CB 4.09Å; V117-R121 HydrophobicContact CG1-CG 4.43Å; V117-R121 WeakPolarHBondContact O-CG 3.47Å; V117-R121 PolarHBondContact O-N 2.82Å; R121-E124 WeakPolarHBondContact CD-OE2 3.49Å; R121-E124 IonicContact NE-OE2 2.77Å; R121-E124 PolarHBondContact O-N 3.37Å; R121-A125 WeakPolarHBondContact O-CB 3.11Å; R121-A125 PolarHBondContact O-N 3.36Å
122	R	88.3	Confident	75.8	Confident	55 Å²	55	69 Å²	69	21%	0.208	36%	0.359	C	S	.	.	H	α-helix	trans	-58.9	-47.4	169.3	-177.8	-159.6	66.8	-177.6	0.3	111.2	I77 A80 L118 Q119 T120 E124 A125 V126	I77-R122 HydrophobicContact CG2-CB 3.96Å; I77-R122 WeakPolarHBondContact O-CG 3.16Å; A80-R122 WeakPolarHBondContact O-CD 3.48Å; A80-R122 PolarHBondContact O-NH1 3.29Å; L118-R122 WeakPolarHBondContact O-CB 3.32Å; L118-R122 PolarHBondContact O-N 2.72Å; Q119-R122 PolarHBondContact O-N 2.66Å; T120-R122 PolarHBondContact O-N 2.91Å; R122-E124 VanDerWaalsContact C-N 3.34Å; R122-E124 PolarHBondContact O-N 3.05Å; R122-A125 WeakPolarHBondContact O-CB 3.35Å; R122-A125 PolarHBondContact O-N 2.84Å; R122-V126 WeakPolarHBondContact O-CG2 3.16Å; R122-V126 PolarHBondContact O-N 3.08Å
123	N	82.9	Confident	73.5	Confident	69 Å²	69	71.7 Å²	71.7	37%	0.369	37%	0.373	S	S	.	.	H	α-helix	trans	-64.9	-39.5	-177.3	-67.6	-13.8	0	0	0	111.7	Q119 T120 V126 Q127	Q119-N123 WeakPolarHBondContact O-CB 3.41Å; Q119-N123 PolarHBondContact O-N 2.82Å; Q119-N123 PolarHBondContact O-ND2 2.91Å; Q119-N123 PolarHBondContact O-OD1 3.45Å; T120-N123 PolarHBondContact O-N 3.46Å; T120-N123 VanDerWaalsContact O-N 3.15Å; N123-V126 PolarHBondContact O-N 3.29Å; N123-Q127 WeakPolarHBondContact O-CG 3.26Å; N123-Q127 PolarHBondContact O-N 3.3Å
124	E	79.6	Confident	70.9	Confident	90 Å²	90	72.4 Å²	72.4	42%	0.421	39%	0.387	S	S	.	.	H	α-helix	trans	-62.1	-40.6	173.7	-71.5	171.3	-179.7	0	0	112.1	T120 R121 R122 Q127 T128	T120-E124 WeakPolarHBondContact O-CG 3.06Å; T120-E124 PolarHBondContact O-N 3.46Å; R121-E124 WeakPolarHBondContact CD-OE2 3.49Å; R121-E124 IonicContact NE-OE2 2.77Å; R121-E124 PolarHBondContact O-N 3.37Å; R122-E124 VanDerWaalsContact C-N 3.34Å; R122-E124 PolarHBondContact O-N 3.05Å; E124-Q127 PolarHBondContact O-N 3.46Å; E124-T128 WeakPolarHBondContact O-CG2 3.38Å; E124-T128 PolarHBondContact O-N 2.97Å; E124-T128 PolarHBondContact O-OG1 2.89Å
125	A	76.1	Confident	67.9	Low	9 Å²	9	77 Å²	77	7%	0.074	42%	0.421	C	S	.	.	H	α-helix	trans	-64.3	-41.7	176	0	0	0	0	0	112.7	L53 R121 R122 Q127 T128 S129	L53-A125 HydrophobicContact CD1-CB 3.31Å; L53-A125 HydrophobicContact CD2-CB 4.11Å; L53-A125 HydrophobicContact CG-CB 4.36Å; R121-A125 WeakPolarHBondContact O-CB 3.11Å; R121-A125 PolarHBondContact O-N 3.36Å; R122-A125 WeakPolarHBondContact O-CB 3.35Å; R122-A125 PolarHBondContact O-N 2.84Å; A125-Q127 VanDerWaalsContact C-N 3.34Å; A125-Q127 PolarHBondContact O-N 3.01Å; A125-T128 WeakPolarHBondContact CA-OG1 3.36Å; A125-T128 PolarHBondContact O-N 3.3Å; A125-T128 PolarHBondContact O-OG1 2.96Å; A125-S129 PolarHBondContact O-N 2.95Å; A125-S129 VanDerWaalsContact O-N 3.11Å
126	V	73.1	Confident	65.4	Low	62 Å²	62	81.8 Å²	81.8	38%	0.376	45%	0.452	S	S	.	.	H	α-helix	trans	-63.8	-41.5	176	174	0	0	0	0	110.6	R122 N123 S129	R122-V126 WeakPolarHBondContact O-CG2 3.16Å; R122-V126 PolarHBondContact O-N 3.08Å; N123-V126 PolarHBondContact O-N 3.29Å; V126-S129 PolarHBondContact O-OG 2.87Å
127	Q	65.1	Low	62.8	Low	131 Å²	131	83.5 Å²	83.5	61%	0.612	47%	0.465	S	S	*	.	H	α-helix	trans	-66.5	-39.3	178	-73.1	179	7.3	0	0	113.3	N123 E124 A125 E130	N123-Q127 WeakPolarHBondContact O-CG 3.26Å; N123-Q127 PolarHBondContact O-N 3.3Å; E124-Q127 PolarHBondContact O-N 3.46Å; A125-Q127 VanDerWaalsContact C-N 3.34Å; A125-Q127 PolarHBondContact O-N 3.01Å; Q127-E130 PolarHBondContact O-N 3.32Å
128	T	63.9	Low	59.9	Low	80 Å²	80	89.9 Å²	89.9	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-70.3	-34	178.8	43.5	0	0	0	0	112.7	E124 A125 E130 S131	E124-T128 WeakPolarHBondContact O-CG2 3.38Å; E124-T128 PolarHBondContact O-N 2.97Å; E124-T128 PolarHBondContact O-OG1 2.89Å; A125-T128 WeakPolarHBondContact CA-OG1 3.36Å; A125-T128 PolarHBondContact O-N 3.3Å; A125-T128 PolarHBondContact O-OG1 2.96Å; T128-E130 PolarHBondContact O-N 3.35Å; T128-S131 PolarHBondContact O-N 3Å; T128-S131 VanDerWaalsContact O-N 3.15Å; T128-S131 PolarHBondContact O-OG 3.25Å
129	S	55.6	Low	57	Low	54 Å²	54	97.5 Å²	97.5	38%	0.378	54%	0.54	S	S	.	.	H	α-helix	trans	-66	-20.6	174.1	71.3	0	0	0	0	114	A125 V126 N133	A125-S129 PolarHBondContact O-N 2.95Å; A125-S129 VanDerWaalsContact O-N 3.11Å; V126-S129 PolarHBondContact O-OG 2.87Å; S129-N133 PolarHBondContact O-ND2 2.85Å
130	E	48.2	Very low	54.2	Low	139 Å²	139	99.1 Å²	99.1	65%	0.65	56%	0.559	S	S	*	*	H	α-helix	trans	-81.4	-23.1	173.8	-71.5	-170.3	163.2	0	0	113.1	Q127 T128	Q127-E130 PolarHBondContact O-N 3.32Å; T128-E130 PolarHBondContact O-N 3.35Å
131	S	44.9	Very low	51.3	Low	78 Å²	78	104.7 Å²	104.7	55%	0.545	59%	0.586	S	S	.	*	H	α-helix	trans	-87.1	-27.7	-177	56.1	0	0	0	0	115	T128	T128-S131 PolarHBondContact O-N 3Å; T128-S131 VanDerWaalsContact O-N 3.15Å; T128-S131 PolarHBondContact O-OG 3.25Å
132	D	39.7	Very low	48.7	Very low	137 Å²	137	107.1 Å²	107.1	73%	0.733	61%	0.609	S	S	*	*	S	Bend	trans	-93.2	-2.4	-172.4	-74.7	-10.8	0	0	0	115	S134	D132-S134 VanDerWaalsContact C-N 3.31Å; D132-S134 PolarHBondContact O-N 3.04Å; D132-S134 VanDerWaalsContact O-N 3.08Å
133	N	34.4	Very low	46	Very low	140 Å²	140	111.8 Å²	111.8	75%	0.749	64%	0.638	S	S	*	*			trans	-88.6	68.9	174.5	-75.8	-42.7	0	0	0	111.5	S129	S129-N133 PolarHBondContact O-ND2 2.85Å
134	S	31.2	Very low	43.4	Very low	111 Å²	111	117.9 Å²	117.9	78%	0.776	66%	0.657	S	S	*	*			trans	-124.4	58.4	164.5	61.7	0	0	0	0	111.4	D132	D132-S134 VanDerWaalsContact C-N 3.31Å; D132-S134 PolarHBondContact O-N 3.04Å; D132-S134 VanDerWaalsContact O-N 3.08Å
135	S	30.9	Very low	40.9	Very low	110 Å²	110	122.6 Å²	122.6	77%	0.769	68%	0.677	S	S	*	*			trans	-133	124	162.3	176.4	0	0	0	0	107.5
136	P	37.7	Very low	38.6	Very low	107 Å²	107	129.5 Å²	129.5	70%	0.695	71%	0.711	S	S	*	*			trans	-85	147	-175.3	33.7	-30	0	0	0	110.5
137	N	30	Very low	36.6	Very low	158 Å²	158	136.2 Å²	136.2	85%	0.845	74%	0.736	S	S	*	*			trans	99	81.2	176.8	-52.8	-17.7	0	0	0	114.3
138	D	28.7	Very low	34.7	Very low	165 Å²	165	139.8 Å²	139.8	88%	0.882	74%	0.744	S	S	*	*				-156.1	123.1	119.6	-130.9	-14.2	0	0	0	110.2	S140	D138-S140 PolarHBondContact O-N 2.93Å
139	D	29.9	Very low	33.1	Very low	160 Å²	160	144.7 Å²	144.7	86%	0.856	76%	0.761	S	S	*	*			trans	-78.5	99.2	-179.3	-84.5	-35.7	0	0	0	109.8
140	S	29.2	Very low	31.9	Very low	105 Å²	105	149.9 Å²	149.9	73%	0.734	78%	0.784	S	S	*	*			trans	-146.1	96.7	152.9	73	0	0	0	0	110.4	D138 T142	D138-S140 PolarHBondContact O-N 2.93Å; S140-T142 PolarHBondContact O-N 2.93Å
141	L	24.9	Very low	30.9	Very low	164 Å²	164	148.1 Å²	148.1	86%	0.859	79%	0.787	S	S	*	*			trans	-52.3	129.1	175.1	-74.3	95.6	0	0	0	111.8
142	T	29.3	Very low	29.9	Very low	125 Å²	125	151.9 Å²	151.9	77%	0.767	80%	0.801	S	S	*	*			trans	-140.7	136	153.7	0.9	0	0	0	0	108.9	S140 Y144	S140-T142 PolarHBondContact O-N 2.93Å; T142-Y144 PolarHBondContact O-N 2.86Å
143	D	31.1	Very low	29.2	Very low	153 Å²	153	153.7 Å²	153.7	82%	0.818	81%	0.807	S	S	*	*	S	Bend	trans	-56.3	15.4	-158.4	-79.9	-39.8	0	0	0	119.1	K145	D143-K145 PolarHBondContact O-N 3.05Å
144	Y	27.7	Very low	28.7	Very low	197 Å²	197	156.8 Å²	156.8	77%	0.773	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-6.7	-171	-98	-87.5	0	0	0	116.5	T142	T142-Y144 PolarHBondContact O-N 2.86Å
145	K	27.9	Very low	28.3	Very low	190 Å²	190	159.8 Å²	159.8	83%	0.826	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-4.5	-179.1	-82.3	-173.5	176.9	177.3	0	116.7	D143 F147	D143-K145 PolarHBondContact O-N 3.05Å; K145-F147 PolarHBondContact O-N 3.03Å
146	L	27.5	Very low	28	Very low	153 Å²	153	163.3 Å²	163.3	80%	0.801	82%	0.822	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-11.3	-177.3	-150.6	75.1	0	0	0	114.9
147	F	30.6	Very low	27.2	Very low	203 Å²	203	167.4 Å²	167.4	89%	0.89	83%	0.834	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-5.1	-172.9	-106.2	-83.7	0	0	0	116.7	K145	K145-F147 PolarHBondContact O-N 3.03Å
148	R	26.6	Very low	26.8	Very low	207 Å²	207	164.5 Å²	164.5	78%	0.781	83%	0.826	S	S	*	*	S	Bend	trans	-101.7	-10.3	-178.2	-118.5	-172.3	-172.9	-173.2	3.3	115.9	N150	R148-N150 PolarHBondContact O-N 2.94Å
149	Q	29.1	Very low	26.6	Very low	182 Å²	182	164.6 Å²	164.6	85%	0.85	83%	0.825	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-3.5	-175.1	-109.9	-176.1	-3.2	0	0	116
150	N	30.7	Very low	26.3	Very low	163 Å²	163	162.5 Å²	162.5	87%	0.872	82%	0.82	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	10.5	-178.3	-81.2	-16.8	0	0	0	115.8	R148	R148-N150 PolarHBondContact O-N 2.94Å
151	S	27.3	Very low	25.9	Very low	102 Å²	102	163.7 Å²	163.7	71%	0.713	82%	0.823	S	S	*	*	S	Bend	trans	-99.8	12.9	-178.4	77.5	0	0	0	0	115.6
152	L	23.5	Very low	25.8	Very low	158 Å²	158	167.4 Å²	167.4	83%	0.827	83%	0.826	S	S	*	*			trans	-130.2	48.9	-175.2	-121.5	151.1	0	0	0	113
153	M	26.1	Very low	25.4	Very low	175 Å²	175	166.1 Å²	166.1	86%	0.862	83%	0.828	S	S	*	*			trans	-109.8	103.7	154.3	-94.7	-160.7	162.9	0	0	109.8	M155	M153-M155 PolarHBondContact O-N 2.78Å
154	K	23.7	Very low	25	Very low	205 Å²	205	163.6 Å²	163.6	89%	0.891	82%	0.822	S	S	*	*			trans	-50	107.4	158.3	-80.9	173.5	172.9	173	0	108.2
155	M	21.9	Very low	24.9	Very low	173 Å²	173	160.3 Å²	160.3	85%	0.852	83%	0.825	S	S	*	*			trans	-123.3	111.7	161.4	-94.1	-166.4	143.9	0	0	109.9	M153 M157	M153-M155 PolarHBondContact O-N 2.78Å; M155-M157 PolarHBondContact O-N 2.87Å
156	Q	23.7	Very low	24.5	Very low	184 Å²	184	158.1 Å²	158.1	86%	0.86	82%	0.821	S	S	*	*			trans	-47.8	127.9	168.6	-78.8	158	-76.1	0	0	110.4	S158	Q156-S158 PolarHBondContact O-N 2.8Å
157	M	21.5	Very low	24.3	Very low	193 Å²	193	157.9 Å²	157.9	95%	0.951	82%	0.819	S	S	*	*			trans	-56	95.8	164.7	-68.6	-74.4	174.9	0	0	109	M155	M155-M157 PolarHBondContact O-N 2.87Å
158	S	22.5	Very low	24	Very low	98 Å²	98	153.4 Å²	153.4	69%	0.685	81%	0.813	S	S	*	*			trans	-119.9	120.3	162.6	50.3	0	0	0	0	106.8	Q156 P160	Q156-S158 PolarHBondContact O-N 2.8Å; S158-P160 VanDerWaalsContact O-CD 3.24Å; S158-P160 WeakPolarHBondContact O-CD 3.43Å
159	I	23.6	Very low	23.7	Very low	166 Å²	166	148.7 Å²	148.7	85%	0.851	81%	0.812	S	S	*	*			trans	-71.2	126.4	-175.2	-61.8	160	0	0	0	108.6
160	P	24	Very low	23.5	Very low	116 Å²	116	147.6 Å²	147.6	75%	0.753	81%	0.812	S	S	*	*			trans	-123.2	116	159.8	17.8	6	0	0	0	110.8	S158	S158-P160 VanDerWaalsContact O-CD 3.24Å; S158-P160 WeakPolarHBondContact O-CD 3.43Å
161	T	21	Very low	23.1	Very low	130 Å²	130	144.8 Å²	144.8	80%	0.798	80%	0.804	S	S	*	*			trans	-37.9	132.7	155.8	27.3	0	0	0	0	115.4
162	R	21.4	Very low	23	Very low	242 Å²	242	147.5 Å²	147.5	91%	0.913	81%	0.811	S	S	*	*			trans	43.8	106	136	-167	179.9	-176.9	178.7	1	117.7
163	A	23	Very low	22.8	Very low	99 Å²	99	149.3 Å²	149.3	82%	0.818	82%	0.815	S	S	*	*			trans	-152	115.6	143.5	0	0	0	0	0	110.3
164	S	21.5	Very low	22.7	Very low	100 Å²	100	145.8 Å²	145.8	70%	0.699	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-65.3	131.3	170.8	37.1	0	0	0	0	111.9
165	P	25.5	Very low	22.6	Very low	128 Å²	128	141.3 Å²	141.3	83%	0.831	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-90.7	123.8	166.8	32.5	-25.9	0	0	0	110.2
166	I	20.5	Very low	22.7	Very low	144 Å²	144	142.2 Å²	142.2	74%	0.738	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-94.9	152.6	170.3	-50.4	177.5	0	0	0	107
167	I	22.3	Very low	22.5	Very low	148 Å²	148	140.3 Å²	140.3	76%	0.759	80%	0.797	S	S	*	*			trans	90.2	105.2	157.1	-43.6	178.2	0	0	0	115.4
168	S	23.7	Very low	22.7	Very low	109 Å²	109	138.6 Å²	138.6	76%	0.762	79%	0.792	S	S	*	*				-174.9	129.7	85.6	21.3	0	0	0	0	110.7
169	S	21.4	Very low	22.7	Very low	108 Å²	108	141.5 Å²	141.5	76%	0.755	80%	0.8	S	S	*	*			trans	-66.7	131.3	164	47.6	0	0	0	0	110.7
170	D	25.2	Very low	22.7	Very low	159 Å²	159	137.1 Å²	137.1	85%	0.85	80%	0.796	S	S	*	*			trans	-134.9	104	152.1	-93.9	-26.3	0	0	0	108.9
171	S	21.7	Very low	22.6	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	80%	0.796	S	S	*	*			trans	-72.7	124.3	164.3	47.4	0	0	0	0	109.3
172	N	24.3	Very low	22.6	Very low	160 Å²	160	138.7 Å²	138.7	86%	0.856	80%	0.8	S	S	*	*			trans	-142.7	100.4	154.1	-90.5	-33.9	0	0	0	109.1
173	E	20.4	Very low	22.7	Very low	196 Å²	196	138.6 Å²	138.6	92%	0.916	80%	0.8	S	S	*	*			trans	-61.9	129.9	159.6	-67.2	177.1	144.2	0	0	109.4
174	S	23.9	Very low	22.7	Very low	100 Å²	100	139 Å²	139	70%	0.699	80%	0.797	S	S	*	*			trans	-151.6	101.6	148.3	66.3	0	0	0	0	109.7	F176	S174-F176 PolarHBondContact O-N 3Å
175	S	21.7	Very low	22.7	Very low	112 Å²	112	146.4 Å²	146.4	78%	0.783	81%	0.809	S	S	*	*			trans	-45	125	162.7	48.8	0	0	0	0	112.9
176	F	23	Very low	22.7	Very low	191 Å²	191	149.5 Å²	149.5	84%	0.838	81%	0.81	S	S	*	*			trans	-130.9	93.9	152.6	-94.4	-80.8	0	0	0	109.3	S174	S174-F176 PolarHBondContact O-N 3Å
177	N	21.2	Very low	22.8	Very low	144 Å²	144	148.4 Å²	148.4	77%	0.77	82%	0.815	S	S	*	*			trans	-63.9	129	156	-95.4	-24	0	0	0	108.2
178	N	24.4	Very low	22.9	Very low	158 Å²	158	146.9 Å²	146.9	85%	0.845	82%	0.817	S	S	*	*			trans	-148.9	112	147.4	-104.6	-20.4	0	0	0	111.1	G180	N178-G180 PolarHBondContact O-N 2.85Å
179	N	22.3	Very low	22.9	Very low	159 Å²	159	147.1 Å²	147.1	85%	0.85	82%	0.819	S	S	*	*			trans	-62.3	119.9	174.2	-71.8	-40.5	0	0	0	111.1
180	G	24	Very low	23	Very low	73 Å²	73	151 Å²	151	75%	0.753	83%	0.825	S	S	*	*			trans	-111.5	85.3	165.7	0	0	0	0	0	110.3	N178 L182	N178-G180 PolarHBondContact O-N 2.85Å; G180-L182 PolarHBondContact O-N 3.07Å
181	S	23	Very low	23	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	83%	0.826	S	S	*	*			trans	-57.6	121	179.3	175.9	0	0	0	0	112.5	R183	S181-R183 PolarHBondContact O-N 3.32Å
182	L	21.1	Very low	23.2	Very low	170 Å²	170	155.4 Å²	155.4	89%	0.89	83%	0.834	S	S	*	*			trans	-66	114.5	164.6	-84.5	93.6	0	0	0	110	G180	G180-L182 PolarHBondContact O-N 3.07Å
183	R	23	Very low	23.3	Very low	241 Å²	241	155 Å²	155	91%	0.909	83%	0.831	S	S	*	*			trans	-88.8	111.3	167.4	-104.8	-179	173.9	-177.4	-1	110.6	S181	S181-R183 PolarHBondContact O-N 3.32Å
184	S	23.2	Very low	23.6	Very low	106 Å²	106	153.3 Å²	153.3	74%	0.741	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-54.8	126.9	168.2	56.7	0	0	0	0	112.9
185	R	21.8	Very low	23.8	Very low	257 Å²	257	158.2 Å²	158.2	97%	0.97	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-97	117.1	166.4	-116.6	175.1	177	163.3	-1.8	109.2
186	K	24.1	Very low	24	Very low	193 Å²	193	160.8 Å²	160.8	84%	0.839	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-73	146.8	-178.3	-74.7	179.5	172.9	-179.7	0	112.2
187	S	23	Very low	24.1	Very low	120 Å²	120	159 Å²	159	84%	0.839	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-62.9	137.5	167.7	42.6	0	0	0	0	113.1
188	S	23.8	Very low	24.3	Very low	117 Å²	117	161.9 Å²	161.9	82%	0.818	84%	0.844	S	S	*	*			trans	-156.6	83.6	165.3	61.9	0	0	0	0	110.7
189	S	23.9	Very low	24.3	Very low	113 Å²	113	163 Å²	163	79%	0.79	85%	0.845	S	S	*	*			trans	-154.8	54.5	165.2	53.2	0	0	0	0	111.1
190	H	24.5	Very low	24.4	Very low	190 Å²	190	164.2 Å²	164.2	88%	0.88	85%	0.85	S	S	*	*			trans	-138.5	71.9	172.7	-93.5	-1.2	0	0	0	110.2
191	Q	25.1	Very low	24.3	Very low	187 Å²	187	165.5 Å²	165.5	87%	0.874	85%	0.848	S	S	*	*			trans	-145.4	9.2	172	-82.6	-158.4	-14.4	0	0	117.7
192	N	26.2	Very low	24.4	Very low	168 Å²	168	166.8 Å²	166.8	90%	0.898	84%	0.844	S	S	*	*	S	Bend	trans	-127	23	-175.2	-87	-13.3	0	0	0	118
193	L	24.9	Very low	24.5	Very low	150 Å²	150	164.7 Å²	164.7	79%	0.785	83%	0.834	S	S	*	*	S	Bend	trans	-117	-9	171.5	-139	85	0	0	0	115.9	K195	L193-K195 VanDerWaalsContact C-N 3.3Å; L193-K195 PolarHBondContact O-N 2.93Å
194	N	27.2	Very low	24.5	Very low	162 Å²	162	161.2 Å²	161.2	87%	0.866	83%	0.828	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	27.7	-179.6	-83.3	-13.2	0	0	0	114.7
195	K	28.1	Very low	24.5	Very low	203 Å²	203	165.4 Å²	165.4	88%	0.883	84%	0.838	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.1	8.5	174	-104.9	-175.3	179	-179	0	115.8	L193	L193-K195 VanDerWaalsContact C-N 3.3Å; L193-K195 PolarHBondContact O-N 2.93Å
196	L	27	Very low	24.6	Very low	166 Å²	166	160.2 Å²	160.2	87%	0.869	83%	0.83	S	S	*	*	S	Bend	trans	-117.4	6.4	176.5	-130.4	90.2	0	0	0	116
197	I	25.4	Very low	24.6	Very low	153 Å²	153	158.7 Å²	158.7	79%	0.785	83%	0.831	S	S	*	*	S	Bend	trans	-116.1	43.6	-179.5	-48.5	-178.4	0	0	0	110.9
198	K	24.3	Very low	24.7	Very low	204 Å²	204	161.4 Å²	161.4	89%	0.887	83%	0.83	S	S	*	*	S	Bend	trans	-140.8	28.1	176.9	-121.5	-175.5	-173.2	-175.2	0	115.1
199	Q	24.6	Very low	24.7	Very low	182 Å²	182	165.2 Å²	165.2	85%	0.85	84%	0.835	S	S	*	*			trans	-150.2	40.3	-175.4	-136.4	170.9	6.4	0	0	116.7
200	L	23.5	Very low	24.6	Very low	185 Å²	185	164.2 Å²	164.2	97%	0.969	83%	0.828	S	S	*	*			trans	-138.9	90.7	158.6	-74.5	173.6	0	0	0	109.3
201	S	23.4	Very low	24.6	Very low	99 Å²	99	165.8 Å²	165.8	69%	0.692	83%	0.828	S	S	*	*			trans	-110.7	124.1	176.7	163.8	0	0	0	0	107.6
202	I	24.1	Very low	24.5	Very low	136 Å²	136	163 Å²	163	70%	0.697	82%	0.819	S	S	*	*			trans	56.4	114.2	138.4	-52.8	169.3	0	0	0	117.2
203	D	23.8	Very low	24.4	Very low	126 Å²	126	161.6 Å²	161.6	67%	0.674	81%	0.811	S	S	*	*				176.5	130.6	109.3	-100.4	-40.2	0	0	0	114
204	Q	23	Very low	24.3	Very low	168 Å²	168	162.2 Å²	162.2	79%	0.785	82%	0.816	S	S	*	*			trans	47.4	119.7	137.2	-63.5	170.9	36	0	0	121.3
205	M	22.9	Very low	24.1	Very low	194 Å²	194	162.1 Å²	162.1	96%	0.956	81%	0.81	S	S	*	*				-159	107.1	128.2	-109.3	176.1	145.3	0	0	110.9
206	N	23.3	Very low	23.8	Very low	148 Å²	148	160.1 Å²	160.1	79%	0.791	81%	0.808	S	S	*	*			trans	-68.5	144.9	160.1	-75.9	-33.1	0	0	0	109.2
207	D	25.7	Very low	23.7	Very low	162 Å²	162	159.6 Å²	159.6	87%	0.866	81%	0.805	S	S	*	*				-171.3	140.2	119.8	-96.4	-24.8	0	0	0	113
208	H	24.2	Very low	23.6	Very low	176 Å²	176	157 Å²	157	82%	0.815	79%	0.792	S	S	*	*			trans	-66.9	147.5	-178.4	-73.4	-94.4	0	0	0	113.1
209	Q	23.3	Very low	23.6	Very low	197 Å²	197	151.9 Å²	151.9	92%	0.921	77%	0.774	S	S	*	*				-163	124.1	124.7	-106.6	175.9	29.3	0	0	112.1
210	S	23.2	Very low	23.6	Very low	93 Å²	93	146.2 Å²	146.2	65%	0.65	75%	0.747	S	S	*	*			trans	-60.3	147.6	169.6	51.1	0	0	0	0	113
211	Y	23.5	Very low	23.7	Very low	222 Å²	222	143.7 Å²	143.7	87%	0.871	74%	0.74	S	S	*	*				-164.7	139.5	123.2	-106.3	-75.8	0	0	0	112
212	N	22.9	Very low	23.7	Very low	130 Å²	130	143 Å²	143	70%	0.695	74%	0.735	S	S	*	*			trans	-45.1	139	-171.9	-73.7	-34.3	0	0	0	120
213	N	23.6	Very low	23.7	Very low	137 Å²	137	141 Å²	141	73%	0.733	73%	0.726	S	S	*	*				27.6	122.3	124	-66.6	-15.8	0	0	0	118.5
214	N	23.5	Very low	23.5	Very low	164 Å²	164	144.8 Å²	144.8	88%	0.877	73%	0.73	S	S	*	*				-154.9	132.1	111.9	-91.4	-25.9	0	0	0	111.4
215	H	23.5	Very low	23.5	Very low	159 Å²	159	142.2 Å²	142.2	74%	0.736	72%	0.721	S	S	*	*			trans	-37.5	144.2	169	-84.2	-102.2	0	0	0	114.3
216	L	22.6	Very low	23.4	Very low	162 Å²	162	135.9 Å²	135.9	85%	0.848	70%	0.696	S	S	*	*				-175.7	151.6	114.7	-94.6	145.9	0	0	0	112.8
217	L	23.1	Very low	23.5	Very low	154 Å²	154	131.8 Å²	131.8	81%	0.806	68%	0.677	S	S	*	*			trans	-55.5	145.3	-164.6	-85.2	68.9	0	0	0	117.2
218	I	23.6	Very low	23.4	Very low	99 Å²	99	129.4 Å²	129.4	51%	0.508	66%	0.663	S	S	.	*			trans	-108.3	129.4	176.1	-66.5	167.9	0	0	0	109.2
219	D	24.8	Very low	23.2	Very low	96 Å²	96	128.2 Å²	128.2	51%	0.513	66%	0.663	S	S	.	*			trans	-112.7	159.7	179.4	-112.7	-29.3	0	0	0	113.9
220	H	24.7	Very low	23.3	Very low	63 Å²	63	127.5 Å²	127.5	29%	0.292	66%	0.659	S	S	.	*			trans	-80.7	134.8	-144.7	-70.4	-108	0	0	0	117.5	T1395 Y1418	H220-T1395 WeakPolarHBondContact CE1-CB 3.42Å; H220-T1395 WeakPolarHBondContact CE1-CG2 3.46Å; H220-T1395 VanDerWaalsContact NE2-CB 3.29Å; H220-T1395 WeakPolarHBondContact NE2-CB 3.38Å; H220-T1395 WeakPolarHBondContact NE2-CG2 3.3Å; H220-Y1418 WeakPolarHBondContact CA-OH 3.35Å; H220-Y1418 AromaticContact CD2-CE2 3.78Å; H220-Y1418 AromaticContact CE1-CD2 3.17Å; H220-Y1418 WeakPolarHBondContact CE1-CD2 3.44Å; H220-Y1418 AromaticContact CE1-CE1 3.9Å; H220-Y1418 AromaticContact CE1-CE2 2.74Å; H220-Y1418 WeakPolarHBondContact CE1-CE2 3.39Å; H220-Y1418 AromaticContact CE1-CG 3.95Å; H220-Y1418 AromaticContact CE1-CZ 3.14Å; H220-Y1418 AromaticContact CG-CE2 3.74Å; H220-Y1418 AromaticContact CG-CZ 3.69Å; H220-Y1418 VanDerWaalsContact CG-OH 3.22Å; H220-Y1418 AromaticContact ND1-CD2 3.94Å; H220-Y1418 AromaticContact ND1-CE1 3.73Å; H220-Y1418 AromaticContact ND1-CE2 3.13Å; H220-Y1418 WeakPolarHBondContact ND1-CE2 3.48Å; H220-Y1418 AromaticContact ND1-CZ 2.96Å; H220-Y1418 PolarHBondContact ND1-OH 2.88Å; H220-Y1418 AromaticContact NE2-CD2 3.65Å; H220-Y1418 AromaticContact NE2-CE2 3.16Å; H220-Y1418 WeakPolarHBondContact NE2-CE2 3.48Å; H220-Y1418 AromaticContact NE2-CZ 3.88Å
221	T	24.8	Very low	23.3	Very low	133 Å²	133	128.5 Å²	128.5	82%	0.816	67%	0.666	S	S	*	*			trans	-104.8	141.6	168.9	51.5	0	0	0	0	113.4
222	S	23.1	Very low	23.2	Very low	84 Å²	84	126.3 Å²	126.3	59%	0.587	67%	0.666	S	S	*	*			trans	-81.5	153.3	-176	39.8	0	0	0	0	113.2	W224	S222-W224 PolarHBondContact O-N 2.82Å
223	L	24.3	Very low	23.2	Very low	95 Å²	95	128.1 Å²	128.1	50%	0.497	68%	0.676	S	S	.	*			trans	-66.3	93.9	-169.2	-66.3	161.4	0	0	0	113.3	R1082	L223-R1082 VanDerWaalsContact CD2-NH2 3.3Å
224	W	21	Very low	23.2	Very low	204 Å²	204	128.2 Å²	128.2	77%	0.773	68%	0.682	S	S	*	*			trans	-90.9	119.7	163.5	-78.2	78.7	0	0	0	110.9	S222 K1057	S222-W224 PolarHBondContact O-N 2.82Å; W224-K1057 VanDerWaalsContact O-CD 3.24Å; W224-K1057 WeakPolarHBondContact O-CD 3.3Å; W224-K1057 WeakPolarHBondContact O-CE 3.42Å; W224-K1057 PolarHBondContact O-NZ 2.84Å
225	I	22.6	Very low	23.2	Very low	114 Å²	114	125.9 Å²	125.9	59%	0.585	68%	0.678	S	S	*	*			trans	-82	113.5	-179.1	-58	175.4	0	0	0	108.8	R776 M1099	I225-R776 PolarHBondContact O-NH1 2.81Å; I225-M1099 HydrophobicContact CD1-CE 3.99Å; I225-M1099 HydrophobicContact CG1-CE 3.97Å; I225-M1099 HydrophobicContact CG2-CE 4.3Å
226	S	20.7	Very low	23.2	Very low	61 Å²	61	123.9 Å²	123.9	43%	0.427	68%	0.682	S	S	.	*			trans	-89.9	143.2	172.5	49.9	0	0	0	0	111.3	R776	S226-R776 PolarHBondContact O-NH1 2.86Å
227	P	24.8	Very low	23.2	Very low	63 Å²	63	121.8 Å²	121.8	41%	0.409	68%	0.681	S	S	.	*			trans	-83	142.6	171.8	25.8	-23.9	0	0	0	109.3	R776	P227-R776 VanDerWaalsContact CA-NH2 3.32Å; P227-R776 HydrophobicContact CB-CG 3.81Å; P227-R776 VanDerWaalsContact CB-NE 3.28Å; P227-R776 HydrophobicContact CG-CB 3.84Å; P227-R776 HydrophobicContact CG-CG 3.52Å; P227-R776 VanDerWaalsContact N-CZ 3.29Å
228	I	24.3	Very low	23.3	Very low	111 Å²	111	119.6 Å²	119.6	57%	0.569	68%	0.678	S	S	*	*			trans	-110.8	134.9	167	-64.9	172.5	0	0	0	107	L1058	I228-L1058 HydrophobicContact CD1-CD2 3.83Å; I228-L1058 HydrophobicContact CG1-CD2 4.45Å
229	D	20.2	Very low	23.3	Very low	152 Å²	152	120.2 Å²	120.2	81%	0.813	69%	0.692	S	S	*	*			trans	-59.3	138.2	-175.6	-69.5	-48.6	0	0	0	113.4
230	H	25.6	Very low	23.2	Very low	182 Å²	182	122.1 Å²	122.1	84%	0.843	71%	0.707	S	S	*	*			trans	-118.9	95.4	165.4	-80.3	-57.8	0	0	0	109.4
231	S	21.8	Very low	23.1	Very low	113 Å²	113	125.3 Å²	125.3	79%	0.79	73%	0.731	S	S	*	*			trans	-87.3	112.3	157.8	58.7	0	0	0	0	108.3
232	M	22.5	Very low	23.1	Very low	177 Å²	177	123.9 Å²	123.9	87%	0.872	73%	0.726	S	S	*	*			trans	-140.9	114.6	161.7	-81.7	-136	150.2	0	0	111.7
233	N	22.2	Very low	23.1	Very low	168 Å²	168	126.8 Å²	126.8	90%	0.898	74%	0.741	S	S	*	*			trans	-58.6	124.5	165.1	-76.4	-31.1	0	0	0	110.5
234	T	23.5	Very low	23.1	Very low	139 Å²	139	127.1 Å²	127.1	85%	0.853	75%	0.747	S	S	*	*			trans	-113.3	102.2	161.2	52.8	0	0	0	0	109.1
235	S	23.3	Very low	23.3	Very low	115 Å²	115	125.2 Å²	125.2	80%	0.804	75%	0.752	S	S	*	*			trans	-63.6	127.8	176.1	46.5	0	0	0	0	112.4
236	S	22.8	Very low	23.4	Very low	117 Å²	117	128.6 Å²	128.6	82%	0.818	76%	0.758	S	S	*	*			trans	-50.1	122.3	168.3	52.7	0	0	0	0	113.5
237	S	24.1	Very low	23.7	Very low	117 Å²	117	132.4 Å²	132.4	82%	0.818	77%	0.774	S	S	*	*			trans	-102.3	100.2	164.1	58.2	0	0	0	0	110	S239	S237-S239 PolarHBondContact O-N 2.69Å
238	S	23.5	Very low	23.8	Very low	109 Å²	109	137 Å²	137	76%	0.762	79%	0.794	S	S	*	*			trans	-71.2	114.1	171.1	51.8	0	0	0	0	110.8
239	S	23.6	Very low	23.9	Very low	112 Å²	112	138.7 Å²	138.7	78%	0.783	80%	0.802	S	S	*	*			trans	-88.4	104.7	170	43.8	0	0	0	0	110.2	S237 T241	S237-S239 PolarHBondContact O-N 2.69Å; S239-T241 PolarHBondContact O-N 2.78Å
240	T	23	Very low	24.1	Very low	135 Å²	135	141 Å²	141	83%	0.828	80%	0.799	S	S	*	*			trans	-71.6	107.9	169.6	46	0	0	0	0	110
241	T	23.6	Very low	24.2	Very low	130 Å²	130	142.4 Å²	142.4	80%	0.798	80%	0.797	S	S	*	*			trans	-88.7	117.6	166.7	38.8	0	0	0	0	109.6	S239 T243	S239-T241 PolarHBondContact O-N 2.78Å; T241-T243 PolarHBondContact O-N 3.34Å
242	S	24	Very low	24.4	Very low	104 Å²	104	145.2 Å²	145.2	73%	0.727	80%	0.802	S	S	*	*			trans	-59.8	127.1	175.9	48.3	0	0	0	0	111.9	T244	S242-T244 PolarHBondContact O-N 2.65Å
243	T	24.1	Very low	24.4	Very low	145 Å²	145	140.8 Å²	140.8	89%	0.89	79%	0.789	S	S	*	*			trans	-60.5	98.5	171.8	31.8	0	0	0	0	112	T241	T241-T243 PolarHBondContact O-N 3.34Å
244	T	24.1	Very low	24.5	Very low	101 Å²	101	142.9 Å²	142.9	62%	0.62	79%	0.785	S	S	*	*			trans	-104	103.5	164	51.7	0	0	0	0	109.9	S242 Y246	S242-T244 PolarHBondContact O-N 2.65Å; T244-Y246 VanDerWaalsContact O-CD2 3.23Å; T244-Y246 WeakPolarHBondContact O-CD2 3.08Å; T244-Y246 PolarHBondContact O-N 2.58Å
245	N	25	Very low	24.5	Very low	164 Å²	164	143.1 Å²	143.1	88%	0.877	78%	0.782	S	S	*	*			trans	14.5	71.2	152.9	-87.9	-23	0	0	0	117.8
246	Y	23.7	Very low	24.6	Very low	185 Å²	185	147.7 Å²	147.7	73%	0.725	78%	0.781	S	S	*	*			trans	-94.6	8.9	170.1	-94.1	-76.7	0	0	0	114.4	T244 L248	T244-Y246 VanDerWaalsContact O-CD2 3.23Å; T244-Y246 WeakPolarHBondContact O-CD2 3.08Å; T244-Y246 PolarHBondContact O-N 2.58Å; Y246-L248 VanDerWaalsContact C-N 3.33Å; Y246-L248 PolarHBondContact O-N 2.81Å
247	D	28	Very low	24.6	Very low	141 Å²	141	147.4 Å²	147.4	75%	0.754	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-7.5	179.6	-93.4	-20.2	0	0	0	115
248	L	27.4	Very low	24.7	Very low	159 Å²	159	149.1 Å²	149.1	83%	0.832	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-9.6	176.7	-98	155.4	0	0	0	114.8	Y246	Y246-L248 VanDerWaalsContact C-N 3.33Å; Y246-L248 PolarHBondContact O-N 2.81Å
249	M	25	Very low	24.9	Very low	148 Å²	148	148.7 Å²	148.7	73%	0.729	78%	0.776	S	S	*	*	S	Bend	trans	-93.5	-6.1	174.9	-92.9	-104.9	-114.5	0	0	114	R251	M249-R251 VanDerWaalsContact C-N 3.28Å; M249-R251 PolarHBondContact O-N 2.82Å
250	R	26	Very low	25.2	Very low	201 Å²	201	154.5 Å²	154.5	76%	0.758	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	0.8	177.1	-137.6	179.6	-158.8	-170.1	4.5	114.6
251	R	26.3	Very low	25.4	Very low	210 Å²	210	152.1 Å²	152.1	79%	0.792	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	2	-176	-78.8	-170	177.8	-179.2	0.4	116.7	M249	M249-R251 VanDerWaalsContact C-N 3.28Å; M249-R251 PolarHBondContact O-N 2.82Å
252	L	25.7	Very low	26	Very low	172 Å²	172	149.1 Å²	149.1	90%	0.901	75%	0.749	S	S	*	*	S	Bend	trans	-124.6	16	179.1	-73.2	174.8	0	0	0	115.8
253	S	23.1	Very low	26.6	Very low	85 Å²	85	148.6 Å²	148.6	59%	0.594	74%	0.738	S	S	*	*			trans	-127.6	45	171.6	71.3	0	0	0	0	112.5	N255	S253-N255 PolarHBondContact O-N 3.36Å
254	Y	23.6	Very low	27.1	Very low	211 Å²	211	147.2 Å²	147.2	83%	0.827	72%	0.724	S	S	*	*			trans	-83.9	71.8	155.1	-82.4	-82.6	0	0	0	107.7	R256	Y254-R256 PolarHBondContact O-N 2.75Å; Y254-R256 VanDerWaalsContact O-N 3.13Å
255	N	23.6	Very low	27.6	Very low	145 Å²	145	148.2 Å²	148.2	78%	0.775	72%	0.724	S	S	*	*			trans	-55.4	117.9	158.9	-86.2	-30.6	0	0	0	106.2	S253 S257	S253-N255 PolarHBondContact O-N 3.36Å; N255-S257 PolarHBondContact O-N 3.14Å
256	R	25.5	Very low	28.1	Very low	210 Å²	210	146 Å²	146	79%	0.792	71%	0.707	S	S	*	*			trans	-41.3	109	172.6	-75.5	177.5	174.3	179.3	-2.3	107.8	Y254 N258	Y254-R256 PolarHBondContact O-N 2.75Å; Y254-R256 VanDerWaalsContact O-N 3.13Å; R256-N258 PolarHBondContact O-N 3.07Å
257	S	24.5	Very low	28.6	Very low	111 Å²	111	143 Å²	143	78%	0.776	70%	0.699	S	S	*	*			trans	-50.5	115.6	169.6	44.2	0	0	0	0	106.8	N255 S259	N255-S257 PolarHBondContact O-N 3.14Å; S257-S259 PolarHBondContact O-N 2.79Å
258	N	25.4	Very low	28.9	Very low	154 Å²	154	142.3 Å²	142.3	82%	0.824	69%	0.691	S	S	*	*			trans	-32.5	104.4	179.2	-69.6	-27	0	0	0	110	R256 Y260	R256-N258 PolarHBondContact O-N 3.07Å; N258-Y260 PolarHBondContact O-N 3.27Å; N258-Y260 VanDerWaalsContact O-N 3.16Å
259	S	28.6	Very low	29.3	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	67%	0.674	S	S	*	*			trans	-57.5	123.3	163.3	59.1	0	0	0	0	105.5	S257 D261	S257-S259 PolarHBondContact O-N 2.79Å; S259-D261 PolarHBondContact O-N 3.1Å
260	Y	28	Very low	29.9	Very low	235 Å²	235	135.8 Å²	135.8	92%	0.922	66%	0.663	S	S	*	*			trans	-50.1	106.2	171.9	-89.6	-93.3	0	0	0	107.6	N258 S262	N258-Y260 PolarHBondContact O-N 3.27Å; N258-Y260 VanDerWaalsContact O-N 3.16Å; Y260-S262 PolarHBondContact O-N 2.89Å; Y260-S262 VanDerWaalsContact O-N 3.07Å
261	D	28.4	Very low	30.3	Very low	85 Å²	85	129.6 Å²	129.6	46%	0.455	65%	0.645	S	S	.	*			trans	-69.3	111.2	-168.4	-159.7	-12.8	0	0	0	107.1	S259 D263 I264	S259-D261 PolarHBondContact O-N 3.1Å; D261-D263 PolarHBondContact O-N 3.19Å; D261-D263 WeakPolarHBondContact OD1-CB 3.3Å; D261-D263 PolarHBondContact OD1-N 3.46Å; D261-I264 HydrophobicContact CB-CD1 4.27Å; D261-I264 HydrophobicContact CB-CG1 4.23Å; D261-I264 PolarHBondContact O-N 3.12Å
262	S	35.3	Very low	30.6	Very low	66 Å²	66	124.6 Å²	124.6	46%	0.462	63%	0.633	S	S	.	*	H	α-helix	trans	-55.4	-19.5	173.7	170.7	0	0	0	0	110.9	Y260 I264 I265 K266	Y260-S262 PolarHBondContact O-N 2.89Å; Y260-S262 VanDerWaalsContact O-N 3.07Å; S262-I264 VanDerWaalsContact C-N 3.33Å; S262-I265 PolarHBondContact O-N 2.72Å; S262-K266 WeakPolarHBondContact O-CB 3.26Å; S262-K266 PolarHBondContact O-N 2.83Å
263	D	36.5	Very low	31	Very low	94 Å²	94	121.2 Å²	121.2	50%	0.503	62%	0.616	S	S	.	*	H	α-helix	trans	-71.7	-25.1	175.6	-68.7	-18.1	0	0	0	112.2	D261 Q267	D261-D263 PolarHBondContact O-N 3.19Å; D261-D263 WeakPolarHBondContact OD1-CB 3.3Å; D261-D263 PolarHBondContact OD1-N 3.46Å; D263-Q267 WeakPolarHBondContact O-CA 3.32Å; D263-Q267 WeakPolarHBondContact O-CB 3.45Å; D263-Q267 PolarHBondContact O-N 2.81Å
264	I	35.2	Very low	31.6	Very low	115 Å²	115	120.8 Å²	120.8	59%	0.59	61%	0.606	S	S	*	*	H	α-helix	trans	-70.1	-35.4	172.9	-64.8	172.3	0	0	0	110.7	D261 S262 H268	D261-I264 HydrophobicContact CB-CD1 4.27Å; D261-I264 HydrophobicContact CB-CG1 4.23Å; D261-I264 PolarHBondContact O-N 3.12Å; S262-I264 VanDerWaalsContact C-N 3.33Å; I264-H268 WeakPolarHBondContact O-CB 3.3Å; I264-H268 PolarHBondContact O-N 3.13Å
265	I	34	Very low	32	Very low	122 Å²	122	116.2 Å²	116.2	63%	0.626	60%	0.595	S	S	*	*	H	α-helix	trans	-78.3	-38.7	175.5	-60.7	178.8	0	0	0	111	S262 Q267 H268 V269	S262-I265 PolarHBondContact O-N 2.72Å; I265-Q267 VanDerWaalsContact C-N 3.29Å; I265-Q267 PolarHBondContact O-N 3.33Å; I265-H268 PolarHBondContact O-N 3.3Å; I265-V269 HydrophobicContact CG2-CG2 4.32Å; I265-V269 WeakPolarHBondContact O-CB 3.28Å; I265-V269 VanDerWaalsContact O-CG2 3.3Å; I265-V269 WeakPolarHBondContact O-CG2 3.36Å; I265-V269 PolarHBondContact O-N 3.43Å
266	K	35.8	Very low	32.4	Very low	119 Å²	119	114.3 Å²	114.3	52%	0.517	59%	0.585	S	S	.	*	H	α-helix	trans	-66.5	-32.4	172.8	-78.7	-178.9	179.6	174.4	0	112.1	S262 N270	S262-K266 WeakPolarHBondContact O-CB 3.26Å; S262-K266 PolarHBondContact O-N 2.83Å; K266-N270 WeakPolarHBondContact O-CB 3.47Å; K266-N270 PolarHBondContact O-N 2.95Å; K266-N270 PolarHBondContact O-ND2 3Å
267	Q	35.6	Very low	32.8	Very low	121 Å²	121	108.2 Å²	108.2	57%	0.565	57%	0.568	S	S	*	*	H	α-helix	trans	-75.8	-33.6	174.2	-160.9	164.9	13.3	0	0	110.6	D263 I265 D271	D263-Q267 WeakPolarHBondContact O-CA 3.32Å; D263-Q267 WeakPolarHBondContact O-CB 3.45Å; D263-Q267 PolarHBondContact O-N 2.81Å; I265-Q267 VanDerWaalsContact C-N 3.29Å; I265-Q267 PolarHBondContact O-N 3.33Å; Q267-D271 WeakPolarHBondContact O-CA 3.49Å; Q267-D271 WeakPolarHBondContact O-CB 3.27Å; Q267-D271 PolarHBondContact O-N 3.02Å
268	H	33.7	Very low	33.4	Very low	126 Å²	126	109.6 Å²	109.6	58%	0.583	56%	0.56	S	S	*	*	H	α-helix	trans	-70.8	-36.4	171.3	-130.8	54.4	0	0	0	113.4	I264 I265 L272	I264-H268 WeakPolarHBondContact O-CB 3.3Å; I264-H268 PolarHBondContact O-N 3.13Å; I265-H268 PolarHBondContact O-N 3.3Å; H268-L272 VanDerWaalsContact O-CB 3.31Å; H268-L272 WeakPolarHBondContact O-CB 3.35Å; H268-L272 WeakPolarHBondContact O-CD1 3.37Å; H268-L272 WeakPolarHBondContact O-CG 2.87Å; H268-L272 PolarHBondContact O-N 2.77Å
269	V	35.7	Very low	33.8	Very low	77 Å²	77	105.1 Å²	105.1	47%	0.467	54%	0.541	S	S	.	.	H	α-helix	trans	-73.1	-36.2	174.8	173.4	0	0	0	0	111.1	I265 N273	I265-V269 HydrophobicContact CG2-CG2 4.32Å; I265-V269 WeakPolarHBondContact O-CB 3.28Å; I265-V269 VanDerWaalsContact O-CG2 3.3Å; I265-V269 WeakPolarHBondContact O-CG2 3.36Å; I265-V269 PolarHBondContact O-N 3.43Å; V269-N273 WeakPolarHBondContact O-CB 3.49Å; V269-N273 PolarHBondContact O-N 3.38Å; V269-N273 PolarHBondContact O-ND2 3.12Å
270	N	37.4	Very low	34	Very low	93 Å²	93	105.3 Å²	105.3	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-74.5	-32.9	172.2	-78.5	-20.5	0	0	0	112.4	K266 N273 I274	K266-N270 WeakPolarHBondContact O-CB 3.47Å; K266-N270 PolarHBondContact O-N 2.95Å; K266-N270 PolarHBondContact O-ND2 3Å; N270-N273 CarbonylContact O-C 3.47Å; N270-N273 PolarHBondContact O-N 2.76Å; N270-I274 HydrophobicContact CB-CD1 4.34Å; N270-I274 WeakPolarHBondContact O-CB 3.26Å; N270-I274 WeakPolarHBondContact O-CD1 3.45Å; N270-I274 WeakPolarHBondContact O-CG1 3.29Å; N270-I274 PolarHBondContact O-N 3.06Å
271	D	33.9	Very low	34.3	Very low	71 Å²	71	100 Å²	100	38%	0.38	52%	0.515	S	S	.	.	H	α-helix	trans	-71.7	-35.7	175.8	-73.5	-21.1	0	0	0	110.6	Q267 I274 I275	Q267-D271 WeakPolarHBondContact O-CA 3.49Å; Q267-D271 WeakPolarHBondContact O-CB 3.27Å; Q267-D271 PolarHBondContact O-N 3.02Å; D271-I274 PolarHBondContact O-N 2.98Å; D271-I275 WeakPolarHBondContact O-CB 3.05Å; D271-I275 WeakPolarHBondContact O-CD1 3.37Å; D271-I275 WeakPolarHBondContact O-CG1 3.43Å; D271-I275 PolarHBondContact O-N 2.88Å
272	L	32.6	Very low	34.5	Very low	106 Å²	106	102.3 Å²	102.3	56%	0.555	53%	0.526	S	S	*	.	H	α-helix	trans	-68.1	-35.4	170.9	-77.8	163.3	0	0	0	112.6	H268 N276	H268-L272 VanDerWaalsContact O-CB 3.31Å; H268-L272 WeakPolarHBondContact O-CB 3.35Å; H268-L272 WeakPolarHBondContact O-CD1 3.37Å; H268-L272 WeakPolarHBondContact O-CG 2.87Å; H268-L272 PolarHBondContact O-N 2.77Å; L272-N276 PolarHBondContact O-N 3.36Å
273	N	34.2	Very low	34.3	Very low	100 Å²	100	106 Å²	106	54%	0.535	54%	0.54	S	S	.	.	H	α-helix	trans	-77.6	-30.2	174	-76.2	-25.2	0	0	0	113.2	V269 N270 N276 D277	V269-N273 WeakPolarHBondContact O-CB 3.49Å; V269-N273 PolarHBondContact O-N 3.38Å; V269-N273 PolarHBondContact O-ND2 3.12Å; N270-N273 CarbonylContact O-C 3.47Å; N270-N273 PolarHBondContact O-N 2.76Å; N273-N276 PolarHBondContact O-N 2.5Å; N273-D277 WeakPolarHBondContact O-CB 3.47Å; N273-D277 PolarHBondContact O-N 3.27Å
274	I	35.6	Very low	34	Very low	76 Å²	76	105 Å²	105	39%	0.39	54%	0.54	S	S	.	.	H	α-helix	trans	-77.1	-31.3	176.8	-70.5	164.8	0	0	0	110.8	N270 D271 N276 D277 K278	N270-I274 HydrophobicContact CB-CD1 4.34Å; N270-I274 WeakPolarHBondContact O-CB 3.26Å; N270-I274 WeakPolarHBondContact O-CD1 3.45Å; N270-I274 WeakPolarHBondContact O-CG1 3.29Å; N270-I274 PolarHBondContact O-N 3.06Å; D271-I274 PolarHBondContact O-N 2.98Å; I274-N276 VanDerWaalsContact C-N 3.34Å; I274-D277 PolarHBondContact O-N 2.92Å; I274-K278 HydrophobicContact CG2-CD 3.85Å; I274-K278 HydrophobicContact CG2-CG 4.14Å; I274-K278 VanDerWaalsContact O-CB 3.31Å; I274-K278 WeakPolarHBondContact O-CB 3.38Å; I274-K278 PolarHBondContact O-N 2.81Å
275	I	33.1	Very low	34	Very low	116 Å²	116	108.1 Å²	108.1	60%	0.595	55%	0.55	S	S	*	.	H	α-helix	trans	-68.3	-35.1	172.9	-70.8	165.9	0	0	0	110.8	D271 S279	D271-I275 WeakPolarHBondContact O-CB 3.05Å; D271-I275 WeakPolarHBondContact O-CD1 3.37Å; D271-I275 WeakPolarHBondContact O-CG1 3.43Å; D271-I275 PolarHBondContact O-N 2.88Å; I275-S279 WeakPolarHBondContact O-CB 3.44Å; I275-S279 PolarHBondContact O-N 3.38Å; I275-S279 PolarHBondContact O-OG 3.26Å
276	N	32.6	Very low	33.8	Very low	104 Å²	104	106.6 Å²	106.6	56%	0.556	55%	0.55	S	S	*	*	H	α-helix	trans	-73.6	-33.8	173.6	-101	-10.8	0	0	0	113.3	L272 N273 I274 S279 I280	L272-N276 PolarHBondContact O-N 3.36Å; N273-N276 PolarHBondContact O-N 2.5Å; I274-N276 VanDerWaalsContact C-N 3.34Å; N276-S279 PolarHBondContact O-OG 3.35Å; N276-I280 WeakPolarHBondContact O-CG1 3.42Å
277	D	33.6	Very low	33.4	Very low	83 Å²	83	108 Å²	108	44%	0.444	56%	0.563	S	S	.	*	H	α-helix	trans	-86.8	-27.7	-177.1	-136.3	40.4	0	0	0	113.6	N273 I274 K281	N273-D277 WeakPolarHBondContact O-CB 3.47Å; N273-D277 PolarHBondContact O-N 3.27Å; I274-D277 PolarHBondContact O-N 2.92Å; D277-K281 WeakPolarHBondContact O-CB 3.44Å; D277-K281 PolarHBondContact O-N 3.31Å; D277-K281 IonicContact OD2-NZ 3.48Å; D277-K281 PolarHBondContact OD2-NZ 2.79Å
278	K	36.7	Very low	33	Very low	140 Å²	140	108.8 Å²	108.8	61%	0.609	57%	0.571	S	S	*	*	H	α-helix	trans	-76.5	-33.1	173.4	-80.7	-176	177.7	173	0	113.2	I274 I280 L282	I274-K278 HydrophobicContact CG2-CD 3.85Å; I274-K278 HydrophobicContact CG2-CG 4.14Å; I274-K278 VanDerWaalsContact O-CB 3.31Å; I274-K278 WeakPolarHBondContact O-CB 3.38Å; I274-K278 PolarHBondContact O-N 2.81Å; K278-I280 VanDerWaalsContact C-N 3.31Å; K278-L282 PolarHBondContact O-N 3.12Å; K278-L282 VanDerWaalsContact O-N 3.15Å
279	S	33.4	Very low	32.6	Very low	60 Å²	60	113.1 Å²	113.1	42%	0.42	58%	0.584	S	S	.	*	H	α-helix	trans	-70	-29.7	175.1	50.9	0	0	0	0	111.9	I275 N276	I275-S279 WeakPolarHBondContact O-CB 3.44Å; I275-S279 PolarHBondContact O-N 3.38Å; I275-S279 PolarHBondContact O-OG 3.26Å; N276-S279 PolarHBondContact O-OG 3.35Å
280	I	33.6	Very low	32.1	Very low	102 Å²	102	117.8 Å²	117.8	52%	0.523	61%	0.605	S	S	.	*	H	α-helix	trans	-84.2	-30.7	176.1	-62.6	175.5	0	0	0	112.7	N276 K278 S284	N276-I280 WeakPolarHBondContact O-CG1 3.42Å; K278-I280 VanDerWaalsContact C-N 3.31Å; I280-S284 PolarHBondContact O-OG 2.92Å; I280-S284 VanDerWaalsContact O-OG 3.07Å
281	K	34.3	Very low	31.5	Very low	124 Å²	124	120.5 Å²	120.5	54%	0.539	62%	0.618	S	S	.	*	H	α-helix	trans	-80.1	-22.1	176.3	-85.2	170.9	-178	141.5	0	115.4	D277	D277-K281 WeakPolarHBondContact O-CB 3.44Å; D277-K281 PolarHBondContact O-N 3.31Å; D277-K281 IonicContact OD2-NZ 3.48Å; D277-K281 PolarHBondContact OD2-NZ 2.79Å
282	L	31.7	Very low	31.1	Very low	134 Å²	134	124.1 Å²	124.1	70%	0.702	64%	0.638	S	S	*	*	H	α-helix	trans	-81.5	-23.4	172.8	-86.7	159.3	0	0	0	113.2	K278 S286	K278-L282 PolarHBondContact O-N 3.12Å; K278-L282 VanDerWaalsContact O-N 3.15Å; L282-S286 PolarHBondContact O-OG 3.43Å
283	L	30.4	Very low	30.7	Very low	143 Å²	143	128.5 Å²	128.5	75%	0.749	66%	0.655	S	S	*	*	H	α-helix	trans	-83.5	-10.8	173.7	-83.1	159.9	0	0	0	114.2
284	S	31.9	Very low	30	Very low	72 Å²	72	129 Å²	129	50%	0.503	67%	0.666	S	S	.	*	H	α-helix	trans	-105	-8	177.2	51.8	0	0	0	0	114.9	I280	I280-S284 PolarHBondContact O-OG 2.92Å; I280-S284 VanDerWaalsContact O-OG 3.07Å
285	K	33.9	Very low	29.4	Very low	181 Å²	181	130.6 Å²	130.6	79%	0.787	68%	0.684	S	S	*	*	S	Bend	trans	-99.9	-5.3	179.7	-90.3	-173.5	175	-177.3	0	116.4
286	S	29.5	Very low	29	Very low	91 Å²	91	130.3 Å²	130.3	64%	0.636	69%	0.693	S	S	*	*	S	Bend	trans	-97.6	-4.8	175.5	31	0	0	0	0	115	L282	L282-S286 PolarHBondContact O-OG 3.43Å
287	N	27.3	Very low	28.5	Very low	148 Å²	148	130.3 Å²	130.3	79%	0.791	70%	0.701	S	S	*	*	S	Bend	trans	-107.5	10.6	-179.2	-95.9	-3.1	0	0	0	116.4
288	N	27.5	Very low	27.9	Very low	138 Å²	138	131.2 Å²	131.2	74%	0.738	71%	0.714	S	S	*	*	S	Bend	trans	-119.9	22.4	177.8	-89.8	-20.6	0	0	0	115.4
289	Y	25.5	Very low	27.2	Very low	217 Å²	217	129.8 Å²	129.8	85%	0.851	72%	0.721	S	S	*	*	S	Bend	trans	-121.4	78.7	160.4	-88.9	-82.7	0	0	0	108.7
290	L	24.9	Very low	26.7	Very low	174 Å²	174	132 Å²	132	91%	0.911	74%	0.737	S	S	*	*			trans	-178	28.5	152.5	-97.9	154.7	0	0	0	114.3
291	I	24.8	Very low	26.1	Very low	151 Å²	151	134.1 Å²	134.1	77%	0.774	75%	0.749	S	S	*	*	S	Bend	trans	-107.7	88.2	156.4	-58.3	176.3	0	0	0	106.5
292	N	25.3	Very low	25.7	Very low	146 Å²	146	136 Å²	136	78%	0.781	77%	0.765	S	S	*	*			trans	159.9	85.2	153	-84.1	-20.1	0	0	0	108.4
293	Q	24.1	Very low	25.3	Very low	198 Å²	198	139 Å²	139	93%	0.925	77%	0.773	S	S	*	*			trans	-168.3	96.2	134.6	-102.8	164.9	39.5	0	0	108.2
294	S	20.9	Very low	25.1	Very low	110 Å²	110	140.2 Å²	140.2	77%	0.769	78%	0.778	S	S	*	*			trans	-55.6	148	163.4	41.5	0	0	0	0	112
295	S	22.1	Very low	24.7	Very low	110 Å²	110	147.3 Å²	147.3	77%	0.769	80%	0.795	S	S	*	*			trans	67.9	101	155.3	60.8	0	0	0	0	119.3
296	S	24.4	Very low	24.3	Very low	111 Å²	111	147.8 Å²	147.8	78%	0.776	80%	0.8	S	S	*	*				177.8	113.3	121.1	55.3	0	0	0	0	112.5
297	S	21.8	Very low	23.9	Very low	104 Å²	104	155.1 Å²	155.1	73%	0.727	81%	0.814	S	S	*	*			trans	44.7	131.4	141.1	57.2	0	0	0	0	123.1
298	S	22.8	Very low	23.8	Very low	101 Å²	101	155.3 Å²	155.3	71%	0.706	82%	0.815	S	S	*	*			trans	78.4	104.6	138.5	53.9	0	0	0	0	121.4
299	S	21.6	Very low	23.7	Very low	110 Å²	110	160.4 Å²	160.4	77%	0.769	82%	0.824	S	S	*	*				68.6	140.1	125.6	64.7	0	0	0	0	122.6
300	S	22.5	Very low	23.7	Very low	106 Å²	106	157.7 Å²	157.7	74%	0.741	82%	0.822	S	S	*	*			trans	87.5	88.9	151.4	21.7	0	0	0	0	119.7
301	N	21.7	Very low	23.6	Very low	147 Å²	147	157 Å²	157	79%	0.786	82%	0.816	S	S	*	*				13.2	120.7	126.8	-72.4	-22.4	0	0	0	118.2
302	N	24.5	Very low	23.5	Very low	163 Å²	163	157.3 Å²	157.3	87%	0.872	82%	0.819	S	S	*	*			trans	-155.7	100.1	132.5	-96.4	-25	0	0	0	110.4
303	K	24.5	Very low	23.4	Very low	199 Å²	199	157.3 Å²	157.3	87%	0.865	82%	0.819	S	S	*	*			trans	-83.3	124	169.1	-76	-179.6	175.2	178.9	0	108.8
304	I	25.7	Very low	23.5	Very low	167 Å²	167	153 Å²	153	86%	0.856	81%	0.808	S	S	*	*			trans	-104.1	140.8	172.2	-68.1	172.9	0	0	0	108.9
305	Y	23.8	Very low	23.7	Very low	222 Å²	222	155.3 Å²	155.3	87%	0.871	81%	0.81	S	S	*	*			trans	-71.1	144.2	-156.7	-90.2	-103.2	0	0	0	117.4
306	H	25.3	Very low	23.7	Very low	190 Å²	190	158.7 Å²	158.7	88%	0.88	81%	0.813	S	S	*	*			trans	-66.8	139.7	166.5	-88.9	-92	0	0	0	112.9
307	R	21.1	Very low	23.7	Very low	245 Å²	245	162 Å²	162	93%	0.925	82%	0.817	S	S	*	*			trans	-115	98.8	-179.8	-163.9	176.7	-171.7	155.5	0.8	108.8
308	N	24.8	Very low	23.8	Very low	152 Å²	152	165.8 Å²	165.8	81%	0.813	82%	0.823	S	S	*	*			trans	-128.8	116.1	167	-97.1	-13	0	0	0	107.7
309	R	25.8	Very low	23.9	Very low	246 Å²	246	169.7 Å²	169.7	93%	0.928	83%	0.83	S	S	*	*			trans	-158.1	92	160.2	-107	-177.8	-170.8	-173.8	1.9	108.5
310	I	25.6	Very low	24	Very low	160 Å²	160	171.9 Å²	171.9	82%	0.821	83%	0.833	S	S	*	*			trans	-81.7	133.1	163.6	-69.9	173.5	0	0	0	106.7	N312	I310-N312 PolarHBondContact O-N 3Å
311	M	22.2	Very low	24.2	Very low	158 Å²	158	175.7 Å²	175.7	78%	0.778	84%	0.839	S	S	*	*			trans	-71.7	109.1	-174.1	-68.8	-96.9	-82	0	0	110.8	L313	M311-L313 HydrophobicContact CE-CD1 4.16Å
312	N	23.7	Very low	24.6	Very low	158 Å²	158	175.3 Å²	175.3	85%	0.845	84%	0.837	S	S	*	*			trans	-103.3	112.8	157.8	-76.3	-13.1	0	0	0	106.9	I310	I310-N312 PolarHBondContact O-N 3Å
313	L	23.3	Very low	24.7	Very low	147 Å²	147	177.4 Å²	177.4	77%	0.77	83%	0.834	S	S	*	*			trans	-98	137.5	165.8	-99.7	133.3	0	0	0	108.2	M311	M311-L313 HydrophobicContact CE-CD1 4.16Å
314	P	26.3	Very low	25	Very low	107 Å²	107	172.6 Å²	172.6	70%	0.695	83%	0.826	S	S	*	*			trans	-92.5	134.1	-157.2	34.7	-27.4	0	0	0	111
315	I	24	Very low	25.3	Very low	158 Å²	158	170.5 Å²	170.5	81%	0.81	82%	0.815	S	S	*	*			trans	-93.5	115.1	163.4	-64.2	172.1	0	0	0	105	E317	I315-E317 PolarHBondContact O-N 3Å
316	E	22.7	Very low	25.5	Very low	181 Å²	181	166.2 Å²	166.2	85%	0.846	81%	0.807	S	S	*	*			trans	-66.9	108.7	175.8	-68.4	176	158.5	0	0	108.6	E318	E316-E318 PolarHBondContact O-N 2.92Å
317	E	24.5	Very low	25.8	Very low	182 Å²	182	163.1 Å²	163.1	85%	0.85	80%	0.796	S	S	*	*			trans	-83.8	104.6	172.3	-71	-179.2	164.9	0	0	108.3	I315 E319	I315-E317 PolarHBondContact O-N 3Å; E317-E319 PolarHBondContact O-N 2.91Å
318	E	22.7	Very low	26.4	Very low	182 Å²	182	157.9 Å²	157.9	85%	0.85	78%	0.782	S	S	*	*			trans	-67.9	123	166.4	-81.7	-175.2	156.3	0	0	109.9	E316 N320	E316-E318 PolarHBondContact O-N 2.92Å; E318-N320 PolarHBondContact O-N 2.88Å
319	E	24.7	Very low	26.8	Very low	184 Å²	184	158.3 Å²	158.3	86%	0.86	78%	0.777	S	S	*	*			trans	-54.4	112.7	178.8	-61.8	169.2	158.2	0	0	111.6	E317	E317-E319 PolarHBondContact O-N 2.91Å
320	N	24.4	Very low	27	Very low	155 Å²	155	152.7 Å²	152.7	83%	0.829	77%	0.765	S	S	*	*			trans	-122.3	84.6	162.9	-87.8	-52.3	0	0	0	108.9	E318 D322	E318-N320 PolarHBondContact O-N 2.88Å; N320-D322 PolarHBondContact O-N 3.3Å; N320-D322 VanDerWaalsContact O-N 3.08Å
321	E	26.8	Very low	27.2	Very low	187 Å²	187	147.9 Å²	147.9	87%	0.874	75%	0.745	S	S	*	*			trans	-63.5	92.9	167.8	-68.8	-173.6	151.5	0	0	110.4
322	D	29.9	Very low	27.8	Very low	138 Å²	138	146 Å²	146	74%	0.738	74%	0.738	S	S	*	*			trans	-154.6	5	160.5	-102.2	-24.2	0	0	0	115.6	N320	N320-D322 PolarHBondContact O-N 3.3Å; N320-D322 VanDerWaalsContact O-N 3.08Å
323	Y	26.3	Very low	28.2	Very low	207 Å²	207	146.9 Å²	146.9	81%	0.812	74%	0.738	S	S	*	*	S	Bend	trans	-94.8	-0.3	178.8	-94.8	-82.2	0	0	0	115.6
324	S	30.3	Very low	28.5	Very low	99 Å²	99	146.3 Å²	146.3	69%	0.692	73%	0.734	S	S	*	*	H	α-helix	trans	-83.1	-17.7	-178.8	-169.3	0	0	0	0	114.8
325	I	33.4	Very low	28.7	Very low	122 Å²	122	148.2 Å²	148.2	63%	0.626	74%	0.738	S	S	*	*	H	α-helix	trans	-89.9	-18	-174.5	-61.8	175.9	0	0	0	112.6
326	L	28.6	Very low	29.3	Very low	133 Å²	133	143.8 Å²	143.8	70%	0.696	73%	0.731	S	S	*	*	H	α-helix	trans	-82.5	-30.3	-177.8	-143.6	83.2	0	0	0	113.6
327	N	30	Very low	29.9	Very low	124 Å²	124	143 Å²	143	66%	0.663	73%	0.728	S	S	*	*	H	α-helix	trans	-79.3	-26.4	-178.4	-90.1	-14.1	0	0	0	113.8	L330 S331	N327-L330 PolarHBondContact O-N 2.91Å; N327-S331 PolarHBondContact O-N 3.46Å; N327-S331 PolarHBondContact O-OG 2.82Å
328	E	34.7	Very low	30.2	Very low	135 Å²	135	140.6 Å²	140.6	63%	0.631	72%	0.721	S	S	*	*	H	α-helix	trans	-79.5	-24.2	-178.6	-145.7	-179.5	-171.3	0	0	112.9	S331	E328-S331 PolarHBondContact O-OG 3Å
329	K	33.4	Very low	30.7	Very low	162 Å²	162	142.6 Å²	142.6	70%	0.704	72%	0.721	S	S	*	*	H	α-helix	trans	-78.1	-27.2	171.7	-82.1	-175.9	177.1	175.2	0	113.1
330	L	29.1	Very low	31.4	Very low	127 Å²	127	137.4 Å²	137.4	67%	0.665	70%	0.704	S	S	*	*	H	α-helix	trans	-80.8	-29.9	178.1	-133.2	81.4	0	0	0	112.7	N327	N327-L330 PolarHBondContact O-N 2.91Å
331	S	30.9	Very low	31.9	Very low	60 Å²	60	136.5 Å²	136.5	42%	0.42	70%	0.695	S	S	.	*	H	α-helix	trans	-76.6	-24.3	179.5	65.3	0	0	0	0	114.1	N327 E328	N327-S331 PolarHBondContact O-N 3.46Å; N327-S331 PolarHBondContact O-OG 2.82Å; E328-S331 PolarHBondContact O-OG 3Å
332	N	35.1	Very low	32.2	Very low	118 Å²	118	133 Å²	133	63%	0.631	68%	0.682	S	S	*	*	S	Bend	trans	-93.5	-4.2	-175.4	-74.9	-21.2	0	0	0	115.1
333	Q	30.8	Very low	32.4	Very low	177 Å²	177	136.4 Å²	136.4	83%	0.827	68%	0.684	S	S	*	*	S	Bend	trans	-100.3	-1	174.4	-84	-169.1	-23	0	0	115.2
334	I	29.3	Very low	33.1	Very low	134 Å²	134	131 Å²	131	69%	0.687	67%	0.673	S	S	*	*	S	Bend	trans	-105.7	-7.1	-179.8	-61.9	178.8	0	0	0	112.9
335	N	31.3	Very low	33.3	Very low	147 Å²	147	129.7 Å²	129.7	79%	0.786	66%	0.661	S	S	*	*	S	Bend	trans	-104.4	88.5	177.8	-75.5	-29.9	0	0	0	111.6
336	G	37.1	Very low	33.2	Very low	65 Å²	65	130 Å²	130	67%	0.67	66%	0.661	S	S	*	*	S	Bend	trans	-169.1	-57.5	172.1	0	0	0	0	0	115.9
337	E	34.4	Very low	33.5	Very low	165 Å²	165	131.5 Å²	131.5	77%	0.771	66%	0.662	S	S	*	*	S	Bend	trans	-115.4	-13.4	-161.8	-68.6	-172	154.3	0	0	116.2	S340	E337-S340 PolarHBondContact O-OG 3.06Å
338	N	31.5	Very low	33.9	Very low	132 Å²	132	129.7 Å²	129.7	71%	0.706	66%	0.655	S	S	*	*	H	α-helix	trans	-84.2	-10.2	-179.6	-78.3	-20.6	0	0	0	115.2
339	R	32.5	Very low	33.7	Very low	224 Å²	224	129.2 Å²	129.2	85%	0.845	66%	0.656	S	S	*	*	H	α-helix	trans	-84	-25.4	179.4	-97.4	-175.2	175.7	-178.2	0.1	114.4
340	S	40.7	Very low	33.7	Very low	74 Å²	74	127.1 Å²	127.1	52%	0.517	65%	0.653	S	S	.	*	H	α-helix	trans	-79.1	-35.8	178.3	57.8	0	0	0	0	111.9	E337 L342 R343 T344	E337-S340 PolarHBondContact O-OG 3.06Å; S340-L342 PolarHBondContact O-N 2.82Å; S340-R343 PolarHBondContact O-N 3.29Å; S340-T344 PolarHBondContact O-N 2.83Å; S340-T344 PolarHBondContact O-OG1 2.83Å
341	H	33.7	Very low	34	Very low	136 Å²	136	127.3 Å²	127.3	63%	0.63	66%	0.655	S	S	*	*	H	α-helix	trans	-69.7	-31.9	179.6	-98.8	-57.4	0	0	0	114	T345	H341-T345 PolarHBondContact O-N 2.78Å; H341-T345 VanDerWaalsContact O-N 3.15Å; H341-T345 PolarHBondContact O-OG1 2.92Å
342	L	32.9	Very low	33.9	Very low	115 Å²	115	130.8 Å²	130.8	60%	0.602	67%	0.668	S	S	*	*	H	α-helix	trans	-73.1	-31.4	177.3	-75.3	168.2	0	0	0	113.2	S340 T345 M346	S340-L342 PolarHBondContact O-N 2.82Å; L342-T345 WeakPolarHBondContact CA-OG1 3.48Å; L342-T345 PolarHBondContact O-OG1 2.81Å; L342-M346 PolarHBondContact O-N 3.21Å; L342-M346 VanDerWaalsContact O-N 3.13Å
343	R	35.2	Very low	33.6	Very low	208 Å²	208	129.9 Å²	129.9	79%	0.785	67%	0.671	S	S	*	*	H	α-helix	trans	-73.5	-32.2	175.1	-96.6	-176.3	178.7	173.9	0.6	113.1	S340 K347	S340-R343 PolarHBondContact O-N 3.29Å; R343-K347 PolarHBondContact O-N 2.81Å
344	T	40.9	Very low	33.3	Very low	93 Å²	93	129.6 Å²	129.6	57%	0.571	67%	0.669	S	S	*	*	H	α-helix	trans	-75.4	-36.7	176.9	-45.5	0	0	0	0	111.2	S340 K347 V348	S340-T344 PolarHBondContact O-N 2.83Å; S340-T344 PolarHBondContact O-OG1 2.83Å; T344-K347 PolarHBondContact O-N 2.84Å; T344-V348 WeakPolarHBondContact O-CG2 3.38Å; T344-V348 PolarHBondContact O-N 2.8Å
345	T	33.1	Very low	33.2	Very low	73 Å²	73	130 Å²	130	45%	0.448	67%	0.673	S	S	.	*	H	α-helix	trans	-71.5	-36.1	177.2	36	0	0	0	0	113.1	H341 L342 V348 L349	H341-T345 PolarHBondContact O-N 2.78Å; H341-T345 VanDerWaalsContact O-N 3.15Å; H341-T345 PolarHBondContact O-OG1 2.92Å; L342-T345 WeakPolarHBondContact CA-OG1 3.48Å; L342-T345 PolarHBondContact O-OG1 2.81Å; T345-V348 PolarHBondContact O-N 2.86Å; T345-L349 PolarHBondContact O-N 2.91Å
346	M	31.3	Very low	32.8	Very low	129 Å²	129	132.9 Å²	132.9	64%	0.635	68%	0.679	S	S	*	*	H	α-helix	trans	-67.3	-35.1	173.5	-87.9	171.8	74.7	0	0	113.2	L342 V348 L349 D350	L342-M346 PolarHBondContact O-N 3.21Å; L342-M346 VanDerWaalsContact O-N 3.13Å; M346-V348 VanDerWaalsContact C-N 3.32Å; M346-V348 PolarHBondContact O-N 2.93Å; M346-L349 PolarHBondContact O-N 2.89Å; M346-D350 PolarHBondContact O-N 2.9Å; M346-D350 VanDerWaalsContact O-N 3.16Å
347	K	36.6	Very low	32.1	Very low	163 Å²	163	135.5 Å²	135.5	71%	0.709	69%	0.685	S	S	*	*	H	α-helix	trans	-70.8	-24	174.8	-82.4	-170.7	174.6	-175	0	114.2	R343 T344	R343-K347 PolarHBondContact O-N 2.81Å; T344-K347 PolarHBondContact O-N 2.84Å
348	V	37.5	Very low	31.5	Very low	86 Å²	86	136.7 Å²	136.7	52%	0.521	69%	0.691	S	S	.	*	H	α-helix	trans	-77.3	-31.9	173.6	173.9	0	0	0	0	111.1	T344 T345 M346 L352	T344-V348 WeakPolarHBondContact O-CG2 3.38Å; T344-V348 PolarHBondContact O-N 2.8Å; T345-V348 PolarHBondContact O-N 2.86Å; M346-V348 VanDerWaalsContact C-N 3.32Å; M346-V348 PolarHBondContact O-N 2.93Å; V348-L352 HydrophobicContact CG1-CD1 4.28Å
349	L	30.7	Very low	31.2	Very low	125 Å²	125	137.1 Å²	137.1	65%	0.654	70%	0.698	S	S	*	*	H	α-helix	trans	-77.3	-34.7	179.5	-82	159.3	0	0	0	113.7	T345 M346	T345-L349 PolarHBondContact O-N 2.91Å; M346-L349 PolarHBondContact O-N 2.89Å
350	D	32.4	Very low	30.8	Very low	118 Å²	118	133.7 Å²	133.7	63%	0.631	70%	0.696	S	S	*	*	H	α-helix	trans	-73.2	-31.1	177.9	-76.1	-21.6	0	0	0	112.9	M346 L352 S353	M346-D350 PolarHBondContact O-N 2.9Å; M346-D350 VanDerWaalsContact O-N 3.16Å; D350-L352 VanDerWaalsContact C-N 3.32Å; D350-L352 PolarHBondContact O-N 2.8Å; D350-S353 PolarHBondContact O-OG 2.74Å
351	N	35.2	Very low	29.9	Very low	131 Å²	131	137.5 Å²	137.5	70%	0.701	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-1.9	-178.5	-83.3	-13.2	0	0	0	115.1
352	L	29.3	Very low	29.4	Very low	134 Å²	134	139.5 Å²	139.5	70%	0.702	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-1.4	179.1	-72	172.4	0	0	0	114.1	V348 D350	V348-L352 HydrophobicContact CG1-CD1 4.28Å; D350-L352 VanDerWaalsContact C-N 3.32Å; D350-L352 PolarHBondContact O-N 2.8Å
353	S	29	Very low	29	Very low	98 Å²	98	143.1 Å²	143.1	69%	0.685	73%	0.732	S	S	*	*	S	Bend	trans	-87.3	-7.5	178.7	70.1	0	0	0	0	115.2	D350	D350-S353 PolarHBondContact O-OG 2.74Å
354	E	25.7	Very low	28.4	Very low	171 Å²	171	143 Å²	143	80%	0.799	74%	0.74	S	S	*	*	S	Bend	trans	-117.7	1.6	-176	-77.6	-164.1	154	0	0	117.4	K356	E354-K356 PolarHBondContact O-N 3.32Å
355	N	26.3	Very low	27.5	Very low	144 Å²	144	145.9 Å²	145.9	77%	0.77	75%	0.747	S	S	*	*			trans	-93.4	85.8	174.8	-79.4	-28	0	0	0	112.6	C357	N355-C357 PolarHBondContact O-N 2.8Å
356	K	23.9	Very low	27	Very low	207 Å²	207	150.1 Å²	150.1	90%	0.9	77%	0.766	S	S	*	*			trans	-50.9	111.8	155.6	-75.8	176.7	176.6	172.7	0	109.4	E354	E354-K356 PolarHBondContact O-N 3.32Å
357	C	21.3	Very low	26.6	Very low	119 Å²	119	153.4 Å²	153.4	80%	0.804	78%	0.782	S	S	*	*			trans	-138.7	124.4	156.6	-114.4	0	0	0	0	111.1	N355	N355-C357 PolarHBondContact O-N 2.8Å
358	Q	22.9	Very low	25.9	Very low	190 Å²	190	153.9 Å²	153.9	89%	0.888	79%	0.787	S	S	*	*			trans	-56.7	129	177.6	-65.1	158.5	-34.6	0	0	110.2
359	V	25	Very low	25.2	Very low	142 Å²	142	155.8 Å²	155.8	86%	0.861	79%	0.794	S	S	*	*			trans	-127.6	125.9	161.7	-178.8	0	0	0	0	108.6
360	N	23.1	Very low	24.9	Very low	152 Å²	152	157 Å²	157	81%	0.813	80%	0.801	S	S	*	*			trans	-59.8	139.5	-167.2	-74.4	-45.5	0	0	0	114.2	Q362	N360-Q362 PolarHBondContact O-N 2.88Å
361	N	22.7	Very low	24.6	Very low	154 Å²	154	160.1 Å²	160.1	82%	0.824	82%	0.817	S	S	*	*			trans	-51.6	119.8	151.5	-67.4	-35.4	0	0	0	109.8
362	Q	22.5	Very low	24	Very low	178 Å²	178	162 Å²	162	83%	0.832	83%	0.825	S	S	*	*			trans	-175.1	126.3	141.2	-104	166.6	41	0	0	111.6	N360	N360-Q362 PolarHBondContact O-N 2.88Å
363	K	24	Very low	23.9	Very low	191 Å²	191	159.2 Å²	159.2	83%	0.83	83%	0.828	S	S	*	*			trans	80.2	96.8	158.4	-61.3	177.8	177.1	-179.6	0	117.5
364	E	23.1	Very low	23.7	Very low	204 Å²	204	162.5 Å²	162.5	95%	0.953	84%	0.838	S	S	*	*			trans	-155.2	81.3	141.7	-108.5	167.2	-157.6	0	0	108.2
365	E	21.9	Very low	23.6	Very low	155 Å²	155	162.1 Å²	162.1	72%	0.724	84%	0.842	S	S	*	*			trans	-96.8	144.4	157	-109	178.7	176.7	0	0	106.9	R413	E365-R413 IonicContact OE1-NH2 2.71Å
366	L	22	Very low	23.5	Very low	161 Å²	161	159.7 Å²	159.7	84%	0.843	84%	0.836	S	S	*	*			trans	82.8	88.8	175.2	-66.9	124	0	0	0	117.5
367	M	23.4	Very low	23.5	Very low	198 Å²	198	160.9 Å²	160.9	98%	0.975	84%	0.836	S	S	*	*				-158.3	94.8	118.4	-86.5	-135.9	-92.7	0	0	109.5
368	Q	21.3	Very low	23.6	Very low	174 Å²	174	162.6 Å²	162.6	81%	0.813	84%	0.837	S	S	*	*			trans	-132.1	135	168.6	-115.2	-177.8	0.3	0	0	108.9
369	N	23.6	Very low	23.7	Very low	126 Å²	126	160.3 Å²	160.3	67%	0.674	84%	0.836	S	S	*	*			trans	86.2	109.7	153.9	-53.5	-16.9	0	0	0	117.8
370	N	24.2	Very low	23.7	Very low	150 Å²	150	156.5 Å²	156.5	80%	0.802	83%	0.825	S	S	*	*				-176.9	105.6	99.4	-85	-22.9	0	0	0	111
371	L	25.6	Very low	23.8	Very low	183 Å²	183	158.5 Å²	158.5	96%	0.958	83%	0.829	S	S	*	*			trans	-137	100.7	163.5	-91.4	156.4	0	0	0	106.9
372	I	24.3	Very low	23.8	Very low	172 Å²	172	159 Å²	159	88%	0.882	83%	0.83	S	S	*	*			trans	-129.7	134.1	173.3	-68.4	175.7	0	0	0	106.7
373	G	26.8	Very low	23.9	Very low	74 Å²	74	158.1 Å²	158.1	76%	0.763	83%	0.831	S	S	*	*			trans	153.3	51.7	167.9	0	0	0	0	0	113.9
374	N	23.7	Very low	23.8	Very low	167 Å²	167	152.3 Å²	152.3	89%	0.893	83%	0.825	S	S	*	*			trans	-77.6	132.7	162.1	-86	-17.7	0	0	0	108.3
375	D	24.8	Very low	23.7	Very low	164 Å²	164	151.3 Å²	151.3	88%	0.877	82%	0.821	S	S	*	*			trans	-133.1	142.7	158	-109.8	-21.6	0	0	0	111.7
376	S	24	Very low	23.7	Very low	92 Å²	92	148.8 Å²	148.8	64%	0.643	82%	0.82	S	S	*	*			trans	-82.2	142	-155.1	55.6	0	0	0	0	115.1
377	Y	22.9	Very low	23.8	Very low	233 Å²	233	153.2 Å²	153.2	91%	0.914	83%	0.825	S	S	*	*			trans	-109.6	116.6	155.6	-91.3	-89.3	0	0	0	109.9
378	L	24.6	Very low	23.6	Very low	154 Å²	154	152.5 Å²	152.5	81%	0.806	82%	0.82	S	S	*	*			trans	-109.8	115.7	179.5	-128.5	153.9	0	0	0	106.9
379	V	24.9	Very low	23.7	Very low	143 Å²	143	150.1 Å²	150.1	87%	0.867	82%	0.817	S	S	*	*			trans	-113.5	103.6	168.4	176.3	0	0	0	0	106.4
380	G	25.1	Very low	23.6	Very low	61 Å²	61	148.5 Å²	148.5	63%	0.629	82%	0.815	S	S	*	*			trans	-101.9	145.8	177.3	0	0	0	0	0	111.4
381	E	24.6	Very low	23.5	Very low	195 Å²	195	148.1 Å²	148.1	91%	0.911	81%	0.813	S	S	*	*			trans	-69.3	152.7	-168.7	-66.1	169.4	136.8	0	0	114.9
382	I	22.5	Very low	23.4	Very low	164 Å²	164	144.6 Å²	144.6	84%	0.841	80%	0.8	S	S	*	*			trans	-85.6	115.5	179.9	-64.6	164.1	0	0	0	108.5
383	N	24.4	Very low	23.4	Very low	160 Å²	160	143.2 Å²	143.2	86%	0.856	79%	0.794	S	S	*	*			trans	-126.3	124.2	158.7	-89.2	-31.1	0	0	0	108.5
384	G	21.3	Very low	23.2	Very low	68 Å²	68	144.6 Å²	144.6	70%	0.701	79%	0.792	S	S	*	*			trans	-75.6	155.2	177.1	0	0	0	0	0	112.8
385	E	22.9	Very low	23.1	Very low	184 Å²	184	142.2 Å²	142.2	86%	0.86	78%	0.783	S	S	*	*				-178.7	118.4	124.7	-101.1	178.8	-175.1	0	0	109.8
386	S	21	Very low	23	Very low	102 Å²	102	143 Å²	143	71%	0.713	78%	0.782	S	S	*	*			trans	37.5	113.7	143.8	50.4	0	0	0	0	120.5
387	R	24.1	Very low	22.9	Very low	253 Å²	253	142.6 Å²	142.6	96%	0.955	78%	0.779	S	S	*	*				-173.3	141.6	119.9	-104.6	166.1	179	167.6	0.9	112.3
388	E	19.7	Very low	22.9	Very low	183 Å²	183	137.8 Å²	137.8	86%	0.855	77%	0.769	S	S	*	*			trans	-76	166	-176	-59.7	169	138.2	0	0	113.3
389	V	22.6	Very low	22.8	Very low	124 Å²	124	138 Å²	138	75%	0.752	77%	0.766	S	S	*	*			trans	101.5	93.1	149.5	-170.1	0	0	0	0	118.2
390	S	21.1	Very low	22.6	Very low	92 Å²	92	138.9 Å²	138.9	64%	0.643	76%	0.758	S	S	*	*				71.2	128	125.5	81.8	0	0	0	0	123.1
391	N	22.8	Very low	22.4	Very low	142 Å²	142	141.3 Å²	141.3	76%	0.759	76%	0.757	S	S	*	*			trans	100.1	121.3	130.4	-75.7	-0.7	0	0	0	121.4
392	T	23.9	Very low	22.3	Very low	110 Å²	110	139.3 Å²	139.3	68%	0.675	75%	0.748	S	S	*	*			trans	83.5	107.6	136.5	55.3	0	0	0	0	120.8
393	D	22.9	Very low	22.2	Very low	143 Å²	143	137.1 Å²	137.1	77%	0.765	74%	0.742	S	S	*	*				82.7	138.2	117.4	-63.9	-16.5	0	0	0	123.4
394	S	24.3	Very low	22.2	Very low	102 Å²	102	138 Å²	138	71%	0.713	74%	0.741	S	S	*	*			trans	75.7	104.4	153.4	56.2	0	0	0	0	117.9
395	T	21.3	Very low	22.2	Very low	117 Å²	117	143.4 Å²	143.4	72%	0.718	75%	0.745	S	S	*	*				76.9	124.8	72.8	56.1	0	0	0	0	115.4
396	E	22.7	Very low	22.3	Very low	182 Å²	182	143.6 Å²	143.6	85%	0.85	75%	0.746	S	S	*	*			trans	71.7	149.8	152.1	-66	168.8	-175.6	0	0	117.6
397	S	22	Very low	22.3	Very low	83 Å²	83	145.2 Å²	145.2	58%	0.58	75%	0.747	S	S	*	*			cis	-173.8	160.1	-28.4	58.9	0	0	0	0	105.2
398	D	22.9	Very low	22.3	Very low	132 Å²	132	144.1 Å²	144.1	71%	0.706	75%	0.745	S	S	*	*			trans	76.8	107.7	146.8	-52.5	-31.1	0	0	0	122.5
399	E	21.1	Very low	22.5	Very low	159 Å²	159	143 Å²	143	74%	0.743	74%	0.744	S	S	*	*				73	118.1	113.7	-71	-163.7	156.2	0	0	123
400	F	20.8	Very low	22.4	Very low	160 Å²	160	143.2 Å²	143.2	70%	0.702	75%	0.746	S	S	*	*				84.4	129.9	126	-93.6	-71.5	0	0	0	123.5
401	N	21.9	Very low	22.5	Very low	112 Å²	112	147 Å²	147	60%	0.599	76%	0.757	S	S	*	*			trans	98.5	114.9	133.6	-83.3	-34.6	0	0	0	121.9
402	Q	21.7	Very low	22.5	Very low	154 Å²	154	144.7 Å²	144.7	72%	0.72	75%	0.752	S	S	*	*				91.9	119	123.8	-76.9	177.2	15.2	0	0	122
403	T	21.8	Very low	22.3	Very low	118 Å²	118	149.7 Å²	149.7	72%	0.724	76%	0.758	S	S	*	*			trans	62.7	122.4	134.1	57.4	0	0	0	0	120.3
404	E	22.7	Very low	22.3	Very low	178 Å²	178	148.7 Å²	148.7	83%	0.832	76%	0.763	S	S	*	*				178.1	156.2	101.7	-92.8	-169.4	153	0	0	114.2
405	K	21.8	Very low	22.2	Very low	182 Å²	182	150.8 Å²	150.8	79%	0.791	77%	0.766	S	S	*	*			trans	-45.6	155.5	-178.5	-63.5	155.8	177.3	165.8	0	117.6
406	E	24.6	Very low	22.2	Very low	187 Å²	187	152.1 Å²	152.1	87%	0.874	77%	0.769	S	S	*	*			trans	-162.2	145.8	131.9	-109.6	171.8	-155.9	0	0	114.6
407	N	20.8	Very low	22.2	Very low	137 Å²	137	152.6 Å²	152.6	73%	0.733	77%	0.768	S	S	*	*			trans	-79.9	150.1	-168.1	-64	-55	0	0	0	114.5
408	Y	24.9	Very low	22.2	Very low	230 Å²	230	157.5 Å²	157.5	90%	0.902	78%	0.779	S	S	*	*			trans	-146.1	140.7	145.1	-86.6	-74.5	0	0	0	114.1
409	N	23.2	Very low	22.3	Very low	159 Å²	159	160.5 Å²	160.5	85%	0.85	79%	0.786	S	S	*	*			trans	-80.4	152.3	-162.6	-79.8	-40.7	0	0	0	116.1
410	V	21.2	Very low	22.5	Very low	129 Å²	129	160.2 Å²	160.2	78%	0.782	79%	0.79	S	S	*	*			trans	-68.3	137.2	167.2	174.3	0	0	0	0	112
411	I	23.5	Very low	22.7	Very low	170 Å²	170	159.6 Å²	159.6	87%	0.872	79%	0.794	S	S	*	*			trans	-132.9	134.1	149.3	-63.1	-178.5	0	0	0	109
412	S	21.7	Very low	23	Very low	94 Å²	94	160 Å²	160	66%	0.657	81%	0.805	S	S	*	*			trans	-103.1	155	-161.6	49.8	0	0	0	0	114.9
413	R	20.6	Very low	23	Very low	216 Å²	216	160.9 Å²	160.9	82%	0.815	81%	0.809	S	S	*	*			trans	21.7	128.8	145.7	-70.6	-179.4	174.2	161.3	1.4	119.2	E365	E365-R413 IonicContact OE1-NH2 2.71Å
414	S	23.2	Very low	23.1	Very low	122 Å²	122	162.6 Å²	162.6	85%	0.853	81%	0.812	S	S	*	*				173.1	150.9	116.6	56.4	0	0	0	0	114
415	D	21.5	Very low	23.3	Very low	145 Å²	145	159.6 Å²	159.6	78%	0.775	81%	0.811	S	S	*	*			trans	-63.1	155.3	-172.2	-57.7	-69	0	0	0	118.9
416	N	22.4	Very low	23.4	Very low	146 Å²	146	160.1 Å²	160.1	78%	0.781	82%	0.816	S	S	*	*			trans	49.1	107.1	141.1	-69.9	-28.7	0	0	0	120.4
417	K	21.2	Very low	23.5	Very low	191 Å²	191	154.5 Å²	154.5	83%	0.83	81%	0.809	S	S	*	*				168.9	155.5	117.8	-95.2	173.3	-179.9	178.4	0	111.3
418	F	23.2	Very low	23.9	Very low	186 Å²	186	154 Å²	154	82%	0.816	81%	0.813	S	S	*	*			trans	98.5	90.4	167.7	-70.1	-82.1	0	0	0	117.4
419	F	24.5	Very low	23.8	Very low	196 Å²	196	152.1 Å²	152.1	86%	0.86	81%	0.813	S	S	*	*			trans	-57	132.4	142.3	-97.4	-99.4	0	0	0	109.9
420	N	25.5	Very low	23.8	Very low	153 Å²	153	152.1 Å²	152.1	82%	0.818	81%	0.813	S	S	*	*			trans	-162	128.4	150.6	-103.5	-8.1	0	0	0	108.8
421	D	25.7	Very low	23.9	Very low	147 Å²	147	149.9 Å²	149.9	79%	0.786	80%	0.802	S	S	*	*			trans	-64.4	143.3	177	-61.6	-53.7	0	0	0	112.4
422	S	26.8	Very low	23.9	Very low	119 Å²	119	146.9 Å²	146.9	83%	0.832	80%	0.797	S	S	*	*			trans	-157.5	93.2	157.2	-49.9	0	0	0	0	110
423	E	22.8	Very low	23.9	Very low	174 Å²	174	151.5 Å²	151.5	81%	0.813	81%	0.808	S	S	*	*			trans	8.7	126.4	142.4	-68.1	172.6	160.3	0	0	121.1
424	I	24	Very low	24	Very low	153 Å²	153	152.6 Å²	152.6	79%	0.785	81%	0.812	S	S	*	*				62.8	115.1	122.8	-53.6	165	0	0	0	119.2
425	S	27.2	Very low	23.9	Very low	116 Å²	116	155.3 Å²	155.3	81%	0.811	81%	0.811	S	S	*	*				-163.9	125.9	123.1	-175.2	0	0	0	0	110.9
426	E	22	Very low	23.9	Very low	192 Å²	192	154.7 Å²	154.7	90%	0.897	82%	0.817	S	S	*	*			trans	-62.8	148.7	175.2	-62.7	172.2	142.6	0	0	112.9
427	G	27.9	Very low	23.9	Very low	69 Å²	69	153.9 Å²	153.9	71%	0.711	82%	0.817	S	S	*	*			trans	-176	124.7	168.3	0	0	0	0	0	110.2
428	P	29.6	Very low	24	Very low	127 Å²	127	148.4 Å²	148.4	83%	0.825	82%	0.815	S	S	*	*			trans	-89.4	159	-151.3	34.9	-35.9	0	0	0	115.3
429	Q	22.2	Very low	24	Very low	191 Å²	191	148.4 Å²	148.4	89%	0.893	82%	0.818	S	S	*	*			trans	-12.6	121.3	158.4	-63.7	175.5	-20.6	0	0	116.1
430	D	23.9	Very low	23.9	Very low	159 Å²	159	148.1 Å²	148.1	85%	0.85	82%	0.819	S	S	*	*			trans	-141.2	121.6	140.9	-118.6	-18.2	0	0	0	109.8
431	S	22.2	Very low	23.8	Very low	81 Å²	81	149.6 Å²	149.6	57%	0.566	82%	0.823	S	S	*	*			trans	-71.9	116.4	171.7	43.6	0	0	0	0	109.9	M62	M62-S431 VanDerWaalsContact CE-OG 3.23Å; M62-S431 WeakPolarHBondContact CE-OG 3.39Å
432	S	23.2	Very low	23.7	Very low	108 Å²	108	147.2 Å²	147.2	76%	0.755	82%	0.818	S	S	*	*			trans	-125.6	111.5	161.6	64.1	0	0	0	0	109.5	R434	S432-R434 PolarHBondContact O-N 2.79Å
433	E	22	Very low	23.6	Very low	190 Å²	190	148.1 Å²	148.1	89%	0.888	82%	0.819	S	S	*	*			trans	-43.9	114.6	169.6	-64.9	167.6	147.9	0	0	111.1	Q435	E433-Q435 PolarHBondContact O-N 2.8Å
434	R	22.5	Very low	23.8	Very low	239 Å²	239	143 Å²	143	90%	0.902	81%	0.812	S	S	*	*			trans	-83.8	103.1	161.4	-80.1	-171.3	-178.1	-177.4	1.6	108.2	S432 C436	S432-R434 PolarHBondContact O-N 2.79Å; R434-C436 PolarHBondContact O-N 2.76Å
435	Q	21.4	Very low	24	Very low	180 Å²	180	144.5 Å²	144.5	84%	0.841	82%	0.816	S	S	*	*			trans	-44.6	113.7	162.6	-70.9	169.3	-24	0	0	110	E433 T437	E433-Q435 PolarHBondContact O-N 2.8Å; Q435-T437 PolarHBondContact O-N 2.81Å; Q435-T437 VanDerWaalsContact O-N 3.09Å
436	C	21.4	Very low	24	Very low	132 Å²	132	149 Å²	149	89%	0.892	82%	0.816	S	S	*	*			trans	-70	99.5	164.3	-82.2	0	0	0	0	108.1	R434 G438	R434-C436 PolarHBondContact O-N 2.76Å; C436-G438 PolarHBondContact O-N 2.85Å
437	T	23	Very low	24.3	Very low	128 Å²	128	146 Å²	146	79%	0.785	81%	0.806	S	S	*	*			trans	-52.4	121.6	168.1	47.7	0	0	0	0	110.4	Q435 Q439	Q435-T437 PolarHBondContact O-N 2.81Å; Q435-T437 VanDerWaalsContact O-N 3.09Å; T437-Q439 PolarHBondContact O-N 3.46Å
438	G	22.3	Very low	24.3	Very low	77 Å²	77	148.8 Å²	148.8	79%	0.794	81%	0.809	S	S	*	*			trans	-60.5	118.6	174.2	0	0	0	0	0	111.4	C436 Q440	C436-G438 PolarHBondContact O-N 2.85Å; G438-Q440 PolarHBondContact O-N 2.86Å
439	Q	24.3	Very low	24.4	Very low	185 Å²	185	147.8 Å²	147.8	86%	0.864	81%	0.805	S	S	*	*			trans	-78.9	103.4	161.6	-80.4	179	-24.4	0	0	108.2	T437 M441	T437-Q439 PolarHBondContact O-N 3.46Å; Q439-M441 PolarHBondContact O-N 2.76Å
440	Q	22.6	Very low	24.8	Very low	190 Å²	190	145.6 Å²	145.6	89%	0.888	80%	0.795	S	S	*	*			trans	-65.8	107.6	160.9	-76.6	178.8	-20.4	0	0	108.2	G438 S442	G438-Q440 PolarHBondContact O-N 2.86Å; Q440-S442 PolarHBondContact O-N 2.83Å
441	M	23.4	Very low	25	Very low	185 Å²	185	144.4 Å²	144.4	91%	0.911	79%	0.788	S	S	*	*			trans	-80.3	98.4	164.1	-73.5	-144.4	-55.8	0	0	108.7	Q439	Q439-M441 PolarHBondContact O-N 2.76Å
442	S	23.6	Very low	25.4	Very low	97 Å²	97	145.2 Å²	145.2	68%	0.678	79%	0.794	S	S	*	*			trans	-92.1	113.4	165.2	60.3	0	0	0	0	110.4	Q440	Q440-S442 PolarHBondContact O-N 2.83Å
443	T	25.1	Very low	25.8	Very low	138 Å²	138	144.5 Å²	144.5	85%	0.847	79%	0.794	S	S	*	*			trans	58.5	126.6	134.3	61.1	0	0	0	0	120.3
444	G	25.6	Very low	26.2	Very low	65 Å²	65	144.1 Å²	144.1	67%	0.67	79%	0.79	S	S	*	*			trans	144.1	82.5	141.6	0	0	0	0	0	116.7	Y446	G444-Y446 PolarHBondContact O-N 3.43Å
445	E	29.4	Very low	26.4	Very low	185 Å²	185	142.4 Å²	142.4	86%	0.864	79%	0.785	S	S	*	*	S	Bend	trans	59.1	48.8	134.1	-57.9	-173.8	154.8	0	0	120.8
446	Y	26.8	Very low	26.6	Very low	210 Å²	210	143.1 Å²	143.1	82%	0.824	79%	0.788	S	S	*	*	S	Bend	trans	-132.9	2.5	159.8	-139.4	-97.8	0	0	0	117	G444	G444-Y446 PolarHBondContact O-N 3.43Å
447	L	27.4	Very low	26.8	Very low	130 Å²	130	141.9 Å²	141.9	68%	0.681	78%	0.781	S	S	*	*	S	Bend	trans	-115.8	-3.4	-176.5	-76	169.2	0	0	0	116.3
448	T	29.1	Very low	26.9	Very low	127 Å²	127	141.3 Å²	141.3	78%	0.779	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-15	174.2	37	0	0	0	0	114
449	S	30.7	Very low	27.1	Very low	106 Å²	106	144.9 Å²	144.9	74%	0.741	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-24	177.8	-163	0	0	0	0	114.1
450	Q	30.6	Very low	27.1	Very low	145 Å²	145	143.1 Å²	143.1	68%	0.678	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-14.8	-177.5	-76.1	-165.8	-6.5	0	0	115.4
451	L	28.4	Very low	27.3	Very low	134 Å²	134	141.4 Å²	141.4	70%	0.702	77%	0.772	S	S	*	*	S	Bend	trans	-84.1	-10.3	178.4	-75.1	169	0	0	0	114
452	S	30.8	Very low	27.4	Very low	99 Å²	99	140.7 Å²	140.7	69%	0.692	77%	0.767	S	S	*	*	S	Bend	trans	-81.8	-22.6	176.2	164.6	0	0	0	0	113.9
453	A	31.5	Very low	27.5	Very low	92 Å²	92	142.8 Å²	142.8	76%	0.76	77%	0.771	S	S	*	*	S	Bend	trans	-101	3.1	-171.6	0	0	0	0	0	115.2
454	K	30.3	Very low	27.6	Very low	183 Å²	183	141.8 Å²	141.8	80%	0.796	77%	0.766	S	S	*	*			trans	-103.8	8.8	179.6	-113.8	179.4	-177.9	177.1	0	114.9	Q456	K454-Q456 PolarHBondContact O-N 2.83Å
455	Y	26	Very low	27.6	Very low	202 Å²	202	149.3 Å²	149.3	79%	0.792	77%	0.774	S	S	*	*			trans	-90.3	83.4	168.6	-78.1	-82.2	0	0	0	109.9
456	Q	25.8	Very low	27.4	Very low	196 Å²	196	147.1 Å²	147.1	92%	0.916	77%	0.774	S	S	*	*			trans	171.8	70.6	152.2	-98.2	172.8	6	0	0	109.4	K454	K454-Q456 PolarHBondContact O-N 2.83Å
457	S	25.6	Very low	27.4	Very low	106 Å²	106	146 Å²	146	74%	0.741	77%	0.774	S	S	*	*			trans	-143.2	104.3	158.7	50.4	0	0	0	0	109.5	I459	S457-I459 PolarHBondContact O-N 2.83Å
458	S	26.2	Very low	27.5	Very low	115 Å²	115	144.5 Å²	144.5	80%	0.804	77%	0.774	S	S	*	*			trans	-49.6	131.5	174.2	-39.8	0	0	0	0	110.2	I460	S458-I460 PolarHBondContact O-N 2.75Å
459	I	25.2	Very low	27.5	Very low	152 Å²	152	147 Å²	147	78%	0.779	78%	0.783	S	S	*	*			trans	-47.2	110.4	177.3	-66.8	164	0	0	0	109.9	S457 L461	S457-I459 PolarHBondContact O-N 2.83Å; I459-L461 HydrophobicContact CG2-CG 4.19Å; I459-L461 PolarHBondContact O-N 3.25Å; I459-L461 VanDerWaalsContact O-N 3.14Å
460	I	24.8	Very low	27.3	Very low	148 Å²	148	145.9 Å²	145.9	76%	0.759	78%	0.775	S	S	*	*			trans	-74.8	94.3	165.8	-64	173.3	0	0	0	106.4	S458 Q462	S458-I460 PolarHBondContact O-N 2.75Å; I460-Q462 HydrophobicContact CG2-CG 4.44Å; I460-Q462 PolarHBondContact O-N 2.6Å
461	L	27.3	Very low	27.4	Very low	154 Å²	154	146.4 Å²	146.4	81%	0.806	78%	0.783	S	S	*	*			trans	-68.2	106.4	162.1	-84.4	160.6	0	0	0	107.6	I459 N463	I459-L461 HydrophobicContact CG2-CG 4.19Å; I459-L461 PolarHBondContact O-N 3.25Å; I459-L461 VanDerWaalsContact O-N 3.14Å; L461-N463 PolarHBondContact O-N 2.84Å
462	Q	25.7	Very low	27.4	Very low	170 Å²	170	147.8 Å²	147.8	79%	0.794	79%	0.789	S	S	*	*			trans	-66.4	128.8	175.4	-75.2	179.9	-26.5	0	0	111.2	I460	I460-Q462 HydrophobicContact CG2-CG 4.44Å; I460-Q462 PolarHBondContact O-N 2.6Å
463	N	25.4	Very low	27.6	Very low	142 Å²	142	150.3 Å²	150.3	76%	0.759	80%	0.795	S	S	*	*			trans	67.4	73.3	152.8	-71.4	-22.4	0	0	0	119	L461 R465	L461-N463 PolarHBondContact O-N 2.84Å; N463-R465 PolarHBondContact O-N 3.38Å
464	P	26.6	Very low	27.6	Very low	116 Å²	116	154 Å²	154	75%	0.753	80%	0.8	S	S	*	*			trans	-71.2	113.4	143	30.6	-23.7	0	0	0	107.4	T466	P464-T466 PolarHBondContact O-N 2.8Å
465	R	26.4	Very low	27.9	Very low	223 Å²	223	153.5 Å²	153.5	84%	0.842	80%	0.801	S	S	*	*			trans	-50.5	124	174.4	-73.2	177.4	174.6	175.5	-2.6	108.9	N463 F467	N463-R465 PolarHBondContact O-N 3.38Å; R465-F467 VanDerWaalsContact C-N 3.33Å; R465-F467 PolarHBondContact O-N 3.37Å
466	T	25	Very low	28.7	Very low	140 Å²	140	151.5 Å²	151.5	86%	0.859	80%	0.804	S	S	*	*			trans	-54.1	93.1	170.9	50	0	0	0	0	109.4	P464	P464-T466 PolarHBondContact O-N 2.8Å
467	F	26.9	Very low	29.4	Very low	186 Å²	186	151.8 Å²	151.8	82%	0.816	81%	0.805	S	S	*	*			trans	-76.9	118.8	155.6	-89.6	-86.9	0	0	0	106	R465 D469	R465-F467 VanDerWaalsContact C-N 3.33Å; R465-F467 PolarHBondContact O-N 3.37Å; F467-D469 PolarHBondContact O-N 3.35Å
468	S	29.1	Very low	30.4	Very low	99 Å²	99	152.9 Å²	152.9	69%	0.692	80%	0.802	S	S	*	*			trans	-56.4	127.8	176.4	47	0	0	0	0	110.3	S470	S468-S470 VanDerWaalsContact C-N 3.29Å; S468-S470 PolarHBondContact O-N 2.86Å
469	D	28.4	Very low	31.7	Very low	180 Å²	180	150.2 Å²	150.2	96%	0.963	78%	0.783	S	S	*	*			trans	-59.9	79.1	174.1	-81.4	-35.4	0	0	0	112.1	F467	F467-D469 PolarHBondContact O-N 3.35Å
470	S	28.4	Very low	33.3	Very low	82 Å²	82	147.7 Å²	147.7	57%	0.573	78%	0.777	S	S	*	*	S	Bend	trans	-130.3	104.3	159	61.4	0	0	0	0	109.1	S468	S468-S470 VanDerWaalsContact C-N 3.29Å; S468-S470 PolarHBondContact O-N 2.86Å
471	D	31.3	Very low	35.3	Very low	156 Å²	156	146 Å²	146	83%	0.834	77%	0.77	S	S	*	*			trans	57.8	79.4	157	-50.7	-27.9	0	0	0	115.9
472	I	29.4	Very low	37.7	Very low	162 Å²	162	141.4 Å²	141.4	83%	0.831	75%	0.746	S	S	*	*			trans	-103	96.8	161.7	-60.7	177.3	0	0	0	107.6	L474	I472-L474 PolarHBondContact O-N 3.4Å
473	D	35.1	Very low	40	Very low	153 Å²	153	140.9 Å²	140.9	82%	0.818	74%	0.738	S	S	*	*			trans	-53.7	119.4	165.3	-78.3	-41.9	0	0	0	109.9	E475	D473-E475 VanDerWaalsContact C-N 3.27Å; D473-E475 PolarHBondContact O-N 3.08Å
474	L	31.5	Very low	42.5	Very low	168 Å²	168	138.3 Å²	138.3	88%	0.88	72%	0.723	S	S	*	*	S	Bend	trans	-77.3	70.5	-177.3	-165.8	87.1	0	0	0	110.3	I472	I472-L474 PolarHBondContact O-N 3.4Å
475	E	35.2	Very low	45.1	Very low	174 Å²	174	141.1 Å²	141.1	81%	0.813	72%	0.718	S	S	*	*			trans	-161.5	87.9	168.1	-111.6	175.9	-147	0	0	109.4	D473	D473-E475 VanDerWaalsContact C-N 3.27Å; D473-E475 PolarHBondContact O-N 3.08Å
476	N	42.9	Very low	47.8	Very low	159 Å²	159	135.9 Å²	135.9	85%	0.85	70%	0.704	S	S	*	*			trans	-174.4	71.7	155.2	-88	-36	0	0	0	109.3	L478	N476-L478 PolarHBondContact O-N 2.83Å
477	E	40.1	Very low	50.5	Low	202 Å²	202	133.2 Å²	133.2	94%	0.944	68%	0.684	S	S	*	*			trans	-64.6	104.3	165	-75.7	-173	156.7	0	0	108.8	S479	E477-S479 PolarHBondContact O-N 2.79Å
478	L	48.1	Very low	53.2	Low	130 Å²	130	131 Å²	131	68%	0.681	67%	0.674	S	S	*	*			trans	-63.7	134.3	176.7	-86.1	109.2	0	0	0	110.6	N476 D482	N476-L478 PolarHBondContact O-N 2.83Å; L478-D482 HydrophobicContact CB-CB 4.46Å; L478-D482 HydrophobicContact CD2-CB 3.73Å
479	S	52.2	Low	55.8	Low	58 Å²	58	129.2 Å²	129.2	41%	0.406	67%	0.665	S	S	.	*			trans	-56.4	142.9	178.8	-178.4	0	0	0	0	110.9	E477 N481 D482 Y483	E477-S479 PolarHBondContact O-N 2.79Å; S479-N481 PolarHBondContact O-N 3.16Å; S479-D482 WeakPolarHBondContact O-CB 3.4Å; S479-D482 PolarHBondContact O-N 2.87Å; S479-Y483 PolarHBondContact O-N 2.72Å
480	P	60.1	Low	58.5	Low	99 Å²	99	126 Å²	126	64%	0.643	64%	0.644	S	S	*	*	H	α-helix	trans	-50.6	-27.4	177.2	-28.4	33.8	0	0	0	114.5	I484	P480-I484 WeakPolarHBondContact O-CG1 3.31Å; P480-I484 PolarHBondContact O-N 3.25Å; P480-I484 VanDerWaalsContact O-N 3.16Å
481	N	66.5	Low	61.2	Low	113 Å²	113	127.4 Å²	127.4	60%	0.604	65%	0.645	S	S	*	*	H	α-helix	trans	-69.8	-30.5	176.1	-78.1	-35	0	0	0	113.6	S479 R485	S479-N481 PolarHBondContact O-N 3.16Å; N481-R485 WeakPolarHBondContact O-CB 3.42Å; N481-R485 PolarHBondContact O-N 3.05Å; N481-R485 VanDerWaalsContact O-N 3.09Å
482	D	76.5	Confident	63.9	Low	58 Å²	58	124.9 Å²	124.9	31%	0.31	63%	0.628	S	S	.	*	H	α-helix	trans	-75.4	-37.5	176.7	-65.2	-36.7	0	0	0	110.6	L478 S479 I484 R485 E486	L478-D482 HydrophobicContact CB-CB 4.46Å; L478-D482 HydrophobicContact CD2-CB 3.73Å; S479-D482 WeakPolarHBondContact O-CB 3.4Å; S479-D482 PolarHBondContact O-N 2.87Å; D482-I484 PolarHBondContact O-N 3.3Å; D482-R485 WeakPolarHBondContact O-CB 3.33Å; D482-R485 PolarHBondContact O-N 3.19Å; D482-R485 VanDerWaalsContact O-N 3.1Å; D482-E486 WeakPolarHBondContact O-CB 3.24Å; D482-E486 PolarHBondContact O-N 3Å
483	Y	75	Confident	66.5	Low	159 Å²	159	121 Å²	121	62%	0.624	62%	0.615	S	S	*	*	H	α-helix	trans	-61.1	-42.1	172.4	-172.6	-106.2	0	0	0	112.5	S479 R485 E486 L487	S479-Y483 PolarHBondContact O-N 2.72Å; Y483-R485 VanDerWaalsContact C-N 3.3Å; Y483-R485 PolarHBondContact O-N 3.33Å; Y483-E486 WeakPolarHBondContact O-CB 3.47Å; Y483-E486 PolarHBondContact O-N 3.4Å; Y483-L487 HydrophobicContact CD1-CD1 3.79Å; Y483-L487 HydrophobicContact CE1-CD1 3.34Å; Y483-L487 HydrophobicContact CE1-CG 4.38Å; Y483-L487 PolarHBondContact O-N 2.82Å
484	I	78.6	Confident	68.7	Low	87 Å²	87	116.4 Å²	116.4	45%	0.446	60%	0.599	S	S	.	*	H	α-helix	trans	-65.1	-36.1	174.2	-67.5	170.3	0	0	0	111.1	P480 D482 K488	P480-I484 WeakPolarHBondContact O-CG1 3.31Å; P480-I484 PolarHBondContact O-N 3.25Å; P480-I484 VanDerWaalsContact O-N 3.16Å; D482-I484 PolarHBondContact O-N 3.3Å; I484-K488 WeakPolarHBondContact O-CG 3.16Å; I484-K488 PolarHBondContact O-N 3.05Å; I484-K488 VanDerWaalsContact O-N 3.07Å
485	R	80.3	Confident	71.3	Confident	175 Å²	175	112.4 Å²	112.4	66%	0.66	58%	0.578	S	S	*	*	H	α-helix	trans	-68.2	-41.5	177.8	-166.8	-177.7	-62.3	-175.9	3.8	111.7	N481 D482 Y483 K488 A489	N481-R485 WeakPolarHBondContact O-CB 3.42Å; N481-R485 PolarHBondContact O-N 3.05Å; N481-R485 VanDerWaalsContact O-N 3.09Å; D482-R485 WeakPolarHBondContact O-CB 3.33Å; D482-R485 PolarHBondContact O-N 3.19Å; D482-R485 VanDerWaalsContact O-N 3.1Å; Y483-R485 VanDerWaalsContact C-N 3.3Å; Y483-R485 PolarHBondContact O-N 3.33Å; R485-K488 PolarHBondContact O-N 2.87Å; R485-A489 PolarHBondContact O-N 2.75Å
486	E	84.2	Confident	73.8	Confident	114 Å²	114	108.5 Å²	108.5	53%	0.533	56%	0.562	S	S	.	*	H	α-helix	trans	-58.6	-50.6	173.8	-172.3	93.7	-152.5	0	0	110.9	D482 Y483 K488 A489 Q490	D482-E486 WeakPolarHBondContact O-CB 3.24Å; D482-E486 PolarHBondContact O-N 3Å; Y483-E486 WeakPolarHBondContact O-CB 3.47Å; Y483-E486 PolarHBondContact O-N 3.4Å; E486-K488 VanDerWaalsContact C-N 3.34Å; E486-K488 PolarHBondContact O-N 2.91Å; E486-A489 PolarHBondContact O-N 3.11Å; E486-A489 VanDerWaalsContact O-N 3.14Å; E486-Q490 WeakPolarHBondContact O-CG 3.34Å; E486-Q490 PolarHBondContact O-N 2.81Å
487	L	80.7	Confident	75.7	Confident	83 Å²	83	109.5 Å²	109.5	44%	0.435	55%	0.554	S	S	.	*	H	α-helix	trans	-60.2	-40.8	178.1	-88.2	162.4	0	0	0	112.6	Y483 Q490 L491	Y483-L487 HydrophobicContact CD1-CD1 3.79Å; Y483-L487 HydrophobicContact CE1-CD1 3.34Å; Y483-L487 HydrophobicContact CE1-CG 4.38Å; Y483-L487 PolarHBondContact O-N 2.82Å; L487-Q490 PolarHBondContact O-N 2.85Å; L487-L491 PolarHBondContact O-N 3.36Å
488	K	84	Confident	77.7	Confident	139 Å²	139	104 Å²	104	60%	0.604	53%	0.528	S	S	*	.	H	α-helix	trans	-64.8	-40.1	175	-77.7	-176.2	177.5	-175.6	0	112.2	I484 R485 E486 L491 Q492	I484-K488 WeakPolarHBondContact O-CG 3.16Å; I484-K488 PolarHBondContact O-N 3.05Å; I484-K488 VanDerWaalsContact O-N 3.07Å; R485-K488 PolarHBondContact O-N 2.87Å; E486-K488 VanDerWaalsContact C-N 3.34Å; E486-K488 PolarHBondContact O-N 2.91Å; K488-L491 PolarHBondContact O-N 3.01Å; K488-Q492 PolarHBondContact O-N 2.89Å
489	A	83.2	Confident	79.3	Confident	62 Å²	62	100.6 Å²	100.6	51%	0.512	52%	0.519	S	S	.	.	H	α-helix	trans	-66	-39.7	176.7	0	0	0	0	0	112	R485 E486 Q492 S493	R485-A489 PolarHBondContact O-N 2.75Å; E486-A489 PolarHBondContact O-N 3.11Å; E486-A489 VanDerWaalsContact O-N 3.14Å; A489-Q492 PolarHBondContact O-N 3.34Å; A489-S493 WeakPolarHBondContact O-CB 3.06Å; A489-S493 PolarHBondContact O-N 3.33Å
490	Q	84.9	Confident	80.8	Confident	112 Å²	112	104.8 Å²	104.8	52%	0.523	53%	0.527	S	S	.	.	H	α-helix	trans	-65.2	-41.4	175.8	-70.9	179.7	10.2	0	0	112.1	E486 L487 S493 A494	E486-Q490 WeakPolarHBondContact O-CG 3.34Å; E486-Q490 PolarHBondContact O-N 2.81Å; L487-Q490 PolarHBondContact O-N 2.85Å; Q490-S493 PolarHBondContact O-N 3.43Å; Q490-A494 PolarHBondContact O-N 3.13Å
491	L	86	Confident	81.9	Confident	113 Å²	113	103.9 Å²	103.9	59%	0.592	52%	0.516	S	S	*	.	H	α-helix	trans	-63.3	-44	176	-176.5	64.9	0	0	0	111.8	L487 K488 A494 L495	L487-L491 PolarHBondContact O-N 3.36Å; K488-L491 PolarHBondContact O-N 3.01Å; L491-A494 PolarHBondContact O-N 3.49Å; L491-L495 HydrophobicContact CG-CD1 4.39Å; L491-L495 WeakPolarHBondContact O-CG 3.43Å; L491-L495 PolarHBondContact O-N 2.86Å
492	Q	86.6	Confident	82.5	Confident	103 Å²	103	106.4 Å²	106.4	48%	0.481	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-43.8	178.3	-170.2	61.1	42.3	0	0	111.5	K488 A489 A494 L495 D496	K488-Q492 PolarHBondContact O-N 2.89Å; A489-Q492 PolarHBondContact O-N 3.34Å; Q492-A494 VanDerWaalsContact C-N 3.3Å; Q492-A494 PolarHBondContact O-N 3.23Å; Q492-L495 PolarHBondContact O-N 3.01Å; Q492-D496 PolarHBondContact NE2-OD1 3.02Å; Q492-D496 VanDerWaalsContact NE2-OD1 3.1Å; Q492-D496 VanDerWaalsContact O-CG 3.25Å; Q492-D496 PolarHBondContact O-N 2.95Å
493	S	85	Confident	82.8	Confident	79 Å²	79	109.5 Å²	109.5	55%	0.552	53%	0.53	S	S	*	.	H	α-helix	trans	-60.7	-37.8	175.7	-177.2	0	0	0	0	112.7	A489 Q490 R497	A489-S493 WeakPolarHBondContact O-CB 3.06Å; A489-S493 PolarHBondContact O-N 3.33Å; Q490-S493 PolarHBondContact O-N 3.43Å; S493-R497 WeakPolarHBondContact O-CB 3.39Å; S493-R497 PolarHBondContact O-N 3.18Å
494	A	81.1	Confident	83	Confident	58 Å²	58	104.7 Å²	104.7	48%	0.479	51%	0.514	S	S	.	.	H	α-helix	trans	-67.1	-41.6	175.8	0	0	0	0	0	112.5	Q490 L491 Q492 R497 E498	Q490-A494 PolarHBondContact O-N 3.13Å; L491-A494 PolarHBondContact O-N 3.49Å; Q492-A494 VanDerWaalsContact C-N 3.3Å; Q492-A494 PolarHBondContact O-N 3.23Å; A494-R497 PolarHBondContact O-N 3.35Å; A494-E498 PolarHBondContact O-N 3.42Å
495	L	86.5	Confident	82.8	Confident	83 Å²	83	104.9 Å²	104.9	44%	0.435	52%	0.515	S	S	.	.	H	α-helix	trans	-65.1	-42.9	176.2	-72.3	170.8	0	0	0	112	L491 Q492 R497 E498 A499	L491-L495 HydrophobicContact CG-CD1 4.39Å; L491-L495 WeakPolarHBondContact O-CG 3.43Å; L491-L495 PolarHBondContact O-N 2.86Å; Q492-L495 PolarHBondContact O-N 3.01Å; L495-R497 VanDerWaalsContact C-N 3.3Å; L495-R497 PolarHBondContact O-N 2.79Å; L495-E498 PolarHBondContact O-N 3.04Å; L495-A499 PolarHBondContact O-N 3.16Å
496	D	86.4	Confident	82.9	Confident	92 Å²	92	99.7 Å²	99.7	49%	0.492	51%	0.506	S	S	.	.	H	α-helix	trans	-64.1	-38.1	177	-65.6	-17.5	0	0	0	111.1	Q492 A499 Y500	Q492-D496 PolarHBondContact NE2-OD1 3.02Å; Q492-D496 VanDerWaalsContact NE2-OD1 3.1Å; Q492-D496 VanDerWaalsContact O-CG 3.25Å; Q492-D496 PolarHBondContact O-N 2.95Å; D496-A499 PolarHBondContact O-N 3.04Å; D496-Y500 PolarHBondContact O-N 2.62Å
497	R	82.8	Confident	82.6	Confident	181 Å²	181	99.1 Å²	99.1	68%	0.683	51%	0.506	S	S	*	.	H	α-helix	trans	-65.2	-40.8	174.2	-173.3	173.2	-176.7	144.8	0.6	112.2	S493 A494 L495 Y500 L501	S493-R497 WeakPolarHBondContact O-CB 3.39Å; S493-R497 PolarHBondContact O-N 3.18Å; A494-R497 PolarHBondContact O-N 3.35Å; L495-R497 VanDerWaalsContact C-N 3.3Å; L495-R497 PolarHBondContact O-N 2.79Å; R497-Y500 PolarHBondContact O-N 3.21Å; R497-L501 HydrophobicContact CG-CD1 4.42Å; R497-L501 VanDerWaalsContact O-CG 3.3Å; R497-L501 WeakPolarHBondContact O-CG 3.46Å; R497-L501 PolarHBondContact O-N 3.23Å
498	E	83.5	Confident	82.4	Confident	86 Å²	86	101.2 Å²	101.2	40%	0.402	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-45.4	175.5	-169.5	-171.2	166.5	0	0	111.4	A494 L495 Y500 L501 R502	A494-E498 PolarHBondContact O-N 3.42Å; L495-E498 PolarHBondContact O-N 3.04Å; E498-Y500 VanDerWaalsContact C-N 3.33Å; E498-Y500 PolarHBondContact O-N 3.42Å; E498-L501 PolarHBondContact O-N 2.84Å; E498-R502 WeakPolarHBondContact O-CG 3.44Å; E498-R502 PolarHBondContact O-N 3.35Å; E498-R502 IonicContact OE1-CZ 3.59Å; E498-R502 IonicContact OE1-NE 2.69Å; E498-R502 PolarHBondContact OE1-NE 3Å; E498-R502 VanDerWaalsContact OE1-NE 3.1Å; E498-R502 IonicContact OE1-NH2 3.25Å; E498-R502 PolarHBondContact OE1-NH2 3.48Å
499	A	81.9	Confident	82	Confident	58 Å²	58	98.9 Å²	98.9	48%	0.479	50%	0.499	S	S	.	.	H	α-helix	trans	-59.2	-43.5	177.4	0	0	0	0	0	111.9	L495 D496 R502 Q503	L495-A499 PolarHBondContact O-N 3.16Å; D496-A499 PolarHBondContact O-N 3.04Å; A499-R502 PolarHBondContact O-N 2.73Å; A499-Q503 PolarHBondContact O-N 2.92Å
500	Y	83.9	Confident	81.6	Confident	147 Å²	147	98.2 Å²	98.2	58%	0.576	49%	0.494	S	S	*	.	H	α-helix	trans	-61.4	-44.3	174.8	178.2	-103.4	0	0	0	112.6	D496 R497 E498 Q503 M504	D496-Y500 PolarHBondContact O-N 2.62Å; R497-Y500 PolarHBondContact O-N 3.21Å; E498-Y500 VanDerWaalsContact C-N 3.33Å; E498-Y500 PolarHBondContact O-N 3.42Å; Y500-Q503 PolarHBondContact O-N 3.12Å; Y500-M504 HydrophobicContact CD1-CE 4.07Å; Y500-M504 HydrophobicContact CE1-CE 3.59Å; Y500-M504 PolarHBondContact O-N 2.86Å
501	L	82.7	Confident	81.3	Confident	80 Å²	80	94.2 Å²	94.2	42%	0.419	48%	0.483	S	S	.	.	H	α-helix	trans	-64.1	-40.7	177.7	-71.4	173.1	0	0	0	112	R497 E498 M504 L505	R497-L501 HydrophobicContact CG-CD1 4.42Å; R497-L501 VanDerWaalsContact O-CG 3.3Å; R497-L501 WeakPolarHBondContact O-CG 3.46Å; R497-L501 PolarHBondContact O-N 3.23Å; E498-L501 PolarHBondContact O-N 2.84Å; L501-M504 HydrophobicContact CD2-CE 3.66Å; L501-M504 PolarHBondContact O-N 2.85Å; L501-L505 WeakPolarHBondContact O-CG 3.47Å; L501-L505 PolarHBondContact O-N 2.88Å
502	R	79.5	Confident	80.7	Confident	166 Å²	166	94.3 Å²	94.3	63%	0.626	48%	0.482	S	S	*	.	H	α-helix	trans	-62.9	-42	175.5	-73.4	-176	-177.1	-166.8	0.7	111.9	E498 A499 M504 L505 S506	E498-R502 WeakPolarHBondContact O-CG 3.44Å; E498-R502 PolarHBondContact O-N 3.35Å; E498-R502 IonicContact OE1-CZ 3.59Å; E498-R502 IonicContact OE1-NE 2.69Å; E498-R502 PolarHBondContact OE1-NE 3Å; E498-R502 VanDerWaalsContact OE1-NE 3.1Å; E498-R502 IonicContact OE1-NH2 3.25Å; E498-R502 PolarHBondContact OE1-NH2 3.48Å; A499-R502 PolarHBondContact O-N 2.73Å; R502-M504 VanDerWaalsContact C-N 3.34Å; R502-L505 PolarHBondContact O-N 2.6Å; R502-S506 PolarHBondContact O-N 2.86Å
503	Q	81.2	Confident	80.1	Confident	123 Å²	123	95.4 Å²	95.4	58%	0.575	48%	0.481	S	S	*	.	H	α-helix	trans	-63.8	-41	175.4	-170.8	178.8	7.1	0	0	111.6	A499 Y500 S506 N507	A499-Q503 PolarHBondContact O-N 2.92Å; Y500-Q503 PolarHBondContact O-N 3.12Å; Q503-S506 PolarHBondContact O-N 2.9Å; Q503-N507 PolarHBondContact O-N 2.51Å
504	M	79.9	Confident	79.8	Confident	58 Å²	58	96.6 Å²	96.6	29%	0.286	48%	0.478	S	S	.	.	H	α-helix	trans	-64.2	-41	177.5	-155.9	-168	-23.7	0	0	112.2	Y500 L501 R502 N507 R508	Y500-M504 HydrophobicContact CD1-CE 4.07Å; Y500-M504 HydrophobicContact CE1-CE 3.59Å; Y500-M504 PolarHBondContact O-N 2.86Å; L501-M504 HydrophobicContact CD2-CE 3.66Å; L501-M504 PolarHBondContact O-N 2.85Å; R502-M504 VanDerWaalsContact C-N 3.34Å; M504-N507 PolarHBondContact O-N 2.91Å; M504-R508 WeakPolarHBondContact O-CG 3.46Å; M504-R508 PolarHBondContact O-N 2.93Å
505	L	75.6	Confident	79.4	Confident	91 Å²	91	98.8 Å²	98.8	48%	0.476	48%	0.481	S	S	.	.	H	α-helix	trans	-62.6	-47.2	174.1	-77.8	166.1	0	0	0	111.4	L501 R502 N507 R508 E509	L501-L505 WeakPolarHBondContact O-CG 3.47Å; L501-L505 PolarHBondContact O-N 2.88Å; R502-L505 PolarHBondContact O-N 2.6Å; L505-N507 VanDerWaalsContact C-N 3.31Å; L505-N507 PolarHBondContact O-N 3.47Å; L505-R508 PolarHBondContact O-N 2.57Å; L505-R508 VanDerWaalsContact O-N 3.11Å; L505-E509 WeakPolarHBondContact O-CG 3.47Å; L505-E509 PolarHBondContact O-N 2.84Å
506	S	80.5	Confident	78.8	Confident	65 Å²	65	99.5 Å²	99.5	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-58.9	-40.7	176.8	-177.9	0	0	0	0	112.5	R502 Q503 A510	R502-S506 PolarHBondContact O-N 2.86Å; Q503-S506 PolarHBondContact O-N 2.9Å; S506-A510 PolarHBondContact O-N 3Å
507	N	77.8	Confident	78.2	Confident	102 Å²	102	101 Å²	101	55%	0.545	49%	0.489	S	S	.	.	H	α-helix	trans	-67.2	-38.2	176.5	-72.6	-13.1	0	0	0	111.8	Q503 M504 L505 A510 G511	Q503-N507 PolarHBondContact O-N 2.51Å; M504-N507 PolarHBondContact O-N 2.91Å; L505-N507 VanDerWaalsContact C-N 3.31Å; L505-N507 PolarHBondContact O-N 3.47Å; N507-A510 PolarHBondContact O-N 3.04Å; N507-G511 PolarHBondContact O-N 3.06Å; N507-G511 VanDerWaalsContact O-N 3.08Å
508	R	76.7	Confident	78	Confident	128 Å²	128	97.7 Å²	97.7	48%	0.483	48%	0.48	S	S	.	.	H	α-helix	trans	-68.1	-40.7	176	-76.4	-178.9	174.9	-172.6	-4.9	112	M504 L505 A510 G511 M512 E568	M504-R508 WeakPolarHBondContact O-CG 3.46Å; M504-R508 PolarHBondContact O-N 2.93Å; L505-R508 PolarHBondContact O-N 2.57Å; L505-R508 VanDerWaalsContact O-N 3.11Å; R508-A510 VanDerWaalsContact C-N 3.32Å; R508-A510 PolarHBondContact O-N 3.38Å; R508-G511 PolarHBondContact O-N 2.81Å; R508-M512 PolarHBondContact O-N 2.87Å; R508-E568 IonicContact CZ-OE1 3.07Å; R508-E568 IonicContact NH1-OE1 3.45Å; R508-E568 PolarHBondContact NH1-OE1 2.82Å; R508-E568 IonicContact NH2-OE1 4Å
509	E	76	Confident	77.4	Confident	89 Å²	89	96.8 Å²	96.8	42%	0.416	48%	0.48	S	S	.	.	H	α-helix	trans	-64.9	-34.6	174.5	-73.4	178.6	176.6	0	0	112.5	L505 R513	L505-E509 WeakPolarHBondContact O-CG 3.47Å; L505-E509 PolarHBondContact O-N 2.84Å; E509-R513 WeakPolarHBondContact O-CG 3.41Å; E509-R513 PolarHBondContact O-N 2.8Å
510	A	75.9	Confident	77	Confident	48 Å²	48	99.3 Å²	99.3	40%	0.397	48%	0.482	S	S	.	.	H	α-helix	trans	-65.3	-44.6	172.2	0	0	0	0	0	111.7	S506 N507 R508 M512 R513 E514	S506-A510 PolarHBondContact O-N 3Å; N507-A510 PolarHBondContact O-N 3.04Å; R508-A510 VanDerWaalsContact C-N 3.32Å; R508-A510 PolarHBondContact O-N 3.38Å; A510-M512 VanDerWaalsContact C-N 3.33Å; A510-M512 PolarHBondContact O-N 2.87Å; A510-R513 PolarHBondContact O-N 3.35Å; A510-E514 PolarHBondContact O-N 2.81Å
511	G	77.5	Confident	76.4	Confident	28 Å²	28	96.6 Å²	96.6	29%	0.289	48%	0.477	S	S	.	.	H	α-helix	trans	-63.9	-36.7	175.9	0	0	0	0	0	113.2	N507 R508 E514 I515	N507-G511 PolarHBondContact O-N 3.06Å; N507-G511 VanDerWaalsContact O-N 3.08Å; R508-G511 PolarHBondContact O-N 2.81Å; G511-E514 PolarHBondContact O-N 2.83Å; G511-I515 WeakPolarHBondContact O-CG1 3.48Å; G511-I515 PolarHBondContact O-N 3.38Å; G511-I515 VanDerWaalsContact O-N 3.11Å
512	M	73.5	Confident	75.6	Confident	116 Å²	116	97.4 Å²	97.4	57%	0.571	48%	0.481	S	S	*	.	H	α-helix	trans	-66.6	-43.1	175.8	-164.5	149.6	61.1	0	0	111.5	R508 A510 E514 I515 D516	R508-M512 PolarHBondContact O-N 2.87Å; A510-M512 VanDerWaalsContact C-N 3.33Å; A510-M512 PolarHBondContact O-N 2.87Å; M512-E514 VanDerWaalsContact C-N 3.31Å; M512-E514 PolarHBondContact O-N 2.75Å; M512-I515 WeakPolarHBondContact O-CB 3.43Å; M512-I515 PolarHBondContact O-N 3.1Å; M512-I515 VanDerWaalsContact O-N 3.11Å; M512-D516 PolarHBondContact O-N 3.38Å
513	R	74.3	Confident	74.6	Confident	125 Å²	125	95 Å²	95	47%	0.472	48%	0.477	S	S	.	.	H	α-helix	trans	-60.3	-37.5	173	-79.4	-171.9	-78.2	175.4	-10.1	113.3	E509 A510 I515 D516 Q517	E509-R513 WeakPolarHBondContact O-CG 3.41Å; E509-R513 PolarHBondContact O-N 2.8Å; A510-R513 PolarHBondContact O-N 3.35Å; R513-I515 VanDerWaalsContact C-N 3.31Å; R513-D516 PolarHBondContact O-N 2.89Å; R513-Q517 WeakPolarHBondContact O-CB 3.48Å; R513-Q517 PolarHBondContact O-N 3.34Å
514	E	78	Confident	73.4	Confident	105 Å²	105	93.3 Å²	93.3	49%	0.491	47%	0.472	S	S	.	.	H	α-helix	trans	-66.6	-35.2	176.1	-160.2	-164.3	152.1	0	0	111.8	A510 G511 M512 K518	A510-E514 PolarHBondContact O-N 2.81Å; G511-E514 PolarHBondContact O-N 2.83Å; M512-E514 VanDerWaalsContact C-N 3.31Å; M512-E514 PolarHBondContact O-N 2.75Å; E514-K518 WeakPolarHBondContact O-CG 3.31Å; E514-K518 PolarHBondContact O-N 2.9Å; E514-K518 VanDerWaalsContact O-N 3.11Å; E514-K518 WeakPolarHBondContact OE1-CE 3.19Å; E514-K518 IonicContact OE1-NZ 2.96Å; E514-K518 PolarHBondContact OE1-NZ 2.94Å
515	I	73.3	Confident	72.3	Confident	104 Å²	104	95.7 Å²	95.7	53%	0.533	49%	0.485	S	S	.	.	H	α-helix	trans	-68.9	-46.6	174	-67.9	168	0	0	0	110.2	G511 M512 R513 Q517 K518 V519	G511-I515 WeakPolarHBondContact O-CG1 3.48Å; G511-I515 PolarHBondContact O-N 3.38Å; G511-I515 VanDerWaalsContact O-N 3.11Å; M512-I515 WeakPolarHBondContact O-CB 3.43Å; M512-I515 PolarHBondContact O-N 3.1Å; M512-I515 VanDerWaalsContact O-N 3.11Å; R513-I515 VanDerWaalsContact C-N 3.31Å; I515-Q517 VanDerWaalsContact C-N 3.28Å; I515-Q517 PolarHBondContact O-N 3.39Å; I515-K518 CarbonylContact O-C 3.53Å; I515-K518 WeakPolarHBondContact O-CA 3.07Å; I515-K518 WeakPolarHBondContact O-CB 3.45Å; I515-K518 PolarHBondContact O-N 2.68Å; I515-V519 HydrophobicContact CG2-CG2 4.31Å; I515-V519 WeakPolarHBondContact O-CG2 3.26Å; I515-V519 PolarHBondContact O-N 3.43Å
516	D	73.9	Confident	71.2	Confident	98 Å²	98	97.6 Å²	97.6	52%	0.524	49%	0.491	S	S	.	.	H	α-helix	trans	-58.2	-42.7	178.3	-67.2	-23.8	0	0	0	111.1	M512 R513 K518 V519 E520	M512-D516 PolarHBondContact O-N 3.38Å; R513-D516 PolarHBondContact O-N 2.89Å; D516-K518 VanDerWaalsContact C-N 3.31Å; D516-K518 PolarHBondContact O-N 3.34Å; D516-V519 PolarHBondContact O-N 2.83Å; D516-E520 WeakPolarHBondContact O-CB 3.47Å; D516-E520 PolarHBondContact O-N 3.15Å
517	Q	74	Confident	69.9	Low	122 Å²	122	101.2 Å²	101.2	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-66.4	-32.6	177	-154.9	171.9	29.2	0	0	112.5	R513 I515 N521	R513-Q517 WeakPolarHBondContact O-CB 3.48Å; R513-Q517 PolarHBondContact O-N 3.34Å; I515-Q517 VanDerWaalsContact C-N 3.28Å; I515-Q517 PolarHBondContact O-N 3.39Å; Q517-N521 WeakPolarHBondContact O-CB 3.49Å; Q517-N521 PolarHBondContact O-N 2.9Å; Q517-N521 PolarHBondContact O-ND2 3.19Å; Q517-N521 VanDerWaalsContact O-ND2 3.09Å
518	K	77.7	Confident	68.6	Low	112 Å²	112	105.3 Å²	105.3	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-71.2	-38	172.6	-76.8	172	-173.3	164.8	0	111.9	E514 I515 D516 N521 I522	E514-K518 WeakPolarHBondContact O-CG 3.31Å; E514-K518 PolarHBondContact O-N 2.9Å; E514-K518 VanDerWaalsContact O-N 3.11Å; E514-K518 WeakPolarHBondContact OE1-CE 3.19Å; E514-K518 IonicContact OE1-NZ 2.96Å; E514-K518 PolarHBondContact OE1-NZ 2.94Å; I515-K518 CarbonylContact O-C 3.53Å; I515-K518 WeakPolarHBondContact O-CA 3.07Å; I515-K518 WeakPolarHBondContact O-CB 3.45Å; I515-K518 PolarHBondContact O-N 2.68Å; D516-K518 VanDerWaalsContact C-N 3.31Å; D516-K518 PolarHBondContact O-N 3.34Å; K518-N521 PolarHBondContact O-N 2.81Å; K518-I522 VanDerWaalsContact O-CG1 3.26Å; K518-I522 WeakPolarHBondContact O-CG1 3.17Å; K518-I522 PolarHBondContact O-N 3.25Å
519	V	72.6	Confident	66.9	Low	67 Å²	67	104.6 Å²	104.6	41%	0.406	52%	0.521	S	S	.	.	H	α-helix	trans	-65.2	-46.7	175.6	173	0	0	0	0	110	I515 D516 N521 I522 E523	I515-V519 HydrophobicContact CG2-CG2 4.31Å; I515-V519 WeakPolarHBondContact O-CG2 3.26Å; I515-V519 PolarHBondContact O-N 3.43Å; D516-V519 PolarHBondContact O-N 2.83Å; V519-N521 VanDerWaalsContact C-N 3.31Å; V519-N521 PolarHBondContact O-N 3.07Å; V519-I522 PolarHBondContact O-N 3.36Å; V519-E523 PolarHBondContact O-N 3.19Å
520	E	72	Confident	65.1	Low	111 Å²	111	106.9 Å²	106.9	52%	0.519	54%	0.536	S	S	.	.	H	α-helix	trans	-60.9	-38.7	175.9	-172.8	-178.7	-173.4	0	0	112	D516 I522 E523 N524	D516-E520 WeakPolarHBondContact O-CB 3.47Å; D516-E520 PolarHBondContact O-N 3.15Å; E520-I522 VanDerWaalsContact C-N 3.35Å; E520-E523 PolarHBondContact O-N 2.79Å; E520-N524 VanDerWaalsContact O-CB 3.28Å; E520-N524 WeakPolarHBondContact O-CB 3.19Å; E520-N524 VanDerWaalsContact O-CG 3.28Å; E520-N524 PolarHBondContact O-N 3.35Å; E520-N524 PolarHBondContact O-ND2 3.4Å; E520-N524 VanDerWaalsContact O-ND2 3.09Å
521	N	71.5	Confident	63.4	Low	91 Å²	91	109.1 Å²	109.1	49%	0.487	55%	0.549	S	S	.	.	H	α-helix	trans	-66	-35.7	173.9	-75.8	-28.2	0	0	0	112.8	Q517 K518 V519 I525	Q517-N521 WeakPolarHBondContact O-CB 3.49Å; Q517-N521 PolarHBondContact O-N 2.9Å; Q517-N521 PolarHBondContact O-ND2 3.19Å; Q517-N521 VanDerWaalsContact O-ND2 3.09Å; K518-N521 PolarHBondContact O-N 2.81Å; V519-N521 VanDerWaalsContact C-N 3.31Å; V519-N521 PolarHBondContact O-N 3.07Å; N521-I525 WeakPolarHBondContact O-CD1 3.44Å; N521-I525 VanDerWaalsContact O-CG1 3.24Å; N521-I525 WeakPolarHBondContact O-CG1 3.14Å; N521-I525 PolarHBondContact O-N 3.48Å; N521-I525 VanDerWaalsContact O-N 3.1Å
522	I	65.8	Low	61.7	Low	97 Å²	97	112.3 Å²	112.3	50%	0.497	57%	0.567	S	S	.	*	H	α-helix	trans	-69.3	-46	175.9	-69.4	164.5	0	0	0	109.9	K518 V519 E520 N524 I525 E526	K518-I522 VanDerWaalsContact O-CG1 3.26Å; K518-I522 WeakPolarHBondContact O-CG1 3.17Å; K518-I522 PolarHBondContact O-N 3.25Å; V519-I522 PolarHBondContact O-N 3.36Å; E520-I522 VanDerWaalsContact C-N 3.35Å; I522-N524 VanDerWaalsContact C-N 3.3Å; I522-N524 PolarHBondContact O-N 3.49Å; I522-I525 PolarHBondContact O-N 2.65Å; I522-I525 VanDerWaalsContact O-N 3.12Å; I522-E526 PolarHBondContact O-N 3.33Å
523	E	58.5	Low	60.2	Low	115 Å²	115	116.7 Å²	116.7	54%	0.537	58%	0.583	S	S	.	*	H	α-helix	trans	-60.6	-39.4	175.9	-73.9	-179.5	168.6	0	0	111.6	V519 E520 I525 E526 M527	V519-E523 PolarHBondContact O-N 3.19Å; E520-E523 PolarHBondContact O-N 2.79Å; E523-I525 VanDerWaalsContact C-N 3.34Å; E523-I525 PolarHBondContact O-N 3.48Å; E523-E526 PolarHBondContact O-N 2.87Å; E523-M527 WeakPolarHBondContact O-CB 3.28Å; E523-M527 VanDerWaalsContact O-CG 3.26Å; E523-M527 WeakPolarHBondContact O-CG 3.39Å; E523-M527 PolarHBondContact O-N 3.28Å
524	N	57	Low	58.7	Low	88 Å²	88	119.7 Å²	119.7	47%	0.471	60%	0.6	S	S	.	*	H	α-helix	trans	-69.4	-27.8	176.1	-79.2	-38.7	0	0	0	113.8	E520 I522 K528	E520-N524 VanDerWaalsContact O-CB 3.28Å; E520-N524 WeakPolarHBondContact O-CB 3.19Å; E520-N524 VanDerWaalsContact O-CG 3.28Å; E520-N524 PolarHBondContact O-N 3.35Å; E520-N524 PolarHBondContact O-ND2 3.4Å; E520-N524 VanDerWaalsContact O-ND2 3.09Å; I522-N524 VanDerWaalsContact C-N 3.3Å; I522-N524 PolarHBondContact O-N 3.49Å; N524-K528 PolarHBondContact O-N 3.14Å
525	I	56.6	Low	57.1	Low	108 Å²	108	121.1 Å²	121.1	55%	0.554	61%	0.61	S	S	*	*	H	α-helix	trans	-74.7	-43	171.9	-69.3	165.2	0	0	0	109.6	N521 I522 E523 M527 K528 D529	N521-I525 WeakPolarHBondContact O-CD1 3.44Å; N521-I525 VanDerWaalsContact O-CG1 3.24Å; N521-I525 WeakPolarHBondContact O-CG1 3.14Å; N521-I525 PolarHBondContact O-N 3.48Å; N521-I525 VanDerWaalsContact O-N 3.1Å; I522-I525 PolarHBondContact O-N 2.65Å; I522-I525 VanDerWaalsContact O-N 3.12Å; E523-I525 VanDerWaalsContact C-N 3.34Å; E523-I525 PolarHBondContact O-N 3.48Å; I525-M527 VanDerWaalsContact C-N 3.33Å; I525-M527 PolarHBondContact O-N 3.4Å; I525-K528 PolarHBondContact O-N 3.17Å; I525-D529 PolarHBondContact O-N 2.85Å; I525-D529 VanDerWaalsContact O-N 3.09Å
526	E	52.4	Low	55.9	Low	130 Å²	130	120.4 Å²	120.4	61%	0.607	61%	0.612	S	S	*	*	H	α-helix	trans	-64.6	-35.9	177.5	-74.5	-175	163.4	0	0	112.4	I522 E523 K528 D529	I522-E526 PolarHBondContact O-N 3.33Å; E523-E526 PolarHBondContact O-N 2.87Å; E526-K528 VanDerWaalsContact C-N 3.34Å; E526-K528 PolarHBondContact O-N 3.06Å; E526-D529 PolarHBondContact O-N 2.98Å
527	M	52.1	Low	55	Low	141 Å²	141	125.5 Å²	125.5	70%	0.695	63%	0.63	S	S	*	*	H	α-helix	trans	-72	-23	176.7	-71.9	-72.4	-79	0	0	113.8	E523 I525	E523-M527 WeakPolarHBondContact O-CB 3.28Å; E523-M527 VanDerWaalsContact O-CG 3.26Å; E523-M527 WeakPolarHBondContact O-CG 3.39Å; E523-M527 PolarHBondContact O-N 3.28Å; I525-M527 VanDerWaalsContact C-N 3.33Å; I525-M527 PolarHBondContact O-N 3.4Å
528	K	51.6	Low	53.9	Low	188 Å²	188	127.4 Å²	127.4	82%	0.817	64%	0.644	S	S	*	*	H	α-helix	trans	-87.2	-26.4	174.2	-86.4	-177.7	176.6	174.5	0	113.4	N524 I525 E526	N524-K528 PolarHBondContact O-N 3.14Å; I525-K528 PolarHBondContact O-N 3.17Å; E526-K528 VanDerWaalsContact C-N 3.34Å; E526-K528 PolarHBondContact O-N 3.06Å
529	D	41.6	Very low	52.8	Low	114 Å²	114	125.2 Å²	125.2	61%	0.61	64%	0.637	S	S	*	*			trans	-104.7	43.5	-178.8	-77.6	-20.5	0	0	0	112.7	I525 E526 S531	I525-D529 PolarHBondContact O-N 2.85Å; I525-D529 VanDerWaalsContact O-N 3.09Å; E526-D529 PolarHBondContact O-N 2.98Å; D529-S531 PolarHBondContact O-N 3.39Å
530	N	38.3	Very low	52.5	Low	137 Å²	137	125.1 Å²	125.1	73%	0.733	64%	0.639	S	S	*	*			trans	-68.4	36.3	166.7	-89.9	-20.4	0	0	0	113.3
531	S	39.8	Very low	52.3	Low	95 Å²	95	125 Å²	125	66%	0.664	65%	0.648	S	S	*	*	S	Bend	trans	-93	101	162.1	70.5	0	0	0	0	108.9	D529 F533	D529-S531 PolarHBondContact O-N 3.39Å; S531-F533 PolarHBondContact O-N 2.99Å
532	S	41.9	Very low	52.4	Low	95 Å²	95	126.1 Å²	126.1	66%	0.664	65%	0.654	S	S	*	*			trans	-11.9	115.7	168.8	63	0	0	0	0	115.3	K534	S532-K534 PolarHBondContact O-N 3.24Å
533	F	42.2	Very low	52.8	Low	208 Å²	208	127.8 Å²	127.8	91%	0.912	66%	0.657	S	S	*	*			trans	-39.6	103.4	170.4	-118.9	-99	0	0	0	111.9	S531 L535	S531-F533 PolarHBondContact O-N 2.99Å; F533-L535 PolarHBondContact O-N 2.91Å
534	K	42.3	Very low	53.4	Low	187 Å²	187	126.3 Å²	126.3	81%	0.813	65%	0.653	S	S	*	*			trans	-89.9	100.7	170	-76.5	-178.5	-178.9	172.4	0	108.7	S532 P536	S532-K534 PolarHBondContact O-N 3.24Å; K534-P536 WeakPolarHBondContact O-CD 3.49Å
535	L	43.4	Very low	54.3	Low	136 Å²	136	130.9 Å²	130.9	71%	0.712	66%	0.664	S	S	*	*			trans	-52.8	124.3	164.1	-108.4	87.7	0	0	0	108.9	F533 K537	F533-L535 PolarHBondContact O-N 2.91Å; L535-K537 PolarHBondContact O-N 3.16Å; L535-K537 VanDerWaalsContact O-N 3.1Å
536	P	49.7	Very low	55.3	Low	89 Å²	89	130.6 Å²	130.6	58%	0.578	66%	0.663	S	S	*	*			trans	-63.8	115.3	176.9	-17.3	28.7	0	0	0	109.4	K534 N538 I539	K534-P536 WeakPolarHBondContact O-CD 3.49Å; P536-N538 PolarHBondContact O-N 2.92Å; P536-I539 HydrophobicContact CB-CD1 4.16Å; P536-I539 HydrophobicContact CB-CG1 4.22Å; P536-I539 HydrophobicContact CG-CD1 4.02Å
537	K	53.3	Low	56.5	Low	205 Å²	205	128.1 Å²	128.1	89%	0.891	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	2.6	-168.9	-74.9	-173.4	174.4	-177.2	0	116.4	L535	L535-K537 PolarHBondContact O-N 3.16Å; L535-K537 VanDerWaalsContact O-N 3.1Å
538	N	51.1	Low	57.8	Low	162 Å²	162	125.6 Å²	125.6	87%	0.866	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.9	53.2	-177.4	-79.3	-22	0	0	0	112.8	P536	P536-N538 PolarHBondContact O-N 2.92Å
539	I	55.5	Low	59.1	Low	65 Å²	65	122.8 Å²	122.8	33%	0.333	63%	0.63	S	S	.	*			trans	-85.5	127.4	171.8	-69	169.3	0	0	0	109.1	P536 K543 L544	P536-I539 HydrophobicContact CB-CD1 4.16Å; P536-I539 HydrophobicContact CB-CG1 4.22Å; P536-I539 HydrophobicContact CG-CD1 4.02Å; I539-K543 HydrophobicContact CG2-CB 4.14Å; I539-L544 HydrophobicContact CG2-CB 4.12Å; I539-L544 HydrophobicContact CG2-CD1 4.46Å
540	S	66.1	Low	61	Low	66 Å²	66	120.8 Å²	120.8	46%	0.462	62%	0.62	S	S	.	*			trans	-65.4	142.6	175.8	64.1	0	0	0	0	110.6	N542 K543 L544	S540-N542 PolarHBondContact O-N 3.3Å; S540-N542 VanDerWaalsContact O-N 3.1Å; S540-K543 PolarHBondContact O-N 3.01Å; S540-K543 WeakPolarHBondContact OG-CB 3.44Å; S540-L544 PolarHBondContact O-N 2.98Å; S540-L544 VanDerWaalsContact O-N 3.12Å
541	P	68.7	Low	62.9	Low	107 Å²	107	121.2 Å²	121.2	70%	0.695	61%	0.612	S	S	*	*	H	α-helix	trans	-58.5	-29.2	-175.6	18.9	-30.2	0	0	0	113.2	R545	P541-R545 PolarHBondContact O-N 3.14Å
542	N	72.9	Confident	64.9	Low	116 Å²	116	120.8 Å²	120.8	62%	0.62	60%	0.6	S	S	*	*	H	α-helix	trans	-66.5	-44.5	174.4	-67.4	-4.6	0	0	0	111.8	S540 L544 R545 D546	S540-N542 PolarHBondContact O-N 3.3Å; S540-N542 VanDerWaalsContact O-N 3.1Å; N542-L544 VanDerWaalsContact C-N 3.31Å; N542-L544 PolarHBondContact O-N 2.8Å; N542-R545 WeakPolarHBondContact O-CB 3.17Å; N542-R545 PolarHBondContact O-N 2.86Å; N542-R545 VanDerWaalsContact O-N 3.14Å; N542-D546 VanDerWaalsContact O-CG 3.29Å; N542-D546 PolarHBondContact O-N 2.85Å
543	K	73.8	Confident	66.8	Low	131 Å²	131	122 Å²	122	57%	0.57	60%	0.595	S	S	*	*	H	α-helix	trans	-68	-32.8	179.8	-163.8	171.8	-173.3	177.4	0	112	I539 S540 M547	I539-K543 HydrophobicContact CG2-CB 4.14Å; S540-K543 PolarHBondContact O-N 3.01Å; S540-K543 WeakPolarHBondContact OG-CB 3.44Å; K543-M547 WeakPolarHBondContact O-CB 3.49Å; K543-M547 VanDerWaalsContact O-CG 3.25Å; K543-M547 WeakPolarHBondContact O-CG 3.49Å; K543-M547 PolarHBondContact O-N 3.39Å
544	L	72	Confident	68.7	Low	84 Å²	84	116.8 Å²	116.8	44%	0.44	57%	0.572	S	S	.	*	H	α-helix	trans	-65.6	-41.5	171.9	-167.3	78.7	0	0	0	111.3	I539 S540 N542 M547 I548	I539-L544 HydrophobicContact CG2-CB 4.12Å; I539-L544 HydrophobicContact CG2-CD1 4.46Å; S540-L544 PolarHBondContact O-N 2.98Å; S540-L544 VanDerWaalsContact O-N 3.12Å; N542-L544 VanDerWaalsContact C-N 3.31Å; N542-L544 PolarHBondContact O-N 2.8Å; L544-M547 PolarHBondContact O-N 3.13Å; L544-I548 HydrophobicContact CD2-CD1 4.45Å; L544-I548 HydrophobicContact CG-CD1 4.17Å; L544-I548 VanDerWaalsContact O-CG1 3.27Å; L544-I548 WeakPolarHBondContact O-CG1 3.22Å; L544-I548 PolarHBondContact O-N 3.05Å
545	R	75.4	Confident	70.6	Confident	185 Å²	185	114.7 Å²	114.7	70%	0.698	57%	0.565	S	S	*	*	H	α-helix	trans	-64.6	-44.4	178	-163.4	174.2	-169.9	166.4	2.3	111.9	P541 N542 M547 I548 E549	P541-R545 PolarHBondContact O-N 3.14Å; N542-R545 WeakPolarHBondContact O-CB 3.17Å; N542-R545 PolarHBondContact O-N 2.86Å; N542-R545 VanDerWaalsContact O-N 3.14Å; R545-M547 VanDerWaalsContact C-N 3.31Å; R545-M547 PolarHBondContact O-N 2.62Å; R545-I548 PolarHBondContact O-N 3Å; R545-E549 PolarHBondContact O-N 2.89Å
546	D	78	Confident	72.5	Confident	101 Å²	101	115.7 Å²	115.7	54%	0.54	56%	0.559	S	S	.	*	H	α-helix	trans	-61.2	-40.7	175.3	-62.9	-19.1	0	0	0	111.3	N542 E549 D550	N542-D546 VanDerWaalsContact O-CG 3.29Å; N542-D546 PolarHBondContact O-N 2.85Å; D546-E549 PolarHBondContact O-N 3.19Å; D546-D550 WeakPolarHBondContact O-CB 3.48Å; D546-D550 PolarHBondContact O-N 3.33Å
547	M	76.4	Confident	74.2	Confident	79 Å²	79	115.4 Å²	115.4	39%	0.389	55%	0.552	S	S	.	*	H	α-helix	trans	-63.2	-44.8	174.7	-75.1	177.9	67.3	0	0	111.7	K543 L544 R545 E549 D550 Y551	K543-M547 WeakPolarHBondContact O-CB 3.49Å; K543-M547 VanDerWaalsContact O-CG 3.25Å; K543-M547 WeakPolarHBondContact O-CG 3.49Å; K543-M547 PolarHBondContact O-N 3.39Å; L544-M547 PolarHBondContact O-N 3.13Å; R545-M547 VanDerWaalsContact C-N 3.31Å; R545-M547 PolarHBondContact O-N 2.62Å; M547-E549 VanDerWaalsContact C-N 3.32Å; M547-E549 PolarHBondContact O-N 2.8Å; M547-D550 PolarHBondContact O-N 3.27Å; M547-Y551 HydrophobicContact CB-CD2 4.48Å; M547-Y551 HydrophobicContact CE-CE2 4.16Å; M547-Y551 WeakPolarHBondContact O-CB 3.33Å; M547-Y551 WeakPolarHBondContact O-CD2 3.5Å; M547-Y551 PolarHBondContact O-N 2.9Å
548	I	79.4	Confident	75.6	Confident	88 Å²	88	111 Å²	111	45%	0.451	54%	0.538	S	S	.	.	H	α-helix	trans	-60.7	-43.3	178.2	-69.8	164.1	0	0	0	110.6	L544 R545 Y551 E552	L544-I548 HydrophobicContact CD2-CD1 4.45Å; L544-I548 HydrophobicContact CG-CD1 4.17Å; L544-I548 VanDerWaalsContact O-CG1 3.27Å; L544-I548 WeakPolarHBondContact O-CG1 3.22Å; L544-I548 PolarHBondContact O-N 3.05Å; R545-I548 PolarHBondContact O-N 3Å; I548-Y551 PolarHBondContact O-N 3.23Å; I548-E552 WeakPolarHBondContact O-CG 3.4Å; I548-E552 PolarHBondContact O-N 2.76Å
549	E	80.5	Confident	77.1	Confident	128 Å²	128	110.5 Å²	110.5	60%	0.598	53%	0.525	S	S	*	.	H	α-helix	trans	-67.1	-40.5	179.9	-159.2	167.6	-162.2	0	0	111.9	R545 D546 M547 E552 Q553	R545-E549 PolarHBondContact O-N 2.89Å; D546-E549 PolarHBondContact O-N 3.19Å; M547-E549 VanDerWaalsContact C-N 3.32Å; M547-E549 PolarHBondContact O-N 2.8Å; E549-E552 PolarHBondContact O-N 3.21Å; E549-Q553 WeakPolarHBondContact O-CB 3.32Å; E549-Q553 PolarHBondContact O-N 2.62Å
550	D	79.8	Confident	78.5	Confident	72 Å²	72	116.5 Å²	116.5	39%	0.385	54%	0.543	S	S	.	.	H	α-helix	trans	-63.9	-39	172.8	-172.5	48.1	0	0	0	111.9	D546 M547 Q553 K554	D546-D550 WeakPolarHBondContact O-CB 3.48Å; D546-D550 PolarHBondContact O-N 3.33Å; M547-D550 PolarHBondContact O-N 3.27Å; D550-Q553 PolarHBondContact O-N 3.33Å; D550-K554 WeakPolarHBondContact O-CB 3.43Å; D550-K554 WeakPolarHBondContact O-CG 3.4Å; D550-K554 PolarHBondContact O-N 2.99Å; D550-K554 WeakPolarHBondContact OD2-CE 3.47Å; D550-K554 IonicContact OD2-NZ 2.95Å; D550-K554 PolarHBondContact OD2-NZ 2.93Å
551	Y	79	Confident	79.5	Confident	146 Å²	146	120 Å²	120	57%	0.573	55%	0.55	S	S	*	.	H	α-helix	trans	-66.4	-43.6	174.5	-85.3	-65.8	0	0	0	112.3	M547 I548 Q553 K554 Q555	M547-Y551 HydrophobicContact CB-CD2 4.48Å; M547-Y551 HydrophobicContact CE-CE2 4.16Å; M547-Y551 WeakPolarHBondContact O-CB 3.33Å; M547-Y551 WeakPolarHBondContact O-CD2 3.5Å; M547-Y551 PolarHBondContact O-N 2.9Å; I548-Y551 PolarHBondContact O-N 3.23Å; Y551-Q553 VanDerWaalsContact C-N 3.29Å; Y551-Q553 PolarHBondContact O-N 3.1Å; Y551-K554 PolarHBondContact O-N 2.84Å; Y551-Q555 VanDerWaalsContact O-CB 3.32Å; Y551-Q555 WeakPolarHBondContact O-CB 3.46Å; Y551-Q555 PolarHBondContact O-N 2.85Å
552	E	81.8	Confident	80.3	Confident	86 Å²	86	119.3 Å²	119.3	40%	0.402	54%	0.541	S	S	.	.	H	α-helix	trans	-61	-40.7	174.2	-78.1	-169.7	-168.5	0	0	111.4	I548 E549 Q555 R556	I548-E552 WeakPolarHBondContact O-CG 3.4Å; I548-E552 PolarHBondContact O-N 2.76Å; E549-E552 PolarHBondContact O-N 3.21Å; E552-Q555 PolarHBondContact O-N 2.88Å; E552-R556 WeakPolarHBondContact O-CG 3.37Å; E552-R556 PolarHBondContact O-N 2.82Å; E552-R556 IonicContact OE2-NH2 3.2Å; E552-R556 PolarHBondContact OE2-NH2 3.4Å
553	Q	81.1	Confident	81	Confident	120 Å²	120	117.9 Å²	117.9	56%	0.561	53%	0.53	S	S	*	.	H	α-helix	trans	-66.5	-44.3	178	-166.4	172.5	0.6	0	0	111.4	E549 D550 Y551 Q555 R556 I557	E549-Q553 WeakPolarHBondContact O-CB 3.32Å; E549-Q553 PolarHBondContact O-N 2.62Å; D550-Q553 PolarHBondContact O-N 3.33Å; Y551-Q553 VanDerWaalsContact C-N 3.29Å; Y551-Q553 PolarHBondContact O-N 3.1Å; Q553-Q555 VanDerWaalsContact C-N 3.35Å; Q553-Q555 PolarHBondContact O-N 2.87Å; Q553-R556 PolarHBondContact O-N 3Å; Q553-I557 HydrophobicContact CG-CD1 4.33Å; Q553-I557 VanDerWaalsContact O-CG1 3.31Å; Q553-I557 WeakPolarHBondContact O-CG1 3.4Å; Q553-I557 PolarHBondContact O-N 3.14Å
554	K	83.3	Confident	81.8	Confident	100 Å²	100	117.9 Å²	117.9	44%	0.435	53%	0.53	S	S	.	.	H	α-helix	trans	-59.3	-44.1	172	-79.3	169.2	178	156.9	0	111.7	D550 Y551 R556 I557 L558	D550-K554 WeakPolarHBondContact O-CB 3.43Å; D550-K554 WeakPolarHBondContact O-CG 3.4Å; D550-K554 PolarHBondContact O-N 2.99Å; D550-K554 WeakPolarHBondContact OD2-CE 3.47Å; D550-K554 IonicContact OD2-NZ 2.95Å; D550-K554 PolarHBondContact OD2-NZ 2.93Å; Y551-K554 PolarHBondContact O-N 2.84Å; K554-R556 PolarHBondContact O-N 3.11Å; K554-I557 PolarHBondContact O-N 3.16Å; K554-L558 WeakPolarHBondContact O-CB 3.46Å; K554-L558 WeakPolarHBondContact O-CG 3.48Å; K554-L558 PolarHBondContact O-N 2.83Å
555	Q	81	Confident	82.5	Confident	142 Å²	142	118.6 Å²	118.6	66%	0.664	53%	0.534	S	S	*	.	H	α-helix	trans	-61.1	-43.1	177.5	-169.5	-177.3	8.1	0	0	111.4	Y551 E552 Q553 L558 Y559	Y551-Q555 VanDerWaalsContact O-CB 3.32Å; Y551-Q555 WeakPolarHBondContact O-CB 3.46Å; Y551-Q555 PolarHBondContact O-N 2.85Å; E552-Q555 PolarHBondContact O-N 2.88Å; Q553-Q555 VanDerWaalsContact C-N 3.35Å; Q553-Q555 PolarHBondContact O-N 2.87Å; Q555-L558 PolarHBondContact O-N 2.86Å; Q555-Y559 WeakPolarHBondContact O-CB 3.4Å; Q555-Y559 PolarHBondContact O-N 2.91Å
556	R	83.1	Confident	83.1	Confident	158 Å²	158	112.7 Å²	112.7	60%	0.596	52%	0.516	S	S	*	.	H	α-helix	trans	-64.1	-40.6	175.3	-70.5	178.7	-150.2	174.8	10	112.4	E552 Q553 K554 Y559 R560	E552-R556 WeakPolarHBondContact O-CG 3.37Å; E552-R556 PolarHBondContact O-N 2.82Å; E552-R556 IonicContact OE2-NH2 3.2Å; E552-R556 PolarHBondContact OE2-NH2 3.4Å; Q553-R556 PolarHBondContact O-N 3Å; K554-R556 PolarHBondContact O-N 3.11Å; R556-Y559 PolarHBondContact O-N 2.78Å; R556-R560 WeakPolarHBondContact O-CG 3.33Å; R556-R560 PolarHBondContact O-N 3.48Å
557	I	85.2	Confident	83.6	Confident	82 Å²	82	111 Å²	111	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-64.9	-45.3	176.8	-68.1	165.3	0	0	0	110.5	Q553 K554 R560 K561	Q553-I557 HydrophobicContact CG-CD1 4.33Å; Q553-I557 VanDerWaalsContact O-CG1 3.31Å; Q553-I557 WeakPolarHBondContact O-CG1 3.4Å; Q553-I557 PolarHBondContact O-N 3.14Å; K554-I557 PolarHBondContact O-N 3.16Å; I557-R560 PolarHBondContact O-N 2.98Å; I557-K561 HydrophobicContact CG2-CD 4.41Å; I557-K561 WeakPolarHBondContact O-CG 3.4Å; I557-K561 PolarHBondContact O-N 3.34Å
558	L	83.7	Confident	84.2	Confident	113 Å²	113	109.3 Å²	109.3	59%	0.592	50%	0.5	S	S	*	.	H	α-helix	trans	-63.7	-42.1	177.3	-72	172.1	0	0	0	111.6	K554 Q555 R560 K561 N562	K554-L558 WeakPolarHBondContact O-CB 3.46Å; K554-L558 WeakPolarHBondContact O-CG 3.48Å; K554-L558 PolarHBondContact O-N 2.83Å; Q555-L558 PolarHBondContact O-N 2.86Å; L558-R560 PolarHBondContact O-N 2.89Å; L558-K561 PolarHBondContact O-N 3.33Å; L558-N562 WeakPolarHBondContact O-CB 3.35Å; L558-N562 PolarHBondContact O-N 2.82Å
559	Y	83	Confident	84.6	Confident	151 Å²	151	109.8 Å²	109.8	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-60.3	-43.5	175.3	-173.3	-96.9	0	0	0	111.9	Q555 R556 N562 Q563	Q555-Y559 WeakPolarHBondContact O-CB 3.4Å; Q555-Y559 PolarHBondContact O-N 2.91Å; R556-Y559 PolarHBondContact O-N 2.78Å; Y559-N562 PolarHBondContact O-N 3.29Å; Y559-Q563 HydrophobicContact CD1-CG 4.14Å; Y559-Q563 HydrophobicContact CE1-CG 3.81Å; Y559-Q563 WeakPolarHBondContact O-CB 3.36Å; Y559-Q563 VanDerWaalsContact O-CG 3.29Å; Y559-Q563 WeakPolarHBondContact O-CG 3.39Å; Y559-Q563 PolarHBondContact O-N 3.05Å; Y559-Q563 PolarHBondContact OH-NE2 2.88Å; Y559-Q563 VanDerWaalsContact OH-NE2 3.14Å
560	R	85.4	Confident	84.9	Confident	191 Å²	191	112.2 Å²	112.2	72%	0.721	51%	0.506	S	S	*	.	H	α-helix	trans	-64	-42	174.7	-75.6	-179.1	-178.6	168.6	0.8	112.7	R556 I557 L558 Q563 F564	R556-R560 WeakPolarHBondContact O-CG 3.33Å; R556-R560 PolarHBondContact O-N 3.48Å; I557-R560 PolarHBondContact O-N 2.98Å; L558-R560 PolarHBondContact O-N 2.89Å; R560-Q563 PolarHBondContact O-N 3.42Å; R560-F564 WeakPolarHBondContact O-CB 3.38Å; R560-F564 PolarHBondContact O-N 2.64Å
561	K	86.6	Confident	85.3	Confident	140 Å²	140	114.6 Å²	114.6	61%	0.609	52%	0.515	S	S	*	.	H	α-helix	trans	-63.4	-41.9	175.9	-76.6	-176.1	176.1	-175.5	0	111.7	I557 L558 F564 L565	I557-K561 HydrophobicContact CG2-CD 4.41Å; I557-K561 WeakPolarHBondContact O-CG 3.4Å; I557-K561 PolarHBondContact O-N 3.34Å; L558-K561 PolarHBondContact O-N 3.33Å; K561-F564 PolarHBondContact O-N 3.17Å; K561-L565 WeakPolarHBondContact O-CB 3.44Å; K561-L565 PolarHBondContact O-N 3.35Å
562	N	85.1	Confident	85.8	Confident	93 Å²	93	111.2 Å²	111.2	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-66.2	-43.8	178	-163.8	-12.3	0	0	0	111	L558 Y559 F564 L565 I566	L558-N562 WeakPolarHBondContact O-CB 3.35Å; L558-N562 PolarHBondContact O-N 2.82Å; Y559-N562 PolarHBondContact O-N 3.29Å; N562-F564 VanDerWaalsContact C-N 3.35Å; N562-F564 PolarHBondContact O-N 3Å; N562-L565 PolarHBondContact O-N 3.07Å; N562-I566 VanDerWaalsContact O-CG1 3.28Å; N562-I566 WeakPolarHBondContact O-CG1 3.24Å; N562-I566 PolarHBondContact O-N 3.45Å; N562-I566 WeakPolarHBondContact OD1-CD1 3.4Å
563	Q	87.3	Confident	86.1	Confident	85 Å²	85	109.9 Å²	109.9	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-57.6	-45.6	173	-74.8	-71.3	-18.5	0	0	112.3	Y559 R560 I566 T567	Y559-Q563 HydrophobicContact CD1-CG 4.14Å; Y559-Q563 HydrophobicContact CE1-CG 3.81Å; Y559-Q563 WeakPolarHBondContact O-CB 3.36Å; Y559-Q563 VanDerWaalsContact O-CG 3.29Å; Y559-Q563 WeakPolarHBondContact O-CG 3.39Å; Y559-Q563 PolarHBondContact O-N 3.05Å; Y559-Q563 PolarHBondContact OH-NE2 2.88Å; Y559-Q563 VanDerWaalsContact OH-NE2 3.14Å; R560-Q563 PolarHBondContact O-N 3.42Å; Q563-I566 PolarHBondContact O-N 2.96Å; Q563-T567 PolarHBondContact O-N 3.35Å; Q563-T567 PolarHBondContact O-OG1 3.34Å; Q563-T567 VanDerWaalsContact O-OG1 3.08Å
564	F	90.4	Very high	86.5	Confident	131 Å²	131	107.6 Å²	107.6	58%	0.575	51%	0.508	S	S	*	.	H	α-helix	trans	-61.5	-43.4	175.7	177.2	-96.9	0	0	0	112.5	R560 K561 N562 T567 E568	R560-F564 WeakPolarHBondContact O-CB 3.38Å; R560-F564 PolarHBondContact O-N 2.64Å; K561-F564 PolarHBondContact O-N 3.17Å; N562-F564 VanDerWaalsContact C-N 3.35Å; N562-F564 PolarHBondContact O-N 3Å; F564-T567 VanDerWaalsContact C-OG1 3.31Å; F564-T567 VanDerWaalsContact CA-OG1 3.31Å; F564-T567 WeakPolarHBondContact CA-OG1 3.2Å; F564-T567 PolarHBondContact O-N 3.03Å; F564-T567 PolarHBondContact O-OG1 2.96Å; F564-E568 PolarHBondContact O-N 2.85Å
565	L	86.5	Confident	86.8	Confident	100 Å²	100	107.1 Å²	107.1	52%	0.524	51%	0.509	S	S	.	.	H	α-helix	trans	-64.1	-42.9	178.1	-162.6	83.8	0	0	0	111.3	K561 N562 T567 E568 I569	K561-L565 WeakPolarHBondContact O-CB 3.44Å; K561-L565 PolarHBondContact O-N 3.35Å; N562-L565 PolarHBondContact O-N 3.07Å; L565-T567 VanDerWaalsContact C-N 3.33Å; L565-T567 PolarHBondContact O-N 2.69Å; L565-E568 PolarHBondContact O-N 3.02Å; L565-I569 HydrophobicContact CD2-CD1 4.05Å; L565-I569 HydrophobicContact CG-CD1 3.92Å; L565-I569 HydrophobicContact CG-CG1 4.47Å; L565-I569 WeakPolarHBondContact O-CB 3.15Å; L565-I569 WeakPolarHBondContact O-CG1 3.3Å; L565-I569 PolarHBondContact O-N 3Å
566	I	87.7	Confident	87.1	Confident	61 Å²	61	107.5 Å²	107.5	31%	0.313	51%	0.508	S	S	.	.	H	α-helix	trans	-61.3	-42	176.5	-69	165.6	0	0	0	110.7	N562 Q563 R570	N562-I566 VanDerWaalsContact O-CG1 3.28Å; N562-I566 WeakPolarHBondContact O-CG1 3.24Å; N562-I566 PolarHBondContact O-N 3.45Å; N562-I566 WeakPolarHBondContact OD1-CD1 3.4Å; Q563-I566 PolarHBondContact O-N 2.96Å; I566-R570 WeakPolarHBondContact O-CB 3.32Å; I566-R570 VanDerWaalsContact O-CG 3.29Å; I566-R570 WeakPolarHBondContact O-CG 3.36Å; I566-R570 PolarHBondContact O-N 2.91Å
567	T	88.9	Confident	87.4	Confident	64 Å²	64	107.4 Å²	107.4	39%	0.393	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-45.8	175.8	44.1	0	0	0	0	112.1	Q563 F564 L565 I569 R570 E571	Q563-T567 PolarHBondContact O-N 3.35Å; Q563-T567 PolarHBondContact O-OG1 3.34Å; Q563-T567 VanDerWaalsContact O-OG1 3.08Å; F564-T567 VanDerWaalsContact C-OG1 3.31Å; F564-T567 VanDerWaalsContact CA-OG1 3.31Å; F564-T567 WeakPolarHBondContact CA-OG1 3.2Å; F564-T567 PolarHBondContact O-N 3.03Å; F564-T567 PolarHBondContact O-OG1 2.96Å; L565-T567 VanDerWaalsContact C-N 3.33Å; L565-T567 PolarHBondContact O-N 2.69Å; T567-I569 PolarHBondContact O-N 3.34Å; T567-R570 PolarHBondContact O-N 3.24Å; T567-E571 PolarHBondContact O-N 3.03Å
568	E	88.4	Confident	87.6	Confident	45 Å²	45	109 Å²	109	21%	0.21	52%	0.516	C	S	.	.	H	α-helix	trans	-63.8	-41.4	178.5	-172.6	82.3	179.7	0	0	111.3	R508 F564 L565 R570 E571 L572	R508-E568 IonicContact CZ-OE1 3.07Å; R508-E568 IonicContact NH1-OE1 3.45Å; R508-E568 PolarHBondContact NH1-OE1 2.82Å; R508-E568 IonicContact NH2-OE1 4Å; F564-E568 PolarHBondContact O-N 2.85Å; L565-E568 PolarHBondContact O-N 3.02Å; E568-R570 VanDerWaalsContact C-N 3.32Å; E568-R570 PolarHBondContact O-N 3.22Å; E568-E571 PolarHBondContact O-N 2.77Å; E568-L572 HydrophobicContact CG-CD1 4.11Å; E568-L572 HydrophobicContact CG-CG 4.47Å; E568-L572 WeakPolarHBondContact O-CB 3.38Å; E568-L572 WeakPolarHBondContact O-CG 3.18Å; E568-L572 PolarHBondContact O-N 2.84Å
569	I	88.3	Confident	87.9	Confident	97 Å²	97	110.6 Å²	110.6	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-61.4	-41.5	175.8	-71.4	167.6	0	0	0	110.7	L565 T567 A573	L565-I569 HydrophobicContact CD2-CD1 4.05Å; L565-I569 HydrophobicContact CG-CD1 3.92Å; L565-I569 HydrophobicContact CG-CG1 4.47Å; L565-I569 WeakPolarHBondContact O-CB 3.15Å; L565-I569 WeakPolarHBondContact O-CG1 3.3Å; L565-I569 PolarHBondContact O-N 3Å; T567-I569 PolarHBondContact O-N 3.34Å; I569-A573 VanDerWaalsContact O-CB 3.23Å; I569-A573 WeakPolarHBondContact O-CB 3.3Å; I569-A573 PolarHBondContact O-N 3.1Å
570	R	86.5	Confident	88.1	Confident	180 Å²	180	106.4 Å²	106.4	68%	0.679	51%	0.509	S	S	*	.	H	α-helix	trans	-64.5	-41.7	176.2	-75.7	174.8	179.7	177.8	1.3	112	I566 T567 E568 S574	I566-R570 WeakPolarHBondContact O-CB 3.32Å; I566-R570 VanDerWaalsContact O-CG 3.29Å; I566-R570 WeakPolarHBondContact O-CG 3.36Å; I566-R570 PolarHBondContact O-N 2.91Å; T567-R570 PolarHBondContact O-N 3.24Å; E568-R570 VanDerWaalsContact C-N 3.32Å; E568-R570 PolarHBondContact O-N 3.22Å; R570-S574 WeakPolarHBondContact O-CB 3.08Å; R570-S574 PolarHBondContact O-N 3.28Å
571	E	89.4	Confident	88.3	Confident	121 Å²	121	99.5 Å²	99.5	57%	0.565	49%	0.486	S	S	*	.	H	α-helix	trans	-65.7	-45.9	176.4	-72.2	-175.2	-174	0	0	111.9	T567 E568 A573 S574 I575	T567-E571 PolarHBondContact O-N 3.03Å; E568-E571 PolarHBondContact O-N 2.77Å; E571-A573 VanDerWaalsContact C-N 3.35Å; E571-A573 PolarHBondContact O-N 2.66Å; E571-S574 WeakPolarHBondContact O-CB 3.38Å; E571-S574 PolarHBondContact O-N 3.34Å; E571-I575 WeakPolarHBondContact O-CG1 3.44Å; E571-I575 PolarHBondContact O-N 2.83Å
572	L	89.5	Confident	88.5	Confident	76 Å²	76	98.9 Å²	98.9	40%	0.398	49%	0.485	S	S	.	.	H	α-helix	trans	-63.6	-39.2	176.5	-71.5	174	0	0	0	112.2	E568 S574 I575 K576	E568-L572 HydrophobicContact CG-CD1 4.11Å; E568-L572 HydrophobicContact CG-CG 4.47Å; E568-L572 WeakPolarHBondContact O-CB 3.38Å; E568-L572 WeakPolarHBondContact O-CG 3.18Å; E568-L572 PolarHBondContact O-N 2.84Å; L572-S574 VanDerWaalsContact C-N 3.33Å; L572-I575 PolarHBondContact O-N 2.88Å; L572-K576 WeakPolarHBondContact O-CB 3.16Å; L572-K576 PolarHBondContact O-N 3.46Å
573	A	87.3	Confident	88.6	Confident	58 Å²	58	97.7 Å²	97.7	48%	0.479	48%	0.484	S	S	.	.	H	α-helix	trans	-63.4	-40.3	173.8	0	0	0	0	0	111.6	I569 E571 K576 Y577	I569-A573 VanDerWaalsContact O-CB 3.23Å; I569-A573 WeakPolarHBondContact O-CB 3.3Å; I569-A573 PolarHBondContact O-N 3.1Å; E571-A573 VanDerWaalsContact C-N 3.35Å; E571-A573 PolarHBondContact O-N 2.66Å; A573-K576 PolarHBondContact O-N 3.23Å; A573-Y577 WeakPolarHBondContact O-CB 3.46Å; A573-Y577 PolarHBondContact O-N 3.49Å
574	S	90.1	Very high	88.7	Confident	72 Å²	72	98.2 Å²	98.2	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-62.6	-46.8	174.4	-177.3	0	0	0	0	111.9	R570 E571 L572 K576 Y577 M578	R570-S574 WeakPolarHBondContact O-CB 3.08Å; R570-S574 PolarHBondContact O-N 3.28Å; E571-S574 WeakPolarHBondContact O-CB 3.38Å; E571-S574 PolarHBondContact O-N 3.34Å; L572-S574 VanDerWaalsContact C-N 3.33Å; S574-K576 PolarHBondContact O-N 3.05Å; S574-Y577 PolarHBondContact O-N 3.14Å; S574-M578 VanDerWaalsContact O-CG 3.3Å; S574-M578 WeakPolarHBondContact O-CG 3.41Å; S574-M578 PolarHBondContact O-N 3.28Å
575	I	89.4	Confident	88.7	Confident	89 Å²	89	97.8 Å²	97.8	46%	0.456	49%	0.487	S	S	.	.	H	α-helix	trans	-62.5	-44.4	177.3	-68.3	168.6	0	0	0	111	E571 L572 Y577 M578 F579	E571-I575 WeakPolarHBondContact O-CG1 3.44Å; E571-I575 PolarHBondContact O-N 2.83Å; L572-I575 PolarHBondContact O-N 2.88Å; I575-Y577 VanDerWaalsContact C-N 3.35Å; I575-Y577 PolarHBondContact O-N 3.23Å; I575-M578 WeakPolarHBondContact O-CB 3.39Å; I575-M578 PolarHBondContact O-N 3.08Å; I575-F579 HydrophobicContact CG2-CD2 3.65Å; I575-F579 HydrophobicContact CG2-CE2 3.45Å; I575-F579 VanDerWaalsContact CG2-CE2 3.45Å; I575-F579 VanDerWaalsContact O-CD2 3.25Å; I575-F579 WeakPolarHBondContact O-CD2 3.24Å; I575-F579 PolarHBondContact O-N 2.89Å
576	K	88.2	Confident	88.8	Confident	151 Å²	151	97.6 Å²	97.6	66%	0.657	49%	0.485	S	S	*	.	H	α-helix	trans	-59.7	-45.6	176.3	-175.7	177.9	179.3	179.7	0	111.3	L572 A573 S574 M578 F579 T580	L572-K576 WeakPolarHBondContact O-CB 3.16Å; L572-K576 PolarHBondContact O-N 3.46Å; A573-K576 PolarHBondContact O-N 3.23Å; S574-K576 PolarHBondContact O-N 3.05Å; K576-M578 VanDerWaalsContact C-N 3.34Å; K576-M578 PolarHBondContact O-N 3.22Å; K576-F579 PolarHBondContact O-N 3.38Å; K576-T580 WeakPolarHBondContact O-CG2 2.89Å; K576-T580 PolarHBondContact O-N 3.15Å; K576-T580 PolarHBondContact O-OG1 3.45Å
577	Y	89	Confident	88.9	Confident	156 Å²	156	97.3 Å²	97.3	61%	0.612	49%	0.489	S	S	*	.	H	α-helix	trans	-58.5	-45.4	175.7	179.7	-96.8	0	0	0	111.5	A573 S574 I575 F579 T580 D581	A573-Y577 WeakPolarHBondContact O-CB 3.46Å; A573-Y577 PolarHBondContact O-N 3.49Å; S574-Y577 PolarHBondContact O-N 3.14Å; I575-Y577 VanDerWaalsContact C-N 3.35Å; I575-Y577 PolarHBondContact O-N 3.23Å; Y577-F579 PolarHBondContact O-N 3.18Å; Y577-T580 WeakPolarHBondContact CA-OG1 3.37Å; Y577-T580 PolarHBondContact O-N 3.41Å; Y577-T580 PolarHBondContact O-OG1 3.49Å; Y577-D581 WeakPolarHBondContact O-CB 3.17Å; Y577-D581 PolarHBondContact O-N 3.06Å
578	M	89.5	Confident	88.8	Confident	115 Å²	115	101.3 Å²	101.3	57%	0.567	50%	0.501	S	S	*	.	H	α-helix	trans	-59.2	-43.4	176.6	-71.6	-71.7	-68.6	0	0	112.7	S574 I575 K576 D581 H582	S574-M578 VanDerWaalsContact O-CG 3.3Å; S574-M578 WeakPolarHBondContact O-CG 3.41Å; S574-M578 PolarHBondContact O-N 3.28Å; I575-M578 WeakPolarHBondContact O-CB 3.39Å; I575-M578 PolarHBondContact O-N 3.08Å; K576-M578 VanDerWaalsContact C-N 3.34Å; K576-M578 PolarHBondContact O-N 3.22Å; M578-D581 PolarHBondContact O-N 3.41Å; M578-H582 WeakPolarHBondContact O-CB 3.48Å; M578-H582 PolarHBondContact O-N 3.23Å
579	F	88.7	Confident	88.9	Confident	147 Å²	147	105.5 Å²	105.5	65%	0.645	52%	0.515	S	S	*	.	H	α-helix	trans	-66	-41.1	175.9	-81.2	-67	0	0	0	112.5	I575 K576 Y577 H582 S583	I575-F579 HydrophobicContact CG2-CD2 3.65Å; I575-F579 HydrophobicContact CG2-CE2 3.45Å; I575-F579 VanDerWaalsContact CG2-CE2 3.45Å; I575-F579 VanDerWaalsContact O-CD2 3.25Å; I575-F579 WeakPolarHBondContact O-CD2 3.24Å; I575-F579 PolarHBondContact O-N 2.89Å; K576-F579 PolarHBondContact O-N 3.38Å; Y577-F579 PolarHBondContact O-N 3.18Å; F579-H582 PolarHBondContact O-N 2.57Å; F579-S583 VanDerWaalsContact O-CB 3.31Å; F579-S583 WeakPolarHBondContact O-CB 3.29Å; F579-S583 PolarHBondContact O-N 2.88Å
580	T	88.7	Confident	88.9	Confident	63 Å²	63	104.7 Å²	104.7	39%	0.387	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-40.3	176.3	52.4	0	0	0	0	112.1	K576 Y577 S583 N584	K576-T580 WeakPolarHBondContact O-CG2 2.89Å; K576-T580 PolarHBondContact O-N 3.15Å; K576-T580 PolarHBondContact O-OG1 3.45Å; Y577-T580 WeakPolarHBondContact CA-OG1 3.37Å; Y577-T580 PolarHBondContact O-N 3.41Å; Y577-T580 PolarHBondContact O-OG1 3.49Å; T580-S583 PolarHBondContact O-N 3.07Å; T580-N584 WeakPolarHBondContact O-CB 3.44Å; T580-N584 PolarHBondContact O-N 3.38Å; T580-N584 PolarHBondContact O-ND2 3.23Å
581	D	89.1	Confident	88.7	Confident	46 Å²	46	102.1 Å²	102.1	25%	0.246	51%	0.507	C	S	.	.	H	α-helix	trans	-64.8	-43.5	175.3	179.8	53.7	0	0	0	111.2	Y577 M578 N584 K585	Y577-D581 WeakPolarHBondContact O-CB 3.17Å; Y577-D581 PolarHBondContact O-N 3.06Å; M578-D581 PolarHBondContact O-N 3.41Å; D581-N584 PolarHBondContact O-N 3.24Å; D581-K585 WeakPolarHBondContact O-CB 3.45Å; D581-K585 VanDerWaalsContact O-CG 3.3Å; D581-K585 WeakPolarHBondContact O-CG 3.29Å; D581-K585 PolarHBondContact O-N 3.25Å; D581-K585 WeakPolarHBondContact OD1-CE 3.38Å; D581-K585 IonicContact OD1-NZ 2.71Å; D581-K585 WeakPolarHBondContact OD2-CE 3.43Å; D581-K585 IonicContact OD2-NZ 3.61Å; D581-K585 PolarHBondContact OD2-NZ 3.48Å
582	H	90.5	Very high	88.4	Confident	126 Å²	126	104 Å²	104	58%	0.583	51%	0.509	S	S	*	.	H	α-helix	trans	-63	-43.8	174.7	-172.3	-84.3	0	0	0	112.2	M578 F579 N584 K585 M586	M578-H582 WeakPolarHBondContact O-CB 3.48Å; M578-H582 PolarHBondContact O-N 3.23Å; F579-H582 PolarHBondContact O-N 2.57Å; H582-N584 PolarHBondContact O-N 2.98Å; H582-K585 PolarHBondContact O-N 3.07Å; H582-M586 VanDerWaalsContact O-CB 3.31Å; H582-M586 WeakPolarHBondContact O-CB 3.35Å; H582-M586 PolarHBondContact O-N 2.71Å
583	S	87.6	Confident	88.2	Confident	68 Å²	68	104 Å²	104	48%	0.476	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-41.5	176.5	-175.7	0	0	0	0	112.1	F579 T580 M586 S587	F579-S583 VanDerWaalsContact O-CB 3.31Å; F579-S583 WeakPolarHBondContact O-CB 3.29Å; F579-S583 PolarHBondContact O-N 2.88Å; T580-S583 PolarHBondContact O-N 3.07Å; S583-M586 PolarHBondContact O-N 2.98Å; S583-S587 WeakPolarHBondContact O-CB 3.45Å; S583-S587 PolarHBondContact O-N 3.17Å; S583-S587 PolarHBondContact O-OG 2.91Å
584	N	89.1	Confident	88.1	Confident	96 Å²	96	105.6 Å²	105.6	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-65.8	-44.2	175.1	-73.8	-23.9	0	0	0	112.1	T580 D581 H582 S587 K588	T580-N584 WeakPolarHBondContact O-CB 3.44Å; T580-N584 PolarHBondContact O-N 3.38Å; T580-N584 PolarHBondContact O-ND2 3.23Å; D581-N584 PolarHBondContact O-N 3.24Å; H582-N584 PolarHBondContact O-N 2.98Å; N584-S587 PolarHBondContact O-N 3.05Å; N584-K588 WeakPolarHBondContact O-CB 3.44Å; N584-K588 WeakPolarHBondContact O-CG 3.42Å; N584-K588 PolarHBondContact O-N 3.01Å
585	K	89.8	Confident	87.7	Confident	122 Å²	122	105.6 Å²	105.6	53%	0.53	50%	0.502	S	S	.	.	H	α-helix	trans	-61.3	-44.3	175	-76.8	170.8	176.8	167.4	0	111.5	D581 H582 K588 Y589	D581-K585 WeakPolarHBondContact O-CB 3.45Å; D581-K585 VanDerWaalsContact O-CG 3.3Å; D581-K585 WeakPolarHBondContact O-CG 3.29Å; D581-K585 PolarHBondContact O-N 3.25Å; D581-K585 WeakPolarHBondContact OD1-CE 3.38Å; D581-K585 IonicContact OD1-NZ 2.71Å; D581-K585 WeakPolarHBondContact OD2-CE 3.43Å; D581-K585 IonicContact OD2-NZ 3.61Å; D581-K585 PolarHBondContact OD2-NZ 3.48Å; H582-K585 PolarHBondContact O-N 3.07Å; K585-K588 PolarHBondContact O-N 3.35Å; K585-Y589 WeakPolarHBondContact O-CB 3.07Å; K585-Y589 PolarHBondContact O-N 3.32Å
586	M	89.4	Confident	87.5	Confident	96 Å²	96	105 Å²	105	47%	0.473	50%	0.498	S	S	.	.	H	α-helix	trans	-64	-43.7	177	-171.4	63	169.9	0	0	111.7	H582 S583 K588 Y589 I590	H582-M586 VanDerWaalsContact O-CB 3.31Å; H582-M586 WeakPolarHBondContact O-CB 3.35Å; H582-M586 PolarHBondContact O-N 2.71Å; S583-M586 PolarHBondContact O-N 2.98Å; M586-K588 PolarHBondContact O-N 2.68Å; M586-Y589 WeakPolarHBondContact O-CB 3.07Å; M586-Y589 PolarHBondContact O-N 3.33Å; M586-Y589 VanDerWaalsContact O-N 3.16Å; M586-Y589 HydrophobicContact SD-CD1 4.44Å; M586-I590 HydrophobicContact CE-CD1 4.37Å; M586-I590 HydrophobicContact CG-CD1 4.13Å; M586-I590 WeakPolarHBondContact O-CG1 3.44Å; M586-I590 PolarHBondContact O-N 3.4Å
587	S	89.5	Confident	87.4	Confident	56 Å²	56	99.2 Å²	99.2	39%	0.392	48%	0.48	S	S	.	.	H	α-helix	trans	-62.4	-43.1	177.1	-59.9	0	0	0	0	111.9	S583 N584 Y589 I590 Q591	S583-S587 WeakPolarHBondContact O-CB 3.45Å; S583-S587 PolarHBondContact O-N 3.17Å; S583-S587 PolarHBondContact O-OG 2.91Å; N584-S587 PolarHBondContact O-N 3.05Å; S587-Y589 VanDerWaalsContact C-N 3.32Å; S587-Y589 PolarHBondContact O-N 3.48Å; S587-I590 PolarHBondContact O-N 3.39Å; S587-Q591 WeakPolarHBondContact O-CB 3.21Å; S587-Q591 WeakPolarHBondContact O-CG 3.47Å; S587-Q591 PolarHBondContact O-N 3.48Å
588	K	86.8	Confident	87.2	Confident	148 Å²	148	93 Å²	93	64%	0.643	46%	0.456	S	S	*	.	H	α-helix	trans	-62.1	-39.1	173	-73.1	176.9	-179.1	-178.8	0	112.1	N584 K585 M586 R592	N584-K588 WeakPolarHBondContact O-CB 3.44Å; N584-K588 WeakPolarHBondContact O-CG 3.42Å; N584-K588 PolarHBondContact O-N 3.01Å; K585-K588 PolarHBondContact O-N 3.35Å; M586-K588 PolarHBondContact O-N 2.68Å; K588-R592 WeakPolarHBondContact O-CB 3.34Å; K588-R592 PolarHBondContact O-N 2.74Å
589	Y	89.5	Confident	87	Confident	132 Å²	132	92.5 Å²	92.5	52%	0.518	45%	0.451	S	S	.	.	H	α-helix	trans	-66	-45	176.7	-177.7	-109.7	0	0	0	112.1	K585 M586 S587 Q591 R592 L593	K585-Y589 WeakPolarHBondContact O-CB 3.07Å; K585-Y589 PolarHBondContact O-N 3.32Å; M586-Y589 WeakPolarHBondContact O-CB 3.07Å; M586-Y589 PolarHBondContact O-N 3.33Å; M586-Y589 VanDerWaalsContact O-N 3.16Å; M586-Y589 HydrophobicContact SD-CD1 4.44Å; S587-Y589 VanDerWaalsContact C-N 3.32Å; S587-Y589 PolarHBondContact O-N 3.48Å; Y589-Q591 PolarHBondContact O-N 3.26Å; Y589-R592 WeakPolarHBondContact O-CB 3.37Å; Y589-R592 PolarHBondContact O-N 3.49Å; Y589-L593 HydrophobicContact CD1-CD1 3.9Å; Y589-L593 HydrophobicContact CD1-CG 4.46Å; Y589-L593 HydrophobicContact CE1-CD1 3.36Å; Y589-L593 HydrophobicContact CE1-CG 4.07Å; Y589-L593 HydrophobicContact CE2-CD1 4.47Å; Y589-L593 HydrophobicContact CE2-CG 4.34Å; Y589-L593 PolarHBondContact O-N 3.09Å
590	I	88.4	Confident	87	Confident	80 Å²	80	93.8 Å²	93.8	41%	0.41	45%	0.452	S	S	.	.	H	α-helix	trans	-61.8	-43.9	175.5	-68.4	167.8	0	0	0	110.9	M586 S587 R592 L593 N594	M586-I590 HydrophobicContact CE-CD1 4.37Å; M586-I590 HydrophobicContact CG-CD1 4.13Å; M586-I590 WeakPolarHBondContact O-CG1 3.44Å; M586-I590 PolarHBondContact O-N 3.4Å; S587-I590 PolarHBondContact O-N 3.39Å; I590-R592 VanDerWaalsContact C-N 3.33Å; I590-R592 PolarHBondContact O-N 2.95Å; I590-L593 PolarHBondContact O-N 2.92Å; I590-N594 WeakPolarHBondContact O-CB 3.06Å; I590-N594 PolarHBondContact O-N 3.32Å; I590-N594 PolarHBondContact O-ND2 3.47Å
591	Q	82.8	Confident	87	Confident	127 Å²	127	94.6 Å²	94.6	59%	0.593	45%	0.448	S	S	*	.	H	α-helix	trans	-59.1	-44.7	174.9	-76.7	177.9	-10.9	0	0	111.6	S587 Y589 N594 M595	S587-Q591 WeakPolarHBondContact O-CB 3.21Å; S587-Q591 WeakPolarHBondContact O-CG 3.47Å; S587-Q591 PolarHBondContact O-N 3.48Å; Y589-Q591 PolarHBondContact O-N 3.26Å; Q591-N594 PolarHBondContact O-N 3.37Å; Q591-M595 WeakPolarHBondContact O-CG 3.49Å; Q591-M595 PolarHBondContact O-N 2.92Å
592	R	83.4	Confident	86.9	Confident	160 Å²	160	94.4 Å²	94.4	60%	0.604	44%	0.444	S	S	*	.	H	α-helix	trans	-60.9	-45.5	175.9	-176.2	178	178.2	156.2	3.5	112.2	K588 Y589 I590 N594 M595 E596	K588-R592 WeakPolarHBondContact O-CB 3.34Å; K588-R592 PolarHBondContact O-N 2.74Å; Y589-R592 WeakPolarHBondContact O-CB 3.37Å; Y589-R592 PolarHBondContact O-N 3.49Å; I590-R592 VanDerWaalsContact C-N 3.33Å; I590-R592 PolarHBondContact O-N 2.95Å; R592-N594 VanDerWaalsContact C-N 3.35Å; R592-N594 PolarHBondContact O-N 2.86Å; R592-M595 WeakPolarHBondContact O-CB 3.4Å; R592-M595 PolarHBondContact O-N 2.98Å; R592-E596 IonicContact NE-OE1 3.67Å; R592-E596 PolarHBondContact NE-OE1 3.49Å; R592-E596 WeakPolarHBondContact O-CG 3.33Å; R592-E596 PolarHBondContact O-N 2.94Å
593	L	86.1	Confident	86.6	Confident	76 Å²	76	91.5 Å²	91.5	40%	0.398	43%	0.43	S	S	.	.	H	α-helix	trans	-62.8	-40.2	176.8	-74.3	178.5	0	0	0	112.3	Y589 I590 E596 G597	Y589-L593 HydrophobicContact CD1-CD1 3.9Å; Y589-L593 HydrophobicContact CD1-CG 4.46Å; Y589-L593 HydrophobicContact CE1-CD1 3.36Å; Y589-L593 HydrophobicContact CE1-CG 4.07Å; Y589-L593 HydrophobicContact CE2-CD1 4.47Å; Y589-L593 HydrophobicContact CE2-CG 4.34Å; Y589-L593 PolarHBondContact O-N 3.09Å; I590-L593 PolarHBondContact O-N 2.92Å; L593-E596 PolarHBondContact O-N 3.21Å; L593-G597 PolarHBondContact O-N 3.18Å
594	N	84	Confident	86.5	Confident	92 Å²	92	92.8 Å²	92.8	49%	0.492	43%	0.426	S	S	.	.	H	α-helix	trans	-63.3	-42.4	175.4	-77.9	-26.6	0	0	0	111.7	I590 Q591 R592 G597 F598	I590-N594 WeakPolarHBondContact O-CB 3.06Å; I590-N594 PolarHBondContact O-N 3.32Å; I590-N594 PolarHBondContact O-ND2 3.47Å; Q591-N594 PolarHBondContact O-N 3.37Å; R592-N594 VanDerWaalsContact C-N 3.35Å; R592-N594 PolarHBondContact O-N 2.86Å; N594-G597 PolarHBondContact O-N 3.22Å; N594-F598 HydrophobicContact CB-CE2 4.49Å; N594-F598 WeakPolarHBondContact O-CD2 3.47Å; N594-F598 PolarHBondContact O-N 2.78Å
595	M	82	Confident	86.4	Confident	71 Å²	71	88.3 Å²	88.3	35%	0.35	40%	0.401	S	S	.	.	H	α-helix	trans	-61.7	-45.6	174.4	-72	-174.9	68.3	0	0	112.1	Q591 R592 G597 F598 K599 L695 S696	Q591-M595 WeakPolarHBondContact O-CG 3.49Å; Q591-M595 PolarHBondContact O-N 2.92Å; R592-M595 WeakPolarHBondContact O-CB 3.4Å; R592-M595 PolarHBondContact O-N 2.98Å; M595-G597 VanDerWaalsContact C-N 3.27Å; M595-G597 PolarHBondContact O-N 3.11Å; M595-F598 PolarHBondContact O-N 3.39Å; M595-K599 WeakPolarHBondContact O-CB 3.14Å; M595-K599 PolarHBondContact O-N 2.63Å; M595-L695 WeakPolarHBondContact O-CD2 3.33Å; M595-S696 WeakPolarHBondContact CE-OG 3.37Å; M595-S696 PolarHBondContact SD-OG 2.93Å
596	E	84.9	Confident	86	Confident	78 Å²	78	85 Å²	85	36%	0.364	39%	0.387	S	S	.	.	H	α-helix	trans	-61	-39.4	174.7	-73.8	177.9	-168.2	0	0	110.8	R592 L593 K599 W600	R592-E596 IonicContact NE-OE1 3.67Å; R592-E596 PolarHBondContact NE-OE1 3.49Å; R592-E596 WeakPolarHBondContact O-CG 3.33Å; R592-E596 PolarHBondContact O-N 2.94Å; L593-E596 PolarHBondContact O-N 3.21Å; E596-K599 WeakPolarHBondContact O-CB 3.37Å; E596-K599 PolarHBondContact O-N 3.25Å; E596-W600 PolarHBondContact O-N 3.14Å
597	G	86.4	Confident	85.5	Confident	28 Å²	28	85.3 Å²	85.3	29%	0.289	39%	0.39	S	S	.	.	H	α-helix	trans	-59.6	-47.2	173.7	0	0	0	0	0	113.5	L593 N594 M595 K599 W600 R601	L593-G597 PolarHBondContact O-N 3.18Å; N594-G597 PolarHBondContact O-N 3.22Å; M595-G597 VanDerWaalsContact C-N 3.27Å; M595-G597 PolarHBondContact O-N 3.11Å; G597-K599 VanDerWaalsContact C-N 3.34Å; G597-W600 PolarHBondContact O-N 2.68Å; G597-R601 VanDerWaalsContact O-CG 3.29Å; G597-R601 WeakPolarHBondContact O-CG 3.36Å; G597-R601 PolarHBondContact O-N 2.8Å
598	F	85.9	Confident	84.9	Confident	25 Å²	25	83.1 Å²	83.1	11%	0.11	37%	0.374	C	S	.	.	H	α-helix	trans	-63.6	-39.9	174.8	-70.3	-57.3	0	0	0	112.3	N594 M595 R601 R602 Y691 Q694 L695	N594-F598 HydrophobicContact CB-CE2 4.49Å; N594-F598 WeakPolarHBondContact O-CD2 3.47Å; N594-F598 PolarHBondContact O-N 2.78Å; M595-F598 PolarHBondContact O-N 3.39Å; F598-R601 PolarHBondContact O-N 3.27Å; F598-R602 WeakPolarHBondContact O-CB 3.39Å; F598-R602 PolarHBondContact O-N 2.59Å; F598-Y691 AromaticContact CD1-CD1 3.82Å; F598-Y691 HydrophobicContact CD1-CD1 3.82Å; F598-Y691 HydrophobicContact CD1-CE1 4.24Å; F598-Y691 HydrophobicContact CE1-CD1 4.46Å; F598-Q694 HydrophobicContact CD1-CB 4.22Å; F598-Q694 HydrophobicContact CD2-CB 4.29Å; F598-Q694 HydrophobicContact CE1-CB 4.48Å; F598-Q694 HydrophobicContact CG-CB 4.15Å; F598-L695 HydrophobicContact CB-CD2 3.99Å; F598-L695 HydrophobicContact CB-CG 4.41Å
599	K	85.1	Confident	84.4	Confident	106 Å²	106	77.1 Å²	77.1	46%	0.461	35%	0.348	S	S	.	.	H	α-helix	trans	-58.8	-49.9	175.9	-178.7	-179.1	176.7	176.6	0	110.7	M595 E596 G597 R601 R602 E603 L695	M595-K599 WeakPolarHBondContact O-CB 3.14Å; M595-K599 PolarHBondContact O-N 2.63Å; E596-K599 WeakPolarHBondContact O-CB 3.37Å; E596-K599 PolarHBondContact O-N 3.25Å; G597-K599 VanDerWaalsContact C-N 3.34Å; K599-R601 PolarHBondContact O-N 3.37Å; K599-R602 WeakPolarHBondContact O-CB 3.21Å; K599-R602 PolarHBondContact O-N 2.59Å; K599-E603 WeakPolarHBondContact O-CG 3.4Å; K599-E603 PolarHBondContact O-N 3.19Å; K599-L695 HydrophobicContact CB-CD2 4.07Å
600	W	87.9	Confident	83.3	Confident	174 Å²	174	72.5 Å²	72.5	66%	0.659	34%	0.338	S	S	*	.	H	α-helix	trans	-66.7	-35.4	179.3	-71.6	118.6	0	0	0	113	E596 G597 E603 Y604	E596-W600 PolarHBondContact O-N 3.14Å; G597-W600 PolarHBondContact O-N 2.68Å; W600-E603 PolarHBondContact O-N 3.08Å; W600-Y604 WeakPolarHBondContact O-CB 3.44Å; W600-Y604 PolarHBondContact O-N 3.48Å
601	R	88.3	Confident	82.2	Confident	80 Å²	80	72.8 Å²	72.8	30%	0.302	35%	0.346	S	S	.	.	H	α-helix	trans	-63.9	-42.9	172.9	-72.8	169.9	-179.8	-169.8	-11	112	G597 F598 K599 Y604 V605 E643 Y691	G597-R601 VanDerWaalsContact O-CG 3.29Å; G597-R601 WeakPolarHBondContact O-CG 3.36Å; G597-R601 PolarHBondContact O-N 2.8Å; F598-R601 PolarHBondContact O-N 3.27Å; K599-R601 PolarHBondContact O-N 3.37Å; R601-Y604 PolarHBondContact O-N 2.64Å; R601-V605 WeakPolarHBondContact O-CG2 3.35Å; R601-V605 PolarHBondContact O-N 3.17Å; R601-E643 IonicContact CZ-OE1 3.4Å; R601-E643 VanDerWaalsContact CZ-OE1 3.26Å; R601-E643 IonicContact CZ-OE2 2.92Å; R601-E643 IonicContact NH1-OE1 3.75Å; R601-E643 PolarHBondContact NH1-OE1 3.33Å; R601-E643 IonicContact NH2-OE1 2.65Å; R601-E643 PolarHBondContact NH2-OE1 2.71Å; R601-E643 IonicContact NH2-OE2 2.76Å; R601-Y691 HydrophobicContact CB-CD1 4.35Å; R601-Y691 HydrophobicContact CB-CD2 4.08Å; R601-Y691 HydrophobicContact CB-CE1 4.22Å; R601-Y691 HydrophobicContact CB-CE2 3.93Å; R601-Y691 HydrophobicContact CB-CG 4.29Å
602	R	86.6	Confident	81.2	Confident	41 Å²	41	68.8 Å²	68.8	16%	0.155	33%	0.328	C	S	.	.	H	α-helix	trans	-57.4	-52.3	173.7	-176.6	-167.1	70.4	-175.7	3.1	111.2	F598 K599 Y604 V605 K606 Y688 T692 L695	F598-R602 WeakPolarHBondContact O-CB 3.39Å; F598-R602 PolarHBondContact O-N 2.59Å; K599-R602 WeakPolarHBondContact O-CB 3.21Å; K599-R602 PolarHBondContact O-N 2.59Å; R602-Y604 VanDerWaalsContact C-N 3.31Å; R602-Y604 PolarHBondContact O-N 3.4Å; R602-V605 PolarHBondContact O-N 2.64Å; R602-K606 PolarHBondContact O-N 3.15Å; R602-Y688 HydrophobicContact CG-CD2 3.51Å; R602-Y688 HydrophobicContact CG-CE2 3.36Å; R602-Y688 HydrophobicContact CG-CG 4.42Å; R602-T692 VanDerWaalsContact CD-OG1 3.28Å; R602-T692 WeakPolarHBondContact CD-OG1 3.33Å; R602-L695 VanDerWaalsContact NH1-CD1 3.3Å
603	E	84.7	Confident	79.6	Confident	66 Å²	66	61.8 Å²	61.8	31%	0.308	31%	0.306	S	S	.	.	H	α-helix	trans	-63.1	-38.3	178.7	-64.7	-46.1	129.4	0	0	112	K599 W600 K606 L607	K599-E603 WeakPolarHBondContact O-CG 3.4Å; K599-E603 PolarHBondContact O-N 3.19Å; W600-E603 PolarHBondContact O-N 3.08Å; E603-K606 PolarHBondContact O-N 3.13Å; E603-L607 WeakPolarHBondContact O-CB 3.48Å; E603-L607 PolarHBondContact O-N 3.49Å
604	Y	86.3	Confident	77.4	Confident	95 Å²	95	60.9 Å²	60.9	37%	0.373	31%	0.31	S	S	.	.	H	α-helix	trans	-65.6	-44.4	177.9	-176.3	-110	0	0	0	112.3	W600 R601 R602 K606 L607 L608 L636	W600-Y604 WeakPolarHBondContact O-CB 3.44Å; W600-Y604 PolarHBondContact O-N 3.48Å; R601-Y604 PolarHBondContact O-N 2.64Å; R602-Y604 VanDerWaalsContact C-N 3.31Å; R602-Y604 PolarHBondContact O-N 3.4Å; Y604-K606 VanDerWaalsContact C-N 3.32Å; Y604-K606 PolarHBondContact O-N 2.72Å; Y604-L607 PolarHBondContact O-N 2.99Å; Y604-L608 HydrophobicContact CD1-CD1 3.92Å; Y604-L608 HydrophobicContact CD1-CG 4.35Å; Y604-L608 HydrophobicContact CE1-CD1 3.44Å; Y604-L608 VanDerWaalsContact CE1-CD1 3.44Å; Y604-L608 HydrophobicContact CE1-CD2 4.46Å; Y604-L608 HydrophobicContact CE1-CG 3.99Å; Y604-L608 HydrophobicContact CE2-CD2 4.47Å; Y604-L608 HydrophobicContact CE2-CG 4.41Å; Y604-L608 WeakPolarHBondContact O-CG 3.31Å; Y604-L608 PolarHBondContact O-N 3.3Å; Y604-L636 HydrophobicContact CE1-CD2 3.61Å; Y604-L636 HydrophobicContact CE1-CG 4.47Å; Y604-L636 WeakPolarHBondContact OH-CD2 3.48Å
605	V	86.4	Confident	75	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.006	32%	0.316	C	S	.	.	H	α-helix	trans	-61.9	-41.2	175.2	170.1	0	0	0	0	111.1	R601 R602 L608 Q609 L640 C684 L687 Y691	R601-V605 WeakPolarHBondContact O-CG2 3.35Å; R601-V605 PolarHBondContact O-N 3.17Å; R602-V605 PolarHBondContact O-N 2.64Å; V605-L608 WeakPolarHBondContact O-CB 3.28Å; V605-L608 PolarHBondContact O-N 2.98Å; V605-Q609 WeakPolarHBondContact O-CB 3.5Å; V605-Q609 PolarHBondContact O-N 3.19Å; V605-L640 HydrophobicContact CG2-CD1 4.2Å; V605-C684 HydrophobicContact CG1-CB 4.04Å; V605-C684 WeakPolarHBondContact CG1-O 3.39Å; V605-L687 HydrophobicContact CG1-CB 3.93Å; V605-L687 HydrophobicContact CG2-CB 4.26Å; V605-L687 HydrophobicContact CG2-CD1 4.43Å; V605-Y691 HydrophobicContact CG2-CD2 4.25Å; V605-Y691 HydrophobicContact CG2-CE2 3.88Å
606	K	81.1	Confident	72.5	Confident	52 Å²	52	64.1 Å²	64.1	23%	0.226	33%	0.328	C	S	.	.	H	α-helix	trans	-63.7	-42.4	176.1	-170	172.4	-172.5	165.3	0	112	R602 E603 Y604 Q609 A610 Y688 D967	R602-K606 PolarHBondContact O-N 3.15Å; E603-K606 PolarHBondContact O-N 3.13Å; Y604-K606 VanDerWaalsContact C-N 3.32Å; Y604-K606 PolarHBondContact O-N 2.72Å; K606-Q609 PolarHBondContact O-N 2.69Å; K606-A610 WeakPolarHBondContact O-CB 3.26Å; K606-A610 PolarHBondContact O-N 3.2Å; K606-Y688 HydrophobicContact CB-CD2 4.05Å; K606-Y688 HydrophobicContact CB-CE2 4.11Å; K606-Y688 HydrophobicContact CD-CD2 4.43Å; K606-Y688 HydrophobicContact CD-CE2 3.76Å; K606-Y688 HydrophobicContact CG-CE2 4.35Å; K606-D967 WeakPolarHBondContact CE-OD2 3.37Å; K606-D967 IonicContact NZ-OD2 3.98Å; K606-D967 PolarHBondContact NZ-OD2 3.47Å
607	L	78.6	Confident	70	Confident	104 Å²	104	64.5 Å²	64.5	55%	0.545	34%	0.336	S	S	.	.	H	α-helix	trans	-61.4	-44.5	174	-177.4	67.6	0	0	0	111.1	E603 Y604 Q609 A610 C611	E603-L607 WeakPolarHBondContact O-CB 3.48Å; E603-L607 PolarHBondContact O-N 3.49Å; Y604-L607 PolarHBondContact O-N 2.99Å; L607-Q609 PolarHBondContact O-N 3.22Å; L607-A610 PolarHBondContact O-N 3.28Å; L607-C611 WeakPolarHBondContact O-CB 3.47Å; L607-C611 PolarHBondContact O-N 3.05Å; L607-C611 PolarHBondContact O-SG 3.27Å
608	L	77	Confident	67.6	Low	9 Å²	9	70.4 Å²	70.4	5%	0.047	36%	0.361	C	S	.	.	H	α-helix	trans	-59.8	-46.3	175.2	-73.2	179.4	0	0	0	111.6	Y604 V605 A610 C611 L612 Y633 L636 I637	Y604-L608 HydrophobicContact CD1-CD1 3.92Å; Y604-L608 HydrophobicContact CD1-CG 4.35Å; Y604-L608 HydrophobicContact CE1-CD1 3.44Å; Y604-L608 VanDerWaalsContact CE1-CD1 3.44Å; Y604-L608 HydrophobicContact CE1-CD2 4.46Å; Y604-L608 HydrophobicContact CE1-CG 3.99Å; Y604-L608 HydrophobicContact CE2-CD2 4.47Å; Y604-L608 HydrophobicContact CE2-CG 4.41Å; Y604-L608 WeakPolarHBondContact O-CG 3.31Å; Y604-L608 PolarHBondContact O-N 3.3Å; V605-L608 WeakPolarHBondContact O-CB 3.28Å; V605-L608 PolarHBondContact O-N 2.98Å; L608-A610 VanDerWaalsContact C-N 3.27Å; L608-A610 PolarHBondContact O-N 3.36Å; L608-C611 PolarHBondContact O-N 3.41Å; L608-L612 WeakPolarHBondContact O-CB 3.41Å; L608-L612 WeakPolarHBondContact O-CD1 3.46Å; L608-L612 WeakPolarHBondContact O-CG 3.45Å; L608-L612 PolarHBondContact O-N 3.49Å; L608-Y633 HydrophobicContact CD2-CD1 3.37Å; L608-Y633 HydrophobicContact CD2-CE1 3.58Å; L608-Y633 HydrophobicContact CD2-CG 4.28Å; L608-L636 HydrophobicContact CD1-CD2 4.46Å; L608-I637 HydrophobicContact CD1-CG1 4.24Å
609	Q	76.3	Confident	65.6	Low	22 Å²	22	73.3 Å²	73.3	10%	0.103	38%	0.382	C	S	.	.	H	α-helix	trans	-59.2	-38.4	176.7	-167.2	-177.2	10	0	0	112	V605 K606 L607 H681 C684 Q685	V605-Q609 WeakPolarHBondContact O-CB 3.5Å; V605-Q609 PolarHBondContact O-N 3.19Å; K606-Q609 PolarHBondContact O-N 2.69Å; L607-Q609 PolarHBondContact O-N 3.22Å; Q609-H681 PolarHBondContact O-CE1 3.14Å; Q609-C684 HydrophobicContact CB-CB 3.92Å; Q609-C684 HydrophobicContact CG-CB 3.96Å; Q609-Q685 VanDerWaalsContact NE2-OE1 3.11Å
610	A	68.1	Low	63.2	Low	36 Å²	36	76.2 Å²	76.2	30%	0.298	40%	0.397	S	S	.	.	H	α-helix	trans	-70.6	-39.6	175.5	0	0	0	0	0	112.5	K606 L607 L608 D965	K606-A610 WeakPolarHBondContact O-CB 3.26Å; K606-A610 PolarHBondContact O-N 3.2Å; L607-A610 PolarHBondContact O-N 3.28Å; L608-A610 VanDerWaalsContact C-N 3.27Å; L608-A610 PolarHBondContact O-N 3.36Å; A610-D965 HydrophobicContact CB-CB 4.23Å
611	C	64.7	Low	60.6	Low	86 Å²	86	75.6 Å²	75.6	58%	0.581	40%	0.401	S	S	*	.	H	α-helix	trans	-76.1	-19.7	179.1	-68.1	0	0	0	0	114	L607 L608 G613	L607-C611 WeakPolarHBondContact O-CB 3.47Å; L607-C611 PolarHBondContact O-N 3.05Å; L607-C611 PolarHBondContact O-SG 3.27Å; L608-C611 PolarHBondContact O-N 3.41Å; C611-G613 PolarHBondContact O-N 2.99Å
612	L	61.5	Low	57.8	Low	42 Å²	42	82.5 Å²	82.5	22%	0.22	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-0.5	176.6	-82.3	158.5	0	0	0	113.5	L608 I637 I680	L608-L612 WeakPolarHBondContact O-CB 3.41Å; L608-L612 WeakPolarHBondContact O-CD1 3.46Å; L608-L612 WeakPolarHBondContact O-CG 3.45Å; L608-L612 PolarHBondContact O-N 3.49Å; L612-I637 HydrophobicContact CD1-CD1 4.13Å; L612-I680 HydrophobicContact CD1-CG2 3.47Å; L612-I680 VanDerWaalsContact CD1-CG2 3.47Å; L612-I680 HydrophobicContact CD2-CG2 4.03Å; L612-I680 HydrophobicContact CG-CG2 4.41Å
613	G	49.9	Very low	55.2	Low	14 Å²	14	85.9 Å²	85.9	14%	0.144	45%	0.448	C	S	.	.	S	Bend	trans	-124	131.4	167.5	0	0	0	0	0	112.8	C611	C611-G613 PolarHBondContact O-N 2.99Å
614	A	38.8	Very low	52.5	Low	57 Å²	57	89.6 Å²	89.6	47%	0.471	47%	0.467	S	S	.	.			trans	82.4	104	165	0	0	0	0	0	118.7	M942	A614-M942 HydrophobicContact CB-CE 4.42Å; A614-M942 HydrophobicContact CB-SD 4.32Å
615	T	33.9	Very low	50.2	Low	102 Å²	102	90.3 Å²	90.3	63%	0.626	47%	0.472	S	S	*	.			trans	-139.5	155.6	148.4	54.3	0	0	0	0	110.7	S626	T615-S626 PolarHBondContact OG1-OG 3.05Å
616	Q	30.3	Very low	47.9	Very low	129 Å²	129	93 Å²	93	60%	0.603	49%	0.491	S	S	*	.			trans	-58.6	162.7	-160.3	-91.8	170.1	-19	0	0	119.3	E945	Q616-E945 VanDerWaalsContact NE2-CD 3.27Å; Q616-E945 PolarHBondContact NE2-OE1 3.49Å; Q616-E945 PolarHBondContact NE2-OE2 2.95Å
617	T	31.8	Very low	45.8	Very low	86 Å²	86	96.3 Å²	96.3	53%	0.528	51%	0.511	S	S	.	.			trans	-76.9	148.2	-173.5	45.1	0	0	0	0	116.9
618	D	36.5	Very low	43.9	Very low	152 Å²	152	101.2 Å²	101.2	81%	0.813	52%	0.524	S	S	*	.				152.2	164.9	118.2	-138.4	26.3	0	0	0	112.3
619	P	44.1	Very low	42.5	Very low	85 Å²	85	102.1 Å²	102.1	55%	0.552	54%	0.535	S	S	*	.	S	Bend	cis	-127.1	1.6	-0.4	23	2.3	0	0	0	119.6
620	H	33.8	Very low	41.5	Very low	168 Å²	168	103.2 Å²	103.2	78%	0.778	54%	0.54	S	S	*	.	S	Bend	trans	-137.6	86.3	-179.3	-69.3	-70.5	0	0	0	113.7
621	H	34.2	Very low	41.1	Very low	160 Å²	160	106.7 Å²	106.7	74%	0.741	55%	0.553	S	S	*	*	S	Bend	trans	57.1	63.2	145.8	-69.4	61.6	0	0	0	117.5
622	R	29.7	Very low	41.2	Very low	225 Å²	225	112 Å²	112	85%	0.849	56%	0.561	S	S	*	*			trans	-169.6	125.4	142.1	-119.2	171.7	176.9	175	-1.5	110	M624	R622-M624 HydrophobicContact CB-CG 4.39Å; R622-M624 PolarHBondContact O-N 2.89Å
623	L	32.6	Very low	41.6	Very low	113 Å²	113	114.6 Å²	114.6	59%	0.592	57%	0.569	S	S	*	*			trans	-59.7	102.8	164.8	-86.4	146	0	0	0	107.5	K954 A958	L623-K954 HydrophobicContact CD1-CB 3.97Å; L623-K954 HydrophobicContact CD1-CD 4.25Å; L623-K954 HydrophobicContact CD1-CG 4.05Å; L623-A958 HydrophobicContact CD2-CB 4.28Å
624	M	26.5	Very low	42.5	Very low	143 Å²	143	116.8 Å²	116.8	70%	0.704	57%	0.574	S	S	*	*			trans	-122.5	134.2	167.3	-71.6	-79.7	89.4	0	0	107.5	R622 S626	R622-M624 HydrophobicContact CB-CG 4.39Å; R622-M624 PolarHBondContact O-N 2.89Å; M624-S626 PolarHBondContact O-N 2.9Å; M624-S626 VanDerWaalsContact O-N 3.15Å
625	F	37.7	Very low	44.3	Very low	110 Å²	110	118.4 Å²	118.4	48%	0.482	58%	0.575	S	S	.	*			trans	-49.8	117.8	168.9	-61.7	-88.9	0	0	0	107.6	D627 T677	F625-D627 PolarHBondContact O-N 3.39Å; F625-T677 HydrophobicContact CE1-CG2 3.78Å; F625-T677 HydrophobicContact CZ-CG2 3.92Å; F625-T677 WeakPolarHBondContact CZ-OG1 3.29Å
626	S	38.3	Very low	46.5	Very low	59 Å²	59	115.9 Å²	115.9	41%	0.413	56%	0.558	S	S	.	*			trans	-69.2	119.4	-179.9	46.9	0	0	0	0	109	T615 M624 Y628	T615-S626 PolarHBondContact OG1-OG 3.05Å; M624-S626 PolarHBondContact O-N 2.9Å; M624-S626 VanDerWaalsContact O-N 3.15Å; S626-Y628 PolarHBondContact O-N 2.96Å
627	D	38.5	Very low	49	Very low	120 Å²	120	109.8 Å²	109.8	64%	0.642	53%	0.529	S	S	*	.			trans	-67.9	26	-175.8	-66.9	-47	0	0	0	114.6	F625 G629 K630	F625-D627 PolarHBondContact O-N 3.39Å; D627-G629 VanDerWaalsContact C-N 3.3Å; D627-G629 PolarHBondContact O-N 3.24Å; D627-K630 PolarHBondContact O-N 3.36Å; D627-K630 WeakPolarHBondContact OD1-CD 3.4Å
628	Y	38.5	Very low	51.4	Low	207 Å²	207	107.1 Å²	107.1	81%	0.812	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	91.9	178.1	-93.9	-76.8	0	0	0	110.4	S626 K630	S626-Y628 PolarHBondContact O-N 2.96Å; Y628-K630 VanDerWaalsContact C-N 3.32Å; Y628-K630 PolarHBondContact O-N 3.42Å
629	G	47.8	Very low	53.8	Low	28 Å²	28	105.8 Å²	105.8	29%	0.289	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	18.7	-178.4	0	0	0	0	0	114	D627 D631 R632 Y633	D627-G629 VanDerWaalsContact C-N 3.3Å; D627-G629 PolarHBondContact O-N 3.24Å; G629-D631 PolarHBondContact O-N 3.5Å; G629-R632 CarbonylContact O-C 3.57Å; G629-R632 WeakPolarHBondContact O-CA 3.16Å; G629-R632 VanDerWaalsContact O-CB 3.31Å; G629-R632 WeakPolarHBondContact O-CB 3.23Å; G629-R632 PolarHBondContact O-N 3.4Å; G629-Y633 WeakPolarHBondContact O-CD2 3.46Å; G629-Y633 PolarHBondContact O-N 3.38Å
630	K	53.6	Low	55.8	Low	46 Å²	46	102.7 Å²	102.7	20%	0.2	48%	0.481	C	S	.	.	H	α-helix	trans	-51.1	-48	176.9	-172.3	-173.7	-175.9	-171.5	0	110.9	D627 Y628 R632 Y633 K634 E676	D627-K630 PolarHBondContact O-N 3.36Å; D627-K630 WeakPolarHBondContact OD1-CD 3.4Å; Y628-K630 VanDerWaalsContact C-N 3.32Å; Y628-K630 PolarHBondContact O-N 3.42Å; K630-R632 VanDerWaalsContact C-N 3.32Å; K630-R632 PolarHBondContact O-N 3.47Å; K630-Y633 PolarHBondContact O-N 2.93Å; K630-K634 WeakPolarHBondContact O-CB 2.74Å; K630-K634 PolarHBondContact O-N 3.44Å; K630-E676 WeakPolarHBondContact CE-OE2 3.28Å; K630-E676 IonicContact NZ-OE2 3.12Å; K630-E676 PolarHBondContact NZ-OE2 2.68Å
631	D	61	Low	58.3	Low	109 Å²	109	94.7 Å²	94.7	58%	0.583	44%	0.444	S	S	*	.	H	α-helix	trans	-63.9	-37.1	174.5	-68	-32.6	0	0	0	112.2	G629 N635	G629-D631 PolarHBondContact O-N 3.5Å; D631-N635 WeakPolarHBondContact O-CB 3.24Å; D631-N635 PolarHBondContact O-N 2.98Å; D631-N635 PolarHBondContact O-ND2 3.24Å; D631-N635 VanDerWaalsContact O-ND2 3.14Å; D631-N635 PolarHBondContact O-OD1 3.14Å
632	R	66.6	Low	60.8	Low	198 Å²	198	90.8 Å²	90.8	75%	0.747	43%	0.429	S	S	*	.	H	α-helix	trans	-65.1	-48.2	177.6	-170.6	-178.3	180	-175.9	-0.2	111.8	G629 K630 L636	G629-R632 CarbonylContact O-C 3.57Å; G629-R632 WeakPolarHBondContact O-CA 3.16Å; G629-R632 VanDerWaalsContact O-CB 3.31Å; G629-R632 WeakPolarHBondContact O-CB 3.23Å; G629-R632 PolarHBondContact O-N 3.4Å; K630-R632 VanDerWaalsContact C-N 3.32Å; K630-R632 PolarHBondContact O-N 3.47Å; R632-L636 VanDerWaalsContact O-CB 3.28Å; R632-L636 WeakPolarHBondContact O-CB 3.17Å; R632-L636 PolarHBondContact O-N 2.88Å
633	Y	69.2	Low	63.4	Low	96 Å²	96	82.8 Å²	82.8	38%	0.376	40%	0.401	S	S	.	.	H	α-helix	trans	-70.6	-38.8	178.3	-64.6	-60	0	0	0	111.4	L608 G629 K630 L636 I637	L608-Y633 HydrophobicContact CD2-CD1 3.37Å; L608-Y633 HydrophobicContact CD2-CE1 3.58Å; L608-Y633 HydrophobicContact CD2-CG 4.28Å; G629-Y633 WeakPolarHBondContact O-CD2 3.46Å; G629-Y633 PolarHBondContact O-N 3.38Å; K630-Y633 PolarHBondContact O-N 2.93Å; Y633-L636 PolarHBondContact O-N 3.31Å; Y633-I637 WeakPolarHBondContact O-CB 3.36Å; Y633-I637 WeakPolarHBondContact O-CD1 3.42Å; Y633-I637 WeakPolarHBondContact O-CG1 3.24Å; Y633-I637 PolarHBondContact O-N 3.32Å
634	K	70	Confident	66	Low	59 Å²	59	77.5 Å²	77.5	26%	0.257	37%	0.374	S	S	.	.	H	α-helix	trans	-61.4	-46.8	173.6	-179.4	-176.4	175.6	-178.3	0	111.5	K630 L636 I637 S638 M654 E676	K630-K634 WeakPolarHBondContact O-CB 2.74Å; K630-K634 PolarHBondContact O-N 3.44Å; K634-L636 VanDerWaalsContact C-N 3.33Å; K634-I637 PolarHBondContact O-N 3.15Å; K634-S638 WeakPolarHBondContact O-CB 3.39Å; K634-S638 PolarHBondContact O-N 3.24Å; K634-M654 HydrophobicContact CG-CE 4.07Å; K634-E676 WeakPolarHBondContact CD-OE1 3.44Å; K634-E676 VanDerWaalsContact CE-OE1 3.3Å; K634-E676 WeakPolarHBondContact CE-OE1 3.13Å; K634-E676 IonicContact NZ-OE1 2.85Å; K634-E676 PolarHBondContact NZ-OE1 3.27Å
635	N	76.2	Confident	68.8	Low	92 Å²	92	74.6 Å²	74.6	49%	0.492	36%	0.355	S	S	.	.	H	α-helix	trans	-62.9	-43.1	176.4	-68.9	-15.1	0	0	0	110.5	D631 S638 E639	D631-N635 WeakPolarHBondContact O-CB 3.24Å; D631-N635 PolarHBondContact O-N 2.98Å; D631-N635 PolarHBondContact O-ND2 3.24Å; D631-N635 VanDerWaalsContact O-ND2 3.14Å; D631-N635 PolarHBondContact O-OD1 3.14Å; N635-S638 WeakPolarHBondContact O-CB 3.16Å; N635-S638 PolarHBondContact O-N 3.05Å; N635-E639 WeakPolarHBondContact O-CG 3.3Å; N635-E639 PolarHBondContact O-N 3.35Å
636	L	80.8	Confident	71.1	Confident	49 Å²	49	78.7 Å²	78.7	26%	0.257	37%	0.367	S	S	.	.	H	α-helix	trans	-63.3	-43.3	176.9	-173.3	63.4	0	0	0	112.5	Y604 L608 R632 Y633 K634 S638 E639 L640	Y604-L636 HydrophobicContact CE1-CD2 3.61Å; Y604-L636 HydrophobicContact CE1-CG 4.47Å; Y604-L636 WeakPolarHBondContact OH-CD2 3.48Å; L608-L636 HydrophobicContact CD1-CD2 4.46Å; R632-L636 VanDerWaalsContact O-CB 3.28Å; R632-L636 WeakPolarHBondContact O-CB 3.17Å; R632-L636 PolarHBondContact O-N 2.88Å; Y633-L636 PolarHBondContact O-N 3.31Å; K634-L636 VanDerWaalsContact C-N 3.33Å; L636-S638 VanDerWaalsContact C-N 3.32Å; L636-E639 PolarHBondContact O-N 3.34Å; L636-L640 HydrophobicContact CG-CD1 4.43Å; L636-L640 WeakPolarHBondContact O-CB 3.38Å; L636-L640 VanDerWaalsContact O-CG 3.29Å; L636-L640 WeakPolarHBondContact O-CG 3.49Å; L636-L640 PolarHBondContact O-N 3.31Å
637	I	81.9	Confident	73.3	Confident	1 Å²	1	81.8 Å²	81.8	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-63.7	-41.5	174.7	-70.4	162.8	0	0	0	109.8	L608 L612 Y633 K634 L640 L641 I680 C684 L687	L608-I637 HydrophobicContact CD1-CG1 4.24Å; L612-I637 HydrophobicContact CD1-CD1 4.13Å; Y633-I637 WeakPolarHBondContact O-CB 3.36Å; Y633-I637 WeakPolarHBondContact O-CD1 3.42Å; Y633-I637 WeakPolarHBondContact O-CG1 3.24Å; Y633-I637 PolarHBondContact O-N 3.32Å; K634-I637 PolarHBondContact O-N 3.15Å; I637-L640 PolarHBondContact O-N 2.82Å; I637-L641 WeakPolarHBondContact O-CB 3.4Å; I637-L641 PolarHBondContact O-N 3.31Å; I637-I680 HydrophobicContact CD1-CG2 3.78Å; I637-C684 VanDerWaalsContact CD1-SG 3.56Å; I637-L687 HydrophobicContact CG2-CD1 4.14Å
638	S	82.9	Confident	75.4	Confident	29 Å²	29	77.2 Å²	77.2	20%	0.203	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-44.2	175.6	-163.9	0	0	0	0	111.9	K634 N635 L636 L641 D642	K634-S638 WeakPolarHBondContact O-CB 3.39Å; K634-S638 PolarHBondContact O-N 3.24Å; N635-S638 WeakPolarHBondContact O-CB 3.16Å; N635-S638 PolarHBondContact O-N 3.05Å; L636-S638 VanDerWaalsContact C-N 3.32Å; S638-L641 WeakPolarHBondContact O-CB 3.19Å; S638-L641 PolarHBondContact O-N 3.37Å; S638-D642 WeakPolarHBondContact O-CB 3.27Å; S638-D642 VanDerWaalsContact O-CG 3.24Å; S638-D642 PolarHBondContact O-N 2.71Å
639	E	85.3	Confident	77.5	Confident	125 Å²	125	72.2 Å²	72.2	58%	0.584	34%	0.342	S	S	*	.	H	α-helix	trans	-62.9	-44.1	176.7	-75.2	174.7	-166.9	0	0	111.9	N635 L636 L641 D642 E643	N635-E639 WeakPolarHBondContact O-CG 3.3Å; N635-E639 PolarHBondContact O-N 3.35Å; L636-E639 PolarHBondContact O-N 3.34Å; E639-L641 VanDerWaalsContact C-N 3.33Å; E639-D642 PolarHBondContact O-N 3.5Å; E639-E643 PolarHBondContact O-N 2.93Å
640	L	86.9	Confident	79	Confident	20 Å²	20	75.5 Å²	75.5	11%	0.105	36%	0.36	C	S	.	.	H	α-helix	trans	-64.1	-39.2	175.4	-71.3	172.9	0	0	0	111.6	V605 L636 I637 E643 A644 L687	V605-L640 HydrophobicContact CG2-CD1 4.2Å; L636-L640 HydrophobicContact CG-CD1 4.43Å; L636-L640 WeakPolarHBondContact O-CB 3.38Å; L636-L640 VanDerWaalsContact O-CG 3.29Å; L636-L640 WeakPolarHBondContact O-CG 3.49Å; L636-L640 PolarHBondContact O-N 3.31Å; I637-L640 PolarHBondContact O-N 2.82Å; L640-E643 PolarHBondContact O-N 3.13Å; L640-A644 VanDerWaalsContact O-CB 3.3Å; L640-A644 WeakPolarHBondContact O-CB 3.49Å; L640-A644 PolarHBondContact O-N 2.92Å; L640-L687 HydrophobicContact CB-CD1 4.02Å; L640-L687 HydrophobicContact CB-CD2 4.5Å
641	L	86.4	Confident	80.4	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-65.4	-44	175.8	-160.7	79.8	0	0	0	111	I637 S638 E639 A644 R645 P652 M654 L687	I637-L641 WeakPolarHBondContact O-CB 3.4Å; I637-L641 PolarHBondContact O-N 3.31Å; S638-L641 WeakPolarHBondContact O-CB 3.19Å; S638-L641 PolarHBondContact O-N 3.37Å; E639-L641 VanDerWaalsContact C-N 3.33Å; L641-A644 PolarHBondContact O-N 3Å; L641-R645 VanDerWaalsContact O-CB 3.29Å; L641-R645 WeakPolarHBondContact O-CB 3.23Å; L641-R645 WeakPolarHBondContact O-CG 3.24Å; L641-R645 PolarHBondContact O-N 2.93Å; L641-P652 HydrophobicContact CD1-CG 4.36Å; L641-P652 WeakPolarHBondContact CD2-O 3.46Å; L641-M654 HydrophobicContact CD2-CG 4.04Å; L641-L687 HydrophobicContact CB-CD1 4.46Å; L641-L687 HydrophobicContact CD1-CD1 4.19Å; L641-L687 HydrophobicContact CD1-CD2 4.12Å; L641-L687 HydrophobicContact CD1-CG 3.8Å
642	D	85.9	Confident	81.3	Confident	77 Å²	77	68.6 Å²	68.6	41%	0.412	33%	0.326	S	S	.	.	H	α-helix	trans	-68	-33.3	177.2	-70	-25.7	0	0	0	112.2	S638 E639 R646	S638-D642 WeakPolarHBondContact O-CB 3.27Å; S638-D642 VanDerWaalsContact O-CG 3.24Å; S638-D642 PolarHBondContact O-N 2.71Å; E639-D642 PolarHBondContact O-N 3.5Å; D642-R646 PolarHBondContact O-N 3.03Å; D642-R646 PolarHBondContact O-NE 3.41Å
643	E	86	Confident	81.8	Confident	58 Å²	58	60.5 Å²	60.5	27%	0.271	30%	0.299	S	S	.	.	H	α-helix	trans	-66.1	-47.4	168.9	-170.9	-171.6	154.4	0	0	111.7	R601 E639 L640 R645 R646	R601-E643 IonicContact CZ-OE1 3.4Å; R601-E643 VanDerWaalsContact CZ-OE1 3.26Å; R601-E643 IonicContact CZ-OE2 2.92Å; R601-E643 IonicContact NH1-OE1 3.75Å; R601-E643 PolarHBondContact NH1-OE1 3.33Å; R601-E643 IonicContact NH2-OE1 2.65Å; R601-E643 PolarHBondContact NH2-OE1 2.71Å; R601-E643 IonicContact NH2-OE2 2.76Å; E639-E643 PolarHBondContact O-N 2.93Å; L640-E643 PolarHBondContact O-N 3.13Å; E643-R645 VanDerWaalsContact C-N 3.31Å; E643-R645 PolarHBondContact O-N 2.94Å; E643-R646 WeakPolarHBondContact O-CB 3.47Å; E643-R646 PolarHBondContact O-N 2.95Å
644	A	86.8	Confident	82	Confident	2 Å²	2	57.1 Å²	57.1	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-63.4	-38.5	179	0	0	0	0	0	111.5	L640 L641 R646 K647 D648 L651 L687 F690	L640-A644 VanDerWaalsContact O-CB 3.3Å; L640-A644 WeakPolarHBondContact O-CB 3.49Å; L640-A644 PolarHBondContact O-N 2.92Å; L641-A644 PolarHBondContact O-N 3Å; A644-R646 VanDerWaalsContact C-N 3.26Å; A644-R646 PolarHBondContact O-N 3Å; A644-K647 CarbonylContact O-C 3.58Å; A644-K647 WeakPolarHBondContact O-CA 3.43Å; A644-K647 PolarHBondContact O-N 3.07Å; A644-D648 PolarHBondContact O-N 2.87Å; A644-L651 HydrophobicContact CB-CD1 3.46Å; A644-L651 VanDerWaalsContact CB-CD1 3.46Å; A644-L687 HydrophobicContact CB-CD2 3.7Å; A644-F690 HydrophobicContact CB-CD1 3.64Å; A644-F690 HydrophobicContact CB-CE1 3.56Å; A644-F690 HydrophobicContact CB-CG 4.19Å; A644-F690 HydrophobicContact CB-CZ 4.05Å
645	R	85.6	Confident	82.1	Confident	81 Å²	81	60.5 Å²	60.5	31%	0.306	31%	0.307	S	S	.	.	H	α-helix	trans	-63.8	-25.3	176.6	-79.6	178.6	72.6	129.8	6.4	114.7	L641 E643 K647 D648 L651 P652 S653	L641-R645 VanDerWaalsContact O-CB 3.29Å; L641-R645 WeakPolarHBondContact O-CB 3.23Å; L641-R645 WeakPolarHBondContact O-CG 3.24Å; L641-R645 PolarHBondContact O-N 2.93Å; E643-R645 VanDerWaalsContact C-N 3.31Å; E643-R645 PolarHBondContact O-N 2.94Å; R645-K647 PolarHBondContact O-N 2.92Å; R645-D648 WeakPolarHBondContact CA-O 3.18Å; R645-D648 CarbonylContact O-C 3.54Å; R645-L651 HydrophobicContact CG-CB 3.76Å; R645-L651 PolarHBondContact NH1-O 2.78Å; R645-P652 WeakPolarHBondContact CD-O 3.44Å; R645-P652 PolarHBondContact NH1-O 3.32Å; R645-S653 VanDerWaalsContact NH1-CA 3.28Å
646	R	85.8	Confident	81.7	Confident	197 Å²	197	61 Å²	61	74%	0.743	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-22	171.4	-76.7	178.2	-96.8	153.1	-8.5	112.3	D642 E643 A644	D642-R646 PolarHBondContact O-N 3.03Å; D642-R646 PolarHBondContact O-NE 3.41Å; E643-R646 WeakPolarHBondContact O-CB 3.47Å; E643-R646 PolarHBondContact O-N 2.95Å; A644-R646 VanDerWaalsContact C-N 3.26Å; A644-R646 PolarHBondContact O-N 3Å
647	K	83	Confident	81	Confident	124 Å²	124	61 Å²	61	54%	0.539	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-36.2	174.6	-64.6	-172.4	174.5	-165.9	0	113.1	A644 R645 F690	A644-K647 CarbonylContact O-C 3.58Å; A644-K647 WeakPolarHBondContact O-CA 3.43Å; A644-K647 PolarHBondContact O-N 3.07Å; R645-K647 PolarHBondContact O-N 2.92Å; K647-F690 HydrophobicContact CB-CE2 4.19Å; K647-F690 HydrophobicContact CB-CZ 3.93Å; K647-F690 HydrophobicContact CD-CZ 4.16Å
648	D	83.6	Confident	80.2	Confident	24 Å²	24	71.4 Å²	71.4	13%	0.128	35%	0.352	C	S	.	.			trans	-130.7	89.8	179.7	-174.5	-6.8	0	0	0	110.1	A644 R645 S650 L651 F690 R693	A644-D648 PolarHBondContact O-N 2.87Å; R645-D648 WeakPolarHBondContact CA-O 3.18Å; R645-D648 CarbonylContact O-C 3.54Å; D648-S650 PolarHBondContact O-N 3.49Å; D648-S650 VanDerWaalsContact OD1-CB 3.31Å; D648-S650 WeakPolarHBondContact OD1-CB 3.09Å; D648-S650 PolarHBondContact OD1-N 2.91Å; D648-S650 VanDerWaalsContact OD1-N 3.16Å; D648-S650 PolarHBondContact OD1-OG 2.84Å; D648-L651 HydrophobicContact CB-CD1 4.12Å; D648-L651 HydrophobicContact CB-CG 4.23Å; D648-L651 PolarHBondContact O-N 2.74Å; D648-F690 HydrophobicContact CB-CD2 3.85Å; D648-F690 HydrophobicContact CB-CE2 3.66Å; D648-R693 IonicContact OD2-CZ 2.68Å; D648-R693 IonicContact OD2-NH1 3.48Å; D648-R693 PolarHBondContact OD2-NH1 3Å; D648-R693 IonicContact OD2-NH2 3.75Å; D648-R693 PolarHBondContact OD2-NH2 2.72Å
649	P	82.5	Confident	79.4	Confident	102 Å²	102	76.7 Å²	76.7	66%	0.662	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-7.4	-177.2	25.6	-32.8	0	0	0	113.9	L651	P649-L651 VanDerWaalsContact C-N 3.31Å
650	S	79.1	Confident	78.6	Confident	97 Å²	97	72.4 Å²	72.4	68%	0.678	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-14.4	176.8	77.5	0	0	0	0	114.1	D648	D648-S650 PolarHBondContact O-N 3.49Å; D648-S650 VanDerWaalsContact OD1-CB 3.31Å; D648-S650 WeakPolarHBondContact OD1-CB 3.09Å; D648-S650 PolarHBondContact OD1-N 2.91Å; D648-S650 VanDerWaalsContact OD1-N 3.16Å; D648-S650 PolarHBondContact OD1-OG 2.84Å
651	L	83.3	Confident	78	Confident	5 Å²	5	76.1 Å²	76.1	3%	0.026	39%	0.39	C	S	.	.	S	Bend	trans	-64	148.5	178.9	-70.4	170.9	0	0	0	112	A644 R645 D648 P649 Q686 F690	A644-L651 HydrophobicContact CB-CD1 3.46Å; A644-L651 VanDerWaalsContact CB-CD1 3.46Å; R645-L651 HydrophobicContact CG-CB 3.76Å; R645-L651 PolarHBondContact NH1-O 2.78Å; D648-L651 HydrophobicContact CB-CD1 4.12Å; D648-L651 HydrophobicContact CB-CG 4.23Å; D648-L651 PolarHBondContact O-N 2.74Å; P649-L651 VanDerWaalsContact C-N 3.31Å; L651-Q686 HydrophobicContact CD2-CB 4.05Å; L651-F690 HydrophobicContact CD1-CB 4.18Å; L651-F690 HydrophobicContact CD1-CD2 3.9Å; L651-F690 HydrophobicContact CD1-CE2 4.48Å; L651-F690 HydrophobicContact CD1-CG 3.96Å; L651-F690 HydrophobicContact CD2-CB 4.27Å
652	P	78.7	Confident	77.6	Confident	5 Å²	5	80.9 Å²	80.9	3%	0.032	41%	0.408	C	S	.	.			trans	-61.7	166.4	-177.1	26.5	-35.8	0	0	0	112.9	L641 R645 H663 Y682 Q686	L641-P652 HydrophobicContact CD1-CG 4.36Å; L641-P652 WeakPolarHBondContact CD2-O 3.46Å; R645-P652 WeakPolarHBondContact CD-O 3.44Å; R645-P652 PolarHBondContact NH1-O 3.32Å; P652-H663 WeakPolarHBondContact CB-NE2 3.45Å; P652-Y682 HydrophobicContact CB-CD1 4.45Å; P652-Y682 HydrophobicContact CB-CE1 3.74Å; P652-Y682 HydrophobicContact CG-CD1 4.28Å; P652-Y682 HydrophobicContact CG-CE1 3.7Å; P652-Q686 HydrophobicContact CG-CB 4.14Å; P652-Q686 HydrophobicContact CG-CG 3.92Å
653	S	77	Confident	77.2	Confident	27 Å²	27	79.2 Å²	79.2	19%	0.189	40%	0.398	C	S	.	.			trans	-109.4	144	168.5	-166.8	0	0	0	0	109.2	R645 I655 Y673	R645-S653 VanDerWaalsContact NH1-CA 3.28Å; S653-I655 WeakPolarHBondContact CB-O 3.38Å; S653-I655 PolarHBondContact O-N 2.93Å; S653-I655 PolarHBondContact OG-N 2.66Å; S653-I655 VanDerWaalsContact OG-N 3.11Å; S653-Y673 WeakPolarHBondContact O-CE1 3.24Å
654	M	74.3	Confident	76.9	Confident	25 Å²	25	79.4 Å²	79.4	12%	0.123	40%	0.403	C	S	.	.	S	Bend	trans	-70.3	-17.3	165.4	-72.4	-61.2	-66	0	0	112.4	K634 L641 I679 I680 S683	K634-M654 HydrophobicContact CG-CE 4.07Å; L641-M654 HydrophobicContact CD2-CG 4.04Å; M654-I679 HydrophobicContact CE-CG2 3.87Å; M654-I679 HydrophobicContact SD-CG2 4.17Å; M654-I680 HydrophobicContact CE-CG1 3.73Å; M654-S683 PolarHBondContact SD-OG 3.16Å; M654-S683 VanDerWaalsContact SD-OG 3.35Å
655	I	72.3	Confident	76.7	Confident	131 Å²	131	80.5 Å²	80.5	67%	0.672	41%	0.409	S	S	*	.	S	Bend	trans	-90.9	120.8	177.5	-56.4	173.4	0	0	0	108.4	S653 P657	S653-I655 WeakPolarHBondContact CB-O 3.38Å; S653-I655 PolarHBondContact O-N 2.93Å; S653-I655 PolarHBondContact OG-N 2.66Å; S653-I655 VanDerWaalsContact OG-N 3.11Å; I655-P657 WeakPolarHBondContact O-CD 3.47Å
656	K	67	Low	76.4	Confident	103 Å²	103	83.9 Å²	83.9	45%	0.448	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-55.5	118.8	177.2	180	178.7	175.5	177.6	0	110.6	D661 Y673	K656-D661 WeakPolarHBondContact CE-OD1 3.47Å; K656-D661 IonicContact NZ-OD1 2.72Å; K656-D661 PolarHBondContact NZ-OD1 3.1Å; K656-Y673 HydrophobicContact CB-CD1 4.19Å; K656-Y673 HydrophobicContact CB-CD2 4.19Å; K656-Y673 HydrophobicContact CB-CG 3.97Å; K656-Y673 HydrophobicContact CD-CD2 4.38Å; K656-Y673 HydrophobicContact CG-CD2 3.8Å; K656-Y673 HydrophobicContact CG-CE2 4.23Å; K656-Y673 HydrophobicContact CG-CG 4.03Å
657	P	66.5	Low	76.4	Confident	47 Å²	47	75.9 Å²	75.9	31%	0.305	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-70	148.5	173.1	28.9	-32.3	0	0	0	110.2	I655 T659 A660 Y673	I655-P657 WeakPolarHBondContact O-CD 3.47Å; P657-T659 PolarHBondContact O-N 3.22Å; P657-T659 VanDerWaalsContact O-N 3.08Å; P657-A660 HydrophobicContact CG-CB 4.11Å; P657-A660 PolarHBondContact O-N 3.07Å; P657-Y673 WeakPolarHBondContact CD-OH 3.07Å; P657-Y673 HydrophobicContact CG-CE2 4.31Å
658	K	65.6	Low	76.5	Confident	220 Å²	220	70.4 Å²	70.4	96%	0.957	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.3	-178.1	-69.5	-174.7	178.6	-179.3	0	114
659	T	66	Low	76.7	Confident	140 Å²	140	69.9 Å²	69.9	86%	0.859	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-13.8	-170.8	49	0	0	0	0	114.4	P657	P657-T659 PolarHBondContact O-N 3.22Å; P657-T659 VanDerWaalsContact O-N 3.08Å
660	A	67.3	Low	76.8	Confident	36 Å²	36	67.5 Å²	67.5	30%	0.298	35%	0.35	S	S	.	.			trans	-137.1	129.8	-174.7	0	0	0	0	0	112.3	P657	P657-A660 HydrophobicContact CG-CB 4.11Å; P657-A660 PolarHBondContact O-N 3.07Å
661	D	75.9	Confident	76.9	Confident	98 Å²	98	64.6 Å²	64.6	52%	0.524	33%	0.326	S	S	.	.	S	Bend	trans	-87.7	-10.6	179.8	-71.4	-35.9	0	0	0	113.8	K656 Y673	K656-D661 WeakPolarHBondContact CE-OD1 3.47Å; K656-D661 IonicContact NZ-OD1 2.72Å; K656-D661 PolarHBondContact NZ-OD1 3.1Å; D661-Y673 WeakPolarHBondContact O-CD2 3.15Å; D661-Y673 PolarHBondContact O-N 3.12Å
662	Y	76.9	Confident	76.5	Confident	99 Å²	99	66.1 Å²	66.1	39%	0.388	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	155.1	-177.9	52.2	-93.5	0	0	0	111.3	V664 K670 H671	Y662-V664 HydrophobicContact CD2-CG2 3.89Å; Y662-V664 HydrophobicContact CE2-CG2 3.82Å; Y662-K670 HydrophobicContact CD2-CB 3.83Å; Y662-K670 HydrophobicContact CD2-CD 4.04Å; Y662-K670 HydrophobicContact CD2-CG 3.74Å; Y662-K670 HydrophobicContact CE1-CD 4.38Å; Y662-K670 HydrophobicContact CE2-CB 4.37Å; Y662-K670 HydrophobicContact CE2-CD 3.74Å; Y662-K670 HydrophobicContact CE2-CG 3.78Å; Y662-K670 HydrophobicContact CG-CB 4.1Å; Y662-K670 HydrophobicContact CG-CD 4.49Å; Y662-K670 HydrophobicContact CG-CG 4.4Å; Y662-H671 CarbonylContact C-O 3.49Å; Y662-H671 VanDerWaalsContact CA-O 3.25Å; Y662-H671 WeakPolarHBondContact CA-O 3.39Å; Y662-H671 WeakPolarHBondContact CB-O 3.49Å
663	H	77	Confident	76.1	Confident	42 Å²	42	67.4 Å²	67.4	19%	0.194	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	148.6	163	-81.4	-62.6	0	0	0	109.9	P652 K670 H671 Y673 I679 Y682	P652-H663 WeakPolarHBondContact CB-NE2 3.45Å; H663-K670 CarbonylContact O-C 3.55Å; H663-K670 WeakPolarHBondContact O-CA 2.97Å; H663-H671 PolarHBondContact N-O 3.21Å; H663-H671 PolarHBondContact O-N 3.02Å; H663-Y673 AromaticContact CD2-CE1 3.87Å; H663-Y673 AromaticContact CD2-CZ 3.47Å; H663-Y673 VanDerWaalsContact CD2-CZ 3.47Å; H663-Y673 PolarHBondContact CD2-OH 3.31Å; H663-Y673 PolarHBondContact CE1-OH 2.95Å; H663-Y673 VanDerWaalsContact CE1-OH 3.22Å; H663-Y673 AromaticContact NE2-CE1 3.99Å; H663-Y673 AromaticContact NE2-CZ 3.52Å; H663-Y673 PolarHBondContact NE2-OH 3.45Å; H663-I679 HydrophobicContact CB-CD1 4.49Å; H663-Y682 HydrophobicContact CB-CD1 4.24Å; H663-Y682 HydrophobicContact CB-CE1 3.66Å; H663-Y682 AromaticContact CD2-CE1 3.96Å; H663-Y682 AromaticContact CG-CE1 3.83Å
664	V	80.7	Confident	75.7	Confident	62 Å²	62	73.7 Å²	73.7	38%	0.376	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.3	171.3	-176.5	0	0	0	0	107.3	Y662 F669 K670 V790	Y662-V664 HydrophobicContact CD2-CG2 3.89Å; Y662-V664 HydrophobicContact CE2-CG2 3.82Å; V664-F669 WeakPolarHBondContact CA-O 3.46Å; V664-K670 HydrophobicContact CG2-CG 4.34Å; V664-V790 HydrophobicContact CG1-CG1 3.94Å; V664-V790 HydrophobicContact CG2-CG1 4.13Å
665	D	81.9	Confident	75.4	Confident	25 Å²	25	76.3 Å²	76.3	13%	0.134	39%	0.386	C	S	.	.			trans	-79	176.6	175.7	70.1	18.7	0	0	0	112.6	Y667 G668 F669 H671 Y682	D665-Y667 PolarHBondContact O-N 3.49Å; D665-Y667 WeakPolarHBondContact OD1-CA 3.26Å; D665-Y667 PolarHBondContact OD1-N 2.89Å; D665-G668 PolarHBondContact O-N 3Å; D665-G668 PolarHBondContact OD1-N 3.42Å; D665-F669 PolarHBondContact N-O 3.49Å; D665-F669 PolarHBondContact OD1-N 3.05Å; D665-F669 WeakPolarHBondContact OD2-CB 3.37Å; D665-H671 IonicContact OD2-CD2 2.85Å; D665-H671 IonicContact OD2-CE1 3.97Å; D665-H671 IonicContact OD2-NE2 3.55Å; D665-H671 PolarHBondContact OD2-NE2 2.82Å; D665-Y682 HydrophobicContact CB-CD2 4.06Å; D665-Y682 HydrophobicContact CB-CE2 3.72Å
666	F	79.2	Confident	75.2	Confident	152 Å²	152	72.9 Å²	72.9	67%	0.667	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.7	-179.6	-70.4	-75.7	0	0	0	114.2
667	Y	86.2	Confident	75.2	Confident	30 Å²	30	69.1 Å²	69.1	12%	0.118	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-4.1	176.7	-53	-67.3	0	0	0	112.7	D665 I731 N789 F833 F910 E911 I914	D665-Y667 PolarHBondContact O-N 3.49Å; D665-Y667 WeakPolarHBondContact OD1-CA 3.26Å; D665-Y667 PolarHBondContact OD1-N 2.89Å; Y667-I731 HydrophobicContact CD1-CD1 4.07Å; Y667-I731 HydrophobicContact CE1-CD1 3.5Å; Y667-I731 VanDerWaalsContact CE1-CD1 3.5Å; Y667-I731 HydrophobicContact CE1-CG1 4.42Å; Y667-N789 PolarHBondContact O-ND2 3.02Å; Y667-F833 AromaticContact CD1-CE1 3.79Å; Y667-F833 HydrophobicContact CD1-CE1 3.79Å; Y667-F833 AromaticContact CD1-CZ 3.69Å; Y667-F833 HydrophobicContact CD1-CZ 3.69Å; Y667-F833 AromaticContact CE1-CE1 3.73Å; Y667-F833 HydrophobicContact CE1-CE1 3.73Å; Y667-F833 AromaticContact CE1-CZ 3.74Å; Y667-F833 HydrophobicContact CE1-CZ 3.74Å; Y667-F910 AromaticContact CD1-CE1 3.73Å; Y667-F910 HydrophobicContact CD1-CE1 3.73Å; Y667-F910 AromaticContact CD2-CD1 3.65Å; Y667-F910 HydrophobicContact CD2-CD1 3.65Å; Y667-F910 AromaticContact CD2-CE1 3.69Å; Y667-F910 HydrophobicContact CD2-CE1 3.69Å; Y667-F910 HydrophobicContact CE1-CE1 4.17Å; Y667-F910 HydrophobicContact CE2-CD1 4Å; Y667-F910 HydrophobicContact CE2-CE1 4.13Å; Y667-F910 AromaticContact CG-CD1 3.92Å; Y667-F910 HydrophobicContact CG-CD1 3.92Å; Y667-F910 AromaticContact CG-CE1 3.46Å; Y667-F910 HydrophobicContact CG-CE1 3.46Å; Y667-F910 VanDerWaalsContact CG-CE1 3.46Å; Y667-F910 HydrophobicContact CG-CZ 4.48Å; Y667-E911 VanDerWaalsContact CE2-OE1 3.28Å; Y667-E911 WeakPolarHBondContact CE2-OE1 3.43Å; Y667-E911 PolarHBondContact OH-OE2 3.11Å; Y667-I914 HydrophobicContact CE1-CD1 4.17Å; Y667-I914 HydrophobicContact CE2-CD1 4.4Å; Y667-I914 WeakPolarHBondContact OH-CD1 3.18Å
668	G	85.6	Confident	75.3	Confident	8 Å²	8	68.7 Å²	68.7	8%	0.082	35%	0.352	C	S	.	.			trans	92.1	6.9	-179.6	0	0	0	0	0	114.8	D665 N789 V790	D665-G668 PolarHBondContact O-N 3Å; D665-G668 PolarHBondContact OD1-N 3.42Å; G668-N789 CarbonylContact O-C 3.53Å; G668-N789 WeakPolarHBondContact O-CA 3.03Å; G668-V790 PolarHBondContact O-N 3.43Å
669	F	88.5	Confident	75.8	Confident	13 Å²	13	58.5 Å²	58.5	6%	0.057	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-78.3	137.1	176.8	-66.1	-78.4	0	0	0	112	V664 D665 H671 M786 N789 L832 F910	V664-F669 WeakPolarHBondContact CA-O 3.46Å; D665-F669 PolarHBondContact N-O 3.49Å; D665-F669 PolarHBondContact OD1-N 3.05Å; D665-F669 WeakPolarHBondContact OD2-CB 3.37Å; F669-H671 PolarHBondContact O-CD2 3.29Å; F669-M786 HydrophobicContact CE1-CG 4.42Å; F669-M786 HydrophobicContact CZ-SD 4.26Å; F669-N789 HydrophobicContact CD1-CB 3.84Å; F669-N789 HydrophobicContact CE1-CB 3.8Å; F669-N789 HydrophobicContact CZ-CB 4.47Å; F669-L832 HydrophobicContact CE2-CD1 4.31Å; F669-L832 HydrophobicContact CZ-CD1 4.22Å; F669-F910 HydrophobicContact CD2-CD1 4.32Å; F669-F910 HydrophobicContact CD2-CG 4.3Å; F669-F910 HydrophobicContact CE2-CB 4.37Å; F669-F910 AromaticContact CE2-CD1 3.72Å; F669-F910 HydrophobicContact CE2-CD1 3.72Å; F669-F910 AromaticContact CE2-CD2 3.47Å; F669-F910 HydrophobicContact CE2-CD2 3.47Å; F669-F910 VanDerWaalsContact CE2-CD2 3.47Å; F669-F910 AromaticContact CE2-CE1 3.79Å; F669-F910 HydrophobicContact CE2-CE1 3.79Å; F669-F910 AromaticContact CE2-CE2 3.55Å; F669-F910 HydrophobicContact CE2-CE2 3.55Å; F669-F910 AromaticContact CE2-CG 3.56Å; F669-F910 HydrophobicContact CE2-CG 3.56Å; F669-F910 AromaticContact CE2-CZ 3.72Å; F669-F910 HydrophobicContact CE2-CZ 3.72Å; F669-F910 AromaticContact CZ-CD2 3.6Å; F669-F910 HydrophobicContact CZ-CD2 3.6Å; F669-F910 AromaticContact CZ-CE2 3.65Å; F669-F910 HydrophobicContact CZ-CE2 3.65Å; F669-F910 HydrophobicContact CZ-CG 4.13Å; F669-F910 HydrophobicContact CZ-CZ 4.22Å
670	K	84.6	Confident	76.3	Confident	53 Å²	53	52 Å²	52	23%	0.23	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	111	178	-59.6	177.3	-175.1	-179	0	110.5	Y662 H663 V664 N788 V790 D793	Y662-K670 HydrophobicContact CD2-CB 3.83Å; Y662-K670 HydrophobicContact CD2-CD 4.04Å; Y662-K670 HydrophobicContact CD2-CG 3.74Å; Y662-K670 HydrophobicContact CE1-CD 4.38Å; Y662-K670 HydrophobicContact CE2-CB 4.37Å; Y662-K670 HydrophobicContact CE2-CD 3.74Å; Y662-K670 HydrophobicContact CE2-CG 3.78Å; Y662-K670 HydrophobicContact CG-CB 4.1Å; Y662-K670 HydrophobicContact CG-CD 4.49Å; Y662-K670 HydrophobicContact CG-CG 4.4Å; H663-K670 CarbonylContact O-C 3.55Å; H663-K670 WeakPolarHBondContact O-CA 2.97Å; V664-K670 HydrophobicContact CG2-CG 4.34Å; K670-N788 WeakPolarHBondContact CB-O 3.25Å; K670-N788 WeakPolarHBondContact CG-O 3.36Å; K670-N788 PolarHBondContact N-O 3.26Å; K670-V790 HydrophobicContact CG-CG1 4.21Å; K670-D793 VanDerWaalsContact CE-OD2 3.28Å; K670-D793 WeakPolarHBondContact CE-OD2 3.44Å; K670-D793 IonicContact NZ-OD2 2.84Å; K670-D793 PolarHBondContact NZ-OD2 3.35Å
671	H	80.6	Confident	76.7	Confident	36 Å²	36	51.6 Å²	51.6	17%	0.167	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	98.3	173.1	-62.5	-73.5	0	0	0	109.8	Y662 H663 D665 F669 I679 Y682	Y662-H671 CarbonylContact C-O 3.49Å; Y662-H671 VanDerWaalsContact CA-O 3.25Å; Y662-H671 WeakPolarHBondContact CA-O 3.39Å; Y662-H671 WeakPolarHBondContact CB-O 3.49Å; H663-H671 PolarHBondContact N-O 3.21Å; H663-H671 PolarHBondContact O-N 3.02Å; D665-H671 IonicContact OD2-CD2 2.85Å; D665-H671 IonicContact OD2-CE1 3.97Å; D665-H671 IonicContact OD2-NE2 3.55Å; D665-H671 PolarHBondContact OD2-NE2 2.82Å; F669-H671 PolarHBondContact O-CD2 3.29Å; H671-I679 HydrophobicContact CB-CD1 4.18Å; H671-Y682 AromaticContact CD2-CD2 3.79Å
672	S	74.8	Confident	76.8	Confident	36 Å²	36	48.1 Å²	48.1	25%	0.252	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	136.7	179.4	-177.6	0	0	0	0	111.7	L674 N675	S672-L674 PolarHBondContact O-N 3.45Å; S672-L674 VanDerWaalsContact O-N 3.15Å; S672-L674 WeakPolarHBondContact OG-CB 3.06Å; S672-L674 PolarHBondContact OG-N 3.32Å; S672-N675 PolarHBondContact O-N 3.03Å
673	Y	70.8	Confident	77.1	Confident	32 Å²	32	43.4 Å²	43.4	13%	0.125	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-16.1	170.8	-66.3	-80	0	0	0	113.5	S653 K656 P657 D661 H663 I679	S653-Y673 WeakPolarHBondContact O-CE1 3.24Å; K656-Y673 HydrophobicContact CB-CD1 4.19Å; K656-Y673 HydrophobicContact CB-CD2 4.19Å; K656-Y673 HydrophobicContact CB-CG 3.97Å; K656-Y673 HydrophobicContact CD-CD2 4.38Å; K656-Y673 HydrophobicContact CG-CD2 3.8Å; K656-Y673 HydrophobicContact CG-CE2 4.23Å; K656-Y673 HydrophobicContact CG-CG 4.03Å; P657-Y673 WeakPolarHBondContact CD-OH 3.07Å; P657-Y673 HydrophobicContact CG-CE2 4.31Å; D661-Y673 WeakPolarHBondContact O-CD2 3.15Å; D661-Y673 PolarHBondContact O-N 3.12Å; H663-Y673 AromaticContact CD2-CE1 3.87Å; H663-Y673 AromaticContact CD2-CZ 3.47Å; H663-Y673 VanDerWaalsContact CD2-CZ 3.47Å; H663-Y673 PolarHBondContact CD2-OH 3.31Å; H663-Y673 PolarHBondContact CE1-OH 2.95Å; H663-Y673 VanDerWaalsContact CE1-OH 3.22Å; H663-Y673 AromaticContact NE2-CE1 3.99Å; H663-Y673 AromaticContact NE2-CZ 3.52Å; H663-Y673 PolarHBondContact NE2-OH 3.45Å; Y673-I679 HydrophobicContact CD1-CD1 3.92Å; Y673-I679 HydrophobicContact CD1-CG1 3.84Å; Y673-I679 HydrophobicContact CE1-CD1 3.94Å; Y673-I679 HydrophobicContact CE1-CG1 4Å; Y673-I679 HydrophobicContact CG-CD1 4.48Å
674	L	67.6	Low	77.4	Confident	160 Å²	160	41.4 Å²	41.4	84%	0.838	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-25.5	172.5	-64.6	171.2	0	0	0	112	S672	S672-L674 PolarHBondContact O-N 3.45Å; S672-L674 VanDerWaalsContact O-N 3.15Å; S672-L674 WeakPolarHBondContact OG-CB 3.06Å; S672-L674 PolarHBondContact OG-N 3.32Å
675	N	68.7	Low	77.5	Confident	79 Å²	79	40 Å²	40	42%	0.422	20%	0.201	S	C	.	.			trans	-101.7	86.5	175.6	-170	-10.5	0	0	0	109.7	S672 T677 S678 I679	S672-N675 PolarHBondContact O-N 3.03Å; N675-T677 PolarHBondContact O-N 3.01Å; N675-T677 PolarHBondContact OD1-N 3.09Å; N675-S678 PolarHBondContact ND2-OG 3.25Å; N675-S678 PolarHBondContact O-N 2.76Å; N675-S678 VanDerWaalsContact O-N 3.1Å; N675-S678 PolarHBondContact OD1-N 3.11Å; N675-I679 PolarHBondContact O-N 3.46Å; N675-I679 VanDerWaalsContact O-N 3.12Å
676	E	66.9	Low	77.7	Confident	59 Å²	59	39.6 Å²	39.6	28%	0.276	20%	0.198	S	C	.	.	H	α-helix	trans	-57	-34.6	-176.5	-168.7	177.1	-158.1	0	0	112.9	K630 K634 I679 I680	K630-E676 WeakPolarHBondContact CE-OE2 3.28Å; K630-E676 IonicContact NZ-OE2 3.12Å; K630-E676 PolarHBondContact NZ-OE2 2.68Å; K634-E676 WeakPolarHBondContact CD-OE1 3.44Å; K634-E676 VanDerWaalsContact CE-OE1 3.3Å; K634-E676 WeakPolarHBondContact CE-OE1 3.13Å; K634-E676 IonicContact NZ-OE1 2.85Å; K634-E676 PolarHBondContact NZ-OE1 3.27Å; E676-I679 WeakPolarHBondContact O-CG2 3.39Å; E676-I679 PolarHBondContact O-N 3.16Å; E676-I680 HydrophobicContact CG-CD1 3.95Å; E676-I680 HydrophobicContact CG-CG1 4.49Å; E676-I680 WeakPolarHBondContact O-CB 3.27Å; E676-I680 WeakPolarHBondContact O-CD1 3.2Å; E676-I680 WeakPolarHBondContact O-CG1 3.5Å; E676-I680 PolarHBondContact O-N 2.67Å
677	T	68.8	Low	78	Confident	25 Å²	25	32.4 Å²	32.4	15%	0.153	17%	0.166	C	C	.	.	H	α-helix	trans	-65.3	-44.6	177.5	-55.5	0	0	0	0	111.3	F625 N675 I680 H681	F625-T677 HydrophobicContact CE1-CG2 3.78Å; F625-T677 HydrophobicContact CZ-CG2 3.92Å; F625-T677 WeakPolarHBondContact CZ-OG1 3.29Å; N675-T677 PolarHBondContact O-N 3.01Å; N675-T677 PolarHBondContact OD1-N 3.09Å; T677-I680 PolarHBondContact O-N 3.09Å; T677-H681 PolarHBondContact O-CD2 3.27Å; T677-H681 PolarHBondContact O-N 3.36Å
678	S	68.6	Low	78	Confident	38 Å²	38	33 Å²	33	27%	0.266	17%	0.169	S	C	.	.	H	α-helix	trans	-63.5	-41.7	177.4	-66.3	0	0	0	0	112.1	N675 I680 H681 Y682	N675-S678 PolarHBondContact ND2-OG 3.25Å; N675-S678 PolarHBondContact O-N 2.76Å; N675-S678 VanDerWaalsContact O-N 3.1Å; N675-S678 PolarHBondContact OD1-N 3.11Å; S678-I680 VanDerWaalsContact C-N 3.35Å; S678-I680 PolarHBondContact O-N 3.15Å; S678-H681 PolarHBondContact O-N 2.59Å; S678-Y682 VanDerWaalsContact O-CB 3.27Å; S678-Y682 WeakPolarHBondContact O-CB 3.29Å; S678-Y682 PolarHBondContact O-N 3.4Å
679	I	74.9	Confident	77.9	Confident	6 Å²	6	34.9 Å²	34.9	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-67.8	-35.8	179.6	-147.4	69.8	0	0	0	112	M654 H663 H671 Y673 N675 E676 Y682 S683	M654-I679 HydrophobicContact CE-CG2 3.87Å; M654-I679 HydrophobicContact SD-CG2 4.17Å; H663-I679 HydrophobicContact CB-CD1 4.49Å; H671-I679 HydrophobicContact CB-CD1 4.18Å; Y673-I679 HydrophobicContact CD1-CD1 3.92Å; Y673-I679 HydrophobicContact CD1-CG1 3.84Å; Y673-I679 HydrophobicContact CE1-CD1 3.94Å; Y673-I679 HydrophobicContact CE1-CG1 4Å; Y673-I679 HydrophobicContact CG-CD1 4.48Å; N675-I679 PolarHBondContact O-N 3.46Å; N675-I679 VanDerWaalsContact O-N 3.12Å; E676-I679 WeakPolarHBondContact O-CG2 3.39Å; E676-I679 PolarHBondContact O-N 3.16Å; I679-Y682 HydrophobicContact CD1-CD1 4.42Å; I679-S683 VanDerWaalsContact O-CB 3.3Å; I679-S683 WeakPolarHBondContact O-CB 3.44Å; I679-S683 PolarHBondContact O-N 3.38Å; I679-S683 PolarHBondContact O-OG 3.42Å
680	I	76.8	Confident	77.8	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-67.2	-49.3	176.4	-68.5	168.8	0	0	0	110	L612 I637 M654 E676 T677 S678 Y682 S683 C684	L612-I680 HydrophobicContact CD1-CG2 3.47Å; L612-I680 VanDerWaalsContact CD1-CG2 3.47Å; L612-I680 HydrophobicContact CD2-CG2 4.03Å; L612-I680 HydrophobicContact CG-CG2 4.41Å; I637-I680 HydrophobicContact CD1-CG2 3.78Å; M654-I680 HydrophobicContact CE-CG1 3.73Å; E676-I680 HydrophobicContact CG-CD1 3.95Å; E676-I680 HydrophobicContact CG-CG1 4.49Å; E676-I680 WeakPolarHBondContact O-CB 3.27Å; E676-I680 WeakPolarHBondContact O-CD1 3.2Å; E676-I680 WeakPolarHBondContact O-CG1 3.5Å; E676-I680 PolarHBondContact O-N 2.67Å; T677-I680 PolarHBondContact O-N 3.09Å; S678-I680 VanDerWaalsContact C-N 3.35Å; S678-I680 PolarHBondContact O-N 3.15Å; I680-Y682 VanDerWaalsContact C-N 3.33Å; I680-Y682 PolarHBondContact O-N 2.72Å; I680-S683 PolarHBondContact O-N 3.42Å; I680-S683 VanDerWaalsContact O-N 3.15Å; I680-C684 PolarHBondContact O-N 3.37Å; I680-C684 PolarHBondContact O-SG 2.68Å
681	H	75	Confident	77.8	Confident	26 Å²	26	32 Å²	32	12%	0.12	16%	0.164	C	C	.	.	H	α-helix	trans	-60.5	-43.1	177.7	-81.5	-68.4	0	0	0	112.1	Q609 T677 S678 S683 C684 Q685 N964	Q609-H681 PolarHBondContact O-CE1 3.14Å; T677-H681 PolarHBondContact O-CD2 3.27Å; T677-H681 PolarHBondContact O-N 3.36Å; S678-H681 PolarHBondContact O-N 2.59Å; H681-S683 VanDerWaalsContact C-N 3.35Å; H681-S683 PolarHBondContact O-N 3.13Å; H681-C684 PolarHBondContact O-N 3.02Å; H681-Q685 PolarHBondContact O-N 3.36Å; H681-N964 PolarHBondContact CE1-ND2 3.42Å
682	Y	79.4	Confident	77.9	Confident	25 Å²	25	31 Å²	31	10%	0.098	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-46	173.6	172.8	-111	0	0	0	111.4	P652 H663 D665 H671 S678 I679 I680 C684 Q685 Q686	P652-Y682 HydrophobicContact CB-CD1 4.45Å; P652-Y682 HydrophobicContact CB-CE1 3.74Å; P652-Y682 HydrophobicContact CG-CD1 4.28Å; P652-Y682 HydrophobicContact CG-CE1 3.7Å; H663-Y682 HydrophobicContact CB-CD1 4.24Å; H663-Y682 HydrophobicContact CB-CE1 3.66Å; H663-Y682 AromaticContact CD2-CE1 3.96Å; H663-Y682 AromaticContact CG-CE1 3.83Å; D665-Y682 HydrophobicContact CB-CD2 4.06Å; D665-Y682 HydrophobicContact CB-CE2 3.72Å; H671-Y682 AromaticContact CD2-CD2 3.79Å; S678-Y682 VanDerWaalsContact O-CB 3.27Å; S678-Y682 WeakPolarHBondContact O-CB 3.29Å; S678-Y682 PolarHBondContact O-N 3.4Å; I679-Y682 HydrophobicContact CD1-CD1 4.42Å; I680-Y682 VanDerWaalsContact C-N 3.33Å; I680-Y682 PolarHBondContact O-N 2.72Å; Y682-C684 PolarHBondContact O-N 3.22Å; Y682-Q685 WeakPolarHBondContact O-CB 3.31Å; Y682-Q685 PolarHBondContact O-N 3.15Å; Y682-Q685 VanDerWaalsContact O-N 3.15Å; Y682-Q686 HydrophobicContact CD1-CG 4.45Å; Y682-Q686 HydrophobicContact CD2-CG 4.16Å; Y682-Q686 HydrophobicContact CE1-CG 4.05Å; Y682-Q686 HydrophobicContact CE2-CG 3.69Å; Y682-Q686 WeakPolarHBondContact O-CG 3.38Å; Y682-Q686 PolarHBondContact O-N 3.33Å
683	S	82.3	Confident	78.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.8	-39.6	178.9	-58.6	0	0	0	0	112.5	M654 I679 I680 H681 Q686 L687	M654-S683 PolarHBondContact SD-OG 3.16Å; M654-S683 VanDerWaalsContact SD-OG 3.35Å; I679-S683 VanDerWaalsContact O-CB 3.3Å; I679-S683 WeakPolarHBondContact O-CB 3.44Å; I679-S683 PolarHBondContact O-N 3.38Å; I679-S683 PolarHBondContact O-OG 3.42Å; I680-S683 PolarHBondContact O-N 3.42Å; I680-S683 VanDerWaalsContact O-N 3.15Å; H681-S683 VanDerWaalsContact C-N 3.35Å; H681-S683 PolarHBondContact O-N 3.13Å; S683-Q686 PolarHBondContact O-N 3.47Å; S683-L687 WeakPolarHBondContact O-CB 3.05Å; S683-L687 WeakPolarHBondContact O-CG 3.36Å; S683-L687 PolarHBondContact O-N 2.99Å
684	C	83.3	Confident	78.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.5	-44.1	172	-73.2	0	0	0	0	111.7	V605 Q609 I637 I680 H681 Y682 L687 Y688	V605-C684 HydrophobicContact CG1-CB 4.04Å; V605-C684 WeakPolarHBondContact CG1-O 3.39Å; Q609-C684 HydrophobicContact CB-CB 3.92Å; Q609-C684 HydrophobicContact CG-CB 3.96Å; I637-C684 VanDerWaalsContact CD1-SG 3.56Å; I680-C684 PolarHBondContact O-N 3.37Å; I680-C684 PolarHBondContact O-SG 2.68Å; H681-C684 PolarHBondContact O-N 3.02Å; Y682-C684 PolarHBondContact O-N 3.22Å; C684-L687 PolarHBondContact O-N 3.07Å; C684-Y688 WeakPolarHBondContact O-CB 3.34Å; C684-Y688 PolarHBondContact O-N 3.02Å
685	Q	83.1	Confident	79.2	Confident	33 Å²	33	31.8 Å²	31.8	15%	0.154	15%	0.151	C	C	.	.	H	α-helix	trans	-61.3	-47.9	177.5	-170.4	61.7	37.4	0	0	111.2	Q609 H681 Y682 L687 Y688 D689	Q609-Q685 VanDerWaalsContact NE2-OE1 3.11Å; H681-Q685 PolarHBondContact O-N 3.36Å; Y682-Q685 WeakPolarHBondContact O-CB 3.31Å; Y682-Q685 PolarHBondContact O-N 3.15Å; Y682-Q685 VanDerWaalsContact O-N 3.15Å; Q685-L687 VanDerWaalsContact C-N 3.31Å; Q685-L687 PolarHBondContact O-N 3.47Å; Q685-Y688 WeakPolarHBondContact O-CB 3.33Å; Q685-Y688 PolarHBondContact O-N 3.45Å; Q685-Y688 VanDerWaalsContact O-N 3.14Å; Q685-D689 PolarHBondContact NE2-OD1 3Å; Q685-D689 PolarHBondContact O-N 3.09Å
686	Q	85.3	Confident	78.7	Confident	17 Å²	17	32.6 Å²	32.6	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-62.7	-36.9	178.1	-63.2	-57.3	118.7	0	0	112.6	L651 P652 Y682 S683 F690	L651-Q686 HydrophobicContact CD2-CB 4.05Å; P652-Q686 HydrophobicContact CG-CB 4.14Å; P652-Q686 HydrophobicContact CG-CG 3.92Å; Y682-Q686 HydrophobicContact CD1-CG 4.45Å; Y682-Q686 HydrophobicContact CD2-CG 4.16Å; Y682-Q686 HydrophobicContact CE1-CG 4.05Å; Y682-Q686 HydrophobicContact CE2-CG 3.69Å; Y682-Q686 WeakPolarHBondContact O-CG 3.38Å; Y682-Q686 PolarHBondContact O-N 3.33Å; S683-Q686 PolarHBondContact O-N 3.47Å; Q686-F690 WeakPolarHBondContact O-CB 3.3Å; Q686-F690 PolarHBondContact O-N 3.12Å
687	L	86.5	Confident	78.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.8	-41.7	173.4	-83.9	174	0	0	0	112.2	V605 I637 L640 L641 A644 S683 C684 Q685 D689 F690 Y691	V605-L687 HydrophobicContact CG1-CB 3.93Å; V605-L687 HydrophobicContact CG2-CB 4.26Å; V605-L687 HydrophobicContact CG2-CD1 4.43Å; I637-L687 HydrophobicContact CG2-CD1 4.14Å; L640-L687 HydrophobicContact CB-CD1 4.02Å; L640-L687 HydrophobicContact CB-CD2 4.5Å; L641-L687 HydrophobicContact CB-CD1 4.46Å; L641-L687 HydrophobicContact CD1-CD1 4.19Å; L641-L687 HydrophobicContact CD1-CD2 4.12Å; L641-L687 HydrophobicContact CD1-CG 3.8Å; A644-L687 HydrophobicContact CB-CD2 3.7Å; S683-L687 WeakPolarHBondContact O-CB 3.05Å; S683-L687 WeakPolarHBondContact O-CG 3.36Å; S683-L687 PolarHBondContact O-N 2.99Å; C684-L687 PolarHBondContact O-N 3.07Å; Q685-L687 VanDerWaalsContact C-N 3.31Å; Q685-L687 PolarHBondContact O-N 3.47Å; L687-D689 VanDerWaalsContact C-N 3.34Å; L687-F690 PolarHBondContact O-N 2.93Å; L687-Y691 HydrophobicContact CB-CE2 4.34Å; L687-Y691 HydrophobicContact CD2-CE2 4.07Å; L687-Y691 WeakPolarHBondContact O-CD2 3.39Å; L687-Y691 PolarHBondContact O-N 3.03Å
688	Y	86	Confident	77.9	Confident	44 Å²	44	32.7 Å²	32.7	17%	0.173	19%	0.185	C	C	.	.	H	α-helix	trans	-59.5	-47.1	175.9	179.4	-95.5	0	0	0	111	R602 K606 C684 Q685 F690 Y691 T692	R602-Y688 HydrophobicContact CG-CD2 3.51Å; R602-Y688 HydrophobicContact CG-CE2 3.36Å; R602-Y688 HydrophobicContact CG-CG 4.42Å; K606-Y688 HydrophobicContact CB-CD2 4.05Å; K606-Y688 HydrophobicContact CB-CE2 4.11Å; K606-Y688 HydrophobicContact CD-CD2 4.43Å; K606-Y688 HydrophobicContact CD-CE2 3.76Å; K606-Y688 HydrophobicContact CG-CE2 4.35Å; C684-Y688 WeakPolarHBondContact O-CB 3.34Å; C684-Y688 PolarHBondContact O-N 3.02Å; Q685-Y688 WeakPolarHBondContact O-CB 3.33Å; Q685-Y688 PolarHBondContact O-N 3.45Å; Q685-Y688 VanDerWaalsContact O-N 3.14Å; Y688-F690 PolarHBondContact O-N 2.74Å; Y688-Y691 PolarHBondContact O-N 3.42Å; Y688-T692 WeakPolarHBondContact O-CB 3.21Å; Y688-T692 PolarHBondContact O-N 3.47Å; Y688-T692 PolarHBondContact O-OG1 2.98Å
689	D	82.8	Confident	77.9	Confident	47 Å²	47	33.9 Å²	33.9	25%	0.251	19%	0.188	S	C	.	.	H	α-helix	trans	-65.7	-39.3	178.1	-65.1	-18.3	0	0	0	111.6	Q685 L687 T692 R693	Q685-D689 PolarHBondContact NE2-OD1 3Å; Q685-D689 PolarHBondContact O-N 3.09Å; L687-D689 VanDerWaalsContact C-N 3.34Å; D689-T692 PolarHBondContact O-N 3.49Å; D689-R693 WeakPolarHBondContact O-CG 3.35Å; D689-R693 PolarHBondContact O-N 2.93Å; D689-R693 PolarHBondContact O-NE 3.23Å
690	F	86.1	Confident	77.8	Confident	4 Å²	4	41 Å²	41	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-52.7	173.6	171.8	-99	0	0	0	111.8	A644 K647 D648 L651 Q686 L687 Y688 T692 R693 Q694	A644-F690 HydrophobicContact CB-CD1 3.64Å; A644-F690 HydrophobicContact CB-CE1 3.56Å; A644-F690 HydrophobicContact CB-CG 4.19Å; A644-F690 HydrophobicContact CB-CZ 4.05Å; K647-F690 HydrophobicContact CB-CE2 4.19Å; K647-F690 HydrophobicContact CB-CZ 3.93Å; K647-F690 HydrophobicContact CD-CZ 4.16Å; D648-F690 HydrophobicContact CB-CD2 3.85Å; D648-F690 HydrophobicContact CB-CE2 3.66Å; L651-F690 HydrophobicContact CD1-CB 4.18Å; L651-F690 HydrophobicContact CD1-CD2 3.9Å; L651-F690 HydrophobicContact CD1-CE2 4.48Å; L651-F690 HydrophobicContact CD1-CG 3.96Å; L651-F690 HydrophobicContact CD2-CB 4.27Å; Q686-F690 WeakPolarHBondContact O-CB 3.3Å; Q686-F690 PolarHBondContact O-N 3.12Å; L687-F690 PolarHBondContact O-N 2.93Å; Y688-F690 PolarHBondContact O-N 2.74Å; F690-T692 VanDerWaalsContact C-N 3.27Å; F690-T692 PolarHBondContact O-N 3.07Å; F690-R693 PolarHBondContact O-N 3.4Å; F690-Q694 HydrophobicContact CE1-CG 4.11Å; F690-Q694 HydrophobicContact CE2-CG 4.25Å; F690-Q694 HydrophobicContact CZ-CG 3.95Å; F690-Q694 WeakPolarHBondContact O-CG 3.44Å; F690-Q694 PolarHBondContact O-N 3.22Å
691	Y	86.1	Confident	78	Confident	2 Å²	2	42 Å²	42	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-66.4	-31	-179.7	-66.8	-49.6	0	0	0	112.6	F598 R601 V605 L687 Y688 Q694 L695	F598-Y691 AromaticContact CD1-CD1 3.82Å; F598-Y691 HydrophobicContact CD1-CD1 3.82Å; F598-Y691 HydrophobicContact CD1-CE1 4.24Å; F598-Y691 HydrophobicContact CE1-CD1 4.46Å; R601-Y691 HydrophobicContact CB-CD1 4.35Å; R601-Y691 HydrophobicContact CB-CD2 4.08Å; R601-Y691 HydrophobicContact CB-CE1 4.22Å; R601-Y691 HydrophobicContact CB-CE2 3.93Å; R601-Y691 HydrophobicContact CB-CG 4.29Å; V605-Y691 HydrophobicContact CG2-CD2 4.25Å; V605-Y691 HydrophobicContact CG2-CE2 3.88Å; L687-Y691 HydrophobicContact CB-CE2 4.34Å; L687-Y691 HydrophobicContact CD2-CE2 4.07Å; L687-Y691 WeakPolarHBondContact O-CD2 3.39Å; L687-Y691 PolarHBondContact O-N 3.03Å; Y688-Y691 PolarHBondContact O-N 3.42Å; Y691-Q694 PolarHBondContact O-N 2.95Å; Y691-L695 PolarHBondContact O-N 3.44Å
692	T	82.2	Confident	78.2	Confident	15 Å²	15	44.2 Å²	44.2	9%	0.092	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-41.8	173.8	-58.1	0	0	0	0	111.5	R602 Y688 D689 F690 Q694 L695 D699	R602-T692 VanDerWaalsContact CD-OG1 3.28Å; R602-T692 WeakPolarHBondContact CD-OG1 3.33Å; Y688-T692 WeakPolarHBondContact O-CB 3.21Å; Y688-T692 PolarHBondContact O-N 3.47Å; Y688-T692 PolarHBondContact O-OG1 2.98Å; D689-T692 PolarHBondContact O-N 3.49Å; F690-T692 VanDerWaalsContact C-N 3.27Å; F690-T692 PolarHBondContact O-N 3.07Å; T692-Q694 VanDerWaalsContact C-N 3.25Å; T692-Q694 PolarHBondContact O-N 3.48Å; T692-L695 PolarHBondContact O-N 3.19Å; T692-D699 HydrophobicContact CG2-CB 3.81Å
693	R	81	Confident	78.3	Confident	147 Å²	147	50 Å²	50	56%	0.555	26%	0.259	S	S	*	.	H	α-helix	trans	-63.6	-25.9	173.8	-73.3	-178.5	-72.3	143.9	-2.8	113.8	D648 D689 F690	D648-R693 IonicContact OD2-CZ 2.68Å; D648-R693 IonicContact OD2-NH1 3.48Å; D648-R693 PolarHBondContact OD2-NH1 3Å; D648-R693 IonicContact OD2-NH2 3.75Å; D648-R693 PolarHBondContact OD2-NH2 2.72Å; D689-R693 WeakPolarHBondContact O-CG 3.35Å; D689-R693 PolarHBondContact O-N 2.93Å; D689-R693 PolarHBondContact O-NE 3.23Å; F690-R693 PolarHBondContact O-N 3.4Å
694	Q	81.2	Confident	78.3	Confident	75 Å²	75	55.3 Å²	55.3	35%	0.35	28%	0.279	S	S	.	.	H	α-helix	trans	-82.5	-13.5	-179.4	-65	-63.1	-50.9	0	0	114	F598 F690 Y691 T692	F598-Q694 HydrophobicContact CD1-CB 4.22Å; F598-Q694 HydrophobicContact CD2-CB 4.29Å; F598-Q694 HydrophobicContact CE1-CB 4.48Å; F598-Q694 HydrophobicContact CG-CB 4.15Å; F690-Q694 HydrophobicContact CE1-CG 4.11Å; F690-Q694 HydrophobicContact CE2-CG 4.25Å; F690-Q694 HydrophobicContact CZ-CG 3.95Å; F690-Q694 WeakPolarHBondContact O-CG 3.44Å; F690-Q694 PolarHBondContact O-N 3.22Å; Y691-Q694 PolarHBondContact O-N 2.95Å; T692-Q694 VanDerWaalsContact C-N 3.25Å; T692-Q694 PolarHBondContact O-N 3.48Å
695	L	77.6	Confident	78.4	Confident	21 Å²	21	55.4 Å²	55.4	11%	0.11	28%	0.279	C	S	.	.	S	Bend	trans	-80.5	128.1	177.9	-70.3	165.3	0	0	0	109.9	M595 F598 K599 R602 Y691 T692 G697 G698	M595-L695 WeakPolarHBondContact O-CD2 3.33Å; F598-L695 HydrophobicContact CB-CD2 3.99Å; F598-L695 HydrophobicContact CB-CG 4.41Å; K599-L695 HydrophobicContact CB-CD2 4.07Å; R602-L695 VanDerWaalsContact NH1-CD1 3.3Å; Y691-L695 PolarHBondContact O-N 3.44Å; T692-L695 PolarHBondContact O-N 3.19Å; L695-G697 PolarHBondContact O-N 2.8Å; L695-G697 VanDerWaalsContact O-N 3.11Å; L695-G698 WeakPolarHBondContact O-CA 3.41Å; L695-G698 PolarHBondContact O-N 2.71Å
696	S	58.3	Low	78.4	Confident	97 Å²	97	55.5 Å²	55.5	68%	0.678	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-16.7	-178	-8.4	0	0	0	0	114.6	M595 G698	M595-S696 WeakPolarHBondContact CE-OG 3.37Å; M595-S696 PolarHBondContact SD-OG 2.93Å; S696-G698 VanDerWaalsContact C-N 3.35Å
697	G	58.3	Low	78.2	Confident	54 Å²	54	57.8 Å²	57.8	56%	0.557	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.4	171.4	0	0	0	0	0	114	L695	L695-G697 PolarHBondContact O-N 2.8Å; L695-G697 VanDerWaalsContact O-N 3.11Å
698	G	61.3	Low	77.8	Confident	32 Å²	32	59 Å²	59	33%	0.33	30%	0.299	S	S	.	.			trans	59.5	-159.8	-172.3	0	0	0	0	0	112.9	L695 S696 E700	L695-G698 WeakPolarHBondContact O-CA 3.41Å; L695-G698 PolarHBondContact O-N 2.71Å; S696-G698 VanDerWaalsContact C-N 3.35Å; G698-E700 PolarHBondContact O-N 2.77Å
699	D	67.5	Low	77.5	Confident	62 Å²	62	60.9 Å²	60.9	33%	0.332	31%	0.312	S	S	.	.			trans	-74.7	111	162.5	179.1	8.3	0	0	0	108.1	T692 N701 F702 Y703	T692-D699 HydrophobicContact CG2-CB 3.81Å; D699-N701 PolarHBondContact O-N 3.49Å; D699-N701 VanDerWaalsContact O-N 3.09Å; D699-N701 VanDerWaalsContact OD1-CB 3.25Å; D699-N701 WeakPolarHBondContact OD1-CB 3.16Å; D699-N701 PolarHBondContact OD1-N 3.24Å; D699-F702 HydrophobicContact CB-CB 3.74Å; D699-F702 WeakPolarHBondContact O-CA 3.46Å; D699-F702 VanDerWaalsContact O-CB 3.32Å; D699-F702 WeakPolarHBondContact O-CB 3.1Å; D699-F702 PolarHBondContact O-N 3.27Å; D699-Y703 PolarHBondContact O-N 3.49Å
700	E	74.1	Confident	77.3	Confident	155 Å²	155	63.4 Å²	63.4	72%	0.724	33%	0.329	S	S	*	.	H	α-helix	trans	-50.9	-35.1	177	-73	179.8	-178.4	0	0	111.2	G698 Y703 R704	G698-E700 PolarHBondContact O-N 2.77Å; E700-Y703 PolarHBondContact O-N 3.02Å; E700-R704 VanDerWaalsContact O-CG 3.27Å; E700-R704 WeakPolarHBondContact O-CG 3.41Å; E700-R704 PolarHBondContact O-N 3.39Å
701	N	80.3	Confident	76.8	Confident	25 Å²	25	66.7 Å²	66.7	13%	0.134	35%	0.345	C	S	.	.	H	α-helix	trans	-67.5	-43.8	176.5	-173.7	43.8	0	0	0	111.5	D699 Y703 R704 W705 S727 G728	D699-N701 PolarHBondContact O-N 3.49Å; D699-N701 VanDerWaalsContact O-N 3.09Å; D699-N701 VanDerWaalsContact OD1-CB 3.25Å; D699-N701 WeakPolarHBondContact OD1-CB 3.16Å; D699-N701 PolarHBondContact OD1-N 3.24Å; N701-Y703 VanDerWaalsContact C-N 3.33Å; N701-Y703 PolarHBondContact O-N 3.34Å; N701-R704 PolarHBondContact O-N 2.92Å; N701-W705 VanDerWaalsContact O-CD1 3.24Å; N701-W705 PolarHBondContact O-N 3.39Å; N701-S727 PolarHBondContact ND2-O 2.83Å; N701-S727 WeakPolarHBondContact OD1-CB 3.39Å; N701-S727 PolarHBondContact OD1-OG 3.26Å; N701-G728 PolarHBondContact ND2-O 2.76Å; N701-G728 PolarHBondContact OD1-O 2.96Å
702	F	80.3	Confident	75.4	Confident	74 Å²	74	71.2 Å²	71.2	33%	0.325	38%	0.383	S	S	.	.	H	α-helix	trans	-59.3	-42	172.7	-178.9	-92.2	0	0	0	112.3	D699 W705 T706 P730 Q732 Y733	D699-F702 HydrophobicContact CB-CB 3.74Å; D699-F702 WeakPolarHBondContact O-CA 3.46Å; D699-F702 VanDerWaalsContact O-CB 3.32Å; D699-F702 WeakPolarHBondContact O-CB 3.1Å; D699-F702 PolarHBondContact O-N 3.27Å; F702-W705 PolarHBondContact O-N 2.96Å; F702-T706 WeakPolarHBondContact CE1-OG1 3.39Å; F702-T706 WeakPolarHBondContact O-CB 3.45Å; F702-T706 PolarHBondContact O-N 3.3Å; F702-T706 PolarHBondContact O-OG1 3.17Å; F702-P730 HydrophobicContact CB-CG 4.34Å; F702-P730 HydrophobicContact CD2-CB 3.84Å; F702-P730 HydrophobicContact CD2-CG 4.1Å; F702-Q732 HydrophobicContact CE2-CG 4.5Å; F702-Y733 HydrophobicContact CD2-CD2 4.47Å; F702-Y733 AromaticContact CD2-CE2 3.84Å; F702-Y733 HydrophobicContact CD2-CE2 3.84Å; F702-Y733 HydrophobicContact CE2-CD2 4.3Å; F702-Y733 AromaticContact CE2-CE2 3.48Å; F702-Y733 HydrophobicContact CE2-CE2 3.48Å; F702-Y733 VanDerWaalsContact CE2-CE2 3.48Å; F702-Y733 AromaticContact CE2-CZ 3.92Å; F702-Y733 HydrophobicContact CZ-CE2 4.01Å
703	Y	80.5	Confident	74.4	Confident	145 Å²	145	78.4 Å²	78.4	57%	0.569	42%	0.42	S	S	*	.	H	α-helix	trans	-62.7	-46	175.8	-179.2	-90.9	0	0	0	111.2	D699 E700 N701 W705 T706 E707	D699-Y703 PolarHBondContact O-N 3.49Å; E700-Y703 PolarHBondContact O-N 3.02Å; N701-Y703 VanDerWaalsContact C-N 3.33Å; N701-Y703 PolarHBondContact O-N 3.34Å; Y703-W705 VanDerWaalsContact C-N 3.33Å; Y703-W705 PolarHBondContact O-N 2.99Å; Y703-T706 PolarHBondContact O-N 3.15Å; Y703-T706 VanDerWaalsContact O-N 3.16Å; Y703-E707 HydrophobicContact CE1-CB 4.3Å; Y703-E707 WeakPolarHBondContact CE1-OE2 3.41Å; Y703-E707 WeakPolarHBondContact O-CB 3.21Å; Y703-E707 PolarHBondContact O-N 3.38Å
704	R	82.3	Confident	73.6	Confident	112 Å²	112	78 Å²	78	42%	0.423	42%	0.419	S	S	.	.	H	α-helix	trans	-60	-41.2	177.2	-71.7	177	72.4	-167.6	0.1	112.4	E700 N701 L708 L724	E700-R704 VanDerWaalsContact O-CG 3.27Å; E700-R704 WeakPolarHBondContact O-CG 3.41Å; E700-R704 PolarHBondContact O-N 3.39Å; N701-R704 PolarHBondContact O-N 2.92Å; R704-L708 WeakPolarHBondContact O-CB 3.38Å; R704-L708 PolarHBondContact O-N 3.42Å; R704-L724 HydrophobicContact CB-CD2 3.82Å
705	W	85.4	Confident	72.8	Confident	2 Å²	2	83.2 Å²	83.2	1%	0.008	44%	0.443	C	S	.	.	H	α-helix	trans	-66	-42.6	173.7	-84.8	101.4	0	0	0	112.5	N701 F702 Y703 L708 L709 L721 L724 G728 V729 P730 Y733 V737	N701-W705 VanDerWaalsContact O-CD1 3.24Å; N701-W705 PolarHBondContact O-N 3.39Å; F702-W705 PolarHBondContact O-N 2.96Å; Y703-W705 VanDerWaalsContact C-N 3.33Å; Y703-W705 PolarHBondContact O-N 2.99Å; W705-L708 HydrophobicContact CE3-CD2 4.37Å; W705-L708 HydrophobicContact CZ3-CD2 4.45Å; W705-L708 PolarHBondContact O-N 3.25Å; W705-L709 HydrophobicContact CE3-CD1 4.24Å; W705-L709 HydrophobicContact CE3-CG 4.39Å; W705-L709 WeakPolarHBondContact O-CB 3.4Å; W705-L709 VanDerWaalsContact O-CG 3.28Å; W705-L709 WeakPolarHBondContact O-CG 3.22Å; W705-L709 PolarHBondContact O-N 2.93Å; W705-L721 HydrophobicContact CH2-CD1 3.8Å; W705-L721 HydrophobicContact CZ3-CD1 4.25Å; W705-L724 HydrophobicContact CD2-CD1 4.5Å; W705-L724 HydrophobicContact CH2-CB 4.21Å; W705-L724 HydrophobicContact CZ2-CB 3.58Å; W705-G728 PolarHBondContact NE1-O 2.96Å; W705-V729 HydrophobicContact CH2-CG2 4.06Å; W705-V729 HydrophobicContact CZ2-CB 4.29Å; W705-V729 HydrophobicContact CZ2-CG1 4.35Å; W705-V729 HydrophobicContact CZ2-CG2 3.64Å; W705-P730 HydrophobicContact CB-CG 4.21Å; W705-P730 HydrophobicContact CG-CG 4.05Å; W705-Y733 HydrophobicContact CB-CD2 3.9Å; W705-Y733 HydrophobicContact CB-CE2 4.1Å; W705-V737 HydrophobicContact CE3-CG2 4.12Å; W705-V737 HydrophobicContact CH2-CG1 3.9Å; W705-V737 HydrophobicContact CH2-CG2 3.96Å; W705-V737 HydrophobicContact CZ3-CG1 4.22Å; W705-V737 HydrophobicContact CZ3-CG2 3.49Å; W705-V737 VanDerWaalsContact CZ3-CG2 3.49Å
706	T	83.2	Confident	72.4	Confident	35 Å²	35	85.7 Å²	85.7	22%	0.215	46%	0.456	C	S	.	.	H	α-helix	trans	-64.8	-47.1	179.4	-55.9	0	0	0	0	110.9	F702 Y703 L708 L709 T710 Y733	F702-T706 WeakPolarHBondContact CE1-OG1 3.39Å; F702-T706 WeakPolarHBondContact O-CB 3.45Å; F702-T706 PolarHBondContact O-N 3.3Å; F702-T706 PolarHBondContact O-OG1 3.17Å; Y703-T706 PolarHBondContact O-N 3.15Å; Y703-T706 VanDerWaalsContact O-N 3.16Å; T706-L708 VanDerWaalsContact C-N 3.28Å; T706-L708 PolarHBondContact O-N 3.27Å; T706-L709 PolarHBondContact O-N 2.97Å; T706-T710 HydrophobicContact CG2-CG2 4.23Å; T706-T710 WeakPolarHBondContact O-CB 3.2Å; T706-T710 VanDerWaalsContact O-CG2 3.27Å; T706-T710 WeakPolarHBondContact O-CG2 3.49Å; T706-T710 PolarHBondContact O-N 2.77Å; T706-T710 PolarHBondContact O-OG1 3.24Å; T706-Y733 PolarHBondContact OG1-OH 3.21Å
707	E	82.1	Confident	73.5	Confident	66 Å²	66	84.4 Å²	84.4	31%	0.308	44%	0.444	S	S	.	.	H	α-helix	trans	-56.7	-45.3	175.3	-177.2	-179.2	-175.9	0	0	110.9	Y703 T710 Q711	Y703-E707 HydrophobicContact CE1-CB 4.3Å; Y703-E707 WeakPolarHBondContact CE1-OE2 3.41Å; Y703-E707 WeakPolarHBondContact O-CB 3.21Å; Y703-E707 PolarHBondContact O-N 3.38Å; E707-T710 PolarHBondContact O-OG1 3.42Å; E707-Q711 WeakPolarHBondContact O-CB 3.26Å; E707-Q711 WeakPolarHBondContact O-CG 3.15Å; E707-Q711 PolarHBondContact O-N 3.22Å; E707-Q711 VanDerWaalsContact O-N 3.15Å; E707-Q711 PolarHBondContact OE1-NE2 2.85Å; E707-Q711 VanDerWaalsContact OE1-NE2 3.12Å
708	L	77.4	Confident	74.7	Confident	24 Å²	24	89.5 Å²	89.5	13%	0.126	45%	0.447	C	S	.	.	H	α-helix	trans	-69.4	-38.3	-178.2	-177.5	131.7	0	0	0	113.4	R704 W705 T706 L716 L724	R704-L708 WeakPolarHBondContact O-CB 3.38Å; R704-L708 PolarHBondContact O-N 3.42Å; W705-L708 HydrophobicContact CE3-CD2 4.37Å; W705-L708 HydrophobicContact CZ3-CD2 4.45Å; W705-L708 PolarHBondContact O-N 3.25Å; T706-L708 VanDerWaalsContact C-N 3.28Å; T706-L708 PolarHBondContact O-N 3.27Å; L708-L716 HydrophobicContact CD1-CD1 3.58Å; L708-L716 HydrophobicContact CD1-CG 4.28Å; L708-L716 HydrophobicContact CD2-CD1 3.46Å; L708-L716 VanDerWaalsContact CD2-CD1 3.46Å; L708-L716 HydrophobicContact CD2-CD2 4.08Å; L708-L716 HydrophobicContact CD2-CG 4.29Å; L708-L716 HydrophobicContact CG-CD1 3.44Å; L708-L716 VanDerWaalsContact CG-CD1 3.44Å; L708-L724 HydrophobicContact CB-CD1 4.4Å; L708-L724 HydrophobicContact CD1-CD1 3.37Å; L708-L724 HydrophobicContact CD2-CD1 4.15Å; L708-L724 HydrophobicContact CG-CD1 4.15Å
709	L	78.8	Confident	75.9	Confident	84 Å²	84	90.8 Å²	90.8	44%	0.44	46%	0.455	S	S	.	.	H	α-helix	trans	-80.7	-22.2	179.2	-67.8	173.3	0	0	0	113.4	W705 T706 Y733	W705-L709 HydrophobicContact CE3-CD1 4.24Å; W705-L709 HydrophobicContact CE3-CG 4.39Å; W705-L709 WeakPolarHBondContact O-CB 3.4Å; W705-L709 VanDerWaalsContact O-CG 3.28Å; W705-L709 WeakPolarHBondContact O-CG 3.22Å; W705-L709 PolarHBondContact O-N 2.93Å; T706-L709 PolarHBondContact O-N 2.97Å; L709-Y733 HydrophobicContact CD1-CD1 3.52Å; L709-Y733 HydrophobicContact CD1-CD2 4.1Å; L709-Y733 HydrophobicContact CD1-CE1 4Å; L709-Y733 HydrophobicContact CD1-CG 3.59Å
710	T	79.4	Confident	76.7	Confident	101 Å²	101	90.6 Å²	90.6	62%	0.62	45%	0.453	S	S	*	.	H	α-helix	trans	-89.1	-25	178.7	52	0	0	0	0	113.5	T706 E707 A712	T706-T710 HydrophobicContact CG2-CG2 4.23Å; T706-T710 WeakPolarHBondContact O-CB 3.2Å; T706-T710 VanDerWaalsContact O-CG2 3.27Å; T706-T710 WeakPolarHBondContact O-CG2 3.49Å; T706-T710 PolarHBondContact O-N 2.77Å; T706-T710 PolarHBondContact O-OG1 3.24Å; E707-T710 PolarHBondContact O-OG1 3.42Å; T710-A712 PolarHBondContact O-N 3.3Å
711	Q	75.4	Confident	77.4	Confident	73 Å²	73	84 Å²	84	34%	0.341	42%	0.423	S	S	.	.			trans	-74	89.7	176.5	-75.2	174.5	7.9	0	0	111.2	E707 N713 R714	E707-Q711 WeakPolarHBondContact O-CB 3.26Å; E707-Q711 WeakPolarHBondContact O-CG 3.15Å; E707-Q711 PolarHBondContact O-N 3.22Å; E707-Q711 VanDerWaalsContact O-N 3.15Å; E707-Q711 PolarHBondContact OE1-NE2 2.85Å; E707-Q711 VanDerWaalsContact OE1-NE2 3.12Å; Q711-N713 PolarHBondContact O-N 3Å; Q711-R714 HydrophobicContact CB-CB 4.29Å; Q711-R714 PolarHBondContact O-N 3.03Å; Q711-R714 VanDerWaalsContact OE1-CD 3.29Å
712	A	56.8	Low	77.9	Confident	97 Å²	97	85 Å²	85	80%	0.802	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-20.8	-176.5	0	0	0	0	0	115.7	T710	T710-A712 PolarHBondContact O-N 3.3Å
713	N	61	Low	78.4	Confident	165 Å²	165	84.6 Å²	84.6	88%	0.882	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	7.7	-171.5	-73.1	-9.1	0	0	0	114.8	Q711	Q711-N713 PolarHBondContact O-N 3Å
714	R	64.6	Low	78.8	Confident	138 Å²	138	77.9 Å²	77.9	52%	0.521	40%	0.404	S	S	.	.			trans	-93.8	116.8	-179.7	-161.1	171.4	178.2	-179	-1.6	110.2	Q711 L716	Q711-R714 HydrophobicContact CB-CB 4.29Å; Q711-R714 PolarHBondContact O-N 3.03Å; Q711-R714 VanDerWaalsContact OE1-CD 3.29Å; R714-L716 PolarHBondContact O-N 2.98Å; R714-L716 VanDerWaalsContact O-N 3.16Å
715	E	64	Low	79.2	Confident	185 Å²	185	72.6 Å²	72.6	86%	0.864	38%	0.384	S	S	*	.			trans	-61.3	117.7	170.2	-72.6	-174.9	171.3	0	0	109.3	T717	E715-T717 PolarHBondContact O-N 3.2Å
716	L	69	Low	79.6	Confident	74 Å²	74	74.8 Å²	74.8	39%	0.387	39%	0.393	S	S	.	.			trans	-72.9	109.5	179.1	-135.9	82.1	0	0	0	109.9	L708 R714 L721	L708-L716 HydrophobicContact CD1-CD1 3.58Å; L708-L716 HydrophobicContact CD1-CG 4.28Å; L708-L716 HydrophobicContact CD2-CD1 3.46Å; L708-L716 VanDerWaalsContact CD2-CD1 3.46Å; L708-L716 HydrophobicContact CD2-CD2 4.08Å; L708-L716 HydrophobicContact CD2-CG 4.29Å; L708-L716 HydrophobicContact CG-CD1 3.44Å; L708-L716 VanDerWaalsContact CG-CD1 3.44Å; R714-L716 PolarHBondContact O-N 2.98Å; R714-L716 VanDerWaalsContact O-N 3.16Å; L716-L721 HydrophobicContact CD2-CB 4.13Å; L716-L721 HydrophobicContact CD2-CD1 3.9Å; L716-L721 HydrophobicContact CD2-CD2 4.2Å; L716-L721 HydrophobicContact CD2-CG 4.3Å
717	T	81.1	Confident	79.8	Confident	69 Å²	69	75 Å²	75	42%	0.423	40%	0.396	S	S	.	.			trans	-74.6	144	171.7	79.9	0	0	0	0	109.7	E715 A719 D720 L721	E715-T717 PolarHBondContact O-N 3.2Å; T717-A719 PolarHBondContact O-N 3.45Å; T717-D720 PolarHBondContact O-N 3.18Å; T717-D720 VanDerWaalsContact O-N 3.17Å; T717-D720 PolarHBondContact OG1-N 2.99Å; T717-D720 PolarHBondContact OG1-OD2 2.97Å; T717-L721 PolarHBondContact O-N 2.96Å
718	R	84	Confident	80.3	Confident	161 Å²	161	72 Å²	72	61%	0.608	38%	0.382	S	S	*	.	H	α-helix	trans	-56.9	-34.4	175.4	-175.6	175	-178.2	131.9	7.6	112	L721 E722 L922	R718-L721 PolarHBondContact O-N 3Å; R718-E722 IonicContact NE-OE1 3.13Å; R718-E722 WeakPolarHBondContact O-CG 3.37Å; R718-E722 PolarHBondContact O-N 3.3Å; R718-L922 PolarHBondContact NH2-O 3.46Å; R718-L922 VanDerWaalsContact NH2-O 3.16Å
719	A	85.8	Confident	80.9	Confident	60 Å²	60	71 Å²	71	50%	0.496	38%	0.377	S	S	.	.	H	α-helix	trans	-65.4	-41.6	178.9	0	0	0	0	0	112.3	T717 L721 E722 V723	T717-A719 PolarHBondContact O-N 3.45Å; A719-L721 VanDerWaalsContact C-N 3.33Å; A719-E722 PolarHBondContact O-N 3.47Å; A719-V723 WeakPolarHBondContact O-CG2 3.36Å; A719-V723 PolarHBondContact O-N 3.31Å; A719-V723 VanDerWaalsContact O-N 3.07Å
720	D	85.4	Confident	81.4	Confident	57 Å²	57	67.6 Å²	67.6	31%	0.305	36%	0.36	S	S	.	.	H	α-helix	trans	-63.5	-43	175.8	-65.5	-42	0	0	0	110.7	T717 E722 V723 L724	T717-D720 PolarHBondContact O-N 3.18Å; T717-D720 VanDerWaalsContact O-N 3.17Å; T717-D720 PolarHBondContact OG1-N 2.99Å; T717-D720 PolarHBondContact OG1-OD2 2.97Å; D720-E722 PolarHBondContact O-N 2.97Å; D720-V723 PolarHBondContact O-N 3.47Å; D720-L724 WeakPolarHBondContact O-CG 3.46Å; D720-L724 PolarHBondContact O-N 2.82Å
721	L	87.7	Confident	81.7	Confident	16 Å²	16	66.1 Å²	66.1	8%	0.084	35%	0.348	C	S	.	.	H	α-helix	trans	-65.1	-37.6	178	-170.1	59.7	0	0	0	112.2	W705 L716 T717 R718 A719 L724 C725 M740 L741 L922	W705-L721 HydrophobicContact CH2-CD1 3.8Å; W705-L721 HydrophobicContact CZ3-CD1 4.25Å; L716-L721 HydrophobicContact CD2-CB 4.13Å; L716-L721 HydrophobicContact CD2-CD1 3.9Å; L716-L721 HydrophobicContact CD2-CD2 4.2Å; L716-L721 HydrophobicContact CD2-CG 4.3Å; T717-L721 PolarHBondContact O-N 2.96Å; R718-L721 PolarHBondContact O-N 3Å; A719-L721 VanDerWaalsContact C-N 3.33Å; L721-L724 PolarHBondContact O-N 3.12Å; L721-C725 WeakPolarHBondContact O-CB 3.37Å; L721-C725 PolarHBondContact O-N 3.22Å; L721-C725 PolarHBondContact O-SG 3.27Å; L721-M740 HydrophobicContact CD2-CE 4.35Å; L721-L741 HydrophobicContact CD2-CD2 3.96Å; L721-L922 HydrophobicContact CB-CD2 4.34Å; L721-L922 HydrophobicContact CD2-CD1 3.56Å; L721-L922 HydrophobicContact CD2-CD2 4.46Å; L721-L922 HydrophobicContact CG-CD1 3.94Å; L721-L922 HydrophobicContact CG-CD2 3.91Å
722	E	91.4	Very high	82.1	Confident	46 Å²	46	68.7 Å²	68.7	22%	0.215	36%	0.359	C	S	.	.	H	α-helix	trans	-62.2	-46.1	173.4	-79	179.4	-158.4	0	0	111.8	R718 A719 D720 L724 R726 L922 E923	R718-E722 IonicContact NE-OE1 3.13Å; R718-E722 WeakPolarHBondContact O-CG 3.37Å; R718-E722 PolarHBondContact O-N 3.3Å; A719-E722 PolarHBondContact O-N 3.47Å; D720-E722 PolarHBondContact O-N 2.97Å; E722-L724 VanDerWaalsContact C-N 3.29Å; E722-L724 PolarHBondContact O-N 3.19Å; E722-R726 VanDerWaalsContact O-CB 3.24Å; E722-R726 WeakPolarHBondContact O-CB 3.38Å; E722-R726 WeakPolarHBondContact O-CD 3.24Å; E722-R726 WeakPolarHBondContact O-CG 3.2Å; E722-R726 PolarHBondContact O-N 3.25Å; E722-R726 IonicContact OE2-CZ 3.92Å; E722-R726 IonicContact OE2-NH1 2.7Å; E722-R726 PolarHBondContact OE2-NH1 3.03Å; E722-R726 IonicContact OE2-NH2 3.7Å; E722-R726 PolarHBondContact OE2-NH2 3.02Å; E722-L922 HydrophobicContact CB-CD2 4.26Å; E722-L922 HydrophobicContact CG-CD2 3.81Å; E722-L922 HydrophobicContact CG-CG 4.49Å; E722-E923 HydrophobicContact CG-CG 4.19Å
723	V	90.3	Very high	83.7	Confident	67 Å²	67	66.7 Å²	66.7	41%	0.406	33%	0.332	S	S	.	.	H	α-helix	trans	-61.3	-42	177.6	172.8	0	0	0	0	110.6	A719 D720 S727	A719-V723 WeakPolarHBondContact O-CG2 3.36Å; A719-V723 PolarHBondContact O-N 3.31Å; A719-V723 VanDerWaalsContact O-N 3.07Å; D720-V723 PolarHBondContact O-N 3.47Å; V723-S727 PolarHBondContact O-N 3.19Å; V723-S727 PolarHBondContact O-OG 2.7Å
724	L	89.5	Confident	85.3	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-72.8	-39.1	-179.1	-71.8	176.9	0	0	0	113.8	R704 W705 L708 D720 L721 E722 R726 S727 G728	R704-L724 HydrophobicContact CB-CD2 3.82Å; W705-L724 HydrophobicContact CD2-CD1 4.5Å; W705-L724 HydrophobicContact CH2-CB 4.21Å; W705-L724 HydrophobicContact CZ2-CB 3.58Å; L708-L724 HydrophobicContact CB-CD1 4.4Å; L708-L724 HydrophobicContact CD1-CD1 3.37Å; L708-L724 HydrophobicContact CD2-CD1 4.15Å; L708-L724 HydrophobicContact CG-CD1 4.15Å; D720-L724 WeakPolarHBondContact O-CG 3.46Å; D720-L724 PolarHBondContact O-N 2.82Å; L721-L724 PolarHBondContact O-N 3.12Å; E722-L724 VanDerWaalsContact C-N 3.29Å; E722-L724 PolarHBondContact O-N 3.19Å; L724-R726 VanDerWaalsContact C-N 3.31Å; L724-S727 WeakPolarHBondContact CA-OG 3.28Å; L724-S727 PolarHBondContact O-N 2.76Å; L724-S727 PolarHBondContact O-OG 3.31Å; L724-G728 CarbonylContact O-C 3.44Å; L724-G728 PolarHBondContact O-N 2.88Å
725	C	91.3	Very high	86.7	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-68.9	-34.7	175.3	-66.3	0	0	0	0	110.9	L721 G728 R915 L922	L721-C725 WeakPolarHBondContact O-CB 3.37Å; L721-C725 PolarHBondContact O-N 3.22Å; L721-C725 PolarHBondContact O-SG 3.27Å; C725-G728 WeakPolarHBondContact O-CA 3.47Å; C725-G728 PolarHBondContact O-N 3.08Å; C725-R915 PolarHBondContact O-NH1 3.45Å; C725-L922 HydrophobicContact CB-CD2 3.93Å
726	R	93.2	Very high	88	Confident	49 Å²	49	50.4 Å²	50.4	19%	0.185	27%	0.268	C	S	.	.	H	α-helix	trans	-70.2	-28.2	172.9	-69.1	171.8	-169.7	150.9	4.3	113	E722 L724 R915 V919 E923 I970	E722-R726 VanDerWaalsContact O-CB 3.24Å; E722-R726 WeakPolarHBondContact O-CB 3.38Å; E722-R726 WeakPolarHBondContact O-CD 3.24Å; E722-R726 WeakPolarHBondContact O-CG 3.2Å; E722-R726 PolarHBondContact O-N 3.25Å; E722-R726 IonicContact OE2-CZ 3.92Å; E722-R726 IonicContact OE2-NH1 2.7Å; E722-R726 PolarHBondContact OE2-NH1 3.03Å; E722-R726 IonicContact OE2-NH2 3.7Å; E722-R726 PolarHBondContact OE2-NH2 3.02Å; L724-R726 VanDerWaalsContact C-N 3.31Å; R726-R915 PolarHBondContact O-NH2 2.81Å; R726-V919 HydrophobicContact CG-CG1 4.39Å; R726-V919 HydrophobicContact CG-CG2 4.07Å; R726-E923 IonicContact CZ-OE1 2.85Å; R726-E923 IonicContact CZ-OE2 3.16Å; R726-E923 IonicContact NE-OE1 3.48Å; R726-E923 PolarHBondContact NE-OE1 3.28Å; R726-E923 IonicContact NE-OE2 3.31Å; R726-E923 IonicContact NH2-OE1 3.29Å; R726-E923 PolarHBondContact NH2-OE1 2.88Å; R726-E923 IonicContact NH2-OE2 3.1Å; R726-E923 PolarHBondContact NH2-OE2 2.95Å; R726-I970 HydrophobicContact CB-CG2 4.17Å; R726-I970 WeakPolarHBondContact O-CD1 3.43Å
727	S	88.6	Confident	89.1	Confident	40 Å²	40	47.1 Å²	47.1	28%	0.28	25%	0.251	S	S	.	.	H	α-helix	trans	-81.6	-25.7	168.5	59.2	0	0	0	0	113.1	N701 V723 L724 R915	N701-S727 PolarHBondContact ND2-O 2.83Å; N701-S727 WeakPolarHBondContact OD1-CB 3.39Å; N701-S727 PolarHBondContact OD1-OG 3.26Å; V723-S727 PolarHBondContact O-N 3.19Å; V723-S727 PolarHBondContact O-OG 2.7Å; L724-S727 WeakPolarHBondContact CA-OG 3.28Å; L724-S727 PolarHBondContact O-N 2.76Å; L724-S727 PolarHBondContact O-OG 3.31Å; S727-R915 PolarHBondContact O-NH2 3.35Å
728	G	90.8	Very high	89.9	Confident	2 Å²	2	43.8 Å²	43.8	2%	0.021	23%	0.231	C	C	.	.			trans	117.4	148.1	165.5	0	0	0	0	0	115.1	N701 W705 L724 C725 P730 R915	N701-G728 PolarHBondContact ND2-O 2.76Å; N701-G728 PolarHBondContact OD1-O 2.96Å; W705-G728 PolarHBondContact NE1-O 2.96Å; L724-G728 CarbonylContact O-C 3.44Å; L724-G728 PolarHBondContact O-N 2.88Å; C725-G728 WeakPolarHBondContact O-CA 3.47Å; C725-G728 PolarHBondContact O-N 3.08Å; G728-P730 WeakPolarHBondContact O-CD 3.13Å; G728-R915 VanDerWaalsContact CA-NH2 3.33Å; G728-R915 VanDerWaalsContact N-NH2 3.18Å
729	V	91.2	Very high	90.4	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.018	22%	0.219	C	C	.	.			trans	-87.6	120.4	-179.5	-171.9	0	0	0	0	107.9	W705 R734 V737 D918	W705-V729 HydrophobicContact CH2-CG2 4.06Å; W705-V729 HydrophobicContact CZ2-CB 4.29Å; W705-V729 HydrophobicContact CZ2-CG1 4.35Å; W705-V729 HydrophobicContact CZ2-CG2 3.64Å; V729-R734 HydrophobicContact CG1-CB 4.06Å; V729-R734 HydrophobicContact CG1-CG 4.37Å; V729-R734 PolarHBondContact O-NE 3.45Å; V729-R734 PolarHBondContact O-NH2 2.92Å; V729-V737 HydrophobicContact CG1-CB 3.94Å; V729-V737 HydrophobicContact CG1-CG1 4.22Å; V729-V737 HydrophobicContact CG1-CG2 3.92Å; V729-V737 HydrophobicContact CG2-CG1 4.07Å; V729-D918 HydrophobicContact CG2-CB 3.93Å; V729-D918 VanDerWaalsContact CG2-CG 3.48Å; V729-D918 WeakPolarHBondContact CG2-OD1 3.44Å; V729-D918 PolarHBondContact N-OD2 3.05Å
730	P	89.1	Confident	90.7	Very high	12 Å²	12	42.2 Å²	42.2	8%	0.078	22%	0.217	C	C	.	.			trans	-60	147.7	173.5	-22.4	32.4	0	0	0	111.2	F702 W705 G728 Q732 Y733 R734	F702-P730 HydrophobicContact CB-CG 4.34Å; F702-P730 HydrophobicContact CD2-CB 3.84Å; F702-P730 HydrophobicContact CD2-CG 4.1Å; W705-P730 HydrophobicContact CB-CG 4.21Å; W705-P730 HydrophobicContact CG-CG 4.05Å; G728-P730 WeakPolarHBondContact O-CD 3.13Å; P730-Q732 VanDerWaalsContact C-N 3.25Å; P730-Q732 PolarHBondContact O-N 3.1Å; P730-Y733 HydrophobicContact CB-CD2 4.09Å; P730-Y733 HydrophobicContact CG-CD2 4.12Å; P730-Y733 PolarHBondContact O-N 3.09Å; P730-R734 PolarHBondContact O-N 2.98Å
731	I	84.7	Confident	91.2	Very high	71 Å²	71	40.5 Å²	40.5	36%	0.364	21%	0.207	S	C	.	.	H	α-helix	trans	-58.3	-35.7	-172.2	-167	163.5	0	0	0	113.4	Y667 Y733 R734	Y667-I731 HydrophobicContact CD1-CD1 4.07Å; Y667-I731 HydrophobicContact CE1-CD1 3.5Å; Y667-I731 VanDerWaalsContact CE1-CD1 3.5Å; Y667-I731 HydrophobicContact CE1-CG1 4.42Å; I731-Y733 PolarHBondContact O-N 2.92Å; I731-R734 PolarHBondContact O-N 2.88Å
732	Q	85.7	Confident	91.5	Very high	126 Å²	126	39.7 Å²	39.7	59%	0.589	20%	0.203	S	C	*	.	H	α-helix	trans	-66.2	-28	-179.4	-54.7	85.1	-7.8	0	0	112.6	F702 P730	F702-Q732 HydrophobicContact CE2-CG 4.5Å; P730-Q732 VanDerWaalsContact C-N 3.25Å; P730-Q732 PolarHBondContact O-N 3.1Å
733	Y	90.1	Very high	91.7	Very high	55 Å²	55	39.7 Å²	39.7	22%	0.216	20%	0.203	C	C	.	.	H	α-helix	trans	-101.2	-11.9	-179.3	-56.8	-51.8	0	0	0	112.4	F702 W705 T706 L709 P730 I731 E735 G736 V737	F702-Y733 HydrophobicContact CD2-CD2 4.47Å; F702-Y733 AromaticContact CD2-CE2 3.84Å; F702-Y733 HydrophobicContact CD2-CE2 3.84Å; F702-Y733 HydrophobicContact CE2-CD2 4.3Å; F702-Y733 AromaticContact CE2-CE2 3.48Å; F702-Y733 HydrophobicContact CE2-CE2 3.48Å; F702-Y733 VanDerWaalsContact CE2-CE2 3.48Å; F702-Y733 AromaticContact CE2-CZ 3.92Å; F702-Y733 HydrophobicContact CZ-CE2 4.01Å; W705-Y733 HydrophobicContact CB-CD2 3.9Å; W705-Y733 HydrophobicContact CB-CE2 4.1Å; T706-Y733 PolarHBondContact OG1-OH 3.21Å; L709-Y733 HydrophobicContact CD1-CD1 3.52Å; L709-Y733 HydrophobicContact CD1-CD2 4.1Å; L709-Y733 HydrophobicContact CD1-CE1 4Å; L709-Y733 HydrophobicContact CD1-CG 3.59Å; P730-Y733 HydrophobicContact CB-CD2 4.09Å; P730-Y733 HydrophobicContact CG-CD2 4.12Å; P730-Y733 PolarHBondContact O-N 3.09Å; I731-Y733 PolarHBondContact O-N 2.92Å; Y733-E735 PolarHBondContact O-N 3.46Å; Y733-G736 PolarHBondContact O-N 3.49Å; Y733-G736 VanDerWaalsContact O-N 3.15Å; Y733-V737 WeakPolarHBondContact O-CB 3.28Å; Y733-V737 VanDerWaalsContact O-CG2 3.3Å; Y733-V737 WeakPolarHBondContact O-CG2 3.38Å; Y733-V737 PolarHBondContact O-N 3.02Å
734	R	93.7	Very high	91.7	Very high	11 Å²	11	39 Å²	39	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-60.9	-45.3	-172.2	-166	174.7	-65.6	127.1	-0.7	113.3	V729 P730 I731 G736 V737 W738 F833 D918	V729-R734 HydrophobicContact CG1-CB 4.06Å; V729-R734 HydrophobicContact CG1-CG 4.37Å; V729-R734 PolarHBondContact O-NE 3.45Å; V729-R734 PolarHBondContact O-NH2 2.92Å; P730-R734 PolarHBondContact O-N 2.98Å; I731-R734 PolarHBondContact O-N 2.88Å; R734-G736 VanDerWaalsContact C-N 3.33Å; R734-G736 PolarHBondContact O-N 3.22Å; R734-V737 PolarHBondContact O-N 2.7Å; R734-W738 HydrophobicContact CG-CD2 3.94Å; R734-W738 HydrophobicContact CG-CG 4.09Å; R734-W738 HydrophobicContact CG-CZ2 4.05Å; R734-W738 VanDerWaalsContact O-CB 3.28Å; R734-W738 WeakPolarHBondContact O-CB 3.06Å; R734-W738 PolarHBondContact O-N 3.27Å; R734-F833 HydrophobicContact CG-CD1 4.4Å; R734-D918 IonicContact NE-OD1 3.44Å
735	E	93.9	Very high	91.9	Very high	90 Å²	90	43.7 Å²	43.7	42%	0.421	23%	0.232	S	C	.	.	H	α-helix	trans	-54.4	-51	174.2	175.5	173.8	-174.8	0	0	110.8	Y733 R739 F833 L834	Y733-E735 PolarHBondContact O-N 3.46Å; E735-R739 WeakPolarHBondContact O-CB 3.43Å; E735-R739 PolarHBondContact O-N 3.24Å; E735-F833 VanDerWaalsContact CB-O 3.22Å; E735-F833 WeakPolarHBondContact CB-O 3.35Å; E735-F833 WeakPolarHBondContact CG-O 3.39Å; E735-L834 HydrophobicContact CG-CD2 4.39Å
736	G	92.2	Very high	92	Very high	46 Å²	46	43.8 Å²	43.8	47%	0.474	23%	0.232	S	C	.	.	H	α-helix	trans	-65.1	-45.1	-178.4	0	0	0	0	0	113.2	Y733 R734 M740	Y733-G736 PolarHBondContact O-N 3.49Å; Y733-G736 VanDerWaalsContact O-N 3.15Å; R734-G736 VanDerWaalsContact C-N 3.33Å; R734-G736 PolarHBondContact O-N 3.22Å; G736-M740 VanDerWaalsContact O-CB 3.31Å; G736-M740 WeakPolarHBondContact O-CB 3.45Å; G736-M740 PolarHBondContact O-N 3.19Å
737	V	92.6	Very high	91.9	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-67.7	-48.9	-179.1	172	0	0	0	0	111	W705 V729 Y733 R734 R739 M740 L741	W705-V737 HydrophobicContact CE3-CG2 4.12Å; W705-V737 HydrophobicContact CH2-CG1 3.9Å; W705-V737 HydrophobicContact CH2-CG2 3.96Å; W705-V737 HydrophobicContact CZ3-CG1 4.22Å; W705-V737 HydrophobicContact CZ3-CG2 3.49Å; W705-V737 VanDerWaalsContact CZ3-CG2 3.49Å; V729-V737 HydrophobicContact CG1-CB 3.94Å; V729-V737 HydrophobicContact CG1-CG1 4.22Å; V729-V737 HydrophobicContact CG1-CG2 3.92Å; V729-V737 HydrophobicContact CG2-CG1 4.07Å; Y733-V737 WeakPolarHBondContact O-CB 3.28Å; Y733-V737 VanDerWaalsContact O-CG2 3.3Å; Y733-V737 WeakPolarHBondContact O-CG2 3.38Å; Y733-V737 PolarHBondContact O-N 3.02Å; R734-V737 PolarHBondContact O-N 2.7Å; V737-R739 VanDerWaalsContact C-N 3.32Å; V737-R739 PolarHBondContact O-N 2.96Å; V737-M740 WeakPolarHBondContact O-CB 3.49Å; V737-M740 PolarHBondContact O-N 2.97Å; V737-L741 HydrophobicContact CG1-CD1 4.1Å; V737-L741 HydrophobicContact CG1-CG 4.42Å; V737-L741 VanDerWaalsContact O-CG 3.31Å; V737-L741 WeakPolarHBondContact O-CG 3.47Å; V737-L741 PolarHBondContact O-N 3.42Å
738	W	96.4	Very high	92.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-44.8	178.1	-74.9	16.7	0	0	0	110.8	R734 M740 L741 I742 V829 F833 L834 W917 D918 L921	R734-W738 HydrophobicContact CG-CD2 3.94Å; R734-W738 HydrophobicContact CG-CG 4.09Å; R734-W738 HydrophobicContact CG-CZ2 4.05Å; R734-W738 VanDerWaalsContact O-CB 3.28Å; R734-W738 WeakPolarHBondContact O-CB 3.06Å; R734-W738 PolarHBondContact O-N 3.27Å; W738-M740 VanDerWaalsContact C-N 3.33Å; W738-M740 PolarHBondContact O-N 3.43Å; W738-L741 PolarHBondContact O-N 3.04Å; W738-I742 HydrophobicContact CB-CD1 4.44Å; W738-I742 WeakPolarHBondContact O-CB 3.25Å; W738-I742 VanDerWaalsContact O-CD1 3.24Å; W738-I742 WeakPolarHBondContact O-CD1 3.37Å; W738-I742 VanDerWaalsContact O-CG1 3.23Å; W738-I742 WeakPolarHBondContact O-CG1 3.49Å; W738-I742 PolarHBondContact O-N 3.1Å; W738-V829 HydrophobicContact CH2-CG1 4.43Å; W738-F833 HydrophobicContact CE3-CB 4.06Å; W738-F833 HydrophobicContact CE3-CD2 4.24Å; W738-F833 HydrophobicContact CE3-CG 4.4Å; W738-F833 AromaticContact CH2-CD2 3.64Å; W738-F833 HydrophobicContact CH2-CD2 3.64Å; W738-F833 AromaticContact CH2-CE2 3.95Å; W738-F833 HydrophobicContact CH2-CE2 3.95Å; W738-F833 HydrophobicContact CH2-CG 4.37Å; W738-F833 HydrophobicContact CZ3-CB 4.08Å; W738-F833 AromaticContact CZ3-CD2 3.43Å; W738-F833 HydrophobicContact CZ3-CD2 3.43Å; W738-F833 VanDerWaalsContact CZ3-CD2 3.43Å; W738-F833 HydrophobicContact CZ3-CE2 4.19Å; W738-F833 HydrophobicContact CZ3-CG 4.01Å; W738-L834 HydrophobicContact CB-CD2 4.16Å; W738-W917 HydrophobicContact CE3-CE3 4.38Å; W738-W917 HydrophobicContact CH2-CB 3.77Å; W738-W917 HydrophobicContact CH2-CD2 4.12Å; W738-W917 AromaticContact CH2-CE3 3.63Å; W738-W917 HydrophobicContact CH2-CE3 3.63Å; W738-W917 HydrophobicContact CH2-CG 4.23Å; W738-W917 HydrophobicContact CZ2-CB 3.57Å; W738-W917 HydrophobicContact CZ2-CE3 4.38Å; W738-W917 HydrophobicContact CZ2-CG 4.49Å; W738-W917 AromaticContact CZ3-CE3 3.62Å; W738-W917 HydrophobicContact CZ3-CE3 3.62Å; W738-W917 HydrophobicContact CZ3-CZ3 4.14Å; W738-D918 PolarHBondContact NE1-OD1 3.07Å; W738-L921 HydrophobicContact CB-CD1 4.01Å; W738-L921 HydrophobicContact CD2-CD1 3.47Å; W738-L921 VanDerWaalsContact CD2-CD1 3.47Å; W738-L921 HydrophobicContact CE3-CD1 3.94Å; W738-L921 HydrophobicContact CG-CD1 3.5Å; W738-L921 HydrophobicContact CZ2-CD1 4.46Å
739	R	95.3	Very high	92.2	Very high	98 Å²	98	52.7 Å²	52.7	37%	0.37	27%	0.271	S	S	.	.	H	α-helix	trans	-57.7	-46.1	174.9	-173.8	178	-178.6	-135.8	-9.9	111.6	E735 V737 L741 I742 H743 L834 R835 D838	E735-R739 WeakPolarHBondContact O-CB 3.43Å; E735-R739 PolarHBondContact O-N 3.24Å; V737-R739 VanDerWaalsContact C-N 3.32Å; V737-R739 PolarHBondContact O-N 2.96Å; R739-L741 PolarHBondContact O-N 2.95Å; R739-I742 PolarHBondContact O-N 3.47Å; R739-H743 VanDerWaalsContact O-CB 3.24Å; R739-H743 WeakPolarHBondContact O-CB 3.45Å; R739-H743 PolarHBondContact O-CD2 3.4Å; R739-H743 PolarHBondContact O-N 3.06Å; R739-L834 HydrophobicContact CB-CD2 4.19Å; R739-R835 VanDerWaalsContact CZ-NH2 3.29Å; R739-D838 IonicContact CZ-OD1 3.77Å; R739-D838 IonicContact NE-OD1 2.81Å; R739-D838 PolarHBondContact NE-OD1 3.07Å; R739-D838 IonicContact NE-OD2 3.93Å; R739-D838 PolarHBondContact NE-OD2 2.83Å
740	M	92.7	Very high	92.3	Very high	89 Å²	89	54.2 Å²	54.2	44%	0.438	28%	0.279	S	S	.	.	H	α-helix	trans	-58.6	-46.8	176.6	179.5	-167.3	74.3	0	0	112	L721 G736 V737 W738 G744	L721-M740 HydrophobicContact CD2-CE 4.35Å; G736-M740 VanDerWaalsContact O-CB 3.31Å; G736-M740 WeakPolarHBondContact O-CB 3.45Å; G736-M740 PolarHBondContact O-N 3.19Å; V737-M740 WeakPolarHBondContact O-CB 3.49Å; V737-M740 PolarHBondContact O-N 2.97Å; W738-M740 VanDerWaalsContact C-N 3.33Å; W738-M740 PolarHBondContact O-N 3.43Å; M740-G744 PolarHBondContact O-N 3.44Å
741	L	94.1	Very high	92.4	Very high	21 Å²	21	60.1 Å²	60.1	11%	0.11	31%	0.305	C	S	.	.	H	α-helix	trans	-62.1	-47.6	179.8	-68.1	173.8	0	0	0	111.7	L721 V737 W738 R739 G744 E745 L921 L922	L721-L741 HydrophobicContact CD2-CD2 3.96Å; V737-L741 HydrophobicContact CG1-CD1 4.1Å; V737-L741 HydrophobicContact CG1-CG 4.42Å; V737-L741 VanDerWaalsContact O-CG 3.31Å; V737-L741 WeakPolarHBondContact O-CG 3.47Å; V737-L741 PolarHBondContact O-N 3.42Å; W738-L741 PolarHBondContact O-N 3.04Å; R739-L741 PolarHBondContact O-N 2.95Å; L741-G744 PolarHBondContact O-N 3.3Å; L741-E745 PolarHBondContact O-N 3.05Å; L741-L921 HydrophobicContact CD1-CB 3.97Å; L741-L922 HydrophobicContact CD1-CB 4.31Å; L741-L922 HydrophobicContact CD2-CB 4.41Å; L741-L922 HydrophobicContact CD2-CD1 3.76Å
742	I	95.4	Very high	92.8	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-67	-46.9	-178.6	-66.9	157.5	0	0	0	111.1	W738 R739 G744 E745 L746 L834 W841 C842 A845 L921	W738-I742 HydrophobicContact CB-CD1 4.44Å; W738-I742 WeakPolarHBondContact O-CB 3.25Å; W738-I742 VanDerWaalsContact O-CD1 3.24Å; W738-I742 WeakPolarHBondContact O-CD1 3.37Å; W738-I742 VanDerWaalsContact O-CG1 3.23Å; W738-I742 WeakPolarHBondContact O-CG1 3.49Å; W738-I742 PolarHBondContact O-N 3.1Å; R739-I742 PolarHBondContact O-N 3.47Å; I742-G744 VanDerWaalsContact C-N 3.3Å; I742-G744 PolarHBondContact O-N 2.9Å; I742-E745 PolarHBondContact O-N 3.43Å; I742-L746 HydrophobicContact CG2-CD1 4.19Å; I742-L746 WeakPolarHBondContact O-CB 3.41Å; I742-L746 PolarHBondContact O-N 3.48Å; I742-L834 HydrophobicContact CD1-CD1 3.7Å; I742-W841 HydrophobicContact CG2-CB 4.16Å; I742-C842 HydrophobicContact CD1-CB 3.56Å; I742-C842 WeakPolarHBondContact CD1-SG 3.45Å; I742-C842 HydrophobicContact CG1-CB 4.45Å; I742-A845 HydrophobicContact CG2-CB 3.99Å; I742-L921 HydrophobicContact CG1-CD2 4.34Å
743	H	94.4	Very high	93.1	Very high	45 Å²	45	61.3 Å²	61.3	21%	0.208	31%	0.311	C	S	.	.	H	α-helix	trans	-67.1	-34.4	178.9	-77.4	-131.6	0	0	0	111.3	R739 L746 H747 M750 D838	R739-H743 VanDerWaalsContact O-CB 3.24Å; R739-H743 WeakPolarHBondContact O-CB 3.45Å; R739-H743 PolarHBondContact O-CD2 3.4Å; R739-H743 PolarHBondContact O-N 3.06Å; H743-L746 CarbonylContact O-C 3.56Å; H743-L746 PolarHBondContact O-N 2.9Å; H743-H747 VanDerWaalsContact O-CA 3.23Å; H743-H747 WeakPolarHBondContact O-CA 3.27Å; H743-H747 WeakPolarHBondContact O-CB 3.46Å; H743-H747 PolarHBondContact O-N 3.02Å; H743-M750 HydrophobicContact CB-SD 4.33Å; H743-M750 WeakPolarHBondContact CE1-CE 3.47Å; H743-M750 WeakPolarHBondContact ND1-CE 3.39Å; H743-D838 IonicContact CD2-OD1 2.8Å; H743-D838 IonicContact CE1-OD1 3.15Å; H743-D838 PolarHBondContact CE1-OD1 3.4Å; H743-D838 VanDerWaalsContact CE1-OD1 3.31Å; H743-D838 IonicContact NE2-OD1 3.37Å; H743-D838 PolarHBondContact NE2-OD1 3.37Å
744	G	91.6	Very high	93	Very high	54 Å²	54	59.8 Å²	59.8	56%	0.557	31%	0.312	S	S	*	.	H	α-helix	trans	-60.3	-48	172.6	0	0	0	0	0	111.9	M740 L741 I742 L746	M740-G744 PolarHBondContact O-N 3.44Å; L741-G744 PolarHBondContact O-N 3.3Å; I742-G744 VanDerWaalsContact C-N 3.3Å; I742-G744 PolarHBondContact O-N 2.9Å; G744-L746 PolarHBondContact O-N 3.35Å
745	E	92.5	Very high	92.7	Very high	102 Å²	102	64.6 Å²	64.6	48%	0.477	34%	0.344	S	S	.	.	H	α-helix	trans	-67.7	-34.4	178.8	-167.7	63.3	-159.3	0	0	112.6	L741 I742 R849 F850	L741-E745 PolarHBondContact O-N 3.05Å; I742-E745 PolarHBondContact O-N 3.43Å; E745-R849 HydrophobicContact CG-CB 3.91Å; E745-R849 HydrophobicContact CG-CG 4.17Å; E745-F850 HydrophobicContact CB-CE1 4.45Å; E745-F850 HydrophobicContact CB-CZ 4.43Å; E745-F850 HydrophobicContact CG-CE1 3.82Å; E745-F850 HydrophobicContact CG-CZ 4.22Å
746	L	94.3	Very high	92.5	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-99.6	5.9	-177	-65.6	-177	0	0	0	114.9	I742 H743 G744 Q748 L749 M750 W841 I844 A845 R849	I742-L746 HydrophobicContact CG2-CD1 4.19Å; I742-L746 WeakPolarHBondContact O-CB 3.41Å; I742-L746 PolarHBondContact O-N 3.48Å; H743-L746 CarbonylContact O-C 3.56Å; H743-L746 PolarHBondContact O-N 2.9Å; G744-L746 PolarHBondContact O-N 3.35Å; L746-Q748 VanDerWaalsContact C-N 3.3Å; L746-Q748 PolarHBondContact O-N 3.39Å; L746-Q748 VanDerWaalsContact O-N 3.13Å; L746-L749 HydrophobicContact CD2-CD2 4.07Å; L746-L749 WeakPolarHBondContact O-CA 3.48Å; L746-L749 WeakPolarHBondContact O-CB 3.48Å; L746-L749 PolarHBondContact O-N 3.21Å; L746-M750 HydrophobicContact CB-CG 4.04Å; L746-M750 HydrophobicContact CB-SD 4.05Å; L746-M750 WeakPolarHBondContact O-CG 3.43Å; L746-M750 PolarHBondContact O-N 2.87Å; L746-W841 HydrophobicContact CD1-CB 4.15Å; L746-W841 HydrophobicContact CD1-CE3 4.01Å; L746-W841 WeakPolarHBondContact CD1-O 3.1Å; L746-I844 HydrophobicContact CD1-CB 4.18Å; L746-I844 HydrophobicContact CD1-CG2 4.06Å; L746-I844 HydrophobicContact CD2-CG2 4.15Å; L746-A845 HydrophobicContact CD1-CB 3.78Å; L746-A845 HydrophobicContact CD2-CB 4.39Å; L746-A845 HydrophobicContact CG-CB 3.97Å; L746-R849 HydrophobicContact CD2-CG 3.56Å
747	H	91.8	Very high	92.6	Very high	103 Å²	103	66.3 Å²	66.3	48%	0.477	34%	0.342	S	S	.	.	H	α-helix	trans	-50.1	-48	-170.8	177.8	-96.6	0	0	0	113	H743 L749 M750 Q751	H743-H747 VanDerWaalsContact O-CA 3.23Å; H743-H747 WeakPolarHBondContact O-CA 3.27Å; H743-H747 WeakPolarHBondContact O-CB 3.46Å; H743-H747 PolarHBondContact O-N 3.02Å; H747-L749 PolarHBondContact O-N 2.79Å; H747-M750 PolarHBondContact O-N 3.46Å; H747-Q751 VanDerWaalsContact CE1-CD 3.48Å; H747-Q751 PolarHBondContact CE1-NE2 2.92Å; H747-Q751 PolarHBondContact NE2-NE2 2.81Å; H747-Q751 VanDerWaalsContact NE2-NE2 3.17Å; H747-Q751 WeakPolarHBondContact O-CG 3.27Å; H747-Q751 PolarHBondContact O-N 2.96Å
748	Q	91.9	Very high	92.7	Very high	149 Å²	149	66.1 Å²	66.1	70%	0.696	34%	0.341	S	S	*	.	H	α-helix	trans	-63.9	-42.1	178.5	-64.6	179.5	4.9	0	0	112.4	L746 Q751 I752	L746-Q748 VanDerWaalsContact C-N 3.3Å; L746-Q748 PolarHBondContact O-N 3.39Å; L746-Q748 VanDerWaalsContact O-N 3.13Å; Q748-Q751 PolarHBondContact O-N 3.43Å; Q748-I752 WeakPolarHBondContact O-CD1 3.3Å; Q748-I752 VanDerWaalsContact O-CG1 3.25Å; Q748-I752 WeakPolarHBondContact O-CG1 3.49Å; Q748-I752 PolarHBondContact O-N 3.16Å; Q748-I752 VanDerWaalsContact O-N 3.13Å
749	L	92.6	Very high	92.4	Very high	26 Å²	26	69.3 Å²	69.3	14%	0.136	36%	0.358	C	S	.	.	H	α-helix	trans	-66.7	-42.6	-179.8	-176.8	65.4	0	0	0	111.1	L746 H747 Q751 I752 K753 W841 I844	L746-L749 HydrophobicContact CD2-CD2 4.07Å; L746-L749 WeakPolarHBondContact O-CA 3.48Å; L746-L749 WeakPolarHBondContact O-CB 3.48Å; L746-L749 PolarHBondContact O-N 3.21Å; H747-L749 PolarHBondContact O-N 2.79Å; L749-Q751 VanDerWaalsContact C-N 3.34Å; L749-Q751 PolarHBondContact O-N 3.18Å; L749-I752 PolarHBondContact O-N 2.84Å; L749-K753 HydrophobicContact CD1-CG 4.24Å; L749-K753 HydrophobicContact CG-CG 4.45Å; L749-K753 WeakPolarHBondContact O-CB 3.23Å; L749-K753 WeakPolarHBondContact O-CG 3.26Å; L749-K753 PolarHBondContact O-N 3.39Å; L749-W841 HydrophobicContact CD2-CZ3 4.3Å; L749-W841 HydrophobicContact CG-CZ3 4.42Å; L749-I844 HydrophobicContact CD2-CG2 3.86Å
750	M	92.8	Very high	92.1	Very high	35 Å²	35	66.2 Å²	66.2	17%	0.172	36%	0.357	C	S	.	.	H	α-helix	trans	-64.7	-38.7	179.1	-65.8	178.2	72.7	0	0	111.5	H743 L746 H747 K753 G754 W841	H743-M750 HydrophobicContact CB-SD 4.33Å; H743-M750 WeakPolarHBondContact CE1-CE 3.47Å; H743-M750 WeakPolarHBondContact ND1-CE 3.39Å; L746-M750 HydrophobicContact CB-CG 4.04Å; L746-M750 HydrophobicContact CB-SD 4.05Å; L746-M750 WeakPolarHBondContact O-CG 3.43Å; L746-M750 PolarHBondContact O-N 2.87Å; H747-M750 PolarHBondContact O-N 3.46Å; M750-K753 PolarHBondContact O-N 2.79Å; M750-G754 PolarHBondContact O-N 3.33Å; M750-W841 HydrophobicContact CE-CD2 4.09Å; M750-W841 HydrophobicContact CE-CG 4.04Å; M750-W841 HydrophobicContact CE-CZ2 4.49Å; M750-W841 HydrophobicContact CG-CD2 3.95Å; M750-W841 HydrophobicContact CG-CE3 3.86Å; M750-W841 HydrophobicContact CG-CH2 3.96Å; M750-W841 HydrophobicContact CG-CZ2 4.06Å; M750-W841 HydrophobicContact CG-CZ3 3.87Å; M750-W841 HydrophobicContact SD-CD2 4.22Å; M750-W841 HydrophobicContact SD-CG 4.34Å
751	Q	91.8	Very high	92	Very high	136 Å²	136	62.3 Å²	62.3	64%	0.636	34%	0.337	S	S	*	.	H	α-helix	trans	-63.7	-43.2	173.7	-75.1	-172	-11	0	0	112.7	H747 Q748 L749	H747-Q751 VanDerWaalsContact CE1-CD 3.48Å; H747-Q751 PolarHBondContact CE1-NE2 2.92Å; H747-Q751 PolarHBondContact NE2-NE2 2.81Å; H747-Q751 VanDerWaalsContact NE2-NE2 3.17Å; H747-Q751 WeakPolarHBondContact O-CG 3.27Å; H747-Q751 PolarHBondContact O-N 2.96Å; Q748-Q751 PolarHBondContact O-N 3.43Å; L749-Q751 VanDerWaalsContact C-N 3.34Å; L749-Q751 PolarHBondContact O-N 3.18Å
752	I	93.4	Very high	91.7	Very high	136 Å²	136	63.1 Å²	63.1	70%	0.697	34%	0.342	S	S	*	.	H	α-helix	trans	-65.2	-40.5	179.4	-68.6	164	0	0	0	111.2	Q748 L749	Q748-I752 WeakPolarHBondContact O-CD1 3.3Å; Q748-I752 VanDerWaalsContact O-CG1 3.25Å; Q748-I752 WeakPolarHBondContact O-CG1 3.49Å; Q748-I752 PolarHBondContact O-N 3.16Å; Q748-I752 VanDerWaalsContact O-N 3.13Å; L749-I752 PolarHBondContact O-N 2.84Å
753	K	91.9	Very high	91.1	Very high	87 Å²	87	70 Å²	70	38%	0.378	37%	0.374	S	S	.	.	H	α-helix	trans	-81.6	-27.5	-176.5	-66.6	-62.4	-170.8	162.4	0	113.5	L749 M750 Y757 W841	L749-K753 HydrophobicContact CD1-CG 4.24Å; L749-K753 HydrophobicContact CG-CG 4.45Å; L749-K753 WeakPolarHBondContact O-CB 3.23Å; L749-K753 WeakPolarHBondContact O-CG 3.26Å; L749-K753 PolarHBondContact O-N 3.39Å; M750-K753 PolarHBondContact O-N 2.79Å; K753-Y757 HydrophobicContact CB-CD1 3.77Å; K753-Y757 HydrophobicContact CB-CD2 4.1Å; K753-Y757 HydrophobicContact CB-CE1 4.17Å; K753-Y757 HydrophobicContact CB-CG 3.7Å; K753-Y757 HydrophobicContact CD-CD1 4.38Å; K753-Y757 HydrophobicContact CD-CD2 4.08Å; K753-Y757 HydrophobicContact CD-CE1 3.98Å; K753-Y757 HydrophobicContact CD-CE2 3.71Å; K753-Y757 HydrophobicContact CD-CG 4.4Å; K753-Y757 WeakPolarHBondContact CE-OH 3.45Å; K753-Y757 HydrophobicContact CG-CD1 4.04Å; K753-Y757 HydrophobicContact CG-CD2 4.47Å; K753-Y757 HydrophobicContact CG-CE1 3.91Å; K753-Y757 HydrophobicContact CG-CE2 4.4Å; K753-Y757 HydrophobicContact CG-CG 4.3Å; K753-Y757 PolarHBondContact NZ-OH 2.97Å; K753-Y757 VanDerWaalsContact NZ-OH 3.11Å; K753-W841 HydrophobicContact CB-CH2 4.17Å; K753-W841 HydrophobicContact CG-CH2 4.49Å
754	G	89	Confident	90.5	Very high	22 Å²	22	72 Å²	72	23%	0.227	38%	0.383	C	S	.	.			trans	80.2	168.7	179.9	0	0	0	0	0	114.1	M750 L756 Y757	M750-G754 PolarHBondContact O-N 3.33Å; G754-L756 PolarHBondContact O-N 2.87Å; G754-Y757 WeakPolarHBondContact O-CB 3.23Å; G754-Y757 PolarHBondContact O-N 3.4Å
755	P	87.1	Confident	89.7	Confident	112 Å²	112	69.7 Å²	69.7	73%	0.727	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-19.1	-168.7	29.2	-36	0	0	0	114.8
756	L	90	Very high	88.4	Confident	132 Å²	132	69 Å²	69	69%	0.691	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	4.6	-179.9	-64.6	176.2	0	0	0	113	G754 Y758 N759 G760	G754-L756 PolarHBondContact O-N 2.87Å; L756-Y758 PolarHBondContact O-N 3.05Å; L756-N759 PolarHBondContact O-N 3.39Å; L756-G760 PolarHBondContact O-N 3.16Å
757	Y	94	Very high	86.9	Confident	40 Å²	40	77 Å²	77	16%	0.157	40%	0.402	C	S	.	.	H	α-helix	trans	-60.6	-47.3	-170.8	-178.6	-122.8	0	0	0	113.3	K753 G754 N759 G760 L761 H813 F840 W841	K753-Y757 HydrophobicContact CB-CD1 3.77Å; K753-Y757 HydrophobicContact CB-CD2 4.1Å; K753-Y757 HydrophobicContact CB-CE1 4.17Å; K753-Y757 HydrophobicContact CB-CG 3.7Å; K753-Y757 HydrophobicContact CD-CD1 4.38Å; K753-Y757 HydrophobicContact CD-CD2 4.08Å; K753-Y757 HydrophobicContact CD-CE1 3.98Å; K753-Y757 HydrophobicContact CD-CE2 3.71Å; K753-Y757 HydrophobicContact CD-CG 4.4Å; K753-Y757 WeakPolarHBondContact CE-OH 3.45Å; K753-Y757 HydrophobicContact CG-CD1 4.04Å; K753-Y757 HydrophobicContact CG-CD2 4.47Å; K753-Y757 HydrophobicContact CG-CE1 3.91Å; K753-Y757 HydrophobicContact CG-CE2 4.4Å; K753-Y757 HydrophobicContact CG-CG 4.3Å; K753-Y757 PolarHBondContact NZ-OH 2.97Å; K753-Y757 VanDerWaalsContact NZ-OH 3.11Å; G754-Y757 WeakPolarHBondContact O-CB 3.23Å; G754-Y757 PolarHBondContact O-N 3.4Å; Y757-N759 PolarHBondContact O-N 3.1Å; Y757-G760 PolarHBondContact O-N 2.94Å; Y757-L761 HydrophobicContact CD1-CD1 4.03Å; Y757-L761 HydrophobicContact CD2-CG 4.42Å; Y757-L761 HydrophobicContact CE1-CD1 3.69Å; Y757-L761 HydrophobicContact CE2-CD1 4.17Å; Y757-L761 HydrophobicContact CE2-CD2 4.1Å; Y757-L761 HydrophobicContact CE2-CG 4.14Å; Y757-L761 HydrophobicContact CG-CD1 4.46Å; Y757-L761 WeakPolarHBondContact O-CG 3.36Å; Y757-L761 PolarHBondContact O-N 2.84Å; Y757-H813 AromaticContact CE1-CE1 3.73Å; Y757-H813 AromaticContact CE1-ND1 3.23Å; Y757-H813 WeakPolarHBondContact CE1-ND1 3.3Å; Y757-H813 AromaticContact CZ-ND1 3.48Å; Y757-H813 PolarHBondContact OH-ND1 3.05Å; Y757-F840 HydrophobicContact CD1-CE1 4.21Å; Y757-F840 HydrophobicContact CD1-CZ 4.38Å; Y757-F840 HydrophobicContact CE1-CE1 4.36Å; Y757-F840 HydrophobicContact CE1-CZ 4.14Å; Y757-W841 AromaticContact CD1-CH2 3.65Å; Y757-W841 HydrophobicContact CD1-CH2 3.65Å; Y757-W841 HydrophobicContact CD1-CZ2 4.05Å; Y757-W841 HydrophobicContact CE1-CH2 4.21Å
758	Y	93.5	Very high	85.6	Confident	1 Å²	1	74 Å²	74	0%	0.004	39%	0.389	C	S	.	.	H	α-helix	trans	-60.5	-45.5	179.9	173.4	-108.4	0	0	0	112.3	L756 L761 L762 A809 K836 E837 F840	L756-Y758 PolarHBondContact O-N 3.05Å; Y758-L761 PolarHBondContact O-N 3.28Å; Y758-L762 HydrophobicContact CD1-CD1 4.32Å; Y758-L762 HydrophobicContact CE1-CD1 3.69Å; Y758-L762 HydrophobicContact CE1-CG 4.47Å; Y758-L762 HydrophobicContact CE2-CD1 4.46Å; Y758-L762 HydrophobicContact CE2-CG 4.49Å; Y758-L762 PolarHBondContact O-N 3.36Å; Y758-A809 HydrophobicContact CD2-CB 3.73Å; Y758-A809 HydrophobicContact CE2-CB 3.51Å; Y758-K836 HydrophobicContact CE1-CD 4.12Å; Y758-K836 HydrophobicContact CE1-CG 4.08Å; Y758-E837 HydrophobicContact CD1-CB 3.95Å; Y758-E837 HydrophobicContact CD1-CG 4.1Å; Y758-E837 HydrophobicContact CE1-CB 4.36Å; Y758-E837 HydrophobicContact CG-CB 4.33Å; Y758-E837 HydrophobicContact CG-CG 4.09Å; Y758-F840 HydrophobicContact CD2-CB 3.67Å; Y758-F840 AromaticContact CD2-CD1 3.59Å; Y758-F840 HydrophobicContact CD2-CD1 3.59Å; Y758-F840 AromaticContact CD2-CD2 3.89Å; Y758-F840 HydrophobicContact CD2-CD2 3.89Å; Y758-F840 HydrophobicContact CD2-CE1 4.13Å; Y758-F840 HydrophobicContact CD2-CE2 4.4Å; Y758-F840 AromaticContact CD2-CG 3.43Å; Y758-F840 HydrophobicContact CD2-CG 3.43Å; Y758-F840 VanDerWaalsContact CD2-CG 3.43Å; Y758-F840 HydrophobicContact CD2-CZ 4.49Å; Y758-F840 HydrophobicContact CE2-CB 3.64Å; Y758-F840 HydrophobicContact CE2-CD1 4.41Å; Y758-F840 HydrophobicContact CE2-CD2 4.12Å; Y758-F840 AromaticContact CE2-CG 3.82Å; Y758-F840 HydrophobicContact CE2-CG 3.82Å; Y758-F840 HydrophobicContact CG-CD1 4.25Å; Y758-F840 HydrophobicContact CG-CG 4.45Å
759	N	90.6	Very high	84.3	Confident	67 Å²	67	72.4 Å²	72.4	36%	0.358	39%	0.39	S	S	.	.	H	α-helix	trans	-65.4	-40.7	178.2	-66.1	-32.6	0	0	0	111.4	L756 Y757 L761 L762 E763	L756-N759 PolarHBondContact O-N 3.39Å; Y757-N759 PolarHBondContact O-N 3.1Å; N759-L761 VanDerWaalsContact C-N 3.29Å; N759-L761 PolarHBondContact O-N 3.24Å; N759-L762 PolarHBondContact O-N 3.43Å; N759-L762 VanDerWaalsContact O-N 3.14Å; N759-E763 PolarHBondContact O-N 3.14Å; N759-E763 VanDerWaalsContact O-N 3.09Å
760	G	89.5	Confident	82.7	Confident	33 Å²	33	75.5 Å²	75.5	34%	0.34	41%	0.406	S	S	.	.	H	α-helix	trans	-58.9	-38.7	174.7	0	0	0	0	0	112.9	L756 Y757 E763 E764	L756-G760 PolarHBondContact O-N 3.16Å; Y757-G760 PolarHBondContact O-N 2.94Å; G760-E763 PolarHBondContact O-N 2.82Å; G760-E764 WeakPolarHBondContact O-CB 3.4Å; G760-E764 PolarHBondContact O-N 3.44Å
761	L	90.5	Very high	81.1	Confident	6 Å²	6	73.9 Å²	73.9	3%	0.031	40%	0.398	C	S	.	.	H	α-helix	trans	-66.1	-36.2	175.8	-67.7	170.6	0	0	0	112.7	Y757 Y758 N759 E764 F765 A809 I812 H813 F840	Y757-L761 HydrophobicContact CD1-CD1 4.03Å; Y757-L761 HydrophobicContact CD2-CG 4.42Å; Y757-L761 HydrophobicContact CE1-CD1 3.69Å; Y757-L761 HydrophobicContact CE2-CD1 4.17Å; Y757-L761 HydrophobicContact CE2-CD2 4.1Å; Y757-L761 HydrophobicContact CE2-CG 4.14Å; Y757-L761 HydrophobicContact CG-CD1 4.46Å; Y757-L761 WeakPolarHBondContact O-CG 3.36Å; Y757-L761 PolarHBondContact O-N 2.84Å; Y758-L761 PolarHBondContact O-N 3.28Å; N759-L761 VanDerWaalsContact C-N 3.29Å; N759-L761 PolarHBondContact O-N 3.24Å; L761-E764 PolarHBondContact O-N 2.85Å; L761-F765 PolarHBondContact O-N 3.26Å; L761-A809 HydrophobicContact CB-CB 4.12Å; L761-A809 HydrophobicContact CD1-CB 4.43Å; L761-I812 HydrophobicContact CD2-CB 4.07Å; L761-I812 HydrophobicContact CD2-CG2 3.6Å; L761-I812 WeakPolarHBondContact O-CD1 3.15Å; L761-H813 HydrophobicContact CD1-CB 4.19Å; L761-F840 HydrophobicContact CD1-CE1 4.31Å; L761-F840 HydrophobicContact CD1-CE2 3.93Å; L761-F840 HydrophobicContact CD1-CZ 3.42Å; L761-F840 VanDerWaalsContact CD1-CZ 3.42Å
762	L	86.8	Confident	79.7	Confident	38 Å²	38	69.9 Å²	69.9	20%	0.199	39%	0.389	C	S	.	.	H	α-helix	trans	-67.9	-40.6	176.9	-67.6	178.5	0	0	0	111.8	Y758 N759 F765 E805 A809	Y758-L762 HydrophobicContact CD1-CD1 4.32Å; Y758-L762 HydrophobicContact CE1-CD1 3.69Å; Y758-L762 HydrophobicContact CE1-CG 4.47Å; Y758-L762 HydrophobicContact CE2-CD1 4.46Å; Y758-L762 HydrophobicContact CE2-CG 4.49Å; Y758-L762 PolarHBondContact O-N 3.36Å; N759-L762 PolarHBondContact O-N 3.43Å; N759-L762 VanDerWaalsContact O-N 3.14Å; L762-F765 PolarHBondContact O-N 3.45Å; L762-E805 HydrophobicContact CD1-CB 4.29Å; L762-E805 HydrophobicContact CD1-CG 4.44Å; L762-E805 HydrophobicContact CD2-CB 3.83Å; L762-E805 HydrophobicContact CD2-CG 4.28Å; L762-E805 VanDerWaalsContact CD2-O 3.23Å; L762-E805 WeakPolarHBondContact CD2-O 2.99Å; L762-A809 HydrophobicContact CD2-CB 4.01Å
763	E	83.7	Confident	78.5	Confident	144 Å²	144	70 Å²	70	67%	0.673	39%	0.386	S	S	*	.	H	α-helix	trans	-62.7	-46.8	174	-69.6	175.6	-177.1	0	0	110.4	N759 G760 F765 S766	N759-E763 PolarHBondContact O-N 3.14Å; N759-E763 VanDerWaalsContact O-N 3.09Å; G760-E763 PolarHBondContact O-N 2.82Å; E763-F765 VanDerWaalsContact C-N 3.27Å; E763-F765 PolarHBondContact O-N 2.76Å; E763-S766 PolarHBondContact O-N 3.43Å; E763-S766 PolarHBondContact O-OG 2.84Å
764	E	81.8	Confident	77.8	Confident	88 Å²	88	67.8 Å²	67.8	41%	0.411	38%	0.377	S	S	.	.	H	α-helix	trans	-59.9	-34.8	177.2	-163.4	-168.4	142.9	0	0	112.4	G760 L761 S766 E767 N768 I812	G760-E764 WeakPolarHBondContact O-CB 3.4Å; G760-E764 PolarHBondContact O-N 3.44Å; L761-E764 PolarHBondContact O-N 2.85Å; E764-S766 PolarHBondContact O-N 2.73Å; E764-E767 PolarHBondContact O-N 2.83Å; E764-N768 HydrophobicContact CG-CB 4.39Å; E764-N768 VanDerWaalsContact O-CB 3.25Å; E764-N768 WeakPolarHBondContact O-CB 3.27Å; E764-N768 PolarHBondContact O-N 2.95Å; E764-N768 PolarHBondContact OE1-ND2 3.43Å; E764-I812 HydrophobicContact CB-CD1 4.32Å; E764-I812 WeakPolarHBondContact OE1-CG2 3.47Å
765	F	73.9	Confident	77.1	Confident	6 Å²	6	71.3 Å²	71.3	3%	0.026	38%	0.383	C	S	.	.	H	α-helix	trans	-62	-27.1	-179.5	-168	-87.6	0	0	0	114.3	L761 L762 E763 E767 A771 R775 Q808 S811 I812	L761-F765 PolarHBondContact O-N 3.26Å; L762-F765 PolarHBondContact O-N 3.45Å; E763-F765 VanDerWaalsContact C-N 3.27Å; E763-F765 PolarHBondContact O-N 2.76Å; F765-E767 VanDerWaalsContact C-N 3.32Å; F765-A771 HydrophobicContact CD1-CB 4.38Å; F765-A771 HydrophobicContact CD2-CB 3.27Å; F765-A771 HydrophobicContact CE1-CB 4.36Å; F765-A771 HydrophobicContact CE2-CB 3.22Å; F765-A771 HydrophobicContact CG-CB 3.85Å; F765-A771 HydrophobicContact CZ-CB 3.78Å; F765-A771 WeakPolarHBondContact CZ-O 3.44Å; F765-R775 HydrophobicContact CE1-CB 4.3Å; F765-R775 HydrophobicContact CE1-CG 4.15Å; F765-R775 VanDerWaalsContact CE1-NE 3.29Å; F765-R775 HydrophobicContact CZ-CB 3.95Å; F765-R775 HydrophobicContact CZ-CG 4.27Å; F765-R775 PolarHBondContact O-NH2 3.47Å; F765-Q808 HydrophobicContact CD1-CB 4.03Å; F765-Q808 HydrophobicContact CD1-CG 3.94Å; F765-Q808 HydrophobicContact CD2-CB 3.57Å; F765-Q808 HydrophobicContact CD2-CG 4.04Å; F765-Q808 WeakPolarHBondContact CD2-O 3.27Å; F765-Q808 HydrophobicContact CE1-CB 4.06Å; F765-Q808 HydrophobicContact CE1-CG 3.51Å; F765-Q808 VanDerWaalsContact CE1-NE2 3.31Å; F765-Q808 HydrophobicContact CE2-CB 3.63Å; F765-Q808 HydrophobicContact CE2-CG 3.64Å; F765-Q808 HydrophobicContact CG-CB 3.83Å; F765-Q808 HydrophobicContact CG-CG 4.23Å; F765-Q808 HydrophobicContact CZ-CB 3.92Å; F765-Q808 HydrophobicContact CZ-CG 3.4Å; F765-S811 WeakPolarHBondContact CE2-OG 3.31Å; F765-I812 HydrophobicContact CB-CD1 3.45Å; F765-I812 VanDerWaalsContact CB-CD1 3.45Å; F765-I812 HydrophobicContact CD2-CD1 3.58Å; F765-I812 HydrophobicContact CD2-CG1 3.93Å; F765-I812 HydrophobicContact CG-CD1 3.97Å
766	S	65.1	Low	76.3	Confident	86 Å²	86	70 Å²	70	60%	0.601	36%	0.364	S	S	*	.	H	α-helix	trans	-68	-33.5	176	68.9	0	0	0	0	112.2	E763 E764	E763-S766 PolarHBondContact O-N 3.43Å; E763-S766 PolarHBondContact O-OG 2.84Å; E764-S766 PolarHBondContact O-N 2.73Å
767	E	64.5	Low	75.7	Confident	171 Å²	171	67 Å²	67	80%	0.799	35%	0.346	S	S	*	.	H	α-helix	trans	-100.2	-22.3	-175.5	-57.9	-167.4	161.1	0	0	114	E764 F765 T769	E764-E767 PolarHBondContact O-N 2.83Å; F765-E767 VanDerWaalsContact C-N 3.32Å; E767-T769 PolarHBondContact O-N 3.28Å
768	N	64.2	Low	75.2	Confident	38 Å²	38	65.1 Å²	65.1	20%	0.203	34%	0.339	C	S	.	.			trans	-77.1	125	-170.2	-167.9	-31	0	0	0	113	E764 L770 A771 I812	E764-N768 HydrophobicContact CG-CB 4.39Å; E764-N768 VanDerWaalsContact O-CB 3.25Å; E764-N768 WeakPolarHBondContact O-CB 3.27Å; E764-N768 PolarHBondContact O-N 2.95Å; E764-N768 PolarHBondContact OE1-ND2 3.43Å; N768-L770 PolarHBondContact O-N 3.45Å; N768-L770 WeakPolarHBondContact OD1-CB 3.43Å; N768-L770 PolarHBondContact OD1-N 3.44Å; N768-A771 HydrophobicContact CB-CB 4.03Å; N768-A771 WeakPolarHBondContact O-CB 3.34Å; N768-A771 PolarHBondContact O-N 3.35Å; N768-I812 HydrophobicContact CB-CD1 4.4Å
769	T	63.6	Low	74.5	Confident	117 Å²	117	67.7 Å²	67.7	72%	0.718	36%	0.357	S	S	*	.	H	α-helix	trans	-69.7	-31	-178.7	-44	0	0	0	0	113.1	E767 A772	E767-T769 PolarHBondContact O-N 3.28Å; T769-A772 WeakPolarHBondContact O-CB 3.31Å; T769-A772 PolarHBondContact O-N 2.94Å
770	L	59.1	Low	74	Confident	90 Å²	90	69.3 Å²	69.3	47%	0.471	37%	0.365	S	S	.	.	H	α-helix	trans	-69.1	-38.5	176.9	-70.2	169.5	0	0	0	111	N768 A772 Q773	N768-L770 PolarHBondContact O-N 3.45Å; N768-L770 WeakPolarHBondContact OD1-CB 3.43Å; N768-L770 PolarHBondContact OD1-N 3.44Å; L770-A772 PolarHBondContact O-N 3.16Å; L770-Q773 WeakPolarHBondContact O-CB 3.42Å; L770-Q773 PolarHBondContact O-N 3.07Å; L770-Q773 VanDerWaalsContact O-N 3.07Å
771	A	58.6	Low	73.7	Confident	2 Å²	2	67.8 Å²	67.8	2%	0.017	35%	0.349	C	S	.	.	H	α-helix	trans	-56.9	-33.8	174.9	0	0	0	0	0	112.9	F765 N768 Q773 H774 R775 I812	F765-A771 HydrophobicContact CD1-CB 4.38Å; F765-A771 HydrophobicContact CD2-CB 3.27Å; F765-A771 HydrophobicContact CE1-CB 4.36Å; F765-A771 HydrophobicContact CE2-CB 3.22Å; F765-A771 HydrophobicContact CG-CB 3.85Å; F765-A771 HydrophobicContact CZ-CB 3.78Å; F765-A771 WeakPolarHBondContact CZ-O 3.44Å; N768-A771 HydrophobicContact CB-CB 4.03Å; N768-A771 WeakPolarHBondContact O-CB 3.34Å; N768-A771 PolarHBondContact O-N 3.35Å; A771-Q773 PolarHBondContact O-N 3.14Å; A771-H774 PolarHBondContact O-N 3.46Å; A771-R775 PolarHBondContact O-N 3Å; A771-I812 HydrophobicContact CB-CD1 4.23Å; A771-I812 HydrophobicContact CB-CG1 4.25Å
772	A	63.1	Low	73.6	Confident	52 Å²	52	68 Å²	68	43%	0.43	35%	0.351	S	S	.	.	H	α-helix	trans	-61.2	-29.5	177.6	0	0	0	0	0	113.2	T769 L770	T769-A772 WeakPolarHBondContact O-CB 3.31Å; T769-A772 PolarHBondContact O-N 2.94Å; L770-A772 PolarHBondContact O-N 3.16Å
773	Q	68.8	Low	73.4	Confident	139 Å²	139	70.5 Å²	70.5	65%	0.65	36%	0.363	S	S	*	.	H	α-helix	trans	-67.2	-40.6	178.7	-60.3	-176.4	-4	0	0	111.7	L770 A771	L770-Q773 WeakPolarHBondContact O-CB 3.42Å; L770-Q773 PolarHBondContact O-N 3.07Å; L770-Q773 VanDerWaalsContact O-N 3.07Å; A771-Q773 PolarHBondContact O-N 3.14Å
774	H	76.4	Confident	73.5	Confident	39 Å²	39	68.2 Å²	68.2	18%	0.181	35%	0.349	C	S	.	.	H	α-helix	trans	-85.6	-25.1	-178.8	-62.8	-63.5	0	0	0	113	A771 R776 Q777 I778 Y819	A771-H774 PolarHBondContact O-N 3.46Å; H774-R776 PolarHBondContact O-N 3.21Å; H774-R776 VanDerWaalsContact O-N 3.17Å; H774-Q777 PolarHBondContact O-N 3.25Å; H774-I778 HydrophobicContact CB-CD1 4.27Å; H774-I778 WeakPolarHBondContact O-CG1 3.33Å; H774-I778 PolarHBondContact O-N 3.46Å; H774-Y819 PolarHBondContact CE1-N 2.96Å; H774-Y819 PolarHBondContact ND1-N 3.27Å
775	R	74.3	Confident	73.9	Confident	96 Å²	96	64 Å²	64	36%	0.362	33%	0.329	S	S	.	.	H	α-helix	trans	-50	-43.1	-179.8	-170.2	179.4	-67.6	171.5	-4.2	112.8	F765 A771 S779	F765-R775 HydrophobicContact CE1-CB 4.3Å; F765-R775 HydrophobicContact CE1-CG 4.15Å; F765-R775 VanDerWaalsContact CE1-NE 3.29Å; F765-R775 HydrophobicContact CZ-CB 3.95Å; F765-R775 HydrophobicContact CZ-CG 4.27Å; F765-R775 PolarHBondContact O-NH2 3.47Å; A771-R775 PolarHBondContact O-N 3Å; R775-S779 WeakPolarHBondContact O-CB 3.42Å; R775-S779 PolarHBondContact O-N 2.94Å; R775-S779 PolarHBondContact O-OG 2.94Å
776	R	71.3	Confident	74.6	Confident	85 Å²	85	63.7 Å²	63.7	32%	0.321	33%	0.328	S	S	.	.	H	α-helix	trans	-61.8	-51.5	176.7	-169.5	-160.1	-166	146.9	14.5	111.6	I225 S226 P227 H774 I778 S779 L780	I225-R776 PolarHBondContact O-NH1 2.81Å; S226-R776 PolarHBondContact O-NH1 2.86Å; P227-R776 VanDerWaalsContact CA-NH2 3.32Å; P227-R776 HydrophobicContact CB-CG 3.81Å; P227-R776 VanDerWaalsContact CB-NE 3.28Å; P227-R776 HydrophobicContact CG-CB 3.84Å; P227-R776 HydrophobicContact CG-CG 3.52Å; P227-R776 VanDerWaalsContact N-CZ 3.29Å; H774-R776 PolarHBondContact O-N 3.21Å; H774-R776 VanDerWaalsContact O-N 3.17Å; R776-I778 VanDerWaalsContact C-N 3.34Å; R776-I778 PolarHBondContact O-N 3.22Å; R776-S779 PolarHBondContact O-N 3.41Å; R776-L780 HydrophobicContact CG-CD1 4.31Å; R776-L780 WeakPolarHBondContact O-CG 3Å; R776-L780 PolarHBondContact O-N 3.05Å
777	Q	76.1	Confident	75.5	Confident	69 Å²	69	63.1 Å²	63.1	32%	0.322	32%	0.322	S	S	.	.	H	α-helix	trans	-65.9	-40.9	-174.4	-169.9	63	40.4	0	0	111	H774 S779 L780 D781 Y819	H774-Q777 PolarHBondContact O-N 3.25Å; Q777-S779 PolarHBondContact O-N 2.79Å; Q777-L780 PolarHBondContact O-N 3.39Å; Q777-D781 PolarHBondContact O-N 3.27Å; Q777-Y819 HydrophobicContact CB-CD1 4.1Å; Q777-Y819 HydrophobicContact CB-CE1 4.3Å; Q777-Y819 HydrophobicContact CG-CD1 3.83Å; Q777-Y819 HydrophobicContact CG-CE1 3.7Å
778	I	83.9	Confident	76.5	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-56.6	-52	172.7	-67.1	168.5	0	0	0	109.4	H774 R776 L780 D781 L782 Q804 L807 Q808 Y819	H774-I778 HydrophobicContact CB-CD1 4.27Å; H774-I778 WeakPolarHBondContact O-CG1 3.33Å; H774-I778 PolarHBondContact O-N 3.46Å; R776-I778 VanDerWaalsContact C-N 3.34Å; R776-I778 PolarHBondContact O-N 3.22Å; I778-L780 VanDerWaalsContact C-N 3.29Å; I778-L780 PolarHBondContact O-N 3.26Å; I778-D781 PolarHBondContact O-N 3.39Å; I778-L782 HydrophobicContact CG2-CD2 4.17Å; I778-L782 HydrophobicContact CG2-CG 4.41Å; I778-L782 WeakPolarHBondContact O-CG 3.35Å; I778-L782 PolarHBondContact O-N 3.22Å; I778-L782 VanDerWaalsContact O-N 3.09Å; I778-Q804 HydrophobicContact CG2-CG 4.45Å; I778-L807 HydrophobicContact CD1-CB 4.02Å; I778-L807 HydrophobicContact CG1-CB 4.19Å; I778-L807 HydrophobicContact CG2-CB 4.08Å; I778-L807 HydrophobicContact CG2-CD1 4.07Å; I778-Q808 HydrophobicContact CD1-CG 4.03Å; I778-Y819 HydrophobicContact CD1-CD2 4.4Å; I778-Y819 HydrophobicContact CD1-CG 4.27Å; I778-Y819 HydrophobicContact CG1-CD1 3.91Å; I778-Y819 HydrophobicContact CG1-CD2 3.81Å; I778-Y819 HydrophobicContact CG1-CE1 4.3Å; I778-Y819 HydrophobicContact CG1-CE2 4.2Å; I778-Y819 HydrophobicContact CG1-CG 3.65Å
779	S	78.8	Confident	77.8	Confident	55 Å²	55	56.9 Å²	56.9	39%	0.385	29%	0.294	S	S	.	.	H	α-helix	trans	-59	-37.1	-177.4	-55.2	0	0	0	0	113.4	R775 R776 Q777 D781	R775-S779 WeakPolarHBondContact O-CB 3.42Å; R775-S779 PolarHBondContact O-N 2.94Å; R775-S779 PolarHBondContact O-OG 2.94Å; R776-S779 PolarHBondContact O-N 3.41Å; Q777-S779 PolarHBondContact O-N 2.79Å; S779-D781 VanDerWaalsContact C-N 3.28Å; S779-D781 PolarHBondContact O-N 3.38Å
780	L	79.2	Confident	79	Confident	101 Å²	101	54 Å²	54	53%	0.529	28%	0.276	S	S	.	.	H	α-helix	trans	-68.2	-28.7	175.5	-68.9	173.2	0	0	0	112.8	R776 Q777 I778	R776-L780 HydrophobicContact CG-CD1 4.31Å; R776-L780 WeakPolarHBondContact O-CG 3Å; R776-L780 PolarHBondContact O-N 3.05Å; Q777-L780 PolarHBondContact O-N 3.39Å; I778-L780 VanDerWaalsContact C-N 3.29Å; I778-L780 PolarHBondContact O-N 3.26Å
781	D	85.2	Confident	80.4	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.011	27%	0.267	C	S	.	.	H	α-helix	trans	-86.8	-23.7	-176.7	-71.8	-7.3	0	0	0	112.9	Q777 I778 S779 L783 R784 T785 Y819 N824	Q777-D781 PolarHBondContact O-N 3.27Å; I778-D781 PolarHBondContact O-N 3.39Å; S779-D781 VanDerWaalsContact C-N 3.28Å; S779-D781 PolarHBondContact O-N 3.38Å; D781-L783 PolarHBondContact O-N 3.47Å; D781-R784 VanDerWaalsContact O-CG 3.28Å; D781-R784 WeakPolarHBondContact O-CG 3.49Å; D781-R784 PolarHBondContact O-N 2.97Å; D781-R784 IonicContact OD1-CZ 2.77Å; D781-R784 IonicContact OD1-NE 3.28Å; D781-R784 PolarHBondContact OD1-NE 2.67Å; D781-R784 IonicContact OD1-NH2 2.86Å; D781-R784 PolarHBondContact OD1-NH2 3.15Å; D781-R784 IonicContact OD2-NH2 3.71Å; D781-R784 PolarHBondContact OD2-NH2 3.22Å; D781-R784 VanDerWaalsContact OD2-NH2 3.14Å; D781-T785 PolarHBondContact O-N 3.46Å; D781-T785 PolarHBondContact O-OG1 3.48Å; D781-Y819 WeakPolarHBondContact CB-OH 3.48Å; D781-Y819 WeakPolarHBondContact OD2-CE1 3.33Å; D781-Y819 PolarHBondContact OD2-OH 3.12Å; D781-N824 HydrophobicContact CB-CB 4.34Å
782	L	87	Confident	82	Confident	11 Å²	11	52.4 Å²	52.4	6%	0.058	27%	0.266	C	S	.	.	H	α-helix	trans	-53	-59.6	-177.1	-69	-179.7	0	0	0	113	I778 R784 T785 V800 L803 Q804	I778-L782 HydrophobicContact CG2-CD2 4.17Å; I778-L782 HydrophobicContact CG2-CG 4.41Å; I778-L782 WeakPolarHBondContact O-CG 3.35Å; I778-L782 PolarHBondContact O-N 3.22Å; I778-L782 VanDerWaalsContact O-N 3.09Å; L782-R784 VanDerWaalsContact C-N 3.26Å; L782-R784 PolarHBondContact O-N 3.12Å; L782-T785 PolarHBondContact O-N 2.8Å; L782-V800 HydrophobicContact CB-CG1 3.98Å; L782-V800 HydrophobicContact CD1-CG1 4.01Å; L782-V800 HydrophobicContact CG-CG1 4.37Å; L782-L803 HydrophobicContact CD2-CB 4.2Å; L782-L803 HydrophobicContact CD2-CD2 3.95Å; L782-L803 HydrophobicContact CD2-CG 3.88Å; L782-Q804 HydrophobicContact CD1-CB 3.83Å; L782-Q804 HydrophobicContact CD1-CG 4.03Å; L782-Q804 HydrophobicContact CD2-CB 3.94Å
783	L	83.8	Confident	83.1	Confident	89 Å²	89	52.3 Å²	52.3	47%	0.466	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-13.9	-172.9	-64.8	179.5	0	0	0	114.5	D781 I795	D781-L783 PolarHBondContact O-N 3.47Å; L783-I795 HydrophobicContact CD2-CB 3.97Å; L783-I795 HydrophobicContact CD2-CG1 4.42Å
784	R	85.4	Confident	83.9	Confident	96 Å²	96	49 Å²	49	36%	0.362	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-0.7	175	66.9	178.3	-166	79.3	4.2	112.9	D781 L782	D781-R784 VanDerWaalsContact O-CG 3.28Å; D781-R784 WeakPolarHBondContact O-CG 3.49Å; D781-R784 PolarHBondContact O-N 2.97Å; D781-R784 IonicContact OD1-CZ 2.77Å; D781-R784 IonicContact OD1-NE 3.28Å; D781-R784 PolarHBondContact OD1-NE 2.67Å; D781-R784 IonicContact OD1-NH2 2.86Å; D781-R784 PolarHBondContact OD1-NH2 3.15Å; D781-R784 IonicContact OD2-NH2 3.71Å; D781-R784 PolarHBondContact OD2-NH2 3.22Å; D781-R784 VanDerWaalsContact OD2-NH2 3.14Å; L782-R784 VanDerWaalsContact C-N 3.26Å; L782-R784 PolarHBondContact O-N 3.12Å
785	T	89.3	Confident	84	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	-92.5	117.1	179.3	-57.3	0	0	0	0	109.8	D781 L782 F792 L803 N824 F825 A828	D781-T785 PolarHBondContact O-N 3.46Å; D781-T785 PolarHBondContact O-OG1 3.48Å; L782-T785 PolarHBondContact O-N 2.8Å; T785-F792 VanDerWaalsContact O-CB 3.31Å; T785-F792 WeakPolarHBondContact O-CB 3.49Å; T785-L803 HydrophobicContact CG2-CD2 3.86Å; T785-N824 HydrophobicContact CG2-CB 4.39Å; T785-N824 PolarHBondContact OG1-ND2 3.5Å; T785-F825 HydrophobicContact CG2-CD1 3.91Å; T785-F825 HydrophobicContact CG2-CE1 4.28Å; T785-A828 HydrophobicContact CG2-CB 3.48Å; T785-A828 VanDerWaalsContact CG2-CB 3.48Å
786	M	88.1	Confident	84.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	48.4	48.9	-177.1	-67.1	-178.4	179.9	0	0	114.7	F669 N788 N789 F792 A828 V829 L832 Y905 F910	F669-M786 HydrophobicContact CE1-CG 4.42Å; F669-M786 HydrophobicContact CZ-SD 4.26Å; M786-N788 PolarHBondContact O-N 3.14Å; M786-N789 HydrophobicContact CB-CB 4.02Å; M786-N789 WeakPolarHBondContact O-CB 3.42Å; M786-N789 PolarHBondContact O-N 3.28Å; M786-F792 HydrophobicContact CB-CB 4.25Å; M786-F792 HydrophobicContact CB-CD2 3.79Å; M786-F792 HydrophobicContact CB-CG 4.26Å; M786-F792 HydrophobicContact SD-CD2 3.99Å; M786-F792 HydrophobicContact SD-CE2 3.78Å; M786-A828 HydrophobicContact CE-CB 4.02Å; M786-A828 HydrophobicContact CG-CB 4.43Å; M786-A828 HydrophobicContact SD-CB 3.89Å; M786-V829 HydrophobicContact CE-CB 4.21Å; M786-V829 HydrophobicContact CE-CG2 3.38Å; M786-L832 HydrophobicContact CE-CD1 3.81Å; M786-L832 HydrophobicContact SD-CD1 3.81Å; M786-L832 HydrophobicContact SD-CG 4.3Å; M786-Y905 HydrophobicContact CE-CD2 3.84Å; M786-Y905 HydrophobicContact CE-CE2 3.29Å; M786-Y905 HydrophobicContact CG-CE2 3.77Å; M786-Y905 WeakPolarHBondContact CG-OH 3.44Å; M786-Y905 PolarHBondContact N-OH 2.85Å; M786-Y905 HydrophobicContact SD-CE2 4.36Å; M786-F910 HydrophobicContact CE-CE2 4.43Å
787	P	85.5	Confident	85	Confident	74 Å²	74	51.5 Å²	51.5	48%	0.481	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.5	-174.3	28.5	-36.8	0	0	0	113.9	N789	P787-N789 VanDerWaalsContact C-N 3.34Å
788	N	84.9	Confident	85.6	Confident	77 Å²	77	52 Å²	52	41%	0.412	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	1.8	175.6	63.2	-27.9	0	0	0	113.7	K670 M786	K670-N788 WeakPolarHBondContact CB-O 3.25Å; K670-N788 WeakPolarHBondContact CG-O 3.36Å; K670-N788 PolarHBondContact N-O 3.26Å; M786-N788 PolarHBondContact O-N 3.14Å
789	N	91	Very high	86	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-103.5	134.1	177.6	-171.5	-67	0	0	0	110.8	Y667 G668 F669 M786 P787 Q791 F792 D793	Y667-N789 PolarHBondContact O-ND2 3.02Å; G668-N789 CarbonylContact O-C 3.53Å; G668-N789 WeakPolarHBondContact O-CA 3.03Å; F669-N789 HydrophobicContact CD1-CB 3.84Å; F669-N789 HydrophobicContact CE1-CB 3.8Å; F669-N789 HydrophobicContact CZ-CB 4.47Å; M786-N789 HydrophobicContact CB-CB 4.02Å; M786-N789 WeakPolarHBondContact O-CB 3.42Å; M786-N789 PolarHBondContact O-N 3.28Å; P787-N789 VanDerWaalsContact C-N 3.34Å; N789-Q791 PolarHBondContact O-N 2.81Å; N789-Q791 WeakPolarHBondContact OD1-CB 3.34Å; N789-Q791 PolarHBondContact OD1-N 3.03Å; N789-F792 HydrophobicContact CB-CD2 4.09Å; N789-F792 CarbonylContact O-C 3.53Å; N789-F792 PolarHBondContact O-N 3.45Å; N789-D793 WeakPolarHBondContact O-CB 3.39Å; N789-D793 PolarHBondContact O-N 2.93Å
790	V	89.6	Confident	86.5	Confident	56 Å²	56	49.6 Å²	49.6	34%	0.339	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-20.5	-178.2	-63.4	0	0	0	0	114.6	V664 G668 K670	V664-V790 HydrophobicContact CG1-CG1 3.94Å; V664-V790 HydrophobicContact CG2-CG1 4.13Å; G668-V790 PolarHBondContact O-N 3.43Å; K670-V790 HydrophobicContact CG-CG1 4.21Å
791	Q	89.1	Confident	87	Confident	60 Å²	60	50.4 Å²	50.4	28%	0.28	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-17.8	176	-63.4	-165.4	-17.8	0	0	113	N789 A797 G799 V800	N789-Q791 PolarHBondContact O-N 2.81Å; N789-Q791 WeakPolarHBondContact OD1-CB 3.34Å; N789-Q791 PolarHBondContact OD1-N 3.03Å; Q791-A797 VanDerWaalsContact O-CB 3.27Å; Q791-A797 WeakPolarHBondContact O-CB 3.49Å; Q791-G799 CarbonylContact O-C 3.59Å; Q791-G799 WeakPolarHBondContact O-CA 3.46Å; Q791-G799 PolarHBondContact O-N 3.31Å; Q791-V800 PolarHBondContact O-N 3.1Å
792	F	92	Very high	87.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	6.4	-172	-51.6	-79.4	0	0	0	114.3	T785 M786 N789 N794 G799 V800 L803 A828 L831 L832	T785-F792 VanDerWaalsContact O-CB 3.31Å; T785-F792 WeakPolarHBondContact O-CB 3.49Å; M786-F792 HydrophobicContact CB-CB 4.25Å; M786-F792 HydrophobicContact CB-CD2 3.79Å; M786-F792 HydrophobicContact CB-CG 4.26Å; M786-F792 HydrophobicContact SD-CD2 3.99Å; M786-F792 HydrophobicContact SD-CE2 3.78Å; N789-F792 HydrophobicContact CB-CD2 4.09Å; N789-F792 CarbonylContact O-C 3.53Å; N789-F792 PolarHBondContact O-N 3.45Å; F792-N794 VanDerWaalsContact C-N 3.35Å; F792-N794 PolarHBondContact O-N 2.88Å; F792-G799 VanDerWaalsContact CE1-C 3.48Å; F792-G799 VanDerWaalsContact CE1-O 3.3Å; F792-G799 WeakPolarHBondContact CE1-O 3.46Å; F792-V800 HydrophobicContact CB-CG2 4.4Å; F792-L803 HydrophobicContact CD1-CD2 4.25Å; F792-L803 HydrophobicContact CE1-CB 4.09Å; F792-L803 HydrophobicContact CE1-CD2 4.27Å; F792-A828 HydrophobicContact CE1-CB 4.36Å; F792-A828 HydrophobicContact CE2-CB 4.44Å; F792-A828 HydrophobicContact CZ-CB 4.08Å; F792-L831 HydrophobicContact CZ-CB 4.21Å; F792-L832 HydrophobicContact CE2-CD2 3.84Å; F792-L832 HydrophobicContact CE2-CG 4.32Å
793	D	84.6	Confident	87.9	Confident	49 Å²	49	53.9 Å²	53.9	26%	0.262	28%	0.281	S	S	.	.	S	Bend	trans	-74.2	-19.1	-169	64	-1.5	0	0	0	115.2	K670 N789	K670-D793 VanDerWaalsContact CE-OD2 3.28Å; K670-D793 WeakPolarHBondContact CE-OD2 3.44Å; K670-D793 IonicContact NZ-OD2 2.84Å; K670-D793 PolarHBondContact NZ-OD2 3.35Å; N789-D793 WeakPolarHBondContact O-CB 3.39Å; N789-D793 PolarHBondContact O-N 2.93Å
794	N	85.9	Confident	88.3	Confident	70 Å²	70	52.4 Å²	52.4	37%	0.374	27%	0.272	S	S	.	.	S	Bend	trans	-150	167	-179.5	72.1	70.4	0	0	0	111.1	F792 D796 A797 V800	F792-N794 VanDerWaalsContact C-N 3.35Å; F792-N794 PolarHBondContact O-N 2.88Å; N794-D796 VanDerWaalsContact C-N 3.27Å; N794-D796 PolarHBondContact O-N 3.2Å; N794-D796 WeakPolarHBondContact OD1-CA 3.2Å; N794-D796 WeakPolarHBondContact OD1-CB 3.5Å; N794-D796 PolarHBondContact OD1-N 3.07Å; N794-A797 WeakPolarHBondContact O-CB 3.48Å; N794-A797 PolarHBondContact O-N 2.77Å; N794-A797 VanDerWaalsContact O-N 3.11Å; N794-A797 PolarHBondContact OD1-N 3.41Å; N794-V800 VanDerWaalsContact O-CG2 3.24Å; N794-V800 WeakPolarHBondContact O-CG2 3.39Å
795	I	78.4	Confident	88.7	Confident	120 Å²	120	49.4 Å²	49.4	62%	0.615	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-27.2	-174	-161.4	162.6	0	0	0	113.9	L783 A797	L783-I795 HydrophobicContact CD2-CB 3.97Å; L783-I795 HydrophobicContact CD2-CG1 4.42Å; I795-A797 VanDerWaalsContact C-N 3.31Å
796	D	80.6	Confident	89.1	Confident	147 Å²	147	49.4 Å²	49.4	79%	0.786	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-1.7	178.7	-56	-46.4	0	0	0	111.9	N794	N794-D796 VanDerWaalsContact C-N 3.27Å; N794-D796 PolarHBondContact O-N 3.2Å; N794-D796 WeakPolarHBondContact OD1-CA 3.2Å; N794-D796 WeakPolarHBondContact OD1-CB 3.5Å; N794-D796 PolarHBondContact OD1-N 3.07Å
797	A	87.3	Confident	89.4	Confident	6 Å²	6	49.5 Å²	49.5	5%	0.05	26%	0.262	C	S	.	.	S	Bend	trans	-69.1	136.6	-179.9	0	0	0	0	0	110.4	Q791 N794 I795 G799 V800	Q791-A797 VanDerWaalsContact O-CB 3.27Å; Q791-A797 WeakPolarHBondContact O-CB 3.49Å; N794-A797 WeakPolarHBondContact O-CB 3.48Å; N794-A797 PolarHBondContact O-N 2.77Å; N794-A797 VanDerWaalsContact O-N 3.11Å; N794-A797 PolarHBondContact OD1-N 3.41Å; I795-A797 VanDerWaalsContact C-N 3.31Å; A797-G799 PolarHBondContact O-N 3.25Å; A797-G799 VanDerWaalsContact O-N 3.14Å; A797-V800 HydrophobicContact CB-CG2 4.31Å; A797-V800 WeakPolarHBondContact O-CB 3.43Å; A797-V800 PolarHBondContact O-N 2.87Å
798	P	88.1	Confident	89.7	Confident	79 Å²	79	47.1 Å²	47.1	51%	0.513	25%	0.245	S	C	.	.	H	α-helix	trans	-65.5	-24.5	-171.4	25.8	-35.3	0	0	0	113.3	K802	P798-K802 VanDerWaalsContact O-CG 3.27Å; P798-K802 WeakPolarHBondContact O-CG 3.35Å; P798-K802 PolarHBondContact O-N 3.39Å
799	G	91.4	Very high	90.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-73.1	-31.7	175.9	0	0	0	0	0	112.7	Q791 F792 A797 K802 L803	Q791-G799 CarbonylContact O-C 3.59Å; Q791-G799 WeakPolarHBondContact O-CA 3.46Å; Q791-G799 PolarHBondContact O-N 3.31Å; F792-G799 VanDerWaalsContact CE1-C 3.48Å; F792-G799 VanDerWaalsContact CE1-O 3.3Å; F792-G799 WeakPolarHBondContact CE1-O 3.46Å; A797-G799 PolarHBondContact O-N 3.25Å; A797-G799 VanDerWaalsContact O-N 3.14Å; G799-K802 PolarHBondContact O-N 3.13Å; G799-L803 VanDerWaalsContact O-CB 3.23Å; G799-L803 WeakPolarHBondContact O-CB 3.23Å; G799-L803 PolarHBondContact O-N 3.22Å
800	V	90.4	Very high	90.2	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.024	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-46.9	176.7	173.4	0	0	0	0	111.1	L782 Q791 F792 N794 A797 L803 Q804	L782-V800 HydrophobicContact CB-CG1 3.98Å; L782-V800 HydrophobicContact CD1-CG1 4.01Å; L782-V800 HydrophobicContact CG-CG1 4.37Å; Q791-V800 PolarHBondContact O-N 3.1Å; F792-V800 HydrophobicContact CB-CG2 4.4Å; N794-V800 VanDerWaalsContact O-CG2 3.24Å; N794-V800 WeakPolarHBondContact O-CG2 3.39Å; A797-V800 HydrophobicContact CB-CG2 4.31Å; A797-V800 WeakPolarHBondContact O-CB 3.43Å; A797-V800 PolarHBondContact O-N 2.87Å; V800-L803 PolarHBondContact O-N 3.27Å; V800-Q804 WeakPolarHBondContact O-CB 3.3Å; V800-Q804 PolarHBondContact O-N 2.95Å
801	Q	89.9	Confident	90.3	Very high	118 Å²	118	41 Å²	41	55%	0.551	21%	0.21	S	C	*	.	H	α-helix	trans	-62.7	-46.6	176.6	-174.4	-175.1	-10.9	0	0	111.4	L803 Q804 E805	Q801-L803 VanDerWaalsContact C-N 3.31Å; Q801-L803 PolarHBondContact O-N 3.24Å; Q801-Q804 WeakPolarHBondContact O-CB 3.4Å; Q801-Q804 PolarHBondContact O-N 3.17Å; Q801-E805 PolarHBondContact NE2-OE1 2.94Å; Q801-E805 WeakPolarHBondContact O-CG 3.34Å; Q801-E805 PolarHBondContact O-N 3.22Å
802	K	95.1	Very high	90.4	Very high	86 Å²	86	39 Å²	39	37%	0.374	20%	0.201	S	C	.	.	H	α-helix	trans	-60.2	-41.1	177.2	-69.3	171.1	-174.1	178.5	0	112	P798 G799 E805 V806 L831	P798-K802 VanDerWaalsContact O-CG 3.27Å; P798-K802 WeakPolarHBondContact O-CG 3.35Å; P798-K802 PolarHBondContact O-N 3.39Å; G799-K802 PolarHBondContact O-N 3.13Å; K802-E805 PolarHBondContact O-N 2.98Å; K802-V806 WeakPolarHBondContact O-CG2 3.39Å; K802-V806 PolarHBondContact O-N 2.99Å; K802-L831 HydrophobicContact CB-CD1 4.08Å; K802-L831 HydrophobicContact CB-CD2 3.93Å
803	L	96.1	Very high	90.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.1	-44.2	177.2	179.6	61.8	0	0	0	111.2	L782 T785 F792 G799 V800 Q801 V806 L807 A827 A828 L831	L782-L803 HydrophobicContact CD2-CB 4.2Å; L782-L803 HydrophobicContact CD2-CD2 3.95Å; L782-L803 HydrophobicContact CD2-CG 3.88Å; T785-L803 HydrophobicContact CG2-CD2 3.86Å; F792-L803 HydrophobicContact CD1-CD2 4.25Å; F792-L803 HydrophobicContact CE1-CB 4.09Å; F792-L803 HydrophobicContact CE1-CD2 4.27Å; G799-L803 VanDerWaalsContact O-CB 3.23Å; G799-L803 WeakPolarHBondContact O-CB 3.23Å; G799-L803 PolarHBondContact O-N 3.22Å; V800-L803 PolarHBondContact O-N 3.27Å; Q801-L803 VanDerWaalsContact C-N 3.31Å; Q801-L803 PolarHBondContact O-N 3.24Å; L803-V806 PolarHBondContact O-N 3.15Å; L803-L807 HydrophobicContact CD1-CD1 3.86Å; L803-L807 HydrophobicContact CD1-CG 4.07Å; L803-L807 HydrophobicContact CG-CD1 3.94Å; L803-L807 HydrophobicContact CG-CG 4.5Å; L803-L807 WeakPolarHBondContact O-CB 3.17Å; L803-L807 VanDerWaalsContact O-CG 3.26Å; L803-L807 WeakPolarHBondContact O-CG 3.19Å; L803-L807 PolarHBondContact O-N 3.11Å; L803-A827 HydrophobicContact CD1-CB 3.56Å; L803-A828 HydrophobicContact CD1-CB 4.25Å; L803-A828 HydrophobicContact CD2-CB 4.45Å; L803-L831 VanDerWaalsContact CA-CD1 3.43Å; L803-L831 HydrophobicContact CB-CD1 3.85Å; L803-L831 HydrophobicContact CD1-CD1 4.12Å
804	Q	92.6	Very high	90.6	Very high	58 Å²	58	39.6 Å²	39.6	27%	0.271	20%	0.204	S	C	.	.	H	α-helix	trans	-57.5	-52.3	174.3	-175	176.3	10.9	0	0	111	I778 L782 V800 Q801 V806 L807 Q808	I778-Q804 HydrophobicContact CG2-CG 4.45Å; L782-Q804 HydrophobicContact CD1-CB 3.83Å; L782-Q804 HydrophobicContact CD1-CG 4.03Å; L782-Q804 HydrophobicContact CD2-CB 3.94Å; V800-Q804 WeakPolarHBondContact O-CB 3.3Å; V800-Q804 PolarHBondContact O-N 2.95Å; Q801-Q804 WeakPolarHBondContact O-CB 3.4Å; Q801-Q804 PolarHBondContact O-N 3.17Å; Q804-V806 PolarHBondContact O-N 3.24Å; Q804-L807 PolarHBondContact O-N 3.17Å; Q804-Q808 HydrophobicContact CG-CG 4.28Å; Q804-Q808 VanDerWaalsContact CG-NE2 3.29Å; Q804-Q808 VanDerWaalsContact NE2-NE2 3.2Å; Q804-Q808 VanDerWaalsContact O-CB 3.27Å; Q804-Q808 WeakPolarHBondContact O-CB 3.01Å; Q804-Q808 WeakPolarHBondContact O-CG 3.47Å; Q804-Q808 PolarHBondContact O-N 3.41Å
805	E	93.7	Very high	90.6	Very high	33 Å²	33	39.8 Å²	39.8	15%	0.154	21%	0.21	C	C	.	.	H	α-helix	trans	-57.5	-47.2	179.4	-71.5	175.4	-162.9	0	0	111.9	L762 Q801 K802 Q808 A809 K836	L762-E805 HydrophobicContact CD1-CB 4.29Å; L762-E805 HydrophobicContact CD1-CG 4.44Å; L762-E805 HydrophobicContact CD2-CB 3.83Å; L762-E805 HydrophobicContact CD2-CG 4.28Å; L762-E805 VanDerWaalsContact CD2-O 3.23Å; L762-E805 WeakPolarHBondContact CD2-O 2.99Å; Q801-E805 PolarHBondContact NE2-OE1 2.94Å; Q801-E805 WeakPolarHBondContact O-CG 3.34Å; Q801-E805 PolarHBondContact O-N 3.22Å; K802-E805 PolarHBondContact O-N 2.98Å; E805-Q808 PolarHBondContact O-N 3.01Å; E805-A809 WeakPolarHBondContact O-CB 3.39Å; E805-A809 PolarHBondContact O-N 2.59Å; E805-K836 VanDerWaalsContact OE2-CD 3.3Å; E805-K836 WeakPolarHBondContact OE2-CD 3.47Å; E805-K836 IonicContact OE2-NZ 2.57Å; E805-K836 PolarHBondContact OE2-NZ 3.02Å
806	V	96.4	Very high	90.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-47.3	179.4	170	0	0	0	0	112.3	K802 L803 Q804 Q808 A809 Y810 A827 L831 K836 A839 F840 L843	K802-V806 WeakPolarHBondContact O-CG2 3.39Å; K802-V806 PolarHBondContact O-N 2.99Å; L803-V806 PolarHBondContact O-N 3.15Å; Q804-V806 PolarHBondContact O-N 3.24Å; V806-Q808 VanDerWaalsContact C-N 3.34Å; V806-Q808 PolarHBondContact O-N 3.15Å; V806-A809 PolarHBondContact O-N 3.07Å; V806-Y810 PolarHBondContact O-N 2.63Å; V806-A827 HydrophobicContact CG1-CB 4.09Å; V806-L831 HydrophobicContact CG2-CD1 4.43Å; V806-L831 HydrophobicContact CG2-CD2 4.21Å; V806-K836 HydrophobicContact CG2-CB 4.24Å; V806-K836 VanDerWaalsContact CG2-O 3.23Å; V806-K836 WeakPolarHBondContact CG2-O 3.49Å; V806-A839 HydrophobicContact CG2-CB 4.38Å; V806-F840 HydrophobicContact CG1-CB 4.25Å; V806-F840 HydrophobicContact CG2-CB 4.47Å; V806-L843 HydrophobicContact CG1-CD2 4.18Å
807	L	94.7	Very high	91.1	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-67.7	-36.1	-179.4	-67.6	175.6	0	0	0	112.1	I778 L803 Q804 S811 Y819 M823 N824 A827 L843	I778-L807 HydrophobicContact CD1-CB 4.02Å; I778-L807 HydrophobicContact CG1-CB 4.19Å; I778-L807 HydrophobicContact CG2-CB 4.08Å; I778-L807 HydrophobicContact CG2-CD1 4.07Å; L803-L807 HydrophobicContact CD1-CD1 3.86Å; L803-L807 HydrophobicContact CD1-CG 4.07Å; L803-L807 HydrophobicContact CG-CD1 3.94Å; L803-L807 HydrophobicContact CG-CG 4.5Å; L803-L807 WeakPolarHBondContact O-CB 3.17Å; L803-L807 VanDerWaalsContact O-CG 3.26Å; L803-L807 WeakPolarHBondContact O-CG 3.19Å; L803-L807 PolarHBondContact O-N 3.11Å; Q804-L807 PolarHBondContact O-N 3.17Å; L807-S811 WeakPolarHBondContact O-CB 3.23Å; L807-S811 PolarHBondContact O-N 2.79Å; L807-Y819 HydrophobicContact CB-CD2 4.4Å; L807-Y819 HydrophobicContact CB-CE2 4.48Å; L807-Y819 HydrophobicContact CD1-CE2 3.83Å; L807-Y819 HydrophobicContact CD2-CD2 4.1Å; L807-Y819 HydrophobicContact CD2-CE2 3.78Å; L807-Y819 HydrophobicContact CG-CE2 4.24Å; L807-M823 HydrophobicContact CD2-CB 4.26Å; L807-N824 HydrophobicContact CD1-CB 3.99Å; L807-A827 HydrophobicContact CD2-CB 3.77Å; L807-A827 HydrophobicContact CG-CB 4.31Å; L807-L843 HydrophobicContact CD2-CD2 4.19Å
808	Q	91.8	Very high	91.1	Very high	23 Å²	23	35.9 Å²	35.9	11%	0.107	18%	0.182	C	C	.	.	H	α-helix	trans	-65.5	-49.1	175.5	-74.1	-179.5	-10.1	0	0	111.4	F765 I778 Q804 E805 V806 Y810 S811 I812	F765-Q808 HydrophobicContact CD1-CB 4.03Å; F765-Q808 HydrophobicContact CD1-CG 3.94Å; F765-Q808 HydrophobicContact CD2-CB 3.57Å; F765-Q808 HydrophobicContact CD2-CG 4.04Å; F765-Q808 WeakPolarHBondContact CD2-O 3.27Å; F765-Q808 HydrophobicContact CE1-CB 4.06Å; F765-Q808 HydrophobicContact CE1-CG 3.51Å; F765-Q808 VanDerWaalsContact CE1-NE2 3.31Å; F765-Q808 HydrophobicContact CE2-CB 3.63Å; F765-Q808 HydrophobicContact CE2-CG 3.64Å; F765-Q808 HydrophobicContact CG-CB 3.83Å; F765-Q808 HydrophobicContact CG-CG 4.23Å; F765-Q808 HydrophobicContact CZ-CB 3.92Å; F765-Q808 HydrophobicContact CZ-CG 3.4Å; I778-Q808 HydrophobicContact CD1-CG 4.03Å; Q804-Q808 HydrophobicContact CG-CG 4.28Å; Q804-Q808 VanDerWaalsContact CG-NE2 3.29Å; Q804-Q808 VanDerWaalsContact NE2-NE2 3.2Å; Q804-Q808 VanDerWaalsContact O-CB 3.27Å; Q804-Q808 WeakPolarHBondContact O-CB 3.01Å; Q804-Q808 WeakPolarHBondContact O-CG 3.47Å; Q804-Q808 PolarHBondContact O-N 3.41Å; E805-Q808 PolarHBondContact O-N 3.01Å; V806-Q808 VanDerWaalsContact C-N 3.34Å; V806-Q808 PolarHBondContact O-N 3.15Å; Q808-Y810 VanDerWaalsContact C-N 3.3Å; Q808-Y810 PolarHBondContact O-N 3.38Å; Q808-S811 PolarHBondContact O-N 2.72Å; Q808-S811 VanDerWaalsContact O-N 3.16Å; Q808-S811 PolarHBondContact O-OG 3.24Å; Q808-I812 PolarHBondContact O-N 2.8Å
809	A	93.2	Very high	91.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58	-43.5	176.1	0	0	0	0	0	111.6	Y758 L761 L762 E805 V806 S811 I812 H813 F840	Y758-A809 HydrophobicContact CD2-CB 3.73Å; Y758-A809 HydrophobicContact CE2-CB 3.51Å; L761-A809 HydrophobicContact CB-CB 4.12Å; L761-A809 HydrophobicContact CD1-CB 4.43Å; L762-A809 HydrophobicContact CD2-CB 4.01Å; E805-A809 WeakPolarHBondContact O-CB 3.39Å; E805-A809 PolarHBondContact O-N 2.59Å; V806-A809 PolarHBondContact O-N 3.07Å; A809-S811 PolarHBondContact O-N 3.5Å; A809-I812 PolarHBondContact O-N 2.86Å; A809-H813 WeakPolarHBondContact O-CB 3.45Å; A809-H813 PolarHBondContact O-N 2.95Å; A809-F840 HydrophobicContact CB-CD2 3.79Å; A809-F840 HydrophobicContact CB-CE2 3.79Å
810	Y	94.2	Very high	90.9	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-40.2	177	-176.3	-92.8	0	0	0	112.8	V806 Q808 I812 H813 N814 M823 L843 I844 L847	V806-Y810 PolarHBondContact O-N 2.63Å; Q808-Y810 VanDerWaalsContact C-N 3.3Å; Q808-Y810 PolarHBondContact O-N 3.38Å; Y810-I812 PolarHBondContact O-N 2.8Å; Y810-I812 VanDerWaalsContact O-N 3.13Å; Y810-H813 WeakPolarHBondContact O-CB 3.44Å; Y810-H813 PolarHBondContact O-N 2.9Å; Y810-H813 VanDerWaalsContact O-N 3.12Å; Y810-N814 PolarHBondContact O-N 3.07Å; Y810-N814 VanDerWaalsContact O-N 3.09Å; Y810-M823 HydrophobicContact CD1-SD 4.05Å; Y810-M823 HydrophobicContact CE1-CE 3.81Å; Y810-M823 HydrophobicContact CE1-SD 3.78Å; Y810-L843 HydrophobicContact CD1-CD2 4.26Å; Y810-L843 HydrophobicContact CD2-CD2 3.96Å; Y810-L843 HydrophobicContact CD2-CG 4.03Å; Y810-L843 HydrophobicContact CE2-CG 4.48Å; Y810-L843 HydrophobicContact CG-CD2 3.67Å; Y810-L843 HydrophobicContact CG-CG 4.22Å; Y810-I844 HydrophobicContact CD2-CG1 3.93Å; Y810-I844 HydrophobicContact CE2-CG1 4.04Å; Y810-L847 HydrophobicContact CD1-CD1 4.31Å; Y810-L847 HydrophobicContact CD2-CD1 4.43Å; Y810-L847 HydrophobicContact CE1-CD1 3.6Å; Y810-L847 HydrophobicContact CE2-CB 4.41Å; Y810-L847 HydrophobicContact CE2-CD1 3.75Å; Y810-L847 WeakPolarHBondContact OH-CD1 3.4Å
811	S	91.5	Very high	90.5	Very high	4 Å²	4	39.5 Å²	39.5	3%	0.028	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-24.4	-179.4	73.8	0	0	0	0	113.8	F765 L807 Q808 A809 S815	F765-S811 WeakPolarHBondContact CE2-OG 3.31Å; L807-S811 WeakPolarHBondContact O-CB 3.23Å; L807-S811 PolarHBondContact O-N 2.79Å; Q808-S811 PolarHBondContact O-N 2.72Å; Q808-S811 VanDerWaalsContact O-N 3.16Å; Q808-S811 PolarHBondContact O-OG 3.24Å; A809-S811 PolarHBondContact O-N 3.5Å; S811-S815 WeakPolarHBondContact O-CA 3.5Å
812	I	90.6	Very high	90.2	Very high	16 Å²	16	34.3 Å²	34.3	8%	0.082	17%	0.172	C	C	.	.	H	α-helix	trans	-89.1	-42.8	173.3	-63.2	176.9	0	0	0	110.7	L761 E764 F765 N768 A771 Q808 A809 Y810 N814 S815	L761-I812 HydrophobicContact CD2-CB 4.07Å; L761-I812 HydrophobicContact CD2-CG2 3.6Å; L761-I812 WeakPolarHBondContact O-CD1 3.15Å; E764-I812 HydrophobicContact CB-CD1 4.32Å; E764-I812 WeakPolarHBondContact OE1-CG2 3.47Å; F765-I812 HydrophobicContact CB-CD1 3.45Å; F765-I812 VanDerWaalsContact CB-CD1 3.45Å; F765-I812 HydrophobicContact CD2-CD1 3.58Å; F765-I812 HydrophobicContact CD2-CG1 3.93Å; F765-I812 HydrophobicContact CG-CD1 3.97Å; N768-I812 HydrophobicContact CB-CD1 4.4Å; A771-I812 HydrophobicContact CB-CD1 4.23Å; A771-I812 HydrophobicContact CB-CG1 4.25Å; Q808-I812 PolarHBondContact O-N 2.8Å; A809-I812 PolarHBondContact O-N 2.86Å; Y810-I812 PolarHBondContact O-N 2.8Å; Y810-I812 VanDerWaalsContact O-N 3.13Å; I812-N814 PolarHBondContact O-N 2.56Å; I812-N814 VanDerWaalsContact O-N 3.15Å; I812-S815 PolarHBondContact O-N 2.55Å
813	H	91.9	Very high	90.2	Very high	30 Å²	30	30.2 Å²	30.2	14%	0.139	15%	0.154	C	C	.	.	H	α-helix	trans	-46.3	-47.6	177.3	-179.9	86.6	0	0	0	111.8	Y757 L761 A809 Y810 F840 E848	Y757-H813 AromaticContact CE1-CE1 3.73Å; Y757-H813 AromaticContact CE1-ND1 3.23Å; Y757-H813 WeakPolarHBondContact CE1-ND1 3.3Å; Y757-H813 AromaticContact CZ-ND1 3.48Å; Y757-H813 PolarHBondContact OH-ND1 3.05Å; L761-H813 HydrophobicContact CD1-CB 4.19Å; A809-H813 WeakPolarHBondContact O-CB 3.45Å; A809-H813 PolarHBondContact O-N 2.95Å; Y810-H813 WeakPolarHBondContact O-CB 3.44Å; Y810-H813 PolarHBondContact O-N 2.9Å; Y810-H813 VanDerWaalsContact O-N 3.12Å; H813-F840 HydrophobicContact CB-CE2 4.16Å; H813-F840 HydrophobicContact CB-CZ 4.21Å; H813-F840 AromaticContact ND1-CZ 3.91Å; H813-E848 IonicContact CD2-OE1 3.21Å; H813-E848 PolarHBondContact CD2-OE1 2.83Å; H813-E848 IonicContact NE2-OE1 3.25Å; H813-E848 IonicContact NE2-OE2 3.88Å
814	N	89.5	Confident	90	Very high	33 Å²	33	30.2 Å²	30.2	18%	0.176	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.7	71.4	176.9	-166.1	-28.4	0	0	0	110.6	Y810 I812 K816 I817 G818 E848	Y810-N814 PolarHBondContact O-N 3.07Å; Y810-N814 VanDerWaalsContact O-N 3.09Å; I812-N814 PolarHBondContact O-N 2.56Å; I812-N814 VanDerWaalsContact O-N 3.15Å; N814-K816 PolarHBondContact O-N 2.88Å; N814-I817 PolarHBondContact O-N 3.31Å; N814-I817 VanDerWaalsContact O-N 3.07Å; N814-I817 PolarHBondContact OD1-N 3.06Å; N814-G818 WeakPolarHBondContact O-CA 3.23Å; N814-G818 PolarHBondContact O-N 2.98Å; N814-E848 PolarHBondContact ND2-OE1 2.95Å
815	S	84.4	Confident	90.1	Very high	73 Å²	73	28.9 Å²	28.9	51%	0.51	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-17.2	-179.3	59.5	0	0	0	0	115.1	S811 I812	S811-S815 WeakPolarHBondContact O-CA 3.5Å; I812-S815 PolarHBondContact O-N 2.55Å
816	K	83.6	Confident	90.3	Very high	158 Å²	158	27.3 Å²	27.3	69%	0.687	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-38.8	174.1	-178.4	-174.9	173	-166.1	0	111.8	N814 E853	N814-K816 PolarHBondContact O-N 2.88Å; K816-E853 IonicContact NZ-OE1 2.85Å
817	I	85.8	Confident	90.3	Very high	34 Å²	34	27.3 Å²	27.3	17%	0.174	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-42.6	176.1	-63	176.9	0	0	0	109.9	N814 Y819 M823 F856	N814-I817 PolarHBondContact O-N 3.31Å; N814-I817 VanDerWaalsContact O-N 3.07Å; N814-I817 PolarHBondContact OD1-N 3.06Å; I817-Y819 PolarHBondContact O-N 3.44Å; I817-M823 HydrophobicContact CG2-CE 3.63Å; I817-F856 HydrophobicContact CG2-CB 4.02Å
818	G	87.2	Confident	90.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.139	C	C	.	.			trans	66.8	-122.1	-174.7	0	0	0	0	0	111	N814	N814-G818 WeakPolarHBondContact O-CA 3.23Å; N814-G818 PolarHBondContact O-N 2.98Å
819	Y	89.9	Confident	90.6	Very high	14 Å²	14	26.1 Å²	26.1	6%	0.055	13%	0.134	C	C	.	.			trans	-112.7	127	173.5	176.2	-99.6	0	0	0	111.1	H774 Q777 I778 D781 L807 I817 M823 N824	H774-Y819 PolarHBondContact CE1-N 2.96Å; H774-Y819 PolarHBondContact ND1-N 3.27Å; Q777-Y819 HydrophobicContact CB-CD1 4.1Å; Q777-Y819 HydrophobicContact CB-CE1 4.3Å; Q777-Y819 HydrophobicContact CG-CD1 3.83Å; Q777-Y819 HydrophobicContact CG-CE1 3.7Å; I778-Y819 HydrophobicContact CD1-CD2 4.4Å; I778-Y819 HydrophobicContact CD1-CG 4.27Å; I778-Y819 HydrophobicContact CG1-CD1 3.91Å; I778-Y819 HydrophobicContact CG1-CD2 3.81Å; I778-Y819 HydrophobicContact CG1-CE1 4.3Å; I778-Y819 HydrophobicContact CG1-CE2 4.2Å; I778-Y819 HydrophobicContact CG1-CG 3.65Å; D781-Y819 WeakPolarHBondContact CB-OH 3.48Å; D781-Y819 WeakPolarHBondContact OD2-CE1 3.33Å; D781-Y819 PolarHBondContact OD2-OH 3.12Å; L807-Y819 HydrophobicContact CB-CD2 4.4Å; L807-Y819 HydrophobicContact CB-CE2 4.48Å; L807-Y819 HydrophobicContact CD1-CE2 3.83Å; L807-Y819 HydrophobicContact CD2-CD2 4.1Å; L807-Y819 HydrophobicContact CD2-CE2 3.78Å; L807-Y819 HydrophobicContact CG-CE2 4.24Å; I817-Y819 PolarHBondContact O-N 3.44Å; Y819-M823 HydrophobicContact CD2-CB 4.27Å; Y819-M823 HydrophobicContact CD2-SD 4.38Å; Y819-M823 HydrophobicContact CE2-CB 3.95Å; Y819-N824 WeakPolarHBondContact OH-CB 3.48Å; Y819-N824 PolarHBondContact OH-OD1 3.43Å
820	C	86.9	Confident	90.7	Very high	30 Å²	30	26.1 Å²	26.1	20%	0.203	13%	0.134	C	C	.	.			trans	-113.9	136.8	171.4	-169.8	0	0	0	0	110.4	G822 M823 F856	C820-G822 PolarHBondContact O-N 2.96Å; C820-M823 HydrophobicContact CB-CE 3.74Å; C820-M823 HydrophobicContact CB-CG 4.43Å; C820-M823 HydrophobicContact CB-SD 4.14Å; C820-M823 PolarHBondContact N-SD 3.15Å; C820-M823 VanDerWaalsContact N-SD 3.37Å; C820-M823 WeakPolarHBondContact O-CB 3.32Å; C820-M823 VanDerWaalsContact O-CG 3.23Å; C820-M823 WeakPolarHBondContact O-CG 3.32Å; C820-M823 PolarHBondContact O-N 3.49Å; C820-M823 VanDerWaalsContact O-N 3.13Å; C820-F856 HydrophobicContact CB-CB 3.98Å; C820-F856 HydrophobicContact CB-CD1 3.87Å; C820-F856 HydrophobicContact CB-CG 4.39Å
821	Q	81.4	Confident	90.9	Very high	116 Å²	116	26.5 Å²	26.5	54%	0.542	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	127.8	179.5	-171.7	179.5	-0.7	0	0	110.3
822	G	84.6	Confident	91	Very high	8 Å²	8	27.7 Å²	27.7	8%	0.082	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	114.8	-29.4	-172.2	0	0	0	0	0	112.9	C820 N824 F825	C820-G822 PolarHBondContact O-N 2.96Å; G822-N824 VanDerWaalsContact C-OD1 3.29Å; G822-N824 VanDerWaalsContact CA-OD1 3.27Å; G822-N824 WeakPolarHBondContact CA-OD1 3.45Å; G822-N824 PolarHBondContact N-OD1 2.93Å; G822-N824 PolarHBondContact O-N 3.15Å; G822-F825 PolarHBondContact O-N 3.43Å; G822-F825 VanDerWaalsContact O-N 3.15Å
823	M	93.3	Very high	91.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.5	-30.3	175.1	-67.3	178.8	174.3	0	0	112.6	L807 Y810 I817 Y819 C820 F825 I826 A827 L847 F856	L807-M823 HydrophobicContact CD2-CB 4.26Å; Y810-M823 HydrophobicContact CD1-SD 4.05Å; Y810-M823 HydrophobicContact CE1-CE 3.81Å; Y810-M823 HydrophobicContact CE1-SD 3.78Å; I817-M823 HydrophobicContact CG2-CE 3.63Å; Y819-M823 HydrophobicContact CD2-CB 4.27Å; Y819-M823 HydrophobicContact CD2-SD 4.38Å; Y819-M823 HydrophobicContact CE2-CB 3.95Å; C820-M823 HydrophobicContact CB-CE 3.74Å; C820-M823 HydrophobicContact CB-CG 4.43Å; C820-M823 HydrophobicContact CB-SD 4.14Å; C820-M823 PolarHBondContact N-SD 3.15Å; C820-M823 VanDerWaalsContact N-SD 3.37Å; C820-M823 WeakPolarHBondContact O-CB 3.32Å; C820-M823 VanDerWaalsContact O-CG 3.23Å; C820-M823 WeakPolarHBondContact O-CG 3.32Å; C820-M823 PolarHBondContact O-N 3.49Å; C820-M823 VanDerWaalsContact O-N 3.13Å; M823-F825 PolarHBondContact O-N 3.35Å; M823-I826 PolarHBondContact O-N 3.1Å; M823-A827 PolarHBondContact O-N 2.82Å; M823-L847 HydrophobicContact CE-CD1 3.77Å; M823-L847 HydrophobicContact CG-CD1 4.07Å; M823-L847 HydrophobicContact SD-CD1 3.99Å; M823-F856 HydrophobicContact CE-CB 3.42Å; M823-F856 VanDerWaalsContact CE-CB 3.42Å; M823-F856 HydrophobicContact CE-CD1 3.9Å; M823-F856 HydrophobicContact CE-CD2 4.24Å; M823-F856 HydrophobicContact CE-CG 3.59Å; M823-F856 HydrophobicContact CG-CD1 4.09Å; M823-F856 HydrophobicContact CG-CE1 4.14Å
824	N	93.8	Very high	91.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-54.5	-38.6	174.4	58.7	-54.8	0	0	0	112.9	D781 T785 L807 Y819 G822 A828	D781-N824 HydrophobicContact CB-CB 4.34Å; T785-N824 HydrophobicContact CG2-CB 4.39Å; T785-N824 PolarHBondContact OG1-ND2 3.5Å; L807-N824 HydrophobicContact CD1-CB 3.99Å; Y819-N824 WeakPolarHBondContact OH-CB 3.48Å; Y819-N824 PolarHBondContact OH-OD1 3.43Å; G822-N824 VanDerWaalsContact C-OD1 3.29Å; G822-N824 VanDerWaalsContact CA-OD1 3.27Å; G822-N824 WeakPolarHBondContact CA-OD1 3.45Å; G822-N824 PolarHBondContact N-OD1 2.93Å; G822-N824 PolarHBondContact O-N 3.15Å; N824-A828 VanDerWaalsContact O-CB 3.23Å; N824-A828 WeakPolarHBondContact O-CB 3.2Å; N824-A828 PolarHBondContact O-N 3.2Å
825	F	94.7	Very high	91.7	Very high	30 Å²	30	31.7 Å²	31.7	13%	0.132	15%	0.154	C	C	.	.	H	α-helix	trans	-71.7	-40.5	-179.3	-61	-56.3	0	0	0	112	T785 G822 M823 A828 V829 Y905	T785-F825 HydrophobicContact CG2-CD1 3.91Å; T785-F825 HydrophobicContact CG2-CE1 4.28Å; G822-F825 PolarHBondContact O-N 3.43Å; G822-F825 VanDerWaalsContact O-N 3.15Å; M823-F825 PolarHBondContact O-N 3.35Å; F825-A828 PolarHBondContact O-N 3.48Å; F825-V829 WeakPolarHBondContact O-CG2 3.45Å; F825-V829 PolarHBondContact O-N 2.8Å; F825-Y905 HydrophobicContact CB-CD1 3.51Å; F825-Y905 HydrophobicContact CB-CE1 4.05Å; F825-Y905 HydrophobicContact CB-CG 3.93Å; F825-Y905 AromaticContact CD1-CD1 3.41Å; F825-Y905 HydrophobicContact CD1-CD1 3.41Å; F825-Y905 VanDerWaalsContact CD1-CD1 3.41Å; F825-Y905 AromaticContact CD1-CE1 3.04Å; F825-Y905 HydrophobicContact CD1-CE1 3.04Å; F825-Y905 HydrophobicContact CD1-CG 4.45Å; F825-Y905 AromaticContact CD1-CZ 3.89Å; F825-Y905 HydrophobicContact CD2-CD1 4.21Å; F825-Y905 HydrophobicContact CE1-CD1 4.12Å; F825-Y905 AromaticContact CE1-CE1 3.49Å; F825-Y905 HydrophobicContact CE1-CE1 3.49Å; F825-Y905 VanDerWaalsContact CE1-CE1 3.49Å; F825-Y905 AromaticContact CG-CD1 3.45Å; F825-Y905 HydrophobicContact CG-CD1 3.45Å; F825-Y905 VanDerWaalsContact CG-CD1 3.45Å; F825-Y905 AromaticContact CG-CE1 3.65Å; F825-Y905 HydrophobicContact CG-CE1 3.65Å; F825-Y905 HydrophobicContact CG-CG 4.36Å; F825-Y905 HydrophobicContact CZ-CE1 4.38Å
826	I	96	Very high	92.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.1	-49.4	175.5	-58.4	174.7	0	0	0	109.8	M823 A828 V829 A830 L843 I846 L847 F856 V903 W917	M823-I826 PolarHBondContact O-N 3.1Å; I826-A828 VanDerWaalsContact C-N 3.33Å; I826-A828 PolarHBondContact O-N 3.02Å; I826-V829 PolarHBondContact O-N 3.45Å; I826-A830 PolarHBondContact O-N 2.87Å; I826-L843 HydrophobicContact CB-CD1 4.02Å; I826-L843 HydrophobicContact CG2-CD1 3.79Å; I826-I846 HydrophobicContact CD1-CG2 4.21Å; I826-I846 HydrophobicContact CG2-CB 4.39Å; I826-I846 HydrophobicContact CG2-CD1 3.56Å; I826-I846 HydrophobicContact CG2-CG2 4.17Å; I826-L847 HydrophobicContact CD1-CD2 4.01Å; I826-F856 HydrophobicContact CD1-CZ 4.08Å; I826-V903 HydrophobicContact CD1-CG2 4.22Å; I826-V903 HydrophobicContact CG1-CG2 4.28Å; I826-W917 HydrophobicContact CG2-CH2 3.84Å; I826-W917 HydrophobicContact CG2-CZ2 4.34Å; I826-W917 WeakPolarHBondContact O-CH2 3.17Å
827	A	97.3	Very high	92.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.8	-39.9	178.8	0	0	0	0	0	112.3	L803 V806 L807 M823 A830 L831 L843	L803-A827 HydrophobicContact CD1-CB 3.56Å; V806-A827 HydrophobicContact CG1-CB 4.09Å; L807-A827 HydrophobicContact CD2-CB 3.77Å; L807-A827 HydrophobicContact CG-CB 4.31Å; M823-A827 PolarHBondContact O-N 2.82Å; A827-A830 PolarHBondContact O-N 2.7Å; A827-L831 WeakPolarHBondContact O-CB 3.44Å; A827-L831 VanDerWaalsContact O-CG 3.32Å; A827-L831 WeakPolarHBondContact O-CG 3.23Å; A827-L831 PolarHBondContact O-N 3.31Å; A827-L843 HydrophobicContact CB-CD2 4.33Å
828	A	96.5	Very high	93.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.7	-42.8	177.6	0	0	0	0	0	112.5	T785 M786 F792 L803 N824 F825 I826 A830 L831 L832	T785-A828 HydrophobicContact CG2-CB 3.48Å; T785-A828 VanDerWaalsContact CG2-CB 3.48Å; M786-A828 HydrophobicContact CE-CB 4.02Å; M786-A828 HydrophobicContact CG-CB 4.43Å; M786-A828 HydrophobicContact SD-CB 3.89Å; F792-A828 HydrophobicContact CE1-CB 4.36Å; F792-A828 HydrophobicContact CE2-CB 4.44Å; F792-A828 HydrophobicContact CZ-CB 4.08Å; L803-A828 HydrophobicContact CD1-CB 4.25Å; L803-A828 HydrophobicContact CD2-CB 4.45Å; N824-A828 VanDerWaalsContact O-CB 3.23Å; N824-A828 WeakPolarHBondContact O-CB 3.2Å; N824-A828 PolarHBondContact O-N 3.2Å; F825-A828 PolarHBondContact O-N 3.48Å; I826-A828 VanDerWaalsContact C-N 3.33Å; I826-A828 PolarHBondContact O-N 3.02Å; A828-A830 VanDerWaalsContact C-N 3.34Å; A828-A830 PolarHBondContact O-N 3.03Å; A828-L831 PolarHBondContact O-N 2.87Å; A828-L832 PolarHBondContact O-N 3.28Å
829	V	95.7	Very high	93.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62	-43.4	174.7	175.9	0	0	0	0	110.8	W738 M786 F825 I826 L831 L832 F833 Y905 L913 W917	W738-V829 HydrophobicContact CH2-CG1 4.43Å; M786-V829 HydrophobicContact CE-CB 4.21Å; M786-V829 HydrophobicContact CE-CG2 3.38Å; F825-V829 WeakPolarHBondContact O-CG2 3.45Å; F825-V829 PolarHBondContact O-N 2.8Å; I826-V829 PolarHBondContact O-N 3.45Å; V829-L831 VanDerWaalsContact C-N 3.33Å; V829-L831 PolarHBondContact O-N 2.97Å; V829-L832 PolarHBondContact O-N 3.34Å; V829-F833 WeakPolarHBondContact O-CD2 3.44Å; V829-Y905 HydrophobicContact CG2-CD2 3.7Å; V829-Y905 HydrophobicContact CG2-CE2 4.39Å; V829-Y905 HydrophobicContact CG2-CG 4.41Å; V829-L913 HydrophobicContact CG2-CD2 4Å; V829-W917 HydrophobicContact CB-CH2 3.66Å; V829-W917 HydrophobicContact CB-CZ2 3.71Å; V829-W917 HydrophobicContact CB-CZ3 4.18Å; V829-W917 HydrophobicContact CG1-CD2 3.79Å; V829-W917 HydrophobicContact CG1-CE3 3.81Å; V829-W917 HydrophobicContact CG1-CH2 3.66Å; V829-W917 HydrophobicContact CG1-CZ2 3.64Å; V829-W917 HydrophobicContact CG1-CZ3 3.74Å; V829-W917 HydrophobicContact CG2-CZ2 4.21Å
830	A	97	Very high	94.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.9	-43	176.1	0	0	0	0	0	111.9	I826 A827 A828 L832 F833 L834 A839 C842	I826-A830 PolarHBondContact O-N 2.87Å; A827-A830 PolarHBondContact O-N 2.7Å; A828-A830 VanDerWaalsContact C-N 3.34Å; A828-A830 PolarHBondContact O-N 3.03Å; A830-L832 PolarHBondContact O-N 2.97Å; A830-F833 PolarHBondContact O-N 3.41Å; A830-F833 VanDerWaalsContact O-N 3.14Å; A830-L834 HydrophobicContact CB-CD1 4.44Å; A830-L834 VanDerWaalsContact O-CB 3.28Å; A830-L834 WeakPolarHBondContact O-CB 3.44Å; A830-L834 PolarHBondContact O-N 3.36Å; A830-A839 HydrophobicContact CB-CB 3.85Å; A830-C842 HydrophobicContact CB-CB 3.98Å
831	L	97	Very high	94.7	Very high	11 Å²	11	23.9 Å²	23.9	6%	0.058	11%	0.107	C	C	.	.	H	α-helix	trans	-66.5	-19	-179.7	-79.1	170.2	0	0	0	114.9	F792 K802 L803 V806 A827 A828 V829 F833 K836 A839	F792-L831 HydrophobicContact CZ-CB 4.21Å; K802-L831 HydrophobicContact CB-CD1 4.08Å; K802-L831 HydrophobicContact CB-CD2 3.93Å; L803-L831 VanDerWaalsContact CA-CD1 3.43Å; L803-L831 HydrophobicContact CB-CD1 3.85Å; L803-L831 HydrophobicContact CD1-CD1 4.12Å; V806-L831 HydrophobicContact CG2-CD1 4.43Å; V806-L831 HydrophobicContact CG2-CD2 4.21Å; A827-L831 WeakPolarHBondContact O-CB 3.44Å; A827-L831 VanDerWaalsContact O-CG 3.32Å; A827-L831 WeakPolarHBondContact O-CG 3.23Å; A827-L831 PolarHBondContact O-N 3.31Å; A828-L831 PolarHBondContact O-N 2.87Å; V829-L831 VanDerWaalsContact C-N 3.33Å; V829-L831 PolarHBondContact O-N 2.97Å; L831-F833 VanDerWaalsContact C-N 3.27Å; L831-F833 PolarHBondContact O-N 2.84Å; L831-K836 HydrophobicContact CD2-CB 4.24Å; L831-A839 HydrophobicContact CD2-CB 3.71Å; L831-A839 HydrophobicContact CG-CB 3.86Å
832	L	94.3	Very high	95.5	Very high	28 Å²	28	18.3 Å²	18.3	15%	0.147	8%	0.082	C	C	.	.	H	α-helix	trans	-69.8	-25.7	173.5	-70.4	177.2	0	0	0	112.6	F669 M786 F792 A828 V829 A830 F910	F669-L832 HydrophobicContact CE2-CD1 4.31Å; F669-L832 HydrophobicContact CZ-CD1 4.22Å; M786-L832 HydrophobicContact CE-CD1 3.81Å; M786-L832 HydrophobicContact SD-CD1 3.81Å; M786-L832 HydrophobicContact SD-CG 4.3Å; F792-L832 HydrophobicContact CE2-CD2 3.84Å; F792-L832 HydrophobicContact CE2-CG 4.32Å; A828-L832 PolarHBondContact O-N 3.28Å; V829-L832 PolarHBondContact O-N 3.34Å; A830-L832 PolarHBondContact O-N 2.97Å; L832-F910 HydrophobicContact CD1-CE2 3.78Å; L832-F910 HydrophobicContact CD1-CZ 3.48Å; L832-F910 VanDerWaalsContact CD1-CZ 3.48Å
833	F	94.1	Very high	96.1	Very high	21 Å²	21	18 Å²	18	9%	0.092	8%	0.078	C	C	.	.	H	α-helix	trans	-122.3	-17.7	-174.3	-58.6	-74.6	0	0	0	113.9	Y667 R734 E735 W738 V829 A830 L831 F910 I914	Y667-F833 AromaticContact CD1-CE1 3.79Å; Y667-F833 HydrophobicContact CD1-CE1 3.79Å; Y667-F833 AromaticContact CD1-CZ 3.69Å; Y667-F833 HydrophobicContact CD1-CZ 3.69Å; Y667-F833 AromaticContact CE1-CE1 3.73Å; Y667-F833 HydrophobicContact CE1-CE1 3.73Å; Y667-F833 AromaticContact CE1-CZ 3.74Å; Y667-F833 HydrophobicContact CE1-CZ 3.74Å; R734-F833 HydrophobicContact CG-CD1 4.4Å; E735-F833 VanDerWaalsContact CB-O 3.22Å; E735-F833 WeakPolarHBondContact CB-O 3.35Å; E735-F833 WeakPolarHBondContact CG-O 3.39Å; W738-F833 HydrophobicContact CE3-CB 4.06Å; W738-F833 HydrophobicContact CE3-CD2 4.24Å; W738-F833 HydrophobicContact CE3-CG 4.4Å; W738-F833 AromaticContact CH2-CD2 3.64Å; W738-F833 HydrophobicContact CH2-CD2 3.64Å; W738-F833 AromaticContact CH2-CE2 3.95Å; W738-F833 HydrophobicContact CH2-CE2 3.95Å; W738-F833 HydrophobicContact CH2-CG 4.37Å; W738-F833 HydrophobicContact CZ3-CB 4.08Å; W738-F833 AromaticContact CZ3-CD2 3.43Å; W738-F833 HydrophobicContact CZ3-CD2 3.43Å; W738-F833 VanDerWaalsContact CZ3-CD2 3.43Å; W738-F833 HydrophobicContact CZ3-CE2 4.19Å; W738-F833 HydrophobicContact CZ3-CG 4.01Å; V829-F833 WeakPolarHBondContact O-CD2 3.44Å; A830-F833 PolarHBondContact O-N 3.41Å; A830-F833 VanDerWaalsContact O-N 3.14Å; L831-F833 VanDerWaalsContact C-N 3.27Å; L831-F833 PolarHBondContact O-N 2.84Å; F833-F910 HydrophobicContact CE2-CE1 4.48Å; F833-F910 HydrophobicContact CE2-CZ 4.03Å; F833-F910 HydrophobicContact CZ-CE1 4.09Å; F833-F910 HydrophobicContact CZ-CZ 4.09Å; F833-I914 HydrophobicContact CE2-CG2 3.84Å; F833-I914 HydrophobicContact CZ-CG2 3.76Å
834	L	96.2	Very high	96.2	Very high	9 Å²	9	18 Å²	18	5%	0.047	8%	0.078	C	C	.	.	S	Bend	trans	-123.1	150.2	-174.5	-57.7	176.1	0	0	0	110.7	E735 W738 R739 I742 A830 D838 A839 C842	E735-L834 HydrophobicContact CG-CD2 4.39Å; W738-L834 HydrophobicContact CB-CD2 4.16Å; R739-L834 HydrophobicContact CB-CD2 4.19Å; I742-L834 HydrophobicContact CD1-CD1 3.7Å; A830-L834 HydrophobicContact CB-CD1 4.44Å; A830-L834 VanDerWaalsContact O-CB 3.28Å; A830-L834 WeakPolarHBondContact O-CB 3.44Å; A830-L834 PolarHBondContact O-N 3.36Å; L834-D838 HydrophobicContact CB-CB 3.97Å; L834-A839 HydrophobicContact CB-CB 4.29Å; L834-C842 HydrophobicContact CD1-CB 3.78Å
835	R	95.4	Very high	96.4	Very high	133 Å²	133	18 Å²	18	50%	0.502	8%	0.078	S	C	.	.			trans	-65.1	157.9	170.3	-59	175.7	-60.4	167.3	5.7	110	R739 E837 D838 A839	R739-R835 VanDerWaalsContact CZ-NH2 3.29Å; R835-E837 VanDerWaalsContact C-N 3.29Å; R835-E837 PolarHBondContact O-N 3.38Å; R835-E837 VanDerWaalsContact O-N 3.14Å; R835-D838 IonicContact CZ-OD2 2.62Å; R835-D838 VanDerWaalsContact CZ-OD2 3.31Å; R835-D838 IonicContact NE-OD2 2.68Å; R835-D838 PolarHBondContact NE-OD2 3Å; R835-D838 IonicContact NH2-OD1 3.14Å; R835-D838 IonicContact NH2-OD2 2.83Å; R835-D838 PolarHBondContact NH2-OD2 3.45Å; R835-D838 CarbonylContact O-C 3.55Å; R835-D838 PolarHBondContact O-N 3.35Å; R835-A839 WeakPolarHBondContact O-CB 3.28Å; R835-A839 PolarHBondContact O-N 3.2Å
836	K	95.4	Very high	96.5	Very high	76 Å²	76	16.6 Å²	16.6	33%	0.33	7%	0.072	S	C	.	.	H	α-helix	trans	-51.9	-42.3	-173.8	62.3	175.6	-171.9	171.5	0	114.6	Y758 E805 V806 L831 A839 F840	Y758-K836 HydrophobicContact CE1-CD 4.12Å; Y758-K836 HydrophobicContact CE1-CG 4.08Å; E805-K836 VanDerWaalsContact OE2-CD 3.3Å; E805-K836 WeakPolarHBondContact OE2-CD 3.47Å; E805-K836 IonicContact OE2-NZ 2.57Å; E805-K836 PolarHBondContact OE2-NZ 3.02Å; V806-K836 HydrophobicContact CG2-CB 4.24Å; V806-K836 VanDerWaalsContact CG2-O 3.23Å; V806-K836 WeakPolarHBondContact CG2-O 3.49Å; L831-K836 HydrophobicContact CD2-CB 4.24Å; K836-A839 PolarHBondContact O-N 3.41Å; K836-F840 PolarHBondContact O-N 2.96Å
837	E	96.2	Very high	96.4	Very high	62 Å²	62	16.9 Å²	16.9	29%	0.29	7%	0.073	S	C	.	.	H	α-helix	trans	-69.6	-44.1	177.4	-177	178.9	177.3	0	0	111.9	Y758 R835 A839 F840 W841	Y758-E837 HydrophobicContact CD1-CB 3.95Å; Y758-E837 HydrophobicContact CD1-CG 4.1Å; Y758-E837 HydrophobicContact CE1-CB 4.36Å; Y758-E837 HydrophobicContact CG-CB 4.33Å; Y758-E837 HydrophobicContact CG-CG 4.09Å; R835-E837 VanDerWaalsContact C-N 3.29Å; R835-E837 PolarHBondContact O-N 3.38Å; R835-E837 VanDerWaalsContact O-N 3.14Å; E837-A839 VanDerWaalsContact C-N 3.28Å; E837-A839 PolarHBondContact O-N 3.37Å; E837-F840 WeakPolarHBondContact O-CB 3.4Å; E837-F840 PolarHBondContact O-N 3.4Å; E837-F840 VanDerWaalsContact O-N 3.16Å; E837-W841 PolarHBondContact O-N 3.37Å
838	D	97.2	Very high	96.2	Very high	4 Å²	4	19.7 Å²	19.7	2%	0.021	9%	0.086	C	C	.	.	H	α-helix	trans	-64.2	-34.6	176.4	-66.5	-55.9	0	0	0	111.2	R739 H743 L834 R835 W841 C842	R739-D838 IonicContact CZ-OD1 3.77Å; R739-D838 IonicContact NE-OD1 2.81Å; R739-D838 PolarHBondContact NE-OD1 3.07Å; R739-D838 IonicContact NE-OD2 3.93Å; R739-D838 PolarHBondContact NE-OD2 2.83Å; H743-D838 IonicContact CD2-OD1 2.8Å; H743-D838 IonicContact CE1-OD1 3.15Å; H743-D838 PolarHBondContact CE1-OD1 3.4Å; H743-D838 VanDerWaalsContact CE1-OD1 3.31Å; H743-D838 IonicContact NE2-OD1 3.37Å; H743-D838 PolarHBondContact NE2-OD1 3.37Å; L834-D838 HydrophobicContact CB-CB 3.97Å; R835-D838 IonicContact CZ-OD2 2.62Å; R835-D838 VanDerWaalsContact CZ-OD2 3.31Å; R835-D838 IonicContact NE-OD2 2.68Å; R835-D838 PolarHBondContact NE-OD2 3Å; R835-D838 IonicContact NH2-OD1 3.14Å; R835-D838 IonicContact NH2-OD2 2.83Å; R835-D838 PolarHBondContact NH2-OD2 3.45Å; R835-D838 CarbonylContact O-C 3.55Å; R835-D838 PolarHBondContact O-N 3.35Å; D838-W841 PolarHBondContact O-N 3.22Å; D838-C842 WeakPolarHBondContact O-CB 3.22Å; D838-C842 PolarHBondContact O-N 2.79Å
839	A	97.7	Very high	96.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-68.3	-34.7	173.5	0	0	0	0	0	112.6	V806 A830 L831 L834 R835 K836 E837 C842 L843	V806-A839 HydrophobicContact CG2-CB 4.38Å; A830-A839 HydrophobicContact CB-CB 3.85Å; L831-A839 HydrophobicContact CD2-CB 3.71Å; L831-A839 HydrophobicContact CG-CB 3.86Å; L834-A839 HydrophobicContact CB-CB 4.29Å; R835-A839 WeakPolarHBondContact O-CB 3.28Å; R835-A839 PolarHBondContact O-N 3.2Å; K836-A839 PolarHBondContact O-N 3.41Å; E837-A839 VanDerWaalsContact C-N 3.28Å; E837-A839 PolarHBondContact O-N 3.37Å; A839-C842 WeakPolarHBondContact O-CB 3.46Å; A839-C842 PolarHBondContact O-N 3.29Å; A839-L843 WeakPolarHBondContact O-CB 3.43Å; A839-L843 PolarHBondContact O-N 2.84Å
840	F	97.7	Very high	96	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.2	-46.6	170.4	162.8	-99.8	0	0	0	111.7	Y757 Y758 L761 V806 A809 H813 K836 E837 C842 L843 I844	Y757-F840 HydrophobicContact CD1-CE1 4.21Å; Y757-F840 HydrophobicContact CD1-CZ 4.38Å; Y757-F840 HydrophobicContact CE1-CE1 4.36Å; Y757-F840 HydrophobicContact CE1-CZ 4.14Å; Y758-F840 HydrophobicContact CD2-CB 3.67Å; Y758-F840 AromaticContact CD2-CD1 3.59Å; Y758-F840 HydrophobicContact CD2-CD1 3.59Å; Y758-F840 AromaticContact CD2-CD2 3.89Å; Y758-F840 HydrophobicContact CD2-CD2 3.89Å; Y758-F840 HydrophobicContact CD2-CE1 4.13Å; Y758-F840 HydrophobicContact CD2-CE2 4.4Å; Y758-F840 AromaticContact CD2-CG 3.43Å; Y758-F840 HydrophobicContact CD2-CG 3.43Å; Y758-F840 VanDerWaalsContact CD2-CG 3.43Å; Y758-F840 HydrophobicContact CD2-CZ 4.49Å; Y758-F840 HydrophobicContact CE2-CB 3.64Å; Y758-F840 HydrophobicContact CE2-CD1 4.41Å; Y758-F840 HydrophobicContact CE2-CD2 4.12Å; Y758-F840 AromaticContact CE2-CG 3.82Å; Y758-F840 HydrophobicContact CE2-CG 3.82Å; Y758-F840 HydrophobicContact CG-CD1 4.25Å; Y758-F840 HydrophobicContact CG-CG 4.45Å; L761-F840 HydrophobicContact CD1-CE1 4.31Å; L761-F840 HydrophobicContact CD1-CE2 3.93Å; L761-F840 HydrophobicContact CD1-CZ 3.42Å; L761-F840 VanDerWaalsContact CD1-CZ 3.42Å; V806-F840 HydrophobicContact CG1-CB 4.25Å; V806-F840 HydrophobicContact CG2-CB 4.47Å; A809-F840 HydrophobicContact CB-CD2 3.79Å; A809-F840 HydrophobicContact CB-CE2 3.79Å; H813-F840 HydrophobicContact CB-CE2 4.16Å; H813-F840 HydrophobicContact CB-CZ 4.21Å; H813-F840 AromaticContact ND1-CZ 3.91Å; K836-F840 PolarHBondContact O-N 2.96Å; E837-F840 WeakPolarHBondContact O-CB 3.4Å; E837-F840 PolarHBondContact O-N 3.4Å; E837-F840 VanDerWaalsContact O-N 3.16Å; F840-C842 VanDerWaalsContact C-N 3.31Å; F840-C842 PolarHBondContact O-N 2.94Å; F840-L843 WeakPolarHBondContact O-CB 3.47Å; F840-L843 PolarHBondContact O-N 2.9Å; F840-I844 HydrophobicContact CD1-CD1 4.05Å; F840-I844 HydrophobicContact CD2-CD1 4.34Å; F840-I844 HydrophobicContact CE1-CD1 3.47Å; F840-I844 VanDerWaalsContact CE1-CD1 3.47Å; F840-I844 HydrophobicContact CE2-CD1 3.79Å; F840-I844 HydrophobicContact CE2-CG1 4.47Å; F840-I844 HydrophobicContact CG-CD1 4.47Å; F840-I844 HydrophobicContact CZ-CD1 3.34Å; F840-I844 HydrophobicContact CZ-CG1 4.43Å; F840-I844 PolarHBondContact O-N 2.82Å
841	W	97.8	Very high	95.8	Very high	3 Å²	3	26.9 Å²	26.9	1%	0.011	11%	0.114	C	C	.	.	H	α-helix	trans	-64.8	-36.2	174.2	-67	117	0	0	0	112.2	I742 L746 L749 M750 K753 Y757 E837 D838 L843 I844 A845	I742-W841 HydrophobicContact CG2-CB 4.16Å; L746-W841 HydrophobicContact CD1-CB 4.15Å; L746-W841 HydrophobicContact CD1-CE3 4.01Å; L746-W841 WeakPolarHBondContact CD1-O 3.1Å; L749-W841 HydrophobicContact CD2-CZ3 4.3Å; L749-W841 HydrophobicContact CG-CZ3 4.42Å; M750-W841 HydrophobicContact CE-CD2 4.09Å; M750-W841 HydrophobicContact CE-CG 4.04Å; M750-W841 HydrophobicContact CE-CZ2 4.49Å; M750-W841 HydrophobicContact CG-CD2 3.95Å; M750-W841 HydrophobicContact CG-CE3 3.86Å; M750-W841 HydrophobicContact CG-CH2 3.96Å; M750-W841 HydrophobicContact CG-CZ2 4.06Å; M750-W841 HydrophobicContact CG-CZ3 3.87Å; M750-W841 HydrophobicContact SD-CD2 4.22Å; M750-W841 HydrophobicContact SD-CG 4.34Å; K753-W841 HydrophobicContact CB-CH2 4.17Å; K753-W841 HydrophobicContact CG-CH2 4.49Å; Y757-W841 AromaticContact CD1-CH2 3.65Å; Y757-W841 HydrophobicContact CD1-CH2 3.65Å; Y757-W841 HydrophobicContact CD1-CZ2 4.05Å; Y757-W841 HydrophobicContact CE1-CH2 4.21Å; E837-W841 PolarHBondContact O-N 3.37Å; D838-W841 PolarHBondContact O-N 3.22Å; W841-L843 VanDerWaalsContact C-N 3.35Å; W841-L843 PolarHBondContact O-N 3.18Å; W841-I844 HydrophobicContact CE3-CD1 3.71Å; W841-I844 HydrophobicContact CZ3-CD1 3.9Å; W841-I844 PolarHBondContact O-N 3.25Å; W841-A845 PolarHBondContact O-N 3.17Å
842	C	97.8	Very high	95.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.4	-48.7	172.3	-172.8	0	0	0	0	111.3	I742 A830 L834 D838 A839 F840 I844 A845 I846	I742-C842 HydrophobicContact CD1-CB 3.56Å; I742-C842 WeakPolarHBondContact CD1-SG 3.45Å; I742-C842 HydrophobicContact CG1-CB 4.45Å; A830-C842 HydrophobicContact CB-CB 3.98Å; L834-C842 HydrophobicContact CD1-CB 3.78Å; D838-C842 WeakPolarHBondContact O-CB 3.22Å; D838-C842 PolarHBondContact O-N 2.79Å; A839-C842 WeakPolarHBondContact O-CB 3.46Å; A839-C842 PolarHBondContact O-N 3.29Å; F840-C842 VanDerWaalsContact C-N 3.31Å; F840-C842 PolarHBondContact O-N 2.94Å; C842-I844 VanDerWaalsContact C-N 3.31Å; C842-I844 PolarHBondContact O-N 3.12Å; C842-A845 PolarHBondContact O-N 2.88Å; C842-I846 VanDerWaalsContact O-CG1 3.32Å; C842-I846 WeakPolarHBondContact O-CG1 3.37Å; C842-I846 PolarHBondContact O-N 3.34Å
843	L	97.1	Very high	95.2	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-59.1	-43.2	178	-173.1	62.7	0	0	0	111.1	V806 L807 Y810 I826 A827 A839 F840 W841 I846 L847	V806-L843 HydrophobicContact CG1-CD2 4.18Å; L807-L843 HydrophobicContact CD2-CD2 4.19Å; Y810-L843 HydrophobicContact CD1-CD2 4.26Å; Y810-L843 HydrophobicContact CD2-CD2 3.96Å; Y810-L843 HydrophobicContact CD2-CG 4.03Å; Y810-L843 HydrophobicContact CE2-CG 4.48Å; Y810-L843 HydrophobicContact CG-CD2 3.67Å; Y810-L843 HydrophobicContact CG-CG 4.22Å; I826-L843 HydrophobicContact CB-CD1 4.02Å; I826-L843 HydrophobicContact CG2-CD1 3.79Å; A827-L843 HydrophobicContact CB-CD2 4.33Å; A839-L843 WeakPolarHBondContact O-CB 3.43Å; A839-L843 PolarHBondContact O-N 2.84Å; F840-L843 WeakPolarHBondContact O-CB 3.47Å; F840-L843 PolarHBondContact O-N 2.9Å; W841-L843 VanDerWaalsContact C-N 3.35Å; W841-L843 PolarHBondContact O-N 3.18Å; L843-I846 PolarHBondContact O-N 2.89Å; L843-L847 HydrophobicContact CD1-CD1 3.58Å; L843-L847 HydrophobicContact CD1-CG 3.98Å; L843-L847 HydrophobicContact CG-CD1 3.75Å; L843-L847 HydrophobicContact CG-CG 4.35Å; L843-L847 VanDerWaalsContact O-CB 3.31Å; L843-L847 WeakPolarHBondContact O-CB 3.37Å; L843-L847 WeakPolarHBondContact O-CG 3.36Å; L843-L847 PolarHBondContact O-N 3.29Å
844	I	96.5	Very high	94.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62	-47.1	174.6	-67.7	166.6	0	0	0	111.6	L746 L749 Y810 F840 W841 C842 I846 L847 E848	L746-I844 HydrophobicContact CD1-CB 4.18Å; L746-I844 HydrophobicContact CD1-CG2 4.06Å; L746-I844 HydrophobicContact CD2-CG2 4.15Å; L749-I844 HydrophobicContact CD2-CG2 3.86Å; Y810-I844 HydrophobicContact CD2-CG1 3.93Å; Y810-I844 HydrophobicContact CE2-CG1 4.04Å; F840-I844 HydrophobicContact CD1-CD1 4.05Å; F840-I844 HydrophobicContact CD2-CD1 4.34Å; F840-I844 HydrophobicContact CE1-CD1 3.47Å; F840-I844 VanDerWaalsContact CE1-CD1 3.47Å; F840-I844 HydrophobicContact CE2-CD1 3.79Å; F840-I844 HydrophobicContact CE2-CG1 4.47Å; F840-I844 HydrophobicContact CG-CD1 4.47Å; F840-I844 HydrophobicContact CZ-CD1 3.34Å; F840-I844 HydrophobicContact CZ-CG1 4.43Å; F840-I844 PolarHBondContact O-N 2.82Å; W841-I844 HydrophobicContact CE3-CD1 3.71Å; W841-I844 HydrophobicContact CZ3-CD1 3.9Å; W841-I844 PolarHBondContact O-N 3.25Å; C842-I844 VanDerWaalsContact C-N 3.31Å; C842-I844 PolarHBondContact O-N 3.12Å; I844-I846 VanDerWaalsContact C-N 3.31Å; I844-I846 PolarHBondContact O-N 3.26Å; I844-L847 PolarHBondContact O-N 2.82Å; I844-E848 HydrophobicContact CG2-CB 4.44Å; I844-E848 HydrophobicContact CG2-CG 4.39Å; I844-E848 WeakPolarHBondContact O-CB 3.36Å; I844-E848 PolarHBondContact O-N 3.11Å
845	A	96.6	Very high	94.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	14%	0.144	C	C	.	.	I	π-helix	trans	-59.2	-45.5	-179.7	0	0	0	0	0	111.1	I742 L746 W841 C842 R849 F850	I742-A845 HydrophobicContact CG2-CB 3.99Å; L746-A845 HydrophobicContact CD1-CB 3.78Å; L746-A845 HydrophobicContact CD2-CB 4.39Å; L746-A845 HydrophobicContact CG-CB 3.97Å; W841-A845 PolarHBondContact O-N 3.17Å; C842-A845 PolarHBondContact O-N 2.88Å; A845-R849 CarbonylContact O-C 3.55Å; A845-R849 WeakPolarHBondContact O-CA 3.49Å; A845-R849 VanDerWaalsContact O-CB 3.29Å; A845-R849 WeakPolarHBondContact O-CB 3.45Å; A845-R849 PolarHBondContact O-N 3.15Å; A845-F850 HydrophobicContact CB-CE2 4.11Å; A845-F850 PolarHBondContact O-N 3.44Å
846	I	96.5	Very high	94.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.122	C	C	.	.	I	π-helix	trans	-64.1	-49.5	179.4	-65.1	177.9	0	0	0	110.9	I826 C842 L843 I844 F850 L851 V903 W917 F920 L921	I826-I846 HydrophobicContact CD1-CG2 4.21Å; I826-I846 HydrophobicContact CG2-CB 4.39Å; I826-I846 HydrophobicContact CG2-CD1 3.56Å; I826-I846 HydrophobicContact CG2-CG2 4.17Å; C842-I846 VanDerWaalsContact O-CG1 3.32Å; C842-I846 WeakPolarHBondContact O-CG1 3.37Å; C842-I846 PolarHBondContact O-N 3.34Å; L843-I846 PolarHBondContact O-N 2.89Å; I844-I846 VanDerWaalsContact C-N 3.31Å; I844-I846 PolarHBondContact O-N 3.26Å; I846-F850 HydrophobicContact CG1-CD2 4.05Å; I846-L851 HydrophobicContact CG2-CD1 3.97Å; I846-L851 HydrophobicContact CG2-CG 4.39Å; I846-L851 VanDerWaalsContact O-CB 3.27Å; I846-L851 WeakPolarHBondContact O-CB 3.14Å; I846-L851 VanDerWaalsContact O-CG 3.26Å; I846-L851 WeakPolarHBondContact O-CG 3.17Å; I846-L851 PolarHBondContact O-N 3.31Å; I846-V903 HydrophobicContact CG2-CG2 4.27Å; I846-W917 HydrophobicContact CD1-CH2 3.76Å; I846-W917 HydrophobicContact CD1-CZ2 4.48Å; I846-W917 HydrophobicContact CD1-CZ3 3.82Å; I846-F920 HydrophobicContact CB-CE1 4.49Å; I846-F920 HydrophobicContact CD1-CE1 4.16Å; I846-F920 HydrophobicContact CG1-CE1 3.9Å; I846-F920 HydrophobicContact CG2-CE1 4.03Å; I846-F920 HydrophobicContact CG2-CZ 4.08Å; I846-L921 HydrophobicContact CD1-CD2 4.26Å; I846-L921 HydrophobicContact CG1-CD2 4.23Å
847	L	94.7	Very high	93.5	Very high	6 Å²	6	25.1 Å²	25.1	3%	0.031	12%	0.117	C	C	.	.	I	π-helix	trans	-78.3	-29.5	-171.6	-62.2	-175.6	0	0	0	114	Y810 M823 I826 L843 I844 L851 F856	Y810-L847 HydrophobicContact CD1-CD1 4.31Å; Y810-L847 HydrophobicContact CD2-CD1 4.43Å; Y810-L847 HydrophobicContact CE1-CD1 3.6Å; Y810-L847 HydrophobicContact CE2-CB 4.41Å; Y810-L847 HydrophobicContact CE2-CD1 3.75Å; Y810-L847 WeakPolarHBondContact OH-CD1 3.4Å; M823-L847 HydrophobicContact CE-CD1 3.77Å; M823-L847 HydrophobicContact CG-CD1 4.07Å; M823-L847 HydrophobicContact SD-CD1 3.99Å; I826-L847 HydrophobicContact CD1-CD2 4.01Å; L843-L847 HydrophobicContact CD1-CD1 3.58Å; L843-L847 HydrophobicContact CD1-CG 3.98Å; L843-L847 HydrophobicContact CG-CD1 3.75Å; L843-L847 HydrophobicContact CG-CG 4.35Å; L843-L847 VanDerWaalsContact O-CB 3.31Å; L843-L847 WeakPolarHBondContact O-CB 3.37Å; L843-L847 WeakPolarHBondContact O-CG 3.36Å; L843-L847 PolarHBondContact O-N 3.29Å; I844-L847 PolarHBondContact O-N 2.82Å; L847-L851 HydrophobicContact CD2-CD1 4.3Å; L847-F856 HydrophobicContact CD2-CD2 3.44Å; L847-F856 VanDerWaalsContact CD2-CD2 3.44Å; L847-F856 HydrophobicContact CD2-CE2 3.08Å; L847-F856 HydrophobicContact CD2-CG 4.37Å; L847-F856 HydrophobicContact CD2-CZ 3.76Å
848	E	93.6	Very high	92.4	Very high	59 Å²	59	28.8 Å²	28.8	28%	0.276	15%	0.149	S	C	.	.	I	π-helix	trans	-117	-16	-170.8	-54	-168.9	175.4	0	0	114.4	H813 N814 I844	H813-E848 IonicContact CD2-OE1 3.21Å; H813-E848 PolarHBondContact CD2-OE1 2.83Å; H813-E848 IonicContact NE2-OE1 3.25Å; H813-E848 IonicContact NE2-OE2 3.88Å; N814-E848 PolarHBondContact ND2-OE1 2.95Å; I844-E848 HydrophobicContact CG2-CB 4.44Å; I844-E848 HydrophobicContact CG2-CG 4.39Å; I844-E848 WeakPolarHBondContact O-CB 3.36Å; I844-E848 PolarHBondContact O-N 3.11Å
849	R	93.5	Very high	91.5	Very high	126 Å²	126	29.3 Å²	29.3	48%	0.475	16%	0.155	S	C	.	.	I	π-helix	trans	-114.9	-46.3	178.5	-57.2	-63.9	175.3	171.1	-4	113.1	E745 L746 A845	E745-R849 HydrophobicContact CG-CB 3.91Å; E745-R849 HydrophobicContact CG-CG 4.17Å; L746-R849 HydrophobicContact CD2-CG 3.56Å; A845-R849 CarbonylContact O-C 3.55Å; A845-R849 WeakPolarHBondContact O-CA 3.49Å; A845-R849 VanDerWaalsContact O-CB 3.29Å; A845-R849 WeakPolarHBondContact O-CB 3.45Å; A845-R849 PolarHBondContact O-N 3.15Å
850	F	93.7	Very high	91	Very high	21 Å²	21	31.2 Å²	31.2	9%	0.092	17%	0.165	C	C	.	.	I	π-helix	trans	-84.5	-43.8	-176.8	-59.6	-34.6	0	0	0	113.1	E745 A845 I846 F920 L921 S925	E745-F850 HydrophobicContact CB-CE1 4.45Å; E745-F850 HydrophobicContact CB-CZ 4.43Å; E745-F850 HydrophobicContact CG-CE1 3.82Å; E745-F850 HydrophobicContact CG-CZ 4.22Å; A845-F850 HydrophobicContact CB-CE2 4.11Å; A845-F850 PolarHBondContact O-N 3.44Å; I846-F850 HydrophobicContact CG1-CD2 4.05Å; F850-F920 HydrophobicContact CB-CE2 4.29Å; F850-F920 HydrophobicContact CB-CZ 3.89Å; F850-F920 HydrophobicContact CD2-CE1 4.11Å; F850-F920 HydrophobicContact CD2-CZ 4.23Å; F850-F920 HydrophobicContact CG-CZ 4.46Å; F850-L921 HydrophobicContact CD2-CD2 4.39Å; F850-L921 HydrophobicContact CE2-CD2 3.74Å; F850-L921 WeakPolarHBondContact CZ-O 3.43Å; F850-S925 WeakPolarHBondContact O-CB 3.09Å; F850-S925 PolarHBondContact O-OG 3Å
851	L	93.9	Very high	90.5	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.026	17%	0.167	C	C	.	.	S	Bend	trans	-87.6	149.1	174.3	-62.3	175	0	0	0	110.5	I846 L847 Y855 F856 L928	I846-L851 HydrophobicContact CG2-CD1 3.97Å; I846-L851 HydrophobicContact CG2-CG 4.39Å; I846-L851 VanDerWaalsContact O-CB 3.27Å; I846-L851 WeakPolarHBondContact O-CB 3.14Å; I846-L851 VanDerWaalsContact O-CG 3.26Å; I846-L851 WeakPolarHBondContact O-CG 3.17Å; I846-L851 PolarHBondContact O-N 3.31Å; L847-L851 HydrophobicContact CD2-CD1 4.3Å; L851-Y855 HydrophobicContact CB-CD2 4.29Å; L851-Y855 HydrophobicContact CB-CG 4.13Å; L851-Y855 HydrophobicContact CD1-CD1 3.96Å; L851-Y855 HydrophobicContact CD1-CE1 4.31Å; L851-Y855 HydrophobicContact CD1-CG 4.34Å; L851-Y855 HydrophobicContact CD2-CD1 4.44Å; L851-Y855 HydrophobicContact CD2-CE1 4.18Å; L851-Y855 HydrophobicContact CD2-CE2 4.33Å; L851-F856 HydrophobicContact CD1-CE2 3.77Å; L851-L928 HydrophobicContact CD2-CD1 3.95Å
852	P	91.4	Very high	90.3	Very high	29 Å²	29	32.1 Å²	32.1	19%	0.188	17%	0.17	C	C	.	.			trans	-55.1	149.1	171.7	-25.5	32.1	0	0	0	113.5	N854 Y855 D862	P852-N854 VanDerWaalsContact C-N 3.28Å; P852-N854 PolarHBondContact O-N 2.98Å; P852-N854 VanDerWaalsContact O-N 3.12Å; P852-Y855 HydrophobicContact CB-CD2 4.22Å; P852-Y855 HydrophobicContact CG-CD2 3.99Å; P852-Y855 HydrophobicContact CG-CE2 4.2Å; P852-Y855 WeakPolarHBondContact O-CB 3.39Å; P852-Y855 PolarHBondContact O-N 3.49Å; P852-Y855 VanDerWaalsContact O-N 3.12Å; P852-D862 HydrophobicContact CB-CB 3.61Å; P852-D862 WeakPolarHBondContact CB-OD2 3.24Å; P852-D862 HydrophobicContact CG-CB 4.2Å
853	E	86	Confident	90.1	Very high	132 Å²	132	32.1 Å²	32.1	62%	0.617	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-36.9	-172.4	-169.4	-169.4	154.3	0	0	114.3	K816	K816-E853 IonicContact NZ-OE1 2.85Å
854	N	85.9	Confident	89.9	Confident	30 Å²	30	35.6 Å²	35.6	16%	0.16	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	25.4	-175.1	-57	-72.8	0	0	0	113	P852 N857 I861 D862	P852-N854 VanDerWaalsContact C-N 3.28Å; P852-N854 PolarHBondContact O-N 2.98Å; P852-N854 VanDerWaalsContact O-N 3.12Å; N854-N857 HydrophobicContact CB-CB 4.44Å; N854-N857 PolarHBondContact O-OD1 3.01Å; N854-I861 HydrophobicContact CB-CG2 3.67Å; N854-D862 VanDerWaalsContact CA-OD2 3.25Å; N854-D862 WeakPolarHBondContact CA-OD2 3.5Å; N854-D862 HydrophobicContact CB-CB 4.48Å; N854-D862 WeakPolarHBondContact CB-OD2 3.31Å; N854-D862 PolarHBondContact N-OD2 3.11Å; N854-D862 PolarHBondContact O-N 3.05Å
855	Y	90.5	Very high	89.8	Confident	1 Å²	1	35.7 Å²	35.7	0%	0.004	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-43.2	-178.5	-137.1	-103.7	0	0	0	113.4	L851 P852 L860 D862 A863 D866 F900 L901	L851-Y855 HydrophobicContact CB-CD2 4.29Å; L851-Y855 HydrophobicContact CB-CG 4.13Å; L851-Y855 HydrophobicContact CD1-CD1 3.96Å; L851-Y855 HydrophobicContact CD1-CE1 4.31Å; L851-Y855 HydrophobicContact CD1-CG 4.34Å; L851-Y855 HydrophobicContact CD2-CD1 4.44Å; L851-Y855 HydrophobicContact CD2-CE1 4.18Å; L851-Y855 HydrophobicContact CD2-CE2 4.33Å; P852-Y855 HydrophobicContact CB-CD2 4.22Å; P852-Y855 HydrophobicContact CG-CD2 3.99Å; P852-Y855 HydrophobicContact CG-CE2 4.2Å; P852-Y855 WeakPolarHBondContact O-CB 3.39Å; P852-Y855 PolarHBondContact O-N 3.49Å; P852-Y855 VanDerWaalsContact O-N 3.12Å; Y855-L860 WeakPolarHBondContact O-CA 3.32Å; Y855-L860 VanDerWaalsContact O-CD2 3.28Å; Y855-L860 WeakPolarHBondContact O-CD2 3.37Å; Y855-D862 HydrophobicContact CD2-CB 3.79Å; Y855-D862 HydrophobicContact CE2-CB 4.46Å; Y855-A863 HydrophobicContact CD1-CB 3.82Å; Y855-A863 HydrophobicContact CD2-CB 4.26Å; Y855-A863 HydrophobicContact CE1-CB 3.62Å; Y855-A863 HydrophobicContact CE2-CB 4.1Å; Y855-A863 HydrophobicContact CG-CB 4.14Å; Y855-D866 HydrophobicContact CE2-CB 4.26Å; Y855-D866 WeakPolarHBondContact CE2-OD2 3.3Å; Y855-D866 PolarHBondContact OH-OD2 3.34Å; Y855-F900 HydrophobicContact CE1-CB 4.38Å; Y855-F900 WeakPolarHBondContact OH-CB 3.48Å; Y855-F900 WeakPolarHBondContact OH-CD2 3.42Å; Y855-L901 HydrophobicContact CD1-CD2 3.85Å; Y855-L901 HydrophobicContact CE1-CD2 3.94Å
856	F	87.5	Confident	89.8	Confident	8 Å²	8	35.8 Å²	35.8	4%	0.035	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	17.6	-176.3	-70.4	-90.3	0	0	0	113.5	I817 C820 M823 I826 L847 L851 L901	I817-F856 HydrophobicContact CG2-CB 4.02Å; C820-F856 HydrophobicContact CB-CB 3.98Å; C820-F856 HydrophobicContact CB-CD1 3.87Å; C820-F856 HydrophobicContact CB-CG 4.39Å; M823-F856 HydrophobicContact CE-CB 3.42Å; M823-F856 VanDerWaalsContact CE-CB 3.42Å; M823-F856 HydrophobicContact CE-CD1 3.9Å; M823-F856 HydrophobicContact CE-CD2 4.24Å; M823-F856 HydrophobicContact CE-CG 3.59Å; M823-F856 HydrophobicContact CG-CD1 4.09Å; M823-F856 HydrophobicContact CG-CE1 4.14Å; I826-F856 HydrophobicContact CD1-CZ 4.08Å; L847-F856 HydrophobicContact CD2-CD2 3.44Å; L847-F856 VanDerWaalsContact CD2-CD2 3.44Å; L847-F856 HydrophobicContact CD2-CE2 3.08Å; L847-F856 HydrophobicContact CD2-CG 4.37Å; L847-F856 HydrophobicContact CD2-CZ 3.76Å; L851-F856 HydrophobicContact CD1-CE2 3.77Å; F856-L901 HydrophobicContact CD1-CD2 4.34Å; F856-L901 HydrophobicContact CE1-CD2 3.87Å; F856-L901 HydrophobicContact CZ-CD2 4.04Å; F856-L901 WeakPolarHBondContact CZ-O 2.79Å
857	N	81.8	Confident	89.9	Confident	40 Å²	40	36 Å²	36	21%	0.214	19%	0.189	C	C	.	.	S	Bend	trans	-65.5	170.7	173.6	80.2	1.5	0	0	0	111.1	N854 G859 L860 I861	N854-N857 HydrophobicContact CB-CB 4.44Å; N854-N857 PolarHBondContact O-OD1 3.01Å; N857-G859 PolarHBondContact O-N 2.91Å; N857-G859 WeakPolarHBondContact OD1-CA 3.06Å; N857-G859 PolarHBondContact OD1-N 3.08Å; N857-L860 PolarHBondContact O-N 2.9Å; N857-L860 WeakPolarHBondContact OD1-CA 3.48Å; N857-L860 PolarHBondContact OD1-N 2.95Å; N857-I861 WeakPolarHBondContact ND2-CG2 3.22Å; N857-I861 PolarHBondContact OD1-N 2.89Å
858	S	72.6	Confident	90	Very high	140 Å²	140	38 Å²	38	98%	0.979	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-18.2	-178	65	0	0	0	0	114.8
859	G	78.5	Confident	90.1	Very high	14 Å²	14	35.2 Å²	35.2	14%	0.144	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-9.3	177.1	0	0	0	0	0	114.6	N857 I861 Q864 M1001	N857-G859 PolarHBondContact O-N 2.91Å; N857-G859 WeakPolarHBondContact OD1-CA 3.06Å; N857-G859 PolarHBondContact OD1-N 3.08Å; G859-I861 PolarHBondContact O-N 2.89Å; G859-Q864 PolarHBondContact O-NE2 2.73Å; G859-M1001 VanDerWaalsContact CA-CE 3.48Å; G859-M1001 WeakPolarHBondContact O-CE 3.46Å
860	L	87.6	Confident	90.3	Very high	41 Å²	41	29.2 Å²	29.2	22%	0.215	16%	0.164	C	C	.	.			trans	48.1	39.3	-168	-54.3	175.2	0	0	0	112.2	Y855 N857 D862 A863 Q864 L901	Y855-L860 WeakPolarHBondContact O-CA 3.32Å; Y855-L860 VanDerWaalsContact O-CD2 3.28Å; Y855-L860 WeakPolarHBondContact O-CD2 3.37Å; N857-L860 PolarHBondContact O-N 2.9Å; N857-L860 WeakPolarHBondContact OD1-CA 3.48Å; N857-L860 PolarHBondContact OD1-N 2.95Å; L860-D862 PolarHBondContact O-N 3.45Å; L860-A863 HydrophobicContact CB-CB 4.16Å; L860-A863 WeakPolarHBondContact O-CB 3.27Å; L860-A863 PolarHBondContact O-N 3.38Å; L860-A863 VanDerWaalsContact O-N 3.17Å; L860-Q864 WeakPolarHBondContact O-CG 3.3Å; L860-Q864 PolarHBondContact O-N 2.89Å; L860-L901 HydrophobicContact CD1-CD1 4.17Å; L860-L901 HydrophobicContact CD2-CD2 4.35Å
861	I	88	Confident	90.5	Very high	8 Å²	8	31.3 Å²	31.3	4%	0.041	17%	0.172	C	C	.	.	H	α-helix	trans	-62.8	-44.6	-164.7	-164.2	170.8	0	0	0	111.7	N854 N857 G859 A863 Q864 V865 Y994 L997 M1001	N854-I861 HydrophobicContact CB-CG2 3.67Å; N857-I861 WeakPolarHBondContact ND2-CG2 3.22Å; N857-I861 PolarHBondContact OD1-N 2.89Å; G859-I861 PolarHBondContact O-N 2.89Å; I861-A863 VanDerWaalsContact C-N 3.31Å; I861-A863 PolarHBondContact O-N 2.79Å; I861-Q864 WeakPolarHBondContact O-CB 3.33Å; I861-Q864 PolarHBondContact O-N 3.27Å; I861-V865 WeakPolarHBondContact O-CG2 3.42Å; I861-V865 PolarHBondContact O-N 2.7Å; I861-Y994 HydrophobicContact CD1-CE2 4.22Å; I861-Y994 HydrophobicContact CG1-CE2 4.49Å; I861-Y994 HydrophobicContact CG2-CD2 4.38Å; I861-Y994 HydrophobicContact CG2-CE2 3.78Å; I861-L997 HydrophobicContact CD1-CB 4.31Å; I861-L997 HydrophobicContact CG1-CB 4.14Å; I861-M1001 HydrophobicContact CB-SD 4.19Å; I861-M1001 HydrophobicContact CD1-SD 3.87Å; I861-M1001 HydrophobicContact CG1-SD 4.05Å
862	D	92.4	Very high	90.6	Very high	14 Å²	14	33.8 Å²	33.8	8%	0.075	18%	0.184	C	C	.	.	H	α-helix	trans	-72.3	-28.9	-179.7	-70	-15.6	0	0	0	111.8	P852 N854 Y855 L860 Q864 V865 D866 Y994	P852-D862 HydrophobicContact CB-CB 3.61Å; P852-D862 WeakPolarHBondContact CB-OD2 3.24Å; P852-D862 HydrophobicContact CG-CB 4.2Å; N854-D862 VanDerWaalsContact CA-OD2 3.25Å; N854-D862 WeakPolarHBondContact CA-OD2 3.5Å; N854-D862 HydrophobicContact CB-CB 4.48Å; N854-D862 WeakPolarHBondContact CB-OD2 3.31Å; N854-D862 PolarHBondContact N-OD2 3.11Å; N854-D862 PolarHBondContact O-N 3.05Å; Y855-D862 HydrophobicContact CD2-CB 3.79Å; Y855-D862 HydrophobicContact CE2-CB 4.46Å; L860-D862 PolarHBondContact O-N 3.45Å; D862-Q864 VanDerWaalsContact C-N 3.35Å; D862-V865 WeakPolarHBondContact O-CB 3.49Å; D862-V865 PolarHBondContact O-N 3.45Å; D862-D866 PolarHBondContact O-N 3.42Å; D862-Y994 WeakPolarHBondContact OD1-CD2 3.39Å; D862-Y994 WeakPolarHBondContact OD1-CE2 3.25Å
863	A	93.8	Very high	90.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.9	-40.3	171.9	0	0	0	0	0	111	Y855 L860 I861 D866 Q867 L897 L901	Y855-A863 HydrophobicContact CD1-CB 3.82Å; Y855-A863 HydrophobicContact CD2-CB 4.26Å; Y855-A863 HydrophobicContact CE1-CB 3.62Å; Y855-A863 HydrophobicContact CE2-CB 4.1Å; Y855-A863 HydrophobicContact CG-CB 4.14Å; L860-A863 HydrophobicContact CB-CB 4.16Å; L860-A863 WeakPolarHBondContact O-CB 3.27Å; L860-A863 PolarHBondContact O-N 3.38Å; L860-A863 VanDerWaalsContact O-N 3.17Å; I861-A863 VanDerWaalsContact C-N 3.31Å; I861-A863 PolarHBondContact O-N 2.79Å; A863-D866 PolarHBondContact O-N 2.77Å; A863-Q867 WeakPolarHBondContact O-CG 3.44Å; A863-Q867 PolarHBondContact O-N 3Å; A863-Q867 VanDerWaalsContact O-N 3.13Å; A863-L897 HydrophobicContact CB-CD1 3.71Å; A863-L901 HydrophobicContact CB-CD2 3.89Å
864	Q	93.4	Very high	91.4	Very high	73 Å²	73	26.2 Å²	26.2	34%	0.341	15%	0.146	S	C	.	.	H	α-helix	trans	-67.1	-38.3	173.2	-67.2	-179.3	24.5	0	0	112.4	G859 L860 I861 D862 D866 Q867 L868 L997	G859-Q864 PolarHBondContact O-NE2 2.73Å; L860-Q864 WeakPolarHBondContact O-CG 3.3Å; L860-Q864 PolarHBondContact O-N 2.89Å; I861-Q864 WeakPolarHBondContact O-CB 3.33Å; I861-Q864 PolarHBondContact O-N 3.27Å; D862-Q864 VanDerWaalsContact C-N 3.35Å; Q864-D866 VanDerWaalsContact C-N 3.35Å; Q864-Q867 WeakPolarHBondContact O-CB 3.27Å; Q864-Q867 PolarHBondContact O-N 3.02Å; Q864-L868 PolarHBondContact O-N 2.97Å; Q864-L868 VanDerWaalsContact O-N 3.15Å; Q864-L997 HydrophobicContact CB-CD1 3.9Å
865	V	94.9	Very high	91.9	Very high	3 Å²	3	29 Å²	29	2%	0.018	16%	0.158	C	C	.	.	H	α-helix	trans	-57.1	-50	172.3	166	0	0	0	0	110.1	I861 D862 Q867 L868 V869 R990 H993 Y994 L997	I861-V865 WeakPolarHBondContact O-CG2 3.42Å; I861-V865 PolarHBondContact O-N 2.7Å; D862-V865 WeakPolarHBondContact O-CB 3.49Å; D862-V865 PolarHBondContact O-N 3.45Å; V865-Q867 PolarHBondContact O-N 3.38Å; V865-L868 WeakPolarHBondContact O-CB 3.46Å; V865-L868 PolarHBondContact O-N 3.42Å; V865-V869 HydrophobicContact CG1-CG2 4.42Å; V865-V869 WeakPolarHBondContact O-CG2 3.47Å; V865-V869 PolarHBondContact O-N 3.01Å; V865-R990 HydrophobicContact CG1-CB 3.98Å; V865-R990 HydrophobicContact CG1-CG 4.03Å; V865-R990 WeakPolarHBondContact CG1-O 3.32Å; V865-H993 HydrophobicContact CG1-CB 3.98Å; V865-H993 HydrophobicContact CG2-CB 4.37Å; V865-Y994 HydrophobicContact CG2-CD2 4.24Å; V865-L997 HydrophobicContact CG2-CD1 3.74Å
866	D	96.5	Very high	92.1	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-59.1	-33.8	177.4	-86.4	4.1	0	0	0	112.3	Y855 D862 A863 Q864 L868 V869 L870 F900 F929 R990	Y855-D866 HydrophobicContact CE2-CB 4.26Å; Y855-D866 WeakPolarHBondContact CE2-OD2 3.3Å; Y855-D866 PolarHBondContact OH-OD2 3.34Å; D862-D866 PolarHBondContact O-N 3.42Å; A863-D866 PolarHBondContact O-N 2.77Å; Q864-D866 VanDerWaalsContact C-N 3.35Å; D866-L868 PolarHBondContact O-N 3.46Å; D866-V869 PolarHBondContact O-N 3.31Å; D866-L870 VanDerWaalsContact O-CB 3.3Å; D866-L870 WeakPolarHBondContact O-CB 3.36Å; D866-L870 PolarHBondContact O-N 2.88Å; D866-F900 HydrophobicContact CB-CD2 3.96Å; D866-F900 HydrophobicContact CB-CE2 4.11Å; D866-F929 HydrophobicContact CB-CE1 4.32Å; D866-F929 HydrophobicContact CB-CZ 3.93Å; D866-F929 WeakPolarHBondContact O-CE1 3.27Å; D866-R990 IonicContact OD1-CZ 2.68Å; D866-R990 IonicContact OD1-NE 2.76Å; D866-R990 PolarHBondContact OD1-NE 2.63Å; D866-R990 IonicContact OD1-NH2 2.64Å; D866-R990 PolarHBondContact OD1-NH2 2.84Å; D866-R990 VanDerWaalsContact OD1-NH2 3.13Å; D866-R990 IonicContact OD2-CZ 2.67Å; D866-R990 IonicContact OD2-NE 2.72Å; D866-R990 IonicContact OD2-NH2 2.59Å; D866-R990 PolarHBondContact OD2-NH2 3.48Å
867	Q	97.4	Very high	92.5	Very high	5 Å²	5	35.7 Å²	35.7	2%	0.023	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-35.4	174.1	-63.2	-41	-63.6	0	0	113.4	A863 Q864 V865 K871 S893 T896 L897	A863-Q867 WeakPolarHBondContact O-CG 3.44Å; A863-Q867 PolarHBondContact O-N 3Å; A863-Q867 VanDerWaalsContact O-N 3.13Å; Q864-Q867 WeakPolarHBondContact O-CB 3.27Å; Q864-Q867 PolarHBondContact O-N 3.02Å; V865-Q867 PolarHBondContact O-N 3.38Å; Q867-K871 WeakPolarHBondContact O-CG 3.36Å; Q867-K871 PolarHBondContact O-N 3.4Å; Q867-K871 VanDerWaalsContact O-N 3.07Å; Q867-S893 WeakPolarHBondContact CB-OG 3.21Å; Q867-T896 PolarHBondContact OE1-OG1 3.41Å; Q867-L897 HydrophobicContact CG-CB 4.16Å; Q867-L897 HydrophobicContact CG-CD1 3.91Å
868	L	96.5	Very high	93.2	Very high	49 Å²	49	34 Å²	34	26%	0.257	18%	0.179	S	C	.	.	H	α-helix	trans	-69.5	-42.5	174.3	-64	179.2	0	0	0	111.2	Q864 V865 D866 L870 K871 E872 H993 L997	Q864-L868 PolarHBondContact O-N 2.97Å; Q864-L868 VanDerWaalsContact O-N 3.15Å; V865-L868 WeakPolarHBondContact O-CB 3.46Å; V865-L868 PolarHBondContact O-N 3.42Å; D866-L868 PolarHBondContact O-N 3.46Å; L868-L870 VanDerWaalsContact C-N 3.33Å; L868-L870 PolarHBondContact O-N 2.95Å; L868-K871 HydrophobicContact CD2-CD 4.39Å; L868-K871 WeakPolarHBondContact O-CB 3.43Å; L868-K871 PolarHBondContact O-N 3.29Å; L868-E872 PolarHBondContact O-N 3.23Å; L868-E872 VanDerWaalsContact O-N 3.12Å; L868-H993 HydrophobicContact CB-CB 4.36Å; L868-H993 HydrophobicContact CD1-CB 4.09Å; L868-L997 HydrophobicContact CD1-CD1 3.65Å; L868-L997 HydrophobicContact CD1-CD2 4.29Å; L868-L997 HydrophobicContact CD1-CG 3.96Å
869	V	96.9	Very high	94.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.2	-43.9	174.1	179.8	0	0	0	0	110.5	V865 D866 K871 E872 I873 F929 I986 R989 R990	V865-V869 HydrophobicContact CG1-CG2 4.42Å; V865-V869 WeakPolarHBondContact O-CG2 3.47Å; V865-V869 PolarHBondContact O-N 3.01Å; D866-V869 PolarHBondContact O-N 3.31Å; V869-K871 VanDerWaalsContact C-N 3.32Å; V869-K871 PolarHBondContact O-N 3.44Å; V869-E872 WeakPolarHBondContact O-CB 3.16Å; V869-E872 PolarHBondContact O-N 2.81Å; V869-E872 VanDerWaalsContact O-N 3.14Å; V869-I873 HydrophobicContact CG1-CD1 4.07Å; V869-I873 HydrophobicContact CG1-CG1 4.45Å; V869-I873 WeakPolarHBondContact O-CG1 3.04Å; V869-I873 PolarHBondContact O-N 3.19Å; V869-F929 HydrophobicContact CB-CE1 3.89Å; V869-F929 HydrophobicContact CB-CZ 4.27Å; V869-F929 HydrophobicContact CG1-CD1 4.47Å; V869-F929 HydrophobicContact CG1-CE1 3.79Å; V869-F929 HydrophobicContact CG1-CZ 4.12Å; V869-I986 HydrophobicContact CG1-CG2 4.37Å; V869-R989 HydrophobicContact CG1-CB 4.21Å; V869-R989 HydrophobicContact CG2-CB 3.88Å; V869-R990 HydrophobicContact CG2-CG 4.09Å
870	L	97.7	Very high	95.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58.8	-43.5	176.5	177.8	63	0	0	0	111.3	D866 L868 E872 I873 V874 T896 F900 F929 A932 V933	D866-L870 VanDerWaalsContact O-CB 3.3Å; D866-L870 WeakPolarHBondContact O-CB 3.36Å; D866-L870 PolarHBondContact O-N 2.88Å; L868-L870 VanDerWaalsContact C-N 3.33Å; L868-L870 PolarHBondContact O-N 2.95Å; L870-E872 VanDerWaalsContact C-N 3.31Å; L870-E872 PolarHBondContact O-N 2.9Å; L870-I873 PolarHBondContact O-N 2.99Å; L870-V874 HydrophobicContact CD1-CG2 4.17Å; L870-V874 HydrophobicContact CG-CG2 4.35Å; L870-V874 WeakPolarHBondContact O-CB 3.23Å; L870-V874 VanDerWaalsContact O-CG2 3.3Å; L870-V874 WeakPolarHBondContact O-CG2 3.37Å; L870-V874 PolarHBondContact O-N 2.81Å; L870-T896 HydrophobicContact CD2-CG2 3.97Å; L870-F900 HydrophobicContact CD1-CZ 4.34Å; L870-F900 HydrophobicContact CD2-CE1 4.42Å; L870-F900 HydrophobicContact CD2-CE2 4.49Å; L870-F900 HydrophobicContact CD2-CZ 3.95Å; L870-F929 HydrophobicContact CB-CD1 4.01Å; L870-F929 HydrophobicContact CB-CE1 4.13Å; L870-F929 HydrophobicContact CD1-CD1 4.16Å; L870-A932 HydrophobicContact CD1-CB 3.85Å; L870-A932 HydrophobicContact CD2-CB 4.18Å; L870-V933 HydrophobicContact CD1-CG2 3.83Å
871	K	96.7	Very high	95.7	Very high	64 Å²	64	35.9 Å²	35.9	28%	0.278	17%	0.167	S	C	.	.	H	α-helix	trans	-59.8	-39.3	176	-76.8	166.6	172.9	163.9	0	112.6	Q867 L868 V869 H875 D891 I892 S893	Q867-K871 WeakPolarHBondContact O-CG 3.36Å; Q867-K871 PolarHBondContact O-N 3.4Å; Q867-K871 VanDerWaalsContact O-N 3.07Å; L868-K871 HydrophobicContact CD2-CD 4.39Å; L868-K871 WeakPolarHBondContact O-CB 3.43Å; L868-K871 PolarHBondContact O-N 3.29Å; V869-K871 VanDerWaalsContact C-N 3.32Å; V869-K871 PolarHBondContact O-N 3.44Å; K871-H875 WeakPolarHBondContact O-CB 3.42Å; K871-H875 PolarHBondContact O-N 2.84Å; K871-D891 WeakPolarHBondContact CE-OD1 3.21Å; K871-D891 IonicContact NZ-OD1 2.81Å; K871-D891 PolarHBondContact NZ-OD1 3.35Å; K871-D891 IonicContact NZ-OD2 3.98Å; K871-D891 PolarHBondContact NZ-OD2 3.39Å; K871-I892 HydrophobicContact CG-CD1 4.33Å; K871-I892 HydrophobicContact CG-CG1 4.26Å; K871-S893 WeakPolarHBondContact CE-OG 3.02Å; K871-S893 PolarHBondContact NZ-OG 3.24Å
872	E	96.5	Very high	96	Very high	58 Å²	58	36 Å²	36	27%	0.271	17%	0.168	S	C	.	.	H	α-helix	trans	-65	-44.9	174.5	-70.1	-179.6	172.8	0	0	111.5	L868 V869 L870 V874 H875 E876 R989 H993	L868-E872 PolarHBondContact O-N 3.23Å; L868-E872 VanDerWaalsContact O-N 3.12Å; V869-E872 WeakPolarHBondContact O-CB 3.16Å; V869-E872 PolarHBondContact O-N 2.81Å; V869-E872 VanDerWaalsContact O-N 3.14Å; L870-E872 VanDerWaalsContact C-N 3.31Å; L870-E872 PolarHBondContact O-N 2.9Å; E872-V874 VanDerWaalsContact C-N 3.34Å; E872-V874 PolarHBondContact O-N 3.43Å; E872-H875 WeakPolarHBondContact O-CB 3.32Å; E872-H875 PolarHBondContact O-N 2.94Å; E872-H875 VanDerWaalsContact O-N 3.14Å; E872-E876 WeakPolarHBondContact O-CG 3.48Å; E872-E876 PolarHBondContact O-N 2.9Å; E872-R989 VanDerWaalsContact OE2-CD 3.25Å; E872-R989 WeakPolarHBondContact OE2-CD 3.31Å; E872-R989 IonicContact OE2-NE 3.21Å; E872-H993 VanDerWaalsContact CD-NE2 3.25Å; E872-H993 IonicContact OE1-CD2 2.7Å; E872-H993 IonicContact OE1-CE1 3.68Å; E872-H993 PolarHBondContact OE1-CE1 3.48Å; E872-H993 VanDerWaalsContact OE1-CE1 3.25Å; E872-H993 IonicContact OE1-NE2 2.76Å; E872-H993 PolarHBondContact OE1-NE2 2.72Å; E872-H993 IonicContact OE2-NE2 3.31Å
873	I	97.4	Very high	96.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-41.3	178.1	-58.1	174.9	0	0	0	110.6	V869 L870 H875 E876 K877 F929 V933 F980 P981	V869-I873 HydrophobicContact CG1-CD1 4.07Å; V869-I873 HydrophobicContact CG1-CG1 4.45Å; V869-I873 WeakPolarHBondContact O-CG1 3.04Å; V869-I873 PolarHBondContact O-N 3.19Å; L870-I873 PolarHBondContact O-N 2.99Å; I873-H875 VanDerWaalsContact C-N 3.3Å; I873-H875 PolarHBondContact O-N 2.91Å; I873-E876 PolarHBondContact O-N 3.36Å; I873-K877 HydrophobicContact CG2-CG 4Å; I873-K877 VanDerWaalsContact O-CB 3.25Å; I873-K877 WeakPolarHBondContact O-CB 3.13Å; I873-K877 WeakPolarHBondContact O-CG 3.36Å; I873-K877 PolarHBondContact O-N 3.4Å; I873-F929 HydrophobicContact CD1-CB 4.03Å; I873-F929 HydrophobicContact CD1-CD1 3.78Å; I873-F929 HydrophobicContact CD1-CE1 4.48Å; I873-F929 HydrophobicContact CD1-CG 4.05Å; I873-V933 HydrophobicContact CB-CG2 4.39Å; I873-V933 HydrophobicContact CG2-CG2 3.77Å; I873-F980 HydrophobicContact CD1-CE1 4.47Å; I873-F980 HydrophobicContact CD1-CZ 4.27Å; I873-F980 HydrophobicContact CG2-CE2 3.87Å; I873-F980 HydrophobicContact CG2-CZ 3.91Å; I873-P981 HydrophobicContact CD1-CG 4.34Å; I873-P981 HydrophobicContact CG1-CG 4.12Å; I873-P981 HydrophobicContact CG2-CG 4.42Å
874	V	97.1	Very high	96.2	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.012	19%	0.191	C	C	.	.	H	α-helix	trans	-63.2	-38.3	174.2	171.3	0	0	0	0	110.8	L870 E872 L878 I892 V933 L936	L870-V874 HydrophobicContact CD1-CG2 4.17Å; L870-V874 HydrophobicContact CG-CG2 4.35Å; L870-V874 WeakPolarHBondContact O-CB 3.23Å; L870-V874 VanDerWaalsContact O-CG2 3.3Å; L870-V874 WeakPolarHBondContact O-CG2 3.37Å; L870-V874 PolarHBondContact O-N 2.81Å; E872-V874 VanDerWaalsContact C-N 3.34Å; E872-V874 PolarHBondContact O-N 3.43Å; V874-L878 HydrophobicContact CG1-CB 4.41Å; V874-L878 CarbonylContact O-C 3.5Å; V874-L878 VanDerWaalsContact O-CA 3.27Å; V874-L878 WeakPolarHBondContact O-CA 3.47Å; V874-L878 WeakPolarHBondContact O-CB 3.35Å; V874-L878 PolarHBondContact O-N 3.34Å; V874-I892 HydrophobicContact CG2-CD1 4.09Å; V874-V933 HydrophobicContact CG2-CG2 4.07Å; V874-L936 HydrophobicContact CG1-CD1 4.46Å; V874-L936 HydrophobicContact CG2-CD1 3.7Å
875	H	96.4	Very high	96.3	Very high	87 Å²	87	36.2 Å²	36.2	40%	0.403	18%	0.177	S	C	.	.	H	α-helix	trans	-63.7	-41	175	-174.1	60	0	0	0	112.4	K871 E872 I873 P879 S882	K871-H875 WeakPolarHBondContact O-CB 3.42Å; K871-H875 PolarHBondContact O-N 2.84Å; E872-H875 WeakPolarHBondContact O-CB 3.32Å; E872-H875 PolarHBondContact O-N 2.94Å; E872-H875 VanDerWaalsContact O-N 3.14Å; I873-H875 VanDerWaalsContact C-N 3.3Å; I873-H875 PolarHBondContact O-N 2.91Å; H875-P879 WeakPolarHBondContact O-CA 3.44Å; H875-P879 WeakPolarHBondContact O-CB 3.36Å; H875-S882 PolarHBondContact ND1-OG 3.16Å; H875-S882 VanDerWaalsContact ND1-OG 3.16Å
876	E	95.4	Very high	96.2	Very high	98 Å²	98	42.8 Å²	42.8	46%	0.458	21%	0.205	S	C	.	.	H	α-helix	trans	-73.3	-40.4	178.7	-70.7	173.8	164.9	0	0	113	E872 I873 R989	E872-E876 WeakPolarHBondContact O-CG 3.48Å; E872-E876 PolarHBondContact O-N 2.9Å; I873-E876 PolarHBondContact O-N 3.36Å; E876-R989 VanDerWaalsContact CD-NH2 3.26Å; E876-R989 IonicContact OE1-CZ 3.31Å; E876-R989 IonicContact OE1-NH1 3.42Å; E876-R989 PolarHBondContact OE1-NH1 2.7Å; E876-R989 IonicContact OE1-NH2 3.97Å; E876-R989 PolarHBondContact OE1-NH2 3.1Å; E876-R989 IonicContact OE2-CZ 3.93Å; E876-R989 IonicContact OE2-NH1 2.97Å; E876-R989 PolarHBondContact OE2-NH1 3Å; E876-R989 IonicContact OE2-NH2 2.79Å; E876-R989 PolarHBondContact OE2-NH2 2.91Å; E876-R989 VanDerWaalsContact OE2-NH2 3.11Å
877	K	95.6	Very high	96	Very high	52 Å²	52	50.5 Å²	50.5	23%	0.226	23%	0.234	C	C	.	.	H	α-helix	trans	-91.5	-32.2	-172.7	-67.3	-71.1	167	-175.4	0	113.7	I873 P879 V933 L977 P979	I873-K877 HydrophobicContact CG2-CG 4Å; I873-K877 VanDerWaalsContact O-CB 3.25Å; I873-K877 WeakPolarHBondContact O-CB 3.13Å; I873-K877 WeakPolarHBondContact O-CG 3.36Å; I873-K877 PolarHBondContact O-N 3.4Å; K877-P879 VanDerWaalsContact C-CD 3.47Å; K877-V933 HydrophobicContact CB-CG1 3.94Å; K877-V933 HydrophobicContact CG-CG1 4.38Å; K877-L977 HydrophobicContact CB-CD2 4.25Å; K877-L977 HydrophobicContact CD-CD2 4.19Å; K877-L977 WeakPolarHBondContact CE-O 3.36Å; K877-L977 HydrophobicContact CG-CD2 4.4Å; K877-L977 PolarHBondContact NZ-O 3.22Å; K877-P979 VanDerWaalsContact CE-O 3.31Å; K877-P979 WeakPolarHBondContact CE-O 3.43Å; K877-P979 PolarHBondContact NZ-O 3.23Å
878	L	96.5	Very high	95.6	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.021	24%	0.24	C	C	.	.			trans	-132.8	59.4	-175	-49.1	174.1	0	0	0	109.9	V874 R880 L881 S882 V933 L936 K937 Q940	V874-L878 HydrophobicContact CG1-CB 4.41Å; V874-L878 CarbonylContact O-C 3.5Å; V874-L878 VanDerWaalsContact O-CA 3.27Å; V874-L878 WeakPolarHBondContact O-CA 3.47Å; V874-L878 WeakPolarHBondContact O-CB 3.35Å; V874-L878 PolarHBondContact O-N 3.34Å; L878-R880 VanDerWaalsContact C-N 3.28Å; L878-R880 PolarHBondContact O-N 3.49Å; L878-L881 HydrophobicContact CB-CB 4.05Å; L878-L881 HydrophobicContact CD1-CD2 4.11Å; L878-L881 PolarHBondContact O-N 3.44Å; L878-L881 VanDerWaalsContact O-N 3.08Å; L878-S882 PolarHBondContact O-N 3.02Å; L878-V933 HydrophobicContact CD1-CG1 4.11Å; L878-V933 HydrophobicContact CG-CG1 4.35Å; L878-L936 HydrophobicContact CD1-CB 3.63Å; L878-K937 HydrophobicContact CD1-CB 4.2Å; L878-K937 HydrophobicContact CD2-CB 3.71Å; L878-K937 HydrophobicContact CD2-CD 4.2Å; L878-K937 HydrophobicContact CD2-CG 3.9Å; L878-Q940 VanDerWaalsContact CD2-OE1 3.22Å
879	P	96.7	Very high	95.3	Very high	68 Å²	68	52.6 Å²	52.6	44%	0.442	26%	0.262	S	S	.	.	H	α-helix	trans	-60.5	-34.9	-171.9	23	-34.4	0	0	0	113.3	H875 K877 S882 S883	H875-P879 WeakPolarHBondContact O-CA 3.44Å; H875-P879 WeakPolarHBondContact O-CB 3.36Å; K877-P879 VanDerWaalsContact C-CD 3.47Å; P879-S882 PolarHBondContact O-N 3.37Å; P879-S883 WeakPolarHBondContact O-CB 3.16Å; P879-S883 PolarHBondContact O-N 3.29Å; P879-S883 PolarHBondContact O-OG 3.03Å; P879-S883 VanDerWaalsContact O-OG 3.09Å
880	R	96.9	Very high	95	Very high	167 Å²	167	53.3 Å²	53.3	63%	0.63	27%	0.266	S	S	*	.	H	α-helix	trans	-61.2	-48.4	175.1	-68.3	177.3	67.6	-169	-1.1	111.1	L878 S883 H884 L944	L878-R880 VanDerWaalsContact C-N 3.28Å; L878-R880 PolarHBondContact O-N 3.49Å; R880-S883 PolarHBondContact O-N 2.92Å; R880-H884 WeakPolarHBondContact O-CB 3.31Å; R880-H884 PolarHBondContact O-N 2.7Å; R880-L944 HydrophobicContact CB-CD1 4.2Å; R880-L944 HydrophobicContact CB-CD2 4.35Å
881	L	96	Very high	94.7	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.9	-41	178.5	-175.1	61.7	0	0	0	111.5	L878 S883 H884 L885 L936 Q940 L943 L944 F952	L878-L881 HydrophobicContact CB-CB 4.05Å; L878-L881 HydrophobicContact CD1-CD2 4.11Å; L878-L881 PolarHBondContact O-N 3.44Å; L878-L881 VanDerWaalsContact O-N 3.08Å; L881-S883 VanDerWaalsContact C-N 3.35Å; L881-S883 PolarHBondContact O-N 3.13Å; L881-H884 WeakPolarHBondContact O-CB 3.37Å; L881-H884 PolarHBondContact O-N 3.21Å; L881-L885 HydrophobicContact CG-CD1 4.19Å; L881-L885 HydrophobicContact CG-CG 4.47Å; L881-L885 WeakPolarHBondContact O-CB 3.25Å; L881-L885 VanDerWaalsContact O-CG 3.26Å; L881-L885 WeakPolarHBondContact O-CG 3.22Å; L881-L885 PolarHBondContact O-N 3.3Å; L881-L936 HydrophobicContact CD2-CB 4.01Å; L881-L936 HydrophobicContact CD2-CD2 4.33Å; L881-Q940 HydrophobicContact CB-CG 4.31Å; L881-L943 HydrophobicContact CD1-CB 3.84Å; L881-L943 HydrophobicContact CD1-CD1 4.42Å; L881-L943 HydrophobicContact CD2-CD1 4.29Å; L881-L944 HydrophobicContact CD1-CD2 4.41Å; L881-F952 HydrophobicContact CD1-CE2 4.16Å
882	S	95.3	Very high	94.5	Very high	10 Å²	10	54.1 Å²	54.1	7%	0.07	27%	0.273	C	S	.	.	H	α-helix	trans	-58.6	-44.7	175.3	-175.8	0	0	0	0	112.2	H875 L878 P879 L885 K886	H875-S882 PolarHBondContact ND1-OG 3.16Å; H875-S882 VanDerWaalsContact ND1-OG 3.16Å; L878-S882 PolarHBondContact O-N 3.02Å; P879-S882 PolarHBondContact O-N 3.37Å; S882-L885 PolarHBondContact O-N 2.62Å; S882-K886 WeakPolarHBondContact O-CG 3.5Å; S882-K886 PolarHBondContact O-N 3.16Å
883	S	95.7	Very high	94.3	Very high	69 Å²	69	52.2 Å²	52.2	48%	0.483	27%	0.266	S	S	.	.	H	α-helix	trans	-65.4	-39	175.5	-64.9	0	0	0	0	112.2	P879 R880 L881 K886 R887	P879-S883 WeakPolarHBondContact O-CB 3.16Å; P879-S883 PolarHBondContact O-N 3.29Å; P879-S883 PolarHBondContact O-OG 3.03Å; P879-S883 VanDerWaalsContact O-OG 3.09Å; R880-S883 PolarHBondContact O-N 2.92Å; L881-S883 VanDerWaalsContact C-N 3.35Å; L881-S883 PolarHBondContact O-N 3.13Å; S883-K886 PolarHBondContact O-N 2.89Å; S883-R887 WeakPolarHBondContact O-CB 3.18Å; S883-R887 PolarHBondContact O-N 3.26Å
884	H	95.3	Very high	93.9	Very high	14 Å²	14	55.9 Å²	55.9	7%	0.065	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-45.3	175.8	-172.7	72.4	0	0	0	112.5	R880 L881 K886 R887 L888 L943 L944 Q946	R880-H884 WeakPolarHBondContact O-CB 3.31Å; R880-H884 PolarHBondContact O-N 2.7Å; L881-H884 WeakPolarHBondContact O-CB 3.37Å; L881-H884 PolarHBondContact O-N 3.21Å; H884-K886 VanDerWaalsContact C-N 3.35Å; H884-K886 PolarHBondContact O-N 2.96Å; H884-R887 PolarHBondContact CE1-NH2 3.49Å; H884-R887 PolarHBondContact ND1-NH2 3.15Å; H884-R887 WeakPolarHBondContact O-CB 3.19Å; H884-R887 PolarHBondContact O-N 2.98Å; H884-L888 WeakPolarHBondContact O-CG 3.48Å; H884-L888 PolarHBondContact O-N 3.47Å; H884-L943 PolarHBondContact CD2-O 2.87Å; H884-L943 PolarHBondContact NE2-O 2.9Å; H884-L943 VanDerWaalsContact NE2-O 3.1Å; H884-L944 HydrophobicContact CB-CD2 3.68Å; H884-L944 PolarHBondContact CE1-O 2.98Å; H884-L944 PolarHBondContact NE2-O 3.26Å; H884-Q946 PolarHBondContact CE1-O 2.68Å; H884-Q946 PolarHBondContact NE2-O 3.35Å
885	L	94	Very high	93.5	Very high	9 Å²	9	57 Å²	57	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-56.5	-47.6	173.7	-75	166.6	0	0	0	111.6	L881 S882 R887 L888 G889 I890 I892 F952	L881-L885 HydrophobicContact CG-CD1 4.19Å; L881-L885 HydrophobicContact CG-CG 4.47Å; L881-L885 WeakPolarHBondContact O-CB 3.25Å; L881-L885 VanDerWaalsContact O-CG 3.26Å; L881-L885 WeakPolarHBondContact O-CG 3.22Å; L881-L885 PolarHBondContact O-N 3.3Å; S882-L885 PolarHBondContact O-N 2.62Å; L885-R887 PolarHBondContact O-N 3.48Å; L885-L888 PolarHBondContact O-N 3.26Å; L885-G889 PolarHBondContact O-N 2.93Å; L885-I890 HydrophobicContact CD2-CB 3.79Å; L885-I890 HydrophobicContact CD2-CG2 3.53Å; L885-I890 PolarHBondContact O-N 3.48Å; L885-I892 HydrophobicContact CD1-CG2 3.51Å; L885-I892 HydrophobicContact CD2-CG2 3.55Å; L885-I892 HydrophobicContact CG-CG2 4.17Å; L885-F952 HydrophobicContact CD2-CE1 3.64Å; L885-F952 HydrophobicContact CD2-CE2 3.91Å; L885-F952 HydrophobicContact CD2-CZ 3.28Å; L885-F952 HydrophobicContact CG-CZ 4.26Å
886	K	92.8	Very high	93.4	Very high	142 Å²	142	53 Å²	53	62%	0.617	29%	0.285	S	S	*	.	H	α-helix	trans	-60.5	-43.6	175.8	-73.2	176	-177.4	178.1	0	111.8	S882 S883 H884 L888 G889	S882-K886 WeakPolarHBondContact O-CG 3.5Å; S882-K886 PolarHBondContact O-N 3.16Å; S883-K886 PolarHBondContact O-N 2.89Å; H884-K886 VanDerWaalsContact C-N 3.35Å; H884-K886 PolarHBondContact O-N 2.96Å; K886-L888 VanDerWaalsContact C-N 3.31Å; K886-L888 PolarHBondContact O-N 2.98Å; K886-G889 PolarHBondContact O-N 2.81Å; K886-G889 VanDerWaalsContact O-N 3.11Å
887	R	92.6	Very high	93.3	Very high	163 Å²	163	50.4 Å²	50.4	62%	0.615	27%	0.274	S	S	*	.	H	α-helix	trans	-62	-37.6	178.3	-174.2	179	63.9	78.2	-2.6	112.4	S883 H884 L885 G889	S883-R887 WeakPolarHBondContact O-CB 3.18Å; S883-R887 PolarHBondContact O-N 3.26Å; H884-R887 PolarHBondContact CE1-NH2 3.49Å; H884-R887 PolarHBondContact ND1-NH2 3.15Å; H884-R887 WeakPolarHBondContact O-CB 3.19Å; H884-R887 PolarHBondContact O-N 2.98Å; L885-R887 PolarHBondContact O-N 3.48Å; R887-G889 VanDerWaalsContact C-N 3.32Å
888	L	89.7	Confident	93.1	Very high	26 Å²	26	51.6 Å²	51.6	14%	0.136	28%	0.283	C	S	.	.	H	α-helix	trans	-83	-5.5	176.7	-63.8	-178.7	0	0	0	113.5	H884 L885 K886 I890 S947 T949 F952	H884-L888 WeakPolarHBondContact O-CG 3.48Å; H884-L888 PolarHBondContact O-N 3.47Å; L885-L888 PolarHBondContact O-N 3.26Å; K886-L888 VanDerWaalsContact C-N 3.31Å; K886-L888 PolarHBondContact O-N 2.98Å; L888-I890 HydrophobicContact CB-CD1 3.64Å; L888-I890 HydrophobicContact CB-CG1 3.67Å; L888-I890 HydrophobicContact CD1-CD1 3.72Å; L888-I890 HydrophobicContact CG-CD1 4.34Å; L888-I890 PolarHBondContact O-N 3.4Å; L888-S947 WeakPolarHBondContact CD2-O 3.08Å; L888-T949 HydrophobicContact CB-CG2 4.24Å; L888-T949 WeakPolarHBondContact O-CG2 3.4Å; L888-F952 HydrophobicContact CD1-CB 4.42Å; L888-F952 HydrophobicContact CD1-CD2 4.29Å
889	G	90.4	Very high	93.1	Very high	71 Å²	71	51.6 Å²	51.6	73%	0.732	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	28	-174.5	0	0	0	0	0	113.2	L885 K886 R887	L885-G889 PolarHBondContact O-N 2.93Å; K886-G889 PolarHBondContact O-N 2.81Å; K886-G889 VanDerWaalsContact O-N 3.11Å; R887-G889 VanDerWaalsContact C-N 3.32Å
890	I	90.5	Very high	93	Very high	16 Å²	16	48.4 Å²	48.4	8%	0.082	26%	0.262	C	S	.	.			trans	-92.5	120.7	-176.3	-64.1	178.7	0	0	0	109.7	L885 L888 T949 F952 W953	L885-I890 HydrophobicContact CD2-CB 3.79Å; L885-I890 HydrophobicContact CD2-CG2 3.53Å; L885-I890 PolarHBondContact O-N 3.48Å; L888-I890 HydrophobicContact CB-CD1 3.64Å; L888-I890 HydrophobicContact CB-CG1 3.67Å; L888-I890 HydrophobicContact CD1-CD1 3.72Å; L888-I890 HydrophobicContact CG-CD1 4.34Å; L888-I890 PolarHBondContact O-N 3.4Å; I890-T949 HydrophobicContact CD1-CG2 4.11Å; I890-T949 HydrophobicContact CG1-CG2 3.85Å; I890-F952 HydrophobicContact CD1-CB 3.58Å; I890-F952 HydrophobicContact CD1-CD1 3.39Å; I890-F952 HydrophobicContact CD1-CD2 4.08Å; I890-F952 HydrophobicContact CD1-CE1 4.12Å; I890-F952 HydrophobicContact CD1-CG 3.39Å; I890-F952 HydrophobicContact CG2-CD1 4.04Å; I890-F952 HydrophobicContact CG2-CE1 3.93Å; I890-W953 HydrophobicContact CG2-CH2 3.71Å; I890-W953 HydrophobicContact CG2-CZ2 3.45Å; I890-W953 VanDerWaalsContact CG2-CZ2 3.45Å; I890-W953 HydrophobicContact CG2-CZ3 4.41Å
891	D	91.7	Very high	92.8	Very high	76 Å²	76	41.4 Å²	41.4	41%	0.406	24%	0.237	S	C	.	.			trans	-95.6	105.3	168.2	-170.4	-12.3	0	0	0	110.8	K871 S893 A894 W953	K871-D891 WeakPolarHBondContact CE-OD1 3.21Å; K871-D891 IonicContact NZ-OD1 2.81Å; K871-D891 PolarHBondContact NZ-OD1 3.35Å; K871-D891 IonicContact NZ-OD2 3.98Å; K871-D891 PolarHBondContact NZ-OD2 3.39Å; D891-S893 PolarHBondContact O-N 3.14Å; D891-S893 VanDerWaalsContact O-N 3.09Å; D891-S893 WeakPolarHBondContact OD1-CB 3.49Å; D891-S893 PolarHBondContact OD1-N 3.38Å; D891-S893 PolarHBondContact OD1-OG 2.69Å; D891-A894 WeakPolarHBondContact O-CB 3.44Å; D891-A894 PolarHBondContact O-N 3.25Å; D891-A894 VanDerWaalsContact O-N 3.1Å; D891-W953 VanDerWaalsContact O-CH2 3.3Å; D891-W953 WeakPolarHBondContact O-CH2 3.32Å
892	I	91.8	Very high	92.7	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.026	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.3	178.2	59.5	171.9	0	0	0	113.7	K871 V874 L885 A894 V895 T896 L936	K871-I892 HydrophobicContact CG-CD1 4.33Å; K871-I892 HydrophobicContact CG-CG1 4.26Å; V874-I892 HydrophobicContact CG2-CD1 4.09Å; L885-I892 HydrophobicContact CD1-CG2 3.51Å; L885-I892 HydrophobicContact CD2-CG2 3.55Å; L885-I892 HydrophobicContact CG-CG2 4.17Å; I892-A894 PolarHBondContact O-N 2.84Å; I892-V895 PolarHBondContact O-N 2.86Å; I892-T896 HydrophobicContact CB-CG2 4.28Å; I892-T896 PolarHBondContact O-N 3.43Å; I892-T896 PolarHBondContact O-OG1 2.99Å; I892-L936 HydrophobicContact CD1-CD1 4.4Å
893	S	91.9	Very high	92.7	Very high	17 Å²	17	41 Å²	41	12%	0.119	23%	0.234	C	C	.	.	H	α-helix	trans	-57.4	-22.9	176.9	-56.7	0	0	0	0	112.9	Q867 K871 D891 V895 T896 L897	Q867-S893 WeakPolarHBondContact CB-OG 3.21Å; K871-S893 WeakPolarHBondContact CE-OG 3.02Å; K871-S893 PolarHBondContact NZ-OG 3.24Å; D891-S893 PolarHBondContact O-N 3.14Å; D891-S893 VanDerWaalsContact O-N 3.09Å; D891-S893 WeakPolarHBondContact OD1-CB 3.49Å; D891-S893 PolarHBondContact OD1-N 3.38Å; D891-S893 PolarHBondContact OD1-OG 2.69Å; S893-V895 PolarHBondContact O-N 3.12Å; S893-T896 WeakPolarHBondContact CA-OG1 3.49Å; S893-L897 WeakPolarHBondContact O-CB 3.32Å; S893-L897 PolarHBondContact O-N 3.46Å
894	A	89.8	Confident	92.7	Very high	77 Å²	77	37.7 Å²	37.7	64%	0.636	21%	0.211	S	C	*	.	H	α-helix	trans	-61.2	-22	174.5	0	0	0	0	0	113.6	D891 I892 W953	D891-A894 WeakPolarHBondContact O-CB 3.44Å; D891-A894 PolarHBondContact O-N 3.25Å; D891-A894 VanDerWaalsContact O-N 3.1Å; I892-A894 PolarHBondContact O-N 2.84Å; A894-W953 HydrophobicContact CB-CH2 3.88Å; A894-W953 HydrophobicContact CB-CZ2 4.13Å
895	V	88.8	Confident	92.5	Very high	27 Å²	27	38 Å²	38	16%	0.164	21%	0.212	C	C	.	.	H	α-helix	trans	-118.5	-43	178.2	174	0	0	0	0	111.2	I892 S893 L897 N898 W899 W953	I892-V895 PolarHBondContact O-N 2.86Å; S893-V895 PolarHBondContact O-N 3.12Å; V895-L897 PolarHBondContact O-N 3.16Å; V895-N898 PolarHBondContact O-N 2.63Å; V895-W899 HydrophobicContact CG1-CZ2 3.67Å; V895-W899 VanDerWaalsContact CG1-NE1 3.34Å; V895-W899 PolarHBondContact O-N 2.89Å; V895-W953 HydrophobicContact CB-CZ3 4.01Å; V895-W953 HydrophobicContact CG2-CE3 3.75Å; V895-W953 HydrophobicContact CG2-CH2 4.12Å; V895-W953 HydrophobicContact CG2-CZ3 3.34Å
896	T	94	Very high	92	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-69.4	-19.8	-175.8	57.5	0	0	0	0	113.6	Q867 L870 I892 S893 W899 F900	Q867-T896 PolarHBondContact OE1-OG1 3.41Å; L870-T896 HydrophobicContact CD2-CG2 3.97Å; I892-T896 HydrophobicContact CB-CG2 4.28Å; I892-T896 PolarHBondContact O-N 3.43Å; I892-T896 PolarHBondContact O-OG1 2.99Å; S893-T896 WeakPolarHBondContact CA-OG1 3.49Å; T896-W899 HydrophobicContact CG2-CD2 4.13Å; T896-W899 HydrophobicContact CG2-CE3 3.7Å; T896-W899 HydrophobicContact CG2-CH2 3.99Å; T896-W899 HydrophobicContact CG2-CZ2 4.37Å; T896-W899 HydrophobicContact CG2-CZ3 3.66Å; T896-W899 WeakPolarHBondContact O-CB 3.46Å; T896-W899 PolarHBondContact O-N 3.23Å; T896-F900 PolarHBondContact O-N 3.42Å
897	L	94	Very high	91.7	Very high	45 Å²	45	36.5 Å²	36.5	24%	0.236	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-45	171.7	-179.4	65	0	0	0	111.3	A863 Q867 S893 V895 W899 F900 L901	A863-L897 HydrophobicContact CB-CD1 3.71Å; Q867-L897 HydrophobicContact CG-CB 4.16Å; Q867-L897 HydrophobicContact CG-CD1 3.91Å; S893-L897 WeakPolarHBondContact O-CB 3.32Å; S893-L897 PolarHBondContact O-N 3.46Å; V895-L897 PolarHBondContact O-N 3.16Å; L897-W899 VanDerWaalsContact C-N 3.3Å; L897-W899 PolarHBondContact O-N 2.96Å; L897-F900 PolarHBondContact O-N 2.95Å; L897-L901 HydrophobicContact CD1-CD1 4.16Å; L897-L901 HydrophobicContact CD1-CG 4.24Å; L897-L901 HydrophobicContact CD2-CD1 4.42Å; L897-L901 HydrophobicContact CG-CD1 3.87Å; L897-L901 HydrophobicContact CG-CG 4.34Å; L897-L901 WeakPolarHBondContact O-CG 3.34Å; L897-L901 PolarHBondContact O-N 3.37Å
898	N	91.6	Very high	91.7	Very high	77 Å²	77	29.4 Å²	29.4	41%	0.412	19%	0.186	S	C	.	.	H	α-helix	trans	-67.6	-33.4	177.9	-171	67.4	0	0	0	111.8	V895 F900 A902	V895-N898 PolarHBondContact O-N 2.63Å; N898-F900 PolarHBondContact O-N 3.43Å; N898-A902 WeakPolarHBondContact O-CB 3.09Å; N898-A902 PolarHBondContact O-N 2.98Å
899	W	94.9	Very high	91.5	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.015	19%	0.187	C	C	.	.	H	α-helix	trans	-58.9	-37.4	174.4	-60	-2.6	0	0	0	111.4	V895 T896 L897 V903 F904 S907 A932 I935 L956 T960	V895-W899 HydrophobicContact CG1-CZ2 3.67Å; V895-W899 VanDerWaalsContact CG1-NE1 3.34Å; V895-W899 PolarHBondContact O-N 2.89Å; T896-W899 HydrophobicContact CG2-CD2 4.13Å; T896-W899 HydrophobicContact CG2-CE3 3.7Å; T896-W899 HydrophobicContact CG2-CH2 3.99Å; T896-W899 HydrophobicContact CG2-CZ2 4.37Å; T896-W899 HydrophobicContact CG2-CZ3 3.66Å; T896-W899 WeakPolarHBondContact O-CB 3.46Å; T896-W899 PolarHBondContact O-N 3.23Å; L897-W899 VanDerWaalsContact C-N 3.3Å; L897-W899 PolarHBondContact O-N 2.96Å; W899-V903 CarbonylContact O-C 3.6Å; W899-V903 WeakPolarHBondContact O-CA 3.42Å; W899-V903 PolarHBondContact O-N 3.45Å; W899-F904 HydrophobicContact CB-CD1 3.93Å; W899-F904 HydrophobicContact CB-CE1 3.79Å; W899-F904 HydrophobicContact CB-CG 4.44Å; W899-F904 HydrophobicContact CB-CZ 4.18Å; W899-F904 HydrophobicContact CD2-CD1 4.34Å; W899-F904 AromaticContact CD2-CE1 3.83Å; W899-F904 HydrophobicContact CD2-CE1 3.83Å; W899-F904 HydrophobicContact CE3-CD1 4.48Å; W899-F904 AromaticContact CE3-CE1 3.55Å; W899-F904 HydrophobicContact CE3-CE1 3.55Å; W899-F904 HydrophobicContact CE3-CZ 4.12Å; W899-F904 HydrophobicContact CG-CD1 4.12Å; W899-F904 AromaticContact CG-CE1 3.95Å; W899-F904 HydrophobicContact CG-CE1 3.95Å; W899-F904 HydrophobicContact CZ3-CE1 4.42Å; W899-F904 PolarHBondContact O-N 2.89Å; W899-S907 VanDerWaalsContact CD1-CB 3.48Å; W899-A932 HydrophobicContact CE3-CB 4.03Å; W899-A932 HydrophobicContact CZ3-CB 4.13Å; W899-I935 HydrophobicContact CH2-CG2 4.29Å; W899-L956 HydrophobicContact CH2-CD1 4.24Å; W899-T960 HydrophobicContact CH2-CG2 3.61Å; W899-T960 HydrophobicContact CZ2-CG2 3.23Å
900	F	95.6	Very high	91.4	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-83.6	-44.8	-178	-72.5	15	0	0	0	111.4	Y855 D866 L870 T896 L897 N898 A902 V903 F904 L928 F929 A932	Y855-F900 HydrophobicContact CE1-CB 4.38Å; Y855-F900 WeakPolarHBondContact OH-CB 3.48Å; Y855-F900 WeakPolarHBondContact OH-CD2 3.42Å; D866-F900 HydrophobicContact CB-CD2 3.96Å; D866-F900 HydrophobicContact CB-CE2 4.11Å; L870-F900 HydrophobicContact CD1-CZ 4.34Å; L870-F900 HydrophobicContact CD2-CE1 4.42Å; L870-F900 HydrophobicContact CD2-CE2 4.49Å; L870-F900 HydrophobicContact CD2-CZ 3.95Å; T896-F900 PolarHBondContact O-N 3.42Å; L897-F900 PolarHBondContact O-N 2.95Å; N898-F900 PolarHBondContact O-N 3.43Å; F900-A902 VanDerWaalsContact C-N 3.26Å; F900-A902 PolarHBondContact O-N 3.48Å; F900-V903 PolarHBondContact O-N 3.2Å; F900-V903 VanDerWaalsContact O-N 3.17Å; F900-F904 HydrophobicContact CE1-CZ 4.48Å; F900-L928 HydrophobicContact CB-CD1 4.37Å; F900-L928 HydrophobicContact CD1-CB 3.94Å; F900-L928 HydrophobicContact CE1-CB 3.75Å; F900-L928 WeakPolarHBondContact CE1-O 3.39Å; F900-L928 HydrophobicContact CE2-CB 4.35Å; F900-L928 HydrophobicContact CG-CB 4.33Å; F900-L928 HydrophobicContact CG-CD1 4.29Å; F900-L928 HydrophobicContact CZ-CB 3.97Å; F900-F929 HydrophobicContact CE2-CD1 4.01Å; F900-F929 AromaticContact CE2-CE1 3.85Å; F900-F929 HydrophobicContact CE2-CE1 3.85Å; F900-F929 HydrophobicContact CE2-CG 4.45Å; F900-F929 HydrophobicContact CE2-CZ 4.16Å; F900-F929 HydrophobicContact CZ-CD1 4.04Å; F900-F929 HydrophobicContact CZ-CE1 4.35Å; F900-F929 HydrophobicContact CZ-CG 4.31Å; F900-A932 HydrophobicContact CE1-CB 3.86Å; F900-A932 HydrophobicContact CZ-CB 4.23Å
901	L	93	Very high	91.2	Very high	20 Å²	20	29.6 Å²	29.6	11%	0.105	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-36	178.4	-70.6	175.2	0	0	0	112.8	Y855 F856 L860 A863 L897	Y855-L901 HydrophobicContact CD1-CD2 3.85Å; Y855-L901 HydrophobicContact CE1-CD2 3.94Å; F856-L901 HydrophobicContact CD1-CD2 4.34Å; F856-L901 HydrophobicContact CE1-CD2 3.87Å; F856-L901 HydrophobicContact CZ-CD2 4.04Å; F856-L901 WeakPolarHBondContact CZ-O 2.79Å; L860-L901 HydrophobicContact CD1-CD1 4.17Å; L860-L901 HydrophobicContact CD2-CD2 4.35Å; A863-L901 HydrophobicContact CB-CD2 3.89Å; L897-L901 HydrophobicContact CD1-CD1 4.16Å; L897-L901 HydrophobicContact CD1-CG 4.24Å; L897-L901 HydrophobicContact CD2-CD1 4.42Å; L897-L901 HydrophobicContact CG-CD1 3.87Å; L897-L901 HydrophobicContact CG-CG 4.34Å; L897-L901 WeakPolarHBondContact O-CG 3.34Å; L897-L901 PolarHBondContact O-N 3.37Å
902	A	92.6	Very high	91.2	Very high	1 Å²	1	26 Å²	26	1%	0.008	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	9.3	-179.9	0	0	0	0	0	113.2	N898 F900 F904 Y905	N898-A902 WeakPolarHBondContact O-CB 3.09Å; N898-A902 PolarHBondContact O-N 2.98Å; F900-A902 VanDerWaalsContact C-N 3.26Å; F900-A902 PolarHBondContact O-N 3.48Å; A902-F904 VanDerWaalsContact C-N 3.25Å; A902-F904 PolarHBondContact O-N 3.18Å; A902-Y905 WeakPolarHBondContact O-CB 3.32Å; A902-Y905 PolarHBondContact O-N 2.83Å
903	V	95.5	Very high	91.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	50.8	-177.1	-165.7	0	0	0	0	111	I826 I846 W899 F900 Y905 L913 W917 F920 L928	I826-V903 HydrophobicContact CD1-CG2 4.22Å; I826-V903 HydrophobicContact CG1-CG2 4.28Å; I846-V903 HydrophobicContact CG2-CG2 4.27Å; W899-V903 CarbonylContact O-C 3.6Å; W899-V903 WeakPolarHBondContact O-CA 3.42Å; W899-V903 PolarHBondContact O-N 3.45Å; F900-V903 PolarHBondContact O-N 3.2Å; F900-V903 VanDerWaalsContact O-N 3.17Å; V903-Y905 VanDerWaalsContact C-N 3.26Å; V903-Y905 PolarHBondContact O-N 3.4Å; V903-L913 WeakPolarHBondContact O-CD1 3.37Å; V903-W917 HydrophobicContact CB-CZ2 4.16Å; V903-W917 HydrophobicContact CG1-CZ2 4.4Å; V903-W917 PolarHBondContact O-NE1 3.16Å; V903-W917 VanDerWaalsContact O-NE1 3.1Å; V903-F920 HydrophobicContact CG1-CD1 3.77Å; V903-F920 HydrophobicContact CG1-CD2 4.49Å; V903-F920 HydrophobicContact CG1-CE1 3.87Å; V903-F920 HydrophobicContact CG1-CG 4.09Å; V903-F920 HydrophobicContact CG1-CZ 4.3Å; V903-F920 HydrophobicContact CG2-CE1 4.31Å; V903-F920 HydrophobicContact CG2-CZ 4.4Å; V903-L928 HydrophobicContact CG1-CD2 4.03Å
904	F	95.3	Very high	91.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	3.7	-177	-72	-88.2	0	0	0	117.4	W899 F900 A902 S907 V908 L913 I916 L928 F931 A932 I935	W899-F904 HydrophobicContact CB-CD1 3.93Å; W899-F904 HydrophobicContact CB-CE1 3.79Å; W899-F904 HydrophobicContact CB-CG 4.44Å; W899-F904 HydrophobicContact CB-CZ 4.18Å; W899-F904 HydrophobicContact CD2-CD1 4.34Å; W899-F904 AromaticContact CD2-CE1 3.83Å; W899-F904 HydrophobicContact CD2-CE1 3.83Å; W899-F904 HydrophobicContact CE3-CD1 4.48Å; W899-F904 AromaticContact CE3-CE1 3.55Å; W899-F904 HydrophobicContact CE3-CE1 3.55Å; W899-F904 HydrophobicContact CE3-CZ 4.12Å; W899-F904 HydrophobicContact CG-CD1 4.12Å; W899-F904 AromaticContact CG-CE1 3.95Å; W899-F904 HydrophobicContact CG-CE1 3.95Å; W899-F904 HydrophobicContact CZ3-CE1 4.42Å; W899-F904 PolarHBondContact O-N 2.89Å; F900-F904 HydrophobicContact CE1-CZ 4.48Å; A902-F904 VanDerWaalsContact C-N 3.25Å; A902-F904 PolarHBondContact O-N 3.18Å; F904-S907 WeakPolarHBondContact O-CB 3.34Å; F904-S907 PolarHBondContact O-N 2.84Å; F904-S907 VanDerWaalsContact O-N 3.12Å; F904-V908 HydrophobicContact CB-CG2 4.06Å; F904-V908 HydrophobicContact CD1-CG1 4.09Å; F904-L913 VanDerWaalsContact C-CD1 3.48Å; F904-L913 HydrophobicContact CB-CD1 3.99Å; F904-I916 HydrophobicContact CB-CD1 4.04Å; F904-I916 HydrophobicContact CD1-CD1 4.35Å; F904-I916 HydrophobicContact CD2-CD1 4.13Å; F904-I916 HydrophobicContact CD2-CG2 3.98Å; F904-I916 HydrophobicContact CG-CD1 3.92Å; F904-L928 HydrophobicContact CD2-CD2 4.02Å; F904-L928 HydrophobicContact CE2-CB 4.47Å; F904-L928 HydrophobicContact CE2-CD2 3.9Å; F904-F931 HydrophobicContact CE2-CB 4.06Å; F904-F931 HydrophobicContact CZ-CB 3.94Å; F904-A932 HydrophobicContact CZ-CB 4.16Å; F904-I935 HydrophobicContact CD1-CD1 4.27Å; F904-I935 HydrophobicContact CE1-CD1 3.73Å
905	Y	91.6	Very high	91.7	Very high	22 Å²	22	22.6 Å²	22.6	9%	0.086	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	142.3	174.3	178.9	-90.7	0	0	0	111.6	M786 F825 V829 A902 V903 S907 L913	M786-Y905 HydrophobicContact CE-CD2 3.84Å; M786-Y905 HydrophobicContact CE-CE2 3.29Å; M786-Y905 HydrophobicContact CG-CE2 3.77Å; M786-Y905 WeakPolarHBondContact CG-OH 3.44Å; M786-Y905 PolarHBondContact N-OH 2.85Å; M786-Y905 HydrophobicContact SD-CE2 4.36Å; F825-Y905 HydrophobicContact CB-CD1 3.51Å; F825-Y905 HydrophobicContact CB-CE1 4.05Å; F825-Y905 HydrophobicContact CB-CG 3.93Å; F825-Y905 AromaticContact CD1-CD1 3.41Å; F825-Y905 HydrophobicContact CD1-CD1 3.41Å; F825-Y905 VanDerWaalsContact CD1-CD1 3.41Å; F825-Y905 AromaticContact CD1-CE1 3.04Å; F825-Y905 HydrophobicContact CD1-CE1 3.04Å; F825-Y905 HydrophobicContact CD1-CG 4.45Å; F825-Y905 AromaticContact CD1-CZ 3.89Å; F825-Y905 HydrophobicContact CD2-CD1 4.21Å; F825-Y905 HydrophobicContact CE1-CD1 4.12Å; F825-Y905 AromaticContact CE1-CE1 3.49Å; F825-Y905 HydrophobicContact CE1-CE1 3.49Å; F825-Y905 VanDerWaalsContact CE1-CE1 3.49Å; F825-Y905 AromaticContact CG-CD1 3.45Å; F825-Y905 HydrophobicContact CG-CD1 3.45Å; F825-Y905 VanDerWaalsContact CG-CD1 3.45Å; F825-Y905 AromaticContact CG-CE1 3.65Å; F825-Y905 HydrophobicContact CG-CE1 3.65Å; F825-Y905 HydrophobicContact CG-CG 4.36Å; F825-Y905 HydrophobicContact CZ-CE1 4.38Å; V829-Y905 HydrophobicContact CG2-CD2 3.7Å; V829-Y905 HydrophobicContact CG2-CE2 4.39Å; V829-Y905 HydrophobicContact CG2-CG 4.41Å; A902-Y905 WeakPolarHBondContact O-CB 3.32Å; A902-Y905 PolarHBondContact O-N 2.83Å; V903-Y905 VanDerWaalsContact C-N 3.26Å; V903-Y905 PolarHBondContact O-N 3.4Å; Y905-S907 PolarHBondContact O-N 3.14Å; Y905-S907 PolarHBondContact O-OG 2.84Å; Y905-L913 HydrophobicContact CD2-CD2 3.77Å
906	D	83.8	Confident	92.1	Very high	110 Å²	110	21.4 Å²	21.4	59%	0.588	11%	0.11	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	6.8	-174.5	-164	40.2	0	0	0	115.6
907	S	87.3	Confident	92.3	Very high	8 Å²	8	21.3 Å²	21.3	6%	0.056	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-34.4	-179.2	-52.1	0	0	0	0	112.2	W899 F904 Y905 T960	W899-S907 VanDerWaalsContact CD1-CB 3.48Å; F904-S907 WeakPolarHBondContact O-CB 3.34Å; F904-S907 PolarHBondContact O-N 2.84Å; F904-S907 VanDerWaalsContact O-N 3.12Å; Y905-S907 PolarHBondContact O-N 3.14Å; Y905-S907 PolarHBondContact O-OG 2.84Å; S907-T960 CarbonylContact O-C 3.6Å; S907-T960 VanDerWaalsContact O-C 3.27Å; S907-T960 WeakPolarHBondContact O-CB 3.45Å
908	V	91.1	Very high	92.3	Very high	15 Å²	15	19.2 Å²	19.2	9%	0.091	10%	0.098	C	C	.	.	S	Bend	trans	-125.9	161.7	-178.8	-60	0	0	0	0	110.6	F904 T912 L913 I916 I935 T963	F904-V908 HydrophobicContact CB-CG2 4.06Å; F904-V908 HydrophobicContact CD1-CG1 4.09Å; V908-T912 HydrophobicContact CB-CG2 4.2Å; V908-T912 HydrophobicContact CG2-CG2 4.24Å; V908-L913 HydrophobicContact CG2-CB 4Å; V908-I916 HydrophobicContact CG2-CD1 4.17Å; V908-I935 HydrophobicContact CG1-CD1 4.04Å; V908-T963 WeakPolarHBondContact CB-OG1 3.41Å; V908-T963 WeakPolarHBondContact CG1-OG1 3.24Å
909	P	87.2	Confident	92.6	Very high	24 Å²	24	15.5 Å²	15.5	16%	0.156	8%	0.078	C	C	.	.			trans	-52.5	148.2	170.2	-25.8	35.6	0	0	0	112.1	E911 T912 L913 R961 T963 N964	P909-E911 VanDerWaalsContact C-N 3.31Å; P909-E911 PolarHBondContact O-N 3.32Å; P909-T912 WeakPolarHBondContact O-CA 3.44Å; P909-T912 WeakPolarHBondContact O-CB 3.28Å; P909-T912 PolarHBondContact O-N 2.86Å; P909-L913 PolarHBondContact O-N 2.99Å; P909-R961 WeakPolarHBondContact CG-O 3.38Å; P909-T963 WeakPolarHBondContact CD-OG1 3.32Å; P909-N964 WeakPolarHBondContact CB-OD1 3.26Å; P909-N964 WeakPolarHBondContact CG-OD1 3.39Å
910	F	88.7	Confident	92.7	Very high	33 Å²	33	15.3 Å²	15.3	15%	0.145	8%	0.078	C	C	.	.	H	α-helix	trans	-62	-37.2	-173.9	-170.5	-97.6	0	0	0	113	Y667 F669 M786 L832 F833 T912 L913 I914	Y667-F910 AromaticContact CD1-CE1 3.73Å; Y667-F910 HydrophobicContact CD1-CE1 3.73Å; Y667-F910 AromaticContact CD2-CD1 3.65Å; Y667-F910 HydrophobicContact CD2-CD1 3.65Å; Y667-F910 AromaticContact CD2-CE1 3.69Å; Y667-F910 HydrophobicContact CD2-CE1 3.69Å; Y667-F910 HydrophobicContact CE1-CE1 4.17Å; Y667-F910 HydrophobicContact CE2-CD1 4Å; Y667-F910 HydrophobicContact CE2-CE1 4.13Å; Y667-F910 AromaticContact CG-CD1 3.92Å; Y667-F910 HydrophobicContact CG-CD1 3.92Å; Y667-F910 AromaticContact CG-CE1 3.46Å; Y667-F910 HydrophobicContact CG-CE1 3.46Å; Y667-F910 VanDerWaalsContact CG-CE1 3.46Å; Y667-F910 HydrophobicContact CG-CZ 4.48Å; F669-F910 HydrophobicContact CD2-CD1 4.32Å; F669-F910 HydrophobicContact CD2-CG 4.3Å; F669-F910 HydrophobicContact CE2-CB 4.37Å; F669-F910 AromaticContact CE2-CD1 3.72Å; F669-F910 HydrophobicContact CE2-CD1 3.72Å; F669-F910 AromaticContact CE2-CD2 3.47Å; F669-F910 HydrophobicContact CE2-CD2 3.47Å; F669-F910 VanDerWaalsContact CE2-CD2 3.47Å; F669-F910 AromaticContact CE2-CE1 3.79Å; F669-F910 HydrophobicContact CE2-CE1 3.79Å; F669-F910 AromaticContact CE2-CE2 3.55Å; F669-F910 HydrophobicContact CE2-CE2 3.55Å; F669-F910 AromaticContact CE2-CG 3.56Å; F669-F910 HydrophobicContact CE2-CG 3.56Å; F669-F910 AromaticContact CE2-CZ 3.72Å; F669-F910 HydrophobicContact CE2-CZ 3.72Å; F669-F910 AromaticContact CZ-CD2 3.6Å; F669-F910 HydrophobicContact CZ-CD2 3.6Å; F669-F910 AromaticContact CZ-CE2 3.65Å; F669-F910 HydrophobicContact CZ-CE2 3.65Å; F669-F910 HydrophobicContact CZ-CG 4.13Å; F669-F910 HydrophobicContact CZ-CZ 4.22Å; M786-F910 HydrophobicContact CE-CE2 4.43Å; L832-F910 HydrophobicContact CD1-CE2 3.78Å; L832-F910 HydrophobicContact CD1-CZ 3.48Å; L832-F910 VanDerWaalsContact CD1-CZ 3.48Å; F833-F910 HydrophobicContact CE2-CE1 4.48Å; F833-F910 HydrophobicContact CE2-CZ 4.03Å; F833-F910 HydrophobicContact CZ-CE1 4.09Å; F833-F910 HydrophobicContact CZ-CZ 4.09Å; F910-T912 VanDerWaalsContact C-N 3.27Å; F910-T912 PolarHBondContact O-N 2.92Å; F910-L913 HydrophobicContact CD2-CD2 3.89Å; F910-L913 HydrophobicContact CE2-CD2 4.01Å; F910-L913 WeakPolarHBondContact O-CB 3.34Å; F910-L913 PolarHBondContact O-N 3.33Å; F910-L913 VanDerWaalsContact O-N 3.15Å; F910-I914 HydrophobicContact CD1-CG2 4.05Å; F910-I914 HydrophobicContact CE1-CG2 3.52Å; F910-I914 HydrophobicContact CE2-CG2 4.4Å; F910-I914 HydrophobicContact CZ-CG2 3.72Å; F910-I914 PolarHBondContact O-N 3.35Å
911	E	86.3	Confident	92.7	Very high	59 Å²	59	15.5 Å²	15.5	28%	0.276	8%	0.079	S	C	.	.	H	α-helix	trans	-62.1	-35.8	173.5	-64.5	-69.6	-174.6	0	0	112.2	Y667 P909 I914 R915	Y667-E911 VanDerWaalsContact CE2-OE1 3.28Å; Y667-E911 WeakPolarHBondContact CE2-OE1 3.43Å; Y667-E911 PolarHBondContact OH-OE2 3.11Å; P909-E911 VanDerWaalsContact C-N 3.31Å; P909-E911 PolarHBondContact O-N 3.32Å; E911-I914 WeakPolarHBondContact O-CG1 3.49Å; E911-I914 WeakPolarHBondContact OE2-CD1 3.39Å; E911-R915 WeakPolarHBondContact O-CG 3.35Å; E911-R915 PolarHBondContact O-N 2.83Å
912	T	91.4	Very high	92.7	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.006	8%	0.078	C	C	.	.	H	α-helix	trans	-70.9	-40.2	174.2	-47	0	0	0	0	110.7	V908 P909 F910 R915 I916 T963 V966 L969	V908-T912 HydrophobicContact CB-CG2 4.2Å; V908-T912 HydrophobicContact CG2-CG2 4.24Å; P909-T912 WeakPolarHBondContact O-CA 3.44Å; P909-T912 WeakPolarHBondContact O-CB 3.28Å; P909-T912 PolarHBondContact O-N 2.86Å; F910-T912 VanDerWaalsContact C-N 3.27Å; F910-T912 PolarHBondContact O-N 2.92Å; T912-R915 PolarHBondContact O-N 2.93Å; T912-I916 HydrophobicContact CG2-CD1 4.23Å; T912-I916 WeakPolarHBondContact O-CG1 3.43Å; T912-I916 PolarHBondContact O-N 2.94Å; T912-T963 WeakPolarHBondContact CG2-O 3.41Å; T912-T963 PolarHBondContact OG1-O 2.94Å; T912-V966 HydrophobicContact CG2-CG2 4.26Å; T912-L969 HydrophobicContact CG2-CD2 3.66Å
913	L	94.9	Very high	92.7	Very high	3 Å²	3	17 Å²	17	2%	0.016	9%	0.085	C	C	.	.	H	α-helix	trans	-57.7	-52.1	178.2	177.4	68.1	0	0	0	111.8	V829 V903 F904 Y905 V908 P909 F910 R915 I916 W917	V829-L913 HydrophobicContact CG2-CD2 4Å; V903-L913 WeakPolarHBondContact O-CD1 3.37Å; F904-L913 VanDerWaalsContact C-CD1 3.48Å; F904-L913 HydrophobicContact CB-CD1 3.99Å; Y905-L913 HydrophobicContact CD2-CD2 3.77Å; V908-L913 HydrophobicContact CG2-CB 4Å; P909-L913 PolarHBondContact O-N 2.99Å; F910-L913 HydrophobicContact CD2-CD2 3.89Å; F910-L913 HydrophobicContact CE2-CD2 4.01Å; F910-L913 WeakPolarHBondContact O-CB 3.34Å; F910-L913 PolarHBondContact O-N 3.33Å; F910-L913 VanDerWaalsContact O-N 3.15Å; L913-R915 PolarHBondContact O-N 3.25Å; L913-I916 WeakPolarHBondContact O-CB 3.41Å; L913-I916 PolarHBondContact O-N 3.08Å; L913-I916 VanDerWaalsContact O-N 3.16Å; L913-W917 PolarHBondContact O-N 3.01Å
914	I	94.6	Very high	92.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63.2	-31.4	-177.8	63.1	-178.9	0	0	0	111.8	Y667 F833 F910 E911 W917 D918	Y667-I914 HydrophobicContact CE1-CD1 4.17Å; Y667-I914 HydrophobicContact CE2-CD1 4.4Å; Y667-I914 WeakPolarHBondContact OH-CD1 3.18Å; F833-I914 HydrophobicContact CE2-CG2 3.84Å; F833-I914 HydrophobicContact CZ-CG2 3.76Å; F910-I914 HydrophobicContact CD1-CG2 4.05Å; F910-I914 HydrophobicContact CE1-CG2 3.52Å; F910-I914 HydrophobicContact CE2-CG2 4.4Å; F910-I914 HydrophobicContact CZ-CG2 3.72Å; F910-I914 PolarHBondContact O-N 3.35Å; E911-I914 WeakPolarHBondContact O-CG1 3.49Å; E911-I914 WeakPolarHBondContact OE2-CD1 3.39Å; I914-W917 WeakPolarHBondContact O-CB 3.29Å; I914-W917 PolarHBondContact O-N 3.4Å; I914-D918 VanDerWaalsContact O-CG 3.31Å; I914-D918 PolarHBondContact O-N 2.81Å
915	R	94.2	Very high	92.5	Very high	25 Å²	25	18 Å²	18	9%	0.094	9%	0.094	C	C	.	.	H	α-helix	trans	-75.2	-35	178.4	-62.9	-71.3	-63.3	96	6.9	111.6	C725 R726 S727 G728 E911 T912 L913 W917 D918 V919 V966 I970	C725-R915 PolarHBondContact O-NH1 3.45Å; R726-R915 PolarHBondContact O-NH2 2.81Å; S727-R915 PolarHBondContact O-NH2 3.35Å; G728-R915 VanDerWaalsContact CA-NH2 3.33Å; G728-R915 VanDerWaalsContact N-NH2 3.18Å; E911-R915 WeakPolarHBondContact O-CG 3.35Å; E911-R915 PolarHBondContact O-N 2.83Å; T912-R915 PolarHBondContact O-N 2.93Å; L913-R915 PolarHBondContact O-N 3.25Å; R915-W917 VanDerWaalsContact C-N 3.3Å; R915-D918 IonicContact NH1-OD2 3.74Å; R915-D918 PolarHBondContact NH1-OD2 3.44Å; R915-D918 VanDerWaalsContact NH1-OD2 3.1Å; R915-V919 PolarHBondContact O-N 2.97Å; R915-V966 HydrophobicContact CB-CG1 3.47Å; R915-V966 VanDerWaalsContact CB-CG1 3.47Å; R915-V966 HydrophobicContact CG-CG1 3.76Å; R915-I970 VanDerWaalsContact NH2-CD1 3.26Å
916	I	96.7	Very high	92.5	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-61.6	-42.1	167.3	-68.2	170.6	0	0	0	110	F904 V908 T912 L913 V919 F920 F931	F904-I916 HydrophobicContact CB-CD1 4.04Å; F904-I916 HydrophobicContact CD1-CD1 4.35Å; F904-I916 HydrophobicContact CD2-CD1 4.13Å; F904-I916 HydrophobicContact CD2-CG2 3.98Å; F904-I916 HydrophobicContact CG-CD1 3.92Å; V908-I916 HydrophobicContact CG2-CD1 4.17Å; T912-I916 HydrophobicContact CG2-CD1 4.23Å; T912-I916 WeakPolarHBondContact O-CG1 3.43Å; T912-I916 PolarHBondContact O-N 2.94Å; L913-I916 WeakPolarHBondContact O-CB 3.41Å; L913-I916 PolarHBondContact O-N 3.08Å; L913-I916 VanDerWaalsContact O-N 3.16Å; I916-V919 PolarHBondContact O-N 3.07Å; I916-F920 WeakPolarHBondContact O-CB 3.34Å; I916-F920 PolarHBondContact O-N 2.96Å; I916-F931 HydrophobicContact CB-CD2 4.14Å; I916-F931 HydrophobicContact CB-CE2 3.97Å; I916-F931 HydrophobicContact CD1-CB 4.48Å; I916-F931 HydrophobicContact CD1-CD2 4.4Å; I916-F931 HydrophobicContact CD1-CG 4.26Å; I916-F931 HydrophobicContact CG1-CD1 4.12Å; I916-F931 HydrophobicContact CG1-CD2 3.73Å; I916-F931 HydrophobicContact CG1-CE1 4.14Å; I916-F931 HydrophobicContact CG1-CE2 3.72Å; I916-F931 HydrophobicContact CG1-CG 3.93Å; I916-F931 HydrophobicContact CG1-CZ 3.94Å; I916-F931 HydrophobicContact CG2-CD2 3.71Å; I916-F931 HydrophobicContact CG2-CE2 3.89Å
917	W	97.3	Very high	93.1	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-65.5	-42.8	179	-84.8	54.1	0	0	0	113.3	W738 I826 V829 I846 V903 L913 I914 R915 V919 F920 L921	W738-W917 HydrophobicContact CE3-CE3 4.38Å; W738-W917 HydrophobicContact CH2-CB 3.77Å; W738-W917 HydrophobicContact CH2-CD2 4.12Å; W738-W917 AromaticContact CH2-CE3 3.63Å; W738-W917 HydrophobicContact CH2-CE3 3.63Å; W738-W917 HydrophobicContact CH2-CG 4.23Å; W738-W917 HydrophobicContact CZ2-CB 3.57Å; W738-W917 HydrophobicContact CZ2-CE3 4.38Å; W738-W917 HydrophobicContact CZ2-CG 4.49Å; W738-W917 AromaticContact CZ3-CE3 3.62Å; W738-W917 HydrophobicContact CZ3-CE3 3.62Å; W738-W917 HydrophobicContact CZ3-CZ3 4.14Å; I826-W917 HydrophobicContact CG2-CH2 3.84Å; I826-W917 HydrophobicContact CG2-CZ2 4.34Å; I826-W917 WeakPolarHBondContact O-CH2 3.17Å; V829-W917 HydrophobicContact CB-CH2 3.66Å; V829-W917 HydrophobicContact CB-CZ2 3.71Å; V829-W917 HydrophobicContact CB-CZ3 4.18Å; V829-W917 HydrophobicContact CG1-CD2 3.79Å; V829-W917 HydrophobicContact CG1-CE3 3.81Å; V829-W917 HydrophobicContact CG1-CH2 3.66Å; V829-W917 HydrophobicContact CG1-CZ2 3.64Å; V829-W917 HydrophobicContact CG1-CZ3 3.74Å; V829-W917 HydrophobicContact CG2-CZ2 4.21Å; I846-W917 HydrophobicContact CD1-CH2 3.76Å; I846-W917 HydrophobicContact CD1-CZ2 4.48Å; I846-W917 HydrophobicContact CD1-CZ3 3.82Å; V903-W917 HydrophobicContact CB-CZ2 4.16Å; V903-W917 HydrophobicContact CG1-CZ2 4.4Å; V903-W917 PolarHBondContact O-NE1 3.16Å; V903-W917 VanDerWaalsContact O-NE1 3.1Å; L913-W917 PolarHBondContact O-N 3.01Å; I914-W917 WeakPolarHBondContact O-CB 3.29Å; I914-W917 PolarHBondContact O-N 3.4Å; R915-W917 VanDerWaalsContact C-N 3.3Å; W917-V919 PolarHBondContact O-N 3.5Å; W917-F920 PolarHBondContact O-N 3.3Å; W917-L921 HydrophobicContact CE3-CD1 4.39Å; W917-L921 WeakPolarHBondContact O-CB 3.44Å; W917-L921 WeakPolarHBondContact O-CG 3.45Å; W917-L921 PolarHBondContact O-N 3.39Å
918	D	95.9	Very high	93.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-51	-43.9	174.4	-70.4	-21.2	0	0	0	111.5	V729 R734 W738 I914 R915	V729-D918 HydrophobicContact CG2-CB 3.93Å; V729-D918 VanDerWaalsContact CG2-CG 3.48Å; V729-D918 WeakPolarHBondContact CG2-OD1 3.44Å; V729-D918 PolarHBondContact N-OD2 3.05Å; R734-D918 IonicContact NE-OD1 3.44Å; W738-D918 PolarHBondContact NE1-OD1 3.07Å; I914-D918 VanDerWaalsContact O-CG 3.31Å; I914-D918 PolarHBondContact O-N 2.81Å; R915-D918 IonicContact NH1-OD2 3.74Å; R915-D918 PolarHBondContact NH1-OD2 3.44Å; R915-D918 VanDerWaalsContact NH1-OD2 3.1Å
919	V	96.4	Very high	93.8	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-80.1	-39.4	-179.6	-175	0	0	0	0	111.5	R726 R915 I916 W917 L922 E923 T927 F931 F974	R726-V919 HydrophobicContact CG-CG1 4.39Å; R726-V919 HydrophobicContact CG-CG2 4.07Å; R915-V919 PolarHBondContact O-N 2.97Å; I916-V919 PolarHBondContact O-N 3.07Å; W917-V919 PolarHBondContact O-N 3.5Å; V919-L922 PolarHBondContact O-N 3.44Å; V919-E923 HydrophobicContact CG1-CB 4.4Å; V919-E923 HydrophobicContact CG1-CG 4.24Å; V919-E923 WeakPolarHBondContact CG1-OE1 3.18Å; V919-E923 WeakPolarHBondContact O-CB 3.31Å; V919-E923 PolarHBondContact O-N 3.34Å; V919-T927 HydrophobicContact CB-CG2 4.05Å; V919-T927 HydrophobicContact CG1-CG2 3.76Å; V919-F931 HydrophobicContact CB-CE2 4.41Å; V919-F974 HydrophobicContact CG1-CE1 4.42Å; V919-F974 HydrophobicContact CG1-CE2 4.06Å; V919-F974 HydrophobicContact CG1-CZ 3.55Å
920	F	96.9	Very high	94.3	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-63.8	-41.1	-179.5	169.9	-104.8	0	0	0	112.5	I846 F850 V903 I916 W917 L922 G924 T927 L928	I846-F920 HydrophobicContact CB-CE1 4.49Å; I846-F920 HydrophobicContact CD1-CE1 4.16Å; I846-F920 HydrophobicContact CG1-CE1 3.9Å; I846-F920 HydrophobicContact CG2-CE1 4.03Å; I846-F920 HydrophobicContact CG2-CZ 4.08Å; F850-F920 HydrophobicContact CB-CE2 4.29Å; F850-F920 HydrophobicContact CB-CZ 3.89Å; F850-F920 HydrophobicContact CD2-CE1 4.11Å; F850-F920 HydrophobicContact CD2-CZ 4.23Å; F850-F920 HydrophobicContact CG-CZ 4.46Å; V903-F920 HydrophobicContact CG1-CD1 3.77Å; V903-F920 HydrophobicContact CG1-CD2 4.49Å; V903-F920 HydrophobicContact CG1-CE1 3.87Å; V903-F920 HydrophobicContact CG1-CG 4.09Å; V903-F920 HydrophobicContact CG1-CZ 4.3Å; V903-F920 HydrophobicContact CG2-CE1 4.31Å; V903-F920 HydrophobicContact CG2-CZ 4.4Å; I916-F920 WeakPolarHBondContact O-CB 3.34Å; I916-F920 PolarHBondContact O-N 2.96Å; W917-F920 PolarHBondContact O-N 3.3Å; F920-L922 PolarHBondContact O-N 2.87Å; F920-G924 WeakPolarHBondContact CD2-O 3.45Å; F920-G924 VanDerWaalsContact O-CA 3.25Å; F920-G924 WeakPolarHBondContact O-CA 3.3Å; F920-G924 PolarHBondContact O-N 3.24Å; F920-T927 HydrophobicContact CB-CG2 4.26Å; F920-L928 HydrophobicContact CD2-CD2 3.99Å; F920-L928 HydrophobicContact CD2-CG 4.08Å; F920-L928 HydrophobicContact CE2-CD1 4.07Å; F920-L928 HydrophobicContact CE2-CD2 4.21Å; F920-L928 HydrophobicContact CE2-CG 4.05Å
921	L	95.7	Very high	94.7	Very high	4 Å²	4	11.6 Å²	11.6	2%	0.021	6%	0.056	C	C	.	.	H	α-helix	trans	-68.4	-16.3	178.7	-67.3	175.8	0	0	0	113.4	W738 L741 I742 I846 F850 W917	W738-L921 HydrophobicContact CB-CD1 4.01Å; W738-L921 HydrophobicContact CD2-CD1 3.47Å; W738-L921 VanDerWaalsContact CD2-CD1 3.47Å; W738-L921 HydrophobicContact CE3-CD1 3.94Å; W738-L921 HydrophobicContact CG-CD1 3.5Å; W738-L921 HydrophobicContact CZ2-CD1 4.46Å; L741-L921 HydrophobicContact CD1-CB 3.97Å; I742-L921 HydrophobicContact CG1-CD2 4.34Å; I846-L921 HydrophobicContact CD1-CD2 4.26Å; I846-L921 HydrophobicContact CG1-CD2 4.23Å; F850-L921 HydrophobicContact CD2-CD2 4.39Å; F850-L921 HydrophobicContact CE2-CD2 3.74Å; F850-L921 WeakPolarHBondContact CZ-O 3.43Å; W917-L921 HydrophobicContact CE3-CD1 4.39Å; W917-L921 WeakPolarHBondContact O-CB 3.44Å; W917-L921 WeakPolarHBondContact O-CG 3.45Å; W917-L921 PolarHBondContact O-N 3.39Å
922	L	94.3	Very high	95.2	Very high	18 Å²	18	8.8 Å²	8.8	9%	0.094	4%	0.043	C	C	.	.	H	α-helix	trans	-100.9	-47.1	176.9	176.6	65.8	0	0	0	113	R718 L721 E722 C725 L741 V919 F920	R718-L922 PolarHBondContact NH2-O 3.46Å; R718-L922 VanDerWaalsContact NH2-O 3.16Å; L721-L922 HydrophobicContact CB-CD2 4.34Å; L721-L922 HydrophobicContact CD2-CD1 3.56Å; L721-L922 HydrophobicContact CD2-CD2 4.46Å; L721-L922 HydrophobicContact CG-CD1 3.94Å; L721-L922 HydrophobicContact CG-CD2 3.91Å; E722-L922 HydrophobicContact CB-CD2 4.26Å; E722-L922 HydrophobicContact CG-CD2 3.81Å; E722-L922 HydrophobicContact CG-CG 4.49Å; C725-L922 HydrophobicContact CB-CD2 3.93Å; L741-L922 HydrophobicContact CD1-CB 4.31Å; L741-L922 HydrophobicContact CD2-CB 4.41Å; L741-L922 HydrophobicContact CD2-CD1 3.76Å; V919-L922 PolarHBondContact O-N 3.44Å; F920-L922 PolarHBondContact O-N 2.87Å
923	E	92.7	Very high	95.5	Very high	34 Å²	34	8.7 Å²	8.7	16%	0.159	4%	0.043	C	C	.	.	H	α-helix	trans	-98.2	-9.5	-172.1	-64.8	-170.5	-128.4	0	0	113.3	E722 R726 V919 T927 F974	E722-E923 HydrophobicContact CG-CG 4.19Å; R726-E923 IonicContact CZ-OE1 2.85Å; R726-E923 IonicContact CZ-OE2 3.16Å; R726-E923 IonicContact NE-OE1 3.48Å; R726-E923 PolarHBondContact NE-OE1 3.28Å; R726-E923 IonicContact NE-OE2 3.31Å; R726-E923 IonicContact NH2-OE1 3.29Å; R726-E923 PolarHBondContact NH2-OE1 2.88Å; R726-E923 IonicContact NH2-OE2 3.1Å; R726-E923 PolarHBondContact NH2-OE2 2.95Å; V919-E923 HydrophobicContact CG1-CB 4.4Å; V919-E923 HydrophobicContact CG1-CG 4.24Å; V919-E923 WeakPolarHBondContact CG1-OE1 3.18Å; V919-E923 WeakPolarHBondContact O-CB 3.31Å; V919-E923 PolarHBondContact O-N 3.34Å; E923-T927 WeakPolarHBondContact CB-OG1 3.17Å; E923-F974 WeakPolarHBondContact OE2-CE1 3.26Å
924	G	92.8	Very high	95.6	Very high	11 Å²	11	8.6 Å²	8.6	11%	0.113	4%	0.042	C	C	.	.			trans	78.1	-160.7	174.9	0	0	0	0	0	114.8	F920 E926 T927	F920-G924 WeakPolarHBondContact CD2-O 3.45Å; F920-G924 VanDerWaalsContact O-CA 3.25Å; F920-G924 WeakPolarHBondContact O-CA 3.3Å; F920-G924 PolarHBondContact O-N 3.24Å; G924-E926 VanDerWaalsContact C-N 3.25Å; G924-E926 PolarHBondContact O-N 3.23Å; G924-E926 VanDerWaalsContact O-N 3.16Å; G924-T927 VanDerWaalsContact O-CB 3.25Å; G924-T927 WeakPolarHBondContact O-CB 3.29Å; G924-T927 PolarHBondContact O-N 3.36Å; G924-T927 PolarHBondContact O-OG1 3.01Å
925	S	93.4	Very high	95.6	Very high	10 Å²	10	8.7 Å²	8.7	7%	0.07	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-15.9	-169.5	54.5	0	0	0	0	115.8	F850 T927 L928 R990	F850-S925 WeakPolarHBondContact O-CB 3.09Å; F850-S925 PolarHBondContact O-OG 3Å; S925-T927 PolarHBondContact O-N 3.32Å; S925-L928 WeakPolarHBondContact O-CB 3.35Å; S925-L928 PolarHBondContact O-N 3.49Å; S925-L928 VanDerWaalsContact O-N 3.11Å; S925-R990 PolarHBondContact OG-NH1 2.71Å; S925-R990 PolarHBondContact OG-NH2 3.23Å; S925-R990 VanDerWaalsContact OG-NH2 3.15Å
926	E	92	Very high	95.6	Very high	40 Å²	40	7.5 Å²	7.5	19%	0.187	4%	0.038	C	C	.	.	H	α-helix	trans	-60.7	-32.2	174.5	-66.9	179.5	-153.8	0	0	112.7	G924 L928 F929 R930 P983 I986	G924-E926 VanDerWaalsContact C-N 3.25Å; G924-E926 PolarHBondContact O-N 3.23Å; G924-E926 VanDerWaalsContact O-N 3.16Å; E926-L928 PolarHBondContact O-N 3.08Å; E926-F929 PolarHBondContact O-N 2.89Å; E926-F929 VanDerWaalsContact O-N 3.15Å; E926-R930 PolarHBondContact O-N 3.09Å; E926-P983 WeakPolarHBondContact OE1-CA 3.46Å; E926-P983 WeakPolarHBondContact OE1-CB 3.42Å; E926-P983 WeakPolarHBondContact OE1-CG 3.34Å; E926-P983 WeakPolarHBondContact OE2-CD 3.43Å; E926-P983 WeakPolarHBondContact OE2-CG 3.33Å; E926-I986 HydrophobicContact CB-CD1 4.4Å; E926-I986 HydrophobicContact CG-CD1 3.88Å
927	T	94.7	Very high	95.6	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-57.4	-33.9	176.6	-58.7	0	0	0	0	111.8	V919 F920 E923 G924 S925 F929 R930 F931	V919-T927 HydrophobicContact CB-CG2 4.05Å; V919-T927 HydrophobicContact CG1-CG2 3.76Å; F920-T927 HydrophobicContact CB-CG2 4.26Å; E923-T927 WeakPolarHBondContact CB-OG1 3.17Å; G924-T927 VanDerWaalsContact O-CB 3.25Å; G924-T927 WeakPolarHBondContact O-CB 3.29Å; G924-T927 PolarHBondContact O-N 3.36Å; G924-T927 PolarHBondContact O-OG1 3.01Å; S925-T927 PolarHBondContact O-N 3.32Å; T927-F929 PolarHBondContact O-N 3.22Å; T927-R930 PolarHBondContact O-N 3.39Å; T927-F931 HydrophobicContact CG2-CD2 3.43Å; T927-F931 VanDerWaalsContact CG2-CD2 3.43Å; T927-F931 HydrophobicContact CG2-CE2 3.21Å; T927-F931 HydrophobicContact CG2-CZ 4.39Å; T927-F931 VanDerWaalsContact O-CD2 3.25Å; T927-F931 WeakPolarHBondContact O-CD2 3.44Å; T927-F931 PolarHBondContact O-N 3.17Å
928	L	96.6	Very high	95.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-63.6	-42.6	178.2	-57.9	-179.9	0	0	0	112	L851 F900 V903 F904 F920 S925 E926 A932	L851-L928 HydrophobicContact CD2-CD1 3.95Å; F900-L928 HydrophobicContact CB-CD1 4.37Å; F900-L928 HydrophobicContact CD1-CB 3.94Å; F900-L928 HydrophobicContact CE1-CB 3.75Å; F900-L928 WeakPolarHBondContact CE1-O 3.39Å; F900-L928 HydrophobicContact CE2-CB 4.35Å; F900-L928 HydrophobicContact CG-CB 4.33Å; F900-L928 HydrophobicContact CG-CD1 4.29Å; F900-L928 HydrophobicContact CZ-CB 3.97Å; V903-L928 HydrophobicContact CG1-CD2 4.03Å; F904-L928 HydrophobicContact CD2-CD2 4.02Å; F904-L928 HydrophobicContact CE2-CB 4.47Å; F904-L928 HydrophobicContact CE2-CD2 3.9Å; F920-L928 HydrophobicContact CD2-CD2 3.99Å; F920-L928 HydrophobicContact CD2-CG 4.08Å; F920-L928 HydrophobicContact CE2-CD1 4.07Å; F920-L928 HydrophobicContact CE2-CD2 4.21Å; F920-L928 HydrophobicContact CE2-CG 4.05Å; S925-L928 WeakPolarHBondContact O-CB 3.35Å; S925-L928 PolarHBondContact O-N 3.49Å; S925-L928 VanDerWaalsContact O-N 3.11Å; E926-L928 PolarHBondContact O-N 3.08Å; L928-A932 WeakPolarHBondContact O-CB 3.48Å; L928-A932 PolarHBondContact O-N 3.45Å
929	F	97.6	Very high	94.9	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-65.6	-43.1	175.6	-61.5	-86.5	0	0	0	111.6	D866 V869 L870 I873 F900 E926 T927 A932 V933 F980 I986	D866-F929 HydrophobicContact CB-CE1 4.32Å; D866-F929 HydrophobicContact CB-CZ 3.93Å; D866-F929 WeakPolarHBondContact O-CE1 3.27Å; V869-F929 HydrophobicContact CB-CE1 3.89Å; V869-F929 HydrophobicContact CB-CZ 4.27Å; V869-F929 HydrophobicContact CG1-CD1 4.47Å; V869-F929 HydrophobicContact CG1-CE1 3.79Å; V869-F929 HydrophobicContact CG1-CZ 4.12Å; L870-F929 HydrophobicContact CB-CD1 4.01Å; L870-F929 HydrophobicContact CB-CE1 4.13Å; L870-F929 HydrophobicContact CD1-CD1 4.16Å; I873-F929 HydrophobicContact CD1-CB 4.03Å; I873-F929 HydrophobicContact CD1-CD1 3.78Å; I873-F929 HydrophobicContact CD1-CE1 4.48Å; I873-F929 HydrophobicContact CD1-CG 4.05Å; F900-F929 HydrophobicContact CE2-CD1 4.01Å; F900-F929 AromaticContact CE2-CE1 3.85Å; F900-F929 HydrophobicContact CE2-CE1 3.85Å; F900-F929 HydrophobicContact CE2-CG 4.45Å; F900-F929 HydrophobicContact CE2-CZ 4.16Å; F900-F929 HydrophobicContact CZ-CD1 4.04Å; F900-F929 HydrophobicContact CZ-CE1 4.35Å; F900-F929 HydrophobicContact CZ-CG 4.31Å; E926-F929 PolarHBondContact O-N 2.89Å; E926-F929 VanDerWaalsContact O-N 3.15Å; T927-F929 PolarHBondContact O-N 3.22Å; F929-A932 PolarHBondContact O-N 3.42Å; F929-V933 WeakPolarHBondContact O-CB 3.38Å; F929-V933 VanDerWaalsContact O-CG2 3.22Å; F929-V933 WeakPolarHBondContact O-CG2 3.21Å; F929-V933 PolarHBondContact O-N 3.15Å; F929-F980 HydrophobicContact CB-CE1 4.18Å; F929-F980 HydrophobicContact CB-CZ 3.92Å; F929-I986 HydrophobicContact CE2-CG2 4.09Å; F929-I986 HydrophobicContact CZ-CG2 4.37Å
930	R	96.9	Very high	94.8	Very high	36 Å²	36	18 Å²	18	14%	0.136	8%	0.083	C	C	.	.	H	α-helix	trans	-58.9	-50.2	179.3	-69.1	178.1	177.4	-82.4	-0.4	111.2	E926 T927 V933 A934 A973 F974 F980	E926-R930 PolarHBondContact O-N 3.09Å; T927-R930 PolarHBondContact O-N 3.39Å; R930-V933 PolarHBondContact O-N 2.95Å; R930-A934 WeakPolarHBondContact O-CB 3.26Å; R930-A934 PolarHBondContact O-N 3.25Å; R930-A973 HydrophobicContact CB-CB 4.22Å; R930-A973 PolarHBondContact NH1-O 2.9Å; R930-F974 VanDerWaalsContact CD-CE1 3.44Å; R930-F980 HydrophobicContact CB-CZ 4.37Å; R930-F980 HydrophobicContact CG-CD1 3.83Å; R930-F980 HydrophobicContact CG-CD2 4.38Å; R930-F980 HydrophobicContact CG-CE1 3.54Å; R930-F980 HydrophobicContact CG-CE2 4.13Å; R930-F980 HydrophobicContact CG-CG 4.24Å; R930-F980 HydrophobicContact CG-CZ 3.7Å
931	F	97.4	Very high	94.4	Very high	1 Å²	1	23.1 Å²	23.1	0%	0.004	11%	0.11	C	C	.	.	H	α-helix	trans	-67.7	-40.9	179.7	-74.7	-59.1	0	0	0	112.6	F904 I916 V919 T927 V933 A934 I935 L969 I970 A973 F974	F904-F931 HydrophobicContact CE2-CB 4.06Å; F904-F931 HydrophobicContact CZ-CB 3.94Å; I916-F931 HydrophobicContact CB-CD2 4.14Å; I916-F931 HydrophobicContact CB-CE2 3.97Å; I916-F931 HydrophobicContact CD1-CB 4.48Å; I916-F931 HydrophobicContact CD1-CD2 4.4Å; I916-F931 HydrophobicContact CD1-CG 4.26Å; I916-F931 HydrophobicContact CG1-CD1 4.12Å; I916-F931 HydrophobicContact CG1-CD2 3.73Å; I916-F931 HydrophobicContact CG1-CE1 4.14Å; I916-F931 HydrophobicContact CG1-CE2 3.72Å; I916-F931 HydrophobicContact CG1-CG 3.93Å; I916-F931 HydrophobicContact CG1-CZ 3.94Å; I916-F931 HydrophobicContact CG2-CD2 3.71Å; I916-F931 HydrophobicContact CG2-CE2 3.89Å; V919-F931 HydrophobicContact CB-CE2 4.41Å; T927-F931 HydrophobicContact CG2-CD2 3.43Å; T927-F931 VanDerWaalsContact CG2-CD2 3.43Å; T927-F931 HydrophobicContact CG2-CE2 3.21Å; T927-F931 HydrophobicContact CG2-CZ 4.39Å; T927-F931 VanDerWaalsContact O-CD2 3.25Å; T927-F931 WeakPolarHBondContact O-CD2 3.44Å; T927-F931 PolarHBondContact O-N 3.17Å; F931-V933 PolarHBondContact O-N 3.06Å; F931-A934 PolarHBondContact O-N 3.48Å; F931-I935 VanDerWaalsContact O-CG1 3.26Å; F931-I935 WeakPolarHBondContact O-CG1 3.29Å; F931-I935 PolarHBondContact O-N 3.47Å; F931-L969 HydrophobicContact CD1-CD1 4.37Å; F931-L969 HydrophobicContact CD1-CD2 3.94Å; F931-L969 HydrophobicContact CD1-CG 3.85Å; F931-L969 HydrophobicContact CE1-CD2 4.28Å; F931-L969 HydrophobicContact CE1-CG 4.12Å; F931-I970 HydrophobicContact CE1-CG1 3.93Å; F931-I970 HydrophobicContact CZ-CG1 4.1Å; F931-A973 HydrophobicContact CD1-CB 4.06Å; F931-A973 HydrophobicContact CE1-CB 4.13Å; F931-F974 HydrophobicContact CE1-CE2 4.49Å; F931-F974 HydrophobicContact CE2-CE2 4.49Å; F931-F974 HydrophobicContact CZ-CE2 4.05Å
932	A	97.3	Very high	93.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.8	-45.8	176.3	0	0	0	0	0	112.1	L870 W899 F900 F904 L928 F929 L936	L870-A932 HydrophobicContact CD1-CB 3.85Å; L870-A932 HydrophobicContact CD2-CB 4.18Å; W899-A932 HydrophobicContact CE3-CB 4.03Å; W899-A932 HydrophobicContact CZ3-CB 4.13Å; F900-A932 HydrophobicContact CE1-CB 3.86Å; F900-A932 HydrophobicContact CZ-CB 4.23Å; F904-A932 HydrophobicContact CZ-CB 4.16Å; L928-A932 WeakPolarHBondContact O-CB 3.48Å; L928-A932 PolarHBondContact O-N 3.45Å; F929-A932 PolarHBondContact O-N 3.42Å; A932-L936 WeakPolarHBondContact O-CG 3.38Å; A932-L936 PolarHBondContact O-N 3.5Å
933	V	97.3	Very high	93.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-69.1	-36.2	177.8	179.7	0	0	0	0	111	L870 I873 V874 K877 L878 F929 R930 F931 L936 K937 L977	L870-V933 HydrophobicContact CD1-CG2 3.83Å; I873-V933 HydrophobicContact CB-CG2 4.39Å; I873-V933 HydrophobicContact CG2-CG2 3.77Å; V874-V933 HydrophobicContact CG2-CG2 4.07Å; K877-V933 HydrophobicContact CB-CG1 3.94Å; K877-V933 HydrophobicContact CG-CG1 4.38Å; L878-V933 HydrophobicContact CD1-CG1 4.11Å; L878-V933 HydrophobicContact CG-CG1 4.35Å; F929-V933 WeakPolarHBondContact O-CB 3.38Å; F929-V933 VanDerWaalsContact O-CG2 3.22Å; F929-V933 WeakPolarHBondContact O-CG2 3.21Å; F929-V933 PolarHBondContact O-N 3.15Å; R930-V933 PolarHBondContact O-N 2.95Å; F931-V933 PolarHBondContact O-N 3.06Å; V933-L936 PolarHBondContact O-N 3.25Å; V933-K937 VanDerWaalsContact O-CB 3.28Å; V933-K937 WeakPolarHBondContact O-CB 3.34Å; V933-K937 PolarHBondContact O-N 2.86Å; V933-L977 HydrophobicContact CB-CD1 3.96Å; V933-L977 HydrophobicContact CG1-CD1 3.74Å; V933-L977 HydrophobicContact CG1-CD2 3.71Å; V933-L977 HydrophobicContact CG1-CG 4.42Å
934	A	96.7	Very high	93.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.1	-42.9	177.2	0	0	0	0	0	112.3	R930 F931 L936 K937 R938 L969 T972 A973 L977	R930-A934 WeakPolarHBondContact O-CB 3.26Å; R930-A934 PolarHBondContact O-N 3.25Å; F931-A934 PolarHBondContact O-N 3.48Å; A934-L936 VanDerWaalsContact C-N 3.32Å; A934-L936 PolarHBondContact O-N 3Å; A934-K937 PolarHBondContact O-N 2.99Å; A934-R938 WeakPolarHBondContact O-CG 3.19Å; A934-R938 PolarHBondContact O-N 3.33Å; A934-L969 HydrophobicContact CB-CD1 3.7Å; A934-T972 HydrophobicContact CB-CG2 3.84Å; A934-A973 HydrophobicContact CB-CB 3.79Å; A934-L977 HydrophobicContact CB-CD1 4.15Å
935	I	94.7	Very high	93.5	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-59.7	-45.2	174.6	-68	171.1	0	0	0	110.3	W899 F904 V908 F931 N939 T960 T963 L969	W899-I935 HydrophobicContact CH2-CG2 4.29Å; F904-I935 HydrophobicContact CD1-CD1 4.27Å; F904-I935 HydrophobicContact CE1-CD1 3.73Å; V908-I935 HydrophobicContact CG1-CD1 4.04Å; F931-I935 VanDerWaalsContact O-CG1 3.26Å; F931-I935 WeakPolarHBondContact O-CG1 3.29Å; F931-I935 PolarHBondContact O-N 3.47Å; I935-N939 PolarHBondContact O-N 3.01Å; I935-N939 PolarHBondContact O-ND2 2.87Å; I935-T960 HydrophobicContact CG2-CG2 3.74Å; I935-T963 HydrophobicContact CG1-CG2 4.17Å; I935-T963 HydrophobicContact CG2-CG2 4.38Å; I935-L969 HydrophobicContact CG1-CD1 3.77Å; I935-L969 HydrophobicContact CG1-CD2 4.46Å
936	L	95.5	Very high	93.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.3	-40.8	177.1	-68.6	173.3	0	0	0	112.3	V874 L878 L881 I892 A932 V933 A934 N939 Q940 L943 L956	V874-L936 HydrophobicContact CG1-CD1 4.46Å; V874-L936 HydrophobicContact CG2-CD1 3.7Å; L878-L936 HydrophobicContact CD1-CB 3.63Å; L881-L936 HydrophobicContact CD2-CB 4.01Å; L881-L936 HydrophobicContact CD2-CD2 4.33Å; I892-L936 HydrophobicContact CD1-CD1 4.4Å; A932-L936 WeakPolarHBondContact O-CG 3.38Å; A932-L936 PolarHBondContact O-N 3.5Å; V933-L936 PolarHBondContact O-N 3.25Å; A934-L936 VanDerWaalsContact C-N 3.32Å; A934-L936 PolarHBondContact O-N 3Å; L936-N939 CarbonylContact O-C 3.59Å; L936-N939 PolarHBondContact O-N 3.48Å; L936-Q940 WeakPolarHBondContact O-CA 3.49Å; L936-Q940 PolarHBondContact O-N 2.89Å; L936-L943 HydrophobicContact CD2-CD1 4.14Å; L936-L956 HydrophobicContact CD2-CD1 3.73Å
937	K	95.1	Very high	92.8	Very high	62 Å²	62	31.6 Å²	31.6	27%	0.27	16%	0.157	S	C	.	.	H	α-helix	trans	-63.5	-47	179.3	178.5	166.1	168.1	166.9	0	111.7	L878 V933 A934 N939 Q940 T972 E976 L977	L878-K937 HydrophobicContact CD1-CB 4.2Å; L878-K937 HydrophobicContact CD2-CB 3.71Å; L878-K937 HydrophobicContact CD2-CD 4.2Å; L878-K937 HydrophobicContact CD2-CG 3.9Å; V933-K937 VanDerWaalsContact O-CB 3.28Å; V933-K937 WeakPolarHBondContact O-CB 3.34Å; V933-K937 PolarHBondContact O-N 2.86Å; A934-K937 PolarHBondContact O-N 2.99Å; K937-N939 PolarHBondContact O-N 2.82Å; K937-Q940 VanDerWaalsContact O-CB 3.26Å; K937-Q940 WeakPolarHBondContact O-CB 3.22Å; K937-Q940 PolarHBondContact O-N 3.45Å; K937-Q940 VanDerWaalsContact O-N 3.17Å; K937-T972 HydrophobicContact CB-CG2 4.1Å; K937-T972 HydrophobicContact CD-CG2 3.79Å; K937-T972 HydrophobicContact CG-CG2 4.02Å; K937-E976 PolarHBondContact NZ-O 2.82Å; K937-L977 HydrophobicContact CD-CD2 3.55Å; K937-L977 HydrophobicContact CD-CG 4.19Å
938	R	90.1	Very high	92.3	Very high	104 Å²	104	34.6 Å²	34.6	39%	0.392	17%	0.173	S	C	.	.	H	α-helix	trans	-63.3	-25.3	-179.7	-74.1	-169.5	63.2	152.3	11.1	113.7	A934 D965 G968 T972	A934-R938 WeakPolarHBondContact O-CG 3.19Å; A934-R938 PolarHBondContact O-N 3.33Å; R938-D965 IonicContact CZ-OD2 3.59Å; R938-D965 PolarHBondContact NH1-O 3.43Å; R938-D965 IonicContact NH1-OD2 3.01Å; R938-D965 PolarHBondContact NH1-OD2 2.92Å; R938-D965 IonicContact NH2-OD2 3.67Å; R938-D965 PolarHBondContact NH2-OD2 2.83Å; R938-G968 VanDerWaalsContact NH1-CA 3.28Å; R938-T972 HydrophobicContact CG-CG2 4.07Å
939	N	90	Very high	91.7	Very high	26 Å²	26	37.4 Å²	37.4	14%	0.139	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	12.4	-179.6	-62.3	-83.4	0	0	0	112.2	I935 L936 K937 D941 M942 L943 A959	I935-N939 PolarHBondContact O-N 3.01Å; I935-N939 PolarHBondContact O-ND2 2.87Å; L936-N939 CarbonylContact O-C 3.59Å; L936-N939 PolarHBondContact O-N 3.48Å; K937-N939 PolarHBondContact O-N 2.82Å; N939-D941 PolarHBondContact O-N 2.93Å; N939-M942 PolarHBondContact O-N 3.01Å; N939-L943 HydrophobicContact CB-CD1 4.11Å; N939-L943 HydrophobicContact CB-CG 4.31Å; N939-L943 WeakPolarHBondContact O-CB 3.19Å; N939-L943 WeakPolarHBondContact O-CG 3.37Å; N939-L943 PolarHBondContact O-N 3.38Å; N939-A959 HydrophobicContact CB-CB 3.98Å; N939-A959 VanDerWaalsContact CG-CB 3.44Å; N939-A959 WeakPolarHBondContact OD1-CB 2.96Å
940	Q	92.6	Very high	90.9	Very high	31 Å²	31	42.4 Å²	42.4	15%	0.145	22%	0.216	C	C	.	.	H	α-helix	trans	-57.9	-46.9	-170.6	179.6	-176.7	-52.5	0	0	111.8	L878 L881 L936 K937 L943 L944	L878-Q940 VanDerWaalsContact CD2-OE1 3.22Å; L881-Q940 HydrophobicContact CB-CG 4.31Å; L936-Q940 WeakPolarHBondContact O-CA 3.49Å; L936-Q940 PolarHBondContact O-N 2.89Å; K937-Q940 VanDerWaalsContact O-CB 3.26Å; K937-Q940 WeakPolarHBondContact O-CB 3.22Å; K937-Q940 PolarHBondContact O-N 3.45Å; K937-Q940 VanDerWaalsContact O-N 3.17Å; Q940-L943 PolarHBondContact O-N 3.35Å; Q940-L944 HydrophobicContact CG-CD1 3.8Å; Q940-L944 HydrophobicContact CG-CG 4.22Å; Q940-L944 WeakPolarHBondContact O-CB 3.36Å; Q940-L944 VanDerWaalsContact O-CG 3.24Å; Q940-L944 WeakPolarHBondContact O-CG 3.45Å; Q940-L944 PolarHBondContact O-N 2.71Å
941	D	88.6	Confident	90	Very high	107 Å²	107	42.4 Å²	42.4	57%	0.572	22%	0.221	S	C	*	.	H	α-helix	trans	-65.3	-47.7	-175.3	-59.9	-38.6	0	0	0	111	N939 L943 L944 E945	N939-D941 PolarHBondContact O-N 2.93Å; D941-L943 VanDerWaalsContact C-N 3.28Å; D941-L943 PolarHBondContact O-N 3.38Å; D941-L944 PolarHBondContact O-N 3.05Å; D941-L944 VanDerWaalsContact O-N 3.17Å; D941-E945 WeakPolarHBondContact O-CG 3.42Å; D941-E945 PolarHBondContact O-N 3.49Å; D941-E945 VanDerWaalsContact O-N 3.12Å
942	M	84.6	Confident	89.6	Confident	53 Å²	53	42.3 Å²	42.3	26%	0.261	22%	0.221	S	C	.	.	H	α-helix	trans	-59.5	-36	174.1	-72.9	-177.4	68.4	0	0	113.1	A614 N939 Q946	A614-M942 HydrophobicContact CB-CE 4.42Å; A614-M942 HydrophobicContact CB-SD 4.32Å; N939-M942 PolarHBondContact O-N 3.01Å; M942-Q946 WeakPolarHBondContact O-CG 3.44Å; M942-Q946 PolarHBondContact O-NE2 3.06Å
943	L	90.2	Very high	89.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-74.2	-33.8	178.4	-71.6	172.6	0	0	0	112.4	L881 H884 L936 N939 Q940 D941 E945 Q946 F952 C955 L956	L881-L943 HydrophobicContact CD1-CB 3.84Å; L881-L943 HydrophobicContact CD1-CD1 4.42Å; L881-L943 HydrophobicContact CD2-CD1 4.29Å; H884-L943 PolarHBondContact CD2-O 2.87Å; H884-L943 PolarHBondContact NE2-O 2.9Å; H884-L943 VanDerWaalsContact NE2-O 3.1Å; L936-L943 HydrophobicContact CD2-CD1 4.14Å; N939-L943 HydrophobicContact CB-CD1 4.11Å; N939-L943 HydrophobicContact CB-CG 4.31Å; N939-L943 WeakPolarHBondContact O-CB 3.19Å; N939-L943 WeakPolarHBondContact O-CG 3.37Å; N939-L943 PolarHBondContact O-N 3.38Å; Q940-L943 PolarHBondContact O-N 3.35Å; D941-L943 VanDerWaalsContact C-N 3.28Å; D941-L943 PolarHBondContact O-N 3.38Å; L943-E945 VanDerWaalsContact C-N 3.33Å; L943-Q946 PolarHBondContact O-N 3.43Å; L943-F952 HydrophobicContact CB-CE2 3.89Å; L943-F952 HydrophobicContact CD2-CD2 4.2Å; L943-F952 HydrophobicContact CD2-CE2 3.84Å; L943-F952 HydrophobicContact CD2-CZ 3.98Å; L943-F952 HydrophobicContact CG-CE2 4.32Å; L943-C955 HydrophobicContact CD2-CB 4.19Å; L943-L956 HydrophobicContact CD1-CD1 4.24Å; L943-L956 HydrophobicContact CD2-CB 4.07Å; L943-L956 HydrophobicContact CD2-CD1 4.45Å
944	L	92.1	Very high	88.2	Confident	37 Å²	37	49.4 Å²	49.4	19%	0.194	25%	0.25	C	C	.	.	H	α-helix	trans	-69.3	-30.9	175.9	-75.6	173.6	0	0	0	112.3	R880 L881 H884 Q940 D941 Q946	R880-L944 HydrophobicContact CB-CD1 4.2Å; R880-L944 HydrophobicContact CB-CD2 4.35Å; L881-L944 HydrophobicContact CD1-CD2 4.41Å; H884-L944 HydrophobicContact CB-CD2 3.68Å; H884-L944 PolarHBondContact CE1-O 2.98Å; H884-L944 PolarHBondContact NE2-O 3.26Å; Q940-L944 HydrophobicContact CG-CD1 3.8Å; Q940-L944 HydrophobicContact CG-CG 4.22Å; Q940-L944 WeakPolarHBondContact O-CB 3.36Å; Q940-L944 VanDerWaalsContact O-CG 3.24Å; Q940-L944 WeakPolarHBondContact O-CG 3.45Å; Q940-L944 PolarHBondContact O-N 2.71Å; D941-L944 PolarHBondContact O-N 3.05Å; D941-L944 VanDerWaalsContact O-N 3.17Å; L944-Q946 PolarHBondContact O-N 3.39Å
945	E	90.5	Very high	87.4	Confident	98 Å²	98	50 Å²	50	46%	0.458	25%	0.254	S	S	.	.	H	α-helix	trans	-66.9	-24.4	175.6	-72.7	170.7	-178.9	0	0	113	Q616 D941 L943 S947	Q616-E945 VanDerWaalsContact NE2-CD 3.27Å; Q616-E945 PolarHBondContact NE2-OE1 3.49Å; Q616-E945 PolarHBondContact NE2-OE2 2.95Å; D941-E945 WeakPolarHBondContact O-CG 3.42Å; D941-E945 PolarHBondContact O-N 3.49Å; D941-E945 VanDerWaalsContact O-N 3.12Å; L943-E945 VanDerWaalsContact C-N 3.33Å; E945-S947 PolarHBondContact O-N 3.15Å
946	Q	86.3	Confident	87.1	Confident	15 Å²	15	50 Å²	50	7%	0.07	25%	0.254	C	S	.	.			trans	-72.7	121.9	-177.5	-51.6	-50.8	-59.9	0	0	111	H884 M942 L943 L944 F952 C955	H884-Q946 PolarHBondContact CE1-O 2.68Å; H884-Q946 PolarHBondContact NE2-O 3.35Å; M942-Q946 WeakPolarHBondContact O-CG 3.44Å; M942-Q946 PolarHBondContact O-NE2 3.06Å; L943-Q946 PolarHBondContact O-N 3.43Å; L944-Q946 PolarHBondContact O-N 3.39Å; Q946-F952 HydrophobicContact CB-CB 4.12Å; Q946-F952 HydrophobicContact CB-CD2 4.39Å; Q946-C955 HydrophobicContact CG-CB 3.99Å
947	S	84.1	Confident	86.5	Confident	91 Å²	91	55.8 Å²	55.8	64%	0.636	28%	0.279	S	S	*	.			trans	-95.7	-17.4	-176.6	61.2	0	0	0	0	114	L888 E945	L888-S947 WeakPolarHBondContact CD2-O 3.08Å; E945-S947 PolarHBondContact O-N 3.15Å
948	D	83.6	Confident	85.6	Confident	63 Å²	63	54.1 Å²	54.1	34%	0.337	28%	0.277	S	S	.	.	S	Bend	trans	-120	155.2	179.3	76	-85.1	0	0	0	112.9	I950 S951 F952	D948-I950 PolarHBondContact O-N 2.92Å; D948-I950 WeakPolarHBondContact OD2-CB 3.43Å; D948-I950 PolarHBondContact OD2-N 3.49Å; D948-I950 VanDerWaalsContact OD2-N 3.09Å; D948-S951 WeakPolarHBondContact OD1-CB 3.36Å; D948-S951 PolarHBondContact OD1-OG 3.28Å; D948-S951 WeakPolarHBondContact OD2-CB 3.46Å; D948-S951 PolarHBondContact OD2-N 3Å; D948-S951 PolarHBondContact OD2-OG 3.48Å; D948-S951 VanDerWaalsContact OD2-OG 3.05Å; D948-F952 WeakPolarHBondContact O-CB 3.45Å; D948-F952 PolarHBondContact O-N 3.13Å
949	T	85.5	Confident	85.1	Confident	60 Å²	60	49.6 Å²	49.6	37%	0.368	26%	0.262	S	S	.	.	H	α-helix	trans	-66.5	-36.1	-175.6	54	0	0	0	0	113	L888 I890 W953	L888-T949 HydrophobicContact CB-CG2 4.24Å; L888-T949 WeakPolarHBondContact O-CG2 3.4Å; I890-T949 HydrophobicContact CD1-CG2 4.11Å; I890-T949 HydrophobicContact CG1-CG2 3.85Å; T949-W953 PolarHBondContact O-N 3.49Å
950	I	80.7	Confident	84.9	Confident	105 Å²	105	48.7 Å²	48.7	54%	0.538	26%	0.257	S	S	.	.	H	α-helix	trans	-70.7	-45.5	-176.6	-62.6	173.5	0	0	0	109.8	D948 W953 K954	D948-I950 PolarHBondContact O-N 2.92Å; D948-I950 WeakPolarHBondContact OD2-CB 3.43Å; D948-I950 PolarHBondContact OD2-N 3.49Å; D948-I950 VanDerWaalsContact OD2-N 3.09Å; I950-W953 PolarHBondContact O-N 3.47Å; I950-K954 HydrophobicContact CG2-CD 4.18Å; I950-K954 WeakPolarHBondContact O-CB 3.47Å; I950-K954 WeakPolarHBondContact O-CG 3.18Å; I950-K954 PolarHBondContact O-N 2.89Å
951	S	78.2	Confident	84.3	Confident	35 Å²	35	55.1 Å²	55.1	25%	0.245	28%	0.28	C	S	.	.	H	α-helix	trans	-66.8	-38.6	176.8	-56.1	0	0	0	0	111.3	D948 W953 K954 C955	D948-S951 WeakPolarHBondContact OD1-CB 3.36Å; D948-S951 PolarHBondContact OD1-OG 3.28Å; D948-S951 WeakPolarHBondContact OD2-CB 3.46Å; D948-S951 PolarHBondContact OD2-N 3Å; D948-S951 PolarHBondContact OD2-OG 3.48Å; D948-S951 VanDerWaalsContact OD2-OG 3.05Å; S951-W953 PolarHBondContact O-N 3.07Å; S951-K954 PolarHBondContact O-N 3.5Å; S951-C955 VanDerWaalsContact O-CB 3.23Å; S951-C955 WeakPolarHBondContact O-CB 3.29Å; S951-C955 PolarHBondContact O-N 3.11Å
952	F	87.5	Confident	83.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-55.5	-50.7	170.6	-176.4	-82.6	0	0	0	111.6	L881 L885 L888 I890 L943 Q946 D948 K954 C955 L956	L881-F952 HydrophobicContact CD1-CE2 4.16Å; L885-F952 HydrophobicContact CD2-CE1 3.64Å; L885-F952 HydrophobicContact CD2-CE2 3.91Å; L885-F952 HydrophobicContact CD2-CZ 3.28Å; L885-F952 HydrophobicContact CG-CZ 4.26Å; L888-F952 HydrophobicContact CD1-CB 4.42Å; L888-F952 HydrophobicContact CD1-CD2 4.29Å; I890-F952 HydrophobicContact CD1-CB 3.58Å; I890-F952 HydrophobicContact CD1-CD1 3.39Å; I890-F952 HydrophobicContact CD1-CD2 4.08Å; I890-F952 HydrophobicContact CD1-CE1 4.12Å; I890-F952 HydrophobicContact CD1-CG 3.39Å; I890-F952 HydrophobicContact CG2-CD1 4.04Å; I890-F952 HydrophobicContact CG2-CE1 3.93Å; L943-F952 HydrophobicContact CB-CE2 3.89Å; L943-F952 HydrophobicContact CD2-CD2 4.2Å; L943-F952 HydrophobicContact CD2-CE2 3.84Å; L943-F952 HydrophobicContact CD2-CZ 3.98Å; L943-F952 HydrophobicContact CG-CE2 4.32Å; Q946-F952 HydrophobicContact CB-CB 4.12Å; Q946-F952 HydrophobicContact CB-CD2 4.39Å; D948-F952 WeakPolarHBondContact O-CB 3.45Å; D948-F952 PolarHBondContact O-N 3.13Å; F952-K954 PolarHBondContact O-N 2.91Å; F952-C955 PolarHBondContact O-N 3.49Å; F952-L956 HydrophobicContact CE1-CB 4.41Å; F952-L956 HydrophobicContact CE1-CD2 4.06Å; F952-L956 WeakPolarHBondContact O-CB 3.43Å; F952-L956 PolarHBondContact O-N 3.45Å
953	W	86.9	Confident	83.7	Confident	63 Å²	63	50.5 Å²	50.5	24%	0.239	26%	0.257	C	S	.	.	H	α-helix	trans	-63.8	-39.5	179.7	-74.4	126	0	0	0	113.2	I890 D891 A894 V895 T949 I950 S951 L956 K957	I890-W953 HydrophobicContact CG2-CH2 3.71Å; I890-W953 HydrophobicContact CG2-CZ2 3.45Å; I890-W953 VanDerWaalsContact CG2-CZ2 3.45Å; I890-W953 HydrophobicContact CG2-CZ3 4.41Å; D891-W953 VanDerWaalsContact O-CH2 3.3Å; D891-W953 WeakPolarHBondContact O-CH2 3.32Å; A894-W953 HydrophobicContact CB-CH2 3.88Å; A894-W953 HydrophobicContact CB-CZ2 4.13Å; V895-W953 HydrophobicContact CB-CZ3 4.01Å; V895-W953 HydrophobicContact CG2-CE3 3.75Å; V895-W953 HydrophobicContact CG2-CH2 4.12Å; V895-W953 HydrophobicContact CG2-CZ3 3.34Å; T949-W953 PolarHBondContact O-N 3.49Å; I950-W953 PolarHBondContact O-N 3.47Å; S951-W953 PolarHBondContact O-N 3.07Å; W953-L956 HydrophobicContact CE3-CD2 4.04Å; W953-L956 HydrophobicContact CZ3-CD2 3.83Å; W953-K957 WeakPolarHBondContact O-CB 3.43Å; W953-K957 WeakPolarHBondContact O-CG 3.39Å; W953-K957 PolarHBondContact O-N 3.46Å
954	K	78.3	Confident	83.2	Confident	85 Å²	85	52 Å²	52	37%	0.37	27%	0.265	S	S	.	.	H	α-helix	trans	-61.8	-47.1	174.5	-79.5	174.4	-177.6	171.6	0	111.3	L623 I950 S951 F952 K957 A958	L623-K954 HydrophobicContact CD1-CB 3.97Å; L623-K954 HydrophobicContact CD1-CD 4.25Å; L623-K954 HydrophobicContact CD1-CG 4.05Å; I950-K954 HydrophobicContact CG2-CD 4.18Å; I950-K954 WeakPolarHBondContact O-CB 3.47Å; I950-K954 WeakPolarHBondContact O-CG 3.18Å; I950-K954 PolarHBondContact O-N 2.89Å; S951-K954 PolarHBondContact O-N 3.5Å; F952-K954 PolarHBondContact O-N 2.91Å; K954-K957 PolarHBondContact O-N 3.43Å; K954-A958 WeakPolarHBondContact O-CB 3.44Å; K954-A958 PolarHBondContact O-N 2.96Å
955	C	80.1	Confident	82.7	Confident	14 Å²	14	52.4 Å²	52.4	10%	0.095	27%	0.267	C	S	.	.	H	α-helix	trans	-61.4	-47.5	177.7	-173.1	0	0	0	0	110.9	L943 Q946 S951 F952 K957 A958 A959	L943-C955 HydrophobicContact CD2-CB 4.19Å; Q946-C955 HydrophobicContact CG-CB 3.99Å; S951-C955 VanDerWaalsContact O-CB 3.23Å; S951-C955 WeakPolarHBondContact O-CB 3.29Å; S951-C955 PolarHBondContact O-N 3.11Å; F952-C955 PolarHBondContact O-N 3.49Å; C955-K957 PolarHBondContact O-N 2.87Å; C955-A958 PolarHBondContact O-N 3.43Å; C955-A959 VanDerWaalsContact O-CB 3.27Å; C955-A959 WeakPolarHBondContact O-CB 3.21Å; C955-A959 PolarHBondContact O-N 3.49Å
956	L	87.6	Confident	82.4	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-41.1	178.2	-176.5	61.8	0	0	0	113.1	W899 L936 L943 F952 W953 A959 T960	W899-L956 HydrophobicContact CH2-CD1 4.24Å; L936-L956 HydrophobicContact CD2-CD1 3.73Å; L943-L956 HydrophobicContact CD1-CD1 4.24Å; L943-L956 HydrophobicContact CD2-CB 4.07Å; L943-L956 HydrophobicContact CD2-CD1 4.45Å; F952-L956 HydrophobicContact CE1-CB 4.41Å; F952-L956 HydrophobicContact CE1-CD2 4.06Å; F952-L956 WeakPolarHBondContact O-CB 3.43Å; F952-L956 PolarHBondContact O-N 3.45Å; W953-L956 HydrophobicContact CE3-CD2 4.04Å; W953-L956 HydrophobicContact CZ3-CD2 3.83Å; L956-A959 PolarHBondContact O-N 2.95Å; L956-T960 HydrophobicContact CD1-CG2 4.49Å; L956-T960 VanDerWaalsContact O-CG2 3.31Å; L956-T960 WeakPolarHBondContact O-CG2 3.24Å; L956-T960 PolarHBondContact O-N 3.01Å; L956-T960 VanDerWaalsContact O-N 3.1Å; L956-T960 PolarHBondContact O-OG1 3.25Å
957	K	83.3	Confident	82.4	Confident	122 Å²	122	51.3 Å²	51.3	53%	0.53	27%	0.266	S	S	.	.	H	α-helix	trans	-65.5	-37.5	174.8	-77.1	-176.3	179	-175.1	0	112.4	W953 K954 C955 T960 R961	W953-K957 WeakPolarHBondContact O-CB 3.43Å; W953-K957 WeakPolarHBondContact O-CG 3.39Å; W953-K957 PolarHBondContact O-N 3.46Å; K954-K957 PolarHBondContact O-N 3.43Å; C955-K957 PolarHBondContact O-N 2.87Å; K957-T960 WeakPolarHBondContact CA-OG1 3.42Å; K957-T960 PolarHBondContact O-OG1 3.44Å; K957-R961 WeakPolarHBondContact O-CB 3.49Å; K957-R961 WeakPolarHBondContact O-CG 3.08Å; K957-R961 PolarHBondContact O-N 3.32Å
958	A	76.6	Confident	82.6	Confident	27 Å²	27	47.8 Å²	47.8	22%	0.223	24%	0.243	C	C	.	.	H	α-helix	trans	-68.3	-47.8	174.7	0	0	0	0	0	111	L623 K954 C955 T960 R961 L962	L623-A958 HydrophobicContact CD2-CB 4.28Å; K954-A958 WeakPolarHBondContact O-CB 3.44Å; K954-A958 PolarHBondContact O-N 2.96Å; C955-A958 PolarHBondContact O-N 3.43Å; A958-T960 VanDerWaalsContact C-N 3.26Å; A958-T960 PolarHBondContact O-N 3.19Å; A958-R961 PolarHBondContact O-N 3.48Å; A958-L962 WeakPolarHBondContact O-CB 3.37Å; A958-L962 VanDerWaalsContact O-CG 3.24Å; A958-L962 WeakPolarHBondContact O-CG 3.28Å; A958-L962 PolarHBondContact O-N 2.89Å
959	A	80.2	Confident	83	Confident	9 Å²	9	44.8 Å²	44.8	7%	0.074	23%	0.228	C	C	.	.	H	α-helix	trans	-52.2	-43.9	178.5	0	0	0	0	0	112.5	N939 C955 L956 T963	N939-A959 HydrophobicContact CB-CB 3.98Å; N939-A959 VanDerWaalsContact CG-CB 3.44Å; N939-A959 WeakPolarHBondContact OD1-CB 2.96Å; C955-A959 VanDerWaalsContact O-CB 3.27Å; C955-A959 WeakPolarHBondContact O-CB 3.21Å; C955-A959 PolarHBondContact O-N 3.49Å; L956-A959 PolarHBondContact O-N 2.95Å; A959-T963 VanDerWaalsContact O-CG2 3.27Å; A959-T963 WeakPolarHBondContact O-CG2 3.44Å
960	T	85.8	Confident	83.4	Confident	7 Å²	7	42.7 Å²	42.7	4%	0.043	21%	0.214	C	C	.	.	H	α-helix	trans	-70.8	-45.9	179.7	48.4	0	0	0	0	112.6	W899 S907 I935 L956 K957 A958 L962 T963	W899-T960 HydrophobicContact CH2-CG2 3.61Å; W899-T960 HydrophobicContact CZ2-CG2 3.23Å; S907-T960 CarbonylContact O-C 3.6Å; S907-T960 VanDerWaalsContact O-C 3.27Å; S907-T960 WeakPolarHBondContact O-CB 3.45Å; I935-T960 HydrophobicContact CG2-CG2 3.74Å; L956-T960 HydrophobicContact CD1-CG2 4.49Å; L956-T960 VanDerWaalsContact O-CG2 3.31Å; L956-T960 WeakPolarHBondContact O-CG2 3.24Å; L956-T960 PolarHBondContact O-N 3.01Å; L956-T960 VanDerWaalsContact O-N 3.1Å; L956-T960 PolarHBondContact O-OG1 3.25Å; K957-T960 WeakPolarHBondContact CA-OG1 3.42Å; K957-T960 PolarHBondContact O-OG1 3.44Å; A958-T960 VanDerWaalsContact C-N 3.26Å; A958-T960 PolarHBondContact O-N 3.19Å; T960-L962 PolarHBondContact O-N 3.24Å; T960-T963 WeakPolarHBondContact O-CG2 3.36Å; T960-T963 PolarHBondContact O-N 2.88Å; T960-T963 PolarHBondContact O-OG1 3.42Å
961	R	80	Confident	84	Confident	166 Å²	166	42.6 Å²	42.6	63%	0.626	21%	0.21	S	C	*	.	H	α-helix	trans	-64.5	-19.3	176.7	-72.8	-179.6	173.6	-157.2	-5.4	114.4	P909 K957 A958	P909-R961 WeakPolarHBondContact CG-O 3.38Å; K957-R961 WeakPolarHBondContact O-CB 3.49Å; K957-R961 WeakPolarHBondContact O-CG 3.08Å; K957-R961 PolarHBondContact O-N 3.32Å; A958-R961 PolarHBondContact O-N 3.48Å
962	L	76.8	Confident	84.7	Confident	47 Å²	47	41.2 Å²	41.2	25%	0.246	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	14.1	-177.5	-63.2	173.6	0	0	0	113.2	A958 T960 N964	A958-L962 WeakPolarHBondContact O-CB 3.37Å; A958-L962 VanDerWaalsContact O-CG 3.24Å; A958-L962 WeakPolarHBondContact O-CG 3.28Å; A958-L962 PolarHBondContact O-N 2.89Å; T960-L962 PolarHBondContact O-N 3.24Å; L962-N964 PolarHBondContact O-N 3.15Å
963	T	83.6	Confident	85.1	Confident	15 Å²	15	41.2 Å²	41.2	9%	0.092	20%	0.199	C	C	.	.			trans	-73.9	49.2	179.2	49.8	0	0	0	0	113.8	V908 P909 T912 I935 A959 T960 D965	V908-T963 WeakPolarHBondContact CB-OG1 3.41Å; V908-T963 WeakPolarHBondContact CG1-OG1 3.24Å; P909-T963 WeakPolarHBondContact CD-OG1 3.32Å; T912-T963 WeakPolarHBondContact CG2-O 3.41Å; T912-T963 PolarHBondContact OG1-O 2.94Å; I935-T963 HydrophobicContact CG1-CG2 4.17Å; I935-T963 HydrophobicContact CG2-CG2 4.38Å; A959-T963 VanDerWaalsContact O-CG2 3.27Å; A959-T963 WeakPolarHBondContact O-CG2 3.44Å; T960-T963 WeakPolarHBondContact O-CG2 3.36Å; T960-T963 PolarHBondContact O-N 2.88Å; T960-T963 PolarHBondContact O-OG1 3.42Å; T963-D965 VanDerWaalsContact C-N 3.35Å
964	N	79.1	Confident	85.4	Confident	33 Å²	33	38.6 Å²	38.6	18%	0.176	19%	0.19	C	C	.	.			trans	-73.4	-24.4	-178.4	-63.7	-54.4	0	0	0	113.3	H681 P909 L962 V966	H681-N964 PolarHBondContact CE1-ND2 3.42Å; P909-N964 WeakPolarHBondContact CB-OD1 3.26Å; P909-N964 WeakPolarHBondContact CG-OD1 3.39Å; L962-N964 PolarHBondContact O-N 3.15Å; N964-V966 VanDerWaalsContact C-N 3.32Å; N964-V966 PolarHBondContact O-N 3.15Å
965	D	81.1	Confident	86.1	Confident	45 Å²	45	39.8 Å²	39.8	24%	0.241	20%	0.197	C	C	.	.			trans	-79.7	81.1	176.1	174.5	27.3	0	0	0	111	A610 R938 T963 G968 L969	A610-D965 HydrophobicContact CB-CB 4.23Å; R938-D965 IonicContact CZ-OD2 3.59Å; R938-D965 PolarHBondContact NH1-O 3.43Å; R938-D965 IonicContact NH1-OD2 3.01Å; R938-D965 PolarHBondContact NH1-OD2 2.92Å; R938-D965 IonicContact NH2-OD2 3.67Å; R938-D965 PolarHBondContact NH2-OD2 2.83Å; T963-D965 VanDerWaalsContact C-N 3.35Å; D965-G968 PolarHBondContact OD1-N 3.31Å; D965-G968 WeakPolarHBondContact OD2-CA 3.5Å; D965-L969 WeakPolarHBondContact O-CB 3.33Å; D965-L969 PolarHBondContact O-N 2.83Å; D965-L969 VanDerWaalsContact O-N 3.08Å
966	V	85.7	Confident	86.7	Confident	20 Å²	20	43.5 Å²	43.5	12%	0.121	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-42	-178.5	-173.2	0	0	0	0	111.8	T912 R915 N964 L969 I970	T912-V966 HydrophobicContact CG2-CG2 4.26Å; R915-V966 HydrophobicContact CB-CG1 3.47Å; R915-V966 VanDerWaalsContact CB-CG1 3.47Å; R915-V966 HydrophobicContact CG-CG1 3.76Å; N964-V966 VanDerWaalsContact C-N 3.32Å; N964-V966 PolarHBondContact O-N 3.15Å; V966-L969 WeakPolarHBondContact O-CA 3.12Å; V966-L969 WeakPolarHBondContact O-CB 3.32Å; V966-L969 PolarHBondContact O-N 2.84Å; V966-L969 VanDerWaalsContact O-N 3.08Å; V966-I970 HydrophobicContact CG1-CD1 3.99Å; V966-I970 HydrophobicContact CG1-CG1 4.36Å; V966-I970 WeakPolarHBondContact O-CG1 3.24Å; V966-I970 PolarHBondContact O-N 3.02Å
967	D	86.8	Confident	87	Confident	70 Å²	70	43.6 Å²	43.6	37%	0.374	21%	0.213	S	C	.	.	H	α-helix	trans	-67.5	-43.7	-176.3	-65.6	-41.6	0	0	0	111.2	K606 L969 I970 K971	K606-D967 WeakPolarHBondContact CE-OD2 3.37Å; K606-D967 IonicContact NZ-OD2 3.98Å; K606-D967 PolarHBondContact NZ-OD2 3.47Å; D967-L969 PolarHBondContact O-N 3.08Å; D967-I970 PolarHBondContact O-N 3.32Å; D967-K971 VanDerWaalsContact O-CB 3.32Å; D967-K971 WeakPolarHBondContact O-CB 3.47Å; D967-K971 PolarHBondContact O-N 3.2Å
968	G	87.6	Confident	87.3	Confident	16 Å²	16	45.6 Å²	45.6	17%	0.165	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-33.7	171.8	0	0	0	0	0	111.9	R938 D965 K971 T972	R938-G968 VanDerWaalsContact NH1-CA 3.28Å; D965-G968 PolarHBondContact OD1-N 3.31Å; D965-G968 WeakPolarHBondContact OD2-CA 3.5Å; G968-K971 PolarHBondContact O-N 3.5Å; G968-T972 PolarHBondContact O-N 3.41Å; G968-T972 PolarHBondContact O-OG1 3.05Å; G968-T972 VanDerWaalsContact O-OG1 3.09Å
969	L	92.2	Very high	87.8	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-67.9	-44.4	178.3	177.9	65	0	0	0	111.1	T912 F931 A934 I935 D965 V966 D967 T972 A973	T912-L969 HydrophobicContact CG2-CD2 3.66Å; F931-L969 HydrophobicContact CD1-CD1 4.37Å; F931-L969 HydrophobicContact CD1-CD2 3.94Å; F931-L969 HydrophobicContact CD1-CG 3.85Å; F931-L969 HydrophobicContact CE1-CD2 4.28Å; F931-L969 HydrophobicContact CE1-CG 4.12Å; A934-L969 HydrophobicContact CB-CD1 3.7Å; I935-L969 HydrophobicContact CG1-CD1 3.77Å; I935-L969 HydrophobicContact CG1-CD2 4.46Å; D965-L969 WeakPolarHBondContact O-CB 3.33Å; D965-L969 PolarHBondContact O-N 2.83Å; D965-L969 VanDerWaalsContact O-N 3.08Å; V966-L969 WeakPolarHBondContact O-CA 3.12Å; V966-L969 WeakPolarHBondContact O-CB 3.32Å; V966-L969 PolarHBondContact O-N 2.84Å; V966-L969 VanDerWaalsContact O-N 3.08Å; D967-L969 PolarHBondContact O-N 3.08Å; L969-T972 PolarHBondContact O-N 3.32Å; L969-A973 VanDerWaalsContact O-CB 3.24Å; L969-A973 WeakPolarHBondContact O-CB 3.21Å; L969-A973 PolarHBondContact O-N 3.25Å
970	I	93.3	Very high	88.4	Confident	15 Å²	15	50.1 Å²	50.1	8%	0.077	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-42.8	175.4	-69.6	178	0	0	0	110.2	R726 R915 F931 V966 D967 T972 A973 F974	R726-I970 HydrophobicContact CB-CG2 4.17Å; R726-I970 WeakPolarHBondContact O-CD1 3.43Å; R915-I970 VanDerWaalsContact NH2-CD1 3.26Å; F931-I970 HydrophobicContact CE1-CG1 3.93Å; F931-I970 HydrophobicContact CZ-CG1 4.1Å; V966-I970 HydrophobicContact CG1-CD1 3.99Å; V966-I970 HydrophobicContact CG1-CG1 4.36Å; V966-I970 WeakPolarHBondContact O-CG1 3.24Å; V966-I970 PolarHBondContact O-N 3.02Å; D967-I970 PolarHBondContact O-N 3.32Å; I970-T972 PolarHBondContact O-N 3.03Å; I970-A973 PolarHBondContact O-N 3.17Å; I970-F974 HydrophobicContact CG2-CD2 3.93Å; I970-F974 WeakPolarHBondContact O-CB 3.28Å; I970-F974 WeakPolarHBondContact O-CD2 3.38Å; I970-F974 PolarHBondContact O-N 3.42Å
971	K	92.6	Very high	88.6	Confident	104 Å²	104	50.2 Å²	50.2	45%	0.452	24%	0.243	S	C	.	.	H	α-helix	trans	-58.5	-48.8	174.9	-169.7	-177.5	-179.9	-178	0	111.7	D967 G968 A973 E975 E976	D967-K971 VanDerWaalsContact O-CB 3.32Å; D967-K971 WeakPolarHBondContact O-CB 3.47Å; D967-K971 PolarHBondContact O-N 3.2Å; G968-K971 PolarHBondContact O-N 3.5Å; K971-A973 VanDerWaalsContact C-N 3.33Å; K971-A973 PolarHBondContact O-N 3.25Å; K971-E975 WeakPolarHBondContact CE-OE2 3.17Å; K971-E975 HydrophobicContact CG-CB 4.31Å; K971-E975 HydrophobicContact CG-CG 4.34Å; K971-E975 WeakPolarHBondContact CG-OE2 3.29Å; K971-E975 WeakPolarHBondContact O-CA 3.27Å; K971-E975 VanDerWaalsContact O-CB 3.25Å; K971-E975 WeakPolarHBondContact O-CB 3.32Å; K971-E975 PolarHBondContact O-N 2.86Å; K971-E976 PolarHBondContact O-N 3.18Å; K971-E976 VanDerWaalsContact O-N 3.17Å
972	T	93.9	Very high	89.1	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.031	24%	0.244	C	C	.	.	I	π-helix	trans	-60.1	-44.6	175	-60.9	0	0	0	0	111.2	A934 K937 R938 G968 L969 I970 E976 L977	A934-T972 HydrophobicContact CB-CG2 3.84Å; K937-T972 HydrophobicContact CB-CG2 4.1Å; K937-T972 HydrophobicContact CD-CG2 3.79Å; K937-T972 HydrophobicContact CG-CG2 4.02Å; R938-T972 HydrophobicContact CG-CG2 4.07Å; G968-T972 PolarHBondContact O-N 3.41Å; G968-T972 PolarHBondContact O-OG1 3.05Å; G968-T972 VanDerWaalsContact O-OG1 3.09Å; L969-T972 PolarHBondContact O-N 3.32Å; I970-T972 PolarHBondContact O-N 3.03Å; T972-E976 WeakPolarHBondContact CB-OE2 3.39Å; T972-E976 HydrophobicContact CG2-CB 4.49Å; T972-E976 WeakPolarHBondContact CG2-OE2 3.37Å; T972-E976 PolarHBondContact OG1-OE2 2.89Å; T972-L977 VanDerWaalsContact O-CG 3.25Å; T972-L977 WeakPolarHBondContact O-CG 3.16Å; T972-L977 PolarHBondContact O-N 2.88Å; T972-L977 VanDerWaalsContact O-N 3.15Å
973	A	95.5	Very high	89.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	I	π-helix	trans	-65.2	-39.8	-177	0	0	0	0	0	114.2	R930 F931 A934 L969 I970 K971	R930-A973 HydrophobicContact CB-CB 4.22Å; R930-A973 PolarHBondContact NH1-O 2.9Å; F931-A973 HydrophobicContact CD1-CB 4.06Å; F931-A973 HydrophobicContact CE1-CB 4.13Å; A934-A973 HydrophobicContact CB-CB 3.79Å; L969-A973 VanDerWaalsContact O-CB 3.24Å; L969-A973 WeakPolarHBondContact O-CB 3.21Å; L969-A973 PolarHBondContact O-N 3.25Å; I970-A973 PolarHBondContact O-N 3.17Å; K971-A973 VanDerWaalsContact C-N 3.33Å; K971-A973 PolarHBondContact O-N 3.25Å
974	F	93.8	Very high	90	Very high	9 Å²	9	57 Å²	57	4%	0.039	28%	0.283	C	S	.	.	I	π-helix	trans	-110	-19.7	-170.3	-70.9	-84	0	0	0	114.6	V919 E923 R930 F931 I970 R978	V919-F974 HydrophobicContact CG1-CE1 4.42Å; V919-F974 HydrophobicContact CG1-CE2 4.06Å; V919-F974 HydrophobicContact CG1-CZ 3.55Å; E923-F974 WeakPolarHBondContact OE2-CE1 3.26Å; R930-F974 VanDerWaalsContact CD-CE1 3.44Å; F931-F974 HydrophobicContact CE1-CE2 4.49Å; F931-F974 HydrophobicContact CE2-CE2 4.49Å; F931-F974 HydrophobicContact CZ-CE2 4.05Å; I970-F974 HydrophobicContact CG2-CD2 3.93Å; I970-F974 WeakPolarHBondContact O-CB 3.28Å; I970-F974 WeakPolarHBondContact O-CD2 3.38Å; I970-F974 PolarHBondContact O-N 3.42Å; F974-R978 WeakPolarHBondContact O-CG 3.22Å; F974-R978 PolarHBondContact O-NE 3.48Å; F974-R978 PolarHBondContact O-NH2 3.17Å
975	E	93.4	Very high	90.6	Very high	110 Å²	110	58.9 Å²	58.9	51%	0.514	29%	0.293	S	S	.	.	I	π-helix	trans	-110.3	-60.5	178.6	-57.5	177.9	-165.7	0	0	111.1	K971 L977 R978	K971-E975 WeakPolarHBondContact CE-OE2 3.17Å; K971-E975 HydrophobicContact CG-CB 4.31Å; K971-E975 HydrophobicContact CG-CG 4.34Å; K971-E975 WeakPolarHBondContact CG-OE2 3.29Å; K971-E975 WeakPolarHBondContact O-CA 3.27Å; K971-E975 VanDerWaalsContact O-CB 3.25Å; K971-E975 WeakPolarHBondContact O-CB 3.32Å; K971-E975 PolarHBondContact O-N 2.86Å; E975-L977 VanDerWaalsContact C-N 3.29Å; E975-L977 PolarHBondContact O-N 2.83Å; E975-R978 WeakPolarHBondContact O-CB 3.38Å; E975-R978 WeakPolarHBondContact O-CG 3.46Å; E975-R978 PolarHBondContact O-N 3.36Å; E975-R978 VanDerWaalsContact O-N 3.14Å
976	E	92.7	Very high	91.2	Very high	92 Å²	92	56.8 Å²	56.8	43%	0.43	28%	0.282	S	S	.	.	I	π-helix	trans	-72.4	-19.8	-170.3	-54.9	175.8	178	0	0	114	K937 K971 T972	K937-E976 PolarHBondContact NZ-O 2.82Å; K971-E976 PolarHBondContact O-N 3.18Å; K971-E976 VanDerWaalsContact O-N 3.17Å; T972-E976 WeakPolarHBondContact CB-OE2 3.39Å; T972-E976 HydrophobicContact CG2-CB 4.49Å; T972-E976 WeakPolarHBondContact CG2-OE2 3.37Å; T972-E976 PolarHBondContact OG1-OE2 2.89Å
977	L	92.6	Very high	91.5	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.016	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	0.6	175.9	-72.9	176.6	0	0	0	113.3	K877 V933 A934 K937 T972 E975 P979 F980	K877-L977 HydrophobicContact CB-CD2 4.25Å; K877-L977 HydrophobicContact CD-CD2 4.19Å; K877-L977 WeakPolarHBondContact CE-O 3.36Å; K877-L977 HydrophobicContact CG-CD2 4.4Å; K877-L977 PolarHBondContact NZ-O 3.22Å; V933-L977 HydrophobicContact CB-CD1 3.96Å; V933-L977 HydrophobicContact CG1-CD1 3.74Å; V933-L977 HydrophobicContact CG1-CD2 3.71Å; V933-L977 HydrophobicContact CG1-CG 4.42Å; A934-L977 HydrophobicContact CB-CD1 4.15Å; K937-L977 HydrophobicContact CD-CD2 3.55Å; K937-L977 HydrophobicContact CD-CG 4.19Å; T972-L977 VanDerWaalsContact O-CG 3.25Å; T972-L977 WeakPolarHBondContact O-CG 3.16Å; T972-L977 PolarHBondContact O-N 2.88Å; T972-L977 VanDerWaalsContact O-N 3.15Å; E975-L977 VanDerWaalsContact C-N 3.29Å; E975-L977 PolarHBondContact O-N 2.83Å; L977-P979 CarbonylContact O-C 3.59Å; L977-F980 HydrophobicContact CB-CD2 4.06Å; L977-F980 HydrophobicContact CD1-CE2 4.27Å
978	R	89.6	Confident	91.9	Very high	163 Å²	163	59.5 Å²	59.5	62%	0.615	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-67.2	144.4	177.2	-69.6	-174.2	-174.3	175.4	7.6	112	F974 E975	F974-R978 WeakPolarHBondContact O-CG 3.22Å; F974-R978 PolarHBondContact O-NE 3.48Å; F974-R978 PolarHBondContact O-NH2 3.17Å; E975-R978 WeakPolarHBondContact O-CB 3.38Å; E975-R978 WeakPolarHBondContact O-CG 3.46Å; E975-R978 PolarHBondContact O-N 3.36Å; E975-R978 VanDerWaalsContact O-N 3.14Å
979	P	88.1	Confident	92.3	Very high	115 Å²	115	60.1 Å²	60.1	75%	0.747	30%	0.304	S	S	*	.	S	Bend	cis	-75.3	125.6	-8.1	29.6	-32.7	0	0	0	111.2	K877 L977	K877-P979 VanDerWaalsContact CE-O 3.31Å; K877-P979 WeakPolarHBondContact CE-O 3.43Å; K877-P979 PolarHBondContact NZ-O 3.23Å; L977-P979 CarbonylContact O-C 3.59Å
980	F	92.7	Very high	92.5	Very high	17 Å²	17	62 Å²	62	8%	0.075	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-85.5	150.3	176.6	-158	-101.8	0	0	0	110.2	I873 F929 R930 L977 K982 I986	I873-F980 HydrophobicContact CD1-CE1 4.47Å; I873-F980 HydrophobicContact CD1-CZ 4.27Å; I873-F980 HydrophobicContact CG2-CE2 3.87Å; I873-F980 HydrophobicContact CG2-CZ 3.91Å; F929-F980 HydrophobicContact CB-CE1 4.18Å; F929-F980 HydrophobicContact CB-CZ 3.92Å; R930-F980 HydrophobicContact CB-CZ 4.37Å; R930-F980 HydrophobicContact CG-CD1 3.83Å; R930-F980 HydrophobicContact CG-CD2 4.38Å; R930-F980 HydrophobicContact CG-CE1 3.54Å; R930-F980 HydrophobicContact CG-CE2 4.13Å; R930-F980 HydrophobicContact CG-CG 4.24Å; R930-F980 HydrophobicContact CG-CZ 3.7Å; L977-F980 HydrophobicContact CB-CD2 4.06Å; L977-F980 HydrophobicContact CD1-CE2 4.27Å; F980-K982 PolarHBondContact O-N 3.16Å; F980-I986 HydrophobicContact CE1-CD1 4.37Å
981	P	90.6	Very high	92.5	Very high	8 Å²	8	64.3 Å²	64.3	5%	0.052	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-49.3	129.4	174.1	-30.8	37.8	0	0	0	111.9	I873 L985 I986	I873-P981 HydrophobicContact CD1-CG 4.34Å; I873-P981 HydrophobicContact CG1-CG 4.12Å; I873-P981 HydrophobicContact CG2-CG 4.42Å; P981-L985 HydrophobicContact CB-CD2 4.09Å; P981-I986 HydrophobicContact CB-CD1 4.33Å; P981-I986 HydrophobicContact CB-CG1 3.95Å
982	K	90.1	Very high	92.6	Very high	150 Å²	150	65.9 Å²	65.9	65%	0.652	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-68.2	156.3	178.8	-69.4	-174.6	179.3	-178.1	0	110.9	F980 Q984 L985 I986	F980-K982 PolarHBondContact O-N 3.16Å; K982-Q984 PolarHBondContact O-N 2.93Å; K982-Q984 VanDerWaalsContact O-N 3.13Å; K982-L985 WeakPolarHBondContact O-CA 3.5Å; K982-L985 WeakPolarHBondContact O-CB 3.44Å; K982-L985 PolarHBondContact O-N 3.27Å; K982-I986 PolarHBondContact O-N 3.11Å; K982-I986 VanDerWaalsContact O-N 3.07Å
983	P	88.4	Confident	92.6	Very high	71 Å²	71	66.5 Å²	66.5	46%	0.461	34%	0.338	S	S	.	.	H	α-helix	trans	-43	-48.4	173.3	-29.4	26.5	0	0	0	114.7	E926 L985 I986 A987	E926-P983 WeakPolarHBondContact OE1-CA 3.46Å; E926-P983 WeakPolarHBondContact OE1-CB 3.42Å; E926-P983 WeakPolarHBondContact OE1-CG 3.34Å; E926-P983 WeakPolarHBondContact OE2-CD 3.43Å; E926-P983 WeakPolarHBondContact OE2-CG 3.33Å; P983-L985 VanDerWaalsContact C-N 3.31Å; P983-L985 PolarHBondContact O-N 2.84Å; P983-I986 PolarHBondContact O-N 3.29Å; P983-A987 WeakPolarHBondContact O-CB 3.04Å; P983-A987 PolarHBondContact O-N 3.48Å
984	Q	89.7	Confident	92.4	Very high	150 Å²	150	70.6 Å²	70.6	70%	0.701	35%	0.354	S	S	*	.	H	α-helix	trans	-63.4	-35.5	-179.2	-65.8	164.6	-13.1	0	0	112.5	K982 T988	K982-Q984 PolarHBondContact O-N 2.93Å; K982-Q984 VanDerWaalsContact O-N 3.13Å; Q984-T988 WeakPolarHBondContact O-CB 3.21Å; Q984-T988 PolarHBondContact O-N 2.89Å; Q984-T988 PolarHBondContact O-OG1 2.92Å
985	L	92.1	Very high	92.2	Very high	73 Å²	73	75 Å²	75	38%	0.382	38%	0.375	S	S	.	.	H	α-helix	trans	-73.6	-40.8	178.2	-179.6	58	0	0	0	111	P981 K982 P983 A987 T988 R989	P981-L985 HydrophobicContact CB-CD2 4.09Å; K982-L985 WeakPolarHBondContact O-CA 3.5Å; K982-L985 WeakPolarHBondContact O-CB 3.44Å; K982-L985 PolarHBondContact O-N 3.27Å; P983-L985 VanDerWaalsContact C-N 3.31Å; P983-L985 PolarHBondContact O-N 2.84Å; L985-A987 VanDerWaalsContact C-N 3.33Å; L985-T988 PolarHBondContact O-N 3.41Å; L985-R989 HydrophobicContact CD1-CG 4.48Å; L985-R989 WeakPolarHBondContact O-CG 3.45Å; L985-R989 PolarHBondContact O-N 2.87Å
986	I	93.9	Very high	91.9	Very high	1 Å²	1	72.3 Å²	72.3	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-61.7	-44.8	174.3	-65.4	172.6	0	0	0	109.7	V869 E926 F929 F980 P981 K982 P983 T988 R989 R990	V869-I986 HydrophobicContact CG1-CG2 4.37Å; E926-I986 HydrophobicContact CB-CD1 4.4Å; E926-I986 HydrophobicContact CG-CD1 3.88Å; F929-I986 HydrophobicContact CE2-CG2 4.09Å; F929-I986 HydrophobicContact CZ-CG2 4.37Å; F980-I986 HydrophobicContact CE1-CD1 4.37Å; P981-I986 HydrophobicContact CB-CD1 4.33Å; P981-I986 HydrophobicContact CB-CG1 3.95Å; K982-I986 PolarHBondContact O-N 3.11Å; K982-I986 VanDerWaalsContact O-N 3.07Å; P983-I986 PolarHBondContact O-N 3.29Å; I986-T988 PolarHBondContact O-N 3.37Å; I986-R989 PolarHBondContact O-N 3.11Å; I986-R990 HydrophobicContact CG2-CG 4.44Å; I986-R990 WeakPolarHBondContact O-CB 3.22Å; I986-R990 WeakPolarHBondContact O-CG 3.33Å; I986-R990 PolarHBondContact O-N 2.99Å
987	A	92.8	Very high	91.6	Very high	53 Å²	53	69.1 Å²	69.1	44%	0.438	35%	0.349	S	S	.	.	H	α-helix	trans	-60.3	-44.1	175.5	0	0	0	0	0	112.5	P983 L985 R989 R990 A991	P983-A987 WeakPolarHBondContact O-CB 3.04Å; P983-A987 PolarHBondContact O-N 3.48Å; L985-A987 VanDerWaalsContact C-N 3.33Å; A987-R989 PolarHBondContact O-N 3.32Å; A987-R990 WeakPolarHBondContact O-CB 3.43Å; A987-R990 PolarHBondContact O-N 2.98Å; A987-A991 PolarHBondContact O-N 2.79Å
988	T	94.5	Very high	91.2	Very high	93 Å²	93	70.1 Å²	70.1	57%	0.571	36%	0.357	S	S	*	.	H	α-helix	trans	-61.9	-43.4	175.6	-61.3	0	0	0	0	112	Q984 L985 I986 A991 Y992	Q984-T988 WeakPolarHBondContact O-CB 3.21Å; Q984-T988 PolarHBondContact O-N 2.89Å; Q984-T988 PolarHBondContact O-OG1 2.92Å; L985-T988 PolarHBondContact O-N 3.41Å; I986-T988 PolarHBondContact O-N 3.37Å; T988-A991 PolarHBondContact O-N 2.87Å; T988-Y992 PolarHBondContact O-N 2.87Å
989	R	96.5	Very high	90.8	Very high	30 Å²	30	67.8 Å²	67.8	11%	0.113	35%	0.351	C	S	.	.	H	α-helix	trans	-64.7	-41.6	176	-70.1	173.1	-177.9	-173.2	1.8	111.7	V869 E872 E876 L985 I986 A987 Y992 H993	V869-R989 HydrophobicContact CG1-CB 4.21Å; V869-R989 HydrophobicContact CG2-CB 3.88Å; E872-R989 VanDerWaalsContact OE2-CD 3.25Å; E872-R989 WeakPolarHBondContact OE2-CD 3.31Å; E872-R989 IonicContact OE2-NE 3.21Å; E876-R989 VanDerWaalsContact CD-NH2 3.26Å; E876-R989 IonicContact OE1-CZ 3.31Å; E876-R989 IonicContact OE1-NH1 3.42Å; E876-R989 PolarHBondContact OE1-NH1 2.7Å; E876-R989 IonicContact OE1-NH2 3.97Å; E876-R989 PolarHBondContact OE1-NH2 3.1Å; E876-R989 IonicContact OE2-CZ 3.93Å; E876-R989 IonicContact OE2-NH1 2.97Å; E876-R989 PolarHBondContact OE2-NH1 3Å; E876-R989 IonicContact OE2-NH2 2.79Å; E876-R989 PolarHBondContact OE2-NH2 2.91Å; E876-R989 VanDerWaalsContact OE2-NH2 3.11Å; L985-R989 HydrophobicContact CD1-CG 4.48Å; L985-R989 WeakPolarHBondContact O-CG 3.45Å; L985-R989 PolarHBondContact O-N 2.87Å; I986-R989 PolarHBondContact O-N 3.11Å; A987-R989 PolarHBondContact O-N 3.32Å; R989-Y992 PolarHBondContact O-N 3.15Å; R989-H993 PolarHBondContact O-CD2 3.37Å; R989-H993 PolarHBondContact O-N 3.2Å
990	R	95.2	Very high	90.3	Very high	41 Å²	41	68.9 Å²	68.9	16%	0.155	34%	0.344	C	S	.	.	H	α-helix	trans	-56.9	-50	173.5	-78.1	174.5	164.9	165.5	-9.2	110.8	V865 D866 V869 S925 I986 A987 Y992 H993 Y994	V865-R990 HydrophobicContact CG1-CB 3.98Å; V865-R990 HydrophobicContact CG1-CG 4.03Å; V865-R990 WeakPolarHBondContact CG1-O 3.32Å; D866-R990 IonicContact OD1-CZ 2.68Å; D866-R990 IonicContact OD1-NE 2.76Å; D866-R990 PolarHBondContact OD1-NE 2.63Å; D866-R990 IonicContact OD1-NH2 2.64Å; D866-R990 PolarHBondContact OD1-NH2 2.84Å; D866-R990 VanDerWaalsContact OD1-NH2 3.13Å; D866-R990 IonicContact OD2-CZ 2.67Å; D866-R990 IonicContact OD2-NE 2.72Å; D866-R990 IonicContact OD2-NH2 2.59Å; D866-R990 PolarHBondContact OD2-NH2 3.48Å; V869-R990 HydrophobicContact CG2-CG 4.09Å; S925-R990 PolarHBondContact OG-NH1 2.71Å; S925-R990 PolarHBondContact OG-NH2 3.23Å; S925-R990 VanDerWaalsContact OG-NH2 3.15Å; I986-R990 HydrophobicContact CG2-CG 4.44Å; I986-R990 WeakPolarHBondContact O-CB 3.22Å; I986-R990 WeakPolarHBondContact O-CG 3.33Å; I986-R990 PolarHBondContact O-N 2.99Å; A987-R990 WeakPolarHBondContact O-CB 3.43Å; A987-R990 PolarHBondContact O-N 2.98Å; R990-Y992 PolarHBondContact O-N 3.28Å; R990-H993 PolarHBondContact O-N 3.17Å; R990-Y994 WeakPolarHBondContact O-CB 3.3Å; R990-Y994 PolarHBondContact O-N 3.11Å
991	A	93.4	Very high	89.5	Confident	62 Å²	62	71 Å²	71	51%	0.512	36%	0.355	S	S	.	.	H	α-helix	trans	-59.8	-44.8	179.1	0	0	0	0	0	112.4	A987 T988 Y994 E995	A987-A991 PolarHBondContact O-N 2.79Å; T988-A991 PolarHBondContact O-N 2.87Å; A991-Y994 PolarHBondContact O-N 2.99Å; A991-E995 PolarHBondContact O-N 2.82Å
992	Y	94.4	Very high	88.8	Confident	137 Å²	137	74.4 Å²	74.4	54%	0.537	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-51.2	177.1	174	-104.6	0	0	0	112.6	T988 R989 R990 Y994 E995 I996	T988-Y992 PolarHBondContact O-N 2.87Å; R989-Y992 PolarHBondContact O-N 3.15Å; R990-Y992 PolarHBondContact O-N 3.28Å; Y992-Y994 VanDerWaalsContact C-N 3.35Å; Y992-Y994 PolarHBondContact O-N 2.86Å; Y992-E995 PolarHBondContact O-N 3.27Å; Y992-I996 HydrophobicContact CD1-CD1 4.05Å; Y992-I996 HydrophobicContact CD2-CD1 4.47Å; Y992-I996 HydrophobicContact CE1-CD1 3.48Å; Y992-I996 VanDerWaalsContact CE1-CD1 3.48Å; Y992-I996 HydrophobicContact CE2-CD1 3.96Å; Y992-I996 VanDerWaalsContact CZ-CD1 3.44Å; Y992-I996 WeakPolarHBondContact O-CG1 3.35Å; Y992-I996 PolarHBondContact O-N 3.47Å
993	H	94	Very high	88	Confident	18 Å²	18	73.2 Å²	73.2	8%	0.083	38%	0.378	C	S	.	.	H	α-helix	trans	-69.1	-33.6	179.7	-76.6	-56.5	0	0	0	112.7	V865 L868 E872 R989 R990 I996 L997	V865-H993 HydrophobicContact CG1-CB 3.98Å; V865-H993 HydrophobicContact CG2-CB 4.37Å; L868-H993 HydrophobicContact CB-CB 4.36Å; L868-H993 HydrophobicContact CD1-CB 4.09Å; E872-H993 VanDerWaalsContact CD-NE2 3.25Å; E872-H993 IonicContact OE1-CD2 2.7Å; E872-H993 IonicContact OE1-CE1 3.68Å; E872-H993 PolarHBondContact OE1-CE1 3.48Å; E872-H993 VanDerWaalsContact OE1-CE1 3.25Å; E872-H993 IonicContact OE1-NE2 2.76Å; E872-H993 PolarHBondContact OE1-NE2 2.72Å; E872-H993 IonicContact OE2-NE2 3.31Å; R989-H993 PolarHBondContact O-CD2 3.37Å; R989-H993 PolarHBondContact O-N 3.2Å; R990-H993 PolarHBondContact O-N 3.17Å; H993-I996 PolarHBondContact O-N 2.91Å; H993-L997 WeakPolarHBondContact O-CB 3.34Å; H993-L997 PolarHBondContact O-N 2.93Å
994	Y	92.1	Very high	87	Confident	87 Å²	87	73.8 Å²	73.8	34%	0.341	37%	0.373	S	S	.	.	H	α-helix	trans	-61.3	-45	173.9	-177.9	-93	0	0	0	110.9	I861 D862 V865 R990 A991 Y992 I996 L997 S998	I861-Y994 HydrophobicContact CD1-CE2 4.22Å; I861-Y994 HydrophobicContact CG1-CE2 4.49Å; I861-Y994 HydrophobicContact CG2-CD2 4.38Å; I861-Y994 HydrophobicContact CG2-CE2 3.78Å; D862-Y994 WeakPolarHBondContact OD1-CD2 3.39Å; D862-Y994 WeakPolarHBondContact OD1-CE2 3.25Å; V865-Y994 HydrophobicContact CG2-CD2 4.24Å; R990-Y994 WeakPolarHBondContact O-CB 3.3Å; R990-Y994 PolarHBondContact O-N 3.11Å; A991-Y994 PolarHBondContact O-N 2.99Å; Y992-Y994 VanDerWaalsContact C-N 3.35Å; Y992-Y994 PolarHBondContact O-N 2.86Å; Y994-I996 VanDerWaalsContact C-N 3.31Å; Y994-I996 PolarHBondContact O-N 3.14Å; Y994-L997 PolarHBondContact O-N 2.99Å; Y994-S998 WeakPolarHBondContact O-CA 3.45Å; Y994-S998 WeakPolarHBondContact O-CB 3.42Å; Y994-S998 PolarHBondContact O-N 3.48Å; Y994-S998 PolarHBondContact O-OG 2.97Å
995	E	89.7	Confident	85.7	Confident	100 Å²	100	73 Å²	73	47%	0.467	37%	0.367	S	S	.	.	H	α-helix	trans	-60.2	-42	177.1	-168.6	-177.3	170.6	0	0	111.6	A991 Y992 S998 K999	A991-E995 PolarHBondContact O-N 2.82Å; Y992-E995 PolarHBondContact O-N 3.27Å; E995-S998 WeakPolarHBondContact CA-OG 3.33Å; E995-S998 PolarHBondContact O-OG 3.47Å; E995-K999 HydrophobicContact CG-CD 4.3Å; E995-K999 WeakPolarHBondContact O-CB 3.03Å; E995-K999 WeakPolarHBondContact O-CG 3.47Å; E995-K999 PolarHBondContact O-N 3.35Å; E995-K999 VanDerWaalsContact O-N 3.07Å; E995-K999 WeakPolarHBondContact OE1-CE 3.26Å; E995-K999 IonicContact OE1-NZ 2.8Å; E995-K999 PolarHBondContact OE1-NZ 3.5Å
996	I	87.6	Confident	84.2	Confident	55 Å²	55	70.4 Å²	70.4	28%	0.282	36%	0.359	S	S	.	.	H	α-helix	trans	-65.8	-51	178	-66	170.5	0	0	0	111.2	Y992 H993 Y994 K1000	Y992-I996 HydrophobicContact CD1-CD1 4.05Å; Y992-I996 HydrophobicContact CD2-CD1 4.47Å; Y992-I996 HydrophobicContact CE1-CD1 3.48Å; Y992-I996 VanDerWaalsContact CE1-CD1 3.48Å; Y992-I996 HydrophobicContact CE2-CD1 3.96Å; Y992-I996 VanDerWaalsContact CZ-CD1 3.44Å; Y992-I996 WeakPolarHBondContact O-CG1 3.35Å; Y992-I996 PolarHBondContact O-N 3.47Å; H993-I996 PolarHBondContact O-N 2.91Å; Y994-I996 VanDerWaalsContact C-N 3.31Å; Y994-I996 PolarHBondContact O-N 3.14Å; I996-K1000 HydrophobicContact CG2-CD 4.33Å; I996-K1000 WeakPolarHBondContact O-CG 3.45Å; I996-K1000 PolarHBondContact O-N 2.9Å
997	L	86.3	Confident	82.5	Confident	25 Å²	25	75 Å²	75	13%	0.131	38%	0.377	C	S	.	.	H	α-helix	trans	-68.8	-40	-177.3	-75.2	176.7	0	0	0	111.5	I861 Q864 V865 L868 H993 Y994 K1000 M1001	I861-L997 HydrophobicContact CD1-CB 4.31Å; I861-L997 HydrophobicContact CG1-CB 4.14Å; Q864-L997 HydrophobicContact CB-CD1 3.9Å; V865-L997 HydrophobicContact CG2-CD1 3.74Å; L868-L997 HydrophobicContact CD1-CD1 3.65Å; L868-L997 HydrophobicContact CD1-CD2 4.29Å; L868-L997 HydrophobicContact CD1-CG 3.96Å; H993-L997 WeakPolarHBondContact O-CB 3.34Å; H993-L997 PolarHBondContact O-N 2.93Å; Y994-L997 PolarHBondContact O-N 2.99Å; L997-K1000 PolarHBondContact O-N 3.49Å; L997-M1001 WeakPolarHBondContact O-CB 3.22Å; L997-M1001 PolarHBondContact O-N 3.46Å
998	S	83.6	Confident	80.5	Confident	24 Å²	24	76.9 Å²	76.9	17%	0.168	37%	0.373	C	S	.	.	H	α-helix	trans	-66.6	-37.6	178.5	62.9	0	0	0	0	111.6	Y994 E995 M1001 S1002	Y994-S998 WeakPolarHBondContact O-CA 3.45Å; Y994-S998 WeakPolarHBondContact O-CB 3.42Å; Y994-S998 PolarHBondContact O-N 3.48Å; Y994-S998 PolarHBondContact O-OG 2.97Å; E995-S998 WeakPolarHBondContact CA-OG 3.33Å; E995-S998 PolarHBondContact O-OG 3.47Å; S998-M1001 PolarHBondContact O-N 3.32Å; S998-S1002 WeakPolarHBondContact O-CB 3.42Å; S998-S1002 PolarHBondContact O-N 3.22Å; S998-S1002 PolarHBondContact O-OG 3.36Å
999	K	81.5	Confident	78.2	Confident	114 Å²	114	76.8 Å²	76.8	50%	0.496	37%	0.366	S	S	.	.	H	α-helix	trans	-62.6	-48.2	169.7	-75.6	174.3	-174.2	172.6	0	111.2	E995 M1001 S1002 I1003	E995-K999 HydrophobicContact CG-CD 4.3Å; E995-K999 WeakPolarHBondContact O-CB 3.03Å; E995-K999 WeakPolarHBondContact O-CG 3.47Å; E995-K999 PolarHBondContact O-N 3.35Å; E995-K999 VanDerWaalsContact O-N 3.07Å; E995-K999 WeakPolarHBondContact OE1-CE 3.26Å; E995-K999 IonicContact OE1-NZ 2.8Å; E995-K999 PolarHBondContact OE1-NZ 3.5Å; K999-M1001 VanDerWaalsContact C-N 3.35Å; K999-M1001 PolarHBondContact O-N 3.11Å; K999-S1002 PolarHBondContact O-N 3.19Å; K999-I1003 WeakPolarHBondContact O-CB 3.35Å; K999-I1003 WeakPolarHBondContact O-CD1 3.49Å; K999-I1003 WeakPolarHBondContact O-CG1 3.3Å; K999-I1003 PolarHBondContact O-N 3.01Å
1000	K	77.9	Confident	75.9	Confident	137 Å²	137	80.2 Å²	80.2	60%	0.596	39%	0.386	S	S	*	.	H	α-helix	trans	-59.2	-43.9	176.7	-74.9	179.3	179.3	-177.3	0	112.1	I996 L997 K1004	I996-K1000 HydrophobicContact CG2-CD 4.33Å; I996-K1000 WeakPolarHBondContact O-CG 3.45Å; I996-K1000 PolarHBondContact O-N 2.9Å; L997-K1000 PolarHBondContact O-N 3.49Å; K1000-K1004 VanDerWaalsContact O-CB 3.31Å; K1000-K1004 WeakPolarHBondContact O-CB 3.33Å; K1000-K1004 PolarHBondContact O-N 3.44Å
1001	M	76.1	Confident	73.7	Confident	63 Å²	63	80.8 Å²	80.8	31%	0.31	39%	0.394	S	S	.	.	H	α-helix	trans	-69.7	-35.8	176.9	-110.7	171.4	-179.7	0	0	112.5	G859 I861 L997 S998 K999 K1004 K1005	G859-M1001 VanDerWaalsContact CA-CE 3.48Å; G859-M1001 WeakPolarHBondContact O-CE 3.46Å; I861-M1001 HydrophobicContact CB-SD 4.19Å; I861-M1001 HydrophobicContact CD1-SD 3.87Å; I861-M1001 HydrophobicContact CG1-SD 4.05Å; L997-M1001 WeakPolarHBondContact O-CB 3.22Å; L997-M1001 PolarHBondContact O-N 3.46Å; S998-M1001 PolarHBondContact O-N 3.32Å; K999-M1001 VanDerWaalsContact C-N 3.35Å; K999-M1001 PolarHBondContact O-N 3.11Å; M1001-K1004 PolarHBondContact O-N 3.33Å; M1001-K1005 WeakPolarHBondContact O-CB 3.5Å; M1001-K1005 PolarHBondContact O-N 3.39Å
1002	S	75.6	Confident	71.2	Confident	78 Å²	78	83.6 Å²	83.6	55%	0.545	40%	0.398	S	S	.	.	H	α-helix	trans	-71.5	-37.1	176.4	-61.7	0	0	0	0	111.6	S998 K999 K1005 G1006	S998-S1002 WeakPolarHBondContact O-CB 3.42Å; S998-S1002 PolarHBondContact O-N 3.22Å; S998-S1002 PolarHBondContact O-OG 3.36Å; K999-S1002 PolarHBondContact O-N 3.19Å; S1002-K1005 PolarHBondContact O-N 3.49Å; S1002-G1006 WeakPolarHBondContact O-CA 3.12Å; S1002-G1006 PolarHBondContact O-N 3.35Å
1003	I	73.6	Confident	68.6	Low	125 Å²	125	83.9 Å²	83.9	64%	0.641	40%	0.402	S	S	*	.	H	α-helix	trans	-63.9	-46.1	170.8	-67.9	162.5	0	0	0	109.5	K999 G1006 Y1007	K999-I1003 WeakPolarHBondContact O-CB 3.35Å; K999-I1003 WeakPolarHBondContact O-CD1 3.49Å; K999-I1003 WeakPolarHBondContact O-CG1 3.3Å; K999-I1003 PolarHBondContact O-N 3.01Å; I1003-G1006 PolarHBondContact O-N 2.87Å; I1003-Y1007 WeakPolarHBondContact O-CB 3.41Å; I1003-Y1007 PolarHBondContact O-N 3.47Å
1004	K	66.4	Low	66.2	Low	83 Å²	83	91.1 Å²	91.1	36%	0.361	44%	0.436	S	S	.	.	H	α-helix	trans	-62.2	-47.8	176.6	-166.4	176.9	-177.5	-178.6	0	110.8	K1000 M1001 G1006 Y1007 W1008 Y1265	K1000-K1004 VanDerWaalsContact O-CB 3.31Å; K1000-K1004 WeakPolarHBondContact O-CB 3.33Å; K1000-K1004 PolarHBondContact O-N 3.44Å; M1001-K1004 PolarHBondContact O-N 3.33Å; K1004-G1006 VanDerWaalsContact C-N 3.33Å; K1004-G1006 PolarHBondContact O-N 2.93Å; K1004-Y1007 WeakPolarHBondContact O-CB 3.18Å; K1004-Y1007 PolarHBondContact O-N 2.9Å; K1004-W1008 PolarHBondContact O-N 3.09Å; K1004-Y1265 WeakPolarHBondContact CE-O 3.14Å
1005	K	63.6	Low	63.4	Low	133 Å²	133	89.4 Å²	89.4	58%	0.578	44%	0.437	S	S	*	.	H	α-helix	trans	-63.6	-38.3	176.9	-172.4	177.5	-178.9	-179.7	0	111.3	M1001 S1002 W1008 Q1009	M1001-K1005 WeakPolarHBondContact O-CB 3.5Å; M1001-K1005 PolarHBondContact O-N 3.39Å; S1002-K1005 PolarHBondContact O-N 3.49Å; K1005-W1008 CarbonylContact O-C 3.52Å; K1005-W1008 PolarHBondContact O-N 2.77Å; K1005-Q1009 HydrophobicContact CG-CG 4.3Å; K1005-Q1009 WeakPolarHBondContact O-CA 3.38Å; K1005-Q1009 WeakPolarHBondContact O-CB 3.33Å; K1005-Q1009 WeakPolarHBondContact O-CG 3.4Å; K1005-Q1009 PolarHBondContact O-N 2.58Å
1006	G	59.6	Low	60.8	Low	20 Å²	20	88.8 Å²	88.8	21%	0.206	44%	0.441	C	S	.	.	H	α-helix	trans	-65.6	-40.5	173.2	0	0	0	0	0	111.9	S1002 I1003 K1004 Q1009 N1010	S1002-G1006 WeakPolarHBondContact O-CA 3.12Å; S1002-G1006 PolarHBondContact O-N 3.35Å; I1003-G1006 PolarHBondContact O-N 2.87Å; K1004-G1006 VanDerWaalsContact C-N 3.33Å; K1004-G1006 PolarHBondContact O-N 2.93Å; G1006-Q1009 CarbonylContact O-C 3.59Å; G1006-Q1009 PolarHBondContact O-N 3.01Å; G1006-N1010 VanDerWaalsContact O-CB 3.26Å; G1006-N1010 WeakPolarHBondContact O-CB 3.4Å; G1006-N1010 PolarHBondContact O-N 2.79Å; G1006-N1010 PolarHBondContact O-ND2 3.36Å; G1006-N1010 PolarHBondContact O-OD1 3.08Å
1007	Y	58.3	Low	58	Low	97 Å²	97	93.6 Å²	93.6	38%	0.38	47%	0.468	S	S	.	.	H	α-helix	trans	-60.5	-48.4	171	-172	-90	0	0	0	110.6	I1003 K1004 Q1009 N1010 V1011 T1266	I1003-Y1007 WeakPolarHBondContact O-CB 3.41Å; I1003-Y1007 PolarHBondContact O-N 3.47Å; K1004-Y1007 WeakPolarHBondContact O-CB 3.18Å; K1004-Y1007 PolarHBondContact O-N 2.9Å; Y1007-Q1009 PolarHBondContact O-N 2.87Å; Y1007-N1010 PolarHBondContact O-N 2.89Å; Y1007-V1011 HydrophobicContact CD1-CG2 4.13Å; Y1007-V1011 HydrophobicContact CE1-CG2 3.96Å; Y1007-V1011 WeakPolarHBondContact O-CB 3.39Å; Y1007-V1011 WeakPolarHBondContact O-CG2 3.28Å; Y1007-V1011 PolarHBondContact O-N 3.42Å; Y1007-T1266 HydrophobicContact CD1-CG2 4.16Å; Y1007-T1266 HydrophobicContact CE1-CG2 4.03Å
1008	W	50.7	Low	55.3	Low	92 Å²	92	98.9 Å²	98.9	35%	0.348	49%	0.492	S	S	.	.	H	α-helix	trans	-64.7	-37.3	174.9	-73.5	109.1	0	0	0	113.3	K1004 K1005 V1011 M1012 F1267	K1004-W1008 PolarHBondContact O-N 3.09Å; K1005-W1008 CarbonylContact O-C 3.52Å; K1005-W1008 PolarHBondContact O-N 2.77Å; W1008-V1011 CarbonylContact O-C 3.53Å; W1008-V1011 PolarHBondContact O-N 2.97Å; W1008-M1012 WeakPolarHBondContact O-CB 3.48Å; W1008-M1012 WeakPolarHBondContact O-CG 3.27Å; W1008-M1012 PolarHBondContact O-N 3.4Å; W1008-F1267 HydrophobicContact CE3-CB 4.07Å; W1008-F1267 HydrophobicContact CH2-CB 3.37Å; W1008-F1267 AromaticContact CH2-CD2 3.58Å; W1008-F1267 HydrophobicContact CH2-CD2 3.58Å; W1008-F1267 AromaticContact CH2-CG 3.8Å; W1008-F1267 HydrophobicContact CH2-CG 3.8Å; W1008-F1267 HydrophobicContact CZ2-CB 3.92Å; W1008-F1267 HydrophobicContact CZ3-CB 3.43Å; W1008-F1267 VanDerWaalsContact CZ3-CB 3.43Å; W1008-F1267 AromaticContact CZ3-CD2 3.66Å; W1008-F1267 HydrophobicContact CZ3-CD2 3.66Å; W1008-F1267 AromaticContact CZ3-CG 3.65Å; W1008-F1267 HydrophobicContact CZ3-CG 3.65Å
1009	Q	45.5	Very low	52.7	Low	91 Å²	91	107.2 Å²	107.2	43%	0.425	53%	0.525	S	S	.	.	H	α-helix	trans	-72.3	-32.1	176.8	-80.7	180	-16.1	0	0	111.6	K1005 G1006 Y1007 M1012 K1013	K1005-Q1009 HydrophobicContact CG-CG 4.3Å; K1005-Q1009 WeakPolarHBondContact O-CA 3.38Å; K1005-Q1009 WeakPolarHBondContact O-CB 3.33Å; K1005-Q1009 WeakPolarHBondContact O-CG 3.4Å; K1005-Q1009 PolarHBondContact O-N 2.58Å; G1006-Q1009 CarbonylContact O-C 3.59Å; G1006-Q1009 PolarHBondContact O-N 3.01Å; Y1007-Q1009 PolarHBondContact O-N 2.87Å; Q1009-M1012 CarbonylContact O-C 3.58Å; Q1009-M1012 PolarHBondContact O-N 3.25Å; Q1009-K1013 WeakPolarHBondContact O-CA 3.27Å; Q1009-K1013 WeakPolarHBondContact O-CB 3.37Å; Q1009-K1013 WeakPolarHBondContact O-CG 3.33Å; Q1009-K1013 PolarHBondContact O-N 2.91Å
1010	N	48.8	Very low	50.1	Low	102 Å²	102	109.6 Å²	109.6	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-71.8	-42.3	172.4	-70.1	-12.2	0	0	0	109.9	G1006 Y1007 M1012 K1013 E1014	G1006-N1010 VanDerWaalsContact O-CB 3.26Å; G1006-N1010 WeakPolarHBondContact O-CB 3.4Å; G1006-N1010 PolarHBondContact O-N 2.79Å; G1006-N1010 PolarHBondContact O-ND2 3.36Å; G1006-N1010 PolarHBondContact O-OD1 3.08Å; Y1007-N1010 PolarHBondContact O-N 2.89Å; N1010-M1012 PolarHBondContact O-N 3.37Å; N1010-K1013 PolarHBondContact O-N 2.74Å; N1010-E1014 PolarHBondContact O-N 3.34Å; N1010-E1014 VanDerWaalsContact O-N 3.1Å
1011	V	49.6	Very low	47.6	Very low	53 Å²	53	111.3 Å²	111.3	32%	0.321	55%	0.552	S	S	.	*	H	α-helix	trans	-59.9	-29.5	170	172.3	0	0	0	0	111.5	Y1007 W1008 F1267	Y1007-V1011 HydrophobicContact CD1-CG2 4.13Å; Y1007-V1011 HydrophobicContact CE1-CG2 3.96Å; Y1007-V1011 WeakPolarHBondContact O-CB 3.39Å; Y1007-V1011 WeakPolarHBondContact O-CG2 3.28Å; Y1007-V1011 PolarHBondContact O-N 3.42Å; W1008-V1011 CarbonylContact O-C 3.53Å; W1008-V1011 PolarHBondContact O-N 2.97Å; V1011-F1267 HydrophobicContact CG1-CD1 4.23Å
1012	M	40.7	Very low	45.3	Very low	122 Å²	122	115.1 Å²	115.1	60%	0.601	57%	0.574	S	S	*	*	H	α-helix	trans	-90.4	-25.7	174.1	-75.5	-159.9	173.2	0	0	114.8	W1008 Q1009 N1010 E1014 S1015	W1008-M1012 WeakPolarHBondContact O-CB 3.48Å; W1008-M1012 WeakPolarHBondContact O-CG 3.27Å; W1008-M1012 PolarHBondContact O-N 3.4Å; Q1009-M1012 CarbonylContact O-C 3.58Å; Q1009-M1012 PolarHBondContact O-N 3.25Å; N1010-M1012 PolarHBondContact O-N 3.37Å; M1012-E1014 VanDerWaalsContact C-N 3.29Å; M1012-S1015 CarbonylContact O-C 3.6Å; M1012-S1015 PolarHBondContact O-N 3.48Å; M1012-S1015 PolarHBondContact O-OG 3.06Å
1013	K	40.3	Very low	43	Very low	142 Å²	142	120.2 Å²	120.2	62%	0.617	59%	0.589	S	S	*	*	H	α-helix	trans	-79	-13.9	177	-84.4	-179.3	177	-175	0	112.3	Q1009 N1010 S1015 P1016	Q1009-K1013 WeakPolarHBondContact O-CA 3.27Å; Q1009-K1013 WeakPolarHBondContact O-CB 3.37Å; Q1009-K1013 WeakPolarHBondContact O-CG 3.33Å; Q1009-K1013 PolarHBondContact O-N 2.91Å; N1010-K1013 PolarHBondContact O-N 2.74Å; K1013-S1015 PolarHBondContact O-N 3.37Å; K1013-P1016 WeakPolarHBondContact O-CD 3.21Å; K1013-P1016 WeakPolarHBondContact O-CG 3.18Å
1014	E	42.3	Very low	40.7	Very low	171 Å²	171	121 Å²	121	80%	0.799	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	1.9	159.8	-72.6	-177.2	169.9	0	0	112.4	N1010 M1012	N1010-E1014 PolarHBondContact O-N 3.34Å; N1010-E1014 VanDerWaalsContact O-N 3.1Å; M1012-E1014 VanDerWaalsContact C-N 3.29Å
1015	S	34.8	Very low	38.8	Very low	51 Å²	51	126.1 Å²	126.1	36%	0.357	62%	0.619	S	S	.	*	S	Bend	trans	-140.9	79.4	167	57	0	0	0	0	112.6	M1012 K1013	M1012-S1015 CarbonylContact O-C 3.6Å; M1012-S1015 PolarHBondContact O-N 3.48Å; M1012-S1015 PolarHBondContact O-OG 3.06Å; K1013-S1015 PolarHBondContact O-N 3.37Å
1016	P	34.4	Very low	37	Very low	86 Å²	86	126.3 Å²	126.3	56%	0.558	63%	0.631	S	S	*	*			trans	-110.1	146.4	-175.2	36.3	-24.5	0	0	0	115.5	K1013	K1013-P1016 WeakPolarHBondContact O-CD 3.21Å; K1013-P1016 WeakPolarHBondContact O-CG 3.18Å
1017	D	29.2	Very low	35.5	Very low	156 Å²	156	133.1 Å²	133.1	83%	0.834	66%	0.657	S	S	*	*			trans	96.6	79.7	153.3	-57.8	-18.8	0	0	0	120.1
1018	E	28.7	Very low	34	Very low	137 Å²	137	137.2 Å²	137.2	64%	0.64	68%	0.68	S	S	*	*			trans	-159.2	51.9	150.8	-131.1	-166.9	-126.1	0	0	113.7	K1033	E1018-K1033 IonicContact OE2-NZ 3.83Å; E1018-K1033 PolarHBondContact OE2-NZ 2.9Å
1019	F	28.3	Very low	32.8	Very low	199 Å²	199	142.2 Å²	142.2	87%	0.873	70%	0.704	S	S	*	*			trans	-150.6	39.7	-176.1	-110.2	-77.4	0	0	0	117.8
1020	I	28.2	Very low	32	Very low	164 Å²	164	150.3 Å²	150.3	84%	0.841	73%	0.73	S	S	*	*			trans	-146.8	93.9	159	-51.7	178.6	0	0	0	109.7
1021	E	25.9	Very low	31	Very low	172 Å²	172	149.5 Å²	149.5	80%	0.804	73%	0.733	S	S	*	*	S	Bend		175.4	140	129	-98.9	177.4	-176.7	0	0	111
1022	N	27.1	Very low	30.2	Very low	144 Å²	144	153.7 Å²	153.7	77%	0.77	76%	0.759	S	S	*	*			trans	87.6	65.3	164.9	-52.6	-31.1	0	0	0	117.8	N1024	N1022-N1024 PolarHBondContact O-N 3.07Å
1023	Q	26.8	Very low	29.8	Very low	184 Å²	184	154.8 Å²	154.8	86%	0.86	76%	0.76	S	S	*	*			trans	-62.6	101.9	134.4	-74.3	179.9	-7.5	0	0	108
1024	N	25.4	Very low	29.9	Very low	141 Å²	141	155 Å²	155	75%	0.754	76%	0.763	S	S	*	*			trans	155.9	79.8	153	-79.2	-19.6	0	0	0	107.5	N1022	N1022-N1024 PolarHBondContact O-N 3.07Å
1025	H	26.8	Very low	30.1	Very low	192 Å²	192	151.9 Å²	151.9	89%	0.889	75%	0.752	S	S	*	*			trans	178.1	67.5	149.4	-88	-54.2	0	0	0	106.5
1026	V	26.7	Very low	31.6	Very low	136 Å²	136	152.2 Å²	152.2	82%	0.824	75%	0.748	S	S	*	*			trans	-72.2	129.5	165.4	-179.7	0	0	0	0	106
1027	Q	26.8	Very low	33.8	Very low	163 Å²	163	148.8 Å²	148.8	76%	0.762	73%	0.727	S	S	*	*	S	Bend	trans	97.7	112.5	-178.3	-53.4	176	9.8	0	0	113.8
1028	H	27.2	Very low	36.6	Very low	183 Å²	183	142.5 Å²	142.5	85%	0.847	69%	0.694	S	S	*	*	S	Bend	trans	97.2	38.1	173.5	-58.9	-76.3	0	0	0	120.1
1029	K	24.6	Very low	39.5	Very low	198 Å²	198	136 Å²	136	86%	0.861	66%	0.664	S	S	*	*			trans	-140.5	73.3	148.2	-73	-167.9	178.8	175.6	0	112.3	S1031	K1029-S1031 VanDerWaalsContact C-N 3.3Å; K1029-S1031 PolarHBondContact O-N 3.41Å
1030	R	28.7	Very low	42.4	Very low	260 Å²	260	126.8 Å²	126.8	98%	0.981	62%	0.623	S	S	*	*			trans	-87.6	73.4	156.7	-84.6	-173.6	176.2	177.4	-1.5	108.3
1031	S	29.1	Very low	45.4	Very low	85 Å²	85	119 Å²	119	59%	0.594	58%	0.584	S	S	*	*	S	Bend	trans	-165.3	129.2	164.6	55.5	0	0	0	0	108.2	K1029	K1029-S1031 VanDerWaalsContact C-N 3.3Å; K1029-S1031 PolarHBondContact O-N 3.41Å
1032	T	31.4	Very low	48.6	Very low	141 Å²	141	111.4 Å²	111.4	87%	0.865	55%	0.549	S	S	*	.	S	Bend	trans	74.6	45	166.6	72.6	0	0	0	0	119.5
1033	K	33.2	Very low	51.7	Low	145 Å²	145	105.7 Å²	105.7	63%	0.63	52%	0.519	S	S	*	.			trans	-110.4	112.4	134.4	-75.7	-161.4	171.5	-150.6	0	106.1	E1018 N1035	E1018-K1033 IonicContact OE2-NZ 3.83Å; E1018-K1033 PolarHBondContact OE2-NZ 2.9Å; K1033-N1035 VanDerWaalsContact C-N 3.28Å; K1033-N1035 PolarHBondContact O-N 2.89Å
1034	E	42.5	Very low	54.6	Low	147 Å²	147	97.8 Å²	97.8	69%	0.687	48%	0.482	S	S	*	.			trans	-60.6	95.4	173.1	-71.3	-173.9	150.1	0	0	107.4	Q1036	E1034-Q1036 PolarHBondContact O-N 3.07Å
1035	N	47.5	Very low	57.5	Low	105 Å²	105	91.9 Å²	91.9	56%	0.561	45%	0.449	S	S	*	.			trans	-56.5	104.8	175.1	-86.1	-8.5	0	0	0	107.9	K1033 A1037	K1033-N1035 VanDerWaalsContact C-N 3.28Å; K1033-N1035 PolarHBondContact O-N 2.89Å; N1035-A1037 VanDerWaalsContact C-N 3.3Å; N1035-A1037 PolarHBondContact O-N 3.29Å
1036	Q	65.9	Low	60.2	Low	59 Å²	59	84.5 Å²	84.5	28%	0.276	42%	0.416	S	S	.	.			trans	-68	89.7	176.5	-71.9	176.7	-25.5	0	0	108.7	E1034 V1038 Y1418	E1034-Q1036 PolarHBondContact O-N 3.07Å; Q1036-V1038 PolarHBondContact O-N 3.46Å; Q1036-Y1418 HydrophobicContact CB-CD1 3.79Å; Q1036-Y1418 HydrophobicContact CB-CD2 4.3Å; Q1036-Y1418 HydrophobicContact CB-CE1 3.98Å; Q1036-Y1418 HydrophobicContact CB-CE2 4.37Å; Q1036-Y1418 HydrophobicContact CB-CG 3.99Å; Q1036-Y1418 HydrophobicContact CG-CD2 4.45Å
1037	A	79.5	Confident	62.8	Low	14 Å²	14	81.7 Å²	81.7	12%	0.116	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-61.9	128.5	177	0	0	0	0	0	109.6	N1035 Y1054 F1419	N1035-A1037 VanDerWaalsContact C-N 3.3Å; N1035-A1037 PolarHBondContact O-N 3.29Å; A1037-Y1054 HydrophobicContact CB-CD2 3.83Å; A1037-F1419 HydrophobicContact CB-CB 4.31Å; A1037-F1419 VanDerWaalsContact O-CB 3.31Å; A1037-F1419 WeakPolarHBondContact O-CB 3.43Å; A1037-F1419 PolarHBondContact O-N 3.38Å
1038	V	87.6	Confident	65.5	Low	24 Å²	24	78.5 Å²	78.5	15%	0.145	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	138	-176.5	176.4	0	0	0	0	109	Q1036 Q1040 Y1054 G1055 T1417 Y1418	Q1036-V1038 PolarHBondContact O-N 3.46Å; V1038-Q1040 WeakPolarHBondContact O-CG 3.5Å; V1038-Q1040 PolarHBondContact O-N 3.01Å; V1038-Y1054 CarbonylContact O-C 3.49Å; V1038-Y1054 WeakPolarHBondContact O-CA 3.42Å; V1038-Y1054 WeakPolarHBondContact O-CB 3.49Å; V1038-G1055 PolarHBondContact N-O 3.17Å; V1038-G1055 PolarHBondContact O-N 3.07Å; V1038-T1417 WeakPolarHBondContact CA-O 3.49Å; V1038-T1417 HydrophobicContact CG1-CG2 4.35Å; V1038-Y1418 HydrophobicContact CG2-CD1 3.9Å; V1038-Y1418 HydrophobicContact CG2-CE1 3.83Å
1039	I	89.7	Confident	68.3	Low	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	119.3	170.5	-57.4	179.1	0	0	0	108.6	I1052 R1398 F1399 C1415 T1417 F1419 A1424 V1425	I1039-I1052 HydrophobicContact CG2-CG2 3.82Å; I1039-R1398 WeakPolarHBondContact O-CD 3.44Å; I1039-R1398 PolarHBondContact O-NE 3.38Å; I1039-F1399 HydrophobicContact CB-CE2 4.4Å; I1039-F1399 HydrophobicContact CG2-CD2 3.87Å; I1039-F1399 HydrophobicContact CG2-CE2 3.75Å; I1039-F1399 WeakPolarHBondContact O-CE2 3.49Å; I1039-C1415 HydrophobicContact CD1-CB 3.97Å; I1039-C1415 HydrophobicContact CG2-CB 4.44Å; I1039-T1417 PolarHBondContact N-O 3.46Å; I1039-F1419 HydrophobicContact CG1-CB 4.05Å; I1039-F1419 HydrophobicContact CG1-CD2 4.37Å; I1039-A1424 HydrophobicContact CD1-CB 4.39Å; I1039-V1425 HydrophobicContact CD1-CG2 4.13Å
1040	Q	90.7	Very high	71.3	Confident	5 Å²	5	62.4 Å²	62.4	2%	0.023	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-39	-169.3	-68.3	171.4	0.8	0	0	113.4	V1038 C1053 G1055 D1056 S1060 R1082 V1083 F1399	V1038-Q1040 WeakPolarHBondContact O-CG 3.5Å; V1038-Q1040 PolarHBondContact O-N 3.01Å; Q1040-C1053 WeakPolarHBondContact CB-O 3.37Å; Q1040-C1053 PolarHBondContact N-O 2.84Å; Q1040-G1055 PolarHBondContact NE2-O 3.43Å; Q1040-D1056 PolarHBondContact NE2-O 3.13Å; Q1040-S1060 VanDerWaalsContact CD-OG 3.28Å; Q1040-S1060 PolarHBondContact NE2-OG 2.92Å; Q1040-S1060 PolarHBondContact OE1-OG 3.06Å; Q1040-R1082 HydrophobicContact CG-CG 4.34Å; Q1040-V1083 WeakPolarHBondContact CB-O 3.3Å; Q1040-V1083 VanDerWaalsContact OE1-N 3.16Å; Q1040-F1399 WeakPolarHBondContact O-CZ 3.36Å
1041	A	90.7	Very high	74.3	Confident	2 Å²	2	50.1 Å²	50.1	2%	0.017	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	153.1	-178.9	0	0	0	0	0	110.5	C1053 V1083 I1086	A1041-C1053 HydrophobicContact CB-CB 4.26Å; A1041-C1053 PolarHBondContact N-O 3.27Å; A1041-C1053 PolarHBondContact O-N 3.24Å; A1041-V1083 HydrophobicContact CB-CG1 3.88Å; A1041-I1086 HydrophobicContact CB-CB 3.78Å; A1041-I1086 HydrophobicContact CB-CG2 3.41Å; A1041-I1086 VanDerWaalsContact CB-CG2 3.41Å
1042	I	92.4	Very high	77.2	Confident	11 Å²	11	46.1 Å²	46.1	6%	0.056	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	138.5	-177.5	179.8	174.9	0	0	0	111.1	L1050 W1051 I1052 I1086 F1399 V1401 I1413 C1415	I1042-L1050 HydrophobicContact CD1-CD1 3.69Å; I1042-L1050 HydrophobicContact CD1-CD2 3.56Å; I1042-L1050 HydrophobicContact CD1-CG 4.03Å; I1042-L1050 HydrophobicContact CG1-CD1 3.25Å; I1042-L1050 HydrophobicContact CG1-CD2 3.99Å; I1042-L1050 HydrophobicContact CG1-CG 3.87Å; I1042-W1051 VanDerWaalsContact CA-O 3.26Å; I1042-W1051 WeakPolarHBondContact CA-O 3.41Å; I1042-I1052 HydrophobicContact CD1-CD1 4.15Å; I1042-I1052 HydrophobicContact CD1-CG1 4.01Å; I1042-I1052 HydrophobicContact CG1-CG1 4.01Å; I1042-I1086 VanDerWaalsContact N-CG2 3.34Å; I1042-I1086 WeakPolarHBondContact O-CG2 3.12Å; I1042-F1399 HydrophobicContact CG2-CB 3.37Å; I1042-F1399 HydrophobicContact CG2-CD1 3.69Å; I1042-F1399 HydrophobicContact CG2-CD2 3.93Å; I1042-F1399 HydrophobicContact CG2-CG 3.36Å; I1042-V1401 HydrophobicContact CD1-CG2 3.65Å; I1042-V1401 HydrophobicContact CG1-CG2 4.03Å; I1042-V1401 HydrophobicContact CG2-CG1 3.87Å; I1042-V1401 HydrophobicContact CG2-CG2 4.5Å; I1042-I1413 HydrophobicContact CD1-CG2 4.04Å; I1042-C1415 WeakPolarHBondContact CD1-SG 3.45Å
1043	T	91.8	Very high	80	Confident	25 Å²	25	39.4 Å²	39.4	15%	0.153	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	146.7	173.2	-160.7	0	0	0	0	113.2	L1050 W1051 I1086 A1088	T1043-L1050 WeakPolarHBondContact O-CD1 3.47Å; T1043-W1051 PolarHBondContact N-O 3.48Å; T1043-W1051 PolarHBondContact O-N 2.85Å; T1043-I1086 HydrophobicContact CG2-CD1 3.78Å; T1043-I1086 HydrophobicContact CG2-CG1 3.73Å; T1043-I1086 HydrophobicContact CG2-CG2 4.22Å; T1043-A1088 HydrophobicContact CG2-CB 3.99Å
1044	F	89.4	Confident	82.7	Confident	17 Å²	17	33.1 Å²	33.1	8%	0.075	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	129.9	167.9	-73.7	-80.4	0	0	0	109.6	L1050 V1067 A1088 V1401 K1403 L1411 I1413	F1044-L1050 HydrophobicContact CD1-CB 3.91Å; F1044-L1050 HydrophobicContact CD1-CD1 4.12Å; F1044-L1050 HydrophobicContact CD2-CD1 4.11Å; F1044-L1050 HydrophobicContact CE1-CB 3.88Å; F1044-L1050 HydrophobicContact CE1-CD1 4.18Å; F1044-L1050 HydrophobicContact CE1-CG 4.48Å; F1044-L1050 HydrophobicContact CE2-CD1 4.2Å; F1044-L1050 HydrophobicContact CG-CD1 4.07Å; F1044-L1050 HydrophobicContact CZ-CD1 4.2Å; F1044-V1067 HydrophobicContact CE1-CG2 4.01Å; F1044-A1088 WeakPolarHBondContact O-CB 3.47Å; F1044-V1401 HydrophobicContact CD2-CB 4.23Å; F1044-V1401 HydrophobicContact CD2-CG2 4.18Å; F1044-V1401 HydrophobicContact CE2-CB 3.91Å; F1044-V1401 HydrophobicContact CE2-CG2 3.57Å; F1044-V1401 HydrophobicContact CZ-CG2 4.33Å; F1044-K1403 HydrophobicContact CB-CD 3.91Å; F1044-K1403 HydrophobicContact CD1-CB 3.97Å; F1044-K1403 HydrophobicContact CD1-CG 4.33Å; F1044-K1403 HydrophobicContact CD2-CB 3.9Å; F1044-K1403 HydrophobicContact CE1-CB 4.05Å; F1044-K1403 HydrophobicContact CE2-CB 3.97Å; F1044-K1403 HydrophobicContact CG-CB 3.91Å; F1044-K1403 HydrophobicContact CG-CD 4.12Å; F1044-K1403 HydrophobicContact CG-CG 4.3Å; F1044-K1403 HydrophobicContact CZ-CB 4.06Å; F1044-L1411 HydrophobicContact CE1-CD2 3.6Å; F1044-L1411 HydrophobicContact CZ-CD2 3.52Å; F1044-I1413 HydrophobicContact CE2-CG1 4.41Å; F1044-I1413 HydrophobicContact CZ-CG1 3.65Å
1045	Y	86.1	Confident	84.8	Confident	17 Å²	17	26.1 Å²	26.1	7%	0.067	13%	0.134	C	C	.	.	S	Bend	trans	-105.5	-23.4	172.6	72.3	-98.2	0	0	0	112	H1049 W1051 E1064 N1091 I1094 V1108	Y1045-H1049 HydrophobicContact CD1-CB 4.25Å; Y1045-H1049 HydrophobicContact CE1-CB 3.36Å; Y1045-H1049 HydrophobicContact CE2-CB 3.89Å; Y1045-H1049 AromaticContact CZ-CG 3.87Å; Y1045-H1049 PolarHBondContact N-O 2.77Å; Y1045-H1049 WeakPolarHBondContact OH-CB 3.36Å; Y1045-W1051 AromaticContact CD1-CD1 3.5Å; Y1045-W1051 VanDerWaalsContact CD1-CD1 3.5Å; Y1045-W1051 HydrophobicContact CD1-CG 4.03Å; Y1045-W1051 AromaticContact CD1-NE1 3.66Å; Y1045-W1051 AromaticContact CE1-CD1 3.28Å; Y1045-W1051 HydrophobicContact CE1-CG 4.23Å; Y1045-W1051 AromaticContact CE1-NE1 3.2Å; Y1045-E1064 PolarHBondContact OH-OE1 2.89Å; Y1045-N1091 WeakPolarHBondContact O-CA 3.28Å; Y1045-N1091 PolarHBondContact O-OD1 2.88Å; Y1045-I1094 HydrophobicContact CD1-CD1 4.25Å; Y1045-I1094 HydrophobicContact CG-CD1 4.25Å; Y1045-V1108 HydrophobicContact CD2-CG1 4.06Å; Y1045-V1108 HydrophobicContact CD2-CG2 4.2Å; Y1045-V1108 HydrophobicContact CE1-CG1 4.21Å; Y1045-V1108 HydrophobicContact CE2-CG1 3.62Å; Y1045-V1108 HydrophobicContact CG-CG2 4.17Å
1046	D	81.9	Confident	86.4	Confident	37 Å²	37	23.3 Å²	23.3	20%	0.198	12%	0.119	C	C	.	.	S	Bend	trans	-135.2	-160.5	167.4	72.9	25.7	0	0	0	111.5	E1048 H1049 K1403	D1046-E1048 PolarHBondContact OD1-N 2.67Å; D1046-H1049 VanDerWaalsContact CG-ND1 3.25Å; D1046-H1049 WeakPolarHBondContact OD1-CA 3.45Å; D1046-H1049 VanDerWaalsContact OD1-CB 3.26Å; D1046-H1049 WeakPolarHBondContact OD1-CB 3.46Å; D1046-H1049 IonicContact OD1-CG 2.7Å; D1046-H1049 PolarHBondContact OD1-N 2.98Å; D1046-H1049 IonicContact OD1-ND1 3.06Å; D1046-H1049 PolarHBondContact OD1-ND1 2.9Å; D1046-H1049 IonicContact OD2-CE1 3.64Å; D1046-H1049 IonicContact OD2-CG 3.64Å; D1046-H1049 IonicContact OD2-ND1 2.72Å; D1046-H1049 PolarHBondContact OD2-ND1 3.34Å; D1046-K1403 WeakPolarHBondContact O-CE 3.26Å; D1046-K1403 PolarHBondContact O-NZ 3.28Å; D1046-K1403 VanDerWaalsContact O-NZ 3.12Å
1047	N	82.4	Confident	86.7	Confident	78 Å²	78	25 Å²	25	42%	0.417	13%	0.126	S	C	.	.	S	Bend	trans	-85.1	-17.7	-178.9	-70.9	-12.4	0	0	0	114	K1403	N1047-K1403 WeakPolarHBondContact OD1-CE 3.38Å
1048	E	82.3	Confident	86.4	Confident	96 Å²	96	28.6 Å²	28.6	45%	0.449	14%	0.143	S	C	.	.	S	Bend	trans	-120.7	-13.2	-173	-61	-168.3	178	0	0	113.1	D1046 V1067 T1068	D1046-E1048 PolarHBondContact OD1-N 2.67Å; E1048-V1067 VanDerWaalsContact O-CB 3.26Å; E1048-V1067 WeakPolarHBondContact O-CB 3.39Å; E1048-V1067 WeakPolarHBondContact O-CG2 3.31Å; E1048-V1067 PolarHBondContact O-N 2.76Å; E1048-T1068 HydrophobicContact CB-CG2 4.12Å; E1048-T1068 HydrophobicContact CG-CG2 3.82Å
1049	H	86.4	Confident	86	Confident	43 Å²	43	31 Å²	31	20%	0.199	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	140.3	-170	-53.8	87.8	0	0	0	111.6	Y1045 D1046 E1064 V1065	Y1045-H1049 HydrophobicContact CD1-CB 4.25Å; Y1045-H1049 HydrophobicContact CE1-CB 3.36Å; Y1045-H1049 HydrophobicContact CE2-CB 3.89Å; Y1045-H1049 AromaticContact CZ-CG 3.87Å; Y1045-H1049 PolarHBondContact N-O 2.77Å; Y1045-H1049 WeakPolarHBondContact OH-CB 3.36Å; D1046-H1049 VanDerWaalsContact CG-ND1 3.25Å; D1046-H1049 WeakPolarHBondContact OD1-CA 3.45Å; D1046-H1049 VanDerWaalsContact OD1-CB 3.26Å; D1046-H1049 WeakPolarHBondContact OD1-CB 3.46Å; D1046-H1049 IonicContact OD1-CG 2.7Å; D1046-H1049 PolarHBondContact OD1-N 2.98Å; D1046-H1049 IonicContact OD1-ND1 3.06Å; D1046-H1049 PolarHBondContact OD1-ND1 2.9Å; D1046-H1049 IonicContact OD2-CE1 3.64Å; D1046-H1049 IonicContact OD2-CG 3.64Å; D1046-H1049 IonicContact OD2-ND1 2.72Å; D1046-H1049 PolarHBondContact OD2-ND1 3.34Å; H1049-E1064 IonicContact CD2-OE1 3.54Å; H1049-V1065 VanDerWaalsContact CA-O 3.3Å; H1049-V1065 WeakPolarHBondContact CA-O 3.48Å
1050	L	88.9	Confident	85.9	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	139.5	-173.7	164.3	79.9	0	0	0	108.3	I1042 T1043 F1044 I1052 E1064 V1065 V1401 I1413	I1042-L1050 HydrophobicContact CD1-CD1 3.69Å; I1042-L1050 HydrophobicContact CD1-CD2 3.56Å; I1042-L1050 HydrophobicContact CD1-CG 4.03Å; I1042-L1050 HydrophobicContact CG1-CD1 3.25Å; I1042-L1050 HydrophobicContact CG1-CD2 3.99Å; I1042-L1050 HydrophobicContact CG1-CG 3.87Å; T1043-L1050 WeakPolarHBondContact O-CD1 3.47Å; F1044-L1050 HydrophobicContact CD1-CB 3.91Å; F1044-L1050 HydrophobicContact CD1-CD1 4.12Å; F1044-L1050 HydrophobicContact CD2-CD1 4.11Å; F1044-L1050 HydrophobicContact CE1-CB 3.88Å; F1044-L1050 HydrophobicContact CE1-CD1 4.18Å; F1044-L1050 HydrophobicContact CE1-CG 4.48Å; F1044-L1050 HydrophobicContact CE2-CD1 4.2Å; F1044-L1050 HydrophobicContact CG-CD1 4.07Å; F1044-L1050 HydrophobicContact CZ-CD1 4.2Å; L1050-I1052 HydrophobicContact CD2-CD1 4.17Å; L1050-I1052 HydrophobicContact CD2-CG1 4.13Å; L1050-I1052 HydrophobicContact CG-CG1 4.34Å; L1050-E1064 CarbonylContact O-C 3.51Å; L1050-E1064 WeakPolarHBondContact O-CA 3.41Å; L1050-V1065 HydrophobicContact CB-CB 4.01Å; L1050-V1065 HydrophobicContact CD2-CB 3.92Å; L1050-V1065 HydrophobicContact CD2-CG1 4.11Å; L1050-V1065 HydrophobicContact CD2-CG2 4.1Å; L1050-V1065 HydrophobicContact CG-CB 4.29Å; L1050-V1065 PolarHBondContact N-O 3.44Å; L1050-V1065 PolarHBondContact O-N 2.91Å; L1050-V1401 HydrophobicContact CD1-CG2 4.22Å; L1050-I1413 HydrophobicContact CD2-CG1 4.26Å; L1050-I1413 HydrophobicContact CD2-CG2 4.18Å
1051	W	89.9	Confident	85.7	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	136.4	171.3	-80.8	14.5	0	0	0	111.4	I1042 T1043 Y1045 I1062 I1075 I1086 I1094 Y1106 V1108	I1042-W1051 VanDerWaalsContact CA-O 3.26Å; I1042-W1051 WeakPolarHBondContact CA-O 3.41Å; T1043-W1051 PolarHBondContact N-O 3.48Å; T1043-W1051 PolarHBondContact O-N 2.85Å; Y1045-W1051 AromaticContact CD1-CD1 3.5Å; Y1045-W1051 VanDerWaalsContact CD1-CD1 3.5Å; Y1045-W1051 HydrophobicContact CD1-CG 4.03Å; Y1045-W1051 AromaticContact CD1-NE1 3.66Å; Y1045-W1051 AromaticContact CE1-CD1 3.28Å; Y1045-W1051 HydrophobicContact CE1-CG 4.23Å; Y1045-W1051 AromaticContact CE1-NE1 3.2Å; W1051-I1062 HydrophobicContact CB-CG2 4.42Å; W1051-I1062 HydrophobicContact CD2-CG2 3.87Å; W1051-I1062 HydrophobicContact CE3-CD1 4.45Å; W1051-I1062 HydrophobicContact CE3-CG2 3.75Å; W1051-I1062 HydrophobicContact CG-CG2 4.18Å; W1051-I1062 HydrophobicContact CZ3-CD1 4.22Å; W1051-I1062 HydrophobicContact CZ3-CG2 4.32Å; W1051-I1075 HydrophobicContact CD2-CD1 4.41Å; W1051-I1075 HydrophobicContact CH2-CD1 4.45Å; W1051-I1075 HydrophobicContact CZ2-CD1 3.78Å; W1051-I1086 HydrophobicContact CB-CD1 4.37Å; W1051-I1094 HydrophobicContact CD2-CD1 3.38Å; W1051-I1094 HydrophobicContact CE3-CB 4.41Å; W1051-I1094 HydrophobicContact CE3-CD1 3.21Å; W1051-I1094 HydrophobicContact CE3-CG1 4.38Å; W1051-I1094 HydrophobicContact CE3-CG2 4.26Å; W1051-I1094 HydrophobicContact CG-CD1 3.98Å; W1051-I1094 HydrophobicContact CH2-CD1 4.03Å; W1051-I1094 HydrophobicContact CZ2-CD1 4.21Å; W1051-I1094 HydrophobicContact CZ3-CB 4.26Å; W1051-I1094 HydrophobicContact CZ3-CD1 3.55Å; W1051-I1094 HydrophobicContact CZ3-CG1 4.45Å; W1051-I1094 HydrophobicContact CZ3-CG2 4.45Å; W1051-Y1106 AromaticContact CH2-CD1 3.33Å; W1051-Y1106 HydrophobicContact CH2-CD1 3.33Å; W1051-Y1106 AromaticContact CH2-CE1 3.51Å; W1051-Y1106 HydrophobicContact CH2-CE1 3.51Å; W1051-Y1106 HydrophobicContact CH2-CG 4.31Å; W1051-Y1106 HydrophobicContact CZ2-CE1 4.49Å; W1051-Y1106 AromaticContact CZ3-CD1 3.68Å; W1051-Y1106 HydrophobicContact CZ3-CD1 3.68Å; W1051-Y1106 HydrophobicContact CZ3-CE1 4.13Å; W1051-Y1106 HydrophobicContact CZ3-CG 4.23Å; W1051-V1108 HydrophobicContact CH2-CB 4.3Å; W1051-V1108 HydrophobicContact CH2-CG2 3.83Å; W1051-V1108 HydrophobicContact CZ2-CB 3.89Å; W1051-V1108 HydrophobicContact CZ2-CG1 3.78Å; W1051-V1108 HydrophobicContact CZ2-CG2 3.61Å
1052	I	90.4	Very high	85.6	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	118.2	173.6	-60.7	-172.4	0	0	0	108.1	I1039 I1042 L1050 Y1054 S1063 V1065 M1072 F1419 V1425	I1039-I1052 HydrophobicContact CG2-CG2 3.82Å; I1042-I1052 HydrophobicContact CD1-CD1 4.15Å; I1042-I1052 HydrophobicContact CD1-CG1 4.01Å; I1042-I1052 HydrophobicContact CG1-CG1 4.01Å; L1050-I1052 HydrophobicContact CD2-CD1 4.17Å; L1050-I1052 HydrophobicContact CD2-CG1 4.13Å; L1050-I1052 HydrophobicContact CG-CG1 4.34Å; I1052-Y1054 HydrophobicContact CG2-CD1 4.42Å; I1052-S1063 PolarHBondContact N-O 3.36Å; I1052-S1063 PolarHBondContact O-N 3.27Å; I1052-V1065 HydrophobicContact CD1-CG2 3.59Å; I1052-V1065 HydrophobicContact CG1-CG2 3.98Å; I1052-M1072 HydrophobicContact CD1-SD 3.97Å; I1052-F1419 HydrophobicContact CG2-CD2 4.41Å; I1052-F1419 HydrophobicContact CG2-CE2 4.46Å; I1052-V1425 HydrophobicContact CD1-CG1 4.01Å; I1052-V1425 HydrophobicContact CD1-CG2 3.72Å
1053	C	90.9	Very high	85.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	127	168	-64.2	0	0	0	0	108.9	Q1040 A1041 Q1061 V1083	Q1040-C1053 WeakPolarHBondContact CB-O 3.37Å; Q1040-C1053 PolarHBondContact N-O 2.84Å; A1041-C1053 HydrophobicContact CB-CB 4.26Å; A1041-C1053 PolarHBondContact N-O 3.27Å; A1041-C1053 PolarHBondContact O-N 3.24Å; C1053-Q1061 WeakPolarHBondContact CA-O 3.16Å; C1053-V1083 HydrophobicContact CB-CB 4.09Å; C1053-V1083 HydrophobicContact CB-CG1 4.26Å; C1053-V1083 HydrophobicContact CB-CG2 4.21Å
1054	Y	89.6	Confident	85.2	Confident	13 Å²	13	33.3 Å²	33.3	5%	0.051	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	153.4	180	63.8	-77.4	0	0	0	110.2	A1037 V1038 I1052 S1060 Q1061 S1063 S1074 F1419	A1037-Y1054 HydrophobicContact CB-CD2 3.83Å; V1038-Y1054 CarbonylContact O-C 3.49Å; V1038-Y1054 WeakPolarHBondContact O-CA 3.42Å; V1038-Y1054 WeakPolarHBondContact O-CB 3.49Å; I1052-Y1054 HydrophobicContact CG2-CD1 4.42Å; Y1054-S1060 CarbonylContact O-C 3.41Å; Y1054-Q1061 HydrophobicContact CD2-CB 4.5Å; Y1054-Q1061 HydrophobicContact CE1-CB 3.91Å; Y1054-Q1061 HydrophobicContact CE2-CB 3.9Å; Y1054-Q1061 PolarHBondContact N-O 3.22Å; Y1054-Q1061 PolarHBondContact O-N 2.81Å; Y1054-Q1061 PolarHBondContact OH-OE1 3.13Å; Y1054-S1063 WeakPolarHBondContact CE1-OG 3.48Å; Y1054-S1063 PolarHBondContact OH-OG 3.07Å; Y1054-S1074 PolarHBondContact OH-OG 2.96Å; Y1054-F1419 AromaticContact CD1-CD2 3.6Å; Y1054-F1419 HydrophobicContact CD1-CD2 3.6Å; Y1054-F1419 AromaticContact CD1-CE2 3.4Å; Y1054-F1419 HydrophobicContact CD1-CE2 3.4Å; Y1054-F1419 HydrophobicContact CD1-CG 4.28Å; Y1054-F1419 AromaticContact CD1-CZ 3.97Å; Y1054-F1419 HydrophobicContact CD1-CZ 3.97Å; Y1054-F1419 HydrophobicContact CD2-CB 4.03Å; Y1054-F1419 AromaticContact CD2-CD1 3.71Å; Y1054-F1419 HydrophobicContact CD2-CD1 3.71Å; Y1054-F1419 AromaticContact CD2-CD2 3.75Å; Y1054-F1419 HydrophobicContact CD2-CD2 3.75Å; Y1054-F1419 HydrophobicContact CD2-CE1 4.04Å; Y1054-F1419 HydrophobicContact CD2-CE2 4.04Å; Y1054-F1419 AromaticContact CD2-CG 3.55Å; Y1054-F1419 HydrophobicContact CD2-CG 3.55Å; Y1054-F1419 HydrophobicContact CD2-CZ 4.18Å; Y1054-F1419 HydrophobicContact CE1-CD2 4.21Å; Y1054-F1419 HydrophobicContact CE1-CE1 4.39Å; Y1054-F1419 AromaticContact CE1-CE2 3.61Å; Y1054-F1419 HydrophobicContact CE1-CE2 3.61Å; Y1054-F1419 AromaticContact CE1-CZ 3.71Å; Y1054-F1419 HydrophobicContact CE1-CZ 3.71Å; Y1054-F1419 AromaticContact CE2-CD1 3.83Å; Y1054-F1419 HydrophobicContact CE2-CD1 3.83Å; Y1054-F1419 HydrophobicContact CE2-CD2 4.32Å; Y1054-F1419 AromaticContact CE2-CE1 3.73Å; Y1054-F1419 HydrophobicContact CE2-CE1 3.73Å; Y1054-F1419 HydrophobicContact CE2-CE2 4.2Å; Y1054-F1419 HydrophobicContact CE2-CG 4.12Å; Y1054-F1419 AromaticContact CE2-CZ 3.91Å; Y1054-F1419 HydrophobicContact CE2-CZ 3.91Å; Y1054-F1419 HydrophobicContact CG-CB 4.14Å; Y1054-F1419 HydrophobicContact CG-CD1 4.22Å; Y1054-F1419 AromaticContact CG-CD2 3.36Å; Y1054-F1419 HydrophobicContact CG-CD2 3.36Å; Y1054-F1419 HydrophobicContact CG-CE1 4.49Å; Y1054-F1419 AromaticContact CG-CE2 3.66Å; Y1054-F1419 HydrophobicContact CG-CE2 3.66Å; Y1054-F1419 AromaticContact CG-CG 3.65Å; Y1054-F1419 HydrophobicContact CG-CG 3.65Å; Y1054-F1419 HydrophobicContact CG-CZ 4.23Å; Y1054-F1419 AromaticContact CZ-CE1 3.92Å; Y1054-F1419 AromaticContact CZ-CE2 3.99Å; Y1054-F1419 AromaticContact CZ-CZ 3.66Å
1055	G	87.1	Confident	85.1	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.01	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.8	-163.7	-178.3	0	0	0	0	0	112.4	V1038 Q1040 Y1059	V1038-G1055 PolarHBondContact N-O 3.17Å; V1038-G1055 PolarHBondContact O-N 3.07Å; Q1040-G1055 PolarHBondContact NE2-O 3.43Å; G1055-Y1059 WeakPolarHBondContact CA-O 3.12Å
1056	D	81.1	Confident	85.1	Confident	46 Å²	46	33.3 Å²	33.3	25%	0.246	16%	0.161	C	C	.	.			trans	-103.1	-145.5	-179.9	73.2	3.6	0	0	0	111.1	Q1040 L1058 Y1059	Q1040-D1056 PolarHBondContact NE2-O 3.13Å; D1056-L1058 WeakPolarHBondContact OD1-CA 3.16Å; D1056-L1058 PolarHBondContact OD1-N 2.87Å; D1056-Y1059 HydrophobicContact CB-CE1 4.47Å; D1056-Y1059 PolarHBondContact N-O 2.94Å; D1056-Y1059 VanDerWaalsContact N-O 3.11Å; D1056-Y1059 WeakPolarHBondContact OD1-CD1 3.31Å; D1056-Y1059 WeakPolarHBondContact OD1-CE1 3.38Å; D1056-Y1059 PolarHBondContact OD1-N 3.44Å; D1056-Y1059 WeakPolarHBondContact OD2-CE1 3.34Å
1057	K	71.9	Confident	85.2	Confident	94 Å²	94	31.7 Å²	31.7	41%	0.409	15%	0.153	S	C	.	.	S	Bend	trans	-88	-21.5	177.3	-63.5	176.8	-177.5	-179.8	0	113	W224	W224-K1057 VanDerWaalsContact O-CD 3.24Å; W224-K1057 WeakPolarHBondContact O-CD 3.3Å; W224-K1057 WeakPolarHBondContact O-CE 3.42Å; W224-K1057 PolarHBondContact O-NZ 2.84Å
1058	L	72.6	Confident	85.2	Confident	90 Å²	90	32.1 Å²	32.1	47%	0.471	16%	0.158	S	C	.	.	S	Bend	trans	-100.9	-36.8	-171.2	-62.2	176.3	0	0	0	111.6	I228 D1056 E1080	I228-L1058 HydrophobicContact CD1-CD2 3.83Å; I228-L1058 HydrophobicContact CG1-CD2 4.45Å; D1056-L1058 WeakPolarHBondContact OD1-CA 3.16Å; D1056-L1058 PolarHBondContact OD1-N 2.87Å; L1058-E1080 CarbonylContact O-C 3.5Å
1059	Y	79.7	Confident	85.1	Confident	75 Å²	75	31 Å²	31	29%	0.294	16%	0.161	S	C	.	.			trans	-136.8	155	-178	63.1	-86.9	0	0	0	112.4	G1055 D1056 L1079	G1055-Y1059 WeakPolarHBondContact CA-O 3.12Å; D1056-Y1059 HydrophobicContact CB-CE1 4.47Å; D1056-Y1059 PolarHBondContact N-O 2.94Å; D1056-Y1059 VanDerWaalsContact N-O 3.11Å; D1056-Y1059 WeakPolarHBondContact OD1-CD1 3.31Å; D1056-Y1059 WeakPolarHBondContact OD1-CE1 3.38Å; D1056-Y1059 PolarHBondContact OD1-N 3.44Å; D1056-Y1059 WeakPolarHBondContact OD2-CE1 3.34Å; Y1059-L1079 VanDerWaalsContact CA-O 3.3Å; Y1059-L1079 WeakPolarHBondContact CA-O 3.46Å
1060	S	87.5	Confident	84.9	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	133.8	171.5	-60.9	0	0	0	0	110.3	Q1040 Y1054 L1079 S1081 R1082 V1083	Q1040-S1060 VanDerWaalsContact CD-OG 3.28Å; Q1040-S1060 PolarHBondContact NE2-OG 2.92Å; Q1040-S1060 PolarHBondContact OE1-OG 3.06Å; Y1054-S1060 CarbonylContact O-C 3.41Å; S1060-L1079 PolarHBondContact N-O 2.85Å; S1060-L1079 PolarHBondContact O-N 2.72Å; S1060-S1081 PolarHBondContact OG-O 3.29Å; S1060-S1081 VanDerWaalsContact OG-O 3.12Å; S1060-R1082 VanDerWaalsContact OG-CA 3.26Å; S1060-R1082 WeakPolarHBondContact OG-CA 3.05Å; S1060-V1083 PolarHBondContact OG-N 3.16Å
1061	Q	87.1	Confident	84.6	Confident	48 Å²	48	31.2 Å²	31.2	22%	0.224	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	156	168.7	-73.7	178.1	-3.7	0	0	109.8	C1053 Y1054 E1078	C1053-Q1061 WeakPolarHBondContact CA-O 3.16Å; Y1054-Q1061 HydrophobicContact CD2-CB 4.5Å; Y1054-Q1061 HydrophobicContact CE1-CB 3.91Å; Y1054-Q1061 HydrophobicContact CE2-CB 3.9Å; Y1054-Q1061 PolarHBondContact N-O 3.22Å; Y1054-Q1061 PolarHBondContact O-N 2.81Å; Y1054-Q1061 PolarHBondContact OH-OE1 3.13Å; Q1061-E1078 HydrophobicContact CG-CG 3.76Å; Q1061-E1078 PolarHBondContact NE2-OE1 2.97Å
1062	I	87.9	Confident	84.4	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.1	176.1	-50.3	176.9	0	0	0	108.4	W1051 I1075 L1079 L1096	W1051-I1062 HydrophobicContact CB-CG2 4.42Å; W1051-I1062 HydrophobicContact CD2-CG2 3.87Å; W1051-I1062 HydrophobicContact CE3-CD1 4.45Å; W1051-I1062 HydrophobicContact CE3-CG2 3.75Å; W1051-I1062 HydrophobicContact CG-CG2 4.18Å; W1051-I1062 HydrophobicContact CZ3-CD1 4.22Å; W1051-I1062 HydrophobicContact CZ3-CG2 4.32Å; I1062-I1075 HydrophobicContact CB-CD1 4.31Å; I1062-I1075 HydrophobicContact CG2-CD1 3.74Å; I1062-I1075 PolarHBondContact O-N 3.31Å; I1062-L1079 HydrophobicContact CD1-CD1 4.05Å; I1062-L1079 HydrophobicContact CG1-CD1 4.17Å; I1062-L1096 HydrophobicContact CD1-CD1 4.42Å
1063	S	87.5	Confident	84.1	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.007	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	137.6	168.9	-80.9	0	0	0	0	109.7	I1052 Y1054 Q1073 S1074	I1052-S1063 PolarHBondContact N-O 3.36Å; I1052-S1063 PolarHBondContact O-N 3.27Å; Y1054-S1063 WeakPolarHBondContact CE1-OG 3.48Å; Y1054-S1063 PolarHBondContact OH-OG 3.07Å; S1063-Q1073 CarbonylContact C-O 3.54Å; S1063-Q1073 WeakPolarHBondContact CA-O 3.49Å; S1063-S1074 WeakPolarHBondContact OG-CA 3.47Å
1064	E	88.5	Confident	83.6	Confident	41 Å²	41	35.3 Å²	35.3	19%	0.192	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	134.4	170	174.1	167.9	-123.2	0	0	109.7	Y1045 H1049 L1050 M1072 Q1073 I1075	Y1045-E1064 PolarHBondContact OH-OE1 2.89Å; H1049-E1064 IonicContact CD2-OE1 3.54Å; L1050-E1064 CarbonylContact O-C 3.51Å; L1050-E1064 WeakPolarHBondContact O-CA 3.41Å; E1064-M1072 CarbonylContact O-C 3.36Å; E1064-M1072 VanDerWaalsContact O-CA 3.3Å; E1064-M1072 WeakPolarHBondContact O-CA 3.15Å; E1064-Q1073 PolarHBondContact N-O 2.79Å; E1064-Q1073 PolarHBondContact O-N 3.29Å; E1064-I1075 HydrophobicContact CB-CD1 4.17Å; E1064-I1075 HydrophobicContact CB-CG1 4.13Å
1065	V	87	Confident	83.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	116.2	174.5	172.6	0	0	0	0	108.2	H1049 L1050 I1052 V1067 C1071 M1072 I1443	H1049-V1065 VanDerWaalsContact CA-O 3.3Å; H1049-V1065 WeakPolarHBondContact CA-O 3.48Å; L1050-V1065 HydrophobicContact CB-CB 4.01Å; L1050-V1065 HydrophobicContact CD2-CB 3.92Å; L1050-V1065 HydrophobicContact CD2-CG1 4.11Å; L1050-V1065 HydrophobicContact CD2-CG2 4.1Å; L1050-V1065 HydrophobicContact CG-CB 4.29Å; L1050-V1065 PolarHBondContact N-O 3.44Å; L1050-V1065 PolarHBondContact O-N 2.91Å; I1052-V1065 HydrophobicContact CD1-CG2 3.59Å; I1052-V1065 HydrophobicContact CG1-CG2 3.98Å; V1065-V1067 HydrophobicContact CG1-CG2 4.44Å; V1065-V1067 PolarHBondContact O-N 3.02Å; V1065-C1071 CarbonylContact C-O 3.57Å; V1065-C1071 WeakPolarHBondContact CA-O 3.4Å; V1065-M1072 HydrophobicContact CG2-CB 3.89Å; V1065-M1072 HydrophobicContact CG2-CG 3.62Å; V1065-M1072 HydrophobicContact CG2-SD 3.68Å; V1065-I1443 HydrophobicContact CG1-CD1 3.77Å; V1065-I1443 HydrophobicContact CG1-CG1 4.45Å; V1065-I1443 HydrophobicContact CG1-CG2 3.84Å; V1065-I1443 HydrophobicContact CG2-CG2 4.46Å
1066	V	86.7	Confident	82.4	Confident	34 Å²	34	38.8 Å²	38.8	21%	0.206	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	101.5	170.1	-175.2	0	0	0	0	107.6	T1068 S1069 N1070 C1071	V1066-T1068 VanDerWaalsContact C-N 3.3Å; V1066-T1068 WeakPolarHBondContact CG1-OG1 3.34Å; V1066-T1068 PolarHBondContact O-N 2.71Å; V1066-S1069 VanDerWaalsContact CB-OG 3.31Å; V1066-S1069 WeakPolarHBondContact CB-OG 3.45Å; V1066-S1069 VanDerWaalsContact CG1-OG 3.23Å; V1066-S1069 WeakPolarHBondContact CG1-OG 3.41Å; V1066-S1069 PolarHBondContact O-N 3.11Å; V1066-S1069 PolarHBondContact O-OG 2.9Å; V1066-N1070 PolarHBondContact O-N 3.44Å; V1066-C1071 PolarHBondContact N-O 3.48Å; V1066-C1071 PolarHBondContact O-N 2.87Å; V1066-C1071 VanDerWaalsContact O-N 3.14Å
1067	V	83.1	Confident	82.1	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.024	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-35.6	-174.7	176	0	0	0	0	112.2	F1044 E1048 V1065 S1069 N1070 L1411 K1427	F1044-V1067 HydrophobicContact CE1-CG2 4.01Å; E1048-V1067 VanDerWaalsContact O-CB 3.26Å; E1048-V1067 WeakPolarHBondContact O-CB 3.39Å; E1048-V1067 WeakPolarHBondContact O-CG2 3.31Å; E1048-V1067 PolarHBondContact O-N 2.76Å; V1065-V1067 HydrophobicContact CG1-CG2 4.44Å; V1065-V1067 PolarHBondContact O-N 3.02Å; V1067-S1069 VanDerWaalsContact C-N 3.33Å; V1067-N1070 PolarHBondContact O-N 2.83Å; V1067-N1070 PolarHBondContact O-OD1 2.74Å; V1067-L1411 HydrophobicContact CB-CD2 4.11Å; V1067-L1411 HydrophobicContact CG1-CD1 3.26Å; V1067-L1411 HydrophobicContact CG1-CD2 3.31Å; V1067-L1411 HydrophobicContact CG1-CG 3.86Å; V1067-L1411 HydrophobicContact CG2-CD2 3.68Å; V1067-K1427 HydrophobicContact CG1-CD 4.07Å; V1067-K1427 PolarHBondContact O-NZ 2.94Å
1068	T	82.5	Confident	82.5	Confident	86 Å²	86	40.8 Å²	40.8	53%	0.528	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-35.7	-177.9	48.2	0	0	0	0	112	E1048 V1066	E1048-T1068 HydrophobicContact CB-CG2 4.12Å; E1048-T1068 HydrophobicContact CG-CG2 3.82Å; V1066-T1068 VanDerWaalsContact C-N 3.3Å; V1066-T1068 WeakPolarHBondContact CG1-OG1 3.34Å; V1066-T1068 PolarHBondContact O-N 2.71Å
1069	S	80.5	Confident	82.9	Confident	73 Å²	73	36.8 Å²	36.8	51%	0.51	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	1	176.7	61.1	0	0	0	0	113.9	V1066 V1067 C1071	V1066-S1069 VanDerWaalsContact CB-OG 3.31Å; V1066-S1069 WeakPolarHBondContact CB-OG 3.45Å; V1066-S1069 VanDerWaalsContact CG1-OG 3.23Å; V1066-S1069 WeakPolarHBondContact CG1-OG 3.41Å; V1066-S1069 PolarHBondContact O-N 3.11Å; V1066-S1069 PolarHBondContact O-OG 2.9Å; V1067-S1069 VanDerWaalsContact C-N 3.33Å; S1069-C1071 PolarHBondContact O-N 2.71Å; S1069-C1071 VanDerWaalsContact OG-CB 3.31Å; S1069-C1071 WeakPolarHBondContact OG-CB 3.25Å
1070	N	82.7	Confident	83	Confident	23 Å²	23	42 Å²	42	12%	0.123	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	40	-172.8	-68	-11.6	0	0	0	112	V1066 V1067 K1427 E1441 Y1444	V1066-N1070 PolarHBondContact O-N 3.44Å; V1067-N1070 PolarHBondContact O-N 2.83Å; V1067-N1070 PolarHBondContact O-OD1 2.74Å; N1070-K1427 WeakPolarHBondContact OD1-CD 3.41Å; N1070-K1427 PolarHBondContact OD1-NZ 2.74Å; N1070-E1441 PolarHBondContact ND2-OE2 3.48Å; N1070-Y1444 HydrophobicContact CB-CD2 4.46Å; N1070-Y1444 WeakPolarHBondContact O-CD2 3.45Å; N1070-Y1444 PolarHBondContact O-N 3.04Å
1071	C	83	Confident	82.8	Confident	24 Å²	24	42.6 Å²	42.6	16%	0.162	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	135.6	-171.2	-176.3	0	0	0	0	110.4	V1065 V1066 S1069 Y1444 F1446	V1065-C1071 CarbonylContact C-O 3.57Å; V1065-C1071 WeakPolarHBondContact CA-O 3.4Å; V1066-C1071 PolarHBondContact N-O 3.48Å; V1066-C1071 PolarHBondContact O-N 2.87Å; V1066-C1071 VanDerWaalsContact O-N 3.14Å; S1069-C1071 PolarHBondContact O-N 2.71Å; S1069-C1071 VanDerWaalsContact OG-CB 3.31Å; S1069-C1071 WeakPolarHBondContact OG-CB 3.25Å; C1071-Y1444 CarbonylContact C-O 3.54Å; C1071-Y1444 WeakPolarHBondContact CA-O 3.38Å; C1071-F1446 WeakPolarHBondContact SG-CB 3.39Å
1072	M	85	Confident	82.8	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.015	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	132	175.9	-177	166.3	59.3	0	0	110.1	I1052 E1064 V1065 F1419 I1443 Y1444 V1445 F1446	I1052-M1072 HydrophobicContact CD1-SD 3.97Å; E1064-M1072 CarbonylContact O-C 3.36Å; E1064-M1072 VanDerWaalsContact O-CA 3.3Å; E1064-M1072 WeakPolarHBondContact O-CA 3.15Å; V1065-M1072 HydrophobicContact CG2-CB 3.89Å; V1065-M1072 HydrophobicContact CG2-CG 3.62Å; V1065-M1072 HydrophobicContact CG2-SD 3.68Å; M1072-F1419 HydrophobicContact CE-CD2 4.07Å; M1072-F1419 HydrophobicContact CE-CE1 4.06Å; M1072-F1419 HydrophobicContact CE-CE2 3.24Å; M1072-F1419 HydrophobicContact CE-CZ 3.23Å; M1072-F1419 HydrophobicContact SD-CD2 4.39Å; M1072-F1419 HydrophobicContact SD-CE2 3.37Å; M1072-F1419 WeakPolarHBondContact SD-CE2 3.3Å; M1072-F1419 HydrophobicContact SD-CZ 3.74Å; M1072-I1443 HydrophobicContact CB-CG2 3.89Å; M1072-Y1444 PolarHBondContact N-O 2.98Å; M1072-V1445 HydrophobicContact CE-CG2 3.53Å; M1072-F1446 PolarHBondContact O-N 2.72Å
1073	Q	83.5	Confident	83	Confident	50 Å²	50	41.3 Å²	41.3	23%	0.234	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	132.5	-177.1	-178.2	172.8	68.6	0	0	110.6	S1063 E1064 R1448	S1063-Q1073 CarbonylContact C-O 3.54Å; S1063-Q1073 WeakPolarHBondContact CA-O 3.49Å; E1064-Q1073 PolarHBondContact N-O 2.79Å; E1064-Q1073 PolarHBondContact O-N 3.29Å; Q1073-R1448 VanDerWaalsContact CD-NH2 3.29Å; Q1073-R1448 HydrophobicContact CG-CG 4.15Å
1074	S	82.1	Confident	83.1	Confident	36 Å²	36	43.4 Å²	43.4	25%	0.252	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	134.4	173.3	-170.9	0	0	0	0	110.8	Y1054 S1063 G1076	Y1054-S1074 PolarHBondContact OH-OG 2.96Å; S1063-S1074 WeakPolarHBondContact OG-CA 3.47Å; S1074-G1076 PolarHBondContact O-N 3.31Å; S1074-G1076 PolarHBondContact OG-N 2.97Å
1075	I	79.2	Confident	83.3	Confident	21 Å²	21	41.9 Å²	41.9	11%	0.108	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-17.6	176.1	-60.1	-178.7	0	0	0	110.7	W1051 I1062 E1064 Y1077 N1111	W1051-I1075 HydrophobicContact CD2-CD1 4.41Å; W1051-I1075 HydrophobicContact CH2-CD1 4.45Å; W1051-I1075 HydrophobicContact CZ2-CD1 3.78Å; I1062-I1075 HydrophobicContact CB-CD1 4.31Å; I1062-I1075 HydrophobicContact CG2-CD1 3.74Å; I1062-I1075 PolarHBondContact O-N 3.31Å; E1064-I1075 HydrophobicContact CB-CD1 4.17Å; E1064-I1075 HydrophobicContact CB-CG1 4.13Å; I1075-Y1077 VanDerWaalsContact C-N 3.29Å; I1075-N1111 VanDerWaalsContact CG2-CG 3.47Å; I1075-N1111 VanDerWaalsContact CG2-ND2 3.29Å; I1075-N1111 WeakPolarHBondContact CG2-ND2 3.36Å; I1075-N1111 WeakPolarHBondContact CG2-OD1 3.34Å
1076	G	71.8	Confident	83.5	Confident	66 Å²	66	43 Å²	43	68%	0.68	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	77	12.6	-178.8	0	0	0	0	0	114.1	S1074	S1074-G1076 PolarHBondContact O-N 3.31Å; S1074-G1076 PolarHBondContact OG-N 2.97Å
1077	Y	74.4	Confident	83.8	Confident	68 Å²	68	42.1 Å²	42.1	27%	0.267	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.6	176.5	-169.3	-90.1	0	0	0	110.4	I1075 L1079 Y1106	I1075-Y1077 VanDerWaalsContact C-N 3.29Å; Y1077-L1079 HydrophobicContact CD1-CD2 4.37Å; Y1077-L1079 HydrophobicContact CD1-CG 4.33Å; Y1077-L1079 HydrophobicContact CE1-CD2 3.76Å; Y1077-L1079 HydrophobicContact CE1-CG 4.17Å; Y1077-Y1106 AromaticContact CD1-CE2 3.76Å; Y1077-Y1106 HydrophobicContact CD1-CE2 3.76Å; Y1077-Y1106 HydrophobicContact CD2-CE2 4.29Å; Y1077-Y1106 HydrophobicContact CE1-CD2 4.42Å; Y1077-Y1106 AromaticContact CE1-CE2 3.67Å; Y1077-Y1106 HydrophobicContact CE1-CE2 3.67Å; Y1077-Y1106 HydrophobicContact CE2-CE2 4.2Å; Y1077-Y1106 HydrophobicContact CG-CE2 4.08Å; Y1077-Y1106 AromaticContact CZ-CE2 3.9Å
1078	E	79.9	Confident	84.2	Confident	113 Å²	113	42.8 Å²	42.8	53%	0.528	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.7	177.9	-72.6	-175.6	168.5	0	0	110.6	Q1061	Q1061-E1078 HydrophobicContact CG-CG 3.76Å; Q1061-E1078 PolarHBondContact NE2-OE1 2.97Å
1079	L	82.2	Confident	84.5	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.037	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	131	169.9	-65.4	160.5	0	0	0	108.4	Y1059 S1060 I1062 Y1077 S1081 V1083 L1096 M1098	Y1059-L1079 VanDerWaalsContact CA-O 3.3Å; Y1059-L1079 WeakPolarHBondContact CA-O 3.46Å; S1060-L1079 PolarHBondContact N-O 2.85Å; S1060-L1079 PolarHBondContact O-N 2.72Å; I1062-L1079 HydrophobicContact CD1-CD1 4.05Å; I1062-L1079 HydrophobicContact CG1-CD1 4.17Å; Y1077-L1079 HydrophobicContact CD1-CD2 4.37Å; Y1077-L1079 HydrophobicContact CD1-CG 4.33Å; Y1077-L1079 HydrophobicContact CE1-CD2 3.76Å; Y1077-L1079 HydrophobicContact CE1-CG 4.17Å; L1079-S1081 PolarHBondContact O-N 2.81Å; L1079-V1083 HydrophobicContact CD1-CG2 3.43Å; L1079-V1083 VanDerWaalsContact CD1-CG2 3.43Å; L1079-L1096 HydrophobicContact CD1-CD1 4.01Å; L1079-L1096 HydrophobicContact CD2-CD1 4.38Å; L1079-M1098 HydrophobicContact CB-SD 4.5Å; L1079-M1098 HydrophobicContact CD2-SD 4.19Å
1080	E	80.5	Confident	84.7	Confident	183 Å²	183	37.7 Å²	37.7	86%	0.855	22%	0.215	S	C	*	.	S	Bend	trans	-71.2	13.1	-179.5	-58.4	177	165.8	0	0	113.9	L1058	L1058-E1080 CarbonylContact O-C 3.5Å
1081	S	84.4	Confident	84.7	Confident	14 Å²	14	42 Å²	42	10%	0.098	24%	0.238	C	C	.	.	S	Bend	trans	-156.7	156.1	176.1	-167.6	0	0	0	0	110.9	S1060 L1079 V1083 S1100	S1060-S1081 PolarHBondContact OG-O 3.29Å; S1060-S1081 VanDerWaalsContact OG-O 3.12Å; L1079-S1081 PolarHBondContact O-N 2.81Å; S1081-V1083 PolarHBondContact O-N 2.8Å; S1081-S1100 WeakPolarHBondContact CB-OG 3.34Å; S1081-S1100 VanDerWaalsContact OG-CB 3.29Å; S1081-S1100 WeakPolarHBondContact OG-CB 3.46Å; S1081-S1100 PolarHBondContact OG-N 3.26Å; S1081-S1100 VanDerWaalsContact OG-N 3.13Å; S1081-S1100 PolarHBondContact OG-OG 2.84Å
1082	R	87.1	Confident	84.9	Confident	20 Å²	20	43.1 Å²	43.1	8%	0.075	24%	0.241	C	C	.	.			trans	-60.8	126	172.4	175.2	160.5	176.5	156.3	4.3	112	L223 Q1040 S1060 M1099	L223-R1082 VanDerWaalsContact CD2-NH2 3.3Å; Q1040-R1082 HydrophobicContact CG-CG 4.34Å; S1060-R1082 VanDerWaalsContact OG-CA 3.26Å; S1060-R1082 WeakPolarHBondContact OG-CA 3.05Å; R1082-M1099 HydrophobicContact CB-CB 4.31Å; R1082-M1099 HydrophobicContact CB-CG 4.14Å; R1082-M1099 HydrophobicContact CB-SD 3.91Å; R1082-M1099 WeakPolarHBondContact CD-SD 3.45Å; R1082-M1099 HydrophobicContact CG-CG 4.06Å; R1082-M1099 HydrophobicContact CG-SD 3.58Å; R1082-M1099 VanDerWaalsContact CG-SD 3.58Å; R1082-M1099 PolarHBondContact O-N 3.34Å
1083	V	90.9	Very high	85.2	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	129	167.9	-178	0	0	0	0	109.2	Q1040 A1041 C1053 S1060 L1079 S1081 C1085 L1096	Q1040-V1083 WeakPolarHBondContact CB-O 3.3Å; Q1040-V1083 VanDerWaalsContact OE1-N 3.16Å; A1041-V1083 HydrophobicContact CB-CG1 3.88Å; C1053-V1083 HydrophobicContact CB-CB 4.09Å; C1053-V1083 HydrophobicContact CB-CG1 4.26Å; C1053-V1083 HydrophobicContact CB-CG2 4.21Å; S1060-V1083 PolarHBondContact OG-N 3.16Å; L1079-V1083 HydrophobicContact CD1-CG2 3.43Å; L1079-V1083 VanDerWaalsContact CD1-CG2 3.43Å; S1081-V1083 PolarHBondContact O-N 2.8Å; V1083-C1085 WeakPolarHBondContact CG1-O 3.24Å; V1083-L1096 HydrophobicContact CG1-CD2 4.01Å; V1083-L1096 HydrophobicContact CG2-CD2 4.39Å
1084	S	90.3	Very high	85.6	Confident	44 Å²	44	40.9 Å²	40.9	31%	0.308	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-42.5	178.7	176.7	0	0	0	0	111.2	G1097 V1123	S1084-G1097 WeakPolarHBondContact CB-O 3.41Å; S1084-G1097 PolarHBondContact N-O 3Å; S1084-V1123 WeakPolarHBondContact CB-O 3.35Å; S1084-V1123 PolarHBondContact OG-O 3.06Å
1085	C	91.5	Very high	86.2	Confident	10 Å²	10	39.1 Å²	39.1	7%	0.068	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	158.9	177.3	55.6	0	0	0	0	110.9	V1083 G1097 V1123 S1124 I1126	V1083-C1085 WeakPolarHBondContact CG1-O 3.24Å; C1085-G1097 PolarHBondContact N-O 2.93Å; C1085-G1097 PolarHBondContact O-N 3.2Å; C1085-V1123 PolarHBondContact SG-O 2.84Å; C1085-S1124 WeakPolarHBondContact CB-O 3.41Å; C1085-I1126 VanDerWaalsContact SG-CD1 3.53Å
1086	I	93.2	Very high	86.8	Confident	23 Å²	23	38.1 Å²	38.1	12%	0.118	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	141.5	-178.3	-171.6	170.6	0	0	0	109.4	A1041 I1042 T1043 W1051 I1094 L1095 L1096	A1041-I1086 HydrophobicContact CB-CB 3.78Å; A1041-I1086 HydrophobicContact CB-CG2 3.41Å; A1041-I1086 VanDerWaalsContact CB-CG2 3.41Å; I1042-I1086 VanDerWaalsContact N-CG2 3.34Å; I1042-I1086 WeakPolarHBondContact O-CG2 3.12Å; T1043-I1086 HydrophobicContact CG2-CD1 3.78Å; T1043-I1086 HydrophobicContact CG2-CG1 3.73Å; T1043-I1086 HydrophobicContact CG2-CG2 4.22Å; W1051-I1086 HydrophobicContact CB-CD1 4.37Å; I1086-I1094 HydrophobicContact CD1-CG2 3.77Å; I1086-I1094 HydrophobicContact CG1-CG2 3.54Å; I1086-L1095 CarbonylContact C-O 3.47Å; I1086-L1095 WeakPolarHBondContact CA-O 3.34Å; I1086-L1096 HydrophobicContact CB-CD2 4.09Å; I1086-L1096 HydrophobicContact CD1-CD2 3.59Å; I1086-L1096 HydrophobicContact CG1-CD2 3.58Å
1087	C	92.5	Very high	87.9	Confident	15 Å²	15	35 Å²	35	10%	0.101	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	121.4	-179.9	-166.9	0	0	0	0	110.3	F1089 L1095 I1126 F1128	C1087-F1089 PolarHBondContact O-N 3.25Å; C1087-L1095 HydrophobicContact CB-CB 4.49Å; C1087-L1095 PolarHBondContact N-O 2.89Å; C1087-L1095 PolarHBondContact O-N 2.63Å; C1087-I1126 HydrophobicContact CB-CB 4.02Å; C1087-I1126 HydrophobicContact CB-CG2 3.84Å; C1087-F1128 VanDerWaalsContact SG-CD1 3.56Å
1088	A	91.1	Very high	88.6	Confident	18 Å²	18	32 Å²	32	15%	0.149	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	104.5	173.5	0	0	0	0	0	109.9	T1043 F1044 I1094 F1128	T1043-A1088 HydrophobicContact CG2-CB 3.99Å; F1044-A1088 WeakPolarHBondContact O-CB 3.47Å; A1088-I1094 HydrophobicContact CB-CG1 4.4Å; A1088-F1128 WeakPolarHBondContact O-CE1 3.23Å
1089	F	88.3	Confident	89	Confident	12 Å²	12	29.4 Å²	29.4	5%	0.053	16%	0.158	C	C	.	.	S	Bend	trans	-76.9	-36.2	-179.4	175.9	-104	0	0	0	111.9	C1087 I1093 L1095 F1128 Y1130 N1137 V1139 I1154	C1087-F1089 PolarHBondContact O-N 3.25Å; F1089-I1093 HydrophobicContact CB-CB 4.48Å; F1089-I1093 HydrophobicContact CB-CG2 4.33Å; F1089-I1093 WeakPolarHBondContact CB-O 3.47Å; F1089-I1093 HydrophobicContact CD1-CB 4.17Å; F1089-I1093 HydrophobicContact CD1-CD1 4.42Å; F1089-I1093 HydrophobicContact CD1-CG2 4.22Å; F1089-I1093 PolarHBondContact N-O 2.85Å; F1089-L1095 HydrophobicContact CB-CD1 4.06Å; F1089-L1095 HydrophobicContact CB-CG 4.04Å; F1089-L1095 HydrophobicContact CD2-CD1 4.39Å; F1089-L1095 HydrophobicContact CG-CD1 4.43Å; F1089-F1128 HydrophobicContact CD2-CB 4.12Å; F1089-F1128 HydrophobicContact CD2-CD1 4.36Å; F1089-F1128 HydrophobicContact CD2-CD2 4.3Å; F1089-F1128 AromaticContact CD2-CG 4Å; F1089-F1128 HydrophobicContact CD2-CG 4Å; F1089-F1128 HydrophobicContact CE2-CB 4.41Å; F1089-Y1130 WeakPolarHBondContact CD1-OH 3.45Å; F1089-Y1130 HydrophobicContact CE1-CE1 4.35Å; F1089-Y1130 WeakPolarHBondContact CE1-OH 3.33Å; F1089-Y1130 AromaticContact CE2-CE1 3.96Å; F1089-Y1130 HydrophobicContact CE2-CE1 3.96Å; F1089-Y1130 HydrophobicContact CE2-CE2 4.34Å; F1089-Y1130 AromaticContact CE2-CZ 3.6Å; F1089-Y1130 VanDerWaalsContact CE2-OH 3.3Å; F1089-Y1130 WeakPolarHBondContact CE2-OH 3.44Å; F1089-Y1130 AromaticContact CZ-CE1 3.67Å; F1089-Y1130 HydrophobicContact CZ-CE1 3.67Å; F1089-Y1130 AromaticContact CZ-CZ 3.59Å; F1089-Y1130 WeakPolarHBondContact CZ-OH 3.29Å; F1089-Y1130 PolarHBondContact O-OH 3.05Å; F1089-N1137 HydrophobicContact CE2-CB 4.27Å; F1089-N1137 HydrophobicContact CZ-CB 4.18Å; F1089-V1139 HydrophobicContact CD2-CG2 4.02Å; F1089-V1139 HydrophobicContact CE2-CG2 3.96Å; F1089-I1154 HydrophobicContact CD1-CG2 4.32Å; F1089-I1154 HydrophobicContact CE1-CG2 4.06Å; F1089-I1154 HydrophobicContact CE2-CB 4.32Å; F1089-I1154 HydrophobicContact CE2-CG2 4.35Å; F1089-I1154 HydrophobicContact CZ-CB 4.1Å; F1089-I1154 HydrophobicContact CZ-CG2 4.06Å; F1089-I1154 WeakPolarHBondContact CZ-O 3.4Å
1090	S	85.4	Confident	89.1	Confident	40 Å²	40	31.2 Å²	31.2	28%	0.28	17%	0.172	S	C	.	.	S	Bend	trans	-145.8	179.1	169.6	74.6	0	0	0	0	109.5	E1092 I1093	S1090-E1092 PolarHBondContact O-N 3.07Å; S1090-E1092 VanDerWaalsContact O-N 3.15Å; S1090-E1092 PolarHBondContact OG-N 3.49Å; S1090-I1093 PolarHBondContact N-O 3.39Å; S1090-I1093 VanDerWaalsContact N-O 3.1Å; S1090-I1093 PolarHBondContact OG-N 3.19Å
1091	N	82.5	Confident	89.6	Confident	115 Å²	115	27.3 Å²	27.3	62%	0.615	15%	0.152	S	C	*	.	S	Bend	trans	-64.7	-14.4	173.8	-61.4	7.3	0	0	0	112.8	Y1045	Y1045-N1091 WeakPolarHBondContact O-CA 3.28Å; Y1045-N1091 PolarHBondContact O-OD1 2.88Å
1092	E	86.9	Confident	89.9	Confident	47 Å²	47	29.1 Å²	29.1	22%	0.22	16%	0.159	C	C	.	.	S	Bend	trans	-110	-33.7	178.9	-176.5	173.8	172.4	0	0	112.9	S1090 S1107 V1108 I1109 F1156	S1090-E1092 PolarHBondContact O-N 3.07Å; S1090-E1092 VanDerWaalsContact O-N 3.15Å; S1090-E1092 PolarHBondContact OG-N 3.49Å; E1092-S1107 CarbonylContact O-C 3.46Å; E1092-S1107 VanDerWaalsContact O-CA 3.28Å; E1092-S1107 WeakPolarHBondContact O-CA 3.2Å; E1092-S1107 PolarHBondContact OE1-OG 2.95Å; E1092-V1108 PolarHBondContact O-N 3.29Å; E1092-I1109 HydrophobicContact CB-CD1 4.13Å; E1092-I1109 HydrophobicContact CB-CG1 4.48Å; E1092-I1109 HydrophobicContact CG-CB 4.27Å; E1092-I1109 HydrophobicContact CG-CD1 3.79Å; E1092-I1109 HydrophobicContact CG-CG1 3.94Å; E1092-F1156 HydrophobicContact CG-CE1 4.27Å; E1092-F1156 HydrophobicContact CG-CZ 4.14Å; E1092-F1156 VanDerWaalsContact OE1-CE1 3.29Å; E1092-F1156 WeakPolarHBondContact OE1-CE1 3.42Å; E1092-F1156 WeakPolarHBondContact OE1-CZ 3.41Å; E1092-F1156 WeakPolarHBondContact OE2-CZ 3.3Å
1093	I	90.5	Very high	90.2	Very high	5 Å²	5	28.2 Å²	28.2	3%	0.026	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.2	-173.1	-57.1	177.8	0	0	0	110	F1089 S1090 L1095 A1105 Y1106 I1114 F1156	F1089-I1093 HydrophobicContact CB-CB 4.48Å; F1089-I1093 HydrophobicContact CB-CG2 4.33Å; F1089-I1093 WeakPolarHBondContact CB-O 3.47Å; F1089-I1093 HydrophobicContact CD1-CB 4.17Å; F1089-I1093 HydrophobicContact CD1-CD1 4.42Å; F1089-I1093 HydrophobicContact CD1-CG2 4.22Å; F1089-I1093 PolarHBondContact N-O 2.85Å; S1090-I1093 PolarHBondContact N-O 3.39Å; S1090-I1093 VanDerWaalsContact N-O 3.1Å; S1090-I1093 PolarHBondContact OG-N 3.19Å; I1093-L1095 HydrophobicContact CG2-CD2 4.23Å; I1093-A1105 HydrophobicContact CG2-CB 4.24Å; I1093-Y1106 WeakPolarHBondContact CA-O 3.45Å; I1093-I1114 HydrophobicContact CB-CD1 4.49Å; I1093-I1114 HydrophobicContact CD1-CD1 4.38Å; I1093-I1114 HydrophobicContact CG1-CD1 3.92Å; I1093-I1114 HydrophobicContact CG2-CD1 4.14Å; I1093-F1156 HydrophobicContact CD1-CD1 4.29Å; I1093-F1156 HydrophobicContact CD1-CD2 4.24Å; I1093-F1156 HydrophobicContact CD1-CE1 4.17Å; I1093-F1156 HydrophobicContact CD1-CE2 4.11Å; I1093-F1156 HydrophobicContact CD1-CG 4.33Å; I1093-F1156 HydrophobicContact CD1-CZ 4.06Å; I1093-F1156 HydrophobicContact CG1-CE1 4.16Å; I1093-F1156 HydrophobicContact CG1-CZ 4.2Å
1094	I	92.2	Very high	90.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.4	172.6	-66.2	173.5	0	0	0	109	Y1045 W1051 I1086 A1088 L1096 A1105 Y1106 V1108	Y1045-I1094 HydrophobicContact CD1-CD1 4.25Å; Y1045-I1094 HydrophobicContact CG-CD1 4.25Å; W1051-I1094 HydrophobicContact CD2-CD1 3.38Å; W1051-I1094 HydrophobicContact CE3-CB 4.41Å; W1051-I1094 HydrophobicContact CE3-CD1 3.21Å; W1051-I1094 HydrophobicContact CE3-CG1 4.38Å; W1051-I1094 HydrophobicContact CE3-CG2 4.26Å; W1051-I1094 HydrophobicContact CG-CD1 3.98Å; W1051-I1094 HydrophobicContact CH2-CD1 4.03Å; W1051-I1094 HydrophobicContact CZ2-CD1 4.21Å; W1051-I1094 HydrophobicContact CZ3-CB 4.26Å; W1051-I1094 HydrophobicContact CZ3-CD1 3.55Å; W1051-I1094 HydrophobicContact CZ3-CG1 4.45Å; W1051-I1094 HydrophobicContact CZ3-CG2 4.45Å; I1086-I1094 HydrophobicContact CD1-CG2 3.77Å; I1086-I1094 HydrophobicContact CG1-CG2 3.54Å; A1088-I1094 HydrophobicContact CB-CG1 4.4Å; I1094-L1096 HydrophobicContact CG2-CD2 4.33Å; I1094-L1096 HydrophobicContact CG2-CG 4.4Å; I1094-A1105 WeakPolarHBondContact O-CA 3.43Å; I1094-Y1106 PolarHBondContact N-O 3.47Å; I1094-Y1106 PolarHBondContact O-N 2.8Å; I1094-V1108 HydrophobicContact CD1-CG2 3.42Å; I1094-V1108 VanDerWaalsContact CD1-CG2 3.42Å; I1094-V1108 HydrophobicContact CG1-CG2 3.87Å
1095	L	94.4	Very high	90.3	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.3	175.7	-57.8	179	0	0	0	109.6	I1086 C1087 F1089 I1093 L1103 C1104 A1105 W1115 V1139 I1154	I1086-L1095 CarbonylContact C-O 3.47Å; I1086-L1095 WeakPolarHBondContact CA-O 3.34Å; C1087-L1095 HydrophobicContact CB-CB 4.49Å; C1087-L1095 PolarHBondContact N-O 2.89Å; C1087-L1095 PolarHBondContact O-N 2.63Å; F1089-L1095 HydrophobicContact CB-CD1 4.06Å; F1089-L1095 HydrophobicContact CB-CG 4.04Å; F1089-L1095 HydrophobicContact CD2-CD1 4.39Å; F1089-L1095 HydrophobicContact CG-CD1 4.43Å; I1093-L1095 HydrophobicContact CG2-CD2 4.23Å; L1095-L1103 HydrophobicContact CB-CD1 4.48Å; L1095-C1104 CarbonylContact C-O 3.57Å; L1095-C1104 WeakPolarHBondContact CA-O 3.25Å; L1095-A1105 HydrophobicContact CD2-CB 3.71Å; L1095-W1115 HydrophobicContact CD2-CH2 3.83Å; L1095-W1115 HydrophobicContact CD2-CZ2 4.13Å; L1095-V1139 HydrophobicContact CD1-CB 4.5Å; L1095-V1139 HydrophobicContact CD1-CG1 3.87Å; L1095-V1139 HydrophobicContact CD1-CG2 3.92Å; L1095-I1154 HydrophobicContact CD1-CD1 4.31Å; L1095-I1154 HydrophobicContact CD2-CG2 4.42Å
1096	L	93.6	Very high	90.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	115.1	-177.6	-64.6	166.8	0	0	0	108.9	I1062 L1079 V1083 I1086 I1094 C1104	I1062-L1096 HydrophobicContact CD1-CD1 4.42Å; L1079-L1096 HydrophobicContact CD1-CD1 4.01Å; L1079-L1096 HydrophobicContact CD2-CD1 4.38Å; V1083-L1096 HydrophobicContact CG1-CD2 4.01Å; V1083-L1096 HydrophobicContact CG2-CD2 4.39Å; I1086-L1096 HydrophobicContact CB-CD2 4.09Å; I1086-L1096 HydrophobicContact CD1-CD2 3.59Å; I1086-L1096 HydrophobicContact CG1-CD2 3.58Å; I1094-L1096 HydrophobicContact CG2-CD2 4.33Å; I1094-L1096 HydrophobicContact CG2-CG 4.4Å; L1096-C1104 HydrophobicContact CB-CB 4.2Å; L1096-C1104 PolarHBondContact N-O 2.83Å; L1096-C1104 PolarHBondContact O-N 3.26Å
1097	G	93.4	Very high	90	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	115.3	170.5	0	0	0	0	0	109.9	S1084 C1085	S1084-G1097 WeakPolarHBondContact CB-O 3.41Å; S1084-G1097 PolarHBondContact N-O 3Å; C1085-G1097 PolarHBondContact N-O 2.93Å; C1085-G1097 PolarHBondContact O-N 3.2Å
1098	M	90	Very high	89.6	Confident	5 Å²	5	24.9 Å²	24.9	3%	0.025	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	150.5	-176.2	-53.5	-152.1	-63.6	0	0	112	L1079 S1100 K1101 Q1102	L1079-M1098 HydrophobicContact CB-SD 4.5Å; L1079-M1098 HydrophobicContact CD2-SD 4.19Å; M1098-S1100 PolarHBondContact O-N 3.17Å; M1098-K1101 PolarHBondContact O-N 3.15Å; M1098-Q1102 HydrophobicContact CB-CB 4.43Å; M1098-Q1102 HydrophobicContact CE-CB 3.82Å; M1098-Q1102 PolarHBondContact N-O 3.14Å
1099	M	87.6	Confident	89.1	Confident	58 Å²	58	30 Å²	30	29%	0.286	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-14.4	173.5	-67.7	-167.2	67.1	0	0	113	I225 R1082 K1101 S1122	I225-M1099 HydrophobicContact CD1-CE 3.99Å; I225-M1099 HydrophobicContact CG1-CE 3.97Å; I225-M1099 HydrophobicContact CG2-CE 4.3Å; R1082-M1099 HydrophobicContact CB-CB 4.31Å; R1082-M1099 HydrophobicContact CB-CG 4.14Å; R1082-M1099 HydrophobicContact CB-SD 3.91Å; R1082-M1099 WeakPolarHBondContact CD-SD 3.45Å; R1082-M1099 HydrophobicContact CG-CG 4.06Å; R1082-M1099 HydrophobicContact CG-SD 3.58Å; R1082-M1099 VanDerWaalsContact CG-SD 3.58Å; R1082-M1099 PolarHBondContact O-N 3.34Å; M1099-K1101 PolarHBondContact O-N 3.49Å; M1099-S1122 PolarHBondContact O-OG 3.32Å; M1099-S1122 VanDerWaalsContact O-OG 3.07Å
1100	S	85.5	Confident	88.9	Confident	46 Å²	46	36.5 Å²	36.5	32%	0.322	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	16.2	170.9	57.9	0	0	0	0	114	S1081 M1098 Q1102	S1081-S1100 WeakPolarHBondContact CB-OG 3.34Å; S1081-S1100 VanDerWaalsContact OG-CB 3.29Å; S1081-S1100 WeakPolarHBondContact OG-CB 3.46Å; S1081-S1100 PolarHBondContact OG-N 3.26Å; S1081-S1100 VanDerWaalsContact OG-N 3.13Å; S1081-S1100 PolarHBondContact OG-OG 2.84Å; M1098-S1100 PolarHBondContact O-N 3.17Å; S1100-Q1102 PolarHBondContact OG-OE1 2.83Å
1101	K	90.9	Very high	88.7	Confident	100 Å²	100	38.1 Å²	38.1	44%	0.435	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	42.2	-178.4	-43	178.8	172	-170.3	0	112.6	M1098 M1099 I1119	M1098-K1101 PolarHBondContact O-N 3.15Å; M1099-K1101 PolarHBondContact O-N 3.49Å; K1101-I1119 WeakPolarHBondContact CB-O 3.25Å; K1101-I1119 PolarHBondContact O-N 2.65Å
1102	Q	90.7	Very high	88.7	Confident	53 Å²	53	34.8 Å²	34.8	25%	0.248	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	140.6	-178.6	-71.5	176.6	-19.6	0	0	110.3	M1098 S1100 Q1116 I1117	M1098-Q1102 HydrophobicContact CB-CB 4.43Å; M1098-Q1102 HydrophobicContact CE-CB 3.82Å; M1098-Q1102 PolarHBondContact N-O 3.14Å; S1100-Q1102 PolarHBondContact OG-OE1 2.83Å; Q1102-Q1116 HydrophobicContact CB-CG 4.1Å; Q1102-Q1116 HydrophobicContact CG-CG 4.37Å; Q1102-Q1116 VanDerWaalsContact NE2-NE2 3.12Å; Q1102-Q1116 VanDerWaalsContact OE1-CD 3.25Å; Q1102-I1117 WeakPolarHBondContact CA-O 3.34Å
1103	L	92.4	Very high	88.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123	166.1	-178.1	70.7	0	0	0	108.1	L1095 W1115 Q1116 I1117 I1119 I1126 I1151	L1095-L1103 HydrophobicContact CB-CD1 4.48Å; L1103-W1115 HydrophobicContact CD2-CZ3 4.48Å; L1103-W1115 HydrophobicContact CG-CZ3 4.35Å; L1103-Q1116 WeakPolarHBondContact O-CA 3.39Å; L1103-I1117 HydrophobicContact CB-CD1 4.34Å; L1103-I1117 HydrophobicContact CB-CG1 3.94Å; L1103-I1117 HydrophobicContact CD2-CD1 4.25Å; L1103-I1117 PolarHBondContact N-O 3.39Å; L1103-I1117 WeakPolarHBondContact O-CG1 3.36Å; L1103-I1117 PolarHBondContact O-N 2.73Å; L1103-I1119 HydrophobicContact CB-CD1 3.43Å; L1103-I1119 VanDerWaalsContact CB-CD1 3.43Å; L1103-I1119 HydrophobicContact CB-CG1 4.2Å; L1103-I1119 HydrophobicContact CD2-CD1 4.13Å; L1103-I1119 HydrophobicContact CG-CD1 4.37Å; L1103-I1126 HydrophobicContact CD1-CD1 3.51Å; L1103-I1126 HydrophobicContact CD1-CG1 4.48Å; L1103-I1151 HydrophobicContact CD2-CD1 3.39Å
1104	C	91.4	Very high	88.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.4	-175.6	174.7	0	0	0	0	109.1	L1095 L1096 K1113 Q1116	L1095-C1104 CarbonylContact C-O 3.57Å; L1095-C1104 WeakPolarHBondContact CA-O 3.25Å; L1096-C1104 HydrophobicContact CB-CB 4.2Å; L1096-C1104 PolarHBondContact N-O 2.83Å; L1096-C1104 PolarHBondContact O-N 3.26Å; C1104-K1113 VanDerWaalsContact SG-CD 3.57Å; C1104-K1113 VanDerWaalsContact SG-CG 3.58Å; C1104-Q1116 HydrophobicContact CB-CG 4.32Å
1105	A	92.4	Very high	88.7	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.8	166.8	0	0	0	0	0	110	I1093 I1094 L1095 I1114 W1115	I1093-A1105 HydrophobicContact CG2-CB 4.24Å; I1094-A1105 WeakPolarHBondContact O-CA 3.43Å; L1095-A1105 HydrophobicContact CD2-CB 3.71Å; A1105-I1114 HydrophobicContact CB-CB 4.25Å; A1105-I1114 HydrophobicContact CB-CD1 4.3Å; A1105-I1114 WeakPolarHBondContact O-CB 3.38Å; A1105-I1114 PolarHBondContact O-N 2.94Å; A1105-W1115 HydrophobicContact CB-CD2 3.58Å; A1105-W1115 HydrophobicContact CB-CE3 3.87Å; A1105-W1115 HydrophobicContact CB-CG 4.27Å; A1105-W1115 HydrophobicContact CB-CH2 3.59Å; A1105-W1115 HydrophobicContact CB-CZ2 3.27Å; A1105-W1115 HydrophobicContact CB-CZ3 3.87Å; A1105-W1115 PolarHBondContact N-O 3.43Å; A1105-W1115 PolarHBondContact O-N 3.15Å
1106	Y	89.8	Confident	88.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	137.7	-176.9	-160.9	-78.9	0	0	0	110	W1051 Y1077 I1093 I1094 N1111 S1112 K1113	W1051-Y1106 AromaticContact CH2-CD1 3.33Å; W1051-Y1106 HydrophobicContact CH2-CD1 3.33Å; W1051-Y1106 AromaticContact CH2-CE1 3.51Å; W1051-Y1106 HydrophobicContact CH2-CE1 3.51Å; W1051-Y1106 HydrophobicContact CH2-CG 4.31Å; W1051-Y1106 HydrophobicContact CZ2-CE1 4.49Å; W1051-Y1106 AromaticContact CZ3-CD1 3.68Å; W1051-Y1106 HydrophobicContact CZ3-CD1 3.68Å; W1051-Y1106 HydrophobicContact CZ3-CE1 4.13Å; W1051-Y1106 HydrophobicContact CZ3-CG 4.23Å; Y1077-Y1106 AromaticContact CD1-CE2 3.76Å; Y1077-Y1106 HydrophobicContact CD1-CE2 3.76Å; Y1077-Y1106 HydrophobicContact CD2-CE2 4.29Å; Y1077-Y1106 HydrophobicContact CE1-CD2 4.42Å; Y1077-Y1106 AromaticContact CE1-CE2 3.67Å; Y1077-Y1106 HydrophobicContact CE1-CE2 3.67Å; Y1077-Y1106 HydrophobicContact CE2-CE2 4.2Å; Y1077-Y1106 HydrophobicContact CG-CE2 4.08Å; Y1077-Y1106 AromaticContact CZ-CE2 3.9Å; I1093-Y1106 WeakPolarHBondContact CA-O 3.45Å; I1094-Y1106 PolarHBondContact N-O 3.47Å; I1094-Y1106 PolarHBondContact O-N 2.8Å; Y1106-N1111 VanDerWaalsContact CZ-C 3.5Å; Y1106-N1111 PolarHBondContact OH-O 2.76Å; Y1106-N1111 VanDerWaalsContact OH-O 3.07Å; Y1106-N1111 PolarHBondContact OH-OD1 2.92Å; Y1106-S1112 PolarHBondContact OH-N 3.24Å; Y1106-K1113 HydrophobicContact CD2-CB 4.32Å
1107	S	88.1	Confident	88.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.4	175.1	171.7	0	0	0	0	109.2	E1092 I1109 R1110 N1111 S1112	E1092-S1107 CarbonylContact O-C 3.46Å; E1092-S1107 VanDerWaalsContact O-CA 3.28Å; E1092-S1107 WeakPolarHBondContact O-CA 3.2Å; E1092-S1107 PolarHBondContact OE1-OG 2.95Å; S1107-I1109 VanDerWaalsContact C-N 3.31Å; S1107-R1110 WeakPolarHBondContact OG-CB 3.45Å; S1107-R1110 WeakPolarHBondContact OG-CG 3.46Å; S1107-R1110 PolarHBondContact OG-N 3.33Å; S1107-R1110 VanDerWaalsContact OG-N 3.1Å; S1107-N1111 WeakPolarHBondContact O-CA 3.25Å; S1107-N1111 PolarHBondContact O-N 2.68Å; S1107-S1112 PolarHBondContact N-O 3.41Å; S1107-S1112 PolarHBondContact O-N 2.98Å
1108	V	83.9	Confident	88.2	Confident	23 Å²	23	46.2 Å²	46.2	14%	0.139	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-46.4	175.1	179.2	0	0	0	0	110.2	Y1045 W1051 E1092 I1094 N1111	Y1045-V1108 HydrophobicContact CD2-CG1 4.06Å; Y1045-V1108 HydrophobicContact CD2-CG2 4.2Å; Y1045-V1108 HydrophobicContact CE1-CG1 4.21Å; Y1045-V1108 HydrophobicContact CE2-CG1 3.62Å; Y1045-V1108 HydrophobicContact CG-CG2 4.17Å; W1051-V1108 HydrophobicContact CH2-CB 4.3Å; W1051-V1108 HydrophobicContact CH2-CG2 3.83Å; W1051-V1108 HydrophobicContact CZ2-CB 3.89Å; W1051-V1108 HydrophobicContact CZ2-CG1 3.78Å; W1051-V1108 HydrophobicContact CZ2-CG2 3.61Å; E1092-V1108 PolarHBondContact O-N 3.29Å; I1094-V1108 HydrophobicContact CD1-CG2 3.42Å; I1094-V1108 VanDerWaalsContact CD1-CG2 3.42Å; I1094-V1108 HydrophobicContact CG1-CG2 3.87Å; V1108-N1111 PolarHBondContact O-N 3.48Å
1109	I	81.9	Confident	88.2	Confident	127 Å²	127	46.4 Å²	46.4	65%	0.651	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-44.9	-174.9	-59.8	177.6	0	0	0	111.6	E1092 S1107 N1111	E1092-I1109 HydrophobicContact CB-CD1 4.13Å; E1092-I1109 HydrophobicContact CB-CG1 4.48Å; E1092-I1109 HydrophobicContact CG-CB 4.27Å; E1092-I1109 HydrophobicContact CG-CD1 3.79Å; E1092-I1109 HydrophobicContact CG-CG1 3.94Å; S1107-I1109 VanDerWaalsContact C-N 3.31Å; I1109-N1111 PolarHBondContact O-N 2.92Å
1110	R	82.7	Confident	88.3	Confident	147 Å²	147	48.4 Å²	48.4	56%	0.555	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-11.4	179.5	-60.6	177.3	-177	160.4	4.8	112.5	S1107 S1112	S1107-R1110 WeakPolarHBondContact OG-CB 3.45Å; S1107-R1110 WeakPolarHBondContact OG-CG 3.46Å; S1107-R1110 PolarHBondContact OG-N 3.33Å; S1107-R1110 VanDerWaalsContact OG-N 3.1Å; R1110-S1112 WeakPolarHBondContact CB-OG 3.5Å; R1110-S1112 PolarHBondContact O-N 3.47Å
1111	N	81.2	Confident	88.7	Confident	75 Å²	75	47.8 Å²	47.8	40%	0.401	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.8	47.1	-171	-166.2	20.5	0	0	0	112.2	I1075 Y1106 S1107 V1108 I1109	I1075-N1111 VanDerWaalsContact CG2-CG 3.47Å; I1075-N1111 VanDerWaalsContact CG2-ND2 3.29Å; I1075-N1111 WeakPolarHBondContact CG2-ND2 3.36Å; I1075-N1111 WeakPolarHBondContact CG2-OD1 3.34Å; Y1106-N1111 VanDerWaalsContact CZ-C 3.5Å; Y1106-N1111 PolarHBondContact OH-O 2.76Å; Y1106-N1111 VanDerWaalsContact OH-O 3.07Å; Y1106-N1111 PolarHBondContact OH-OD1 2.92Å; S1107-N1111 WeakPolarHBondContact O-CA 3.25Å; S1107-N1111 PolarHBondContact O-N 2.68Å; V1108-N1111 PolarHBondContact O-N 3.48Å; I1109-N1111 PolarHBondContact O-N 2.92Å
1112	S	83.7	Confident	88.8	Confident	45 Å²	45	43.8 Å²	43.8	32%	0.315	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	150.2	-174.7	69	0	0	0	0	112	Y1106 S1107 R1110 I1114	Y1106-S1112 PolarHBondContact OH-N 3.24Å; S1107-S1112 PolarHBondContact N-O 3.41Å; S1107-S1112 PolarHBondContact O-N 2.98Å; R1110-S1112 WeakPolarHBondContact CB-OG 3.5Å; R1110-S1112 PolarHBondContact O-N 3.47Å; S1112-I1114 PolarHBondContact O-N 2.82Å
1113	K	87.2	Confident	88.9	Confident	84 Å²	84	41.3 Å²	41.3	37%	0.365	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	125.8	169.7	-173.8	166.5	81.1	-177.3	0	110.8	C1104 Y1106 Q1116	C1104-K1113 VanDerWaalsContact SG-CD 3.57Å; C1104-K1113 VanDerWaalsContact SG-CG 3.58Å; Y1106-K1113 HydrophobicContact CD2-CB 4.32Å; K1113-Q1116 HydrophobicContact CD-CB 3.98Å
1114	I	89.3	Confident	88.9	Confident	38 Å²	38	42.6 Å²	42.6	20%	0.195	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-58.2	178	-52.5	175.4	0	0	0	109	I1093 A1105 S1112 F1156	I1093-I1114 HydrophobicContact CB-CD1 4.49Å; I1093-I1114 HydrophobicContact CD1-CD1 4.38Å; I1093-I1114 HydrophobicContact CG1-CD1 3.92Å; I1093-I1114 HydrophobicContact CG2-CD1 4.14Å; A1105-I1114 HydrophobicContact CB-CB 4.25Å; A1105-I1114 HydrophobicContact CB-CD1 4.3Å; A1105-I1114 WeakPolarHBondContact O-CB 3.38Å; A1105-I1114 PolarHBondContact O-N 2.94Å; S1112-I1114 PolarHBondContact O-N 2.82Å; I1114-F1156 HydrophobicContact CD1-CD1 4.05Å; I1114-F1156 HydrophobicContact CD1-CE1 4.31Å; I1114-F1156 HydrophobicContact CG2-CB 4.47Å; I1114-F1156 HydrophobicContact CG2-CD1 4.4Å; I1114-F1156 WeakPolarHBondContact CG2-O 3.3Å
1115	W	92	Very high	89.1	Confident	13 Å²	13	43.5 Å²	43.5	5%	0.049	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	162.8	178	48.3	-107.9	0	0	0	109.7	L1095 L1103 A1105 I1117 I1154 G1155 E1157 E1158 P1159	L1095-W1115 HydrophobicContact CD2-CH2 3.83Å; L1095-W1115 HydrophobicContact CD2-CZ2 4.13Å; L1103-W1115 HydrophobicContact CD2-CZ3 4.48Å; L1103-W1115 HydrophobicContact CG-CZ3 4.35Å; A1105-W1115 HydrophobicContact CB-CD2 3.58Å; A1105-W1115 HydrophobicContact CB-CE3 3.87Å; A1105-W1115 HydrophobicContact CB-CG 4.27Å; A1105-W1115 HydrophobicContact CB-CH2 3.59Å; A1105-W1115 HydrophobicContact CB-CZ2 3.27Å; A1105-W1115 HydrophobicContact CB-CZ3 3.87Å; A1105-W1115 PolarHBondContact N-O 3.43Å; A1105-W1115 PolarHBondContact O-N 3.15Å; W1115-I1117 HydrophobicContact CE3-CG1 4.42Å; W1115-I1117 HydrophobicContact CE3-CG2 4.24Å; W1115-I1117 HydrophobicContact CZ3-CD1 4.35Å; W1115-I1117 HydrophobicContact CZ3-CG1 4.1Å; W1115-I1154 HydrophobicContact CH2-CD1 4.09Å; W1115-I1154 HydrophobicContact CH2-CG2 4.48Å; W1115-I1154 HydrophobicContact CZ2-CD1 4.38Å; W1115-I1154 HydrophobicContact CZ2-CG2 3.88Å; W1115-G1155 PolarHBondContact NE1-O 3.38Å; W1115-E1157 PolarHBondContact NE1-O 2.89Å; W1115-E1158 HydrophobicContact CB-CB 3.97Å; W1115-E1158 HydrophobicContact CB-CG 4.22Å; W1115-E1158 HydrophobicContact CG-CB 4.19Å; W1115-P1159 HydrophobicContact CH2-CG 4.48Å
1116	Q	90.1	Very high	89.2	Confident	53 Å²	53	44 Å²	44	25%	0.248	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	119.6	179.2	-179.5	-177.8	-59.6	0	0	108.5	Q1102 L1103 C1104 K1113	Q1102-Q1116 HydrophobicContact CB-CG 4.1Å; Q1102-Q1116 HydrophobicContact CG-CG 4.37Å; Q1102-Q1116 VanDerWaalsContact NE2-NE2 3.12Å; Q1102-Q1116 VanDerWaalsContact OE1-CD 3.25Å; L1103-Q1116 WeakPolarHBondContact O-CA 3.39Å; C1104-Q1116 HydrophobicContact CB-CG 4.32Å; K1113-Q1116 HydrophobicContact CD-CB 3.98Å
1117	I	90.5	Very high	89.4	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.026	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	140.2	-177.6	57.6	168.3	0	0	0	110.1	Q1102 L1103 W1115 I1119 I1151 E1158 P1159 I1163	Q1102-I1117 WeakPolarHBondContact CA-O 3.34Å; L1103-I1117 HydrophobicContact CB-CD1 4.34Å; L1103-I1117 HydrophobicContact CB-CG1 3.94Å; L1103-I1117 HydrophobicContact CD2-CD1 4.25Å; L1103-I1117 PolarHBondContact N-O 3.39Å; L1103-I1117 WeakPolarHBondContact O-CG1 3.36Å; L1103-I1117 PolarHBondContact O-N 2.73Å; W1115-I1117 HydrophobicContact CE3-CG1 4.42Å; W1115-I1117 HydrophobicContact CE3-CG2 4.24Å; W1115-I1117 HydrophobicContact CZ3-CD1 4.35Å; W1115-I1117 HydrophobicContact CZ3-CG1 4.1Å; I1117-I1119 HydrophobicContact CD1-CD1 4.49Å; I1117-I1119 HydrophobicContact CD1-CG1 4.48Å; I1117-I1119 HydrophobicContact CG1-CG1 4.47Å; I1117-I1151 HydrophobicContact CD1-CD1 3.78Å; I1117-E1158 HydrophobicContact CG2-CG 3.75Å; I1117-P1159 HydrophobicContact CD1-CG 4.22Å; I1117-I1163 HydrophobicContact CD1-CD1 3.64Å
1118	P	90.4	Very high	89.7	Confident	98 Å²	98	47.9 Å²	47.9	64%	0.636	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	141.8	168.8	31.1	-32.8	0	0	0	110.1
1119	I	91.5	Very high	90	Very high	10 Å²	10	47 Å²	47	5%	0.051	24%	0.24	C	C	.	.			trans	-125.1	158.9	175.2	-65.7	-167.6	0	0	0	108.3	K1101 L1103 I1117 D1121 V1123 L1143 V1149 Y1165	K1101-I1119 WeakPolarHBondContact CB-O 3.25Å; K1101-I1119 PolarHBondContact O-N 2.65Å; L1103-I1119 HydrophobicContact CB-CD1 3.43Å; L1103-I1119 VanDerWaalsContact CB-CD1 3.43Å; L1103-I1119 HydrophobicContact CB-CG1 4.2Å; L1103-I1119 HydrophobicContact CD2-CD1 4.13Å; L1103-I1119 HydrophobicContact CG-CD1 4.37Å; I1117-I1119 HydrophobicContact CD1-CD1 4.49Å; I1117-I1119 HydrophobicContact CD1-CG1 4.48Å; I1117-I1119 HydrophobicContact CG1-CG1 4.47Å; I1119-D1121 VanDerWaalsContact C-N 3.25Å; I1119-D1121 PolarHBondContact O-N 3.16Å; I1119-V1123 HydrophobicContact CD1-CG2 4.15Å; I1119-L1143 HydrophobicContact CG2-CD1 3.49Å; I1119-L1143 VanDerWaalsContact CG2-CD1 3.49Å; I1119-L1143 HydrophobicContact CG2-CD2 3.6Å; I1119-L1143 HydrophobicContact CG2-CG 4.19Å; I1119-V1149 HydrophobicContact CG2-CG2 3.83Å; I1119-Y1165 HydrophobicContact CG2-CE1 4.05Å
1120	H	88.7	Confident	90.3	Very high	99 Å²	99	46 Å²	46	46%	0.458	23%	0.229	S	C	.	.	S	Bend	trans	-55.8	-36.6	-176.6	-68.6	-176.9	0	0	0	114.1	L1143 E1147 Y1165	H1120-L1143 HydrophobicContact CB-CD1 4.17Å; H1120-E1147 IonicContact CE1-OE2 3.06Å; H1120-E1147 IonicContact CG-OE2 2.72Å; H1120-E1147 IonicContact ND1-OE1 3.12Å; H1120-E1147 IonicContact ND1-OE2 2.78Å; H1120-E1147 PolarHBondContact ND1-OE2 2.86Å; H1120-Y1165 HydrophobicContact CB-CD1 4.47Å; H1120-Y1165 HydrophobicContact CB-CE1 4.09Å; H1120-Y1165 AromaticContact CD2-CE1 3.58Å; H1120-Y1165 AromaticContact CD2-CZ 3.61Å; H1120-Y1165 AromaticContact CE1-CD1 3.53Å; H1120-Y1165 AromaticContact CE1-CD2 3.75Å; H1120-Y1165 AromaticContact CE1-CE1 3.76Å; H1120-Y1165 AromaticContact CE1-CE2 3.97Å; H1120-Y1165 AromaticContact CE1-CG 3.53Å; H1120-Y1165 AromaticContact CE1-CZ 3.99Å; H1120-Y1165 AromaticContact CG-CD1 3.76Å; H1120-Y1165 AromaticContact CG-CE1 3.48Å; H1120-Y1165 VanDerWaalsContact CG-CE1 3.48Å; H1120-Y1165 AromaticContact ND1-CD1 3.37Å; H1120-Y1165 WeakPolarHBondContact ND1-CD1 3.03Å; H1120-Y1165 AromaticContact ND1-CE1 3.6Å; H1120-Y1165 AromaticContact ND1-CG 3.83Å; H1120-Y1165 AromaticContact NE2-CD1 4Å; H1120-Y1165 AromaticContact NE2-CD2 3.9Å; H1120-Y1165 AromaticContact NE2-CE1 3.77Å; H1120-Y1165 AromaticContact NE2-CE2 3.66Å; H1120-Y1165 AromaticContact NE2-CZ 3.61Å
1121	D	93.1	Very high	90.5	Very high	33 Å²	33	40.7 Å²	40.7	18%	0.176	21%	0.21	C	C	.	.	S	Bend	trans	-151.9	-179.9	179.8	-155.9	7.7	0	0	0	112.6	I1119 L1143 T1144 N1145	I1119-D1121 VanDerWaalsContact C-N 3.25Å; I1119-D1121 PolarHBondContact O-N 3.16Å; D1121-L1143 HydrophobicContact CB-CB 4.48Å; D1121-T1144 PolarHBondContact OD1-OG1 3.34Å; D1121-T1144 PolarHBondContact OD2-OG1 3.41Å; D1121-N1145 HydrophobicContact CB-CB 4.01Å; D1121-N1145 WeakPolarHBondContact OD2-CB 3.41Å; D1121-N1145 PolarHBondContact OD2-N 3.48Å
1122	S	93.2	Very high	90.3	Very high	17 Å²	17	44 Å²	44	12%	0.119	23%	0.226	C	C	.	.			trans	-61.1	134.3	-179.4	-55.5	0	0	0	0	111.3	M1099 L1143 T1144	M1099-S1122 PolarHBondContact O-OG 3.32Å; M1099-S1122 VanDerWaalsContact O-OG 3.07Å; S1122-L1143 WeakPolarHBondContact O-CA 3.24Å; S1122-T1144 WeakPolarHBondContact CB-OG1 3.38Å; S1122-T1144 PolarHBondContact N-OG1 2.95Å; S1122-T1144 PolarHBondContact O-N 3.44Å; S1122-T1144 PolarHBondContact O-OG1 3.42Å
1123	V	93.5	Very high	89.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	121.7	-179.9	-170.5	0	0	0	0	109.8	S1084 C1085 I1119 I1126 A1141 L1143	S1084-V1123 WeakPolarHBondContact CB-O 3.35Å; S1084-V1123 PolarHBondContact OG-O 3.06Å; C1085-V1123 PolarHBondContact SG-O 2.84Å; I1119-V1123 HydrophobicContact CD1-CG2 4.15Å; V1123-I1126 HydrophobicContact CG1-CD1 3.81Å; V1123-I1126 HydrophobicContact CG1-CG1 3.49Å; V1123-I1126 VanDerWaalsContact CG1-CG1 3.49Å; V1123-A1141 HydrophobicContact CG1-CB 3.81Å; V1123-L1143 HydrophobicContact CB-CD2 4.31Å; V1123-L1143 HydrophobicContact CG1-CD2 4.44Å; V1123-L1143 HydrophobicContact CG2-CD2 3.87Å
1124	S	92.7	Very high	89.1	Confident	27 Å²	27	50.2 Å²	50.2	19%	0.189	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	-39	-174.5	51.8	0	0	0	0	113.7	C1085 G1142 I1173	C1085-S1124 WeakPolarHBondContact CB-O 3.41Å; S1124-G1142 PolarHBondContact N-O 3.44Å; S1124-G1142 VanDerWaalsContact OG-C 3.28Å; S1124-G1142 PolarHBondContact OG-O 3.39Å; S1124-I1173 WeakPolarHBondContact CB-O 3.29Å; S1124-I1173 PolarHBondContact OG-O 3.37Å
1125	D	95	Very high	88.6	Confident	19 Å²	19	56.7 Å²	56.7	10%	0.102	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	148	177.7	-154.5	12.9	0	0	0	109.4	A1141 G1142 S1175 V1176 K1217	D1125-A1141 WeakPolarHBondContact O-CA 3.41Å; D1125-G1142 PolarHBondContact O-N 2.84Å; D1125-S1175 WeakPolarHBondContact OD2-CA 3.39Å; D1125-S1175 PolarHBondContact OD2-OG 3.29Å; D1125-S1175 VanDerWaalsContact OD2-OG 3.04Å; D1125-V1176 HydrophobicContact CB-CG2 4.46Å; D1125-V1176 PolarHBondContact OD2-N 3.1Å; D1125-K1217 VanDerWaalsContact CG-NZ 3.28Å; D1125-K1217 IonicContact OD1-NZ 3.05Å; D1125-K1217 PolarHBondContact OD1-NZ 3Å; D1125-K1217 IonicContact OD2-NZ 3.03Å; D1125-K1217 PolarHBondContact OD2-NZ 3.44Å
1126	I	95.1	Very high	88.2	Confident	10 Å²	10	57.9 Å²	57.9	5%	0.051	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	135.4	-178.2	-60.8	162.2	0	0	0	109.2	C1085 C1087 L1103 V1123 V1139 Y1140 A1141	C1085-I1126 VanDerWaalsContact SG-CD1 3.53Å; C1087-I1126 HydrophobicContact CB-CB 4.02Å; C1087-I1126 HydrophobicContact CB-CG2 3.84Å; L1103-I1126 HydrophobicContact CD1-CD1 3.51Å; L1103-I1126 HydrophobicContact CD1-CG1 4.48Å; V1123-I1126 HydrophobicContact CG1-CD1 3.81Å; V1123-I1126 HydrophobicContact CG1-CG1 3.49Å; V1123-I1126 VanDerWaalsContact CG1-CG1 3.49Å; I1126-V1139 HydrophobicContact CG2-CG1 3.75Å; I1126-Y1140 WeakPolarHBondContact CA-O 3.39Å; I1126-A1141 HydrophobicContact CG1-CB 4.09Å
1127	T	94.2	Very high	88.1	Confident	27 Å²	27	56.2 Å²	56.2	17%	0.166	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	167.4	168.8	-163.7	0	0	0	0	110.5	Y1140 V1176 L1178 L1183	T1127-Y1140 HydrophobicContact CG2-CD2 4.01Å; T1127-Y1140 PolarHBondContact N-O 3.41Å; T1127-Y1140 PolarHBondContact O-N 3.2Å; T1127-V1176 HydrophobicContact CG2-CB 4.23Å; T1127-V1176 HydrophobicContact CG2-CG1 3.62Å; T1127-L1178 HydrophobicContact CG2-CB 4.49Å; T1127-L1183 HydrophobicContact CG2-CD1 3.96Å
1128	F	93.3	Very high	88.1	Confident	55 Å²	55	57 Å²	57	24%	0.241	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	155.8	-179.8	65.8	-92.2	0	0	0	111.7	C1087 A1088 F1089 Y1130 K1138 V1139 L1178	C1087-F1128 VanDerWaalsContact SG-CD1 3.56Å; A1088-F1128 WeakPolarHBondContact O-CE1 3.23Å; F1089-F1128 HydrophobicContact CD2-CB 4.12Å; F1089-F1128 HydrophobicContact CD2-CD1 4.36Å; F1089-F1128 HydrophobicContact CD2-CD2 4.3Å; F1089-F1128 AromaticContact CD2-CG 4Å; F1089-F1128 HydrophobicContact CD2-CG 4Å; F1089-F1128 HydrophobicContact CE2-CB 4.41Å; F1128-Y1130 AromaticContact CD2-CD2 3.6Å; F1128-Y1130 HydrophobicContact CD2-CD2 3.6Å; F1128-Y1130 AromaticContact CD2-CE2 3.4Å; F1128-Y1130 HydrophobicContact CD2-CE2 3.4Å; F1128-Y1130 AromaticContact CE2-CD2 3.53Å; F1128-Y1130 HydrophobicContact CE2-CD2 3.53Å; F1128-Y1130 AromaticContact CE2-CE2 3.22Å; F1128-Y1130 HydrophobicContact CE2-CE2 3.22Å; F1128-Y1130 HydrophobicContact CZ-CE2 4.25Å; F1128-K1138 CarbonylContact C-O 3.58Å; F1128-K1138 VanDerWaalsContact CA-O 3.24Å; F1128-K1138 WeakPolarHBondContact CA-O 3.24Å; F1128-V1139 HydrophobicContact CB-CG2 3.85Å; F1128-L1178 WeakPolarHBondContact O-CD2 3.39Å
1129	A	90.8	Very high	88.3	Confident	6 Å²	6	52.4 Å²	52.4	5%	0.05	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.6	172.4	0	0	0	0	0	110.1	F1131 N1137 K1138 Y1140 L1178	A1129-F1131 HydrophobicContact CB-CE1 4.28Å; A1129-F1131 HydrophobicContact CB-CE2 3.81Å; A1129-F1131 HydrophobicContact CB-CZ 3.6Å; A1129-N1137 CarbonylContact O-C 3.58Å; A1129-N1137 VanDerWaalsContact O-CA 3.3Å; A1129-N1137 WeakPolarHBondContact O-CA 3.17Å; A1129-K1138 PolarHBondContact N-O 2.65Å; A1129-K1138 PolarHBondContact O-N 3.36Å; A1129-Y1140 HydrophobicContact CB-CE2 3.81Å; A1129-L1178 HydrophobicContact CB-CD1 4.4Å; A1129-L1178 HydrophobicContact CB-CD2 3.64Å
1130	Y	88.3	Confident	88.5	Confident	106 Å²	106	51.9 Å²	51.9	42%	0.416	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.2	168.8	-73.3	-77.9	0	0	0	109.6	F1089 F1128 N1137	F1089-Y1130 WeakPolarHBondContact CD1-OH 3.45Å; F1089-Y1130 HydrophobicContact CE1-CE1 4.35Å; F1089-Y1130 WeakPolarHBondContact CE1-OH 3.33Å; F1089-Y1130 AromaticContact CE2-CE1 3.96Å; F1089-Y1130 HydrophobicContact CE2-CE1 3.96Å; F1089-Y1130 HydrophobicContact CE2-CE2 4.34Å; F1089-Y1130 AromaticContact CE2-CZ 3.6Å; F1089-Y1130 VanDerWaalsContact CE2-OH 3.3Å; F1089-Y1130 WeakPolarHBondContact CE2-OH 3.44Å; F1089-Y1130 AromaticContact CZ-CE1 3.67Å; F1089-Y1130 HydrophobicContact CZ-CE1 3.67Å; F1089-Y1130 AromaticContact CZ-CZ 3.59Å; F1089-Y1130 WeakPolarHBondContact CZ-OH 3.29Å; F1089-Y1130 PolarHBondContact O-OH 3.05Å; F1128-Y1130 AromaticContact CD2-CD2 3.6Å; F1128-Y1130 HydrophobicContact CD2-CD2 3.6Å; F1128-Y1130 AromaticContact CD2-CE2 3.4Å; F1128-Y1130 HydrophobicContact CD2-CE2 3.4Å; F1128-Y1130 AromaticContact CE2-CD2 3.53Å; F1128-Y1130 HydrophobicContact CE2-CD2 3.53Å; F1128-Y1130 AromaticContact CE2-CE2 3.22Å; F1128-Y1130 HydrophobicContact CE2-CE2 3.22Å; F1128-Y1130 HydrophobicContact CZ-CE2 4.25Å; Y1130-N1137 HydrophobicContact CD1-CB 3.53Å; Y1130-N1137 HydrophobicContact CE1-CB 3.69Å; Y1130-N1137 HydrophobicContact CG-CB 4.4Å
1131	F	85.5	Confident	88.8	Confident	34 Å²	34	47.2 Å²	47.2	15%	0.149	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	87.9	178.6	-58.5	-73.9	0	0	0	109.4	A1129 H1133 D1134 H1135 T1136 K1138 A1196 K1197	A1129-F1131 HydrophobicContact CB-CE1 4.28Å; A1129-F1131 HydrophobicContact CB-CE2 3.81Å; A1129-F1131 HydrophobicContact CB-CZ 3.6Å; F1131-H1133 PolarHBondContact O-N 3.01Å; F1131-H1133 VanDerWaalsContact O-N 3.12Å; F1131-D1134 PolarHBondContact O-N 3.3Å; F1131-H1135 PolarHBondContact O-N 2.9Å; F1131-H1135 VanDerWaalsContact O-N 3.09Å; F1131-T1136 PolarHBondContact N-O 3.4Å; F1131-K1138 HydrophobicContact CD2-CG 4.4Å; F1131-K1138 HydrophobicContact CE2-CB 4.06Å; F1131-K1138 HydrophobicContact CE2-CD 3.98Å; F1131-K1138 HydrophobicContact CE2-CG 3.78Å; F1131-A1196 HydrophobicContact CZ-CB 4.29Å; F1131-K1197 HydrophobicContact CD1-CB 4Å; F1131-K1197 HydrophobicContact CD1-CD 4.13Å; F1131-K1197 HydrophobicContact CD1-CG 3.95Å; F1131-K1197 HydrophobicContact CE1-CB 3.5Å; F1131-K1197 VanDerWaalsContact CE1-CB 3.5Å; F1131-K1197 HydrophobicContact CE1-CD 4.48Å; F1131-K1197 HydrophobicContact CE1-CG 3.92Å; F1131-K1197 HydrophobicContact CG-CG 4.3Å; F1131-K1197 VanDerWaalsContact CZ-CA 3.49Å; F1131-K1197 HydrophobicContact CZ-CB 3.84Å; F1131-K1197 HydrophobicContact CZ-CG 4.25Å
1132	L	77.3	Confident	88.9	Confident	144 Å²	144	45.6 Å²	45.6	75%	0.754	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-37	-172.8	-69.4	170.7	0	0	0	114.2	D1134	L1132-D1134 VanDerWaalsContact C-N 3.33Å; L1132-D1134 PolarHBondContact O-N 3.48Å
1133	H	74.7	Confident	89	Confident	182 Å²	182	44.8 Å²	44.8	84%	0.843	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-29.3	-178.2	-69.3	-60.8	0	0	0	114	F1131	F1131-H1133 PolarHBondContact O-N 3.01Å; F1131-H1133 VanDerWaalsContact O-N 3.12Å
1134	D	71.8	Confident	89	Confident	78 Å²	78	47.1 Å²	47.1	42%	0.417	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-6	-176.9	-64.2	20	0	0	0	111.2	F1131 L1132 T1136 K1197	F1131-D1134 PolarHBondContact O-N 3.3Å; L1132-D1134 VanDerWaalsContact C-N 3.33Å; L1132-D1134 PolarHBondContact O-N 3.48Å; D1134-T1136 HydrophobicContact CB-CG2 4.06Å; D1134-T1136 WeakPolarHBondContact CB-OG1 3.37Å; D1134-T1136 PolarHBondContact O-N 3.36Å; D1134-T1136 VanDerWaalsContact O-N 3.14Å; D1134-K1197 IonicContact OD1-NZ 3.52Å; D1134-K1197 PolarHBondContact OD1-NZ 2.87Å; D1134-K1197 WeakPolarHBondContact OD2-CE 3.4Å; D1134-K1197 IonicContact OD2-NZ 3.53Å; D1134-K1197 PolarHBondContact OD2-NZ 3.47Å
1135	H	79.1	Confident	88.8	Confident	174 Å²	174	48.1 Å²	48.1	81%	0.806	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	25.8	-168.1	-58.6	-69.2	0	0	0	113.7	F1131	F1131-H1135 PolarHBondContact O-N 2.9Å; F1131-H1135 VanDerWaalsContact O-N 3.09Å
1136	T	82.4	Confident	88.5	Confident	38 Å²	38	47.2 Å²	47.2	23%	0.233	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	155.5	177.5	58	0	0	0	0	110.9	F1131 D1134 N1153	F1131-T1136 PolarHBondContact N-O 3.4Å; D1134-T1136 HydrophobicContact CB-CG2 4.06Å; D1134-T1136 WeakPolarHBondContact CB-OG1 3.37Å; D1134-T1136 PolarHBondContact O-N 3.36Å; D1134-T1136 VanDerWaalsContact O-N 3.14Å; T1136-N1153 WeakPolarHBondContact CA-OD1 3.49Å; T1136-N1153 VanDerWaalsContact CB-OD1 3.26Å; T1136-N1153 WeakPolarHBondContact CB-OD1 3.25Å; T1136-N1153 WeakPolarHBondContact CG2-OD1 3.49Å
1137	N	89.4	Confident	88.5	Confident	19 Å²	19	48.2 Å²	48.2	10%	0.102	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	155	170.8	69.3	67.6	0	0	0	109.7	F1089 A1129 Y1130 N1153 I1154	F1089-N1137 HydrophobicContact CE2-CB 4.27Å; F1089-N1137 HydrophobicContact CZ-CB 4.18Å; A1129-N1137 CarbonylContact O-C 3.58Å; A1129-N1137 VanDerWaalsContact O-CA 3.3Å; A1129-N1137 WeakPolarHBondContact O-CA 3.17Å; Y1130-N1137 HydrophobicContact CD1-CB 3.53Å; Y1130-N1137 HydrophobicContact CE1-CB 3.69Å; Y1130-N1137 HydrophobicContact CG-CB 4.4Å; N1137-N1153 PolarHBondContact N-OD1 3.11Å; N1137-N1153 PolarHBondContact O-N 3.05Å; N1137-N1153 WeakPolarHBondContact OD1-CA 3.4Å; N1137-N1153 PolarHBondContact OD1-N 3.02Å; N1137-I1154 PolarHBondContact ND2-O 3.31Å; N1137-I1154 PolarHBondContact OD1-N 2.97Å
1138	K	90.5	Very high	88.5	Confident	22 Å²	22	46.9 Å²	46.9	10%	0.096	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	135.8	172.7	-63.6	-168.2	-174	-159.9	0	109.6	F1128 A1129 F1131 Y1140 V1150 I1151 E1152 K1197	F1128-K1138 CarbonylContact C-O 3.58Å; F1128-K1138 VanDerWaalsContact CA-O 3.24Å; F1128-K1138 WeakPolarHBondContact CA-O 3.24Å; A1129-K1138 PolarHBondContact N-O 2.65Å; A1129-K1138 PolarHBondContact O-N 3.36Å; F1131-K1138 HydrophobicContact CD2-CG 4.4Å; F1131-K1138 HydrophobicContact CE2-CB 4.06Å; F1131-K1138 HydrophobicContact CE2-CD 3.98Å; F1131-K1138 HydrophobicContact CE2-CG 3.78Å; K1138-Y1140 HydrophobicContact CB-CE1 4.07Å; K1138-Y1140 HydrophobicContact CB-CE2 4.04Å; K1138-Y1140 WeakPolarHBondContact CB-OH 3.45Å; K1138-Y1140 HydrophobicContact CD-CE1 4.44Å; K1138-V1150 HydrophobicContact CD-CG1 4.19Å; K1138-I1151 CarbonylContact C-O 3.59Å; K1138-I1151 WeakPolarHBondContact CA-O 3.42Å; K1138-E1152 HydrophobicContact CD-CG 4.21Å; K1138-E1152 WeakPolarHBondContact CE-OE1 3.32Å; K1138-E1152 HydrophobicContact CG-CG 4.09Å; K1138-E1152 IonicContact NZ-OE1 3.1Å; K1138-E1152 PolarHBondContact NZ-OE1 3.29Å; K1138-K1197 WeakPolarHBondContact CE-O 3.48Å; K1138-K1197 PolarHBondContact NZ-O 3.39Å
1139	V	93.7	Very high	88.5	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133	171.2	175.8	0	0	0	0	108.5	F1089 L1095 I1126 F1128 V1150 I1151 I1154	F1089-V1139 HydrophobicContact CD2-CG2 4.02Å; F1089-V1139 HydrophobicContact CE2-CG2 3.96Å; L1095-V1139 HydrophobicContact CD1-CB 4.5Å; L1095-V1139 HydrophobicContact CD1-CG1 3.87Å; L1095-V1139 HydrophobicContact CD1-CG2 3.92Å; I1126-V1139 HydrophobicContact CG2-CG1 3.75Å; F1128-V1139 HydrophobicContact CB-CG2 3.85Å; V1139-V1150 CarbonylContact O-C 3.48Å; V1139-V1150 WeakPolarHBondContact O-CA 3.49Å; V1139-I1151 HydrophobicContact CB-CB 4.44Å; V1139-I1151 PolarHBondContact N-O 3.22Å; V1139-I1151 PolarHBondContact O-N 3.09Å; V1139-I1154 HydrophobicContact CB-CD1 3.62Å; V1139-I1154 HydrophobicContact CB-CG1 4.29Å; V1139-I1154 HydrophobicContact CG1-CD1 4.15Å; V1139-I1154 HydrophobicContact CG2-CB 4.13Å; V1139-I1154 HydrophobicContact CG2-CD1 3.47Å; V1139-I1154 VanDerWaalsContact CG2-CD1 3.47Å; V1139-I1154 HydrophobicContact CG2-CG1 3.88Å
1140	Y	95.7	Very high	88.5	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117.8	-179.5	-48.1	-82.3	0	0	0	108	I1126 T1127 A1129 K1138 V1149 V1150 L1183 A1196 M1199	I1126-Y1140 WeakPolarHBondContact CA-O 3.39Å; T1127-Y1140 HydrophobicContact CG2-CD2 4.01Å; T1127-Y1140 PolarHBondContact N-O 3.41Å; T1127-Y1140 PolarHBondContact O-N 3.2Å; A1129-Y1140 HydrophobicContact CB-CE2 3.81Å; K1138-Y1140 HydrophobicContact CB-CE1 4.07Å; K1138-Y1140 HydrophobicContact CB-CE2 4.04Å; K1138-Y1140 WeakPolarHBondContact CB-OH 3.45Å; K1138-Y1140 HydrophobicContact CD-CE1 4.44Å; Y1140-V1149 CarbonylContact C-O 3.54Å; Y1140-V1149 WeakPolarHBondContact CA-O 3.38Å; Y1140-V1150 HydrophobicContact CD1-CG1 4.04Å; Y1140-V1150 HydrophobicContact CD1-CG2 4.06Å; Y1140-V1150 HydrophobicContact CE1-CG1 3.89Å; Y1140-V1150 HydrophobicContact CE1-CG2 4.45Å; Y1140-L1183 HydrophobicContact CD1-CD1 4.34Å; Y1140-L1183 HydrophobicContact CD1-CD2 3.47Å; Y1140-L1183 VanDerWaalsContact CD1-CD2 3.47Å; Y1140-L1183 HydrophobicContact CD2-CD1 3.78Å; Y1140-L1183 HydrophobicContact CD2-CD2 4.42Å; Y1140-L1183 HydrophobicContact CE1-CD2 3.91Å; Y1140-L1183 HydrophobicContact CE2-CD1 4.26Å; Y1140-L1183 HydrophobicContact CG-CD1 3.81Å; Y1140-L1183 HydrophobicContact CG-CD2 3.76Å; Y1140-L1183 HydrophobicContact CG-CG 4.46Å; Y1140-A1196 VanDerWaalsContact OH-C 3.31Å; Y1140-A1196 PolarHBondContact OH-O 3.38Å; Y1140-M1199 HydrophobicContact CD1-SD 4.14Å; Y1140-M1199 HydrophobicContact CE1-CE 4.49Å; Y1140-M1199 HydrophobicContact CE1-SD 3.52Å; Y1140-M1199 VanDerWaalsContact CE1-SD 3.52Å
1141	A	95.5	Very high	88.6	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.5	-179.7	0	0	0	0	0	109.3	V1123 D1125 I1126 V1149	V1123-A1141 HydrophobicContact CG1-CB 3.81Å; D1125-A1141 WeakPolarHBondContact O-CA 3.41Å; I1126-A1141 HydrophobicContact CG1-CB 4.09Å; A1141-V1149 HydrophobicContact CB-CB 4.21Å; A1141-V1149 PolarHBondContact N-O 3.39Å; A1141-V1149 PolarHBondContact O-N 3.47Å
1142	G	95.3	Very high	88.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	137.7	173.1	0	0	0	0	0	110.3	S1124 D1125	S1124-G1142 PolarHBondContact N-O 3.44Å; S1124-G1142 VanDerWaalsContact OG-C 3.28Å; S1124-G1142 PolarHBondContact OG-O 3.39Å; D1125-G1142 PolarHBondContact O-N 2.84Å
1143	L	96.2	Very high	89	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	159.5	179.7	-54.2	-169.6	0	0	0	112.7	I1119 H1120 D1121 S1122 V1123 N1145 G1146 E1147 V1149 Y1165 I1173	I1119-L1143 HydrophobicContact CG2-CD1 3.49Å; I1119-L1143 VanDerWaalsContact CG2-CD1 3.49Å; I1119-L1143 HydrophobicContact CG2-CD2 3.6Å; I1119-L1143 HydrophobicContact CG2-CG 4.19Å; H1120-L1143 HydrophobicContact CB-CD1 4.17Å; D1121-L1143 HydrophobicContact CB-CB 4.48Å; S1122-L1143 WeakPolarHBondContact O-CA 3.24Å; V1123-L1143 HydrophobicContact CB-CD2 4.31Å; V1123-L1143 HydrophobicContact CG1-CD2 4.44Å; V1123-L1143 HydrophobicContact CG2-CD2 3.87Å; L1143-N1145 VanDerWaalsContact C-N 3.27Å; L1143-N1145 WeakPolarHBondContact CB-OD1 3.39Å; L1143-N1145 PolarHBondContact O-N 2.96Å; L1143-G1146 PolarHBondContact O-N 3.26Å; L1143-E1147 VanDerWaalsContact CB-O 3.3Å; L1143-E1147 WeakPolarHBondContact CB-O 3.2Å; L1143-E1147 HydrophobicContact CD1-CB 4.2Å; L1143-E1147 WeakPolarHBondContact CG-O 3.37Å; L1143-E1147 PolarHBondContact N-O 3.4Å; L1143-V1149 HydrophobicContact CD1-CG2 3.53Å; L1143-V1149 HydrophobicContact CD2-CG2 3.81Å; L1143-V1149 HydrophobicContact CG-CG2 3.69Å; L1143-Y1165 HydrophobicContact CD1-CE1 4.4Å; L1143-I1173 PolarHBondContact O-N 2.96Å
1144	T	92.1	Very high	89.5	Confident	48 Å²	48	28.4 Å²	28.4	29%	0.294	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-17.8	177.4	48.5	0	0	0	0	114.6	D1121 S1122 G1146 P1172	D1121-T1144 PolarHBondContact OD1-OG1 3.34Å; D1121-T1144 PolarHBondContact OD2-OG1 3.41Å; S1122-T1144 WeakPolarHBondContact CB-OG1 3.38Å; S1122-T1144 PolarHBondContact N-OG1 2.95Å; S1122-T1144 PolarHBondContact O-N 3.44Å; S1122-T1144 PolarHBondContact O-OG1 3.42Å; T1144-G1146 VanDerWaalsContact C-N 3.31Å; T1144-P1172 VanDerWaalsContact O-CA 3.28Å; T1144-P1172 WeakPolarHBondContact O-CA 3.25Å; T1144-P1172 WeakPolarHBondContact O-CB 3.35Å; T1144-P1172 WeakPolarHBondContact O-CG 3.39Å
1145	N	89.2	Confident	90.1	Very high	49 Å²	49	25.7 Å²	25.7	26%	0.262	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.7	173.9	66.7	-6.5	0	0	0	113.5	D1121 L1143 E1147	D1121-N1145 HydrophobicContact CB-CB 4.01Å; D1121-N1145 WeakPolarHBondContact OD2-CB 3.41Å; D1121-N1145 PolarHBondContact OD2-N 3.48Å; L1143-N1145 VanDerWaalsContact C-N 3.27Å; L1143-N1145 WeakPolarHBondContact CB-OD1 3.39Å; L1143-N1145 PolarHBondContact O-N 2.96Å; N1145-E1147 VanDerWaalsContact ND2-CD 3.32Å; N1145-E1147 PolarHBondContact ND2-OE2 3.07Å; N1145-E1147 WeakPolarHBondContact OD1-CB 3.36Å; N1145-E1147 PolarHBondContact OD1-N 2.85Å
1146	G	88.6	Confident	90.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	92.3	8.2	-178.9	0	0	0	0	0	115.4	L1143 T1144 I1168 S1169 I1171	L1143-G1146 PolarHBondContact O-N 3.26Å; T1144-G1146 VanDerWaalsContact C-N 3.31Å; G1146-I1168 PolarHBondContact O-N 3.37Å; G1146-I1168 VanDerWaalsContact O-N 3.14Å; G1146-S1169 CarbonylContact C-O 3.56Å; G1146-S1169 VanDerWaalsContact CA-O 3.29Å; G1146-S1169 WeakPolarHBondContact CA-O 3.43Å; G1146-S1169 PolarHBondContact O-N 3.27Å; G1146-S1169 VanDerWaalsContact O-N 3.13Å; G1146-I1171 WeakPolarHBondContact CA-O 3.28Å
1147	E	94.3	Very high	90.3	Very high	30 Å²	30	27.9 Å²	27.9	14%	0.14	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	144	172.4	-59.5	-178.5	143.8	0	0	111.9	H1120 L1143 N1145 I1166 T1167 I1173	H1120-E1147 IonicContact CE1-OE2 3.06Å; H1120-E1147 IonicContact CG-OE2 2.72Å; H1120-E1147 IonicContact ND1-OE1 3.12Å; H1120-E1147 IonicContact ND1-OE2 2.78Å; H1120-E1147 PolarHBondContact ND1-OE2 2.86Å; L1143-E1147 VanDerWaalsContact CB-O 3.3Å; L1143-E1147 WeakPolarHBondContact CB-O 3.2Å; L1143-E1147 HydrophobicContact CD1-CB 4.2Å; L1143-E1147 WeakPolarHBondContact CG-O 3.37Å; L1143-E1147 PolarHBondContact N-O 3.4Å; N1145-E1147 VanDerWaalsContact ND2-CD 3.32Å; N1145-E1147 PolarHBondContact ND2-OE2 3.07Å; N1145-E1147 WeakPolarHBondContact OD1-CB 3.36Å; N1145-E1147 PolarHBondContact OD1-N 2.85Å; E1147-I1166 WeakPolarHBondContact CA-O 3.34Å; E1147-T1167 HydrophobicContact CG-CG2 4.21Å; E1147-T1167 PolarHBondContact OE1-OG1 3.48Å; E1147-I1173 VanDerWaalsContact C-CD1 3.46Å; E1147-I1173 VanDerWaalsContact O-CD1 3.24Å; E1147-I1173 WeakPolarHBondContact O-CD1 3.16Å
1148	L	93.9	Very high	90	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120.3	169.4	179.3	74.3	0	0	0	108.8	V1150 I1166 I1168 I1173 V1176 L1183 M1199	L1148-V1150 HydrophobicContact CD2-CG2 4.3Å; L1148-V1150 HydrophobicContact CG-CG2 4.42Å; L1148-I1166 HydrophobicContact CB-CB 4.46Å; L1148-I1166 PolarHBondContact N-O 3.35Å; L1148-I1166 PolarHBondContact O-N 3.28Å; L1148-I1168 HydrophobicContact CB-CD1 3.56Å; L1148-I1168 HydrophobicContact CB-CG1 4.04Å; L1148-I1168 HydrophobicContact CD2-CD1 4.02Å; L1148-I1168 HydrophobicContact CG-CD1 4.31Å; L1148-I1173 HydrophobicContact CB-CD1 3.91Å; L1148-I1173 HydrophobicContact CD1-CD1 4.47Å; L1148-V1176 HydrophobicContact CD1-CG1 4.38Å; L1148-V1176 HydrophobicContact CD1-CG2 4.25Å; L1148-L1183 HydrophobicContact CD2-CD2 3.69Å; L1148-M1199 HydrophobicContact CD2-CE 3.56Å
1149	V	93.4	Very high	89.4	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.5	172.9	-170.8	0	0	0	0	108.9	I1119 Y1140 A1141 L1143 I1151 I1163 Y1164 Y1165	I1119-V1149 HydrophobicContact CG2-CG2 3.83Å; Y1140-V1149 CarbonylContact C-O 3.54Å; Y1140-V1149 WeakPolarHBondContact CA-O 3.38Å; A1141-V1149 HydrophobicContact CB-CB 4.21Å; A1141-V1149 PolarHBondContact N-O 3.39Å; A1141-V1149 PolarHBondContact O-N 3.47Å; L1143-V1149 HydrophobicContact CD1-CG2 3.53Å; L1143-V1149 HydrophobicContact CD2-CG2 3.81Å; L1143-V1149 HydrophobicContact CG-CG2 3.69Å; V1149-I1151 HydrophobicContact CG1-CD1 4.27Å; V1149-I1151 HydrophobicContact CG1-CG1 3.84Å; V1149-I1163 HydrophobicContact CG1-CG2 3.56Å; V1149-Y1164 CarbonylContact C-O 3.56Å; V1149-Y1164 WeakPolarHBondContact CA-O 3.42Å; V1149-Y1165 HydrophobicContact CB-CE1 4.47Å; V1149-Y1165 HydrophobicContact CG1-CE1 4.21Å; V1149-Y1165 HydrophobicContact CG2-CD1 3.7Å; V1149-Y1165 HydrophobicContact CG2-CE1 3.52Å
1150	V	91.3	Very high	88	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.1	173.6	-171.8	0	0	0	0	107.8	K1138 V1139 Y1140 L1148 I1163 Y1164 I1166 M1199	K1138-V1150 HydrophobicContact CD-CG1 4.19Å; V1139-V1150 CarbonylContact O-C 3.48Å; V1139-V1150 WeakPolarHBondContact O-CA 3.49Å; Y1140-V1150 HydrophobicContact CD1-CG1 4.04Å; Y1140-V1150 HydrophobicContact CD1-CG2 4.06Å; Y1140-V1150 HydrophobicContact CE1-CG1 3.89Å; Y1140-V1150 HydrophobicContact CE1-CG2 4.45Å; L1148-V1150 HydrophobicContact CD2-CG2 4.3Å; L1148-V1150 HydrophobicContact CG-CG2 4.42Å; V1150-I1163 WeakPolarHBondContact O-CA 3.41Å; V1150-Y1164 PolarHBondContact N-O 2.86Å; V1150-Y1164 PolarHBondContact O-N 3.45Å; V1150-I1166 HydrophobicContact CG2-CD1 3.84Å; V1150-M1199 HydrophobicContact CG2-CE 3.85Å; V1150-M1199 HydrophobicContact CG2-CG 4.42Å; V1150-M1199 HydrophobicContact CG2-SD 4.29Å
1151	I	90.5	Very high	86.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	120.9	178.4	-49.9	-179.7	0	0	0	108.1	L1103 I1117 K1138 V1139 V1149 I1154 P1159 S1162 I1163	L1103-I1151 HydrophobicContact CD2-CD1 3.39Å; I1117-I1151 HydrophobicContact CD1-CD1 3.78Å; K1138-I1151 CarbonylContact C-O 3.59Å; K1138-I1151 WeakPolarHBondContact CA-O 3.42Å; V1139-I1151 HydrophobicContact CB-CB 4.44Å; V1139-I1151 PolarHBondContact N-O 3.22Å; V1139-I1151 PolarHBondContact O-N 3.09Å; V1149-I1151 HydrophobicContact CG1-CD1 4.27Å; V1149-I1151 HydrophobicContact CG1-CG1 3.84Å; I1151-I1154 HydrophobicContact CB-CD1 3.84Å; I1151-I1154 HydrophobicContact CB-CG1 4.02Å; I1151-I1154 HydrophobicContact CD1-CD1 4.15Å; I1151-I1154 HydrophobicContact CG2-CD1 3.63Å; I1151-I1154 HydrophobicContact CG2-CG1 3.47Å; I1151-I1154 VanDerWaalsContact CG2-CG1 3.47Å; I1151-P1159 HydrophobicContact CG2-CB 3.6Å; I1151-P1159 HydrophobicContact CG2-CG 3.72Å; I1151-S1162 WeakPolarHBondContact CA-O 3.38Å; I1151-I1163 HydrophobicContact CG1-CG1 4.17Å; I1151-I1163 HydrophobicContact CG1-CG2 4.28Å; I1151-I1163 HydrophobicContact CG2-CG1 4.15Å
1152	E	86.7	Confident	85.6	Confident	50 Å²	50	48 Å²	48	23%	0.234	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	143.2	-179.4	-51.7	-167.3	155.9	0	0	111.2	K1138 I1154 S1162 Y1164	K1138-E1152 HydrophobicContact CD-CG 4.21Å; K1138-E1152 WeakPolarHBondContact CE-OE1 3.32Å; K1138-E1152 HydrophobicContact CG-CG 4.09Å; K1138-E1152 IonicContact NZ-OE1 3.1Å; K1138-E1152 PolarHBondContact NZ-OE1 3.29Å; E1152-I1154 PolarHBondContact O-N 3.29Å; E1152-S1162 PolarHBondContact N-O 2.7Å; E1152-S1162 WeakPolarHBondContact O-CB 3.24Å; E1152-Y1164 HydrophobicContact CG-CD2 4.26Å; E1152-Y1164 HydrophobicContact CG-CE2 3.85Å
1153	N	84.8	Confident	85.2	Confident	82 Å²	82	50 Å²	50	44%	0.439	25%	0.249	S	C	.	.	S	Bend	trans	56.8	47.7	173.2	-56.6	-40.5	0	0	0	114.4	T1136 N1137	T1136-N1153 WeakPolarHBondContact CA-OD1 3.49Å; T1136-N1153 VanDerWaalsContact CB-OD1 3.26Å; T1136-N1153 WeakPolarHBondContact CB-OD1 3.25Å; T1136-N1153 WeakPolarHBondContact CG2-OD1 3.49Å; N1137-N1153 PolarHBondContact N-OD1 3.11Å; N1137-N1153 PolarHBondContact O-N 3.05Å; N1137-N1153 WeakPolarHBondContact OD1-CA 3.4Å; N1137-N1153 PolarHBondContact OD1-N 3.02Å
1154	I	85.4	Confident	84.5	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.026	27%	0.27	C	S	.	.			trans	-60.9	138.5	170.8	-68.8	-154.8	0	0	0	110.9	F1089 L1095 W1115 N1137 V1139 I1151 E1152	F1089-I1154 HydrophobicContact CD1-CG2 4.32Å; F1089-I1154 HydrophobicContact CE1-CG2 4.06Å; F1089-I1154 HydrophobicContact CE2-CB 4.32Å; F1089-I1154 HydrophobicContact CE2-CG2 4.35Å; F1089-I1154 HydrophobicContact CZ-CB 4.1Å; F1089-I1154 HydrophobicContact CZ-CG2 4.06Å; F1089-I1154 WeakPolarHBondContact CZ-O 3.4Å; L1095-I1154 HydrophobicContact CD1-CD1 4.31Å; L1095-I1154 HydrophobicContact CD2-CG2 4.42Å; W1115-I1154 HydrophobicContact CH2-CD1 4.09Å; W1115-I1154 HydrophobicContact CH2-CG2 4.48Å; W1115-I1154 HydrophobicContact CZ2-CD1 4.38Å; W1115-I1154 HydrophobicContact CZ2-CG2 3.88Å; N1137-I1154 PolarHBondContact ND2-O 3.31Å; N1137-I1154 PolarHBondContact OD1-N 2.97Å; V1139-I1154 HydrophobicContact CB-CD1 3.62Å; V1139-I1154 HydrophobicContact CB-CG1 4.29Å; V1139-I1154 HydrophobicContact CG1-CD1 4.15Å; V1139-I1154 HydrophobicContact CG2-CB 4.13Å; V1139-I1154 HydrophobicContact CG2-CD1 3.47Å; V1139-I1154 VanDerWaalsContact CG2-CD1 3.47Å; V1139-I1154 HydrophobicContact CG2-CG1 3.88Å; I1151-I1154 HydrophobicContact CB-CD1 3.84Å; I1151-I1154 HydrophobicContact CB-CG1 4.02Å; I1151-I1154 HydrophobicContact CD1-CD1 4.15Å; I1151-I1154 HydrophobicContact CG2-CD1 3.63Å; I1151-I1154 HydrophobicContact CG2-CG1 3.47Å; I1151-I1154 VanDerWaalsContact CG2-CG1 3.47Å; E1152-I1154 PolarHBondContact O-N 3.29Å
1155	G	84.2	Confident	84.4	Confident	21 Å²	21	56.7 Å²	56.7	22%	0.216	27%	0.27	C	S	.	.	S	Bend	trans	-161.5	-147.9	173.9	0	0	0	0	0	111.8	W1115 E1157	W1115-G1155 PolarHBondContact NE1-O 3.38Å; G1155-E1157 VanDerWaalsContact C-N 3.28Å
1156	F	84	Confident	84	Confident	87 Å²	87	56.8 Å²	56.8	38%	0.382	27%	0.27	S	S	.	.	S	Bend	trans	-73	-22.2	174.8	-69.8	-81.3	0	0	0	113.4	E1092 I1093 I1114	E1092-F1156 HydrophobicContact CG-CE1 4.27Å; E1092-F1156 HydrophobicContact CG-CZ 4.14Å; E1092-F1156 VanDerWaalsContact OE1-CE1 3.29Å; E1092-F1156 WeakPolarHBondContact OE1-CE1 3.42Å; E1092-F1156 WeakPolarHBondContact OE1-CZ 3.41Å; E1092-F1156 WeakPolarHBondContact OE2-CZ 3.3Å; I1093-F1156 HydrophobicContact CD1-CD1 4.29Å; I1093-F1156 HydrophobicContact CD1-CD2 4.24Å; I1093-F1156 HydrophobicContact CD1-CE1 4.17Å; I1093-F1156 HydrophobicContact CD1-CE2 4.11Å; I1093-F1156 HydrophobicContact CD1-CG 4.33Å; I1093-F1156 HydrophobicContact CD1-CZ 4.06Å; I1093-F1156 HydrophobicContact CG1-CE1 4.16Å; I1093-F1156 HydrophobicContact CG1-CZ 4.2Å; I1114-F1156 HydrophobicContact CD1-CD1 4.05Å; I1114-F1156 HydrophobicContact CD1-CE1 4.31Å; I1114-F1156 HydrophobicContact CG2-CB 4.47Å; I1114-F1156 HydrophobicContact CG2-CD1 4.4Å; I1114-F1156 WeakPolarHBondContact CG2-O 3.3Å
1157	E	82	Confident	84	Confident	170 Å²	170	60.6 Å²	60.6	79%	0.794	29%	0.293	S	S	*	.	S	Bend	trans	-85.7	146.3	176.7	-63.8	-175.4	178.9	0	0	110.3	W1115 G1155	W1115-E1157 PolarHBondContact NE1-O 2.89Å; G1155-E1157 VanDerWaalsContact C-N 3.28Å
1158	E	83	Confident	83.4	Confident	75 Å²	75	60.2 Å²	60.2	35%	0.35	29%	0.292	S	S	.	.			trans	-68.8	127	177.8	-178.1	-173.5	-162.2	0	0	110.2	W1115 I1117 R1160	W1115-E1158 HydrophobicContact CB-CB 3.97Å; W1115-E1158 HydrophobicContact CB-CG 4.22Å; W1115-E1158 HydrophobicContact CG-CB 4.19Å; I1117-E1158 HydrophobicContact CG2-CG 3.75Å; E1158-R1160 HydrophobicContact CG-CG 4.28Å; E1158-R1160 PolarHBondContact O-N 3.31Å; E1158-R1160 VanDerWaalsContact O-N 3.07Å; E1158-R1160 IonicContact OE2-CZ 2.59Å; E1158-R1160 IonicContact OE2-NE 2.91Å; E1158-R1160 PolarHBondContact OE2-NE 3.43Å; E1158-R1160 IonicContact OE2-NH2 2.66Å; E1158-R1160 PolarHBondContact OE2-NH2 3.46Å
1159	P	78.2	Confident	82.8	Confident	11 Å²	11	61.1 Å²	61.1	7%	0.071	30%	0.298	C	S	.	.			trans	-76	97.8	178.9	29.8	-32.5	0	0	0	110	W1115 I1117 I1151 I1163	W1115-P1159 HydrophobicContact CH2-CG 4.48Å; I1117-P1159 HydrophobicContact CD1-CG 4.22Å; I1151-P1159 HydrophobicContact CG2-CB 3.6Å; I1151-P1159 HydrophobicContact CG2-CG 3.72Å; P1159-I1163 VanDerWaalsContact O-CD1 3.31Å; P1159-I1163 WeakPolarHBondContact O-CD1 3.18Å
1160	R	63.7	Low	82.3	Confident	191 Å²	191	70.3 Å²	70.3	72%	0.721	34%	0.338	S	S	*	.	S	Bend	trans	-87.5	-40.9	-177.2	-68.5	-175.5	179.3	173.5	2	114.3	E1158	E1158-R1160 HydrophobicContact CG-CG 4.28Å; E1158-R1160 PolarHBondContact O-N 3.31Å; E1158-R1160 VanDerWaalsContact O-N 3.07Å; E1158-R1160 IonicContact OE2-CZ 2.59Å; E1158-R1160 IonicContact OE2-NE 2.91Å; E1158-R1160 PolarHBondContact OE2-NE 3.43Å; E1158-R1160 IonicContact OE2-NH2 2.66Å; E1158-R1160 PolarHBondContact OE2-NH2 3.46Å
1161	D	64.5	Low	82.1	Confident	151 Å²	151	74.1 Å²	74.1	81%	0.807	36%	0.358	S	S	*	.	S	Bend	trans	-118	15.1	-170.6	-60.8	-41.3	0	0	0	113.4
1162	S	76.7	Confident	82.1	Confident	37 Å²	37	77.1 Å²	77.1	26%	0.259	38%	0.377	S	S	.	.			trans	-125.6	25.9	-169.7	-48.1	0	0	0	0	113.1	I1151 E1152	I1151-S1162 WeakPolarHBondContact CA-O 3.38Å; E1152-S1162 PolarHBondContact N-O 2.7Å; E1152-S1162 WeakPolarHBondContact O-CB 3.24Å
1163	I	86.1	Confident	82.5	Confident	42 Å²	42	74.7 Å²	74.7	22%	0.215	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.8	-179.3	-55.3	171.3	0	0	0	109	I1117 V1149 V1150 I1151 P1159 Y1165	I1117-I1163 HydrophobicContact CD1-CD1 3.64Å; V1149-I1163 HydrophobicContact CG1-CG2 3.56Å; V1150-I1163 WeakPolarHBondContact O-CA 3.41Å; I1151-I1163 HydrophobicContact CG1-CG1 4.17Å; I1151-I1163 HydrophobicContact CG1-CG2 4.28Å; I1151-I1163 HydrophobicContact CG2-CG1 4.15Å; P1159-I1163 VanDerWaalsContact O-CD1 3.31Å; P1159-I1163 WeakPolarHBondContact O-CD1 3.18Å; I1163-Y1165 HydrophobicContact CG2-CD2 4.33Å; I1163-Y1165 HydrophobicContact CG2-CE2 3.61Å
1164	Y	82.8	Confident	82.9	Confident	115 Å²	115	72.2 Å²	72.2	45%	0.451	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138	178.5	-52.9	-84.9	0	0	0	110	V1149 V1150 E1152	V1149-Y1164 CarbonylContact C-O 3.56Å; V1149-Y1164 WeakPolarHBondContact CA-O 3.42Å; V1150-Y1164 PolarHBondContact N-O 2.86Å; V1150-Y1164 PolarHBondContact O-N 3.45Å; E1152-Y1164 HydrophobicContact CG-CD2 4.26Å; E1152-Y1164 HydrophobicContact CG-CE2 3.85Å
1165	Y	88.4	Confident	83.4	Confident	72 Å²	72	72 Å²	72	28%	0.282	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.9	176.4	-65.1	-95.2	0	0	0	109.2	I1119 H1120 L1143 V1149 I1163	I1119-Y1165 HydrophobicContact CG2-CE1 4.05Å; H1120-Y1165 HydrophobicContact CB-CD1 4.47Å; H1120-Y1165 HydrophobicContact CB-CE1 4.09Å; H1120-Y1165 AromaticContact CD2-CE1 3.58Å; H1120-Y1165 AromaticContact CD2-CZ 3.61Å; H1120-Y1165 AromaticContact CE1-CD1 3.53Å; H1120-Y1165 AromaticContact CE1-CD2 3.75Å; H1120-Y1165 AromaticContact CE1-CE1 3.76Å; H1120-Y1165 AromaticContact CE1-CE2 3.97Å; H1120-Y1165 AromaticContact CE1-CG 3.53Å; H1120-Y1165 AromaticContact CE1-CZ 3.99Å; H1120-Y1165 AromaticContact CG-CD1 3.76Å; H1120-Y1165 AromaticContact CG-CE1 3.48Å; H1120-Y1165 VanDerWaalsContact CG-CE1 3.48Å; H1120-Y1165 AromaticContact ND1-CD1 3.37Å; H1120-Y1165 WeakPolarHBondContact ND1-CD1 3.03Å; H1120-Y1165 AromaticContact ND1-CE1 3.6Å; H1120-Y1165 AromaticContact ND1-CG 3.83Å; H1120-Y1165 AromaticContact NE2-CD1 4Å; H1120-Y1165 AromaticContact NE2-CD2 3.9Å; H1120-Y1165 AromaticContact NE2-CE1 3.77Å; H1120-Y1165 AromaticContact NE2-CE2 3.66Å; H1120-Y1165 AromaticContact NE2-CZ 3.61Å; L1143-Y1165 HydrophobicContact CD1-CE1 4.4Å; V1149-Y1165 HydrophobicContact CB-CE1 4.47Å; V1149-Y1165 HydrophobicContact CG1-CE1 4.21Å; V1149-Y1165 HydrophobicContact CG2-CD1 3.7Å; V1149-Y1165 HydrophobicContact CG2-CE1 3.52Å; I1163-Y1165 HydrophobicContact CG2-CD2 4.33Å; I1163-Y1165 HydrophobicContact CG2-CE2 3.61Å
1166	I	81.6	Confident	84	Confident	51 Å²	51	71.3 Å²	71.3	26%	0.262	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	107.3	177.8	-58.2	173.1	0	0	0	107.5	E1147 L1148 V1150 I1168 M1199	E1147-I1166 WeakPolarHBondContact CA-O 3.34Å; L1148-I1166 HydrophobicContact CB-CB 4.46Å; L1148-I1166 PolarHBondContact N-O 3.35Å; L1148-I1166 PolarHBondContact O-N 3.28Å; V1150-I1166 HydrophobicContact CG2-CD1 3.84Å; I1166-I1168 HydrophobicContact CG2-CG1 4.37Å; I1166-I1168 PolarHBondContact O-N 2.9Å; I1166-I1168 VanDerWaalsContact O-N 3.1Å; I1166-M1199 HydrophobicContact CD1-CB 4.32Å; I1166-M1199 HydrophobicContact CD1-CE 3.55Å; I1166-M1199 HydrophobicContact CD1-CG 4.4Å
1167	T	88.9	Confident	84.5	Confident	80 Å²	80	68.3 Å²	68.3	49%	0.491	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	105.8	174.9	-45.1	0	0	0	0	109.5	E1147	E1147-T1167 HydrophobicContact CG-CG2 4.21Å; E1147-T1167 PolarHBondContact OE1-OG1 3.48Å
1168	I	82	Confident	85.1	Confident	22 Å²	22	62.2 Å²	62.2	11%	0.113	31%	0.306	C	S	.	.			trans	-85	-40.8	178.1	-62.3	-176.9	0	0	0	110	G1146 L1148 I1166 I1173 C1185 F1192 F1194	G1146-I1168 PolarHBondContact O-N 3.37Å; G1146-I1168 VanDerWaalsContact O-N 3.14Å; L1148-I1168 HydrophobicContact CB-CD1 3.56Å; L1148-I1168 HydrophobicContact CB-CG1 4.04Å; L1148-I1168 HydrophobicContact CD2-CD1 4.02Å; L1148-I1168 HydrophobicContact CG-CD1 4.31Å; I1166-I1168 HydrophobicContact CG2-CG1 4.37Å; I1166-I1168 PolarHBondContact O-N 2.9Å; I1166-I1168 VanDerWaalsContact O-N 3.1Å; I1168-I1173 HydrophobicContact CD1-CD1 3.87Å; I1168-I1173 HydrophobicContact CG1-CD1 4.44Å; I1168-C1185 HydrophobicContact CD1-CB 3.6Å; I1168-F1192 HydrophobicContact CG2-CB 3.66Å; I1168-F1192 HydrophobicContact CG2-CD1 3.73Å; I1168-F1192 HydrophobicContact CG2-CD2 3.2Å; I1168-F1192 HydrophobicContact CG2-CE1 4.14Å; I1168-F1192 HydrophobicContact CG2-CE2 3.67Å; I1168-F1192 HydrophobicContact CG2-CG 3.24Å; I1168-F1192 HydrophobicContact CG2-CZ 4.1Å; I1168-F1194 HydrophobicContact CD1-CE2 3.64Å; I1168-F1194 HydrophobicContact CD1-CZ 4.01Å; I1168-F1194 HydrophobicContact CG1-CE2 4.18Å; I1168-F1194 HydrophobicContact CG1-CZ 4.02Å
1169	S	79.8	Confident	85.4	Confident	19 Å²	19	58.7 Å²	58.7	13%	0.133	29%	0.29	C	S	.	.			trans	-160.5	-178.4	-175.9	69	0	0	0	0	111	G1146 I1171 S1187	G1146-S1169 CarbonylContact C-O 3.56Å; G1146-S1169 VanDerWaalsContact CA-O 3.29Å; G1146-S1169 WeakPolarHBondContact CA-O 3.43Å; G1146-S1169 PolarHBondContact O-N 3.27Å; G1146-S1169 VanDerWaalsContact O-N 3.13Å; S1169-I1171 PolarHBondContact OG-N 3.3Å; S1169-I1171 PolarHBondContact OG-O 3.48Å; S1169-S1187 WeakPolarHBondContact OG-CB 3.25Å; S1169-S1187 PolarHBondContact OG-OG 3.26Å
1170	F	84.3	Confident	85.7	Confident	193 Å²	193	64.9 Å²	64.9	85%	0.846	32%	0.315	S	S	*	.	S	Bend	trans	-103.5	9.7	170	-57.8	-75.1	0	0	0	113
1171	I	86	Confident	86.7	Confident	82 Å²	82	58.9 Å²	58.9	42%	0.421	30%	0.303	S	S	.	.	S	Bend	trans	-108.1	141.7	178.2	-60.9	172.3	0	0	0	106.9	G1146 S1169 I1173 S1187	G1146-I1171 WeakPolarHBondContact CA-O 3.28Å; S1169-I1171 PolarHBondContact OG-N 3.3Å; S1169-I1171 PolarHBondContact OG-O 3.48Å; I1171-I1173 PolarHBondContact O-N 3.36Å; I1171-S1187 WeakPolarHBondContact CB-OG 3.48Å; I1171-S1187 PolarHBondContact O-OG 2.8Å
1172	P	91.6	Very high	88	Confident	63 Å²	63	53.1 Å²	53.1	41%	0.409	27%	0.271	S	S	.	.			trans	-49.1	131.1	178.5	-26.6	28.4	0	0	0	112.9	T1144 S1174	T1144-P1172 VanDerWaalsContact O-CA 3.28Å; T1144-P1172 WeakPolarHBondContact O-CA 3.25Å; T1144-P1172 WeakPolarHBondContact O-CB 3.35Å; T1144-P1172 WeakPolarHBondContact O-CG 3.39Å; P1172-S1174 PolarHBondContact O-N 2.91Å
1173	I	94.5	Very high	88.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	114.9	167.9	-61.3	-177.1	0	0	0	106.6	S1124 L1143 E1147 L1148 I1168 I1171 V1176 A1186	S1124-I1173 WeakPolarHBondContact CB-O 3.29Å; S1124-I1173 PolarHBondContact OG-O 3.37Å; L1143-I1173 PolarHBondContact O-N 2.96Å; E1147-I1173 VanDerWaalsContact C-CD1 3.46Å; E1147-I1173 VanDerWaalsContact O-CD1 3.24Å; E1147-I1173 WeakPolarHBondContact O-CD1 3.16Å; L1148-I1173 HydrophobicContact CB-CD1 3.91Å; L1148-I1173 HydrophobicContact CD1-CD1 4.47Å; I1168-I1173 HydrophobicContact CD1-CD1 3.87Å; I1168-I1173 HydrophobicContact CG1-CD1 4.44Å; I1171-I1173 PolarHBondContact O-N 3.36Å; I1173-V1176 HydrophobicContact CG2-CG2 3.61Å; I1173-A1186 CarbonylContact C-O 3.59Å; I1173-A1186 WeakPolarHBondContact CA-O 3.43Å; I1173-A1186 WeakPolarHBondContact CG2-O 3.31Å
1174	S	94.1	Very high	89.4	Confident	30 Å²	30	49.4 Å²	49.4	21%	0.21	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	-28.7	-174.5	58.9	0	0	0	0	113.2	P1172 A1186 I1215	P1172-S1174 PolarHBondContact O-N 2.91Å; S1174-A1186 PolarHBondContact N-O 3.16Å; S1174-A1186 WeakPolarHBondContact OG-CB 3.31Å; S1174-I1215 WeakPolarHBondContact CB-O 3.4Å; S1174-I1215 PolarHBondContact OG-O 3.44Å
1175	S	95.1	Very high	90	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	142.9	178.3	-168.3	0	0	0	0	111.7	D1125 A1186 I1218	D1125-S1175 WeakPolarHBondContact OD2-CA 3.39Å; D1125-S1175 PolarHBondContact OD2-OG 3.29Å; D1125-S1175 VanDerWaalsContact OD2-OG 3.04Å; S1175-A1186 PolarHBondContact O-N 2.93Å; S1175-I1218 PolarHBondContact OG-N 3.45Å
1176	V	96	Very high	90.4	Very high	6 Å²	6	40.5 Å²	40.5	4%	0.036	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.6	175.4	-171.3	0	0	0	0	108.7	D1125 T1127 L1148 I1173 L1183 W1184	D1125-V1176 HydrophobicContact CB-CG2 4.46Å; D1125-V1176 PolarHBondContact OD2-N 3.1Å; T1127-V1176 HydrophobicContact CG2-CB 4.23Å; T1127-V1176 HydrophobicContact CG2-CG1 3.62Å; L1148-V1176 HydrophobicContact CD1-CG1 4.38Å; L1148-V1176 HydrophobicContact CD1-CG2 4.25Å; I1173-V1176 HydrophobicContact CG2-CG2 3.61Å; V1176-L1183 HydrophobicContact CG1-CD1 3.62Å; V1176-L1183 HydrophobicContact CG1-CG 4.2Å; V1176-W1184 WeakPolarHBondContact CA-O 3.37Å
1177	L	95.6	Very high	90.9	Very high	24 Å²	24	38.3 Å²	38.3	13%	0.126	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.1	-177.9	174.6	69.7	0	0	0	110.8	W1184 I1218 L1220 V1225	L1177-W1184 HydrophobicContact CB-CB 4.28Å; L1177-W1184 PolarHBondContact N-O 3.09Å; L1177-W1184 PolarHBondContact O-N 3.07Å; L1177-I1218 HydrophobicContact CB-CB 4.32Å; L1177-I1218 HydrophobicContact CB-CG2 4.27Å; L1177-I1218 HydrophobicContact CD2-CB 4.26Å; L1177-I1218 HydrophobicContact CD2-CG2 3.46Å; L1177-I1218 VanDerWaalsContact CD2-CG2 3.46Å; L1177-L1220 HydrophobicContact CD1-CB 4.13Å; L1177-L1220 HydrophobicContact CD2-CB 4.14Å; L1177-V1225 HydrophobicContact CD2-CG1 4Å; L1177-V1225 HydrophobicContact CD2-CG2 4.48Å
1178	L	93.8	Very high	91	Very high	43 Å²	43	34.6 Å²	34.6	23%	0.225	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	114.2	166.7	-176.3	70	0	0	0	109.8	T1127 F1128 A1129 A1196	T1127-L1178 HydrophobicContact CG2-CB 4.49Å; F1128-L1178 WeakPolarHBondContact O-CD2 3.39Å; A1129-L1178 HydrophobicContact CB-CD1 4.4Å; A1129-L1178 HydrophobicContact CB-CD2 3.64Å; L1178-A1196 HydrophobicContact CD1-CB 3.43Å; L1178-A1196 VanDerWaalsContact CD1-CB 3.43Å
1179	A	89.2	Confident	91.3	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.008	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	108.9	176.2	0	0	0	0	0	110.3	S1181 Q1182 L1220	A1179-S1181 PolarHBondContact O-N 2.82Å; A1179-S1181 VanDerWaalsContact O-N 3.1Å; A1179-Q1182 PolarHBondContact N-O 3.44Å; A1179-Q1182 WeakPolarHBondContact O-CB 3.33Å; A1179-Q1182 PolarHBondContact O-N 3.44Å; A1179-L1220 HydrophobicContact CB-CD1 4.15Å; A1179-L1220 HydrophobicContact CB-CD2 4.24Å
1180	K	84.8	Confident	92	Very high	140 Å²	140	34.2 Å²	34.2	61%	0.609	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	-110.5	-172.6	-53	176.7	-174.4	174.6	0	110.5	D1241	K1180-D1241 IonicContact NZ-OD1 3.51Å; K1180-D1241 PolarHBondContact NZ-OD1 3.16Å; K1180-D1241 IonicContact NZ-OD2 3.43Å; K1180-D1241 PolarHBondContact NZ-OD2 3.21Å
1181	S	85.9	Confident	92.4	Very high	66 Å²	66	25.1 Å²	25.1	46%	0.462	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	8.5	176.1	52	0	0	0	0	113.4	A1179 H1195 A1196	A1179-S1181 PolarHBondContact O-N 2.82Å; A1179-S1181 VanDerWaalsContact O-N 3.1Å; S1181-H1195 PolarHBondContact O-CD2 2.93Å; S1181-A1196 PolarHBondContact O-N 2.88Å
1182	Q	92	Very high	92.8	Very high	30 Å²	30	22.4 Å²	22.4	14%	0.14	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.5	-178.8	-61.1	177.1	7.9	0	0	110.9	A1179 I1193 F1194 P1240	A1179-Q1182 PolarHBondContact N-O 3.44Å; A1179-Q1182 WeakPolarHBondContact O-CB 3.33Å; A1179-Q1182 PolarHBondContact O-N 3.44Å; Q1182-I1193 HydrophobicContact CB-CG2 3.94Å; Q1182-I1193 HydrophobicContact CG-CG2 4.26Å; Q1182-F1194 CarbonylContact C-O 3.43Å; Q1182-F1194 WeakPolarHBondContact CA-O 3.4Å; Q1182-P1240 PolarHBondContact NE2-O 2.99Å; Q1182-P1240 PolarHBondContact OE1-O 3.4Å
1183	L	94.5	Very high	92.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	114.4	171.6	-175.2	73.8	0	0	0	109.3	T1127 Y1140 L1148 V1176 I1193 F1194 A1196 M1199	T1127-L1183 HydrophobicContact CG2-CD1 3.96Å; Y1140-L1183 HydrophobicContact CD1-CD1 4.34Å; Y1140-L1183 HydrophobicContact CD1-CD2 3.47Å; Y1140-L1183 VanDerWaalsContact CD1-CD2 3.47Å; Y1140-L1183 HydrophobicContact CD2-CD1 3.78Å; Y1140-L1183 HydrophobicContact CD2-CD2 4.42Å; Y1140-L1183 HydrophobicContact CE1-CD2 3.91Å; Y1140-L1183 HydrophobicContact CE2-CD1 4.26Å; Y1140-L1183 HydrophobicContact CG-CD1 3.81Å; Y1140-L1183 HydrophobicContact CG-CD2 3.76Å; Y1140-L1183 HydrophobicContact CG-CG 4.46Å; L1148-L1183 HydrophobicContact CD2-CD2 3.69Å; V1176-L1183 HydrophobicContact CG1-CD1 3.62Å; V1176-L1183 HydrophobicContact CG1-CG 4.2Å; L1183-I1193 CarbonylContact O-C 3.58Å; L1183-I1193 VanDerWaalsContact O-CA 3.31Å; L1183-I1193 WeakPolarHBondContact O-CA 2.89Å; L1183-F1194 HydrophobicContact CB-CB 4.4Å; L1183-F1194 PolarHBondContact N-O 2.83Å; L1183-F1194 PolarHBondContact O-N 3.25Å; L1183-A1196 HydrophobicContact CB-CB 4.42Å; L1183-M1199 HydrophobicContact CD2-CE 3.91Å; L1183-M1199 HydrophobicContact CD2-SD 4.14Å
1184	W	96.7	Very high	92.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	116.2	-178.7	-69.6	51.6	0	0	0	109.4	V1176 L1177 I1191 I1193 I1205 V1225 P1240 L1243	V1176-W1184 WeakPolarHBondContact CA-O 3.37Å; L1177-W1184 HydrophobicContact CB-CB 4.28Å; L1177-W1184 PolarHBondContact N-O 3.09Å; L1177-W1184 PolarHBondContact O-N 3.07Å; W1184-I1191 HydrophobicContact CB-CG2 4.13Å; W1184-I1191 HydrophobicContact CD2-CG2 4.26Å; W1184-I1191 HydrophobicContact CE3-CD1 4.31Å; W1184-I1191 HydrophobicContact CE3-CG2 3.69Å; W1184-I1191 HydrophobicContact CG-CG2 4.5Å; W1184-I1191 HydrophobicContact CZ3-CD1 4.46Å; W1184-I1191 HydrophobicContact CZ3-CG2 4.43Å; W1184-I1193 HydrophobicContact CD2-CD1 3.92Å; W1184-I1193 HydrophobicContact CD2-CG1 3.99Å; W1184-I1193 HydrophobicContact CE3-CD1 4.19Å; W1184-I1193 HydrophobicContact CE3-CG1 4.44Å; W1184-I1193 HydrophobicContact CG-CG1 4.15Å; W1184-I1193 HydrophobicContact CH2-CD1 3.95Å; W1184-I1193 HydrophobicContact CZ2-CD1 3.68Å; W1184-I1193 HydrophobicContact CZ3-CD1 4.19Å; W1184-I1205 HydrophobicContact CH2-CD1 4.25Å; W1184-I1205 HydrophobicContact CZ3-CD1 4.31Å; W1184-V1225 HydrophobicContact CE3-CG1 4.17Å; W1184-V1225 HydrophobicContact CH2-CG2 4.36Å; W1184-V1225 HydrophobicContact CZ2-CG2 4.37Å; W1184-V1225 HydrophobicContact CZ3-CB 4.45Å; W1184-V1225 HydrophobicContact CZ3-CG1 4.13Å; W1184-P1240 HydrophobicContact CZ2-CB 4.27Å; W1184-L1243 HydrophobicContact CH2-CD2 3.47Å; W1184-L1243 VanDerWaalsContact CH2-CD2 3.47Å; W1184-L1243 HydrophobicContact CZ2-CD2 3.28Å
1185	C	95.7	Very high	92.1	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.007	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	109.1	-179.6	-58.2	0	0	0	0	109.8	I1168 I1191 F1192	I1168-C1185 HydrophobicContact CD1-CB 3.6Å; C1185-I1191 WeakPolarHBondContact O-CA 3.23Å; C1185-F1192 PolarHBondContact N-O 3.15Å; C1185-F1192 PolarHBondContact O-N 2.95Å
1186	A	95.8	Very high	91.7	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	127.1	174.3	0	0	0	0	0	111.1	I1173 S1174 S1175 S1190 I1215 I1218	I1173-A1186 CarbonylContact C-O 3.59Å; I1173-A1186 WeakPolarHBondContact CA-O 3.43Å; I1173-A1186 WeakPolarHBondContact CG2-O 3.31Å; S1174-A1186 PolarHBondContact N-O 3.16Å; S1174-A1186 WeakPolarHBondContact OG-CB 3.31Å; S1175-A1186 PolarHBondContact O-N 2.93Å; A1186-S1190 WeakPolarHBondContact CA-O 3.08Å; A1186-I1215 HydrophobicContact CB-CB 3.88Å; A1186-I1215 HydrophobicContact CB-CD1 3.94Å; A1186-I1215 HydrophobicContact CB-CG2 3.67Å; A1186-I1218 HydrophobicContact CB-CD1 3.61Å; A1186-I1218 HydrophobicContact CB-CG1 4.21Å
1187	S	92.2	Very high	90.9	Very high	4 Å²	4	25.1 Å²	25.1	3%	0.028	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	118.8	168.4	174.3	0	0	0	0	110.2	S1169 I1171 S1189 S1190	S1169-S1187 WeakPolarHBondContact OG-CB 3.25Å; S1169-S1187 PolarHBondContact OG-OG 3.26Å; I1171-S1187 WeakPolarHBondContact CB-OG 3.48Å; I1171-S1187 PolarHBondContact O-OG 2.8Å; S1187-S1189 PolarHBondContact O-N 3.21Å; S1187-S1190 PolarHBondContact N-O 3.19Å; S1187-S1190 PolarHBondContact O-N 3.39Å; S1187-S1190 VanDerWaalsContact O-O 3.07Å
1188	G	91.2	Very high	90	Very high	2 Å²	2	27.3 Å²	27.3	2%	0.021	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	-126.8	-170.8	0	0	0	0	0	111.5	D1213 I1215	G1188-D1213 CarbonylContact C-O 3.57Å; G1188-D1213 VanDerWaalsContact C-O 3.26Å; G1188-I1215 WeakPolarHBondContact O-CG1 3.31Å; G1188-I1215 PolarHBondContact O-N 2.67Å
1189	S	89.2	Confident	89.4	Confident	17 Å²	17	26.8 Å²	26.8	12%	0.119	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	1.9	175.4	57.2	0	0	0	0	113.6	S1187 S1206 I1207 D1213	S1187-S1189 PolarHBondContact O-N 3.21Å; S1189-S1206 PolarHBondContact O-OG 3.17Å; S1189-I1207 VanDerWaalsContact O-CG1 3.3Å; S1189-I1207 WeakPolarHBondContact O-CG1 3.39Å; S1189-I1207 PolarHBondContact O-N 3.22Å; S1189-D1213 WeakPolarHBondContact CA-O 3.36Å; S1189-D1213 VanDerWaalsContact CB-O 3.31Å; S1189-D1213 WeakPolarHBondContact CB-O 3.45Å; S1189-D1213 PolarHBondContact N-O 3.23Å; S1189-D1213 VanDerWaalsContact N-O 3.07Å
1190	S	93.2	Very high	88.2	Confident	17 Å²	17	31.5 Å²	31.5	12%	0.119	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	150	-177.1	-72.7	0	0	0	0	112.3	A1186 S1187 Q1204 I1205	A1186-S1190 WeakPolarHBondContact CA-O 3.08Å; S1187-S1190 PolarHBondContact N-O 3.19Å; S1187-S1190 PolarHBondContact O-N 3.39Å; S1187-S1190 VanDerWaalsContact O-O 3.07Å; S1190-Q1204 PolarHBondContact OG-NE2 3.1Å; S1190-I1205 CarbonylContact C-O 3.52Å; S1190-I1205 WeakPolarHBondContact CA-O 3.38Å
1191	I	94.2	Very high	88	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.2	173.5	-58.7	176.8	0	0	0	107.8	W1184 C1185 I1193 Q1204 I1205 I1207 I1215 I1218 I1227	W1184-I1191 HydrophobicContact CB-CG2 4.13Å; W1184-I1191 HydrophobicContact CD2-CG2 4.26Å; W1184-I1191 HydrophobicContact CE3-CD1 4.31Å; W1184-I1191 HydrophobicContact CE3-CG2 3.69Å; W1184-I1191 HydrophobicContact CG-CG2 4.5Å; W1184-I1191 HydrophobicContact CZ3-CD1 4.46Å; W1184-I1191 HydrophobicContact CZ3-CG2 4.43Å; C1185-I1191 WeakPolarHBondContact O-CA 3.23Å; I1191-I1193 HydrophobicContact CG2-CG1 4.07Å; I1191-Q1204 CarbonylContact O-C 3.54Å; I1191-Q1204 VanDerWaalsContact O-CA 3.26Å; I1191-Q1204 WeakPolarHBondContact O-CA 3.46Å; I1191-I1205 PolarHBondContact N-O 2.86Å; I1191-I1205 PolarHBondContact O-N 2.65Å; I1191-I1207 HydrophobicContact CD1-CG2 4.13Å; I1191-I1215 HydrophobicContact CD1-CD1 3.89Å; I1191-I1215 HydrophobicContact CG1-CD1 3.4Å; I1191-I1215 VanDerWaalsContact CG1-CD1 3.4Å; I1191-I1218 HydrophobicContact CD1-CD1 3.63Å; I1191-I1218 HydrophobicContact CD1-CG1 4.49Å; I1191-I1218 HydrophobicContact CG1-CD1 3.95Å; I1191-I1218 HydrophobicContact CG2-CD1 4.24Å; I1191-I1227 HydrophobicContact CD1-CD1 3.5Å; I1191-I1227 VanDerWaalsContact CD1-CD1 3.5Å; I1191-I1227 HydrophobicContact CD1-CG1 4.49Å
1192	F	93.8	Very high	87.6	Confident	26 Å²	26	34.2 Å²	34.2	11%	0.114	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124	176.7	-60.2	-97.4	0	0	0	108.6	I1168 C1185 F1194 Y1201 Q1204	I1168-F1192 HydrophobicContact CG2-CB 3.66Å; I1168-F1192 HydrophobicContact CG2-CD1 3.73Å; I1168-F1192 HydrophobicContact CG2-CD2 3.2Å; I1168-F1192 HydrophobicContact CG2-CE1 4.14Å; I1168-F1192 HydrophobicContact CG2-CE2 3.67Å; I1168-F1192 HydrophobicContact CG2-CG 3.24Å; I1168-F1192 HydrophobicContact CG2-CZ 4.1Å; C1185-F1192 PolarHBondContact N-O 3.15Å; C1185-F1192 PolarHBondContact O-N 2.95Å; F1192-F1194 HydrophobicContact CB-CE2 3.65Å; F1192-F1194 HydrophobicContact CB-CZ 4.1Å; F1192-Y1201 HydrophobicContact CD1-CE2 4.25Å; F1192-Q1204 HydrophobicContact CD1-CB 4.12Å; F1192-Q1204 HydrophobicContact CD1-CG 3.99Å; F1192-Q1204 HydrophobicContact CE1-CB 4.26Å; F1192-Q1204 HydrophobicContact CE1-CG 3.8Å; F1192-Q1204 HydrophobicContact CZ-CG 4.16Å
1193	I	91.9	Very high	87.2	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.5	-174.6	-56.1	173.7	0	0	0	108.7	Q1182 L1183 W1184 I1191 Y1202 K1203 I1205 L1243	Q1182-I1193 HydrophobicContact CB-CG2 3.94Å; Q1182-I1193 HydrophobicContact CG-CG2 4.26Å; L1183-I1193 CarbonylContact O-C 3.58Å; L1183-I1193 VanDerWaalsContact O-CA 3.31Å; L1183-I1193 WeakPolarHBondContact O-CA 2.89Å; W1184-I1193 HydrophobicContact CD2-CD1 3.92Å; W1184-I1193 HydrophobicContact CD2-CG1 3.99Å; W1184-I1193 HydrophobicContact CE3-CD1 4.19Å; W1184-I1193 HydrophobicContact CE3-CG1 4.44Å; W1184-I1193 HydrophobicContact CG-CG1 4.15Å; W1184-I1193 HydrophobicContact CH2-CD1 3.95Å; W1184-I1193 HydrophobicContact CZ2-CD1 3.68Å; W1184-I1193 HydrophobicContact CZ3-CD1 4.19Å; I1191-I1193 HydrophobicContact CG2-CG1 4.07Å; I1193-Y1202 HydrophobicContact CB-CD1 4.43Å; I1193-Y1202 HydrophobicContact CG2-CD1 4.04Å; I1193-Y1202 WeakPolarHBondContact O-CA 3.42Å; I1193-Y1202 WeakPolarHBondContact O-CB 3.49Å; I1193-Y1202 PolarHBondContact O-N 3.35Å; I1193-K1203 WeakPolarHBondContact CB-O 3.02Å; I1193-K1203 PolarHBondContact N-O 3.39Å; I1193-K1203 PolarHBondContact O-N 3.05Å; I1193-I1205 HydrophobicContact CD1-CD1 3.61Å; I1193-I1205 HydrophobicContact CD1-CG1 4.2Å; I1193-L1243 HydrophobicContact CD1-CD1 3.73Å; I1193-L1243 HydrophobicContact CD1-CD2 3.57Å; I1193-L1243 HydrophobicContact CD1-CG 4.29Å
1194	F	89.8	Confident	86.9	Confident	14 Å²	14	41.8 Å²	41.8	6%	0.061	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	156	177.1	-56.7	-94.3	0	0	0	109.9	I1168 Q1182 L1183 F1192 A1196 M1199 D1200 Y1201	I1168-F1194 HydrophobicContact CD1-CE2 3.64Å; I1168-F1194 HydrophobicContact CD1-CZ 4.01Å; I1168-F1194 HydrophobicContact CG1-CE2 4.18Å; I1168-F1194 HydrophobicContact CG1-CZ 4.02Å; Q1182-F1194 CarbonylContact C-O 3.43Å; Q1182-F1194 WeakPolarHBondContact CA-O 3.4Å; L1183-F1194 HydrophobicContact CB-CB 4.4Å; L1183-F1194 PolarHBondContact N-O 2.83Å; L1183-F1194 PolarHBondContact O-N 3.25Å; F1192-F1194 HydrophobicContact CB-CE2 3.65Å; F1192-F1194 HydrophobicContact CB-CZ 4.1Å; F1194-A1196 PolarHBondContact O-N 2.95Å; F1194-M1199 HydrophobicContact CB-CE 4.23Å; F1194-M1199 HydrophobicContact CG-CE 4.26Å; F1194-D1200 CarbonylContact C-O 3.59Å; F1194-D1200 VanDerWaalsContact CA-O 3.26Å; F1194-D1200 WeakPolarHBondContact CA-O 3.48Å; F1194-Y1201 HydrophobicContact CD1-CD2 4.25Å; F1194-Y1201 AromaticContact CE1-CD2 3.75Å; F1194-Y1201 HydrophobicContact CE1-CD2 3.75Å; F1194-Y1201 HydrophobicContact CE1-CG 4.36Å; F1194-Y1201 HydrophobicContact CZ-CD2 4.06Å
1195	H	82.7	Confident	86.6	Confident	68 Å²	68	42.5 Å²	42.5	32%	0.315	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.6	165	-176.3	-108.1	0	0	0	109.2	S1181 K1197 T1198 M1199 D1200	S1181-H1195 PolarHBondContact O-CD2 2.93Å; H1195-K1197 VanDerWaalsContact C-N 3.34Å; H1195-K1197 PolarHBondContact O-N 3.49Å; H1195-T1198 PolarHBondContact ND1-N 3.16Å; H1195-T1198 PolarHBondContact ND1-OG1 2.98Å; H1195-M1199 WeakPolarHBondContact O-CA 3.43Å; H1195-M1199 PolarHBondContact O-N 3.48Å; H1195-D1200 HydrophobicContact CB-CB 4.35Å; H1195-D1200 PolarHBondContact N-O 3.4Å
1196	A	87.2	Confident	86.2	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.008	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-42.2	-168.9	0	0	0	0	0	112.8	F1131 Y1140 L1178 S1181 L1183 F1194	F1131-A1196 HydrophobicContact CZ-CB 4.29Å; Y1140-A1196 VanDerWaalsContact OH-C 3.31Å; Y1140-A1196 PolarHBondContact OH-O 3.38Å; L1178-A1196 HydrophobicContact CD1-CB 3.43Å; L1178-A1196 VanDerWaalsContact CD1-CB 3.43Å; S1181-A1196 PolarHBondContact O-N 2.88Å; L1183-A1196 HydrophobicContact CB-CB 4.42Å; F1194-A1196 PolarHBondContact O-N 2.95Å
1197	K	78.7	Confident	85.8	Confident	73 Å²	73	46 Å²	46	32%	0.317	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-51.7	-177.1	-169.4	178.3	178.3	176.9	0	112.6	F1131 D1134 K1138 H1195	F1131-K1197 HydrophobicContact CD1-CB 4Å; F1131-K1197 HydrophobicContact CD1-CD 4.13Å; F1131-K1197 HydrophobicContact CD1-CG 3.95Å; F1131-K1197 HydrophobicContact CE1-CB 3.5Å; F1131-K1197 VanDerWaalsContact CE1-CB 3.5Å; F1131-K1197 HydrophobicContact CE1-CD 4.48Å; F1131-K1197 HydrophobicContact CE1-CG 3.92Å; F1131-K1197 HydrophobicContact CG-CG 4.3Å; F1131-K1197 VanDerWaalsContact CZ-CA 3.49Å; F1131-K1197 HydrophobicContact CZ-CB 3.84Å; F1131-K1197 HydrophobicContact CZ-CG 4.25Å; D1134-K1197 IonicContact OD1-NZ 3.52Å; D1134-K1197 PolarHBondContact OD1-NZ 2.87Å; D1134-K1197 WeakPolarHBondContact OD2-CE 3.4Å; D1134-K1197 IonicContact OD2-NZ 3.53Å; D1134-K1197 PolarHBondContact OD2-NZ 3.47Å; K1138-K1197 WeakPolarHBondContact CE-O 3.48Å; K1138-K1197 PolarHBondContact NZ-O 3.39Å; H1195-K1197 VanDerWaalsContact C-N 3.34Å; H1195-K1197 PolarHBondContact O-N 3.49Å
1198	T	76.5	Confident	85.3	Confident	70 Å²	70	46.6 Å²	46.6	43%	0.429	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-12.7	-170.7	56.5	0	0	0	0	113.1	H1195 D1200	H1195-T1198 PolarHBondContact ND1-N 3.16Å; H1195-T1198 PolarHBondContact ND1-OG1 2.98Å; T1198-D1200 WeakPolarHBondContact CB-OD2 3.4Å; T1198-D1200 PolarHBondContact O-N 2.92Å; T1198-D1200 PolarHBondContact OG1-OD2 3.22Å
1199	M	82.1	Confident	84.4	Confident	31 Å²	31	53.8 Å²	53.8	15%	0.153	27%	0.265	C	S	.	.			trans	58.8	19.6	-170.8	-65.1	-55.1	-64.2	0	0	114.2	Y1140 L1148 V1150 I1166 L1183 F1194 H1195 Y1201	Y1140-M1199 HydrophobicContact CD1-SD 4.14Å; Y1140-M1199 HydrophobicContact CE1-CE 4.49Å; Y1140-M1199 HydrophobicContact CE1-SD 3.52Å; Y1140-M1199 VanDerWaalsContact CE1-SD 3.52Å; L1148-M1199 HydrophobicContact CD2-CE 3.56Å; V1150-M1199 HydrophobicContact CG2-CE 3.85Å; V1150-M1199 HydrophobicContact CG2-CG 4.42Å; V1150-M1199 HydrophobicContact CG2-SD 4.29Å; I1166-M1199 HydrophobicContact CD1-CB 4.32Å; I1166-M1199 HydrophobicContact CD1-CE 3.55Å; I1166-M1199 HydrophobicContact CD1-CG 4.4Å; L1183-M1199 HydrophobicContact CD2-CE 3.91Å; L1183-M1199 HydrophobicContact CD2-SD 4.14Å; F1194-M1199 HydrophobicContact CB-CE 4.23Å; F1194-M1199 HydrophobicContact CG-CE 4.26Å; H1195-M1199 WeakPolarHBondContact O-CA 3.43Å; H1195-M1199 PolarHBondContact O-N 3.48Å; M1199-Y1201 PolarHBondContact O-N 3.42Å
1200	D	64.9	Low	83.5	Confident	100 Å²	100	55.5 Å²	55.5	54%	0.535	27%	0.273	S	S	.	.			trans	-66.2	127.4	174.3	-63.9	-39.6	0	0	0	109.9	F1194 H1195 T1198 Y1202	F1194-D1200 CarbonylContact C-O 3.59Å; F1194-D1200 VanDerWaalsContact CA-O 3.26Å; F1194-D1200 WeakPolarHBondContact CA-O 3.48Å; H1195-D1200 HydrophobicContact CB-CB 4.35Å; H1195-D1200 PolarHBondContact N-O 3.4Å; T1198-D1200 WeakPolarHBondContact CB-OD2 3.4Å; T1198-D1200 PolarHBondContact O-N 2.92Å; T1198-D1200 PolarHBondContact OG1-OD2 3.22Å; D1200-Y1202 PolarHBondContact O-N 2.97Å
1201	Y	80.3	Confident	82.3	Confident	127 Å²	127	59.7 Å²	59.7	50%	0.498	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	127.3	175.1	173.5	-100.7	0	0	0	110.6	F1192 F1194 M1199 Q1204	F1192-Y1201 HydrophobicContact CD1-CE2 4.25Å; F1194-Y1201 HydrophobicContact CD1-CD2 4.25Å; F1194-Y1201 AromaticContact CE1-CD2 3.75Å; F1194-Y1201 HydrophobicContact CE1-CD2 3.75Å; F1194-Y1201 HydrophobicContact CE1-CG 4.36Å; F1194-Y1201 HydrophobicContact CZ-CD2 4.06Å; M1199-Y1201 PolarHBondContact O-N 3.42Å; Y1201-Q1204 WeakPolarHBondContact OH-CB 3.36Å; Y1201-Q1204 PolarHBondContact OH-N 3.29Å
1202	Y	76.7	Confident	81.3	Confident	137 Å²	137	65 Å²	65	54%	0.537	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-60.5	-179.7	-176	-114.5	0	0	0	111.8	I1193 D1200 L1243	I1193-Y1202 HydrophobicContact CB-CD1 4.43Å; I1193-Y1202 HydrophobicContact CG2-CD1 4.04Å; I1193-Y1202 WeakPolarHBondContact O-CA 3.42Å; I1193-Y1202 WeakPolarHBondContact O-CB 3.49Å; I1193-Y1202 PolarHBondContact O-N 3.35Å; D1200-Y1202 PolarHBondContact O-N 2.97Å; Y1202-L1243 HydrophobicContact CD1-CD1 3.86Å; Y1202-L1243 HydrophobicContact CE1-CD1 3.45Å; Y1202-L1243 VanDerWaalsContact CE1-CD1 3.45Å; Y1202-L1243 HydrophobicContact CE1-CG 4.33Å
1203	K	83.9	Confident	80.8	Confident	103 Å²	103	65 Å²	65	45%	0.448	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	154.7	-174.8	-163.8	171.3	-179.4	-177.1	0	112.3	I1193 L1243	I1193-K1203 WeakPolarHBondContact CB-O 3.02Å; I1193-K1203 PolarHBondContact N-O 3.39Å; I1193-K1203 PolarHBondContact O-N 3.05Å; K1203-L1243 HydrophobicContact CB-CD1 4.02Å; K1203-L1243 HydrophobicContact CD-CD1 3.68Å; K1203-L1243 HydrophobicContact CG-CD1 4.36Å
1204	Q	88.8	Confident	80.6	Confident	86 Å²	86	67.3 Å²	67.3	40%	0.402	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.8	165.6	-179.9	-175.8	-3.6	0	0	110	S1190 I1191 F1192 Y1201	S1190-Q1204 PolarHBondContact OG-NE2 3.1Å; I1191-Q1204 CarbonylContact O-C 3.54Å; I1191-Q1204 VanDerWaalsContact O-CA 3.26Å; I1191-Q1204 WeakPolarHBondContact O-CA 3.46Å; F1192-Q1204 HydrophobicContact CD1-CB 4.12Å; F1192-Q1204 HydrophobicContact CD1-CG 3.99Å; F1192-Q1204 HydrophobicContact CE1-CB 4.26Å; F1192-Q1204 HydrophobicContact CE1-CG 3.8Å; F1192-Q1204 HydrophobicContact CZ-CG 4.16Å; Y1201-Q1204 WeakPolarHBondContact OH-CB 3.36Å; Y1201-Q1204 PolarHBondContact OH-N 3.29Å
1205	I	89	Confident	80.8	Confident	14 Å²	14	66.7 Å²	66.7	7%	0.072	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132	175.3	-51.4	174.7	0	0	0	107.7	W1184 S1190 I1191 I1193 W1238 L1243	W1184-I1205 HydrophobicContact CH2-CD1 4.25Å; W1184-I1205 HydrophobicContact CZ3-CD1 4.31Å; S1190-I1205 CarbonylContact C-O 3.52Å; S1190-I1205 WeakPolarHBondContact CA-O 3.38Å; I1191-I1205 PolarHBondContact N-O 2.86Å; I1191-I1205 PolarHBondContact O-N 2.65Å; I1193-I1205 HydrophobicContact CD1-CD1 3.61Å; I1193-I1205 HydrophobicContact CD1-CG1 4.2Å; I1205-W1238 HydrophobicContact CD1-CE3 4.49Å; I1205-W1238 HydrophobicContact CD1-CZ3 4.38Å; I1205-W1238 HydrophobicContact CG2-CE3 4.3Å; I1205-W1238 HydrophobicContact CG2-CH2 3.44Å; I1205-W1238 VanDerWaalsContact CG2-CH2 3.44Å; I1205-W1238 HydrophobicContact CG2-CZ2 4.37Å; I1205-W1238 HydrophobicContact CG2-CZ3 3.41Å; I1205-W1238 VanDerWaalsContact CG2-CZ3 3.41Å; I1205-L1243 HydrophobicContact CD1-CB 3.75Å; I1205-L1243 HydrophobicContact CD1-CD1 4.08Å; I1205-L1243 HydrophobicContact CD1-CD2 3.97Å; I1205-L1243 HydrophobicContact CD1-CG 4.15Å
1206	S	89	Confident	81.2	Confident	59 Å²	59	65.5 Å²	65.5	41%	0.413	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	126.2	167.6	-158.4	0	0	0	0	109.3	S1189 S1208	S1189-S1206 PolarHBondContact O-OG 3.17Å; S1206-S1208 PolarHBondContact OG-O 3.08Å
1207	I	86.8	Confident	81.5	Confident	15 Å²	15	68.7 Å²	68.7	8%	0.077	35%	0.349	C	S	.	.	S	Bend	trans	-84.3	-17.3	177.6	63	156.5	0	0	0	112.4	S1189 I1191 I1215 I1227 V1229 W1238	S1189-I1207 VanDerWaalsContact O-CG1 3.3Å; S1189-I1207 WeakPolarHBondContact O-CG1 3.39Å; S1189-I1207 PolarHBondContact O-N 3.22Å; I1191-I1207 HydrophobicContact CD1-CG2 4.13Å; I1207-I1215 HydrophobicContact CD1-CD1 4.05Å; I1207-I1215 HydrophobicContact CD1-CG1 3.42Å; I1207-I1215 VanDerWaalsContact CD1-CG1 3.42Å; I1207-I1215 HydrophobicContact CG1-CD1 4.14Å; I1207-I1215 HydrophobicContact CG1-CG1 4Å; I1207-I1227 HydrophobicContact CD1-CG2 4.14Å; I1207-I1227 HydrophobicContact CG2-CD1 4.07Å; I1207-V1229 HydrophobicContact CD1-CG2 3.27Å; I1207-W1238 HydrophobicContact CB-CZ2 4.42Å; I1207-W1238 HydrophobicContact CG2-CZ2 3.82Å
1208	S	80.9	Confident	82.2	Confident	17 Å²	17	65.3 Å²	65.3	12%	0.119	34%	0.335	C	S	.	.			trans	-147.9	153.3	-179	-171.8	0	0	0	0	110.9	S1206 N1210 D1213	S1206-S1208 PolarHBondContact OG-O 3.08Å; S1208-N1210 PolarHBondContact OG-N 3.1Å; S1208-N1210 VanDerWaalsContact OG-N 3.15Å; S1208-D1213 WeakPolarHBondContact CB-OD2 3.46Å; S1208-D1213 PolarHBondContact OG-OD2 3.44Å
1209	N	72.7	Confident	83	Confident	153 Å²	153	63 Å²	63	82%	0.818	32%	0.321	S	S	*	.	S	Bend	trans	-89.7	-9.8	170.5	-66	-11.6	0	0	0	111.7	P1211	N1209-P1211 WeakPolarHBondContact O-CD 3.32Å
1210	N	71.4	Confident	83.5	Confident	53 Å²	53	65 Å²	65	28%	0.283	33%	0.332	S	S	.	.			trans	-79	118.8	176.7	-175	0.4	0	0	0	109.5	S1208 L1212 D1213	S1208-N1210 PolarHBondContact OG-N 3.1Å; S1208-N1210 VanDerWaalsContact OG-N 3.15Å; N1210-L1212 PolarHBondContact O-N 2.95Å; N1210-L1212 WeakPolarHBondContact OD1-CB 3.4Å; N1210-L1212 PolarHBondContact OD1-N 3.44Å; N1210-L1212 VanDerWaalsContact OD1-N 3.08Å; N1210-D1213 HydrophobicContact CB-CB 4.49Å; N1210-D1213 PolarHBondContact ND2-OD1 3.04Å; N1210-D1213 PolarHBondContact O-N 3.38Å
1211	P	66.4	Low	84.7	Confident	106 Å²	106	60.7 Å²	60.7	69%	0.688	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-14.5	179.2	29	-36.2	0	0	0	113.5	N1209	N1209-P1211 WeakPolarHBondContact O-CD 3.32Å
1212	L	74.2	Confident	85	Confident	111 Å²	111	60.3 Å²	60.3	58%	0.581	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-13.8	178.6	-60.7	175.2	0	0	0	113.3	N1210 V1214 Y1265	N1210-L1212 PolarHBondContact O-N 2.95Å; N1210-L1212 WeakPolarHBondContact OD1-CB 3.4Å; N1210-L1212 PolarHBondContact OD1-N 3.44Å; N1210-L1212 VanDerWaalsContact OD1-N 3.08Å; L1212-V1214 PolarHBondContact O-N 3.02Å; L1212-Y1265 HydrophobicContact CD1-CE1 3.54Å
1213	D	82.2	Confident	85.4	Confident	28 Å²	28	55 Å²	55	15%	0.15	30%	0.299	C	S	.	.			trans	-73.3	120.4	177	-70.9	-4.6	0	0	0	109.2	G1188 S1189 S1208 N1210 V1229	G1188-D1213 CarbonylContact C-O 3.57Å; G1188-D1213 VanDerWaalsContact C-O 3.26Å; S1189-D1213 WeakPolarHBondContact CA-O 3.36Å; S1189-D1213 VanDerWaalsContact CB-O 3.31Å; S1189-D1213 WeakPolarHBondContact CB-O 3.45Å; S1189-D1213 PolarHBondContact N-O 3.23Å; S1189-D1213 VanDerWaalsContact N-O 3.07Å; S1208-D1213 WeakPolarHBondContact CB-OD2 3.46Å; S1208-D1213 PolarHBondContact OG-OD2 3.44Å; N1210-D1213 HydrophobicContact CB-CB 4.49Å; N1210-D1213 PolarHBondContact ND2-OD1 3.04Å; N1210-D1213 PolarHBondContact O-N 3.38Å; D1213-V1229 HydrophobicContact CB-CG1 4.12Å
1214	V	88.5	Confident	85.7	Confident	48 Å²	48	50.3 Å²	50.3	29%	0.291	28%	0.28	S	S	.	.			trans	-114	121.2	176.7	-177.9	0	0	0	0	108.7	L1212 L1216 R1230	L1212-V1214 PolarHBondContact O-N 3.02Å; V1214-L1216 PolarHBondContact O-N 3.05Å; V1214-R1230 HydrophobicContact CB-CB 4.5Å; V1214-R1230 VanDerWaalsContact O-CB 3.29Å; V1214-R1230 WeakPolarHBondContact O-CB 3.28Å; V1214-R1230 PolarHBondContact O-N 3.02Å
1215	I	93.3	Very high	86	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	127.3	173	-66.4	160.5	0	0	0	108.3	S1174 A1186 G1188 I1191 I1207 I1218 I1227	S1174-I1215 WeakPolarHBondContact CB-O 3.4Å; S1174-I1215 PolarHBondContact OG-O 3.44Å; A1186-I1215 HydrophobicContact CB-CB 3.88Å; A1186-I1215 HydrophobicContact CB-CD1 3.94Å; A1186-I1215 HydrophobicContact CB-CG2 3.67Å; G1188-I1215 WeakPolarHBondContact O-CG1 3.31Å; G1188-I1215 PolarHBondContact O-N 2.67Å; I1191-I1215 HydrophobicContact CD1-CD1 3.89Å; I1191-I1215 HydrophobicContact CG1-CD1 3.4Å; I1191-I1215 VanDerWaalsContact CG1-CD1 3.4Å; I1207-I1215 HydrophobicContact CD1-CD1 4.05Å; I1207-I1215 HydrophobicContact CD1-CG1 3.42Å; I1207-I1215 VanDerWaalsContact CD1-CG1 3.42Å; I1207-I1215 HydrophobicContact CG1-CD1 4.14Å; I1207-I1215 HydrophobicContact CG1-CG1 4Å; I1215-I1218 HydrophobicContact CG2-CD1 4.33Å; I1215-I1218 HydrophobicContact CG2-CG1 3.77Å; I1215-I1227 HydrophobicContact CG1-CG2 4.39Å; I1215-I1227 HydrophobicContact CG2-CG2 4.02Å
1216	L	92.7	Very high	86.3	Confident	44 Å²	44	45.7 Å²	45.7	23%	0.23	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-50.9	-179.7	174.1	65.7	0	0	0	111.4	V1214 A1228 R1230 V1272 T1273	V1214-L1216 PolarHBondContact O-N 3.05Å; L1216-A1228 HydrophobicContact CB-CB 4.27Å; L1216-A1228 HydrophobicContact CD2-CB 4.35Å; L1216-A1228 PolarHBondContact N-O 2.84Å; L1216-R1230 HydrophobicContact CB-CB 4.12Å; L1216-R1230 HydrophobicContact CD1-CB 4.43Å; L1216-R1230 HydrophobicContact CD1-CG 4.43Å; L1216-V1272 VanDerWaalsContact CD2-O 3.27Å; L1216-V1272 WeakPolarHBondContact CD2-O 3.44Å; L1216-T1273 WeakPolarHBondContact CD2-O 3.45Å
1217	K	92	Very high	86.6	Confident	67 Å²	67	42.9 Å²	42.9	29%	0.291	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	145.1	-178.5	-163.7	71.3	-174.7	174.4	0	110.1	D1125 A1228	D1125-K1217 VanDerWaalsContact CG-NZ 3.28Å; D1125-K1217 IonicContact OD1-NZ 3.05Å; D1125-K1217 PolarHBondContact OD1-NZ 3Å; D1125-K1217 IonicContact OD2-NZ 3.03Å; D1125-K1217 PolarHBondContact OD2-NZ 3.44Å; K1217-A1228 PolarHBondContact O-N 3.27Å
1218	I	94.9	Very high	86.9	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.015	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127.5	170.1	-50.9	178	0	0	0	107.7	S1175 L1177 A1186 I1191 I1215 V1225 W1226 I1227	S1175-I1218 PolarHBondContact OG-N 3.45Å; L1177-I1218 HydrophobicContact CB-CB 4.32Å; L1177-I1218 HydrophobicContact CB-CG2 4.27Å; L1177-I1218 HydrophobicContact CD2-CB 4.26Å; L1177-I1218 HydrophobicContact CD2-CG2 3.46Å; L1177-I1218 VanDerWaalsContact CD2-CG2 3.46Å; A1186-I1218 HydrophobicContact CB-CD1 3.61Å; A1186-I1218 HydrophobicContact CB-CG1 4.21Å; I1191-I1218 HydrophobicContact CD1-CD1 3.63Å; I1191-I1218 HydrophobicContact CD1-CG1 4.49Å; I1191-I1218 HydrophobicContact CG1-CD1 3.95Å; I1191-I1218 HydrophobicContact CG2-CD1 4.24Å; I1215-I1218 HydrophobicContact CG2-CD1 4.33Å; I1215-I1218 HydrophobicContact CG2-CG1 3.77Å; I1218-V1225 HydrophobicContact CG2-CG1 3.2Å; I1218-W1226 WeakPolarHBondContact CA-O 3.13Å; I1218-I1227 HydrophobicContact CG1-CG1 4.45Å; I1218-I1227 HydrophobicContact CG2-CG1 4.2Å
1219	C	92.8	Very high	87.3	Confident	20 Å²	20	41.5 Å²	41.5	14%	0.135	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.4	-179.7	-63.5	0	0	0	0	110.7	W1226 I1275 P1277	C1219-W1226 PolarHBondContact N-O 3.42Å; C1219-W1226 PolarHBondContact O-N 2.91Å; C1219-I1275 PolarHBondContact SG-O 3.42Å; C1219-P1277 HydrophobicContact CB-CG 3.87Å
1220	L	92.8	Very high	88	Confident	74 Å²	74	42.7 Å²	42.7	39%	0.387	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.7	172.9	-176.5	66.1	0	0	0	110.1	L1177 A1179 V1225 P1277	L1177-L1220 HydrophobicContact CD1-CB 4.13Å; L1177-L1220 HydrophobicContact CD2-CB 4.14Å; A1179-L1220 HydrophobicContact CB-CD1 4.15Å; A1179-L1220 HydrophobicContact CB-CD2 4.24Å; L1220-V1225 HydrophobicContact CD1-CG2 3.91Å; L1220-P1277 WeakPolarHBondContact O-CG 2.94Å
1221	G	90	Very high	88.7	Confident	9 Å²	9	41.6 Å²	41.6	9%	0.093	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	176	168	0	0	0	0	0	111.9	N1223 G1224	G1221-N1223 PolarHBondContact O-N 3.38Å; G1221-G1224 CarbonylContact C-O 3.36Å; G1221-G1224 PolarHBondContact N-O 3.14Å; G1221-G1224 PolarHBondContact O-N 2.99Å; G1221-G1224 VanDerWaalsContact O-N 3.12Å; G1221-G1224 VanDerWaalsContact O-O 3.07Å
1222	D	86.3	Confident	89.7	Confident	120 Å²	120	36.7 Å²	36.7	64%	0.642	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.9	-176.6	-68.8	-1.5	0	0	0	113.5	D1279	D1222-D1279 VanDerWaalsContact OD2-CA 3.28Å; D1222-D1279 WeakPolarHBondContact OD2-CA 3.24Å
1223	N	85.7	Confident	90.4	Very high	25 Å²	25	31.6 Å²	31.6	13%	0.134	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-5.9	-178.3	-63.1	-59.7	0	0	0	113.6	G1221 L1237 I1296 T1298 Y1382	G1221-N1223 PolarHBondContact O-N 3.38Å; N1223-L1237 HydrophobicContact CB-CD2 4.23Å; N1223-I1296 WeakPolarHBondContact ND2-CG2 3.42Å; N1223-T1298 PolarHBondContact OD1-OG1 3.38Å; N1223-Y1382 HydrophobicContact CB-CD1 4.39Å; N1223-Y1382 HydrophobicContact CB-CE1 3.77Å
1224	G	90	Very high	90.7	Very high	5 Å²	5	30.2 Å²	30.2	5%	0.052	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139.1	-162.2	-176.6	0	0	0	0	0	113.6	G1221 W1238	G1221-G1224 CarbonylContact C-O 3.36Å; G1221-G1224 PolarHBondContact N-O 3.14Å; G1221-G1224 PolarHBondContact O-N 2.99Å; G1221-G1224 VanDerWaalsContact O-N 3.12Å; G1221-G1224 VanDerWaalsContact O-O 3.07Å; G1224-W1238 CarbonylContact C-O 3.47Å; G1224-W1238 WeakPolarHBondContact CA-O 3.5Å
1225	V	93.7	Very high	90.9	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	118.3	-176.1	178.3	0	0	0	0	110.1	L1177 W1184 I1218 L1220 I1227 L1237 W1238 P1240	L1177-V1225 HydrophobicContact CD2-CG1 4Å; L1177-V1225 HydrophobicContact CD2-CG2 4.48Å; W1184-V1225 HydrophobicContact CE3-CG1 4.17Å; W1184-V1225 HydrophobicContact CH2-CG2 4.36Å; W1184-V1225 HydrophobicContact CZ2-CG2 4.37Å; W1184-V1225 HydrophobicContact CZ3-CB 4.45Å; W1184-V1225 HydrophobicContact CZ3-CG1 4.13Å; I1218-V1225 HydrophobicContact CG2-CG1 3.2Å; L1220-V1225 HydrophobicContact CD1-CG2 3.91Å; V1225-I1227 HydrophobicContact CG1-CG1 4.33Å; V1225-L1237 CarbonylContact O-C 3.56Å; V1225-L1237 WeakPolarHBondContact O-CA 3.3Å; V1225-W1238 HydrophobicContact CB-CB 4.35Å; V1225-W1238 PolarHBondContact N-O 3.04Å; V1225-W1238 PolarHBondContact O-N 3.42Å; V1225-P1240 HydrophobicContact CG2-CB 3.93Å; V1225-P1240 HydrophobicContact CG2-CG 4.47Å
1226	W	95.4	Very high	90.8	Very high	2 Å²	2	28 Å²	28	1%	0.008	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	137.6	175.6	-70.2	92.5	0	0	0	111.2	I1218 C1219 I1235 E1236 L1237 L1247 P1277 L1282 I1296 L1384	I1218-W1226 WeakPolarHBondContact CA-O 3.13Å; C1219-W1226 PolarHBondContact N-O 3.42Å; C1219-W1226 PolarHBondContact O-N 2.91Å; W1226-I1235 HydrophobicContact CE3-CD1 4.25Å; W1226-I1235 HydrophobicContact CZ3-CD1 3.85Å; W1226-I1235 HydrophobicContact CZ3-CG1 4.47Å; W1226-E1236 CarbonylContact C-O 3.59Å; W1226-E1236 VanDerWaalsContact CA-O 3.28Å; W1226-E1236 WeakPolarHBondContact CA-O 3.33Å; W1226-L1237 HydrophobicContact CD2-CB 4.34Å; W1226-L1237 HydrophobicContact CD2-CD1 3.9Å; W1226-L1237 HydrophobicContact CE3-CB 4.08Å; W1226-L1237 HydrophobicContact CE3-CD1 4.49Å; W1226-L1237 HydrophobicContact CG-CD1 4.13Å; W1226-L1237 HydrophobicContact CH2-CB 4.04Å; W1226-L1237 HydrophobicContact CH2-CD2 4.25Å; W1226-L1237 HydrophobicContact CZ2-CB 4.3Å; W1226-L1237 HydrophobicContact CZ2-CD1 4.03Å; W1226-L1237 HydrophobicContact CZ2-CD2 4Å; W1226-L1237 HydrophobicContact CZ2-CG 4.32Å; W1226-L1237 HydrophobicContact CZ3-CB 3.92Å; W1226-L1247 HydrophobicContact CH2-CD1 4.44Å; W1226-L1247 HydrophobicContact CH2-CD2 4.42Å; W1226-L1247 HydrophobicContact CZ3-CD1 4.26Å; W1226-P1277 HydrophobicContact CG-CB 4.37Å; W1226-L1282 HydrophobicContact CD2-CD1 3.84Å; W1226-L1282 HydrophobicContact CD2-CD2 4.11Å; W1226-L1282 HydrophobicContact CE3-CD1 4.32Å; W1226-L1282 HydrophobicContact CE3-CD2 3.79Å; W1226-L1282 HydrophobicContact CG-CD1 4.03Å; W1226-L1282 HydrophobicContact CH2-CD2 3.83Å; W1226-L1282 HydrophobicContact CZ2-CD1 4.48Å; W1226-L1282 HydrophobicContact CZ2-CD2 4.12Å; W1226-L1282 HydrophobicContact CZ3-CD2 3.65Å; W1226-I1296 HydrophobicContact CZ2-CD1 3.78Å; W1226-I1296 HydrophobicContact CZ2-CG1 4.36Å; W1226-L1384 HydrophobicContact CH2-CD1 4.16Å; W1226-L1384 HydrophobicContact CH2-CD2 4.01Å; W1226-L1384 HydrophobicContact CH2-CG 4.5Å; W1226-L1384 HydrophobicContact CZ3-CD1 4.49Å
1227	I	95.3	Very high	90.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	132.3	-178.4	-56.6	175.8	0	0	0	109.9	I1191 I1207 I1215 I1218 V1225 E1236 W1238	I1191-I1227 HydrophobicContact CD1-CD1 3.5Å; I1191-I1227 VanDerWaalsContact CD1-CD1 3.5Å; I1191-I1227 HydrophobicContact CD1-CG1 4.49Å; I1207-I1227 HydrophobicContact CD1-CG2 4.14Å; I1207-I1227 HydrophobicContact CG2-CD1 4.07Å; I1215-I1227 HydrophobicContact CG1-CG2 4.39Å; I1215-I1227 HydrophobicContact CG2-CG2 4.02Å; I1218-I1227 HydrophobicContact CG1-CG1 4.45Å; I1218-I1227 HydrophobicContact CG2-CG1 4.2Å; V1225-I1227 HydrophobicContact CG1-CG1 4.33Å; I1227-E1236 HydrophobicContact CB-CB 4.33Å; I1227-E1236 PolarHBondContact N-O 3.44Å; I1227-E1236 PolarHBondContact O-N 2.91Å; I1227-W1238 VanDerWaalsContact CD1-CD1 3.44Å; I1227-W1238 HydrophobicContact CD1-CD2 4.41Å; I1227-W1238 HydrophobicContact CD1-CG 3.95Å
1228	A	93.5	Very high	90.8	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.008	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	146.7	168.8	0	0	0	0	0	110.4	L1216 K1217 V1272 I1275	L1216-A1228 HydrophobicContact CB-CB 4.27Å; L1216-A1228 HydrophobicContact CD2-CB 4.35Å; L1216-A1228 PolarHBondContact N-O 2.84Å; K1217-A1228 PolarHBondContact O-N 3.27Å; A1228-V1272 HydrophobicContact CB-CG1 3.99Å; A1228-I1275 HydrophobicContact CB-CD1 3.33Å; A1228-I1275 HydrophobicContact CB-CG1 3.93Å
1229	V	90.1	Very high	90.5	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.012	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.9	171.7	171.4	0	0	0	0	110.1	I1207 D1213 G1231 S1232	I1207-V1229 HydrophobicContact CD1-CG2 3.27Å; D1213-V1229 HydrophobicContact CB-CG1 4.12Å; V1229-G1231 PolarHBondContact O-N 3.48Å; V1229-S1232 PolarHBondContact O-N 3.06Å; V1229-S1232 VanDerWaalsContact O-N 3.16Å
1230	R	87.4	Confident	90.3	Very high	178 Å²	178	24.8 Å²	24.8	67%	0.672	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	125.2	-177	-173.6	174.6	-178.7	145.5	-1.7	109.8	V1214 L1216 S1232	V1214-R1230 HydrophobicContact CB-CB 4.5Å; V1214-R1230 VanDerWaalsContact O-CB 3.29Å; V1214-R1230 WeakPolarHBondContact O-CB 3.28Å; V1214-R1230 PolarHBondContact O-N 3.02Å; L1216-R1230 HydrophobicContact CB-CB 4.12Å; L1216-R1230 HydrophobicContact CD1-CB 4.43Å; L1216-R1230 HydrophobicContact CD1-CG 4.43Å; R1230-S1232 VanDerWaalsContact C-N 3.3Å
1231	G	85.6	Confident	89.9	Confident	30 Å²	30	25.8 Å²	25.8	31%	0.309	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.2	-11.7	179.1	0	0	0	0	0	114.9	V1229 R1271	V1229-G1231 PolarHBondContact O-N 3.48Å; G1231-R1271 WeakPolarHBondContact O-CB 3.42Å
1232	S	88	Confident	89.6	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.021	15%	0.154	C	C	.	.			trans	-96.7	152.6	-177.9	-178.6	0	0	0	0	112	V1229 R1230 V1234 E1263 R1271 V1272	V1229-S1232 PolarHBondContact O-N 3.06Å; V1229-S1232 VanDerWaalsContact O-N 3.16Å; R1230-S1232 VanDerWaalsContact C-N 3.3Å; S1232-V1234 VanDerWaalsContact C-N 3.32Å; S1232-V1234 WeakPolarHBondContact OG-CB 3.49Å; S1232-V1234 PolarHBondContact OG-N 3.37Å; S1232-E1263 PolarHBondContact OG-OE1 3.18Å; S1232-R1271 WeakPolarHBondContact O-CA 3.08Å; S1232-V1272 PolarHBondContact O-N 3.12Å
1233	S	87.9	Confident	89.5	Confident	4 Å²	4	26.5 Å²	26.5	3%	0.028	13%	0.126	C	C	.	.	S	Bend	trans	-93.6	9.6	167.9	61.2	0	0	0	0	113.3	N1250 I1251 V1252 N1268	S1233-N1250 PolarHBondContact OG-OD1 3.35Å; S1233-I1251 WeakPolarHBondContact O-CB 3.25Å; S1233-I1251 WeakPolarHBondContact O-CD1 3.38Å; S1233-I1251 PolarHBondContact O-N 2.86Å; S1233-V1252 VanDerWaalsContact CB-CG2 3.44Å; S1233-N1268 WeakPolarHBondContact CB-ND2 3.39Å; S1233-N1268 PolarHBondContact OG-ND2 3.47Å
1234	V	88.5	Confident	89.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	134.7	-176.3	-177.1	0	0	0	0	110.5	S1232 L1248 F1249 N1250 L1257 P1261	S1232-V1234 VanDerWaalsContact C-N 3.32Å; S1232-V1234 WeakPolarHBondContact OG-CB 3.49Å; S1232-V1234 PolarHBondContact OG-N 3.37Å; V1234-L1248 HydrophobicContact CG1-CD1 3.29Å; V1234-L1248 HydrophobicContact CG1-CG 3.75Å; V1234-F1249 WeakPolarHBondContact CA-O 3.41Å; V1234-N1250 HydrophobicContact CG2-CB 4.21Å; V1234-L1257 HydrophobicContact CG1-CD1 4.05Å; V1234-L1257 HydrophobicContact CG2-CD1 3.96Å; V1234-P1261 HydrophobicContact CG2-CG 4.21Å
1235	I	92.4	Very high	89.4	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	152	177.5	56.2	166.5	0	0	0	111.3	W1226 F1249 I1251 V1272 I1275 L1282 I1284	W1226-I1235 HydrophobicContact CE3-CD1 4.25Å; W1226-I1235 HydrophobicContact CZ3-CD1 3.85Å; W1226-I1235 HydrophobicContact CZ3-CG1 4.47Å; I1235-F1249 HydrophobicContact CD1-CD1 4.15Å; I1235-F1249 HydrophobicContact CG1-CB 4.07Å; I1235-F1249 HydrophobicContact CG1-CD1 4.22Å; I1235-F1249 WeakPolarHBondContact CG1-O 3.31Å; I1235-F1249 PolarHBondContact N-O 3.49Å; I1235-F1249 PolarHBondContact O-N 3.48Å; I1235-I1251 HydrophobicContact CB-CD1 4.44Å; I1235-I1251 HydrophobicContact CD1-CD1 4.21Å; I1235-I1251 HydrophobicContact CD1-CG1 4.22Å; I1235-I1251 HydrophobicContact CG1-CD1 4.09Å; I1235-I1251 HydrophobicContact CG1-CG1 4.19Å; I1235-I1251 HydrophobicContact CG2-CD1 3.56Å; I1235-V1272 HydrophobicContact CG2-CG2 3.94Å; I1235-I1275 HydrophobicContact CB-CD1 4.25Å; I1235-I1275 HydrophobicContact CG2-CD1 3.43Å; I1235-I1275 VanDerWaalsContact CG2-CD1 3.43Å; I1235-I1275 HydrophobicContact CG2-CG1 4.49Å; I1235-L1282 HydrophobicContact CD1-CD2 3.38Å; I1235-I1284 HydrophobicContact CD1-CD1 3.87Å
1236	E	92.4	Very high	89	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	145.1	-178.9	-38.6	-164.8	-170.5	0	0	111.3	W1226 I1227 W1238 R1245 L1247 L1248 R1260	W1226-E1236 CarbonylContact C-O 3.59Å; W1226-E1236 VanDerWaalsContact CA-O 3.28Å; W1226-E1236 WeakPolarHBondContact CA-O 3.33Å; I1227-E1236 HydrophobicContact CB-CB 4.33Å; I1227-E1236 PolarHBondContact N-O 3.44Å; I1227-E1236 PolarHBondContact O-N 2.91Å; E1236-W1238 PolarHBondContact OE2-NE1 3.35Å; E1236-R1245 WeakPolarHBondContact OE2-CD 3.27Å; E1236-L1247 WeakPolarHBondContact CA-O 3.4Å; E1236-L1248 HydrophobicContact CB-CD1 4.5Å; E1236-L1248 HydrophobicContact CG-CD1 3.6Å; E1236-R1260 IonicContact OE1-CZ 3.74Å; E1236-R1260 VanDerWaalsContact OE1-CZ 3.25Å; E1236-R1260 IonicContact OE1-NH1 2.98Å; E1236-R1260 PolarHBondContact OE1-NH1 2.85Å; E1236-R1260 IonicContact OE1-NH2 3.26Å; E1236-R1260 PolarHBondContact OE1-NH2 2.86Å
1237	L	92.5	Very high	88.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	133.3	166.9	-179.4	60.5	0	0	0	109	N1223 V1225 W1226 I1246 L1247 Y1382	N1223-L1237 HydrophobicContact CB-CD2 4.23Å; V1225-L1237 CarbonylContact O-C 3.56Å; V1225-L1237 WeakPolarHBondContact O-CA 3.3Å; W1226-L1237 HydrophobicContact CD2-CB 4.34Å; W1226-L1237 HydrophobicContact CD2-CD1 3.9Å; W1226-L1237 HydrophobicContact CE3-CB 4.08Å; W1226-L1237 HydrophobicContact CE3-CD1 4.49Å; W1226-L1237 HydrophobicContact CG-CD1 4.13Å; W1226-L1237 HydrophobicContact CH2-CB 4.04Å; W1226-L1237 HydrophobicContact CH2-CD2 4.25Å; W1226-L1237 HydrophobicContact CZ2-CB 4.3Å; W1226-L1237 HydrophobicContact CZ2-CD1 4.03Å; W1226-L1237 HydrophobicContact CZ2-CD2 4Å; W1226-L1237 HydrophobicContact CZ2-CG 4.32Å; W1226-L1237 HydrophobicContact CZ3-CB 3.92Å; L1237-I1246 HydrophobicContact CB-CB 4.37Å; L1237-I1246 HydrophobicContact CD2-CB 4.33Å; L1237-I1246 HydrophobicContact CD2-CD1 4.23Å; L1237-I1246 HydrophobicContact CD2-CG2 4.2Å; L1237-I1246 HydrophobicContact CG-CB 4.19Å; L1237-I1246 HydrophobicContact CG-CD1 4.12Å; L1237-I1246 WeakPolarHBondContact O-CB 3.34Å; L1237-I1246 PolarHBondContact O-N 3.36Å; L1237-L1247 HydrophobicContact CB-CD1 4.45Å; L1237-L1247 HydrophobicContact CB-CD2 4.05Å; L1237-L1247 HydrophobicContact CB-CG 3.8Å; L1237-L1247 HydrophobicContact CD2-CD2 3.9Å; L1237-L1247 PolarHBondContact N-O 3Å; L1237-L1247 VanDerWaalsContact N-O 3.1Å; L1237-L1247 PolarHBondContact O-N 3.4Å; L1237-Y1382 HydrophobicContact CD2-CD1 4.47Å; L1237-Y1382 HydrophobicContact CD2-CG 4.43Å
1238	W	92.6	Very high	88.4	Confident	21 Å²	21	34.8 Å²	34.8	8%	0.08	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	142.2	-178.5	-74	71.1	0	0	0	111.1	I1205 I1207 G1224 V1225 I1227 E1236 P1240 I1244 R1245	I1205-W1238 HydrophobicContact CD1-CE3 4.49Å; I1205-W1238 HydrophobicContact CD1-CZ3 4.38Å; I1205-W1238 HydrophobicContact CG2-CE3 4.3Å; I1205-W1238 HydrophobicContact CG2-CH2 3.44Å; I1205-W1238 VanDerWaalsContact CG2-CH2 3.44Å; I1205-W1238 HydrophobicContact CG2-CZ2 4.37Å; I1205-W1238 HydrophobicContact CG2-CZ3 3.41Å; I1205-W1238 VanDerWaalsContact CG2-CZ3 3.41Å; I1207-W1238 HydrophobicContact CB-CZ2 4.42Å; I1207-W1238 HydrophobicContact CG2-CZ2 3.82Å; G1224-W1238 CarbonylContact C-O 3.47Å; G1224-W1238 WeakPolarHBondContact CA-O 3.5Å; V1225-W1238 HydrophobicContact CB-CB 4.35Å; V1225-W1238 PolarHBondContact N-O 3.04Å; V1225-W1238 PolarHBondContact O-N 3.42Å; I1227-W1238 VanDerWaalsContact CD1-CD1 3.44Å; I1227-W1238 HydrophobicContact CD1-CD2 4.41Å; I1227-W1238 HydrophobicContact CD1-CG 3.95Å; E1236-W1238 PolarHBondContact OE2-NE1 3.35Å; W1238-P1240 WeakPolarHBondContact O-CD 3.38Å; W1238-I1244 WeakPolarHBondContact CA-O 3.37Å; W1238-I1244 VanDerWaalsContact CE3-C 3.41Å; W1238-R1245 HydrophobicContact CD2-CB 4.02Å; W1238-R1245 HydrophobicContact CD2-CG 4.49Å; W1238-R1245 HydrophobicContact CE3-CB 4.32Å; W1238-R1245 HydrophobicContact CH2-CB 4.1Å; W1238-R1245 HydrophobicContact CZ2-CB 3.77Å; W1238-R1245 HydrophobicContact CZ2-CG 4.22Å; W1238-R1245 HydrophobicContact CZ3-CB 4.35Å
1239	D	88	Confident	88.2	Confident	33 Å²	33	34.9 Å²	34.9	18%	0.176	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	116.5	171	-174.1	-31.7	0	0	0	108.8	D1241 R1242 L1243 I1244 I1246	D1239-D1241 VanDerWaalsContact C-N 3.28Å; D1239-D1241 PolarHBondContact O-N 3.38Å; D1239-D1241 PolarHBondContact OD1-N 2.93Å; D1239-R1242 HydrophobicContact CB-CB 4.13Å; D1239-R1242 PolarHBondContact OD1-N 3.03Å; D1239-R1242 VanDerWaalsContact OD1-N 3.08Å; D1239-R1242 WeakPolarHBondContact OD2-CD 3.29Å; D1239-R1242 WeakPolarHBondContact OD2-CG 3.25Å; D1239-L1243 VanDerWaalsContact O-CA 3.23Å; D1239-L1243 WeakPolarHBondContact O-CA 3.44Å; D1239-L1243 PolarHBondContact O-N 3.44Å; D1239-I1244 HydrophobicContact CB-CG1 4.04Å; D1239-I1244 PolarHBondContact N-O 3.42Å; D1239-I1246 HydrophobicContact CB-CD1 3.93Å; D1239-I1246 HydrophobicContact CB-CG1 4.05Å
1240	P	88.2	Confident	88.2	Confident	13 Å²	13	35.6 Å²	35.6	8%	0.084	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-24.6	-179	26.3	-32.9	0	0	0	113.8	Q1182 W1184 V1225 W1238 L1243	Q1182-P1240 PolarHBondContact NE2-O 2.99Å; Q1182-P1240 PolarHBondContact OE1-O 3.4Å; W1184-P1240 HydrophobicContact CZ2-CB 4.27Å; V1225-P1240 HydrophobicContact CG2-CB 3.93Å; V1225-P1240 HydrophobicContact CG2-CG 4.47Å; W1238-P1240 WeakPolarHBondContact O-CD 3.38Å; P1240-L1243 VanDerWaalsContact O-CD2 3.3Å; P1240-L1243 WeakPolarHBondContact O-CD2 3.09Å
1241	D	85.1	Confident	88.2	Confident	94 Å²	94	27.5 Å²	27.5	50%	0.503	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-40.3	-177.3	-62.4	-35.5	0	0	0	110.4	K1180 D1239	K1180-D1241 IonicContact NZ-OD1 3.51Å; K1180-D1241 PolarHBondContact NZ-OD1 3.16Å; K1180-D1241 IonicContact NZ-OD2 3.43Å; K1180-D1241 PolarHBondContact NZ-OD2 3.21Å; D1239-D1241 VanDerWaalsContact C-N 3.28Å; D1239-D1241 PolarHBondContact O-N 3.38Å; D1239-D1241 PolarHBondContact OD1-N 2.93Å
1242	R	82.4	Confident	88.2	Confident	132 Å²	132	28.5 Å²	28.5	50%	0.498	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-14.5	-179.2	-63.3	-177.1	-179.7	-168.4	1.6	114.2	D1239 I1244 N1377	D1239-R1242 HydrophobicContact CB-CB 4.13Å; D1239-R1242 PolarHBondContact OD1-N 3.03Å; D1239-R1242 VanDerWaalsContact OD1-N 3.08Å; D1239-R1242 WeakPolarHBondContact OD2-CD 3.29Å; D1239-R1242 WeakPolarHBondContact OD2-CG 3.25Å; R1242-I1244 VanDerWaalsContact C-N 3.25Å; R1242-I1244 HydrophobicContact CB-CD1 4.04Å; R1242-I1244 HydrophobicContact CB-CG1 3.82Å; R1242-I1244 PolarHBondContact O-N 2.96Å; R1242-N1377 PolarHBondContact NH1-O 3.04Å
1243	L	85.5	Confident	87.8	Confident	12 Å²	12	33.7 Å²	33.7	6%	0.063	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	41.3	-176.3	-57.2	-171.4	0	0	0	113	W1184 I1193 Y1202 K1203 I1205 D1239 P1240	W1184-L1243 HydrophobicContact CH2-CD2 3.47Å; W1184-L1243 VanDerWaalsContact CH2-CD2 3.47Å; W1184-L1243 HydrophobicContact CZ2-CD2 3.28Å; I1193-L1243 HydrophobicContact CD1-CD1 3.73Å; I1193-L1243 HydrophobicContact CD1-CD2 3.57Å; I1193-L1243 HydrophobicContact CD1-CG 4.29Å; Y1202-L1243 HydrophobicContact CD1-CD1 3.86Å; Y1202-L1243 HydrophobicContact CE1-CD1 3.45Å; Y1202-L1243 VanDerWaalsContact CE1-CD1 3.45Å; Y1202-L1243 HydrophobicContact CE1-CG 4.33Å; K1203-L1243 HydrophobicContact CB-CD1 4.02Å; K1203-L1243 HydrophobicContact CD-CD1 3.68Å; K1203-L1243 HydrophobicContact CG-CD1 4.36Å; I1205-L1243 HydrophobicContact CD1-CB 3.75Å; I1205-L1243 HydrophobicContact CD1-CD1 4.08Å; I1205-L1243 HydrophobicContact CD1-CD2 3.97Å; I1205-L1243 HydrophobicContact CD1-CG 4.15Å; D1239-L1243 VanDerWaalsContact O-CA 3.23Å; D1239-L1243 WeakPolarHBondContact O-CA 3.44Å; D1239-L1243 PolarHBondContact O-N 3.44Å; P1240-L1243 VanDerWaalsContact O-CD2 3.3Å; P1240-L1243 WeakPolarHBondContact O-CD2 3.09Å
1244	I	85.2	Confident	87.7	Confident	64 Å²	64	37.5 Å²	37.5	33%	0.328	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	145.6	177.3	60.8	178.1	0	0	0	110.5	W1238 D1239 R1242 I1246 N1377	W1238-I1244 WeakPolarHBondContact CA-O 3.37Å; W1238-I1244 VanDerWaalsContact CE3-C 3.41Å; D1239-I1244 HydrophobicContact CB-CG1 4.04Å; D1239-I1244 PolarHBondContact N-O 3.42Å; R1242-I1244 VanDerWaalsContact C-N 3.25Å; R1242-I1244 HydrophobicContact CB-CD1 4.04Å; R1242-I1244 HydrophobicContact CB-CG1 3.82Å; R1242-I1244 PolarHBondContact O-N 2.96Å; I1244-I1246 PolarHBondContact O-N 2.97Å; I1244-N1377 HydrophobicContact CD1-CB 4.3Å
1245	R	87.3	Confident	87.4	Confident	96 Å²	96	40.2 Å²	40.2	36%	0.362	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	123	173	-168.8	-177.1	67.3	-167.3	2.6	109.7	E1236 W1238 S1258	E1236-R1245 WeakPolarHBondContact OE2-CD 3.27Å; W1238-R1245 HydrophobicContact CD2-CB 4.02Å; W1238-R1245 HydrophobicContact CD2-CG 4.49Å; W1238-R1245 HydrophobicContact CE3-CB 4.32Å; W1238-R1245 HydrophobicContact CH2-CB 4.1Å; W1238-R1245 HydrophobicContact CZ2-CB 3.77Å; W1238-R1245 HydrophobicContact CZ2-CG 4.22Å; W1238-R1245 HydrophobicContact CZ3-CB 4.35Å; R1245-S1258 PolarHBondContact NH2-O 3.25Å
1246	I	86.1	Confident	87.1	Confident	26 Å²	26	44.6 Å²	44.6	13%	0.133	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-50	177.1	-61.3	-178.3	0	0	0	110.3	L1237 D1239 I1244 Y1382	L1237-I1246 HydrophobicContact CB-CB 4.37Å; L1237-I1246 HydrophobicContact CD2-CB 4.33Å; L1237-I1246 HydrophobicContact CD2-CD1 4.23Å; L1237-I1246 HydrophobicContact CD2-CG2 4.2Å; L1237-I1246 HydrophobicContact CG-CB 4.19Å; L1237-I1246 HydrophobicContact CG-CD1 4.12Å; L1237-I1246 WeakPolarHBondContact O-CB 3.34Å; L1237-I1246 PolarHBondContact O-N 3.36Å; D1239-I1246 HydrophobicContact CB-CD1 3.93Å; D1239-I1246 HydrophobicContact CB-CG1 4.05Å; I1244-I1246 PolarHBondContact O-N 2.97Å; I1246-Y1382 HydrophobicContact CD1-CE2 4.23Å; I1246-Y1382 HydrophobicContact CG2-CD2 3.35Å; I1246-Y1382 HydrophobicContact CG2-CE2 3.45Å; I1246-Y1382 VanDerWaalsContact CG2-CE2 3.45Å; I1246-Y1382 HydrophobicContact CG2-CG 4.4Å
1247	L	87.7	Confident	86.6	Confident	17 Å²	17	46.4 Å²	46.4	9%	0.089	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	160.3	179.8	72.1	92.9	0	0	0	112.1	W1226 E1236 L1237 F1249 Y1382 L1384	W1226-L1247 HydrophobicContact CH2-CD1 4.44Å; W1226-L1247 HydrophobicContact CH2-CD2 4.42Å; W1226-L1247 HydrophobicContact CZ3-CD1 4.26Å; E1236-L1247 WeakPolarHBondContact CA-O 3.4Å; L1237-L1247 HydrophobicContact CB-CD1 4.45Å; L1237-L1247 HydrophobicContact CB-CD2 4.05Å; L1237-L1247 HydrophobicContact CB-CG 3.8Å; L1237-L1247 HydrophobicContact CD2-CD2 3.9Å; L1237-L1247 PolarHBondContact N-O 3Å; L1237-L1247 VanDerWaalsContact N-O 3.1Å; L1237-L1247 PolarHBondContact O-N 3.4Å; L1247-F1249 HydrophobicContact CD1-CB 3.76Å; L1247-Y1382 HydrophobicContact CD2-CG 4.39Å; L1247-L1384 HydrophobicContact CD1-CD1 4.08Å
1248	L	89.4	Confident	85.4	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.016	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	122.9	173.9	-176.4	69.8	0	0	0	107.5	V1234 E1236 Y1256 L1257 R1259 R1260	V1234-L1248 HydrophobicContact CG1-CD1 3.29Å; V1234-L1248 HydrophobicContact CG1-CG 3.75Å; E1236-L1248 HydrophobicContact CB-CD1 4.5Å; E1236-L1248 HydrophobicContact CG-CD1 3.6Å; L1248-Y1256 WeakPolarHBondContact O-CA 3.34Å; L1248-L1257 HydrophobicContact CB-CB 4.27Å; L1248-L1257 HydrophobicContact CD2-CB 3.63Å; L1248-L1257 HydrophobicContact CD2-CD1 4.32Å; L1248-L1257 HydrophobicContact CG-CB 3.86Å; L1248-L1257 HydrophobicContact CG-CD1 4.29Å; L1248-L1257 PolarHBondContact O-N 3.23Å; L1248-R1259 VanDerWaalsContact CD2-C 3.43Å; L1248-R1260 HydrophobicContact CD2-CB 4.46Å
1249	F	90.4	Very high	84.4	Confident	3 Å²	3	57.6 Å²	57.6	1%	0.013	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129.6	-171.1	-176.5	-100.5	0	0	0	111.4	V1234 I1235 L1247 I1251 E1254 Y1256 Y1294 L1384	V1234-F1249 WeakPolarHBondContact CA-O 3.41Å; I1235-F1249 HydrophobicContact CD1-CD1 4.15Å; I1235-F1249 HydrophobicContact CG1-CB 4.07Å; I1235-F1249 HydrophobicContact CG1-CD1 4.22Å; I1235-F1249 WeakPolarHBondContact CG1-O 3.31Å; I1235-F1249 PolarHBondContact N-O 3.49Å; I1235-F1249 PolarHBondContact O-N 3.48Å; L1247-F1249 HydrophobicContact CD1-CB 3.76Å; F1249-I1251 HydrophobicContact CD1-CG1 4.18Å; F1249-I1251 HydrophobicContact CE1-CG1 4.34Å; F1249-E1254 HydrophobicContact CZ-CB 4.07Å; F1249-E1254 HydrophobicContact CZ-CG 4.35Å; F1249-Y1256 AromaticContact CD2-CD1 3.89Å; F1249-Y1256 HydrophobicContact CD2-CD1 3.89Å; F1249-Y1256 HydrophobicContact CD2-CD2 4.39Å; F1249-Y1256 AromaticContact CD2-CE1 3.74Å; F1249-Y1256 HydrophobicContact CD2-CE1 3.74Å; F1249-Y1256 HydrophobicContact CD2-CE2 4.25Å; F1249-Y1256 HydrophobicContact CD2-CG 4.21Å; F1249-Y1256 AromaticContact CD2-CZ 3.91Å; F1249-Y1256 HydrophobicContact CE2-CE1 4.33Å; F1249-Y1256 HydrophobicContact CE2-CE2 4.14Å; F1249-Y1294 HydrophobicContact CE1-CD1 4.34Å; F1249-Y1294 AromaticContact CE1-CE1 3.68Å; F1249-Y1294 HydrophobicContact CE1-CE1 3.68Å; F1249-Y1294 AromaticContact CE1-CZ 3.89Å; F1249-Y1294 HydrophobicContact CZ-CD1 4.5Å; F1249-Y1294 AromaticContact CZ-CE1 3.84Å; F1249-Y1294 HydrophobicContact CZ-CE1 3.84Å; F1249-L1384 HydrophobicContact CB-CD1 3.85Å; F1249-L1384 HydrophobicContact CD1-CD1 3.7Å; F1249-L1384 HydrophobicContact CD2-CD1 3.93Å; F1249-L1384 HydrophobicContact CE1-CD1 4.17Å; F1249-L1384 HydrophobicContact CE2-CB 4.35Å; F1249-L1384 HydrophobicContact CE2-CD1 4.38Å; F1249-L1384 HydrophobicContact CG-CD1 3.55Å; F1249-L1384 HydrophobicContact CZ-CB 4.28Å; F1249-L1384 HydrophobicContact CZ-CD1 4.48Å
1250	N	89.2	Confident	83.6	Confident	17 Å²	17	57.5 Å²	57.5	9%	0.091	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	120.1	173.9	-171.6	-20.9	0	0	0	109.8	S1233 V1234 V1252 E1254 T1255 L1257	S1233-N1250 PolarHBondContact OG-OD1 3.35Å; V1234-N1250 HydrophobicContact CG2-CB 4.21Å; N1250-V1252 PolarHBondContact OD1-N 3.02Å; N1250-E1254 WeakPolarHBondContact O-CA 3.28Å; N1250-E1254 PolarHBondContact O-N 3.38Å; N1250-T1255 PolarHBondContact N-O 2.96Å; N1250-T1255 PolarHBondContact O-N 3.02Å; N1250-L1257 HydrophobicContact CB-CD1 3.87Å; N1250-L1257 HydrophobicContact CB-CG 4.35Å
1251	I	87.9	Confident	82.5	Confident	8 Å²	8	59.2 Å²	59.2	4%	0.041	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-30.9	-175.2	-65.6	154.4	0	0	0	112.2	S1233 I1235 F1249 V1272 I1284 L1292 Y1294	S1233-I1251 WeakPolarHBondContact O-CB 3.25Å; S1233-I1251 WeakPolarHBondContact O-CD1 3.38Å; S1233-I1251 PolarHBondContact O-N 2.86Å; I1235-I1251 HydrophobicContact CB-CD1 4.44Å; I1235-I1251 HydrophobicContact CD1-CD1 4.21Å; I1235-I1251 HydrophobicContact CD1-CG1 4.22Å; I1235-I1251 HydrophobicContact CG1-CD1 4.09Å; I1235-I1251 HydrophobicContact CG1-CG1 4.19Å; I1235-I1251 HydrophobicContact CG2-CD1 3.56Å; F1249-I1251 HydrophobicContact CD1-CG1 4.18Å; F1249-I1251 HydrophobicContact CE1-CG1 4.34Å; I1251-V1272 HydrophobicContact CD1-CG2 3.2Å; I1251-I1284 HydrophobicContact CD1-CD1 3.49Å; I1251-I1284 VanDerWaalsContact CD1-CD1 3.49Å; I1251-I1284 HydrophobicContact CD1-CG2 4.03Å; I1251-I1284 HydrophobicContact CG1-CD1 3.86Å; I1251-L1292 HydrophobicContact CG2-CD1 3.2Å; I1251-Y1294 HydrophobicContact CG2-CE2 4.33Å
1252	V	84.5	Confident	81.3	Confident	52 Å²	52	63 Å²	63	32%	0.315	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-48	-177	172.6	0	0	0	0	110.8	S1233 N1250 Q1270	S1233-V1252 VanDerWaalsContact CB-CG2 3.44Å; N1250-V1252 PolarHBondContact OD1-N 3.02Å; V1252-Q1270 VanDerWaalsContact CG1-OE1 3.25Å; V1252-Q1270 HydrophobicContact CG2-CB 3.73Å
1253	N	80.9	Confident	79.8	Confident	111 Å²	111	60.2 Å²	60.2	59%	0.594	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-6.4	-178.3	-63.8	-16.4	0	0	0	112.9	T1255	N1253-T1255 VanDerWaalsContact C-N 3.25Å; N1253-T1255 HydrophobicContact CB-CG2 4.08Å; N1253-T1255 WeakPolarHBondContact O-CG2 3.2Å; N1253-T1255 PolarHBondContact O-N 3.02Å
1254	E	84.8	Confident	77.9	Confident	84 Å²	84	67.3 Å²	67.3	39%	0.393	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	40	-174	-65	172.8	-141	0	0	113.2	F1249 N1250 K1386	F1249-E1254 HydrophobicContact CZ-CB 4.07Å; F1249-E1254 HydrophobicContact CZ-CG 4.35Å; N1250-E1254 WeakPolarHBondContact O-CA 3.28Å; N1250-E1254 PolarHBondContact O-N 3.38Å; E1254-K1386 WeakPolarHBondContact OE1-CE 3.44Å; E1254-K1386 IonicContact OE1-NZ 2.65Å; E1254-K1386 PolarHBondContact OE1-NZ 3.38Å; E1254-K1386 IonicContact OE2-NZ 2.83Å
1255	T	83.3	Confident	76.3	Confident	58 Å²	58	71.3 Å²	71.3	36%	0.356	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.5	-176.4	54	0	0	0	0	112.7	N1250 N1253	N1250-T1255 PolarHBondContact N-O 2.96Å; N1250-T1255 PolarHBondContact O-N 3.02Å; N1253-T1255 VanDerWaalsContact C-N 3.25Å; N1253-T1255 HydrophobicContact CB-CG2 4.08Å; N1253-T1255 WeakPolarHBondContact O-CG2 3.2Å; N1253-T1255 PolarHBondContact O-N 3.02Å
1256	Y	84.5	Confident	74.5	Confident	92 Å²	92	69.8 Å²	69.8	36%	0.361	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	134.1	166.7	-61.1	-87.5	0	0	0	109.8	L1248 F1249 E1383 L1384	L1248-Y1256 WeakPolarHBondContact O-CA 3.34Å; F1249-Y1256 AromaticContact CD2-CD1 3.89Å; F1249-Y1256 HydrophobicContact CD2-CD1 3.89Å; F1249-Y1256 HydrophobicContact CD2-CD2 4.39Å; F1249-Y1256 AromaticContact CD2-CE1 3.74Å; F1249-Y1256 HydrophobicContact CD2-CE1 3.74Å; F1249-Y1256 HydrophobicContact CD2-CE2 4.25Å; F1249-Y1256 HydrophobicContact CD2-CG 4.21Å; F1249-Y1256 AromaticContact CD2-CZ 3.91Å; F1249-Y1256 HydrophobicContact CE2-CE1 4.33Å; F1249-Y1256 HydrophobicContact CE2-CE2 4.14Å; Y1256-E1383 WeakPolarHBondContact OH-CA 3.36Å; Y1256-L1384 PolarHBondContact OH-N 3.48Å
1257	L	82.4	Confident	73.4	Confident	39 Å²	39	71.9 Å²	71.9	20%	0.204	35%	0.349	C	S	.	.			trans	-112.7	142.6	-175.8	-60.9	172.1	0	0	0	109.9	V1234 L1248 N1250 P1261	V1234-L1257 HydrophobicContact CG1-CD1 4.05Å; V1234-L1257 HydrophobicContact CG2-CD1 3.96Å; L1248-L1257 HydrophobicContact CB-CB 4.27Å; L1248-L1257 HydrophobicContact CD2-CB 3.63Å; L1248-L1257 HydrophobicContact CD2-CD1 4.32Å; L1248-L1257 HydrophobicContact CG-CB 3.86Å; L1248-L1257 HydrophobicContact CG-CD1 4.29Å; L1248-L1257 PolarHBondContact O-N 3.23Å; N1250-L1257 HydrophobicContact CB-CD1 3.87Å; N1250-L1257 HydrophobicContact CB-CG 4.35Å; L1257-P1261 HydrophobicContact CD1-CG 4.32Å
1258	S	68.4	Low	72.6	Confident	82 Å²	82	72.6 Å²	72.6	57%	0.573	35%	0.353	S	S	*	.	S	Bend	trans	-82.1	-35.9	170.5	55.4	0	0	0	0	112.1	R1245	R1245-S1258 PolarHBondContact NH2-O 3.25Å
1259	R	70.8	Confident	71.9	Confident	174 Å²	174	74.9 Å²	74.9	66%	0.657	37%	0.368	S	S	*	.	S	Bend	trans	-136.9	150.6	-179.1	-170	173.4	176.2	-178.3	-5.2	109.4	L1248	L1248-R1259 VanDerWaalsContact CD2-C 3.43Å
1260	R	70.6	Confident	71.4	Confident	30 Å²	30	77.8 Å²	77.8	11%	0.113	38%	0.381	C	S	.	.			trans	-61.2	129.8	174.5	-158.3	-178.8	-142.1	106.2	21.3	108.6	E1236 L1248	E1236-R1260 IonicContact OE1-CZ 3.74Å; E1236-R1260 VanDerWaalsContact OE1-CZ 3.25Å; E1236-R1260 IonicContact OE1-NH1 2.98Å; E1236-R1260 PolarHBondContact OE1-NH1 2.85Å; E1236-R1260 IonicContact OE1-NH2 3.26Å; E1236-R1260 PolarHBondContact OE1-NH2 2.86Å; L1248-R1260 HydrophobicContact CD2-CB 4.46Å
1261	P	65.8	Low	71.5	Confident	50 Å²	50	79.1 Å²	79.1	33%	0.325	39%	0.385	S	S	.	.			trans	-60.9	138.6	171.2	23.3	-31.2	0	0	0	108.7	V1234 L1257 E1263	V1234-P1261 HydrophobicContact CG2-CG 4.21Å; L1257-P1261 HydrophobicContact CD1-CG 4.32Å; P1261-E1263 HydrophobicContact CB-CG 4.39Å; P1261-E1263 HydrophobicContact CG-CG 4.05Å; P1261-E1263 PolarHBondContact O-N 3.36Å
1262	E	59.6	Low	71.7	Confident	174 Å²	174	78.8 Å²	78.8	81%	0.813	38%	0.384	S	S	*	.			trans	-70.9	84.8	164.5	-67.8	-177.1	-174.8	0	0	106.2	E1264	E1262-E1264 PolarHBondContact O-N 3.09Å
1263	E	51.8	Low	72	Confident	73 Å²	73	77.7 Å²	77.7	34%	0.341	38%	0.377	S	S	.	.			trans	-62	119.5	-178.8	-69.8	-179.6	-169	0	0	108.6	S1232 P1261 Y1265	S1232-E1263 PolarHBondContact OG-OE1 3.18Å; P1261-E1263 HydrophobicContact CB-CG 4.39Å; P1261-E1263 HydrophobicContact CG-CG 4.05Å; P1261-E1263 PolarHBondContact O-N 3.36Å; E1263-Y1265 PolarHBondContact O-N 3.33Å
1264	E	44.4	Very low	72.6	Confident	161 Å²	161	73.2 Å²	73.2	75%	0.752	35%	0.354	S	S	*	.			trans	-57.1	133.8	168	-67.7	-176	166.2	0	0	108	E1262 T1266	E1262-E1264 PolarHBondContact O-N 3.09Å; E1264-T1266 PolarHBondContact O-N 3.37Å; E1264-T1266 PolarHBondContact O-OG1 3.25Å
1265	Y	51.5	Low	73	Confident	147 Å²	147	69.5 Å²	69.5	58%	0.576	34%	0.336	S	S	*	.	S	Bend	trans	-60.9	36.8	-172.9	-58.5	-85.7	0	0	0	116.8	K1004 L1212 E1263	K1004-Y1265 WeakPolarHBondContact CE-O 3.14Å; L1212-Y1265 HydrophobicContact CD1-CE1 3.54Å; E1263-Y1265 PolarHBondContact O-N 3.33Å
1266	T	51.3	Low	73.5	Confident	65 Å²	65	67.8 Å²	67.8	40%	0.399	33%	0.325	S	S	.	.	S	Bend	trans	-85.5	142.4	171.8	55.4	0	0	0	0	109	Y1007 E1264 N1268	Y1007-T1266 HydrophobicContact CD1-CG2 4.16Å; Y1007-T1266 HydrophobicContact CE1-CG2 4.03Å; E1264-T1266 PolarHBondContact O-N 3.37Å; E1264-T1266 PolarHBondContact O-OG1 3.25Å; T1266-N1268 PolarHBondContact O-N 2.84Å; T1266-N1268 VanDerWaalsContact O-N 3.14Å
1267	F	62.5	Low	73.9	Confident	69 Å²	69	64 Å²	64	30%	0.303	31%	0.312	S	S	.	.			trans	-62.2	116.8	173.5	-170.3	-115.6	0	0	0	108.9	W1008 V1011 P1269	W1008-F1267 HydrophobicContact CE3-CB 4.07Å; W1008-F1267 HydrophobicContact CH2-CB 3.37Å; W1008-F1267 AromaticContact CH2-CD2 3.58Å; W1008-F1267 HydrophobicContact CH2-CD2 3.58Å; W1008-F1267 AromaticContact CH2-CG 3.8Å; W1008-F1267 HydrophobicContact CH2-CG 3.8Å; W1008-F1267 HydrophobicContact CZ2-CB 3.92Å; W1008-F1267 HydrophobicContact CZ3-CB 3.43Å; W1008-F1267 VanDerWaalsContact CZ3-CB 3.43Å; W1008-F1267 AromaticContact CZ3-CD2 3.66Å; W1008-F1267 HydrophobicContact CZ3-CD2 3.66Å; W1008-F1267 AromaticContact CZ3-CG 3.65Å; W1008-F1267 HydrophobicContact CZ3-CG 3.65Å; V1011-F1267 HydrophobicContact CG1-CD1 4.23Å; F1267-P1269 WeakPolarHBondContact O-CD 3.5Å
1268	N	71.4	Confident	73.9	Confident	33 Å²	33	64 Å²	64	18%	0.176	31%	0.309	C	S	.	.			trans	-82.5	107	170.9	-171.3	-15.5	0	0	0	108.8	S1233 T1266 Q1270 R1271	S1233-N1268 WeakPolarHBondContact CB-ND2 3.39Å; S1233-N1268 PolarHBondContact OG-ND2 3.47Å; T1266-N1268 PolarHBondContact O-N 2.84Å; T1266-N1268 VanDerWaalsContact O-N 3.14Å; N1268-Q1270 PolarHBondContact O-N 2.77Å; N1268-Q1270 WeakPolarHBondContact OD1-CA 3.31Å; N1268-Q1270 PolarHBondContact OD1-N 3.19Å; N1268-R1271 HydrophobicContact CB-CB 4.28Å; N1268-R1271 VanDerWaalsContact O-CB 3.27Å; N1268-R1271 WeakPolarHBondContact O-CB 3.38Å; N1268-R1271 WeakPolarHBondContact O-CG 3.49Å; N1268-R1271 PolarHBondContact O-N 3.41Å; N1268-R1271 VanDerWaalsContact O-N 3.14Å; N1268-R1271 PolarHBondContact O-NH1 3.44Å; N1268-R1271 PolarHBondContact OD1-N 3.24Å
1269	P	73.6	Confident	74.5	Confident	50 Å²	50	63.3 Å²	63.3	33%	0.325	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-34.6	176.7	24.2	-32.8	0	0	0	111.1	F1267 R1271 G1287 M1288	F1267-P1269 WeakPolarHBondContact O-CD 3.5Å; P1269-R1271 PolarHBondContact O-N 2.98Å; P1269-G1287 CarbonylContact O-C 3.27Å; P1269-G1287 VanDerWaalsContact O-C 3.24Å; P1269-G1287 VanDerWaalsContact O-CA 3.24Å; P1269-G1287 WeakPolarHBondContact O-CA 3.5Å; P1269-M1288 HydrophobicContact CB-CG 3.89Å; P1269-M1288 HydrophobicContact CB-SD 3.56Å; P1269-M1288 VanDerWaalsContact CB-SD 3.56Å; P1269-M1288 WeakPolarHBondContact O-CG 3.44Å; P1269-M1288 PolarHBondContact O-N 2.86Å
1270	Q	80.5	Confident	75.2	Confident	64 Å²	64	57.6 Å²	57.6	30%	0.299	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	16.4	178.6	-64.1	178.2	-17.5	0	0	113.3	V1252 N1268 M1288	V1252-Q1270 VanDerWaalsContact CG1-OE1 3.25Å; V1252-Q1270 HydrophobicContact CG2-CB 3.73Å; N1268-Q1270 PolarHBondContact O-N 2.77Å; N1268-Q1270 WeakPolarHBondContact OD1-CA 3.31Å; N1268-Q1270 PolarHBondContact OD1-N 3.19Å; Q1270-M1288 HydrophobicContact CG-CG 4.18Å
1271	R	90.5	Very high	76.1	Confident	45 Å²	45	56.9 Å²	56.9	17%	0.17	28%	0.281	C	S	.	.			trans	-55.5	150.8	173.2	70.7	-169.7	-179	-68.5	-3.6	111.4	G1231 S1232 N1268 P1269 T1273 T1286 G1287	G1231-R1271 WeakPolarHBondContact O-CB 3.42Å; S1232-R1271 WeakPolarHBondContact O-CA 3.08Å; N1268-R1271 HydrophobicContact CB-CB 4.28Å; N1268-R1271 VanDerWaalsContact O-CB 3.27Å; N1268-R1271 WeakPolarHBondContact O-CB 3.38Å; N1268-R1271 WeakPolarHBondContact O-CG 3.49Å; N1268-R1271 PolarHBondContact O-N 3.41Å; N1268-R1271 VanDerWaalsContact O-N 3.14Å; N1268-R1271 PolarHBondContact O-NH1 3.44Å; N1268-R1271 PolarHBondContact OD1-N 3.24Å; P1269-R1271 PolarHBondContact O-N 2.98Å; R1271-T1273 HydrophobicContact CG-CG2 4.33Å; R1271-T1286 CarbonylContact O-C 3.48Å; R1271-T1286 WeakPolarHBondContact O-CA 3.46Å; R1271-G1287 PolarHBondContact O-N 3.48Å
1272	V	91.8	Very high	77.3	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.012	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	132.2	169.6	-179.9	0	0	0	0	109.6	L1216 A1228 S1232 I1235 I1251 I1275 I1284	L1216-V1272 VanDerWaalsContact CD2-O 3.27Å; L1216-V1272 WeakPolarHBondContact CD2-O 3.44Å; A1228-V1272 HydrophobicContact CB-CG1 3.99Å; S1232-V1272 PolarHBondContact O-N 3.12Å; I1235-V1272 HydrophobicContact CG2-CG2 3.94Å; I1251-V1272 HydrophobicContact CD1-CG2 3.2Å; V1272-I1275 HydrophobicContact CG1-CD1 3.99Å; V1272-I1275 HydrophobicContact CG1-CG1 3.5Å; V1272-I1284 HydrophobicContact CB-CG2 4.43Å; V1272-I1284 HydrophobicContact CG1-CG2 3.87Å; V1272-I1284 HydrophobicContact CG2-CG2 3.94Å
1273	T	91.4	Very high	79	Confident	28 Å²	28	46.2 Å²	46.2	17%	0.172	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-28.4	175.4	49.2	0	0	0	0	112.5	L1216 R1271 G1285 T1286 P1396 I1397	L1216-T1273 WeakPolarHBondContact CD2-O 3.45Å; R1271-T1273 HydrophobicContact CG-CG2 4.33Å; T1273-G1285 PolarHBondContact N-O 3.03Å; T1273-G1285 VanDerWaalsContact OG1-C 3.23Å; T1273-G1285 PolarHBondContact OG1-O 2.65Å; T1273-T1286 PolarHBondContact OG1-O 3.37Å; T1273-P1396 HydrophobicContact CG2-CB 4.34Å; T1273-I1397 WeakPolarHBondContact CB-O 3.36Å; T1273-I1397 PolarHBondContact OG1-O 3.39Å
1274	V	93	Very high	81	Confident	18 Å²	18	42.7 Å²	42.7	11%	0.109	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	147.8	176.2	59.1	0	0	0	0	110.2	I1284 G1285 I1397 L1400	V1274-I1284 WeakPolarHBondContact O-CA 3.49Å; V1274-G1285 PolarHBondContact N-O 3.36Å; V1274-G1285 PolarHBondContact O-N 3.05Å; V1274-I1397 HydrophobicContact CG1-CG2 3.96Å; V1274-L1400 HydrophobicContact CG1-CB 4.25Å; V1274-L1400 HydrophobicContact CG1-CD1 3.8Å; V1274-L1400 HydrophobicContact CG1-CG 3.76Å; V1274-L1400 HydrophobicContact CG2-CB 4.1Å
1275	I	94.2	Very high	83.3	Confident	5 Å²	5	35 Å²	35	3%	0.026	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.2	175	-54	-176.7	0	0	0	108.7	C1219 A1228 I1235 V1272 L1282 W1283	C1219-I1275 PolarHBondContact SG-O 3.42Å; A1228-I1275 HydrophobicContact CB-CD1 3.33Å; A1228-I1275 HydrophobicContact CB-CG1 3.93Å; I1235-I1275 HydrophobicContact CB-CD1 4.25Å; I1235-I1275 HydrophobicContact CG2-CD1 3.43Å; I1235-I1275 VanDerWaalsContact CG2-CD1 3.43Å; I1235-I1275 HydrophobicContact CG2-CG1 4.49Å; V1272-I1275 HydrophobicContact CG1-CD1 3.99Å; V1272-I1275 HydrophobicContact CG1-CG1 3.5Å; I1275-L1282 HydrophobicContact CG2-CD1 3.37Å; I1275-L1282 HydrophobicContact CG2-CG 4.14Å; I1275-W1283 CarbonylContact C-O 3.26Å; I1275-W1283 WeakPolarHBondContact CA-O 3.42Å
1276	L	93.8	Very high	85.3	Confident	23 Å²	23	28.1 Å²	28.1	12%	0.12	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	99.4	174	179.3	70.1	0	0	0	110.3	W1283 L1400 M1402 I1412	L1276-W1283 HydrophobicContact CB-CB 4.15Å; L1276-W1283 PolarHBondContact N-O 2.99Å; L1276-W1283 WeakPolarHBondContact O-CB 3.4Å; L1276-W1283 PolarHBondContact O-N 3.34Å; L1276-L1400 HydrophobicContact CB-CB 3.9Å; L1276-L1400 HydrophobicContact CB-CD1 4.44Å; L1276-L1400 HydrophobicContact CD2-CB 4.03Å; L1276-M1402 HydrophobicContact CD1-CG 3.86Å; L1276-M1402 HydrophobicContact CD1-SD 4.12Å; L1276-M1402 HydrophobicContact CD2-CB 3.94Å; L1276-M1402 HydrophobicContact CD2-CG 3.98Å; L1276-M1402 HydrophobicContact CD2-SD 4.5Å; L1276-M1402 HydrophobicContact CG-CG 4.33Å; L1276-M1402 HydrophobicContact CG-SD 4.43Å; L1276-I1412 HydrophobicContact CD2-CG2 4.3Å
1277	P	92	Very high	87	Confident	13 Å²	13	25.4 Å²	25.4	8%	0.084	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	135.9	170.8	31.6	-32.9	0	0	0	110.4	C1219 L1220 W1226 L1282	C1219-P1277 HydrophobicContact CB-CG 3.87Å; L1220-P1277 WeakPolarHBondContact O-CG 2.94Å; W1226-P1277 HydrophobicContact CG-CB 4.37Å; P1277-L1282 HydrophobicContact CB-CD1 3.88Å
1278	Y	83.8	Confident	88.1	Confident	37 Å²	37	26 Å²	26	15%	0.145	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	124.6	177	172.5	-108.6	0	0	0	111.3	N1280 T1281 M1402 I1410	Y1278-N1280 PolarHBondContact O-N 3.44Å; Y1278-T1281 PolarHBondContact N-O 3.07Å; Y1278-T1281 CarbonylContact O-C 3.24Å; Y1278-T1281 WeakPolarHBondContact O-CA 3.38Å; Y1278-T1281 WeakPolarHBondContact O-CB 3.37Å; Y1278-T1281 PolarHBondContact O-N 3.28Å; Y1278-T1281 PolarHBondContact O-OG1 2.9Å; Y1278-M1402 HydrophobicContact CD2-CE 3.13Å; Y1278-M1402 HydrophobicContact CD2-SD 3.56Å; Y1278-M1402 VanDerWaalsContact CD2-SD 3.56Å; Y1278-M1402 HydrophobicContact CE2-CE 3.5Å; Y1278-M1402 HydrophobicContact CE2-SD 4.49Å; Y1278-M1402 HydrophobicContact CG-CE 3.97Å; Y1278-M1402 HydrophobicContact CG-SD 3.96Å; Y1278-I1410 HydrophobicContact CE1-CB 4.48Å; Y1278-I1410 HydrophobicContact CE1-CD1 3.73Å; Y1278-I1410 HydrophobicContact CE1-CG1 3.99Å; Y1278-I1410 HydrophobicContact CE1-CG2 4.29Å; Y1278-I1410 HydrophobicContact CE2-CG1 4.34Å; Y1278-I1410 WeakPolarHBondContact OH-CD1 3.5Å; Y1278-I1410 WeakPolarHBondContact OH-CG1 3.38Å
1279	D	80.8	Confident	88.8	Confident	69 Å²	69	24.4 Å²	24.4	37%	0.369	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	-132.3	-175.5	-170.8	-10	0	0	0	108.8	D1222 T1281	D1222-D1279 VanDerWaalsContact OD2-CA 3.28Å; D1222-D1279 WeakPolarHBondContact OD2-CA 3.24Å; D1279-T1281 PolarHBondContact O-N 2.98Å
1280	N	85.2	Confident	89.6	Confident	54 Å²	54	23.2 Å²	23.2	29%	0.289	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	30.8	172.3	-65.1	-67.9	0	0	0	112.4	Y1278 Q1295 I1296	Y1278-N1280 PolarHBondContact O-N 3.44Å; N1280-Q1295 CarbonylContact O-C 3.57Å; N1280-Q1295 WeakPolarHBondContact O-CA 3.22Å; N1280-Q1295 VanDerWaalsContact O-CD 3.32Å; N1280-Q1295 PolarHBondContact O-NE2 3.36Å; N1280-I1296 PolarHBondContact O-N 3.09Å
1281	T	88.4	Confident	90.2	Very high	14 Å²	14	20.1 Å²	20.1	9%	0.086	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	149.5	175.6	67	0	0	0	0	112.2	Y1278 D1279 W1283 Y1294	Y1278-T1281 PolarHBondContact N-O 3.07Å; Y1278-T1281 CarbonylContact O-C 3.24Å; Y1278-T1281 WeakPolarHBondContact O-CA 3.38Å; Y1278-T1281 WeakPolarHBondContact O-CB 3.37Å; Y1278-T1281 PolarHBondContact O-N 3.28Å; Y1278-T1281 PolarHBondContact O-OG1 2.9Å; D1279-T1281 PolarHBondContact O-N 2.98Å; T1281-W1283 PolarHBondContact OG1-NE1 3.08Å; T1281-Y1294 CarbonylContact C-O 3.56Å; T1281-Y1294 WeakPolarHBondContact CA-O 3.38Å
1282	L	92.9	Very high	90.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	115.3	173.5	-174.9	68.9	0	0	0	109	W1226 I1235 I1275 P1277 I1284 V1293 Y1294 I1296 L1384	W1226-L1282 HydrophobicContact CD2-CD1 3.84Å; W1226-L1282 HydrophobicContact CD2-CD2 4.11Å; W1226-L1282 HydrophobicContact CE3-CD1 4.32Å; W1226-L1282 HydrophobicContact CE3-CD2 3.79Å; W1226-L1282 HydrophobicContact CG-CD1 4.03Å; W1226-L1282 HydrophobicContact CH2-CD2 3.83Å; W1226-L1282 HydrophobicContact CZ2-CD1 4.48Å; W1226-L1282 HydrophobicContact CZ2-CD2 4.12Å; W1226-L1282 HydrophobicContact CZ3-CD2 3.65Å; I1235-L1282 HydrophobicContact CD1-CD2 3.38Å; I1275-L1282 HydrophobicContact CG2-CD1 3.37Å; I1275-L1282 HydrophobicContact CG2-CG 4.14Å; P1277-L1282 HydrophobicContact CB-CD1 3.88Å; L1282-I1284 HydrophobicContact CD2-CD1 3.98Å; L1282-I1284 HydrophobicContact CD2-CG1 4.34Å; L1282-I1284 HydrophobicContact CG-CD1 4.28Å; L1282-I1284 HydrophobicContact CG-CG1 4.11Å; L1282-V1293 WeakPolarHBondContact O-CA 3.32Å; L1282-Y1294 PolarHBondContact N-O 3.46Å; L1282-Y1294 PolarHBondContact O-N 3.26Å; L1282-I1296 HydrophobicContact CB-CD1 4.27Å; L1282-I1296 HydrophobicContact CB-CG1 4.47Å; L1282-L1384 HydrophobicContact CD2-CD2 4.3Å
1283	W	93.8	Very high	90.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	136.1	177	-67.5	66.6	0	0	0	110	I1275 L1276 T1281 V1291 L1292 V1293 L1400 I1412 W1428 W1438	I1275-W1283 CarbonylContact C-O 3.26Å; I1275-W1283 WeakPolarHBondContact CA-O 3.42Å; L1276-W1283 HydrophobicContact CB-CB 4.15Å; L1276-W1283 PolarHBondContact N-O 2.99Å; L1276-W1283 WeakPolarHBondContact O-CB 3.4Å; L1276-W1283 PolarHBondContact O-N 3.34Å; T1281-W1283 PolarHBondContact OG1-NE1 3.08Å; W1283-V1291 HydrophobicContact CE3-CG1 3.64Å; W1283-V1291 HydrophobicContact CZ3-CG1 3.9Å; W1283-L1292 CarbonylContact C-O 3.37Å; W1283-L1292 WeakPolarHBondContact CA-O 3.49Å; W1283-V1293 HydrophobicContact CD2-CB 4.48Å; W1283-V1293 HydrophobicContact CD2-CG1 4.24Å; W1283-V1293 HydrophobicContact CD2-CG2 3.54Å; W1283-V1293 HydrophobicContact CE3-CG2 3.51Å; W1283-V1293 HydrophobicContact CG-CG1 4.43Å; W1283-V1293 HydrophobicContact CG-CG2 4.23Å; W1283-V1293 HydrophobicContact CH2-CG2 3.79Å; W1283-V1293 HydrophobicContact CZ2-CG1 4.15Å; W1283-V1293 HydrophobicContact CZ2-CG2 3.81Å; W1283-V1293 HydrophobicContact CZ3-CG2 3.64Å; W1283-L1400 HydrophobicContact CB-CD1 4.01Å; W1283-I1412 HydrophobicContact CD2-CD1 3.95Å; W1283-I1412 HydrophobicContact CE3-CD1 4.44Å; W1283-I1412 HydrophobicContact CE3-CG2 4.24Å; W1283-I1412 HydrophobicContact CH2-CD1 4Å; W1283-I1412 HydrophobicContact CZ2-CD1 3.43Å; W1283-I1412 VanDerWaalsContact CZ2-CD1 3.43Å; W1283-I1412 HydrophobicContact CZ3-CD1 4.47Å; W1283-I1412 HydrophobicContact CZ3-CG2 4.32Å; W1283-W1428 HydrophobicContact CH2-CB 4.27Å; W1283-W1428 HydrophobicContact CH2-CD2 4.21Å; W1283-W1428 HydrophobicContact CH2-CE3 4.1Å; W1283-W1428 HydrophobicContact CH2-CG 4.32Å; W1283-W1428 HydrophobicContact CZ3-CB 4.46Å; W1283-W1428 AromaticContact CZ3-CD2 3.84Å; W1283-W1428 HydrophobicContact CZ3-CD2 3.84Å; W1283-W1428 AromaticContact CZ3-CE3 3.99Å; W1283-W1428 HydrophobicContact CZ3-CE3 3.99Å; W1283-W1428 HydrophobicContact CZ3-CG 4.06Å; W1283-W1438 HydrophobicContact CH2-CB 4.26Å; W1283-W1438 AromaticContact CH2-CD2 3.63Å; W1283-W1438 HydrophobicContact CH2-CD2 3.63Å; W1283-W1438 AromaticContact CH2-CE3 3.75Å; W1283-W1438 HydrophobicContact CH2-CE3 3.75Å; W1283-W1438 AromaticContact CH2-CG 3.85Å; W1283-W1438 HydrophobicContact CH2-CG 3.85Å; W1283-W1438 HydrophobicContact CH2-CZ3 4.29Å; W1283-W1438 AromaticContact CZ2-CD2 3.53Å; W1283-W1438 HydrophobicContact CZ2-CD2 3.53Å; W1283-W1438 AromaticContact CZ2-CE2 3.5Å; W1283-W1438 AromaticContact CZ2-CE3 3.85Å; W1283-W1438 HydrophobicContact CZ2-CE3 3.85Å; W1283-W1438 AromaticContact CZ2-CG 3.96Å; W1283-W1438 HydrophobicContact CZ2-CG 3.96Å; W1283-W1438 HydrophobicContact CZ2-CH2 4.08Å; W1283-W1438 AromaticContact CZ2-CZ2 3.8Å; W1283-W1438 HydrophobicContact CZ2-CZ2 3.8Å; W1283-W1438 HydrophobicContact CZ2-CZ3 4.11Å; W1283-W1438 AromaticContact CZ2-NE1 3.87Å
1284	I	93.9	Very high	90.1	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	124.8	-174.8	-50.4	-175.6	0	0	0	108.7	I1235 I1251 V1272 V1274 L1282 V1291 L1292 Y1294	I1235-I1284 HydrophobicContact CD1-CD1 3.87Å; I1251-I1284 HydrophobicContact CD1-CD1 3.49Å; I1251-I1284 VanDerWaalsContact CD1-CD1 3.49Å; I1251-I1284 HydrophobicContact CD1-CG2 4.03Å; I1251-I1284 HydrophobicContact CG1-CD1 3.86Å; V1272-I1284 HydrophobicContact CB-CG2 4.43Å; V1272-I1284 HydrophobicContact CG1-CG2 3.87Å; V1272-I1284 HydrophobicContact CG2-CG2 3.94Å; V1274-I1284 WeakPolarHBondContact O-CA 3.49Å; L1282-I1284 HydrophobicContact CD2-CD1 3.98Å; L1282-I1284 HydrophobicContact CD2-CG1 4.34Å; L1282-I1284 HydrophobicContact CG-CD1 4.28Å; L1282-I1284 HydrophobicContact CG-CG1 4.11Å; I1284-V1291 CarbonylContact O-C 3.54Å; I1284-V1291 WeakPolarHBondContact O-CA 3.49Å; I1284-L1292 HydrophobicContact CB-CB 4.28Å; I1284-L1292 PolarHBondContact N-O 3.47Å; I1284-L1292 PolarHBondContact O-N 3.44Å; I1284-Y1294 HydrophobicContact CD1-CD2 3.98Å; I1284-Y1294 HydrophobicContact CD1-CE2 3.94Å
1285	G	93.3	Very high	89.9	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.7	166.8	0	0	0	0	0	110.1	T1273 V1274 E1290	T1273-G1285 PolarHBondContact N-O 3.03Å; T1273-G1285 VanDerWaalsContact OG1-C 3.23Å; T1273-G1285 PolarHBondContact OG1-O 2.65Å; V1274-G1285 PolarHBondContact N-O 3.36Å; V1274-G1285 PolarHBondContact O-N 3.05Å; G1285-E1290 WeakPolarHBondContact CA-O 3.42Å
1286	T	93	Very high	89.7	Confident	2 Å²	2	18.6 Å²	18.6	1%	0.012	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	161.2	178.6	76.5	0	0	0	0	112.5	R1271 T1273 M1288 G1289 E1290 L1292 I1397	R1271-T1286 CarbonylContact O-C 3.48Å; R1271-T1286 WeakPolarHBondContact O-CA 3.46Å; T1273-T1286 PolarHBondContact OG1-O 3.37Å; T1286-M1288 PolarHBondContact O-N 3Å; T1286-M1288 PolarHBondContact OG1-N 3.11Å; T1286-G1289 PolarHBondContact O-N 2.98Å; T1286-E1290 HydrophobicContact CG2-CB 4.25Å; T1286-E1290 PolarHBondContact N-O 3.29Å; T1286-E1290 WeakPolarHBondContact OG1-CB 3.48Å; T1286-E1290 PolarHBondContact OG1-N 3.35Å; T1286-E1290 VanDerWaalsContact OG1-N 3.16Å; T1286-L1292 HydrophobicContact CG2-CD1 3.86Å; T1286-L1292 HydrophobicContact CG2-CG 4.18Å; T1286-I1397 PolarHBondContact O-N 2.91Å
1287	G	87.9	Confident	89.3	Confident	8 Å²	8	19.1 Å²	19.1	8%	0.082	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-17	172.6	0	0	0	0	0	114.6	P1269 R1271 P1396	P1269-G1287 CarbonylContact O-C 3.27Å; P1269-G1287 VanDerWaalsContact O-C 3.24Å; P1269-G1287 VanDerWaalsContact O-CA 3.24Å; P1269-G1287 WeakPolarHBondContact O-CA 3.5Å; R1271-G1287 PolarHBondContact O-N 3.48Å; G1287-P1396 WeakPolarHBondContact O-CG 3.34Å
1288	M	85.4	Confident	88.8	Confident	80 Å²	80	20.8 Å²	20.8	39%	0.394	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	8.1	174.5	-71.9	-59.7	-76.2	0	0	112.9	P1269 Q1270 T1286 E1290 K1391	P1269-M1288 HydrophobicContact CB-CG 3.89Å; P1269-M1288 HydrophobicContact CB-SD 3.56Å; P1269-M1288 VanDerWaalsContact CB-SD 3.56Å; P1269-M1288 WeakPolarHBondContact O-CG 3.44Å; P1269-M1288 PolarHBondContact O-N 2.86Å; Q1270-M1288 HydrophobicContact CG-CG 4.18Å; T1286-M1288 PolarHBondContact O-N 3Å; T1286-M1288 PolarHBondContact OG1-N 3.11Å; M1288-E1290 VanDerWaalsContact C-N 3.3Å; M1288-E1290 HydrophobicContact CB-CG 4.43Å; M1288-E1290 PolarHBondContact O-N 2.97Å; M1288-K1391 WeakPolarHBondContact O-CD 3.44Å; M1288-K1391 WeakPolarHBondContact O-CE 3.39Å; M1288-K1391 PolarHBondContact O-NZ 3.44Å
1289	G	85.8	Confident	88.6	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	S	Bend	trans	73.1	22.8	-178.3	0	0	0	0	0	113.8	T1286 V1392 A1393 T1395	T1286-G1289 PolarHBondContact O-N 2.98Å; G1289-V1392 PolarHBondContact O-N 3.23Å; G1289-A1393 WeakPolarHBondContact CA-O 3.33Å; G1289-A1393 PolarHBondContact O-N 3.43Å; G1289-A1393 VanDerWaalsContact O-N 3.12Å; G1289-T1395 WeakPolarHBondContact CA-O 3.31Å
1290	E	91	Very high	88.2	Confident	25 Å²	25	22.3 Å²	22.3	12%	0.117	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	143.4	171.2	-55.9	-179.7	123	0	0	110.7	G1285 T1286 M1288 L1292 R1389 S1390 K1391	G1285-E1290 WeakPolarHBondContact CA-O 3.42Å; T1286-E1290 HydrophobicContact CG2-CB 4.25Å; T1286-E1290 PolarHBondContact N-O 3.29Å; T1286-E1290 WeakPolarHBondContact OG1-CB 3.48Å; T1286-E1290 PolarHBondContact OG1-N 3.35Å; T1286-E1290 VanDerWaalsContact OG1-N 3.16Å; M1288-E1290 VanDerWaalsContact C-N 3.3Å; M1288-E1290 HydrophobicContact CB-CG 4.43Å; M1288-E1290 PolarHBondContact O-N 2.97Å; E1290-L1292 HydrophobicContact CB-CD2 4.45Å; E1290-R1389 IonicContact OE1-CZ 3.48Å; E1290-R1389 VanDerWaalsContact OE1-CZ 3.28Å; E1290-R1389 IonicContact OE1-NE 2.58Å; E1290-R1389 PolarHBondContact OE1-NE 2.98Å; E1290-R1389 IonicContact OE1-NH2 2.84Å; E1290-R1389 PolarHBondContact OE1-NH2 3.48Å; E1290-R1389 IonicContact OE2-CZ 3.11Å; E1290-R1389 IonicContact OE2-NE 2.63Å; E1290-R1389 IonicContact OE2-NH2 3.38Å; E1290-R1389 PolarHBondContact OE2-NH2 3.25Å; E1290-R1389 VanDerWaalsContact OE2-NH2 3.12Å; E1290-S1390 CarbonylContact C-O 3.57Å; E1290-S1390 WeakPolarHBondContact CA-O 3.49Å; E1290-K1391 HydrophobicContact CG-CB 4.23Å; E1290-K1391 HydrophobicContact CG-CD 3.96Å
1291	V	91.4	Very high	87.1	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.7	165.6	178	0	0	0	0	108.3	W1283 I1284 S1390 V1392 I1397 W1428	W1283-V1291 HydrophobicContact CE3-CG1 3.64Å; W1283-V1291 HydrophobicContact CZ3-CG1 3.9Å; I1284-V1291 CarbonylContact O-C 3.54Å; I1284-V1291 WeakPolarHBondContact O-CA 3.49Å; V1291-S1390 PolarHBondContact N-O 3.09Å; V1291-S1390 PolarHBondContact O-N 3.44Å; V1291-V1392 HydrophobicContact CG2-CG2 3.74Å; V1291-I1397 HydrophobicContact CG2-CD1 4.24Å; V1291-I1397 HydrophobicContact CG2-CG1 3.98Å; V1291-I1397 HydrophobicContact CG2-CG2 4.46Å; V1291-W1428 HydrophobicContact CB-CH2 4.24Å; V1291-W1428 HydrophobicContact CB-CZ2 3.95Å; V1291-W1428 HydrophobicContact CG1-CH2 4.37Å; V1291-W1428 HydrophobicContact CG1-CZ2 4.09Å; V1291-W1428 HydrophobicContact CG2-CZ2 3.96Å
1292	L	91.2	Very high	85.2	Confident	7 Å²	7	27.2 Å²	27.2	4%	0.037	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.8	177.7	-50.7	175.5	0	0	0	109.4	I1251 W1283 I1284 T1286 E1290 Y1294 V1388 R1389	I1251-L1292 HydrophobicContact CG2-CD1 3.2Å; W1283-L1292 CarbonylContact C-O 3.37Å; W1283-L1292 WeakPolarHBondContact CA-O 3.49Å; I1284-L1292 HydrophobicContact CB-CB 4.28Å; I1284-L1292 PolarHBondContact N-O 3.47Å; I1284-L1292 PolarHBondContact O-N 3.44Å; T1286-L1292 HydrophobicContact CG2-CD1 3.86Å; T1286-L1292 HydrophobicContact CG2-CG 4.18Å; E1290-L1292 HydrophobicContact CB-CD2 4.45Å; L1292-Y1294 HydrophobicContact CB-CE2 3.96Å; L1292-Y1294 HydrophobicContact CD1-CE2 4.41Å; L1292-V1388 WeakPolarHBondContact CA-O 3.4Å; L1292-R1389 HydrophobicContact CD2-CB 3.76Å; L1292-R1389 HydrophobicContact CD2-CG 3.52Å
1293	V	90.7	Very high	82.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.2	176.6	-171.5	0	0	0	0	109.1	L1282 W1283 I1387 V1388	L1282-V1293 WeakPolarHBondContact O-CA 3.32Å; W1283-V1293 HydrophobicContact CD2-CB 4.48Å; W1283-V1293 HydrophobicContact CD2-CG1 4.24Å; W1283-V1293 HydrophobicContact CD2-CG2 3.54Å; W1283-V1293 HydrophobicContact CE3-CG2 3.51Å; W1283-V1293 HydrophobicContact CG-CG1 4.43Å; W1283-V1293 HydrophobicContact CG-CG2 4.23Å; W1283-V1293 HydrophobicContact CH2-CG2 3.79Å; W1283-V1293 HydrophobicContact CZ2-CG1 4.15Å; W1283-V1293 HydrophobicContact CZ2-CG2 3.81Å; W1283-V1293 HydrophobicContact CZ3-CG2 3.64Å; V1293-I1387 PolarHBondContact O-N 3.47Å; V1293-V1388 HydrophobicContact CB-CB 3.83Å; V1293-V1388 HydrophobicContact CB-CG2 4.14Å; V1293-V1388 HydrophobicContact CG2-CB 3.85Å; V1293-V1388 HydrophobicContact CG2-CG1 4.46Å; V1293-V1388 HydrophobicContact CG2-CG2 4.28Å; V1293-V1388 PolarHBondContact N-O 3.39Å; V1293-V1388 PolarHBondContact O-N 3.28Å
1294	Y	90.8	Very high	80.3	Confident	1 Å²	1	43.1 Å²	43.1	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.3	175.4	-69.4	-96	0	0	0	110.5	F1249 I1251 T1281 L1282 I1284 L1292 L1384 Q1385 K1386	F1249-Y1294 HydrophobicContact CE1-CD1 4.34Å; F1249-Y1294 AromaticContact CE1-CE1 3.68Å; F1249-Y1294 HydrophobicContact CE1-CE1 3.68Å; F1249-Y1294 AromaticContact CE1-CZ 3.89Å; F1249-Y1294 HydrophobicContact CZ-CD1 4.5Å; F1249-Y1294 AromaticContact CZ-CE1 3.84Å; F1249-Y1294 HydrophobicContact CZ-CE1 3.84Å; I1251-Y1294 HydrophobicContact CG2-CE2 4.33Å; T1281-Y1294 CarbonylContact C-O 3.56Å; T1281-Y1294 WeakPolarHBondContact CA-O 3.38Å; L1282-Y1294 PolarHBondContact N-O 3.46Å; L1282-Y1294 PolarHBondContact O-N 3.26Å; I1284-Y1294 HydrophobicContact CD1-CD2 3.98Å; I1284-Y1294 HydrophobicContact CD1-CE2 3.94Å; L1292-Y1294 HydrophobicContact CB-CE2 3.96Å; L1292-Y1294 HydrophobicContact CD1-CE2 4.41Å; Y1294-L1384 HydrophobicContact CD1-CB 3.99Å; Y1294-L1384 HydrophobicContact CG-CD2 4.4Å; Y1294-Q1385 CarbonylContact C-O 3.55Å; Y1294-Q1385 WeakPolarHBondContact CA-O 3.43Å; Y1294-K1386 HydrophobicContact CD1-CB 3.84Å; Y1294-K1386 HydrophobicContact CD1-CG 4.43Å; Y1294-K1386 HydrophobicContact CE1-CB 3.57Å; Y1294-K1386 HydrophobicContact CE1-CD 4.42Å; Y1294-K1386 HydrophobicContact CE1-CG 4.04Å
1295	Q	89.3	Confident	77.6	Confident	53 Å²	53	52.5 Å²	52.5	25%	0.248	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	130.2	162.5	-164	63.7	34.6	0	0	109.4	N1280 H1297 L1384 Q1385 I1387	N1280-Q1295 CarbonylContact O-C 3.57Å; N1280-Q1295 WeakPolarHBondContact O-CA 3.22Å; N1280-Q1295 VanDerWaalsContact O-CD 3.32Å; N1280-Q1295 PolarHBondContact O-NE2 3.36Å; Q1295-H1297 VanDerWaalsContact CG-CE1 3.44Å; Q1295-H1297 WeakPolarHBondContact CG-CE1 3.33Å; Q1295-L1384 CarbonylContact O-C 3.56Å; Q1295-L1384 WeakPolarHBondContact O-CA 3.46Å; Q1295-Q1385 HydrophobicContact CB-CB 4.43Å; Q1295-Q1385 PolarHBondContact N-O 3.27Å; Q1295-Q1385 PolarHBondContact O-N 3.22Å; Q1295-I1387 HydrophobicContact CB-CD1 3.51Å; Q1295-I1387 HydrophobicContact CB-CG1 3.91Å; Q1295-I1387 HydrophobicContact CG-CD1 4.2Å; Q1295-I1387 VanDerWaalsContact OE1-CD1 3.25Å
1296	I	89.4	Confident	74.6	Confident	4 Å²	4	63 Å²	63	2%	0.021	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	117.5	173.2	-51.9	162.7	0	0	0	107.8	N1223 W1226 N1280 L1282 Y1382 L1384	N1223-I1296 WeakPolarHBondContact ND2-CG2 3.42Å; W1226-I1296 HydrophobicContact CZ2-CD1 3.78Å; W1226-I1296 HydrophobicContact CZ2-CG1 4.36Å; N1280-I1296 PolarHBondContact O-N 3.09Å; L1282-I1296 HydrophobicContact CB-CD1 4.27Å; L1282-I1296 HydrophobicContact CB-CG1 4.47Å; I1296-Y1382 HydrophobicContact CG2-CD1 4.1Å; I1296-L1384 HydrophobicContact CG1-CD2 3.82Å
1297	H	85.6	Confident	71.7	Confident	35 Å²	35	68.1 Å²	68.1	16%	0.162	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	128.8	171.9	-61.9	90.2	0	0	0	109.5	Q1295 Y1299 Y1382 E1383 Q1385	Q1295-H1297 VanDerWaalsContact CG-CE1 3.44Å; Q1295-H1297 WeakPolarHBondContact CG-CE1 3.33Å; H1297-Y1299 HydrophobicContact CB-CE2 3.89Å; H1297-Y1382 CarbonylContact O-C 3.59Å; H1297-Y1382 WeakPolarHBondContact O-CA 3.46Å; H1297-E1383 HydrophobicContact CB-CB 4.22Å; H1297-E1383 PolarHBondContact N-O 3.23Å; H1297-E1383 PolarHBondContact O-N 3.14Å; H1297-Q1385 PolarHBondContact CE1-OE1 3.43Å
1298	T	82.1	Confident	69	Low	48 Å²	48	75.1 Å²	75.1	29%	0.294	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	120.2	-178.3	-51.2	0	0	0	0	109.6	N1223 Y1380 I1381 Y1382	N1223-T1298 PolarHBondContact OD1-OG1 3.38Å; T1298-Y1380 HydrophobicContact CG2-CD1 3.74Å; T1298-Y1380 HydrophobicContact CG2-CG 3.98Å; T1298-I1381 WeakPolarHBondContact CA-O 3.42Å; T1298-Y1382 HydrophobicContact CG2-CD1 3.94Å; T1298-Y1382 HydrophobicContact CG2-CE1 3.49Å; T1298-Y1382 VanDerWaalsContact CG2-CE1 3.49Å; T1298-Y1382 WeakPolarHBondContact OG1-CD1 3.27Å; T1298-Y1382 WeakPolarHBondContact OG1-CE1 3.34Å
1299	Y	77.7	Confident	66.3	Low	51 Å²	51	80.2 Å²	80.2	20%	0.2	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134	179.7	-54.6	-85.7	0	0	0	110.6	H1297 M1314 Y1380 I1381 E1383	H1297-Y1299 HydrophobicContact CB-CE2 3.89Å; Y1299-M1314 HydrophobicContact CD1-CE 3.87Å; Y1299-M1314 HydrophobicContact CD2-CE 3.96Å; Y1299-M1314 HydrophobicContact CE1-CE 4.45Å; Y1299-M1314 HydrophobicContact CG-CE 3.59Å; Y1299-Y1380 CarbonylContact O-C 3.56Å; Y1299-Y1380 WeakPolarHBondContact O-CA 3.45Å; Y1299-I1381 PolarHBondContact N-O 2.9Å; Y1299-I1381 PolarHBondContact O-N 2.92Å; Y1299-E1383 HydrophobicContact CE2-CB 3.92Å; Y1299-E1383 VanDerWaalsContact CE2-OE2 3.24Å; Y1299-E1383 WeakPolarHBondContact CE2-OE2 3.48Å; Y1299-E1383 PolarHBondContact OH-OE2 3.05Å
1300	Q	72.6	Confident	63.5	Low	87 Å²	87	82.9 Å²	82.9	41%	0.407	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	132.2	175.5	-168.8	173.4	-7.5	0	0	110.5	T1302 N1379 Y1380	Q1300-T1302 PolarHBondContact O-N 3.36Å; Q1300-N1379 WeakPolarHBondContact CA-O 3.47Å; Q1300-Y1380 HydrophobicContact CB-CD1 4.06Å; Q1300-Y1380 HydrophobicContact CB-CE1 3.87Å; Q1300-Y1380 HydrophobicContact CG-CD1 4.35Å; Q1300-Y1380 HydrophobicContact CG-CE1 3.92Å
1301	K	63	Low	60.6	Low	87 Å²	87	88 Å²	88	38%	0.378	45%	0.449	S	S	.	.			trans	-68.7	114.2	172	-70.8	177.3	-177.4	160.4	0	109	A1375 S1378 N1379 I1381	K1301-A1375 PolarHBondContact NZ-O 3.4Å; K1301-S1378 WeakPolarHBondContact CE-O 3.38Å; K1301-S1378 PolarHBondContact NZ-O 3.23Å; K1301-N1379 PolarHBondContact N-O 2.95Å; K1301-I1381 HydrophobicContact CG-CD1 4.11Å; K1301-I1381 HydrophobicContact CG-CG1 4.14Å
1302	T	47.4	Very low	57.6	Low	83 Å²	83	94.9 Å²	94.9	51%	0.509	49%	0.485	S	S	.	.			trans	-84.3	115.5	170.8	53.7	0	0	0	0	109.9	Q1300 K1304	Q1300-T1302 PolarHBondContact O-N 3.36Å; T1302-K1304 PolarHBondContact O-N 3.04Å
1303	E	45.6	Very low	54.5	Low	192 Å²	192	102.3 Å²	102.3	90%	0.897	52%	0.519	S	S	*	.			trans	-67.8	98.5	170.6	-69.6	-176.4	169.3	0	0	109.9	K1305	E1303-K1305 PolarHBondContact O-N 2.87Å
1304	K	38.9	Very low	51.5	Low	143 Å²	143	107.3 Å²	107.3	62%	0.622	54%	0.544	S	S	*	.			trans	-71.4	109.7	168.2	-82.3	-170.2	177.9	-176.5	0	108.7	T1302 K1306 G1310	T1302-K1304 PolarHBondContact O-N 3.04Å; K1304-K1306 PolarHBondContact O-N 3.47Å; K1304-G1310 PolarHBondContact NZ-O 3.41Å
1305	K	36.4	Very low	48.6	Very low	197 Å²	197	111.7 Å²	111.7	86%	0.857	57%	0.571	S	S	*	*			trans	-53.3	128.2	159.4	-82.5	-176.8	175.9	178.5	0	108.2	E1303 S1307	E1303-K1305 PolarHBondContact O-N 2.87Å; K1305-S1307 PolarHBondContact O-N 3.2Å
1306	K	32.1	Very low	45.8	Very low	219 Å²	219	118 Å²	118	95%	0.952	59%	0.592	S	S	*	*	S	Bend	trans	-44.3	105.2	-177.7	-70.3	177.5	175.6	179.1	0	112.1	K1304	K1304-K1306 PolarHBondContact O-N 3.47Å
1307	S	31.2	Very low	42.9	Very low	111 Å²	111	125.2 Å²	125.2	78%	0.776	63%	0.626	S	S	*	*			trans	-142.1	129.5	153.9	60.1	0	0	0	0	107.9	K1305	K1305-S1307 PolarHBondContact O-N 3.2Å
1308	L	31.2	Very low	40.2	Very low	155 Å²	155	131.5 Å²	131.5	81%	0.812	65%	0.653	S	S	*	*	S	Bend	trans	-42.5	142.9	-171.5	-110.9	71.7	0	0	0	114.8
1309	E	28	Very low	37.5	Very low	186 Å²	186	140.4 Å²	140.4	87%	0.869	68%	0.681	S	S	*	*			trans	56.7	102.4	156	-63.1	-179.1	171.4	0	0	117.7
1310	G	28.1	Very low	35	Very low	56 Å²	56	143.5 Å²	143.5	58%	0.577	71%	0.71	S	S	*	*			trans	157.7	114.6	163.6	0	0	0	0	0	115	K1304	K1304-G1310 PolarHBondContact NZ-O 3.41Å
1311	T	29.9	Very low	32.8	Very low	132 Å²	132	145.6 Å²	145.6	81%	0.81	73%	0.729	S	S	*	*			trans	-21.5	138.5	175.6	-42.8	0	0	0	0	117.2	Q1313	T1311-Q1313 PolarHBondContact O-N 2.94Å
1312	I	28	Very low	31.1	Very low	145 Å²	145	147 Å²	147	74%	0.744	75%	0.75	S	S	*	*			trans	-56.3	119.1	177.4	-58.3	167.9	0	0	0	109.8	M1314	I1312-M1314 HydrophobicContact CG2-CG 4.31Å
1313	Q	26.7	Very low	30.2	Very low	164 Å²	164	150.4 Å²	150.4	77%	0.766	76%	0.764	S	S	*	*			trans	-108.7	115.7	165.5	-87	-173.7	-12.7	0	0	108.8	T1311	T1311-Q1313 PolarHBondContact O-N 2.94Å
1314	M	27.5	Very low	29.4	Very low	104 Å²	104	149.8 Å²	149.8	51%	0.512	76%	0.758	S	S	.	*	P	Polyproline II helix	trans	-80.8	116.4	175.2	-65.5	-84.4	-83.7	0	0	108.8	Y1299 I1312	Y1299-M1314 HydrophobicContact CD1-CE 3.87Å; Y1299-M1314 HydrophobicContact CD2-CE 3.96Å; Y1299-M1314 HydrophobicContact CE1-CE 4.45Å; Y1299-M1314 HydrophobicContact CG-CE 3.59Å; I1312-M1314 HydrophobicContact CG2-CG 4.31Å
1315	T	30.3	Very low	29.2	Very low	94 Å²	94	150.4 Å²	150.4	58%	0.577	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-88.6	117.5	176.8	37.4	0	0	0	0	110.9
1316	R	30.5	Very low	29	Very low	185 Å²	185	149.2 Å²	149.2	70%	0.698	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-77.3	128	175.9	-169	176.1	-175.9	172.4	3.1	110	K1318	R1316-K1318 PolarHBondContact O-N 3.46Å
1317	H	27	Very low	28.8	Very low	156 Å²	156	147 Å²	147	72%	0.722	76%	0.764	S	S	*	*			trans	-67.7	103.8	168.8	-109.6	-70.6	0	0	0	109.4	R1319	H1317-R1319 PolarHBondContact O-N 3.29Å
1318	K	29.7	Very low	28.8	Very low	167 Å²	167	150.7 Å²	150.7	73%	0.726	77%	0.768	S	S	*	*			trans	-82.1	101.6	167.7	-76.7	-174.8	175.3	-176.7	0	108.7	R1316	R1316-K1318 PolarHBondContact O-N 3.46Å
1319	R	25.9	Very low	29	Very low	234 Å²	234	151.3 Å²	151.3	88%	0.883	77%	0.772	S	S	*	*			trans	-69.4	133	150	-81.8	-176.8	175.4	170.7	-0.6	107	H1317 T1321	H1317-R1319 PolarHBondContact O-N 3.29Å; R1319-T1321 PolarHBondContact O-N 3.47Å
1320	S	24.1	Very low	29.1	Very low	116 Å²	116	149.8 Å²	149.8	81%	0.811	77%	0.768	S	S	*	*	S	Bend	trans	-59.8	112.9	-168.7	50.6	0	0	0	0	113.3
1321	T	26.6	Very low	29.3	Very low	131 Å²	131	149.7 Å²	149.7	80%	0.804	77%	0.767	S	S	*	*			trans	-159.2	128.1	145.3	42.2	0	0	0	0	108.5	R1319 L1323	R1319-T1321 PolarHBondContact O-N 3.47Å; T1321-L1323 PolarHBondContact O-N 3.39Å
1322	S	28.3	Very low	29.5	Very low	117 Å²	117	151.9 Å²	151.9	82%	0.818	77%	0.768	S	S	*	*			trans	-70.9	118.9	-176.8	58.7	0	0	0	0	111.8
1323	L	27.8	Very low	29.6	Very low	154 Å²	154	151 Å²	151	81%	0.806	77%	0.77	S	S	*	*			trans	-152.6	91.1	159.1	-102	135.8	0	0	0	105.7	T1321	T1321-L1323 PolarHBondContact O-N 3.39Å
1324	K	29.6	Very low	29.8	Very low	179 Å²	179	149 Å²	149	78%	0.778	77%	0.768	S	S	*	*			trans	-109.9	4.1	-172.8	-131.9	-173.7	179.9	-171.2	0	114.2
1325	D	35	Very low	29.8	Very low	156 Å²	156	154.2 Å²	154.2	83%	0.834	78%	0.782	S	S	*	*	S	Bend	trans	-118.9	1.9	-167.4	-65.6	-25.6	0	0	0	117.1
1326	E	31.9	Very low	29.9	Very low	172 Å²	172	159 Å²	159	80%	0.804	80%	0.795	S	S	*	*	S	Bend	trans	-106.4	-0.9	179.7	-86.4	-172.2	156.4	0	0	116.8
1327	L	27.2	Very low	29.8	Very low	173 Å²	173	156.1 Å²	156.1	91%	0.906	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	11.6	-177.4	-93.9	159.5	0	0	0	115.5
1328	Q	32.2	Very low	29.9	Very low	188 Å²	188	156.7 Å²	156.7	88%	0.879	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-1.9	178.6	-104.2	-178.5	3.8	0	0	116
1329	L	34.2	Very low	29.7	Very low	169 Å²	169	156.2 Å²	156.2	89%	0.885	81%	0.81	S	S	*	*	S	Bend	trans	-106	-2.4	-174.2	-134	83.2	0	0	0	117.3
1330	I	30.3	Very low	29.6	Very low	154 Å²	154	154.8 Å²	154.8	79%	0.79	81%	0.81	S	S	*	*	S	Bend	trans	-114.8	15.8	-176.7	-52	178.5	0	0	0	112.2
1331	G	32.3	Very low	29.7	Very low	53 Å²	53	154.3 Å²	154.3	55%	0.546	81%	0.807	S	S	.	*	S	Bend	trans	-91	-11.1	-172.9	0	0	0	0	0	117.6
1332	E	33.4	Very low	29.7	Very low	178 Å²	178	154.5 Å²	154.5	83%	0.832	81%	0.808	S	S	*	*	S	Bend	trans	-106.1	-15.7	-166.8	-72.7	-164.4	147.5	0	0	116.4
1333	T	30.6	Very low	29.5	Very low	128 Å²	128	160.6 Å²	160.6	79%	0.785	81%	0.813	S	S	*	*	S	Bend	trans	-89.4	-18.9	-171.6	-18.9	0	0	0	0	114.8
1334	T	30.8	Very low	29.4	Very low	120 Å²	120	159.1 Å²	159.1	74%	0.736	82%	0.815	S	S	*	*	S	Bend	trans	-99.5	-5	-176.3	23.8	0	0	0	0	115
1335	R	28.8	Very low	29.3	Very low	215 Å²	215	156.3 Å²	156.3	81%	0.811	81%	0.814	S	S	*	*	S	Bend	trans	-88.5	-6.4	-174.2	-129.2	176.5	-172.1	162.2	2.1	115.7
1336	K	30.9	Very low	28.9	Very low	195 Å²	195	154.1 Å²	154.1	85%	0.848	81%	0.811	S	S	*	*	S	Bend	trans	-97.5	-4.6	-174.2	-84.7	-176.5	177.4	173.5	0	116.4
1337	T	30.2	Very low	28.6	Very low	124 Å²	124	153.1 Å²	153.1	76%	0.761	81%	0.812	S	S	*	*	S	Bend	trans	-105.3	3.1	-171.8	-13.7	0	0	0	0	116
1338	L	27.7	Very low	28.8	Very low	168 Å²	168	150.5 Å²	150.5	88%	0.88	81%	0.805	S	S	*	*	S	Bend	trans	-122.6	14.3	-174.8	-92.5	151.3	0	0	0	115.9
1339	L	26.2	Very low	28.7	Very low	156 Å²	156	148.9 Å²	148.9	82%	0.817	80%	0.802	S	S	*	*			trans	-108.4	57.6	179.1	-86.1	160	0	0	0	112.9
1340	K	23.9	Very low	28.6	Very low	204 Å²	204	147.6 Å²	147.6	89%	0.887	80%	0.801	S	S	*	*			trans	-155.3	92.9	162.9	-77.5	-166.1	-179.8	174.1	0	112.2
1341	S	25.6	Very low	28.4	Very low	106 Å²	106	144.6 Å²	144.6	74%	0.741	79%	0.794	S	S	*	*			trans	177.7	96.3	137.9	61.5	0	0	0	0	108.8
1342	T	26.3	Very low	28.3	Very low	135 Å²	135	150.3 Å²	150.3	83%	0.828	81%	0.806	S	S	*	*				91.2	106.8	108.2	49.2	0	0	0	0	114
1343	R	24.1	Very low	28.2	Very low	246 Å²	246	149.9 Å²	149.9	93%	0.928	81%	0.808	S	S	*	*			trans	-51.8	137.2	169.3	-66.1	167.7	170.1	173.7	-5.4	111.7
1344	C	25.3	Very low	28.4	Very low	123 Å²	123	149.1 Å²	149.1	83%	0.831	81%	0.805	S	S	*	*			trans	-122.8	143.6	153	-71.8	0	0	0	0	109.2
1345	P	28.4	Very low	28.3	Very low	119 Å²	119	151.1 Å²	151.1	77%	0.773	81%	0.811	S	S	*	*			trans	-97	144.5	-154.6	3.8	18.5	0	0	0	113.7
1346	S	27.4	Very low	28.3	Very low	110 Å²	110	150.3 Å²	150.3	77%	0.769	81%	0.813	S	S	*	*			trans	2.9	120.2	151.8	47.2	0	0	0	0	120.6
1347	N	25.7	Very low	28.3	Very low	152 Å²	152	148.1 Å²	148.1	81%	0.813	81%	0.811	S	S	*	*			trans	-11	140.5	140.3	-91	-5.3	0	0	0	117.4
1348	P	31.1	Very low	28.2	Very low	117 Å²	117	148.4 Å²	148.4	76%	0.76	82%	0.815	S	S	*	*			trans	-106.7	133.1	141.5	32.8	-20.7	0	0	0	111.3
1349	D	30.2	Very low	28.1	Very low	154 Å²	154	149 Å²	149	82%	0.824	81%	0.813	S	S	*	*			trans	-52	132.8	172.5	-65.4	-57.3	0	0	0	113.4
1350	V	32.1	Very low	28.2	Very low	142 Å²	142	147.3 Å²	147.3	86%	0.861	81%	0.812	S	S	*	*			trans	-139.2	98.9	152.8	-174.3	0	0	0	0	109.2
1351	S	26.3	Very low	28.3	Very low	92 Å²	92	144.8 Å²	144.8	64%	0.643	81%	0.807	S	S	*	*			trans	-71.1	146.7	163.9	52.2	0	0	0	0	111.6
1352	H	29.4	Very low	28.3	Very low	173 Å²	173	149.6 Å²	149.6	80%	0.801	82%	0.815	S	S	*	*			trans	72.5	109.2	163.4	-66.5	-70.6	0	0	0	118
1353	I	32	Very low	28.2	Very low	169 Å²	169	153.6 Å²	153.6	87%	0.867	82%	0.817	S	S	*	*				-161.6	141.9	127.6	-87.9	140.2	0	0	0	108.1
1354	P	34.5	Very low	28.4	Very low	111 Å²	111	147.1 Å²	147.1	72%	0.721	81%	0.806	S	S	*	*			trans	-103.8	158.1	-160.3	36.2	-24.9	0	0	0	115.1
1355	D	28.3	Very low	28.4	Very low	163 Å²	163	149.6 Å²	149.6	87%	0.872	81%	0.81	S	S	*	*			trans	15.6	101.1	156.9	-66.2	-26.2	0	0	0	118.4
1356	K	29.6	Very low	28.3	Very low	197 Å²	197	155.7 Å²	155.7	86%	0.857	82%	0.818	S	S	*	*			trans	-159.4	116.1	143.8	-107.8	173.6	-174.4	-171.5	0	110.5
1357	D	29.8	Very low	28.2	Very low	150 Å²	150	159.2 Å²	159.2	80%	0.802	82%	0.822	S	S	*	*			trans	24.5	119.2	162	-58	-40.4	0	0	0	120	E1359	D1357-E1359 PolarHBondContact O-N 3.09Å
1358	P	29.1	Very low	28.2	Very low	130 Å²	130	158.5 Å²	158.5	84%	0.844	82%	0.819	S	S	*	*			trans	-88.1	106.3	-176.3	34.4	-29.4	0	0	0	111.2
1359	E	25.6	Very low	28	Very low	179 Å²	179	159 Å²	159	84%	0.836	83%	0.825	S	S	*	*			trans	-80.8	138.9	155.5	-81.8	-169.6	159.7	0	0	110.4	D1357 L1361	D1357-E1359 PolarHBondContact O-N 3.09Å; E1359-L1361 PolarHBondContact O-N 3.03Å; E1359-L1361 VanDerWaalsContact O-N 3.16Å
1360	P	28	Very low	27.9	Very low	121 Å²	121	159.6 Å²	159.6	79%	0.786	83%	0.827	S	S	*	*			trans	-84.4	100.3	-160.3	33.1	-33.1	0	0	0	111.3
1361	L	26.7	Very low	27.9	Very low	152 Å²	152	159.6 Å²	159.6	80%	0.796	82%	0.821	S	S	*	*			trans	-89.3	114.5	171	-81.2	162.3	0	0	0	111.2	E1359 Y1363	E1359-L1361 PolarHBondContact O-N 3.03Å; E1359-L1361 VanDerWaalsContact O-N 3.16Å; L1361-Y1363 PolarHBondContact O-N 3.11Å
1362	F	23.8	Very low	28.1	Very low	207 Å²	207	158.7 Å²	158.7	91%	0.908	81%	0.808	S	S	*	*			trans	-38.6	120.5	167.3	-77.6	-103.1	0	0	0	113
1363	Y	25.4	Very low	28.1	Very low	219 Å²	219	158.3 Å²	158.3	86%	0.859	81%	0.807	S	S	*	*			trans	-111.8	126.8	165.8	-91.6	-84.3	0	0	0	111	L1361	L1361-Y1363 PolarHBondContact O-N 3.11Å
1364	P	27.8	Very low	28.1	Very low	110 Å²	110	158.4 Å²	158.4	71%	0.714	80%	0.803	S	S	*	*			trans	-82.5	126	-176.2	31.4	-31.2	0	0	0	112.4	R1366	P1364-R1366 PolarHBondContact O-N 3.34Å
1365	L	25.3	Very low	28.2	Very low	175 Å²	175	154.9 Å²	154.9	92%	0.916	78%	0.783	S	S	*	*			trans	19.9	91.1	145.7	-66.5	160.5	0	0	0	116.9
1366	R	25.6	Very low	28.8	Very low	247 Å²	247	153.4 Å²	153.4	93%	0.932	77%	0.774	S	S	*	*			trans	-86.5	115.2	153.1	-83.4	-170.1	179	-174.7	1.7	109.8	P1364 N1368	P1364-R1366 PolarHBondContact O-N 3.34Å; R1366-N1368 PolarHBondContact O-N 2.89Å
1367	Q	25.9	Very low	29.7	Very low	183 Å²	183	149.2 Å²	149.2	86%	0.855	76%	0.761	S	S	*	*			trans	-61.8	114.7	165.2	-72.9	171.5	-24.3	0	0	109.5
1368	N	24.9	Very low	30.7	Very low	138 Å²	138	143.1 Å²	143.1	74%	0.738	73%	0.73	S	S	*	*	S	Bend	trans	177.5	97.9	140.8	-86.8	-19.8	0	0	0	108	R1366 L1370	R1366-N1368 PolarHBondContact O-N 2.89Å; N1368-L1370 PolarHBondContact O-N 3.11Å
1369	S	28	Very low	32.2	Very low	127 Å²	127	141.5 Å²	141.5	89%	0.888	71%	0.714	S	S	*	*			trans	22.6	69.6	158.3	59.3	0	0	0	0	116.2
1370	L	27.5	Very low	34.1	Very low	166 Å²	166	137.5 Å²	137.5	87%	0.869	69%	0.692	S	S	*	*			trans	-100.4	114.9	170	-89.6	156.2	0	0	0	109	N1368 L1372	N1368-L1370 PolarHBondContact O-N 3.11Å; L1370-L1372 PolarHBondContact O-N 2.88Å
1371	I	31.9	Very low	36.3	Very low	142 Å²	142	134.4 Å²	134.4	73%	0.728	67%	0.668	S	S	*	*			trans	-47	126.1	173.1	-66.5	161.4	0	0	0	109.1	E1373	I1371-E1373 PolarHBondContact O-N 3.11Å; I1371-E1373 VanDerWaalsContact O-N 3.14Å
1372	L	31.9	Very low	38.9	Very low	73 Å²	73	128.9 Å²	128.9	38%	0.382	64%	0.637	S	S	.	*			trans	-48.4	111	-173.6	-107.5	107.5	0	0	0	113.6	L1370 H1374	L1370-L1372 PolarHBondContact O-N 2.88Å; L1372-H1374 PolarHBondContact O-N 3.49Å; L1372-H1374 VanDerWaalsContact O-N 3.11Å
1373	E	29.2	Very low	41.8	Very low	166 Å²	166	123.2 Å²	123.2	78%	0.776	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-0	172.2	-89.8	-174.9	163.3	0	0	114.4	I1371 I1376	I1371-E1373 PolarHBondContact O-N 3.11Å; I1371-E1373 VanDerWaalsContact O-N 3.14Å; E1373-I1376 WeakPolarHBondContact O-CD1 3.5Å; E1373-I1376 WeakPolarHBondContact O-CG1 3.37Å
1374	H	32	Very low	44.8	Very low	171 Å²	171	113.4 Å²	113.4	79%	0.792	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	0.2	-179.2	-76	59.9	0	0	0	114.6	L1372 I1376	L1372-H1374 PolarHBondContact O-N 3.49Å; L1372-H1374 VanDerWaalsContact O-N 3.11Å; H1374-I1376 PolarHBondContact O-N 2.9Å; H1374-I1376 VanDerWaalsContact O-N 3.16Å
1375	A	36	Very low	47.6	Very low	36 Å²	36	113.4 Å²	113.4	30%	0.298	57%	0.566	S	S	.	*			trans	-84.2	39.3	167	0	0	0	0	0	111.8	K1301 N1377 S1378	K1301-A1375 PolarHBondContact NZ-O 3.4Å; A1375-N1377 PolarHBondContact O-N 3.45Å; A1375-N1377 VanDerWaalsContact O-N 3.15Å; A1375-S1378 PolarHBondContact O-N 2.89Å
1376	I	40.3	Very low	50.6	Low	132 Å²	132	108 Å²	108	68%	0.677	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-29.9	-172.2	-63.1	-178.1	0	0	0	111.6	E1373 H1374	E1373-I1376 WeakPolarHBondContact O-CD1 3.5Å; E1373-I1376 WeakPolarHBondContact O-CG1 3.37Å; H1374-I1376 PolarHBondContact O-N 2.9Å; H1374-I1376 VanDerWaalsContact O-N 3.16Å
1377	N	48.6	Very low	53.4	Low	109 Å²	109	99.9 Å²	99.9	58%	0.583	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-4.2	-172.6	-75.4	-12.4	0	0	0	115.9	R1242 I1244 A1375	R1242-N1377 PolarHBondContact NH1-O 3.04Å; I1244-N1377 HydrophobicContact CD1-CB 4.3Å; A1375-N1377 PolarHBondContact O-N 3.45Å; A1375-N1377 VanDerWaalsContact O-N 3.15Å
1378	S	50.9	Low	56	Low	22 Å²	22	92.2 Å²	92.2	15%	0.154	48%	0.476	C	S	.	.			trans	-89.5	125.6	171.7	67.8	0	0	0	0	110.4	K1301 A1375 Y1380	K1301-S1378 WeakPolarHBondContact CE-O 3.38Å; K1301-S1378 PolarHBondContact NZ-O 3.23Å; A1375-S1378 PolarHBondContact O-N 2.89Å; S1378-Y1380 WeakPolarHBondContact CB-O 3.38Å; S1378-Y1380 PolarHBondContact O-N 3.47Å; S1378-Y1380 VanDerWaalsContact O-N 3.16Å; S1378-Y1380 PolarHBondContact OG-O 2.69Å
1379	N	60.1	Low	59	Low	96 Å²	96	91.9 Å²	91.9	51%	0.513	46%	0.464	S	S	.	.	S	Bend	trans	-64.9	-10.8	169.3	-73.9	-2.8	0	0	0	112.1	Q1300 K1301	Q1300-N1379 WeakPolarHBondContact CA-O 3.47Å; K1301-N1379 PolarHBondContact N-O 2.95Å
1380	Y	66	Low	61.7	Low	95 Å²	95	87.4 Å²	87.4	37%	0.373	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	139.7	-174.4	-60.1	-79	0	0	0	111.5	T1298 Y1299 Q1300 S1378	T1298-Y1380 HydrophobicContact CG2-CD1 3.74Å; T1298-Y1380 HydrophobicContact CG2-CG 3.98Å; Y1299-Y1380 CarbonylContact O-C 3.56Å; Y1299-Y1380 WeakPolarHBondContact O-CA 3.45Å; Q1300-Y1380 HydrophobicContact CB-CD1 4.06Å; Q1300-Y1380 HydrophobicContact CB-CE1 3.87Å; Q1300-Y1380 HydrophobicContact CG-CD1 4.35Å; Q1300-Y1380 HydrophobicContact CG-CE1 3.92Å; S1378-Y1380 WeakPolarHBondContact CB-O 3.38Å; S1378-Y1380 PolarHBondContact O-N 3.47Å; S1378-Y1380 VanDerWaalsContact O-N 3.16Å; S1378-Y1380 PolarHBondContact OG-O 2.69Å
1381	I	74.2	Confident	64.4	Low	56 Å²	56	83.5 Å²	83.5	29%	0.287	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.9	169.4	-60.4	172.1	0	0	0	107	T1298 Y1299 K1301	T1298-I1381 WeakPolarHBondContact CA-O 3.42Å; Y1299-I1381 PolarHBondContact N-O 2.9Å; Y1299-I1381 PolarHBondContact O-N 2.92Å; K1301-I1381 HydrophobicContact CG-CD1 4.11Å; K1301-I1381 HydrophobicContact CG-CG1 4.14Å
1382	Y	81.2	Confident	66.9	Low	37 Å²	37	77.4 Å²	77.4	15%	0.145	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.6	-180	-63.2	-88	0	0	0	110	N1223 L1237 I1246 L1247 I1296 H1297 T1298	N1223-Y1382 HydrophobicContact CB-CD1 4.39Å; N1223-Y1382 HydrophobicContact CB-CE1 3.77Å; L1237-Y1382 HydrophobicContact CD2-CD1 4.47Å; L1237-Y1382 HydrophobicContact CD2-CG 4.43Å; I1246-Y1382 HydrophobicContact CD1-CE2 4.23Å; I1246-Y1382 HydrophobicContact CG2-CD2 3.35Å; I1246-Y1382 HydrophobicContact CG2-CE2 3.45Å; I1246-Y1382 VanDerWaalsContact CG2-CE2 3.45Å; I1246-Y1382 HydrophobicContact CG2-CG 4.4Å; L1247-Y1382 HydrophobicContact CD2-CG 4.39Å; I1296-Y1382 HydrophobicContact CG2-CD1 4.1Å; H1297-Y1382 CarbonylContact O-C 3.59Å; H1297-Y1382 WeakPolarHBondContact O-CA 3.46Å; T1298-Y1382 HydrophobicContact CG2-CD1 3.94Å; T1298-Y1382 HydrophobicContact CG2-CE1 3.49Å; T1298-Y1382 VanDerWaalsContact CG2-CE1 3.49Å; T1298-Y1382 WeakPolarHBondContact OG1-CD1 3.27Å; T1298-Y1382 WeakPolarHBondContact OG1-CE1 3.34Å
1383	E	84.4	Confident	69.4	Low	87 Å²	87	74.5 Å²	74.5	41%	0.407	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	115.9	177.5	179.1	-177.9	-157	0	0	110	Y1256 H1297 Y1299	Y1256-E1383 WeakPolarHBondContact OH-CA 3.36Å; H1297-E1383 HydrophobicContact CB-CB 4.22Å; H1297-E1383 PolarHBondContact N-O 3.23Å; H1297-E1383 PolarHBondContact O-N 3.14Å; Y1299-E1383 HydrophobicContact CE2-CB 3.92Å; Y1299-E1383 VanDerWaalsContact CE2-OE2 3.24Å; Y1299-E1383 WeakPolarHBondContact CE2-OE2 3.48Å; Y1299-E1383 PolarHBondContact OH-OE2 3.05Å
1384	L	88.7	Confident	71.8	Confident	14 Å²	14	73.5 Å²	73.5	7%	0.073	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	114.5	171.7	-70.3	160.8	0	0	0	109.8	W1226 L1247 F1249 Y1256 L1282 Y1294 Q1295 I1296	W1226-L1384 HydrophobicContact CH2-CD1 4.16Å; W1226-L1384 HydrophobicContact CH2-CD2 4.01Å; W1226-L1384 HydrophobicContact CH2-CG 4.5Å; W1226-L1384 HydrophobicContact CZ3-CD1 4.49Å; L1247-L1384 HydrophobicContact CD1-CD1 4.08Å; F1249-L1384 HydrophobicContact CB-CD1 3.85Å; F1249-L1384 HydrophobicContact CD1-CD1 3.7Å; F1249-L1384 HydrophobicContact CD2-CD1 3.93Å; F1249-L1384 HydrophobicContact CE1-CD1 4.17Å; F1249-L1384 HydrophobicContact CE2-CB 4.35Å; F1249-L1384 HydrophobicContact CE2-CD1 4.38Å; F1249-L1384 HydrophobicContact CG-CD1 3.55Å; F1249-L1384 HydrophobicContact CZ-CB 4.28Å; F1249-L1384 HydrophobicContact CZ-CD1 4.48Å; Y1256-L1384 PolarHBondContact OH-N 3.48Å; L1282-L1384 HydrophobicContact CD2-CD2 4.3Å; Y1294-L1384 HydrophobicContact CD1-CB 3.99Å; Y1294-L1384 HydrophobicContact CG-CD2 4.4Å; Q1295-L1384 CarbonylContact O-C 3.56Å; Q1295-L1384 WeakPolarHBondContact O-CA 3.46Å; I1296-L1384 HydrophobicContact CG1-CD2 3.82Å
1385	Q	86.3	Confident	74.4	Confident	109 Å²	109	65.8 Å²	65.8	51%	0.509	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	118.1	172.4	-178.4	-177	-0.4	0	0	109.4	Y1294 Q1295 H1297 I1387	Y1294-Q1385 CarbonylContact C-O 3.55Å; Y1294-Q1385 WeakPolarHBondContact CA-O 3.43Å; Q1295-Q1385 HydrophobicContact CB-CB 4.43Å; Q1295-Q1385 PolarHBondContact N-O 3.27Å; Q1295-Q1385 PolarHBondContact O-N 3.22Å; H1297-Q1385 PolarHBondContact CE1-OE1 3.43Å; Q1385-I1387 PolarHBondContact O-N 3.34Å
1386	K	88.3	Confident	76.9	Confident	61 Å²	61	65.3 Å²	65.3	27%	0.265	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	123.2	176.4	-167.3	176.6	60.7	178.5	0	110.4	E1254 Y1294 R1389	E1254-K1386 WeakPolarHBondContact OE1-CE 3.44Å; E1254-K1386 IonicContact OE1-NZ 2.65Å; E1254-K1386 PolarHBondContact OE1-NZ 3.38Å; E1254-K1386 IonicContact OE2-NZ 2.83Å; Y1294-K1386 HydrophobicContact CD1-CB 3.84Å; Y1294-K1386 HydrophobicContact CD1-CG 4.43Å; Y1294-K1386 HydrophobicContact CE1-CB 3.57Å; Y1294-K1386 HydrophobicContact CE1-CD 4.42Å; Y1294-K1386 HydrophobicContact CE1-CG 4.04Å; K1386-R1389 HydrophobicContact CD-CB 4.44Å
1387	I	84.4	Confident	79.4	Confident	77 Å²	77	59.1 Å²	59.1	40%	0.395	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-43.5	176.2	-54	165.6	0	0	0	110.8	V1293 Q1295 Q1385	V1293-I1387 PolarHBondContact O-N 3.47Å; Q1295-I1387 HydrophobicContact CB-CD1 3.51Å; Q1295-I1387 HydrophobicContact CB-CG1 3.91Å; Q1295-I1387 HydrophobicContact CG-CD1 4.2Å; Q1295-I1387 VanDerWaalsContact OE1-CD1 3.25Å; Q1385-I1387 PolarHBondContact O-N 3.34Å
1388	V	82.1	Confident	81.4	Confident	23 Å²	23	57.6 Å²	57.6	14%	0.139	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	136.3	-174.7	-175.3	0	0	0	0	109.5	L1292 V1293	L1292-V1388 WeakPolarHBondContact CA-O 3.4Å; V1293-V1388 HydrophobicContact CB-CB 3.83Å; V1293-V1388 HydrophobicContact CB-CG2 4.14Å; V1293-V1388 HydrophobicContact CG2-CB 3.85Å; V1293-V1388 HydrophobicContact CG2-CG1 4.46Å; V1293-V1388 HydrophobicContact CG2-CG2 4.28Å; V1293-V1388 PolarHBondContact N-O 3.39Å; V1293-V1388 PolarHBondContact O-N 3.28Å
1389	R	86.4	Confident	83.4	Confident	131 Å²	131	58.5 Å²	58.5	49%	0.494	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	112.5	162.8	172.3	172	-171.3	170.2	13.6	106.9	E1290 L1292 K1386	E1290-R1389 IonicContact OE1-CZ 3.48Å; E1290-R1389 VanDerWaalsContact OE1-CZ 3.28Å; E1290-R1389 IonicContact OE1-NE 2.58Å; E1290-R1389 PolarHBondContact OE1-NE 2.98Å; E1290-R1389 IonicContact OE1-NH2 2.84Å; E1290-R1389 PolarHBondContact OE1-NH2 3.48Å; E1290-R1389 IonicContact OE2-CZ 3.11Å; E1290-R1389 IonicContact OE2-NE 2.63Å; E1290-R1389 IonicContact OE2-NH2 3.38Å; E1290-R1389 PolarHBondContact OE2-NH2 3.25Å; E1290-R1389 VanDerWaalsContact OE2-NH2 3.12Å; L1292-R1389 HydrophobicContact CD2-CB 3.76Å; L1292-R1389 HydrophobicContact CD2-CG 3.52Å; K1386-R1389 HydrophobicContact CD-CB 4.44Å
1390	S	84.7	Confident	84.9	Confident	32 Å²	32	54.5 Å²	54.5	22%	0.224	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	119.1	-178.5	-171.2	0	0	0	0	109.1	E1290 V1291 V1392	E1290-S1390 CarbonylContact C-O 3.57Å; E1290-S1390 WeakPolarHBondContact CA-O 3.49Å; V1291-S1390 PolarHBondContact N-O 3.09Å; V1291-S1390 PolarHBondContact O-N 3.44Å; S1390-V1392 PolarHBondContact O-N 3.46Å; S1390-V1392 WeakPolarHBondContact OG-CG1 3.46Å
1391	K	85.7	Confident	86.1	Confident	84 Å²	84	51.3 Å²	51.3	37%	0.365	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	109.4	168.4	173.9	71.7	175.4	-178.5	0	106.5	M1288 E1290 A1393 E1394	M1288-K1391 WeakPolarHBondContact O-CD 3.44Å; M1288-K1391 WeakPolarHBondContact O-CE 3.39Å; M1288-K1391 PolarHBondContact O-NZ 3.44Å; E1290-K1391 HydrophobicContact CG-CB 4.23Å; E1290-K1391 HydrophobicContact CG-CD 3.96Å; K1391-A1393 WeakPolarHBondContact CD-O 3.31Å; K1391-A1393 WeakPolarHBondContact CE-O 3.49Å; K1391-A1393 PolarHBondContact NZ-O 3.43Å; K1391-E1394 WeakPolarHBondContact CE-OE2 3.35Å; K1391-E1394 IonicContact NZ-OE2 2.79Å; K1391-E1394 PolarHBondContact NZ-OE2 2.87Å
1392	V	83.2	Confident	86.8	Confident	15 Å²	15	51.2 Å²	51.2	9%	0.091	24%	0.242	C	C	.	.			trans	-116.7	-15	-171.1	-62.1	0	0	0	0	113.8	G1289 V1291 S1390 I1397 L1426 W1428	G1289-V1392 PolarHBondContact O-N 3.23Å; V1291-V1392 HydrophobicContact CG2-CG2 3.74Å; S1390-V1392 PolarHBondContact O-N 3.46Å; S1390-V1392 WeakPolarHBondContact OG-CG1 3.46Å; V1392-I1397 HydrophobicContact CG2-CD1 3.63Å; V1392-L1426 HydrophobicContact CB-CD1 3.56Å; V1392-L1426 HydrophobicContact CG1-CD1 4.08Å; V1392-L1426 HydrophobicContact CG2-CD1 4.01Å; V1392-W1428 HydrophobicContact CG1-CH2 3.71Å; V1392-W1428 HydrophobicContact CG1-CZ2 3.69Å; V1392-W1428 HydrophobicContact CG2-CZ2 4.47Å
1393	A	84.4	Confident	87	Confident	11 Å²	11	51.7 Å²	51.7	9%	0.091	25%	0.245	C	C	.	.			trans	-143.6	155.2	173.2	0	0	0	0	0	109.6	G1289 K1391 T1395 I1397	G1289-A1393 WeakPolarHBondContact CA-O 3.33Å; G1289-A1393 PolarHBondContact O-N 3.43Å; G1289-A1393 VanDerWaalsContact O-N 3.12Å; K1391-A1393 WeakPolarHBondContact CD-O 3.31Å; K1391-A1393 WeakPolarHBondContact CE-O 3.49Å; K1391-A1393 PolarHBondContact NZ-O 3.43Å; A1393-T1395 WeakPolarHBondContact CB-O 3.23Å; A1393-I1397 HydrophobicContact CB-CD1 4.1Å
1394	E	80.3	Confident	86.8	Confident	146 Å²	146	52.3 Å²	52.3	68%	0.682	25%	0.246	S	C	*	.	S	Bend	trans	-76.7	-20.8	165.9	-64.9	-52.9	150.7	0	0	112.2	K1391	K1391-E1394 WeakPolarHBondContact CE-OE2 3.35Å; K1391-E1394 IonicContact NZ-OE2 2.79Å; K1391-E1394 PolarHBondContact NZ-OE2 2.87Å
1395	T	85.9	Confident	86.2	Confident	8 Å²	8	54.4 Å²	54.4	5%	0.049	26%	0.257	C	S	.	.	S	Bend	trans	-102.1	152.6	-174.1	80.3	0	0	0	0	110.1	H220 G1289 A1393 I1397 S1416 T1417 Y1418 D1421	H220-T1395 WeakPolarHBondContact CE1-CB 3.42Å; H220-T1395 WeakPolarHBondContact CE1-CG2 3.46Å; H220-T1395 VanDerWaalsContact NE2-CB 3.29Å; H220-T1395 WeakPolarHBondContact NE2-CB 3.38Å; H220-T1395 WeakPolarHBondContact NE2-CG2 3.3Å; G1289-T1395 WeakPolarHBondContact CA-O 3.31Å; A1393-T1395 WeakPolarHBondContact CB-O 3.23Å; T1395-I1397 PolarHBondContact O-N 3.31Å; T1395-S1416 VanDerWaalsContact OG1-CB 3.28Å; T1395-S1416 WeakPolarHBondContact OG1-CB 3.42Å; T1395-S1416 PolarHBondContact OG1-OG 3.18Å; T1395-T1417 PolarHBondContact OG1-N 3.42Å; T1395-Y1418 HydrophobicContact CG2-CD2 4.36Å; T1395-D1421 VanDerWaalsContact CG2-OD2 3.24Å; T1395-D1421 WeakPolarHBondContact CG2-OD2 3.38Å; T1395-D1421 PolarHBondContact OG1-OD2 2.91Å
1396	P	89.5	Confident	85.4	Confident	27 Å²	27	52.5 Å²	52.5	18%	0.175	25%	0.253	C	S	.	.			trans	-52.3	137.6	-178.7	-25.9	30.1	0	0	0	113.1	T1273 G1287 R1398 S1416 T1417	T1273-P1396 HydrophobicContact CG2-CB 4.34Å; G1287-P1396 WeakPolarHBondContact O-CG 3.34Å; P1396-R1398 PolarHBondContact O-N 2.89Å; P1396-S1416 CarbonylContact O-C 3.5Å; P1396-T1417 WeakPolarHBondContact CD-OG1 3.32Å; P1396-T1417 PolarHBondContact O-N 2.84Å; P1396-T1417 PolarHBondContact O-OG1 2.78Å
1397	I	91.7	Very high	84.5	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	28%	0.276	C	S	.	.			trans	-70.6	112	169.9	-54.4	-52.9	0	0	0	108	T1273 V1274 T1286 V1291 V1392 A1393 T1395 L1400 C1415	T1273-I1397 WeakPolarHBondContact CB-O 3.36Å; T1273-I1397 PolarHBondContact OG1-O 3.39Å; V1274-I1397 HydrophobicContact CG1-CG2 3.96Å; T1286-I1397 PolarHBondContact O-N 2.91Å; V1291-I1397 HydrophobicContact CG2-CD1 4.24Å; V1291-I1397 HydrophobicContact CG2-CG1 3.98Å; V1291-I1397 HydrophobicContact CG2-CG2 4.46Å; V1392-I1397 HydrophobicContact CG2-CD1 3.63Å; A1393-I1397 HydrophobicContact CB-CD1 4.1Å; T1395-I1397 PolarHBondContact O-N 3.31Å; I1397-L1400 HydrophobicContact CG2-CD2 4.44Å; I1397-L1400 HydrophobicContact CG2-CG 4.27Å; I1397-C1415 CarbonylContact C-O 3.57Å; I1397-C1415 WeakPolarHBondContact CA-O 3.39Å
1398	R	90.6	Very high	83.6	Confident	77 Å²	77	57.8 Å²	57.8	29%	0.291	29%	0.293	S	S	.	.			trans	-86.8	-36.4	-177.4	-68.9	-172.3	67	86.3	5.8	112.7	I1039 P1396 C1415	I1039-R1398 WeakPolarHBondContact O-CD 3.44Å; I1039-R1398 PolarHBondContact O-NE 3.38Å; P1396-R1398 PolarHBondContact O-N 2.89Å; R1398-C1415 PolarHBondContact N-O 2.98Å
1399	F	93	Very high	83.1	Confident	42 Å²	42	60.8 Å²	60.8	18%	0.184	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	141.8	-173.8	-54.5	-77.5	0	0	0	111.9	I1039 Q1040 I1042 S1414 C1415	I1039-F1399 HydrophobicContact CB-CE2 4.4Å; I1039-F1399 HydrophobicContact CG2-CD2 3.87Å; I1039-F1399 HydrophobicContact CG2-CE2 3.75Å; I1039-F1399 WeakPolarHBondContact O-CE2 3.49Å; Q1040-F1399 WeakPolarHBondContact O-CZ 3.36Å; I1042-F1399 HydrophobicContact CG2-CB 3.37Å; I1042-F1399 HydrophobicContact CG2-CD1 3.69Å; I1042-F1399 HydrophobicContact CG2-CD2 3.93Å; I1042-F1399 HydrophobicContact CG2-CG 3.36Å; F1399-S1414 WeakPolarHBondContact O-CA 3.28Å; F1399-C1415 HydrophobicContact CB-CB 4.17Å; F1399-C1415 HydrophobicContact CD2-CB 4.17Å; F1399-C1415 PolarHBondContact N-O 2.97Å; F1399-C1415 PolarHBondContact O-N 3.17Å
1400	L	92.3	Very high	82.7	Confident	11 Å²	11	55.4 Å²	55.4	6%	0.058	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	116.5	165.1	-73.8	171.3	0	0	0	106.2	V1274 L1276 W1283 I1397 I1413	V1274-L1400 HydrophobicContact CG1-CB 4.25Å; V1274-L1400 HydrophobicContact CG1-CD1 3.8Å; V1274-L1400 HydrophobicContact CG1-CG 3.76Å; V1274-L1400 HydrophobicContact CG2-CB 4.1Å; L1276-L1400 HydrophobicContact CB-CB 3.9Å; L1276-L1400 HydrophobicContact CB-CD1 4.44Å; L1276-L1400 HydrophobicContact CD2-CB 4.03Å; W1283-L1400 HydrophobicContact CB-CD1 4.01Å; I1397-L1400 HydrophobicContact CG2-CD2 4.44Å; I1397-L1400 HydrophobicContact CG2-CG 4.27Å; L1400-I1413 WeakPolarHBondContact CA-O 3.5Å
1401	V	90.8	Very high	82.6	Confident	28 Å²	28	54 Å²	54	17%	0.17	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	147.5	177.3	-68.7	0	0	0	0	109.7	I1042 F1044 L1050 I1412 I1413	I1042-V1401 HydrophobicContact CD1-CG2 3.65Å; I1042-V1401 HydrophobicContact CG1-CG2 4.03Å; I1042-V1401 HydrophobicContact CG2-CG1 3.87Å; I1042-V1401 HydrophobicContact CG2-CG2 4.5Å; F1044-V1401 HydrophobicContact CD2-CB 4.23Å; F1044-V1401 HydrophobicContact CD2-CG2 4.18Å; F1044-V1401 HydrophobicContact CE2-CB 3.91Å; F1044-V1401 HydrophobicContact CE2-CG2 3.57Å; F1044-V1401 HydrophobicContact CZ-CG2 4.33Å; L1050-V1401 HydrophobicContact CD1-CG2 4.22Å; V1401-I1412 CarbonylContact O-C 3.54Å; V1401-I1412 WeakPolarHBondContact O-CA 3.25Å; V1401-I1413 HydrophobicContact CG2-CB 3.86Å; V1401-I1413 HydrophobicContact CG2-CG2 4.48Å; V1401-I1413 PolarHBondContact N-O 2.86Å; V1401-I1413 PolarHBondContact O-N 2.85Å
1402	M	89.1	Confident	82.8	Confident	55 Å²	55	50 Å²	50	27%	0.271	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	150.6	178.5	55.5	169.1	-68.2	0	0	111.7	L1276 Y1278 I1410 L1411 I1412	L1276-M1402 HydrophobicContact CD1-CG 3.86Å; L1276-M1402 HydrophobicContact CD1-SD 4.12Å; L1276-M1402 HydrophobicContact CD2-CB 3.94Å; L1276-M1402 HydrophobicContact CD2-CG 3.98Å; L1276-M1402 HydrophobicContact CD2-SD 4.5Å; L1276-M1402 HydrophobicContact CG-CG 4.33Å; L1276-M1402 HydrophobicContact CG-SD 4.43Å; Y1278-M1402 HydrophobicContact CD2-CE 3.13Å; Y1278-M1402 HydrophobicContact CD2-SD 3.56Å; Y1278-M1402 VanDerWaalsContact CD2-SD 3.56Å; Y1278-M1402 HydrophobicContact CE2-CE 3.5Å; Y1278-M1402 HydrophobicContact CE2-SD 4.49Å; Y1278-M1402 HydrophobicContact CG-CE 3.97Å; Y1278-M1402 HydrophobicContact CG-SD 3.96Å; M1402-I1410 HydrophobicContact CE-CG2 4.48Å; M1402-L1411 CarbonylContact C-O 3.58Å; M1402-L1411 VanDerWaalsContact CA-O 3.26Å; M1402-L1411 WeakPolarHBondContact CA-O 3.44Å; M1402-I1412 HydrophobicContact CB-CG1 4.11Å
1403	K	84.7	Confident	83.2	Confident	47 Å²	47	49.3 Å²	49.3	20%	0.204	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	128	166.6	-166.3	73.8	176.3	-152.9	0	109.2	F1044 D1046 N1047 L1411	F1044-K1403 HydrophobicContact CB-CD 3.91Å; F1044-K1403 HydrophobicContact CD1-CB 3.97Å; F1044-K1403 HydrophobicContact CD1-CG 4.33Å; F1044-K1403 HydrophobicContact CD2-CB 3.9Å; F1044-K1403 HydrophobicContact CE1-CB 4.05Å; F1044-K1403 HydrophobicContact CE2-CB 3.97Å; F1044-K1403 HydrophobicContact CG-CB 3.91Å; F1044-K1403 HydrophobicContact CG-CD 4.12Å; F1044-K1403 HydrophobicContact CG-CG 4.3Å; F1044-K1403 HydrophobicContact CZ-CB 4.06Å; D1046-K1403 WeakPolarHBondContact O-CE 3.26Å; D1046-K1403 PolarHBondContact O-NZ 3.28Å; D1046-K1403 VanDerWaalsContact O-NZ 3.12Å; N1047-K1403 WeakPolarHBondContact OD1-CE 3.38Å; K1403-L1411 PolarHBondContact N-O 3.05Å; K1403-L1411 PolarHBondContact O-N 3.2Å
1404	K	80.8	Confident	83.5	Confident	99 Å²	99	48.9 Å²	48.9	43%	0.43	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	110	172.9	-171.6	177.6	176.5	-170.4	0	108	T1406 D1407 I1410	K1404-T1406 WeakPolarHBondContact CG-O 3.38Å; K1404-D1407 WeakPolarHBondContact CE-OD1 3.17Å; K1404-D1407 IonicContact NZ-OD1 3.98Å; K1404-D1407 PolarHBondContact NZ-OD1 3.02Å; K1404-I1410 HydrophobicContact CG-CG1 4.33Å
1405	I	76.7	Confident	84	Confident	59 Å²	59	41.9 Å²	41.9	30%	0.303	22%	0.219	S	C	.	.			trans	-87	-47.9	-177.8	-59.9	172.6	0	0	0	109.3	H1409 L1411	I1405-H1409 PolarHBondContact N-O 3.43Å; I1405-L1411 HydrophobicContact CD1-CB 4.04Å
1406	T	70	Confident	84.2	Confident	69 Å²	69	41.6 Å²	41.6	42%	0.423	22%	0.217	S	C	.	.	S	Bend	trans	-134.6	173.6	171.7	66.2	0	0	0	0	109.5	K1404 S1408 H1409	K1404-T1406 WeakPolarHBondContact CG-O 3.38Å; T1406-S1408 PolarHBondContact O-N 3.12Å; T1406-S1408 PolarHBondContact OG1-N 3.1Å; T1406-S1408 PolarHBondContact OG1-OG 2.88Å; T1406-H1409 PolarHBondContact N-O 3.45Å; T1406-H1409 VanDerWaalsContact N-O 3.12Å; T1406-H1409 PolarHBondContact O-N 3.05Å; T1406-H1409 WeakPolarHBondContact OG1-CB 3.3Å; T1406-H1409 PolarHBondContact OG1-N 2.86Å
1407	D	67.7	Low	84.1	Confident	140 Å²	140	40.8 Å²	40.8	75%	0.749	21%	0.211	S	C	*	.	S	Bend	trans	-59.9	-24.3	174.2	-75.4	-34.1	0	0	0	113.5	K1404	K1404-D1407 WeakPolarHBondContact CE-OD1 3.17Å; K1404-D1407 IonicContact NZ-OD1 3.98Å; K1404-D1407 PolarHBondContact NZ-OD1 3.02Å
1408	S	66.8	Low	83.8	Confident	109 Å²	109	41.4 Å²	41.4	76%	0.762	21%	0.214	S	C	*	.	S	Bend	trans	-103	-27	178.7	58	0	0	0	0	114.1	T1406	T1406-S1408 PolarHBondContact O-N 3.12Å; T1406-S1408 PolarHBondContact OG1-N 3.1Å; T1406-S1408 PolarHBondContact OG1-OG 2.88Å
1409	H	71.6	Confident	83.4	Confident	85 Å²	85	38.4 Å²	38.4	39%	0.394	20%	0.203	S	C	.	.			trans	-108.7	110.5	-173.5	-161.1	59.8	0	0	0	110.9	I1405 T1406	I1405-H1409 PolarHBondContact N-O 3.43Å; T1406-H1409 PolarHBondContact N-O 3.45Å; T1406-H1409 VanDerWaalsContact N-O 3.12Å; T1406-H1409 PolarHBondContact O-N 3.05Å; T1406-H1409 WeakPolarHBondContact OG1-CB 3.3Å; T1406-H1409 PolarHBondContact OG1-N 2.86Å
1410	I	78	Confident	82.6	Confident	18 Å²	18	39.1 Å²	39.1	9%	0.092	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	139.7	175.8	-57.1	108.7	0	0	0	108.5	Y1278 M1402 K1404 I1412	Y1278-I1410 HydrophobicContact CE1-CB 4.48Å; Y1278-I1410 HydrophobicContact CE1-CD1 3.73Å; Y1278-I1410 HydrophobicContact CE1-CG1 3.99Å; Y1278-I1410 HydrophobicContact CE1-CG2 4.29Å; Y1278-I1410 HydrophobicContact CE2-CG1 4.34Å; Y1278-I1410 WeakPolarHBondContact OH-CD1 3.5Å; Y1278-I1410 WeakPolarHBondContact OH-CG1 3.38Å; M1402-I1410 HydrophobicContact CE-CG2 4.48Å; K1404-I1410 HydrophobicContact CG-CG1 4.33Å; I1410-I1412 HydrophobicContact CG2-CG1 4.19Å
1411	L	82.7	Confident	81.8	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.016	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128.2	174.4	-170.2	92.3	0	0	0	108.9	F1044 V1067 M1402 K1403 I1405 I1413 K1427	F1044-L1411 HydrophobicContact CE1-CD2 3.6Å; F1044-L1411 HydrophobicContact CZ-CD2 3.52Å; V1067-L1411 HydrophobicContact CB-CD2 4.11Å; V1067-L1411 HydrophobicContact CG1-CD1 3.26Å; V1067-L1411 HydrophobicContact CG1-CD2 3.31Å; V1067-L1411 HydrophobicContact CG1-CG 3.86Å; V1067-L1411 HydrophobicContact CG2-CD2 3.68Å; M1402-L1411 CarbonylContact C-O 3.58Å; M1402-L1411 VanDerWaalsContact CA-O 3.26Å; M1402-L1411 WeakPolarHBondContact CA-O 3.44Å; K1403-L1411 PolarHBondContact N-O 3.05Å; K1403-L1411 PolarHBondContact O-N 3.2Å; I1405-L1411 HydrophobicContact CD1-CB 4.04Å; L1411-I1413 HydrophobicContact CD2-CD1 4.23Å; L1411-I1413 HydrophobicContact CD2-CG1 4.09Å; L1411-K1427 HydrophobicContact CD1-CD 3.81Å; L1411-K1427 HydrophobicContact CD1-CG 3.69Å
1412	I	88.5	Confident	80.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	133.9	171.5	-61.2	172.5	0	0	0	107.5	L1276 W1283 V1401 M1402 I1410 W1428 W1438	L1276-I1412 HydrophobicContact CD2-CG2 4.3Å; W1283-I1412 HydrophobicContact CD2-CD1 3.95Å; W1283-I1412 HydrophobicContact CE3-CD1 4.44Å; W1283-I1412 HydrophobicContact CE3-CG2 4.24Å; W1283-I1412 HydrophobicContact CH2-CD1 4Å; W1283-I1412 HydrophobicContact CZ2-CD1 3.43Å; W1283-I1412 VanDerWaalsContact CZ2-CD1 3.43Å; W1283-I1412 HydrophobicContact CZ3-CD1 4.47Å; W1283-I1412 HydrophobicContact CZ3-CG2 4.32Å; V1401-I1412 CarbonylContact O-C 3.54Å; V1401-I1412 WeakPolarHBondContact O-CA 3.25Å; M1402-I1412 HydrophobicContact CB-CG1 4.11Å; I1410-I1412 HydrophobicContact CG2-CG1 4.19Å; I1412-W1428 HydrophobicContact CB-CB 4.06Å; I1412-W1428 WeakPolarHBondContact O-CB 3.34Å; I1412-W1428 PolarHBondContact O-N 3.46Å; I1412-W1438 HydrophobicContact CD1-CH2 3.9Å; I1412-W1438 HydrophobicContact CD1-CZ3 4.1Å
1413	I	91.4	Very high	80	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	130.4	175.6	-57.7	-84.2	0	0	0	107.7	I1042 F1044 L1050 L1400 V1401 L1411 V1425 L1426 K1427 I1443	I1042-I1413 HydrophobicContact CD1-CG2 4.04Å; F1044-I1413 HydrophobicContact CE2-CG1 4.41Å; F1044-I1413 HydrophobicContact CZ-CG1 3.65Å; L1050-I1413 HydrophobicContact CD2-CG1 4.26Å; L1050-I1413 HydrophobicContact CD2-CG2 4.18Å; L1400-I1413 WeakPolarHBondContact CA-O 3.5Å; V1401-I1413 HydrophobicContact CG2-CB 3.86Å; V1401-I1413 HydrophobicContact CG2-CG2 4.48Å; V1401-I1413 PolarHBondContact N-O 2.86Å; V1401-I1413 PolarHBondContact O-N 2.85Å; L1411-I1413 HydrophobicContact CD2-CD1 4.23Å; L1411-I1413 HydrophobicContact CD2-CG1 4.09Å; I1413-V1425 HydrophobicContact CG2-CG1 3.63Å; I1413-L1426 CarbonylContact C-O 3.51Å; I1413-L1426 VanDerWaalsContact CA-O 3.29Å; I1413-L1426 WeakPolarHBondContact CA-O 3.24Å; I1413-K1427 HydrophobicContact CD1-CB 4.01Å; I1413-K1427 HydrophobicContact CD1-CG 4.44Å; I1413-I1443 HydrophobicContact CD1-CD1 3.41Å; I1413-I1443 VanDerWaalsContact CD1-CD1 3.41Å
1414	S	91.8	Very high	79.9	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.014	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	140.4	168.6	64.6	0	0	0	0	110.6	F1399 V1425 L1426 W1428	F1399-S1414 WeakPolarHBondContact O-CA 3.28Å; S1414-V1425 WeakPolarHBondContact O-CA 3.45Å; S1414-L1426 PolarHBondContact N-O 3.36Å; S1414-L1426 PolarHBondContact O-N 3.33Å; S1414-W1428 PolarHBondContact OG-NE1 3.26Å
1415	C	91.2	Very high	80.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	133.4	176.1	-55.9	0	0	0	0	112.1	I1039 I1042 I1397 R1398 F1399 A1424	I1039-C1415 HydrophobicContact CD1-CB 3.97Å; I1039-C1415 HydrophobicContact CG2-CB 4.44Å; I1042-C1415 WeakPolarHBondContact CD1-SG 3.45Å; I1397-C1415 CarbonylContact C-O 3.57Å; I1397-C1415 WeakPolarHBondContact CA-O 3.39Å; R1398-C1415 PolarHBondContact N-O 2.98Å; F1399-C1415 HydrophobicContact CB-CB 4.17Å; F1399-C1415 HydrophobicContact CD2-CB 4.17Å; F1399-C1415 PolarHBondContact N-O 2.97Å; F1399-C1415 PolarHBondContact O-N 3.17Å; C1415-A1424 CarbonylContact C-O 3.59Å; C1415-A1424 WeakPolarHBondContact CA-O 3.26Å
1416	S	89.6	Confident	80.8	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.014	19%	0.186	C	C	.	.			trans	-80	-167.1	172.1	86.8	0	0	0	0	110.8	T1395 P1396 D1421 A1424	T1395-S1416 VanDerWaalsContact OG1-CB 3.28Å; T1395-S1416 WeakPolarHBondContact OG1-CB 3.42Å; T1395-S1416 PolarHBondContact OG1-OG 3.18Å; P1396-S1416 CarbonylContact O-C 3.5Å; S1416-D1421 PolarHBondContact OG-OD2 2.86Å; S1416-A1424 PolarHBondContact N-O 3.41Å; S1416-A1424 WeakPolarHBondContact OG-CA 3.39Å
1417	T	86.8	Confident	81.7	Confident	10 Å²	10	31.1 Å²	31.1	6%	0.061	17%	0.171	C	C	.	.	S	Bend	trans	-80.1	-42.4	-176.3	-65.5	0	0	0	0	114	V1038 I1039 T1395 P1396	V1038-T1417 WeakPolarHBondContact CA-O 3.49Å; V1038-T1417 HydrophobicContact CG1-CG2 4.35Å; I1039-T1417 PolarHBondContact N-O 3.46Å; T1395-T1417 PolarHBondContact OG1-N 3.42Å; P1396-T1417 WeakPolarHBondContact CD-OG1 3.32Å; P1396-T1417 PolarHBondContact O-N 2.84Å; P1396-T1417 PolarHBondContact O-OG1 2.78Å
1418	Y	85.5	Confident	82.6	Confident	14 Å²	14	24.6 Å²	24.6	6%	0.055	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-106.9	134.9	-175	-60.5	-49.7	0	0	0	111.7	H220 Q1036 V1038 T1395 N1420 D1421 A1424	H220-Y1418 WeakPolarHBondContact CA-OH 3.35Å; H220-Y1418 AromaticContact CD2-CE2 3.78Å; H220-Y1418 AromaticContact CE1-CD2 3.17Å; H220-Y1418 WeakPolarHBondContact CE1-CD2 3.44Å; H220-Y1418 AromaticContact CE1-CE1 3.9Å; H220-Y1418 AromaticContact CE1-CE2 2.74Å; H220-Y1418 WeakPolarHBondContact CE1-CE2 3.39Å; H220-Y1418 AromaticContact CE1-CG 3.95Å; H220-Y1418 AromaticContact CE1-CZ 3.14Å; H220-Y1418 AromaticContact CG-CE2 3.74Å; H220-Y1418 AromaticContact CG-CZ 3.69Å; H220-Y1418 VanDerWaalsContact CG-OH 3.22Å; H220-Y1418 AromaticContact ND1-CD2 3.94Å; H220-Y1418 AromaticContact ND1-CE1 3.73Å; H220-Y1418 AromaticContact ND1-CE2 3.13Å; H220-Y1418 WeakPolarHBondContact ND1-CE2 3.48Å; H220-Y1418 AromaticContact ND1-CZ 2.96Å; H220-Y1418 PolarHBondContact ND1-OH 2.88Å; H220-Y1418 AromaticContact NE2-CD2 3.65Å; H220-Y1418 AromaticContact NE2-CE2 3.16Å; H220-Y1418 WeakPolarHBondContact NE2-CE2 3.48Å; H220-Y1418 AromaticContact NE2-CZ 3.88Å; Q1036-Y1418 HydrophobicContact CB-CD1 3.79Å; Q1036-Y1418 HydrophobicContact CB-CD2 4.3Å; Q1036-Y1418 HydrophobicContact CB-CE1 3.98Å; Q1036-Y1418 HydrophobicContact CB-CE2 4.37Å; Q1036-Y1418 HydrophobicContact CB-CG 3.99Å; Q1036-Y1418 HydrophobicContact CG-CD2 4.45Å; V1038-Y1418 HydrophobicContact CG2-CD1 3.9Å; V1038-Y1418 HydrophobicContact CG2-CE1 3.83Å; T1395-Y1418 HydrophobicContact CG2-CD2 4.36Å; Y1418-N1420 PolarHBondContact O-N 3.37Å; Y1418-D1421 PolarHBondContact O-N 3.32Å; Y1418-A1424 WeakPolarHBondContact O-CB 3.42Å
1419	F	81.6	Confident	83.2	Confident	13 Å²	13	22.9 Å²	22.9	6%	0.057	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-30.8	-179.5	-178.4	-96	0	0	0	113	A1037 I1039 I1052 Y1054 M1072 A1424	A1037-F1419 HydrophobicContact CB-CB 4.31Å; A1037-F1419 VanDerWaalsContact O-CB 3.31Å; A1037-F1419 WeakPolarHBondContact O-CB 3.43Å; A1037-F1419 PolarHBondContact O-N 3.38Å; I1039-F1419 HydrophobicContact CG1-CB 4.05Å; I1039-F1419 HydrophobicContact CG1-CD2 4.37Å; I1052-F1419 HydrophobicContact CG2-CD2 4.41Å; I1052-F1419 HydrophobicContact CG2-CE2 4.46Å; Y1054-F1419 AromaticContact CD1-CD2 3.6Å; Y1054-F1419 HydrophobicContact CD1-CD2 3.6Å; Y1054-F1419 AromaticContact CD1-CE2 3.4Å; Y1054-F1419 HydrophobicContact CD1-CE2 3.4Å; Y1054-F1419 HydrophobicContact CD1-CG 4.28Å; Y1054-F1419 AromaticContact CD1-CZ 3.97Å; Y1054-F1419 HydrophobicContact CD1-CZ 3.97Å; Y1054-F1419 HydrophobicContact CD2-CB 4.03Å; Y1054-F1419 AromaticContact CD2-CD1 3.71Å; Y1054-F1419 HydrophobicContact CD2-CD1 3.71Å; Y1054-F1419 AromaticContact CD2-CD2 3.75Å; Y1054-F1419 HydrophobicContact CD2-CD2 3.75Å; Y1054-F1419 HydrophobicContact CD2-CE1 4.04Å; Y1054-F1419 HydrophobicContact CD2-CE2 4.04Å; Y1054-F1419 AromaticContact CD2-CG 3.55Å; Y1054-F1419 HydrophobicContact CD2-CG 3.55Å; Y1054-F1419 HydrophobicContact CD2-CZ 4.18Å; Y1054-F1419 HydrophobicContact CE1-CD2 4.21Å; Y1054-F1419 HydrophobicContact CE1-CE1 4.39Å; Y1054-F1419 AromaticContact CE1-CE2 3.61Å; Y1054-F1419 HydrophobicContact CE1-CE2 3.61Å; Y1054-F1419 AromaticContact CE1-CZ 3.71Å; Y1054-F1419 HydrophobicContact CE1-CZ 3.71Å; Y1054-F1419 AromaticContact CE2-CD1 3.83Å; Y1054-F1419 HydrophobicContact CE2-CD1 3.83Å; Y1054-F1419 HydrophobicContact CE2-CD2 4.32Å; Y1054-F1419 AromaticContact CE2-CE1 3.73Å; Y1054-F1419 HydrophobicContact CE2-CE1 3.73Å; Y1054-F1419 HydrophobicContact CE2-CE2 4.2Å; Y1054-F1419 HydrophobicContact CE2-CG 4.12Å; Y1054-F1419 AromaticContact CE2-CZ 3.91Å; Y1054-F1419 HydrophobicContact CE2-CZ 3.91Å; Y1054-F1419 HydrophobicContact CG-CB 4.14Å; Y1054-F1419 HydrophobicContact CG-CD1 4.22Å; Y1054-F1419 AromaticContact CG-CD2 3.36Å; Y1054-F1419 HydrophobicContact CG-CD2 3.36Å; Y1054-F1419 HydrophobicContact CG-CE1 4.49Å; Y1054-F1419 AromaticContact CG-CE2 3.66Å; Y1054-F1419 HydrophobicContact CG-CE2 3.66Å; Y1054-F1419 AromaticContact CG-CG 3.65Å; Y1054-F1419 HydrophobicContact CG-CG 3.65Å; Y1054-F1419 HydrophobicContact CG-CZ 4.23Å; Y1054-F1419 AromaticContact CZ-CE1 3.92Å; Y1054-F1419 AromaticContact CZ-CE2 3.99Å; Y1054-F1419 AromaticContact CZ-CZ 3.66Å; M1072-F1419 HydrophobicContact CE-CD2 4.07Å; M1072-F1419 HydrophobicContact CE-CE1 4.06Å; M1072-F1419 HydrophobicContact CE-CE2 3.24Å; M1072-F1419 HydrophobicContact CE-CZ 3.23Å; M1072-F1419 HydrophobicContact SD-CD2 4.39Å; M1072-F1419 HydrophobicContact SD-CE2 3.37Å; M1072-F1419 WeakPolarHBondContact SD-CE2 3.3Å; M1072-F1419 HydrophobicContact SD-CZ 3.74Å; F1419-A1424 WeakPolarHBondContact O-CB 3.36Å
1420	N	76.1	Confident	83.4	Confident	57 Å²	57	25.3 Å²	25.3	31%	0.305	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	1.8	-177.4	-68.1	-29.2	0	0	0	113.7	Y1418	Y1418-N1420 PolarHBondContact O-N 3.37Å
1421	D	76.2	Confident	82.9	Confident	44 Å²	44	26.8 Å²	26.8	24%	0.235	13%	0.128	C	C	.	.	S	Bend	trans	-66.2	143.1	174.4	-71.8	-13.1	0	0	0	110.1	T1395 S1416 Y1418 D1423 A1424	T1395-D1421 VanDerWaalsContact CG2-OD2 3.24Å; T1395-D1421 WeakPolarHBondContact CG2-OD2 3.38Å; T1395-D1421 PolarHBondContact OG1-OD2 2.91Å; S1416-D1421 PolarHBondContact OG-OD2 2.86Å; Y1418-D1421 PolarHBondContact O-N 3.32Å; D1421-D1423 PolarHBondContact O-N 3.45Å; D1421-D1423 VanDerWaalsContact O-N 3.13Å; D1421-A1424 HydrophobicContact CB-CB 4.03Å; D1421-A1424 WeakPolarHBondContact O-CB 3.45Å; D1421-A1424 PolarHBondContact O-N 3.21Å
1422	D	68.9	Low	82	Confident	67 Å²	67	33.9 Å²	33.9	36%	0.358	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-31.3	-179.5	-88.2	-14.2	0	0	0	113.3	P1456 A1457 Y1458	D1422-P1456 HydrophobicContact CB-CB 3.88Å; D1422-P1456 WeakPolarHBondContact O-CG 3.5Å; D1422-P1456 VanDerWaalsContact OD1-CA 3.27Å; D1422-P1456 WeakPolarHBondContact OD1-CA 3.44Å; D1422-A1457 PolarHBondContact OD1-N 3.23Å; D1422-A1457 WeakPolarHBondContact OD2-CA 3.47Å; D1422-A1457 WeakPolarHBondContact OD2-CB 3.49Å; D1422-A1457 PolarHBondContact OD2-N 2.99Å; D1422-Y1458 HydrophobicContact CB-CD1 4.45Å; D1422-Y1458 HydrophobicContact CB-CE1 4.36Å
1423	D	73.7	Confident	80.5	Confident	52 Å²	52	40.8 Å²	40.8	28%	0.278	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	35.2	177.7	-62.2	-51.4	0	0	0	111.2	D1421 V1425 L1426 Y1458	D1421-D1423 PolarHBondContact O-N 3.45Å; D1421-D1423 VanDerWaalsContact O-N 3.13Å; D1423-V1425 VanDerWaalsContact C-N 3.28Å; D1423-V1425 PolarHBondContact O-N 3.03Å; D1423-L1426 HydrophobicContact CB-CD1 4.42Å; D1423-L1426 HydrophobicContact CB-CD2 4.01Å; D1423-L1426 HydrophobicContact CB-CG 4.4Å; D1423-Y1458 WeakPolarHBondContact OD1-CE1 3.31Å; D1423-Y1458 PolarHBondContact OD1-OH 3.31Å
1424	A	82.2	Confident	78.8	Confident	5 Å²	5	45.4 Å²	45.4	4%	0.041	23%	0.228	C	C	.	.	S	Bend	trans	-57.9	-39.1	-178.7	0	0	0	0	0	113.2	I1039 C1415 S1416 Y1418 F1419 D1421	I1039-A1424 HydrophobicContact CD1-CB 4.39Å; C1415-A1424 CarbonylContact C-O 3.59Å; C1415-A1424 WeakPolarHBondContact CA-O 3.26Å; S1416-A1424 PolarHBondContact N-O 3.41Å; S1416-A1424 WeakPolarHBondContact OG-CA 3.39Å; Y1418-A1424 WeakPolarHBondContact O-CB 3.42Å; F1419-A1424 WeakPolarHBondContact O-CB 3.36Å; D1421-A1424 HydrophobicContact CB-CB 4.03Å; D1421-A1424 WeakPolarHBondContact O-CB 3.45Å; D1421-A1424 PolarHBondContact O-N 3.21Å
1425	V	87.7	Confident	77.1	Confident	5 Å²	5	46.9 Å²	46.9	3%	0.03	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	114.3	-176	-171.4	0	0	0	0	109	I1039 I1052 I1413 S1414 D1423 I1443	I1039-V1425 HydrophobicContact CD1-CG2 4.13Å; I1052-V1425 HydrophobicContact CD1-CG1 4.01Å; I1052-V1425 HydrophobicContact CD1-CG2 3.72Å; I1413-V1425 HydrophobicContact CG2-CG1 3.63Å; S1414-V1425 WeakPolarHBondContact O-CA 3.45Å; D1423-V1425 VanDerWaalsContact C-N 3.28Å; D1423-V1425 PolarHBondContact O-N 3.03Å; V1425-I1443 HydrophobicContact CB-CB 4.31Å; V1425-I1443 HydrophobicContact CG1-CB 4.22Å; V1425-I1443 HydrophobicContact CG1-CD1 3.6Å; V1425-I1443 HydrophobicContact CG1-CG1 4.45Å; V1425-I1443 PolarHBondContact O-N 3.32Å
1426	L	88.8	Confident	75.5	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.3	-178.1	-60.5	175.2	0	0	0	110.9	V1392 I1413 S1414 D1423 N1440 P1442	V1392-L1426 HydrophobicContact CB-CD1 3.56Å; V1392-L1426 HydrophobicContact CG1-CD1 4.08Å; V1392-L1426 HydrophobicContact CG2-CD1 4.01Å; I1413-L1426 CarbonylContact C-O 3.51Å; I1413-L1426 VanDerWaalsContact CA-O 3.29Å; I1413-L1426 WeakPolarHBondContact CA-O 3.24Å; S1414-L1426 PolarHBondContact N-O 3.36Å; S1414-L1426 PolarHBondContact O-N 3.33Å; D1423-L1426 HydrophobicContact CB-CD1 4.42Å; D1423-L1426 HydrophobicContact CB-CD2 4.01Å; D1423-L1426 HydrophobicContact CB-CG 4.4Å; L1426-N1440 HydrophobicContact CB-CB 4.37Å; L1426-P1442 HydrophobicContact CD2-CB 4.05Å
1427	K	88.3	Confident	74.4	Confident	25 Å²	25	54.4 Å²	54.4	11%	0.109	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122.1	171.6	173.6	178.6	170.7	-179.1	0	109.8	V1067 N1070 L1411 I1413 N1440 E1441 I1443	V1067-K1427 HydrophobicContact CG1-CD 4.07Å; V1067-K1427 PolarHBondContact O-NZ 2.94Å; N1070-K1427 WeakPolarHBondContact OD1-CD 3.41Å; N1070-K1427 PolarHBondContact OD1-NZ 2.74Å; L1411-K1427 HydrophobicContact CD1-CD 3.81Å; L1411-K1427 HydrophobicContact CD1-CG 3.69Å; I1413-K1427 HydrophobicContact CD1-CB 4.01Å; I1413-K1427 HydrophobicContact CD1-CG 4.44Å; K1427-N1440 CarbonylContact O-C 3.51Å; K1427-N1440 VanDerWaalsContact O-CA 3.25Å; K1427-N1440 WeakPolarHBondContact O-CA 3.39Å; K1427-E1441 PolarHBondContact N-O 2.86Å; K1427-E1441 PolarHBondContact O-N 2.71Å; K1427-I1443 HydrophobicContact CB-CD1 4.14Å; K1427-I1443 HydrophobicContact CB-CG1 4.27Å
1428	W	87.5	Confident	73.9	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.008	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	130.7	177.5	-62.4	79.9	0	0	0	110.3	W1283 V1291 V1392 I1412 S1414 W1438 T1439 N1440	W1283-W1428 HydrophobicContact CH2-CB 4.27Å; W1283-W1428 HydrophobicContact CH2-CD2 4.21Å; W1283-W1428 HydrophobicContact CH2-CE3 4.1Å; W1283-W1428 HydrophobicContact CH2-CG 4.32Å; W1283-W1428 HydrophobicContact CZ3-CB 4.46Å; W1283-W1428 AromaticContact CZ3-CD2 3.84Å; W1283-W1428 HydrophobicContact CZ3-CD2 3.84Å; W1283-W1428 AromaticContact CZ3-CE3 3.99Å; W1283-W1428 HydrophobicContact CZ3-CE3 3.99Å; W1283-W1428 HydrophobicContact CZ3-CG 4.06Å; V1291-W1428 HydrophobicContact CB-CH2 4.24Å; V1291-W1428 HydrophobicContact CB-CZ2 3.95Å; V1291-W1428 HydrophobicContact CG1-CH2 4.37Å; V1291-W1428 HydrophobicContact CG1-CZ2 4.09Å; V1291-W1428 HydrophobicContact CG2-CZ2 3.96Å; V1392-W1428 HydrophobicContact CG1-CH2 3.71Å; V1392-W1428 HydrophobicContact CG1-CZ2 3.69Å; V1392-W1428 HydrophobicContact CG2-CZ2 4.47Å; I1412-W1428 HydrophobicContact CB-CB 4.06Å; I1412-W1428 WeakPolarHBondContact O-CB 3.34Å; I1412-W1428 PolarHBondContact O-N 3.46Å; S1414-W1428 PolarHBondContact OG-NE1 3.26Å; W1428-W1438 HydrophobicContact CB-CE3 4.19Å; W1428-W1438 HydrophobicContact CE3-CB 4.23Å; W1428-T1439 WeakPolarHBondContact CA-O 3.23Å; W1428-N1440 HydrophobicContact CD2-CB 3.91Å; W1428-N1440 HydrophobicContact CE3-CB 3.94Å; W1428-N1440 HydrophobicContact CG-CB 4.46Å; W1428-N1440 HydrophobicContact CH2-CB 4.31Å; W1428-N1440 WeakPolarHBondContact CH2-ND2 3.21Å; W1428-N1440 HydrophobicContact CZ2-CB 4.26Å; W1428-N1440 HydrophobicContact CZ3-CB 4.15Å
1429	K	79	Confident	73.5	Confident	74 Å²	74	57.1 Å²	57.1	32%	0.322	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.1	175.1	68.8	-177.4	-172.6	178.2	0	110.4	T1439 E1441	K1429-T1439 WeakPolarHBondContact CG-OG1 3.26Å; K1429-T1439 PolarHBondContact N-O 3.36Å; K1429-T1439 PolarHBondContact O-N 3.08Å; K1429-T1439 VanDerWaalsContact O-O 3.14Å; K1429-T1439 PolarHBondContact O-OG1 3.46Å; K1429-E1441 VanDerWaalsContact CE-OE1 3.24Å; K1429-E1441 WeakPolarHBondContact CE-OE1 3.38Å; K1429-E1441 IonicContact NZ-OE1 3.71Å; K1429-E1441 PolarHBondContact NZ-OE1 2.93Å
1430	R	75.2	Confident	73.6	Confident	135 Å²	135	59.5 Å²	59.5	51%	0.509	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	130.7	174	-159.3	170.7	-175.5	175.6	-1.3	108.7	N1432 G1435 W1438	R1430-N1432 PolarHBondContact O-N 2.97Å; R1430-G1435 PolarHBondContact NE-O 3.4Å; R1430-G1435 PolarHBondContact NH2-O 3.14Å; R1430-W1438 HydrophobicContact CB-CE3 4.41Å; R1430-W1438 HydrophobicContact CB-CH2 4.48Å; R1430-W1438 HydrophobicContact CB-CZ3 4.38Å
1431	D	68.6	Low	73.9	Confident	50 Å²	50	59.5 Å²	59.5	27%	0.267	31%	0.314	S	S	.	.			trans	-67.1	123.7	175.3	-179.6	13.5	0	0	0	109.9	N1433 G1435 I1437 T1439	D1431-N1433 PolarHBondContact O-N 2.93Å; D1431-N1433 PolarHBondContact OD1-N 3.49Å; D1431-G1435 PolarHBondContact O-N 3.44Å; D1431-I1437 PolarHBondContact N-O 2.84Å; D1431-T1439 HydrophobicContact CB-CG2 4.5Å
1432	N	64.3	Low	74.3	Confident	151 Å²	151	57.9 Å²	57.9	81%	0.807	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-26.9	-178.1	-72.9	-17.1	0	0	0	112.3	R1430	R1430-N1432 PolarHBondContact O-N 2.97Å
1433	N	57.3	Low	75	Confident	145 Å²	145	55.3 Å²	55.3	78%	0.775	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-39.8	-174.1	-68.3	-17.5	0	0	0	112.8	D1431	D1431-N1433 PolarHBondContact O-N 2.93Å; D1431-N1433 PolarHBondContact OD1-N 3.49Å
1434	N	54.9	Low	75.3	Confident	98 Å²	98	55.5 Å²	55.5	52%	0.524	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-5.4	-175.6	-82.2	-14.2	0	0	0	114.6	S1436 I1437	N1434-S1436 PolarHBondContact O-N 2.86Å; N1434-S1436 PolarHBondContact O-OG 3.24Å; N1434-I1437 HydrophobicContact CB-CD1 3.8Å; N1434-I1437 HydrophobicContact CB-CG1 4.11Å
1435	G	55.2	Low	75.1	Confident	32 Å²	32	57.1 Å²	57.1	33%	0.33	30%	0.299	S	S	.	.	S	Bend	trans	55.9	-4.1	170.8	0	0	0	0	0	116.2	R1430 D1431	R1430-G1435 PolarHBondContact NE-O 3.4Å; R1430-G1435 PolarHBondContact NH2-O 3.14Å; D1431-G1435 PolarHBondContact O-N 3.44Å
1436	S	58.6	Low	74.6	Confident	78 Å²	78	59.5 Å²	59.5	55%	0.545	31%	0.309	S	S	.	.	S	Bend	trans	-128	-18.9	-170.3	-38.3	0	0	0	0	111.1	N1434	N1434-S1436 PolarHBondContact O-N 2.86Å; N1434-S1436 PolarHBondContact O-OG 3.24Å
1437	I	66.8	Low	73.8	Confident	83 Å²	83	62.6 Å²	62.6	43%	0.426	33%	0.326	S	S	.	.			trans	-99.5	124.4	-171.8	-55.5	177.8	0	0	0	108	D1431 N1434	D1431-I1437 PolarHBondContact N-O 2.84Å; N1434-I1437 HydrophobicContact CB-CD1 3.8Å; N1434-I1437 HydrophobicContact CB-CG1 4.11Å
1438	W	76.5	Confident	72.8	Confident	31 Å²	31	67.7 Å²	67.7	12%	0.117	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	134.6	170.5	-71.9	90.9	0	0	0	109.1	W1283 I1412 W1428 R1430	W1283-W1438 HydrophobicContact CH2-CB 4.26Å; W1283-W1438 AromaticContact CH2-CD2 3.63Å; W1283-W1438 HydrophobicContact CH2-CD2 3.63Å; W1283-W1438 AromaticContact CH2-CE3 3.75Å; W1283-W1438 HydrophobicContact CH2-CE3 3.75Å; W1283-W1438 AromaticContact CH2-CG 3.85Å; W1283-W1438 HydrophobicContact CH2-CG 3.85Å; W1283-W1438 HydrophobicContact CH2-CZ3 4.29Å; W1283-W1438 AromaticContact CZ2-CD2 3.53Å; W1283-W1438 HydrophobicContact CZ2-CD2 3.53Å; W1283-W1438 AromaticContact CZ2-CE2 3.5Å; W1283-W1438 AromaticContact CZ2-CE3 3.85Å; W1283-W1438 HydrophobicContact CZ2-CE3 3.85Å; W1283-W1438 AromaticContact CZ2-CG 3.96Å; W1283-W1438 HydrophobicContact CZ2-CG 3.96Å; W1283-W1438 HydrophobicContact CZ2-CH2 4.08Å; W1283-W1438 AromaticContact CZ2-CZ2 3.8Å; W1283-W1438 HydrophobicContact CZ2-CZ2 3.8Å; W1283-W1438 HydrophobicContact CZ2-CZ3 4.11Å; W1283-W1438 AromaticContact CZ2-NE1 3.87Å; I1412-W1438 HydrophobicContact CD1-CH2 3.9Å; I1412-W1438 HydrophobicContact CD1-CZ3 4.1Å; W1428-W1438 HydrophobicContact CB-CE3 4.19Å; W1428-W1438 HydrophobicContact CE3-CB 4.23Å; R1430-W1438 HydrophobicContact CB-CE3 4.41Å; R1430-W1438 HydrophobicContact CB-CH2 4.48Å; R1430-W1438 HydrophobicContact CB-CZ3 4.38Å
1439	T	76.8	Confident	71.7	Confident	49 Å²	49	76.5 Å²	76.5	30%	0.301	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	151.9	174.5	57	0	0	0	0	108.5	W1428 K1429 D1431	W1428-T1439 WeakPolarHBondContact CA-O 3.23Å; K1429-T1439 WeakPolarHBondContact CG-OG1 3.26Å; K1429-T1439 PolarHBondContact N-O 3.36Å; K1429-T1439 PolarHBondContact O-N 3.08Å; K1429-T1439 VanDerWaalsContact O-O 3.14Å; K1429-T1439 PolarHBondContact O-OG1 3.46Å; D1431-T1439 HydrophobicContact CB-CG2 4.5Å
1440	N	83.7	Confident	71.3	Confident	64 Å²	64	75.9 Å²	75.9	34%	0.342	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	151.4	176	59.1	53.1	0	0	0	111.1	L1426 K1427 W1428	L1426-N1440 HydrophobicContact CB-CB 4.37Å; K1427-N1440 CarbonylContact O-C 3.51Å; K1427-N1440 VanDerWaalsContact O-CA 3.25Å; K1427-N1440 WeakPolarHBondContact O-CA 3.39Å; W1428-N1440 HydrophobicContact CD2-CB 3.91Å; W1428-N1440 HydrophobicContact CE3-CB 3.94Å; W1428-N1440 HydrophobicContact CG-CB 4.46Å; W1428-N1440 HydrophobicContact CH2-CB 4.31Å; W1428-N1440 WeakPolarHBondContact CH2-ND2 3.21Å; W1428-N1440 HydrophobicContact CZ2-CB 4.26Å; W1428-N1440 HydrophobicContact CZ3-CB 4.15Å
1441	E	83	Confident	71	Confident	56 Å²	56	76.7 Å²	76.7	26%	0.262	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134	173.3	-64.6	-177.3	160.9	0	0	108.4	N1070 K1427 K1429	N1070-E1441 PolarHBondContact ND2-OE2 3.48Å; K1427-E1441 PolarHBondContact N-O 2.86Å; K1427-E1441 PolarHBondContact O-N 2.71Å; K1429-E1441 VanDerWaalsContact CE-OE1 3.24Å; K1429-E1441 WeakPolarHBondContact CE-OE1 3.38Å; K1429-E1441 IonicContact NZ-OE1 3.71Å; K1429-E1441 PolarHBondContact NZ-OE1 2.93Å
1442	P	84	Confident	71.1	Confident	11 Å²	11	77 Å²	77	7%	0.071	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	144	174.8	30.3	-34.7	0	0	0	111.3	L1426 Y1444 P1456 M1459	L1426-P1442 HydrophobicContact CD2-CB 4.05Å; P1442-Y1444 HydrophobicContact CG-CE1 4.01Å; P1442-P1456 HydrophobicContact CB-CG 4.46Å; P1442-M1459 HydrophobicContact CG-CE 3.57Å
1443	I	82.9	Confident	71.4	Confident	13 Å²	13	73.5 Å²	73.5	7%	0.067	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-91.4	124.8	170.3	-72.9	162	0	0	0	108.5	V1065 M1072 I1413 V1425 K1427	V1065-I1443 HydrophobicContact CG1-CD1 3.77Å; V1065-I1443 HydrophobicContact CG1-CG1 4.45Å; V1065-I1443 HydrophobicContact CG1-CG2 3.84Å; V1065-I1443 HydrophobicContact CG2-CG2 4.46Å; M1072-I1443 HydrophobicContact CB-CG2 3.89Å; I1413-I1443 HydrophobicContact CD1-CD1 3.41Å; I1413-I1443 VanDerWaalsContact CD1-CD1 3.41Å; V1425-I1443 HydrophobicContact CB-CB 4.31Å; V1425-I1443 HydrophobicContact CG1-CB 4.22Å; V1425-I1443 HydrophobicContact CG1-CD1 3.6Å; V1425-I1443 HydrophobicContact CG1-CG1 4.45Å; V1425-I1443 PolarHBondContact O-N 3.32Å; K1427-I1443 HydrophobicContact CB-CD1 4.14Å; K1427-I1443 HydrophobicContact CB-CG1 4.27Å
1444	Y	80.7	Confident	72	Confident	55 Å²	55	72 Å²	72	22%	0.216	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	141.9	-173.1	-54.6	-70.1	0	0	0	112	N1070 C1071 M1072 P1442 L1453 L1455 P1456 M1459	N1070-Y1444 HydrophobicContact CB-CD2 4.46Å; N1070-Y1444 WeakPolarHBondContact O-CD2 3.45Å; N1070-Y1444 PolarHBondContact O-N 3.04Å; C1071-Y1444 CarbonylContact C-O 3.54Å; C1071-Y1444 WeakPolarHBondContact CA-O 3.38Å; M1072-Y1444 PolarHBondContact N-O 2.98Å; P1442-Y1444 HydrophobicContact CG-CE1 4.01Å; Y1444-L1453 HydrophobicContact CD1-CD2 3.93Å; Y1444-L1453 HydrophobicContact CD2-CD2 3.8Å; Y1444-L1453 HydrophobicContact CG-CD2 3.42Å; Y1444-L1453 VanDerWaalsContact CG-CD2 3.42Å; Y1444-L1453 HydrophobicContact CG-CG 4.38Å; Y1444-L1455 HydrophobicContact CD1-CD2 3.99Å; Y1444-L1455 HydrophobicContact CE1-CD2 3.83Å; Y1444-P1456 HydrophobicContact CE1-CG 4.48Å; Y1444-M1459 HydrophobicContact CE1-CE 4.47Å; Y1444-M1459 HydrophobicContact CE1-SD 3.8Å; Y1444-M1459 PolarHBondContact OH-SD 3.13Å
1445	V	77.2	Confident	72.6	Confident	39 Å²	39	69.7 Å²	69.7	24%	0.236	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	122	173.1	-167.4	0	0	0	0	109.3	M1072 R1454	M1072-V1445 HydrophobicContact CE-CG2 3.53Å; V1445-R1454 HydrophobicContact CB-CB 4.23Å; V1445-R1454 PolarHBondContact O-N 3.33Å
1446	F	77.5	Confident	73.1	Confident	56 Å²	56	68.5 Å²	68.5	25%	0.246	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	114.2	171.4	179.7	-97.1	0	0	0	109.7	C1071 M1072 R1448 L1453	C1071-F1446 WeakPolarHBondContact SG-CB 3.39Å; M1072-F1446 PolarHBondContact O-N 2.72Å; F1446-R1448 HydrophobicContact CE1-CG 4.42Å; F1446-L1453 HydrophobicContact CD2-CD1 4.38Å
1447	D	71.7	Confident	73.4	Confident	67 Å²	67	66.2 Å²	66.2	36%	0.358	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	120.2	174.8	176	19.3	0	0	0	109.8	E1449 S1450 H1451 S1452	D1447-E1449 VanDerWaalsContact C-N 3.33Å; D1447-E1449 PolarHBondContact OD1-N 3.47Å; D1447-S1450 WeakPolarHBondContact CB-OG 3.28Å; D1447-S1450 VanDerWaalsContact CG-OG 3.25Å; D1447-S1450 VanDerWaalsContact OD2-CB 3.25Å; D1447-S1450 WeakPolarHBondContact OD2-CB 3.41Å; D1447-S1450 PolarHBondContact OD2-N 3.15Å; D1447-S1450 PolarHBondContact OD2-OG 3.46Å; D1447-H1451 WeakPolarHBondContact O-CA 3.29Å; D1447-H1451 PolarHBondContact O-N 3.44Å; D1447-H1451 VanDerWaalsContact O-N 3.09Å; D1447-S1452 PolarHBondContact N-O 2.81Å; D1447-S1452 PolarHBondContact O-N 3.47Å
1448	R	66.9	Low	73.5	Confident	133 Å²	133	67.1 Å²	67.1	50%	0.502	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-35.2	179.2	-82	-172.6	176	169.3	7	111.9	Q1073 F1446	Q1073-R1448 VanDerWaalsContact CD-NH2 3.29Å; Q1073-R1448 HydrophobicContact CG-CG 4.15Å; F1446-R1448 HydrophobicContact CE1-CG 4.42Å
1449	E	65.7	Low	73.2	Confident	187 Å²	187	67.9 Å²	67.9	87%	0.874	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-44.6	-173	-66.1	-171.8	168.4	0	0	111.6	D1447 H1451	D1447-E1449 VanDerWaalsContact C-N 3.33Å; D1447-E1449 PolarHBondContact OD1-N 3.47Å; E1449-H1451 VanDerWaalsContact C-N 3.34Å
1450	S	69	Low	72.7	Confident	61 Å²	61	71.2 Å²	71.2	43%	0.427	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-7	177	63.5	0	0	0	0	114.2	D1447 S1452	D1447-S1450 WeakPolarHBondContact CB-OG 3.28Å; D1447-S1450 VanDerWaalsContact CG-OG 3.25Å; D1447-S1450 VanDerWaalsContact OD2-CB 3.25Å; D1447-S1450 WeakPolarHBondContact OD2-CB 3.41Å; D1447-S1450 PolarHBondContact OD2-N 3.15Å; D1447-S1450 PolarHBondContact OD2-OG 3.46Å; S1450-S1452 PolarHBondContact O-N 3.43Å; S1450-S1452 VanDerWaalsContact O-N 3.13Å; S1450-S1452 PolarHBondContact OG-N 3.35Å; S1450-S1452 PolarHBondContact OG-OG 3.41Å
1451	H	69	Low	72	Confident	152 Å²	152	73.1 Å²	73.1	70%	0.704	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	35.3	-169	-73.4	-63	0	0	0	112.7	D1447 E1449	D1447-H1451 WeakPolarHBondContact O-CA 3.29Å; D1447-H1451 PolarHBondContact O-N 3.44Å; D1447-H1451 VanDerWaalsContact O-N 3.09Å; E1449-H1451 VanDerWaalsContact C-N 3.34Å
1452	S	72	Confident	71.2	Confident	56 Å²	56	73.3 Å²	73.3	39%	0.392	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	149.4	-173.7	80.4	0	0	0	0	112.2	D1447 S1450	D1447-S1452 PolarHBondContact N-O 2.81Å; D1447-S1452 PolarHBondContact O-N 3.47Å; S1450-S1452 PolarHBondContact O-N 3.43Å; S1450-S1452 VanDerWaalsContact O-N 3.13Å; S1450-S1452 PolarHBondContact OG-N 3.35Å; S1450-S1452 PolarHBondContact OG-OG 3.41Å
1453	L	70.3	Confident	70.4	Confident	78 Å²	78	76.3 Å²	76.3	41%	0.408	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	119.2	177	-145.1	109.6	0	0	0	108.5	Y1444 F1446 L1455	Y1444-L1453 HydrophobicContact CD1-CD2 3.93Å; Y1444-L1453 HydrophobicContact CD2-CD2 3.8Å; Y1444-L1453 HydrophobicContact CG-CD2 3.42Å; Y1444-L1453 VanDerWaalsContact CG-CD2 3.42Å; Y1444-L1453 HydrophobicContact CG-CG 4.38Å; F1446-L1453 HydrophobicContact CD2-CD1 4.38Å; L1453-L1455 HydrophobicContact CD2-CD2 3.99Å; L1453-L1455 PolarHBondContact O-N 3.36Å; L1453-L1455 VanDerWaalsContact O-N 3.12Å
1454	R	69.7	Low	69.5	Low	114 Å²	114	79.1 Å²	79.1	43%	0.43	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	100.3	176.3	-165.5	179.9	-175.1	176.8	2.8	109	V1445	V1445-R1454 HydrophobicContact CB-CB 4.23Å; V1445-R1454 PolarHBondContact O-N 3.33Å
1455	L	66.7	Low	68.8	Low	48 Å²	48	81.8 Å²	81.8	25%	0.251	41%	0.411	S	S	.	.			trans	-78.6	142.9	176.9	-69.6	172.4	0	0	0	111.4	Y1444 L1453 R1460 L1463	Y1444-L1455 HydrophobicContact CD1-CD2 3.99Å; Y1444-L1455 HydrophobicContact CE1-CD2 3.83Å; L1453-L1455 HydrophobicContact CD2-CD2 3.99Å; L1453-L1455 PolarHBondContact O-N 3.36Å; L1453-L1455 VanDerWaalsContact O-N 3.12Å; L1455-R1460 HydrophobicContact CB-CG 3.8Å; L1455-R1460 PolarHBondContact O-NE 3.43Å; L1455-R1460 PolarHBondContact O-NH2 3.32Å; L1455-L1463 HydrophobicContact CD1-CD1 3.82Å
1456	P	66.8	Low	68.3	Low	7 Å²	7	85.5 Å²	85.5	5%	0.045	43%	0.426	C	S	.	.			trans	-52.7	146.6	169.7	-27.6	35.5	0	0	0	112.3	D1422 P1442 Y1444 Y1458 M1459 R1460	D1422-P1456 HydrophobicContact CB-CB 3.88Å; D1422-P1456 WeakPolarHBondContact O-CG 3.5Å; D1422-P1456 VanDerWaalsContact OD1-CA 3.27Å; D1422-P1456 WeakPolarHBondContact OD1-CA 3.44Å; P1442-P1456 HydrophobicContact CB-CG 4.46Å; Y1444-P1456 HydrophobicContact CE1-CG 4.48Å; P1456-Y1458 VanDerWaalsContact C-N 3.28Å; P1456-Y1458 HydrophobicContact CB-CD1 3.64Å; P1456-Y1458 HydrophobicContact CB-CE1 3.3Å; P1456-Y1458 HydrophobicContact CB-CG 4.44Å; P1456-Y1458 HydrophobicContact CG-CE1 4.06Å; P1456-Y1458 PolarHBondContact O-N 3.49Å; P1456-M1459 HydrophobicContact CB-CG 4.4Å; P1456-M1459 HydrophobicContact CG-CG 4.49Å; P1456-M1459 HydrophobicContact CG-SD 4.46Å; P1456-M1459 PolarHBondContact O-N 2.89Å; P1456-M1459 VanDerWaalsContact O-N 3.08Å; P1456-R1460 PolarHBondContact O-N 3.39Å
1457	A	65.2	Low	67.7	Low	31 Å²	31	88.4 Å²	88.4	26%	0.256	44%	0.442	S	S	.	.	H	α-helix	trans	-58.5	-38.7	-176.7	0	0	0	0	0	112.5	D1422 M1459 R1460 N1461	D1422-A1457 PolarHBondContact OD1-N 3.23Å; D1422-A1457 WeakPolarHBondContact OD2-CA 3.47Å; D1422-A1457 WeakPolarHBondContact OD2-CB 3.49Å; D1422-A1457 PolarHBondContact OD2-N 2.99Å; A1457-M1459 PolarHBondContact O-N 2.92Å; A1457-R1460 PolarHBondContact O-N 3.16Å; A1457-N1461 WeakPolarHBondContact O-CB 3.32Å; A1457-N1461 VanDerWaalsContact O-CG 3.25Å; A1457-N1461 PolarHBondContact O-N 3.26Å; A1457-N1461 PolarHBondContact O-ND2 3.17Å
1458	Y	68.5	Low	67.2	Low	102 Å²	102	91.6 Å²	91.6	40%	0.4	45%	0.454	S	S	.	.	H	α-helix	trans	-65.1	-36.4	176.5	68.1	-93	0	0	0	112.8	D1422 D1423 P1456 N1461 S1462	D1422-Y1458 HydrophobicContact CB-CD1 4.45Å; D1422-Y1458 HydrophobicContact CB-CE1 4.36Å; D1423-Y1458 WeakPolarHBondContact OD1-CE1 3.31Å; D1423-Y1458 PolarHBondContact OD1-OH 3.31Å; P1456-Y1458 VanDerWaalsContact C-N 3.28Å; P1456-Y1458 HydrophobicContact CB-CD1 3.64Å; P1456-Y1458 HydrophobicContact CB-CE1 3.3Å; P1456-Y1458 HydrophobicContact CB-CG 4.44Å; P1456-Y1458 HydrophobicContact CG-CE1 4.06Å; P1456-Y1458 PolarHBondContact O-N 3.49Å; Y1458-N1461 PolarHBondContact O-N 3.47Å; Y1458-S1462 WeakPolarHBondContact O-CB 3.44Å; Y1458-S1462 PolarHBondContact O-N 3.45Å
1459	M	69.5	Low	66.7	Low	46 Å²	46	89.8 Å²	89.8	23%	0.227	45%	0.454	C	S	.	.	H	α-helix	trans	-69.9	-40.9	174.5	-70.8	-163.4	176.6	0	0	111.2	P1442 Y1444 P1456 A1457 N1461 S1462 L1463	P1442-M1459 HydrophobicContact CG-CE 3.57Å; Y1444-M1459 HydrophobicContact CE1-CE 4.47Å; Y1444-M1459 HydrophobicContact CE1-SD 3.8Å; Y1444-M1459 PolarHBondContact OH-SD 3.13Å; P1456-M1459 HydrophobicContact CB-CG 4.4Å; P1456-M1459 HydrophobicContact CG-CG 4.49Å; P1456-M1459 HydrophobicContact CG-SD 4.46Å; P1456-M1459 PolarHBondContact O-N 2.89Å; P1456-M1459 VanDerWaalsContact O-N 3.08Å; A1457-M1459 PolarHBondContact O-N 2.92Å; M1459-N1461 VanDerWaalsContact C-N 3.31Å; M1459-N1461 PolarHBondContact O-N 3.35Å; M1459-S1462 PolarHBondContact O-N 3.43Å; M1459-L1463 WeakPolarHBondContact O-CB 3.36Å; M1459-L1463 PolarHBondContact O-N 3.37Å
1460	R	66.5	Low	66.2	Low	120 Å²	120	87.7 Å²	87.7	45%	0.453	44%	0.442	S	S	.	.	H	α-helix	trans	-58.3	-43.9	173.1	-75.8	-173.8	-90.6	156.5	-1.1	111.3	L1455 P1456 A1457 L1463 C1464	L1455-R1460 HydrophobicContact CB-CG 3.8Å; L1455-R1460 PolarHBondContact O-NE 3.43Å; L1455-R1460 PolarHBondContact O-NH2 3.32Å; P1456-R1460 PolarHBondContact O-N 3.39Å; A1457-R1460 PolarHBondContact O-N 3.16Å; R1460-L1463 PolarHBondContact O-N 3.31Å; R1460-C1464 WeakPolarHBondContact O-CB 3.29Å; R1460-C1464 PolarHBondContact O-N 3.2Å; R1460-C1464 PolarHBondContact O-SG 3.1Å
1461	N	68.7	Low	65.5	Low	104 Å²	104	91.8 Å²	91.8	56%	0.556	45%	0.453	S	S	*	.	H	α-helix	trans	-65.2	-42.7	177.4	-70.8	-17.8	0	0	0	112.2	A1457 Y1458 M1459 C1464 L1465	A1457-N1461 WeakPolarHBondContact O-CB 3.32Å; A1457-N1461 VanDerWaalsContact O-CG 3.25Å; A1457-N1461 PolarHBondContact O-N 3.26Å; A1457-N1461 PolarHBondContact O-ND2 3.17Å; Y1458-N1461 PolarHBondContact O-N 3.47Å; M1459-N1461 VanDerWaalsContact C-N 3.31Å; M1459-N1461 PolarHBondContact O-N 3.35Å; N1461-C1464 PolarHBondContact O-N 3.35Å; N1461-L1465 WeakPolarHBondContact O-CB 3.45Å; N1461-L1465 WeakPolarHBondContact O-CG 3.4Å; N1461-L1465 PolarHBondContact O-N 2.86Å
1462	S	67.5	Low	64.5	Low	59 Å²	59	87 Å²	87	41%	0.413	44%	0.437	S	S	.	.	H	α-helix	trans	-65	-42.8	176	-171.8	0	0	0	0	112.4	Y1458 M1459 L1465 Q1466	Y1458-S1462 WeakPolarHBondContact O-CB 3.44Å; Y1458-S1462 PolarHBondContact O-N 3.45Å; M1459-S1462 PolarHBondContact O-N 3.43Å; S1462-L1465 PolarHBondContact O-N 2.93Å; S1462-Q1466 WeakPolarHBondContact O-CB 3.42Å; S1462-Q1466 WeakPolarHBondContact O-CG 3.06Å; S1462-Q1466 PolarHBondContact O-N 3.2Å
1463	L	66	Low	63.4	Low	74 Å²	74	89 Å²	89	39%	0.387	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-42.1	173.2	-102.7	146.9	0	0	0	111.8	L1455 M1459 R1460 Q1466 M1467	L1455-L1463 HydrophobicContact CD1-CD1 3.82Å; M1459-L1463 WeakPolarHBondContact O-CB 3.36Å; M1459-L1463 PolarHBondContact O-N 3.37Å; R1460-L1463 PolarHBondContact O-N 3.31Å; L1463-Q1466 PolarHBondContact O-N 3.37Å; L1463-M1467 HydrophobicContact CD2-CE 4.47Å; L1463-M1467 VanDerWaalsContact O-CB 3.25Å; L1463-M1467 WeakPolarHBondContact O-CB 3.32Å; L1463-M1467 WeakPolarHBondContact O-CG 3.45Å; L1463-M1467 PolarHBondContact O-N 3.45Å
1464	C	65.5	Low	62.4	Low	73 Å²	73	91.1 Å²	91.1	49%	0.493	45%	0.452	S	S	.	.	H	α-helix	trans	-61.5	-43.6	173.6	-85.2	0	0	0	0	111.7	R1460 N1461 M1467 H1468	R1460-C1464 WeakPolarHBondContact O-CB 3.29Å; R1460-C1464 PolarHBondContact O-N 3.2Å; R1460-C1464 PolarHBondContact O-SG 3.1Å; N1461-C1464 PolarHBondContact O-N 3.35Å; C1464-M1467 PolarHBondContact O-N 2.88Å; C1464-H1468 WeakPolarHBondContact O-CB 3.35Å; C1464-H1468 PolarHBondContact O-CD2 3.43Å; C1464-H1468 PolarHBondContact O-N 3.29Å
1465	L	65.5	Low	61.3	Low	111 Å²	111	93.5 Å²	93.5	58%	0.581	47%	0.47	S	S	*	.	H	α-helix	trans	-63.9	-42.5	175.3	-78.2	161	0	0	0	111.8	N1461 S1462 H1468 N1469	N1461-L1465 WeakPolarHBondContact O-CB 3.45Å; N1461-L1465 WeakPolarHBondContact O-CG 3.4Å; N1461-L1465 PolarHBondContact O-N 2.86Å; S1462-L1465 PolarHBondContact O-N 2.93Å; L1465-H1468 PolarHBondContact O-N 3.06Å; L1465-N1469 WeakPolarHBondContact O-CB 3.45Å; L1465-N1469 VanDerWaalsContact O-CG 3.3Å; L1465-N1469 PolarHBondContact O-N 2.99Å
1466	Q	66.9	Low	60.2	Low	117 Å²	117	98 Å²	98	55%	0.547	49%	0.494	S	S	.	.	H	α-helix	trans	-67.3	-37.9	175.2	-74.5	-173.5	-0.2	0	0	112.5	S1462 L1463 N1469 K1470	S1462-Q1466 WeakPolarHBondContact O-CB 3.42Å; S1462-Q1466 WeakPolarHBondContact O-CG 3.06Å; S1462-Q1466 PolarHBondContact O-N 3.2Å; L1463-Q1466 PolarHBondContact O-N 3.37Å; Q1466-N1469 PolarHBondContact O-N 3.43Å; Q1466-K1470 WeakPolarHBondContact O-CB 3.31Å; Q1466-K1470 WeakPolarHBondContact O-CG 3.41Å; Q1466-K1470 PolarHBondContact O-N 3.07Å
1467	M	65	Low	58.6	Low	116 Å²	116	106.2 Å²	106.2	57%	0.571	54%	0.538	S	S	*	.	H	α-helix	trans	-66.8	-41.1	174.1	-74.7	-102.3	-172.1	0	0	111.1	L1463 C1464 K1470 K1471	L1463-M1467 HydrophobicContact CD2-CE 4.47Å; L1463-M1467 VanDerWaalsContact O-CB 3.25Å; L1463-M1467 WeakPolarHBondContact O-CB 3.32Å; L1463-M1467 WeakPolarHBondContact O-CG 3.45Å; L1463-M1467 PolarHBondContact O-N 3.45Å; C1464-M1467 PolarHBondContact O-N 2.88Å; M1467-K1470 PolarHBondContact O-N 2.85Å; M1467-K1471 WeakPolarHBondContact O-CB 3.47Å; M1467-K1471 WeakPolarHBondContact O-CG 3.37Å; M1467-K1471 PolarHBondContact O-N 3.37Å
1468	H	60.7	Low	58.3	Low	134 Å²	134	110 Å²	110	62%	0.62	55%	0.552	S	S	*	*	H	α-helix	trans	-65.6	-41.9	173.6	-94.1	-74.8	0	0	0	111.8	C1464 L1465 K1471 S1472	C1464-H1468 WeakPolarHBondContact O-CB 3.35Å; C1464-H1468 PolarHBondContact O-CD2 3.43Å; C1464-H1468 PolarHBondContact O-N 3.29Å; L1465-H1468 PolarHBondContact O-N 3.06Å; H1468-K1471 PolarHBondContact O-N 3.1Å; H1468-S1472 PolarHBondContact O-N 3.41Å
1469	N	56.8	Low	57.8	Low	95 Å²	95	110.4 Å²	110.4	51%	0.508	56%	0.56	S	S	.	*	H	α-helix	trans	-66.4	-39.7	174	-76.6	-15.9	0	0	0	111.7	L1465 Q1466 S1472 I1473	L1465-N1469 WeakPolarHBondContact O-CB 3.45Å; L1465-N1469 VanDerWaalsContact O-CG 3.3Å; L1465-N1469 PolarHBondContact O-N 2.99Å; Q1466-N1469 PolarHBondContact O-N 3.43Å; N1469-S1472 PolarHBondContact O-N 3.34Å; N1469-S1472 PolarHBondContact O-OG 2.93Å; N1469-I1473 WeakPolarHBondContact O-CB 3.39Å; N1469-I1473 WeakPolarHBondContact O-CD1 3.42Å; N1469-I1473 WeakPolarHBondContact O-CG1 3.42Å; N1469-I1473 PolarHBondContact O-N 2.97Å
1470	K	55.5	Low	57.1	Low	143 Å²	143	114 Å²	114	62%	0.622	58%	0.579	S	S	*	*	H	α-helix	trans	-65	-41.4	172.6	-82.2	-176.7	176.1	178.9	0	111.6	Q1466 M1467 I1473 I1474	Q1466-K1470 WeakPolarHBondContact O-CB 3.31Å; Q1466-K1470 WeakPolarHBondContact O-CG 3.41Å; Q1466-K1470 PolarHBondContact O-N 3.07Å; M1467-K1470 PolarHBondContact O-N 2.85Å; K1470-I1473 PolarHBondContact O-N 2.97Å; K1470-I1474 WeakPolarHBondContact O-CB 3.49Å; K1470-I1474 WeakPolarHBondContact O-CD1 3.48Å; K1470-I1474 WeakPolarHBondContact O-CG1 3.5Å; K1470-I1474 PolarHBondContact O-N 3.17Å
1471	K	52.4	Low	56.6	Low	147 Å²	147	113.6 Å²	113.6	64%	0.639	59%	0.586	S	S	*	*	H	α-helix	trans	-64.7	-37.3	174.1	-82.5	-175	176	-179.3	0	112.2	M1467 H1468 I1474 M1475	M1467-K1471 WeakPolarHBondContact O-CB 3.47Å; M1467-K1471 WeakPolarHBondContact O-CG 3.37Å; M1467-K1471 PolarHBondContact O-N 3.37Å; H1468-K1471 PolarHBondContact O-N 3.1Å; K1471-I1474 PolarHBondContact O-N 3.12Å; K1471-M1475 WeakPolarHBondContact O-CB 3.25Å; K1471-M1475 WeakPolarHBondContact O-CG 3.32Å; K1471-M1475 PolarHBondContact O-N 3.22Å
1472	S	48.1	Very low	55.8	Low	53 Å²	53	114.3 Å²	114.3	37%	0.371	59%	0.588	S	S	.	*	H	α-helix	trans	-70.6	-36.8	175.2	79.7	0	0	0	0	111.9	H1468 N1469 I1474 M1475 N1476	H1468-S1472 PolarHBondContact O-N 3.41Å; N1469-S1472 PolarHBondContact O-N 3.34Å; N1469-S1472 PolarHBondContact O-OG 2.93Å; S1472-I1474 VanDerWaalsContact C-N 3.34Å; S1472-M1475 PolarHBondContact O-N 3.14Å; S1472-N1476 VanDerWaalsContact O-CB 3.28Å; S1472-N1476 WeakPolarHBondContact O-CB 3.27Å; S1472-N1476 PolarHBondContact O-N 3.07Å
1473	I	49.1	Very low	55	Low	97 Å²	97	117.9 Å²	117.9	50%	0.497	60%	0.6	S	S	.	*	H	α-helix	trans	-66.1	-35.8	172.9	-67.1	162	0	0	0	111.2	N1469 K1470 N1477	N1469-I1473 WeakPolarHBondContact O-CB 3.39Å; N1469-I1473 WeakPolarHBondContact O-CD1 3.42Å; N1469-I1473 WeakPolarHBondContact O-CG1 3.42Å; N1469-I1473 PolarHBondContact O-N 2.97Å; K1470-I1473 PolarHBondContact O-N 2.97Å; I1473-N1477 WeakPolarHBondContact O-CB 3.47Å; I1473-N1477 PolarHBondContact O-N 2.96Å; I1473-N1477 PolarHBondContact O-ND2 3.33Å
1474	I	49.8	Very low	54.3	Low	123 Å²	123	121.1 Å²	121.1	63%	0.631	62%	0.615	S	S	*	*	H	α-helix	trans	-76.4	-27.6	175.8	-65.9	164.9	0	0	0	112.2	K1470 K1471 S1472 N1477	K1470-I1474 WeakPolarHBondContact O-CB 3.49Å; K1470-I1474 WeakPolarHBondContact O-CD1 3.48Å; K1470-I1474 WeakPolarHBondContact O-CG1 3.5Å; K1470-I1474 PolarHBondContact O-N 3.17Å; K1471-I1474 PolarHBondContact O-N 3.12Å; S1472-I1474 VanDerWaalsContact C-N 3.34Å; I1474-N1477 VanDerWaalsContact O-OXT 3.04Å
1475	M	45.7	Very low	53.4	Low	164 Å²	164	124.8 Å²	124.8	81%	0.808	62%	0.624	S	S	*	*	H	α-helix	trans	-84.3	-21.7	174.7	-77.4	-98.7	-90	0	0	113.3	K1471 S1472	K1471-M1475 WeakPolarHBondContact O-CB 3.25Å; K1471-M1475 WeakPolarHBondContact O-CG 3.32Å; K1471-M1475 PolarHBondContact O-N 3.22Å; S1472-M1475 PolarHBondContact O-N 3.14Å
1476	N	45.3	Very low	52.4	Low	141 Å²	141	125.9 Å²	125.9	75%	0.754	63%	0.628	S	S	*	*	H	α-helix	trans	-91.6	-10.7	175.3	-79.4	-12.6	0	0	0	113.8	S1472	S1472-N1476 VanDerWaalsContact O-CB 3.28Å; S1472-N1476 WeakPolarHBondContact O-CB 3.27Å; S1472-N1476 PolarHBondContact O-N 3.07Å
1477	N	33.2	Very low	51.1	Low	181 Å²	181	126.7 Å²	126.7	97%	0.968	64%	0.635	S	S	*	*			trans	-98.2	0	167.5	-76.5	-22.3	0	0	0	109.5	I1473 I1474	I1473-N1477 WeakPolarHBondContact O-CB 3.47Å; I1473-N1477 PolarHBondContact O-N 2.96Å; I1473-N1477 PolarHBondContact O-ND2 3.33Å; I1474-N1477 VanDerWaalsContact O-OXT 3.04Å

Retrieved 1,477 of 1,477 residues in 336.6 ms (Link to these results)

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