A0A5K4F1I1_SCHMA Loading...

PH domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1I1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,462 aa.

						>A0A5K4F1I1_SCHMA|A0A5K4F1I1
MSSWQRLSGYLNSKPTGPFKRLKGIQRHWYVFEESTLKLMAYRNQMDAAIPDKEPLKTINIHGAVFHIDPAEHNQFSIISDGKEHILQAETEDAMLLWLHVLQTRRNEAVQTSESDNSSPNDDSLTDYKLFRQNSLMKMQMSIPTRASPIISSDSNESSFNNNGSLRSRKSSSHQNLNKLIKQLSIDQMNDHQSYNNNHLLIDHTSLWISPIDHSMNTSSSSSTTSTTNYDLMRRLSYNRSNSYDSDIIKQHVNDLNIINDKSIKLLSKSNNYLINQSSSSSSSNNKIYHRNRIMNLPIEEEENEDYSILNEKLSNQINGENRSHLRTTMKVLDNLSENKCQVNNQKEELMPENNLIGNDSYLVGEINGESREVSNTDSTESDEFNQTEKENYNVISRSDNKFFNDSEISEGPQDSSERQCTGQQMSTGEYLTSQLSAKYQSSIILQNPRTFSDSDIDLENELSPNDYIRELKAQLQSALDREAYLRQMLSNREAGMREIDQKVENIENIEMKDNSSFKLPKNISPNKLRDMIEDYEQKQRILYRKNQFLITEIRELASIKYMFTDHSNKMSKYIQRLNMEGFKWRREYVKLLQACLGATQTDPHHRLMFSDYGKDRYKNLISELLDEARRKDPSLPSMIKPKTADYHVDFYGFKHSYLNETSIIHYSCQQLYDFYTRQLSGGDENFYRWTELLTQANRELTRADLEVLCRSGVPIQYREGVWRMLIHGELHQLMQIKGPLYYNGLLEEFSENTLAAQHRRQISLDLLRTMPNNVQFDNIDAPGVQKLQEVLQAYSIHNSKIGYCQGMNFIAAVALLFLRKEDAFWCLIAILERFLPENYFNSGLIDAQVDQLVLKEIVHEKLPRLSSHLKRLGIDISAVTLNWFLAVFYDSVPFETLIRIWDVFLLEGSETLFRFAVAILKRNQDMLLEQSDTISFWKCLKAATRLTNDVDGLIKTAFEELRPFPKPQLIATRRAYHYEILSKKMSIKKGYWQNVMKESPDEFIENQNHVQHKRSTKENQAVIQAITFYDNEHLWICYGDKLYSQISEVVVTSNCMQSIGYELESRVSCICAFSNEIILLGMMSKQLCAYSVIRNSKIWQIPIHDSVSDITFAYFLHDHTNKVYAGLTNGELVVIENIGFEEPRDSIYYITISFIPISSVLLAKSQLWCASGSSIFIFHAKTMDYYKQISISNNPLDVILKICLGDNGVWIAVRGSSVIELWDPDRLIRILLFNIVNETYLSRRPEEEYTFNPQRVTVILPYDNTLWIGTGMGEVLVYQIHTYQKTEKKKSLEGTIQMTRHKRSTSLKDELQLIGETTRKTLLKSTRCPSNPDVSHIPDKDPEPLFYPLRQNSLILEHAINSNYIYELQKIVRSKVAETPIRFLVMKKITDSHILIISCSTYFNDDDAVLKWKRDNNNGSIWTNEPIYVFDRESHSLRLPAYMRNSLCLQMHNKKSIIMNN
					

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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	26.5	Very low	62.5	Low	222 Å²	222	94.1 Å²	94.1	100%	1.094	48%	0.482	S	S	*	.				0	54.5	0	-64	-177.2	81.6	0	0	110.8	S3	M1-S3 VanDerWaalsContact C-N 3.29Å; M1-S3 PolarHBondContact O-N 3.41Å; M1-S3 VanDerWaalsContact O-N 3.17Å
2	S	31.5	Very low	64.9	Low	134 Å²	134	90.3 Å²	90.3	94%	0.937	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	22.8	-167.8	51.9	0	0	0	0	115.5
3	S	32.5	Very low	66.6	Low	90 Å²	90	83.7 Å²	83.7	63%	0.629	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	10.9	-172.9	64.5	0	0	0	0	116.3	M1	M1-S3 VanDerWaalsContact C-N 3.29Å; M1-S3 PolarHBondContact O-N 3.41Å; M1-S3 VanDerWaalsContact O-N 3.17Å
4	W	29	Very low	67.8	Low	118 Å²	118	81.1 Å²	81.1	45%	0.447	42%	0.415	S	S	.	.			trans	-126.9	58.9	-173.7	-66.8	90.6	0	0	0	115	Q45 A49	W4-Q45 HydrophobicContact CH2-CG 4.34Å; W4-A49 HydrophobicContact CH2-CB 4.37Å; W4-A49 HydrophobicContact CZ2-CB 4.06Å
5	Q	51.5	Low	68.2	Low	188 Å²	188	77.9 Å²	77.9	88%	0.879	40%	0.401	S	S	*	.			trans	-104.3	10.6	167.6	-82.2	-170.1	-16.9	0	0	114.2
6	R	65.2	Low	68.2	Low	122 Å²	122	76.8 Å²	76.8	46%	0.46	40%	0.399	S	S	.	.	S	Bend	trans	-92.4	135.4	179.6	-66.2	179	-177.5	-169.5	-4.6	110.9	S8 E33	R6-S8 PolarHBondContact O-N 3.48Å; R6-S8 PolarHBondContact O-OG 3.39Å; R6-S8 VanDerWaalsContact O-OG 3.13Å; R6-E33 IonicContact CZ-OE1 3.86Å; R6-E33 IonicContact NH1-OE1 3.36Å; R6-E33 PolarHBondContact NH1-OE1 2.72Å; R6-E33 IonicContact NH2-OE1 3.94Å
7	L	87.6	Confident	67.9	Low	30 Å²	30	74.8 Å²	74.8	16%	0.157	40%	0.402	C	S	.	.			trans	-55.8	113.5	175.1	180	73	0	0	0	109.6	F32 L97 W98 V101	L7-F32 HydrophobicContact CB-CB 4.25Å; L7-F32 HydrophobicContact CD2-CB 4.47Å; L7-F32 PolarHBondContact O-N 3.32Å; L7-L97 HydrophobicContact CD1-CD2 4.4Å; L7-L97 HydrophobicContact CD1-CG 4.47Å; L7-W98 HydrophobicContact CD1-CD2 4.49Å; L7-W98 HydrophobicContact CD2-CD2 3.94Å; L7-W98 HydrophobicContact CD2-CE3 3.3Å; L7-W98 HydrophobicContact CD2-CH2 4.26Å; L7-W98 HydrophobicContact CD2-CZ3 3.49Å; L7-W98 VanDerWaalsContact CD2-CZ3 3.49Å; L7-W98 HydrophobicContact CG-CD2 4.2Å; L7-W98 HydrophobicContact CG-CE3 3.82Å; L7-W98 HydrophobicContact CG-CH2 3.92Å; L7-W98 HydrophobicContact CG-CZ2 4.3Å; L7-W98 HydrophobicContact CG-CZ3 3.66Å; L7-V101 HydrophobicContact CD2-CB 3.77Å; L7-V101 HydrophobicContact CD2-CG1 3.76Å; L7-V101 HydrophobicContact CD2-CG2 4.34Å
8	S	88.5	Confident	67.2	Low	36 Å²	36	77.7 Å²	77.7	25%	0.252	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	152.8	-177.1	52.9	0	0	0	0	111.7	R6 Y30	R6-S8 PolarHBondContact O-N 3.48Å; R6-S8 PolarHBondContact O-OG 3.39Å; R6-S8 VanDerWaalsContact O-OG 3.13Å; S8-Y30 CarbonylContact C-O 3.59Å; S8-Y30 WeakPolarHBondContact CA-O 3.44Å; S8-Y30 VanDerWaalsContact CB-O 3.3Å; S8-Y30 WeakPolarHBondContact CB-O 3.3Å
9	G	91	Very high	66.4	Low	12 Å²	12	81.5 Å²	81.5	12%	0.124	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.9	170.4	-178	0	0	0	0	0	113.1	Y30	G9-Y30 PolarHBondContact N-O 3.39Å; G9-Y30 PolarHBondContact O-N 2.85Å
10	Y	92.1	Very high	65.8	Low	81 Å²	81	82.9 Å²	82.9	32%	0.318	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	131.8	174.5	-77.4	-70.4	0	0	0	111.3	R27 H28 W29	Y10-R27 HydrophobicContact CD1-CG 3.81Å; Y10-R27 HydrophobicContact CG-CG 4.28Å; Y10-H28 WeakPolarHBondContact CA-O 3.39Å; Y10-W29 HydrophobicContact CD1-CB 4.32Å; Y10-W29 HydrophobicContact CD1-CE3 4Å; Y10-W29 AromaticContact CD2-CE3 3.39Å; Y10-W29 HydrophobicContact CD2-CE3 3.39Å; Y10-W29 AromaticContact CD2-CZ3 3.48Å; Y10-W29 HydrophobicContact CD2-CZ3 3.48Å; Y10-W29 VanDerWaalsContact CD2-CZ3 3.48Å; Y10-W29 HydrophobicContact CE1-CB 4.06Å; Y10-W29 AromaticContact CE1-CE3 3.99Å; Y10-W29 HydrophobicContact CE1-CE3 3.99Å; Y10-W29 AromaticContact CE2-CE3 3.36Å; Y10-W29 HydrophobicContact CE2-CE3 3.36Å; Y10-W29 AromaticContact CE2-CZ3 3.55Å; Y10-W29 HydrophobicContact CE2-CZ3 3.55Å; Y10-W29 AromaticContact CG-CE3 3.7Å; Y10-W29 HydrophobicContact CG-CE3 3.7Å; Y10-W29 HydrophobicContact CG-CZ3 4.16Å; Y10-W29 AromaticContact CZ-CE3 3.66Å
11	L	92.7	Very high	65.2	Low	2 Å²	2	91.1 Å²	91.1	1%	0.01	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.5	166.6	-63.1	171	0	0	0	109.7	H28 Y30 F76 L87 A89 W98	L11-H28 PolarHBondContact N-O 3.16Å; L11-H28 PolarHBondContact O-N 2.84Å; L11-H28 VanDerWaalsContact O-N 3.15Å; L11-Y30 HydrophobicContact CB-CD2 3.59Å; L11-Y30 HydrophobicContact CB-CE2 3.77Å; L11-Y30 HydrophobicContact CB-CG 4.46Å; L11-Y30 HydrophobicContact CD1-CD2 4.06Å; L11-Y30 HydrophobicContact CD1-CG 4.11Å; L11-Y30 HydrophobicContact CG-CD2 4.11Å; L11-F76 HydrophobicContact CD1-CZ 4.06Å; L11-F76 HydrophobicContact CD2-CE1 4.31Å; L11-F76 HydrophobicContact CD2-CZ 4.49Å; L11-L87 HydrophobicContact CD1-CB 4.45Å; L11-L87 HydrophobicContact CD1-CD1 4.04Å; L11-A89 HydrophobicContact CD2-CB 3.84Å; L11-W98 HydrophobicContact CD1-CD2 4.08Å; L11-W98 HydrophobicContact CD1-CE3 4.47Å; L11-W98 HydrophobicContact CD1-CG 4.49Å; L11-W98 HydrophobicContact CD1-CZ2 4.12Å; L11-W98 HydrophobicContact CG-CZ2 4.41Å
12	N	90.8	Very high	66.4	Low	48 Å²	48	87.4 Å²	87.4	26%	0.257	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	115.9	174.7	-70.8	-25.5	0	0	0	109.2	I25 R27 L87 Q88	N12-I25 HydrophobicContact CB-CG2 3.78Å; N12-R27 VanDerWaalsContact OD1-CB 3.3Å; N12-R27 WeakPolarHBondContact OD1-CB 3.42Å; N12-R27 VanDerWaalsContact OD1-CG 3.26Å; N12-R27 WeakPolarHBondContact OD1-CG 3.43Å; N12-L87 CarbonylContact O-C 3.47Å; N12-L87 WeakPolarHBondContact O-CA 3.25Å; N12-Q88 HydrophobicContact CB-CB 4.2Å; N12-Q88 PolarHBondContact N-O 3.07Å; N12-Q88 PolarHBondContact O-N 2.8Å
13	S	87.7	Confident	67.3	Low	5 Å²	5	87.7 Å²	87.7	4%	0.035	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.8	176.5	-175.9	0	0	0	0	109.9	Q26	S13-Q26 PolarHBondContact N-O 3.28Å; S13-Q26 PolarHBondContact O-N 3.28Å; S13-Q26 VanDerWaalsContact O-N 3.08Å
14	K	82.2	Confident	69.1	Low	48 Å²	48	86 Å²	86	21%	0.209	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	130.5	169.8	-72.5	-175	179.2	172.8	0	108.5	I25 E72 Q75 I86	K14-I25 HydrophobicContact CG-CD1 4.23Å; K14-I25 HydrophobicContact CG-CG1 4.15Å; K14-E72 IonicContact NZ-OE2 3.15Å; K14-E72 PolarHBondContact NZ-OE2 2.81Å; K14-Q75 VanDerWaalsContact CE-OE1 3.27Å; K14-I86 HydrophobicContact CB-CB 4.19Å; K14-I86 HydrophobicContact CB-CG2 4.07Å; K14-I86 HydrophobicContact CD-CG2 4.3Å; K14-I86 PolarHBondContact N-O 2.79Å
15	P	74.6	Confident	71.6	Confident	32 Å²	32	85.1 Å²	85.1	21%	0.208	43%	0.432	C	S	.	.			trans	-64.6	142.6	178.8	14.5	-16.2	0	0	0	111.3	K20 K23	P15-K20 WeakPolarHBondContact O-CE 3.38Å; P15-K20 WeakPolarHBondContact O-CG 3.43Å; P15-K23 HydrophobicContact CB-CB 4.02Å; P15-K23 HydrophobicContact CG-CB 3.82Å; P15-K23 WeakPolarHBondContact CG-O 3.2Å
16	T	68	Low	73.1	Confident	61 Å²	61	80 Å²	80	37%	0.374	41%	0.409	S	S	.	.			trans	-113.7	151	175.4	48.3	0	0	0	0	110.3	E84 I86	T16-E84 WeakPolarHBondContact CB-O 3.35Å; T16-E84 VanDerWaalsContact CG2-O 3.31Å; T16-E84 WeakPolarHBondContact CG2-O 3.29Å; T16-E84 PolarHBondContact OG1-O 3.47Å; T16-I86 HydrophobicContact CG2-CB 4.4Å; T16-I86 HydrophobicContact CG2-CD1 3.67Å; T16-I86 HydrophobicContact CG2-CG1 3.75Å
17	G	63.2	Low	74.3	Confident	43 Å²	43	80.7 Å²	80.7	44%	0.443	41%	0.411	S	S	.	.	S	Bend	trans	100.6	-179.9	-178.3	0	0	0	0	0	116.5	F19 K20	G17-F19 PolarHBondContact O-N 3.07Å; G17-F19 VanDerWaalsContact O-N 3.16Å; G17-K20 WeakPolarHBondContact O-CB 3.49Å; G17-K20 VanDerWaalsContact O-CG 3.31Å; G17-K20 WeakPolarHBondContact O-CG 3.47Å; G17-K20 PolarHBondContact O-N 3.24Å; G17-K20 VanDerWaalsContact O-N 3.16Å
18	P	55.6	Low	74.6	Confident	127 Å²	127	80.3 Å²	80.3	83%	0.825	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.5	-167.5	22.7	-32.2	0	0	0	114.6	K20	P18-K20 VanDerWaalsContact C-N 3.33Å; P18-K20 PolarHBondContact O-N 3.47Å
19	F	51	Low	74.8	Confident	149 Å²	149	79.9 Å²	79.9	65%	0.654	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	18.6	178.2	-57.7	-71.7	0	0	0	113.7	G17 R21 L22	G17-F19 PolarHBondContact O-N 3.07Å; G17-F19 VanDerWaalsContact O-N 3.16Å; F19-R21 PolarHBondContact O-N 3.08Å; F19-L22 HydrophobicContact CD1-CD1 4.07Å; F19-L22 PolarHBondContact O-N 3.43Å
20	K	54.4	Low	75	Confident	110 Å²	110	79.4 Å²	79.4	48%	0.478	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.5	-36.8	178.6	-100.7	178	-177	-171.7	0	113.8	P15 G17 P18 L22	P15-K20 WeakPolarHBondContact O-CE 3.38Å; P15-K20 WeakPolarHBondContact O-CG 3.43Å; G17-K20 WeakPolarHBondContact O-CB 3.49Å; G17-K20 VanDerWaalsContact O-CG 3.31Å; G17-K20 WeakPolarHBondContact O-CG 3.47Å; G17-K20 PolarHBondContact O-N 3.24Å; G17-K20 VanDerWaalsContact O-N 3.16Å; P18-K20 VanDerWaalsContact C-N 3.33Å; P18-K20 PolarHBondContact O-N 3.47Å; K20-L22 VanDerWaalsContact C-N 3.34Å; K20-L22 PolarHBondContact O-N 2.86Å
21	R	54	Low	75	Confident	255 Å²	255	76.3 Å²	76.3	96%	0.962	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-19.9	-178.5	-68.6	-173.4	179.3	-174	-0.7	114.7	F19	F19-R21 PolarHBondContact O-N 3.08Å
22	L	50.8	Low	75.1	Confident	145 Å²	145	76.2 Å²	76.2	76%	0.759	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-20.4	-174.3	-77.4	159.5	0	0	0	113.8	F19 K20	F19-L22 HydrophobicContact CD1-CD1 4.07Å; F19-L22 PolarHBondContact O-N 3.43Å; K20-L22 VanDerWaalsContact C-N 3.34Å; K20-L22 PolarHBondContact O-N 2.86Å
23	K	51.9	Low	75	Confident	139 Å²	139	75.8 Å²	75.8	60%	0.604	38%	0.381	S	S	*	.	S	Bend	trans	-109	121.3	178.8	-71.7	-175.4	177.7	179.5	0	108.9	P15	P15-K23 HydrophobicContact CB-CB 4.02Å; P15-K23 HydrophobicContact CG-CB 3.82Å; P15-K23 WeakPolarHBondContact CG-O 3.2Å
24	G	69.7	Low	74.8	Confident	54 Å²	54	78.8 Å²	78.8	56%	0.557	40%	0.395	S	S	*	.			trans	-69.2	170	172	0	0	0	0	0	112.3	Q26	G24-Q26 PolarHBondContact O-N 2.86Å
25	I	80.9	Confident	74.7	Confident	100 Å²	100	81.1 Å²	81.1	51%	0.513	42%	0.417	S	S	.	.			trans	-61.7	128.4	173.1	-57.5	-179.1	0	0	0	108.8	N12 K14	N12-I25 HydrophobicContact CB-CG2 3.78Å; K14-I25 HydrophobicContact CG-CD1 4.23Å; K14-I25 HydrophobicContact CG-CG1 4.15Å
26	Q	83	Confident	75.2	Confident	82 Å²	82	82.4 Å²	82.4	38%	0.383	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	120.1	-178.3	-63.4	-176.6	-33	0	0	110.6	S13 G24 H28	S13-Q26 PolarHBondContact N-O 3.28Å; S13-Q26 PolarHBondContact O-N 3.28Å; S13-Q26 VanDerWaalsContact O-N 3.08Å; G24-Q26 PolarHBondContact O-N 2.86Å; Q26-H28 VanDerWaalsContact CB-CE1 3.47Å; Q26-H28 WeakPolarHBondContact CB-CE1 3.16Å; Q26-H28 PolarHBondContact OE1-CE1 2.92Å
27	R	91.2	Very high	76.2	Confident	136 Å²	136	80.7 Å²	80.7	51%	0.513	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118.8	174.3	-169.4	173.3	-169.9	-166.6	5.8	109.5	Y10 N12 E90	Y10-R27 HydrophobicContact CD1-CG 3.81Å; Y10-R27 HydrophobicContact CG-CG 4.28Å; N12-R27 VanDerWaalsContact OD1-CB 3.3Å; N12-R27 WeakPolarHBondContact OD1-CB 3.42Å; N12-R27 VanDerWaalsContact OD1-CG 3.26Å; N12-R27 WeakPolarHBondContact OD1-CG 3.43Å; R27-E90 IonicContact NH2-OE2 3.23Å
28	H	93.3	Very high	77.6	Confident	21 Å²	21	83 Å²	83	10%	0.097	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	154.4	179.4	-64.8	131.8	0	0	0	110.4	Y10 L11 Q26 Y30 A41 Y42	Y10-H28 WeakPolarHBondContact CA-O 3.39Å; L11-H28 PolarHBondContact N-O 3.16Å; L11-H28 PolarHBondContact O-N 2.84Å; L11-H28 VanDerWaalsContact O-N 3.15Å; Q26-H28 VanDerWaalsContact CB-CE1 3.47Å; Q26-H28 WeakPolarHBondContact CB-CE1 3.16Å; Q26-H28 PolarHBondContact OE1-CE1 2.92Å; H28-Y30 HydrophobicContact CB-CD2 4.34Å; H28-Y30 HydrophobicContact CB-CE2 3.87Å; H28-Y30 WeakPolarHBondContact O-CD2 3.11Å; H28-A41 HydrophobicContact CB-CB 4.25Å; H28-Y42 CarbonylContact C-O 3.53Å; H28-Y42 WeakPolarHBondContact CA-O 3.36Å; H28-Y42 WeakPolarHBondContact CB-O 3.21Å
29	W	93.2	Very high	79.4	Confident	27 Å²	27	77 Å²	77	10%	0.102	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	113.2	173.4	-173.2	-94.5	0	0	0	109.6	Y10 A41 Y42 Q45	Y10-W29 HydrophobicContact CD1-CB 4.32Å; Y10-W29 HydrophobicContact CD1-CE3 4Å; Y10-W29 AromaticContact CD2-CE3 3.39Å; Y10-W29 HydrophobicContact CD2-CE3 3.39Å; Y10-W29 AromaticContact CD2-CZ3 3.48Å; Y10-W29 HydrophobicContact CD2-CZ3 3.48Å; Y10-W29 VanDerWaalsContact CD2-CZ3 3.48Å; Y10-W29 HydrophobicContact CE1-CB 4.06Å; Y10-W29 AromaticContact CE1-CE3 3.99Å; Y10-W29 HydrophobicContact CE1-CE3 3.99Å; Y10-W29 AromaticContact CE2-CE3 3.36Å; Y10-W29 HydrophobicContact CE2-CE3 3.36Å; Y10-W29 AromaticContact CE2-CZ3 3.55Å; Y10-W29 HydrophobicContact CE2-CZ3 3.55Å; Y10-W29 AromaticContact CG-CE3 3.7Å; Y10-W29 HydrophobicContact CG-CE3 3.7Å; Y10-W29 HydrophobicContact CG-CZ3 4.16Å; Y10-W29 AromaticContact CZ-CE3 3.66Å; W29-A41 CarbonylContact O-C 3.57Å; W29-Y42 PolarHBondContact N-O 3.37Å; W29-Y42 PolarHBondContact O-N 3.38Å; W29-Q45 HydrophobicContact CD2-CB 3.79Å; W29-Q45 HydrophobicContact CD2-CG 4.15Å; W29-Q45 HydrophobicContact CE3-CB 3.98Å; W29-Q45 HydrophobicContact CE3-CG 4.5Å; W29-Q45 HydrophobicContact CG-CB 4.2Å; W29-Q45 HydrophobicContact CH2-CB 4.44Å; W29-Q45 HydrophobicContact CH2-CG 4.14Å; W29-Q45 HydrophobicContact CZ2-CB 4.3Å; W29-Q45 HydrophobicContact CZ2-CG 3.78Å; W29-Q45 HydrophobicContact CZ3-CB 4.29Å; W29-Q45 HydrophobicContact CZ3-CG 4.49Å
30	Y	95.4	Very high	81.4	Confident	2 Å²	2	71 Å²	71	1%	0.008	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	142.3	178.6	-74.9	-97.1	0	0	0	110.9	S8 G9 L11 H28 L39 M40 A41 L87	S8-Y30 CarbonylContact C-O 3.59Å; S8-Y30 WeakPolarHBondContact CA-O 3.44Å; S8-Y30 VanDerWaalsContact CB-O 3.3Å; S8-Y30 WeakPolarHBondContact CB-O 3.3Å; G9-Y30 PolarHBondContact N-O 3.39Å; G9-Y30 PolarHBondContact O-N 2.85Å; L11-Y30 HydrophobicContact CB-CD2 3.59Å; L11-Y30 HydrophobicContact CB-CE2 3.77Å; L11-Y30 HydrophobicContact CB-CG 4.46Å; L11-Y30 HydrophobicContact CD1-CD2 4.06Å; L11-Y30 HydrophobicContact CD1-CG 4.11Å; L11-Y30 HydrophobicContact CG-CD2 4.11Å; H28-Y30 HydrophobicContact CB-CD2 4.34Å; H28-Y30 HydrophobicContact CB-CE2 3.87Å; H28-Y30 WeakPolarHBondContact O-CD2 3.11Å; Y30-L39 HydrophobicContact CD1-CD1 4.21Å; Y30-L39 HydrophobicContact CD1-CD2 4.18Å; Y30-L39 HydrophobicContact CD1-CG 3.88Å; Y30-M40 CarbonylContact C-O 3.53Å; Y30-M40 VanDerWaalsContact CA-O 3.28Å; Y30-M40 WeakPolarHBondContact CA-O 3.29Å; Y30-A41 HydrophobicContact CD1-CB 3.82Å; Y30-A41 HydrophobicContact CE1-CB 3.5Å; Y30-A41 VanDerWaalsContact CE1-CB 3.5Å; Y30-A41 HydrophobicContact CE2-CB 4.26Å; Y30-A41 HydrophobicContact CG-CB 4.37Å; Y30-L87 HydrophobicContact CE1-CD2 4.28Å; Y30-L87 HydrophobicContact CE2-CD2 4.2Å; Y30-L87 WeakPolarHBondContact OH-CD2 3.23Å
31	V	92.3	Very high	83.2	Confident	16 Å²	16	65.8 Å²	65.8	10%	0.097	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	122.9	174.5	-176.9	0	0	0	0	107.9	M40 Y42 A48	V31-M40 PolarHBondContact N-O 3.27Å; V31-M40 PolarHBondContact O-N 2.93Å; V31-Y42 HydrophobicContact CB-CE2 4.32Å; V31-Y42 HydrophobicContact CG2-CD2 4.15Å; V31-Y42 HydrophobicContact CG2-CE2 4.17Å; V31-A48 HydrophobicContact CG2-CB 4.01Å
32	F	93.6	Very high	85.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	119.5	173.2	-178.4	-123.9	0	0	0	110.1	L7 E34 L37 L39 I61 W98 V101 L102 R105	L7-F32 HydrophobicContact CB-CB 4.25Å; L7-F32 HydrophobicContact CD2-CB 4.47Å; L7-F32 PolarHBondContact O-N 3.32Å; F32-E34 HydrophobicContact CD1-CG 3.91Å; F32-E34 HydrophobicContact CE1-CB 4.48Å; F32-E34 HydrophobicContact CE1-CG 3.84Å; F32-L37 HydrophobicContact CZ-CD2 3.94Å; F32-L39 HydrophobicContact CB-CD1 3.95Å; F32-L39 HydrophobicContact CD2-CB 4.32Å; F32-I61 HydrophobicContact CD2-CG1 4.35Å; F32-I61 HydrophobicContact CE2-CB 4.21Å; F32-I61 HydrophobicContact CE2-CG1 3.77Å; F32-W98 HydrophobicContact CB-CZ3 4.32Å; F32-V101 HydrophobicContact CD1-CG1 4.5Å; F32-L102 HydrophobicContact CB-CD2 4.28Å; F32-L102 HydrophobicContact CD1-CD2 4.02Å; F32-L102 HydrophobicContact CD2-CD2 3.45Å; F32-L102 VanDerWaalsContact CD2-CD2 3.45Å; F32-L102 HydrophobicContact CE1-CD2 4.18Å; F32-L102 HydrophobicContact CE2-CD2 3.66Å; F32-L102 HydrophobicContact CG-CD2 3.64Å; F32-L102 HydrophobicContact CZ-CD2 4.01Å; F32-R105 HydrophobicContact CE1-CB 4.02Å; F32-R105 HydrophobicContact CE1-CG 3.89Å; F32-R105 HydrophobicContact CZ-CB 3.99Å; F32-R105 HydrophobicContact CZ-CG 4.38Å
33	E	88.7	Confident	86.8	Confident	40 Å²	40	56.4 Å²	56.4	19%	0.187	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	105.7	174.2	-176.9	167.2	-116.9	0	0	110.3	R6 S35 T36 L37 K38 M40	R6-E33 IonicContact CZ-OE1 3.86Å; R6-E33 IonicContact NH1-OE1 3.36Å; R6-E33 PolarHBondContact NH1-OE1 2.72Å; R6-E33 IonicContact NH2-OE1 3.94Å; E33-S35 VanDerWaalsContact C-N 3.32Å; E33-S35 WeakPolarHBondContact CG-OG 3.34Å; E33-S35 PolarHBondContact O-N 2.96Å; E33-T36 HydrophobicContact CG-CG2 4.4Å; E33-T36 WeakPolarHBondContact CG-OG1 3.4Å; E33-T36 PolarHBondContact O-N 2.6Å; E33-T36 WeakPolarHBondContact OE2-CG2 3.28Å; E33-T36 PolarHBondContact OE2-OG1 3.46Å; E33-L37 WeakPolarHBondContact O-CA 3.43Å; E33-L37 PolarHBondContact O-N 3.19Å; E33-K38 PolarHBondContact N-O 3.28Å; E33-K38 PolarHBondContact O-N 2.72Å; E33-M40 HydrophobicContact CB-CE 3.62Å; E33-M40 HydrophobicContact CG-CE 4.47Å
34	E	83.9	Confident	88.5	Confident	67 Å²	67	52.1 Å²	52.1	31%	0.313	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-33.6	-173.9	-58.9	-177.6	168.3	0	0	113	F32 T36 R105	F32-E34 HydrophobicContact CD1-CG 3.91Å; F32-E34 HydrophobicContact CE1-CB 4.48Å; F32-E34 HydrophobicContact CE1-CG 3.84Å; E34-T36 VanDerWaalsContact C-N 3.31Å; E34-T36 PolarHBondContact O-N 2.73Å; E34-R105 IonicContact OE1-CZ 2.88Å; E34-R105 IonicContact OE1-NH1 3.29Å; E34-R105 IonicContact OE1-NH2 3.95Å; E34-R105 PolarHBondContact OE1-NH2 3.27Å; E34-R105 IonicContact OE2-CZ 2.83Å; E34-R105 IonicContact OE2-NH1 3.88Å; E34-R105 PolarHBondContact OE2-NH1 2.75Å; E34-R105 IonicContact OE2-NH2 2.71Å; E34-R105 PolarHBondContact OE2-NH2 2.83Å
35	S	79.2	Confident	89.4	Confident	97 Å²	97	53.8 Å²	53.8	68%	0.678	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-29.6	-178.9	51	0	0	0	0	113.1	E33	E33-S35 VanDerWaalsContact C-N 3.32Å; E33-S35 WeakPolarHBondContact CG-OG 3.34Å; E33-S35 PolarHBondContact O-N 2.96Å
36	T	85.5	Confident	89.4	Confident	60 Å²	60	56.2 Å²	56.2	37%	0.368	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-6.2	-179.6	59.4	0	0	0	0	112.5	E33 E34 K38	E33-T36 HydrophobicContact CG-CG2 4.4Å; E33-T36 WeakPolarHBondContact CG-OG1 3.4Å; E33-T36 PolarHBondContact O-N 2.6Å; E33-T36 WeakPolarHBondContact OE2-CG2 3.28Å; E33-T36 PolarHBondContact OE2-OG1 3.46Å; E34-T36 VanDerWaalsContact C-N 3.31Å; E34-T36 PolarHBondContact O-N 2.73Å; T36-K38 PolarHBondContact O-N 3.06Å
37	L	89.9	Confident	89.6	Confident	25 Å²	25	54.1 Å²	54.1	13%	0.131	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	36.7	-172.1	-64.5	163.8	0	0	0	112.4	F32 E33 I61 R105 A109	F32-L37 HydrophobicContact CZ-CD2 3.94Å; E33-L37 WeakPolarHBondContact O-CA 3.43Å; E33-L37 PolarHBondContact O-N 3.19Å; L37-I61 HydrophobicContact CB-CB 4.48Å; L37-I61 VanDerWaalsContact O-CB 3.27Å; L37-I61 WeakPolarHBondContact O-CB 3.37Å; L37-I61 WeakPolarHBondContact O-CG1 3.36Å; L37-I61 PolarHBondContact O-N 2.95Å; L37-R105 HydrophobicContact CD2-CB 3.92Å; L37-A109 HydrophobicContact CD1-CB 3.29Å
38	K	91.4	Very high	89.2	Confident	91 Å²	91	48.7 Å²	48.7	40%	0.396	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.5	-179.8	-75.5	172.4	179.4	-177.3	0	110.6	E33 T36 T58 I59	E33-K38 PolarHBondContact N-O 3.28Å; E33-K38 PolarHBondContact O-N 2.72Å; T36-K38 PolarHBondContact O-N 3.06Å; K38-T58 HydrophobicContact CB-CG2 3.77Å; K38-T58 HydrophobicContact CD-CG2 3.82Å; K38-T58 HydrophobicContact CG-CG2 3.86Å; K38-I59 WeakPolarHBondContact CA-O 3.24Å
39	L	94.1	Very high	88.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	110.4	171.8	-178.9	64.3	0	0	0	108.8	Y30 F32 T58 I59 I61 I78 L87 W98 L102	Y30-L39 HydrophobicContact CD1-CD1 4.21Å; Y30-L39 HydrophobicContact CD1-CD2 4.18Å; Y30-L39 HydrophobicContact CD1-CG 3.88Å; F32-L39 HydrophobicContact CB-CD1 3.95Å; F32-L39 HydrophobicContact CD2-CB 4.32Å; L39-T58 CarbonylContact O-C 3.58Å; L39-T58 WeakPolarHBondContact O-CA 3.34Å; L39-I59 HydrophobicContact CB-CB 4.29Å; L39-I59 HydrophobicContact CD2-CD1 4.44Å; L39-I59 PolarHBondContact N-O 3.14Å; L39-I59 PolarHBondContact O-N 3.11Å; L39-I61 HydrophobicContact CB-CD1 4.24Å; L39-I61 HydrophobicContact CB-CG1 4.31Å; L39-I78 HydrophobicContact CD2-CD1 3.86Å; L39-L87 HydrophobicContact CD2-CD1 4.25Å; L39-W98 HydrophobicContact CD1-CE3 4.47Å; L39-W98 HydrophobicContact CD1-CH2 4.06Å; L39-W98 HydrophobicContact CD1-CZ3 3.53Å; L39-L102 HydrophobicContact CD2-CD1 4.23Å
40	M	92.6	Very high	87.9	Confident	24 Å²	24	53.4 Å²	53.4	12%	0.118	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.8	-172	-68.1	-178.8	-70.9	0	0	111.3	Y30 V31 E33 Y42 P55 K57 T58	Y30-M40 CarbonylContact C-O 3.53Å; Y30-M40 VanDerWaalsContact CA-O 3.28Å; Y30-M40 WeakPolarHBondContact CA-O 3.29Å; V31-M40 PolarHBondContact N-O 3.27Å; V31-M40 PolarHBondContact O-N 2.93Å; E33-M40 HydrophobicContact CB-CE 3.62Å; E33-M40 HydrophobicContact CG-CE 4.47Å; M40-Y42 HydrophobicContact CB-CE2 3.74Å; M40-P55 HydrophobicContact CB-CB 3.83Å; M40-P55 HydrophobicContact CB-CG 4.31Å; M40-P55 HydrophobicContact CG-CB 4.18Å; M40-P55 HydrophobicContact CG-CG 4.1Å; M40-P55 HydrophobicContact SD-CG 4.11Å; M40-K57 CarbonylContact C-O 3.25Å; M40-K57 WeakPolarHBondContact CA-O 3.36Å; M40-T58 HydrophobicContact CG-CG2 4.11Å
41	A	92.3	Very high	87	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	132.6	179.1	0	0	0	0	0	111.2	H28 W29 Y30 P55 L56 K57	H28-A41 HydrophobicContact CB-CB 4.25Å; W29-A41 CarbonylContact O-C 3.57Å; Y30-A41 HydrophobicContact CD1-CB 3.82Å; Y30-A41 HydrophobicContact CE1-CB 3.5Å; Y30-A41 VanDerWaalsContact CE1-CB 3.5Å; Y30-A41 HydrophobicContact CE2-CB 4.26Å; Y30-A41 HydrophobicContact CG-CB 4.37Å; A41-P55 CarbonylContact O-C 3.58Å; A41-P55 WeakPolarHBondContact O-CA 3.24Å; A41-L56 WeakPolarHBondContact O-CB 3.42Å; A41-L56 PolarHBondContact O-N 2.8Å; A41-K57 HydrophobicContact CB-CB 4.01Å; A41-K57 PolarHBondContact N-O 3.39Å
42	Y	93.5	Very high	86.3	Confident	26 Å²	26	65.7 Å²	65.7	10%	0.102	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	158.5	176.4	-62.7	-91	0	0	0	110	H28 W29 V31 M40 N44 A48 K53 P55	H28-Y42 CarbonylContact C-O 3.53Å; H28-Y42 WeakPolarHBondContact CA-O 3.36Å; H28-Y42 WeakPolarHBondContact CB-O 3.21Å; W29-Y42 PolarHBondContact N-O 3.37Å; W29-Y42 PolarHBondContact O-N 3.38Å; V31-Y42 HydrophobicContact CB-CE2 4.32Å; V31-Y42 HydrophobicContact CG2-CD2 4.15Å; V31-Y42 HydrophobicContact CG2-CE2 4.17Å; M40-Y42 HydrophobicContact CB-CE2 3.74Å; Y42-N44 VanDerWaalsContact C-N 3.26Å; Y42-N44 PolarHBondContact O-N 3.44Å; Y42-A48 HydrophobicContact CD1-CB 4.19Å; Y42-A48 HydrophobicContact CD2-CB 3.55Å; Y42-A48 HydrophobicContact CE2-CB 4.1Å; Y42-A48 HydrophobicContact CG-CB 3.6Å; Y42-K53 HydrophobicContact CE1-CB 4.46Å; Y42-K53 WeakPolarHBondContact CE1-O 3.2Å; Y42-P55 HydrophobicContact CE1-CB 4.06Å; Y42-P55 HydrophobicContact CE2-CB 4.31Å
43	R	87.2	Confident	85.8	Confident	177 Å²	177	70.5 Å²	70.5	67%	0.668	37%	0.369	S	S	*	.	S	Bend	trans	-62.2	-38.8	-177.4	-161.9	179	179.2	177.4	-0.1	111.7	D47 L56	R43-D47 WeakPolarHBondContact CB-OD2 3.45Å; R43-L56 HydrophobicContact CB-CD1 4.03Å
44	N	88.5	Confident	85.6	Confident	49 Å²	49	76.6 Å²	76.6	26%	0.262	40%	0.398	S	S	.	.	S	Bend	trans	-154.6	174.9	178.4	58.8	45.3	0	0	0	109.4	Y42 M46 D47 A48	Y42-N44 VanDerWaalsContact C-N 3.26Å; Y42-N44 PolarHBondContact O-N 3.44Å; N44-M46 VanDerWaalsContact C-N 3.28Å; N44-M46 PolarHBondContact O-N 2.79Å; N44-M46 WeakPolarHBondContact OD1-CB 3.4Å; N44-M46 PolarHBondContact OD1-N 2.77Å; N44-D47 PolarHBondContact O-N 3.41Å; N44-D47 PolarHBondContact OD1-N 3.45Å; N44-A48 PolarHBondContact O-N 2.82Å
45	Q	87.2	Confident	85.9	Confident	89 Å²	89	75.3 Å²	75.3	42%	0.416	40%	0.395	S	S	.	.	H	α-helix	trans	-62.4	-32.1	179.4	-174.6	179.2	9.2	0	0	113.4	W4 W29 A48 A49	W4-Q45 HydrophobicContact CH2-CG 4.34Å; W29-Q45 HydrophobicContact CD2-CB 3.79Å; W29-Q45 HydrophobicContact CD2-CG 4.15Å; W29-Q45 HydrophobicContact CE3-CB 3.98Å; W29-Q45 HydrophobicContact CE3-CG 4.5Å; W29-Q45 HydrophobicContact CG-CB 4.2Å; W29-Q45 HydrophobicContact CH2-CB 4.44Å; W29-Q45 HydrophobicContact CH2-CG 4.14Å; W29-Q45 HydrophobicContact CZ2-CB 4.3Å; W29-Q45 HydrophobicContact CZ2-CG 3.78Å; W29-Q45 HydrophobicContact CZ3-CB 4.29Å; W29-Q45 HydrophobicContact CZ3-CG 4.49Å; Q45-A48 PolarHBondContact O-N 3.32Å; Q45-A49 PolarHBondContact O-N 2.71Å
46	M	82.4	Confident	86.2	Confident	151 Å²	151	75.3 Å²	75.3	74%	0.744	39%	0.387	S	S	*	.	H	α-helix	trans	-68.4	-41.8	179.7	-62.1	-161.5	-135.2	0	0	111.4	N44 A48 A49 I50	N44-M46 VanDerWaalsContact C-N 3.28Å; N44-M46 PolarHBondContact O-N 2.79Å; N44-M46 WeakPolarHBondContact OD1-CB 3.4Å; N44-M46 PolarHBondContact OD1-N 2.77Å; M46-A48 VanDerWaalsContact C-N 3.26Å; M46-A48 PolarHBondContact O-N 2.79Å; M46-A49 WeakPolarHBondContact O-CB 3.07Å; M46-A49 PolarHBondContact O-N 3.34Å; M46-I50 PolarHBondContact O-N 3.1Å
47	D	86.1	Confident	86.3	Confident	38 Å²	38	76 Å²	76	20%	0.203	39%	0.385	C	S	.	.	H	α-helix	trans	-60.3	-38.2	176.1	-76.7	3.1	0	0	0	111.4	R43 N44 A49 I50 K53	R43-D47 WeakPolarHBondContact CB-OD2 3.45Å; N44-D47 PolarHBondContact O-N 3.41Å; N44-D47 PolarHBondContact OD1-N 3.45Å; D47-A49 VanDerWaalsContact C-N 3.25Å; D47-A49 PolarHBondContact O-N 3.17Å; D47-I50 PolarHBondContact O-N 3.01Å; D47-K53 WeakPolarHBondContact O-CB 3.46Å
48	A	83	Confident	86.4	Confident	23 Å²	23	78 Å²	78	19%	0.19	40%	0.398	C	S	.	.	H	α-helix	trans	-70.2	-20.4	176.3	0	0	0	0	0	113.7	V31 Y42 N44 Q45 M46	V31-A48 HydrophobicContact CG2-CB 4.01Å; Y42-A48 HydrophobicContact CD1-CB 4.19Å; Y42-A48 HydrophobicContact CD2-CB 3.55Å; Y42-A48 HydrophobicContact CE2-CB 4.1Å; Y42-A48 HydrophobicContact CG-CB 3.6Å; N44-A48 PolarHBondContact O-N 2.82Å; Q45-A48 PolarHBondContact O-N 3.32Å; M46-A48 VanDerWaalsContact C-N 3.26Å; M46-A48 PolarHBondContact O-N 2.79Å
49	A	79.2	Confident	86.4	Confident	58 Å²	58	73.8 Å²	73.8	48%	0.479	38%	0.38	S	S	.	.	H	α-helix	trans	-86.6	-13.9	178.5	0	0	0	0	0	112.9	W4 Q45 M46 D47 P51	W4-A49 HydrophobicContact CH2-CB 4.37Å; W4-A49 HydrophobicContact CZ2-CB 4.06Å; Q45-A49 PolarHBondContact O-N 2.71Å; M46-A49 WeakPolarHBondContact O-CB 3.07Å; M46-A49 PolarHBondContact O-N 3.34Å; D47-A49 VanDerWaalsContact C-N 3.25Å; D47-A49 PolarHBondContact O-N 3.17Å; A49-P51 WeakPolarHBondContact O-CD 3.04Å
50	I	80.5	Confident	86.3	Confident	89 Å²	89	76.3 Å²	76.3	46%	0.456	39%	0.394	S	S	.	.	S	Bend	trans	-77.9	117.6	176.5	-61.8	168.8	0	0	0	108.3	M46 D47 K53	M46-I50 PolarHBondContact O-N 3.1Å; D47-I50 PolarHBondContact O-N 3.01Å; I50-K53 HydrophobicContact CB-CB 4.05Å; I50-K53 HydrophobicContact CG2-CB 4.19Å; I50-K53 WeakPolarHBondContact O-CB 3.19Å; I50-K53 PolarHBondContact O-N 3.47Å
51	P	76.2	Confident	86.3	Confident	108 Å²	108	75.2 Å²	75.2	70%	0.701	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	139.9	175.3	-20.5	31.9	0	0	0	110.9	A49 K53	A49-P51 WeakPolarHBondContact O-CD 3.04Å; P51-K53 PolarHBondContact O-N 3.49Å; P51-K53 VanDerWaalsContact O-N 3.15Å
52	D	78	Confident	85.8	Confident	168 Å²	168	79.2 Å²	79.2	90%	0.898	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	14.9	178.7	-49.4	-38.7	0	0	0	115.9	E54	D52-E54 PolarHBondContact O-N 2.78Å
53	K	82	Confident	85.2	Confident	100 Å²	100	79.6 Å²	79.6	44%	0.435	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-69.5	125.6	170.7	-171.4	66.3	175.8	-179.8	0	109.9	Y42 D47 I50 P51	Y42-K53 HydrophobicContact CE1-CB 4.46Å; Y42-K53 WeakPolarHBondContact CE1-O 3.2Å; D47-K53 WeakPolarHBondContact O-CB 3.46Å; I50-K53 HydrophobicContact CB-CB 4.05Å; I50-K53 HydrophobicContact CG2-CB 4.19Å; I50-K53 WeakPolarHBondContact O-CB 3.19Å; I50-K53 PolarHBondContact O-N 3.47Å; P51-K53 PolarHBondContact O-N 3.49Å; P51-K53 VanDerWaalsContact O-N 3.15Å
54	E	85.5	Confident	85.3	Confident	169 Å²	169	71.2 Å²	71.2	79%	0.79	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-66.3	131.7	177	-71.3	-170.2	160.4	0	0	111.9	D52	D52-E54 PolarHBondContact O-N 2.78Å
55	P	88.8	Confident	85.1	Confident	40 Å²	40	72.9 Å²	72.9	26%	0.26	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-72.9	144.1	176.6	30.1	-35	0	0	0	111.5	M40 A41 Y42 K57 T58	M40-P55 HydrophobicContact CB-CB 3.83Å; M40-P55 HydrophobicContact CB-CG 4.31Å; M40-P55 HydrophobicContact CG-CB 4.18Å; M40-P55 HydrophobicContact CG-CG 4.1Å; M40-P55 HydrophobicContact SD-CG 4.11Å; A41-P55 CarbonylContact O-C 3.58Å; A41-P55 WeakPolarHBondContact O-CA 3.24Å; Y42-P55 HydrophobicContact CE1-CB 4.06Å; Y42-P55 HydrophobicContact CE2-CB 4.31Å; P55-K57 VanDerWaalsContact C-N 3.3Å; P55-K57 PolarHBondContact O-N 2.99Å; P55-T58 VanDerWaalsContact CG-OG1 3.29Å; P55-T58 WeakPolarHBondContact CG-OG1 3.46Å
56	L	87.3	Confident	85.3	Confident	97 Å²	97	70 Å²	70	51%	0.508	39%	0.385	S	S	.	.	S	Bend	trans	-62.6	-36.5	176.4	-64.6	174.1	0	0	0	112.7	A41 R43	A41-L56 WeakPolarHBondContact O-CB 3.42Å; A41-L56 PolarHBondContact O-N 2.8Å; R43-L56 HydrophobicContact CB-CD1 4.03Å
57	K	87.6	Confident	85.4	Confident	73 Å²	73	67.6 Å²	67.6	32%	0.317	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	143.4	177.1	-66.1	-177.7	-173.7	172	0	109.2	M40 A41 P55	M40-K57 CarbonylContact C-O 3.25Å; M40-K57 WeakPolarHBondContact CA-O 3.36Å; A41-K57 HydrophobicContact CB-CB 4.01Å; A41-K57 PolarHBondContact N-O 3.39Å; P55-K57 VanDerWaalsContact C-N 3.3Å; P55-K57 PolarHBondContact O-N 2.99Å
58	T	90.8	Very high	85.3	Confident	68 Å²	68	69.3 Å²	69.3	42%	0.417	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.8	173.9	-57.6	0	0	0	0	108.4	K38 L39 M40 P55	K38-T58 HydrophobicContact CB-CG2 3.77Å; K38-T58 HydrophobicContact CD-CG2 3.82Å; K38-T58 HydrophobicContact CG-CG2 3.86Å; L39-T58 CarbonylContact O-C 3.58Å; L39-T58 WeakPolarHBondContact O-CA 3.34Å; M40-T58 HydrophobicContact CG-CG2 4.11Å; P55-T58 VanDerWaalsContact CG-OG1 3.29Å; P55-T58 WeakPolarHBondContact CG-OG1 3.46Å
59	I	91.9	Very high	84.9	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.015	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.7	178.9	-54.7	170.5	0	0	0	107.4	K38 L39 I61 I78 H85	K38-I59 WeakPolarHBondContact CA-O 3.24Å; L39-I59 HydrophobicContact CB-CB 4.29Å; L39-I59 HydrophobicContact CD2-CD1 4.44Å; L39-I59 PolarHBondContact N-O 3.14Å; L39-I59 PolarHBondContact O-N 3.11Å; I59-I61 HydrophobicContact CG2-CD1 4.3Å; I59-I78 HydrophobicContact CG2-CG2 4.09Å; I59-H85 HydrophobicContact CD1-CB 3.84Å
60	N	91.5	Very high	84.6	Confident	53 Å²	53	74.7 Å²	74.7	28%	0.283	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.1	176.6	-171.5	-9.6	0	0	0	110	H62 S80	N60-H62 WeakPolarHBondContact OD1-CB 3.42Å; N60-H62 PolarHBondContact OD1-N 2.86Å; N60-H62 VanDerWaalsContact OD1-N 3.08Å; N60-S80 VanDerWaalsContact O-CB 3.29Å; N60-S80 WeakPolarHBondContact O-CB 3.23Å; N60-S80 PolarHBondContact O-OG 3.37Å
61	I	92.7	Very high	84.2	Confident	0 Å²	0	74 Å²	74	0%	0	41%	0.412	C	S	.	.			trans	-95.9	-18.3	-177.1	-59.3	-58.1	0	0	0	112.6	F32 L37 L39 I59 G63 A64 F66 I78 L102 R106	F32-I61 HydrophobicContact CD2-CG1 4.35Å; F32-I61 HydrophobicContact CE2-CB 4.21Å; F32-I61 HydrophobicContact CE2-CG1 3.77Å; L37-I61 HydrophobicContact CB-CB 4.48Å; L37-I61 VanDerWaalsContact O-CB 3.27Å; L37-I61 WeakPolarHBondContact O-CB 3.37Å; L37-I61 WeakPolarHBondContact O-CG1 3.36Å; L37-I61 PolarHBondContact O-N 2.95Å; L39-I61 HydrophobicContact CB-CD1 4.24Å; L39-I61 HydrophobicContact CB-CG1 4.31Å; I59-I61 HydrophobicContact CG2-CD1 4.3Å; I61-G63 PolarHBondContact O-N 2.98Å; I61-A64 HydrophobicContact CD1-CB 4.35Å; I61-A64 PolarHBondContact O-N 2.95Å; I61-F66 HydrophobicContact CD1-CE1 4.44Å; I61-F66 HydrophobicContact CD1-CZ 4.46Å; I61-F66 HydrophobicContact CG2-CZ 3.95Å; I61-I78 HydrophobicContact CD1-CG2 4.27Å; I61-L102 HydrophobicContact CD1-CD2 4.38Å; I61-L102 HydrophobicContact CG1-CD2 4.26Å; I61-R106 HydrophobicContact CG2-CB 3.9Å; I61-R106 WeakPolarHBondContact O-CG 3.48Å
62	H	81.3	Confident	84.3	Confident	84 Å²	84	72.8 Å²	72.8	39%	0.389	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-32.1	-172.1	-168.2	-81	0	0	0	114.2	N60	N60-H62 WeakPolarHBondContact OD1-CB 3.42Å; N60-H62 PolarHBondContact OD1-N 2.86Å; N60-H62 VanDerWaalsContact OD1-N 3.08Å
63	G	80.7	Confident	84.2	Confident	34 Å²	34	72.1 Å²	72.1	35%	0.351	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	14.6	176.8	0	0	0	0	0	114.4	I61	I61-G63 PolarHBondContact O-N 2.98Å
64	A	89.2	Confident	84.5	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.008	38%	0.377	C	S	.	.			trans	-75.6	142.2	-171.2	0	0	0	0	0	112.9	I61 F66 I78 I79 R106	I61-A64 HydrophobicContact CD1-CB 4.35Å; I61-A64 PolarHBondContact O-N 2.95Å; A64-F66 HydrophobicContact CB-CZ 4.22Å; A64-I78 HydrophobicContact CB-CG2 3.76Å; A64-I79 CarbonylContact C-O 3.57Å; A64-I79 VanDerWaalsContact CA-O 3.29Å; A64-I79 WeakPolarHBondContact CA-O 3.13Å; A64-R106 WeakPolarHBondContact O-CD 3.17Å; A64-R106 PolarHBondContact O-NH1 2.9Å
65	V	85.7	Confident	84.7	Confident	84 Å²	84	61.9 Å²	61.9	51%	0.509	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.3	171.1	-176.8	0	0	0	0	108.5	I79	V65-I79 HydrophobicContact CB-CB 4.48Å; V65-I79 PolarHBondContact N-O 3.29Å; V65-I79 PolarHBondContact O-N 2.82Å
66	F	91.4	Very high	84.8	Confident	28 Å²	28	60 Å²	60	12%	0.123	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	137.5	-177.9	-54.4	-81.9	0	0	0	109.8	I61 A64 S77 I78 L99 L102 Q103 R106	I61-F66 HydrophobicContact CD1-CE1 4.44Å; I61-F66 HydrophobicContact CD1-CZ 4.46Å; I61-F66 HydrophobicContact CG2-CZ 3.95Å; A64-F66 HydrophobicContact CB-CZ 4.22Å; F66-S77 WeakPolarHBondContact CA-O 3.24Å; F66-I78 HydrophobicContact CD1-CB 4.49Å; F66-I78 HydrophobicContact CD1-CD1 4.49Å; F66-I78 HydrophobicContact CD1-CG1 3.96Å; F66-I78 HydrophobicContact CD1-CG2 4.22Å; F66-I78 HydrophobicContact CE1-CD1 4.18Å; F66-I78 HydrophobicContact CE1-CG1 4.09Å; F66-I78 HydrophobicContact CE1-CG2 3.96Å; F66-L99 HydrophobicContact CB-CD2 3.91Å; F66-L99 HydrophobicContact CD1-CD2 4.1Å; F66-L99 HydrophobicContact CG-CD2 4.26Å; F66-L102 HydrophobicContact CE1-CB 3.77Å; F66-L102 HydrophobicContact CE1-CD1 4.17Å; F66-L102 HydrophobicContact CZ-CB 3.71Å; F66-Q103 HydrophobicContact CD2-CB 4.12Å; F66-Q103 HydrophobicContact CD2-CG 4.33Å; F66-Q103 HydrophobicContact CE2-CB 4.11Å; F66-R106 HydrophobicContact CE2-CB 4.41Å
67	H	84.9	Confident	85	Confident	102 Å²	102	55.8 Å²	55.8	47%	0.472	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	142	177.6	-174	62.4	0	0	0	110.5	F76 S77	H67-F76 CarbonylContact O-C 3.59Å; H67-F76 WeakPolarHBondContact O-CA 3.49Å; H67-S77 PolarHBondContact N-O 3.05Å; H67-S77 PolarHBondContact O-N 3.11Å
68	I	82.7	Confident	85.3	Confident	73 Å²	73	52.3 Å²	52.3	37%	0.374	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.8	172.4	-54.9	174.5	0	0	0	106	P70 F76 M95 L99	I68-P70 WeakPolarHBondContact O-CD 3.45Å; I68-F76 HydrophobicContact CG1-CB 4.49Å; I68-M95 HydrophobicContact CG2-CE 4.41Å; I68-M95 HydrophobicContact CG2-SD 4.44Å; I68-L99 HydrophobicContact CD1-CD1 3.38Å; I68-L99 HydrophobicContact CG1-CD1 3.49Å; I68-L99 VanDerWaalsContact CG1-CD1 3.49Å
69	D	76	Confident	85.2	Confident	69 Å²	69	52.3 Å²	52.3	37%	0.369	29%	0.291	S	S	.	.			trans	-91.6	111.9	169.7	-173.6	-17	0	0	0	108	A71 E72	D69-A71 PolarHBondContact O-N 3.32Å; D69-A71 VanDerWaalsContact O-N 3.1Å; D69-A71 WeakPolarHBondContact OD1-CB 3.48Å; D69-A71 PolarHBondContact OD1-N 2.87Å; D69-E72 HydrophobicContact CB-CB 4.5Å; D69-E72 PolarHBondContact O-N 2.87Å; D69-E72 VanDerWaalsContact O-N 3.1Å
70	P	72.2	Confident	85	Confident	125 Å²	125	52.3 Å²	52.3	81%	0.812	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-15.1	-176.6	25.4	-32.9	0	0	0	113.5	I68	I68-P70 WeakPolarHBondContact O-CD 3.45Å
71	A	71.6	Confident	84.6	Confident	74 Å²	74	54.3 Å²	54.3	61%	0.612	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-24.6	175.8	0	0	0	0	0	113.2	D69	D69-A71 PolarHBondContact O-N 3.32Å; D69-A71 VanDerWaalsContact O-N 3.1Å; D69-A71 WeakPolarHBondContact OD1-CB 3.48Å; D69-A71 PolarHBondContact OD1-N 2.87Å
72	E	78.2	Confident	83.9	Confident	83 Å²	83	57.8 Å²	57.8	39%	0.388	34%	0.338	S	S	.	.	S	Bend	trans	-106.1	110.3	-173.2	-69.9	-80.5	157.7	0	0	111	K14 D69 N74 Q75	K14-E72 IonicContact NZ-OE2 3.15Å; K14-E72 PolarHBondContact NZ-OE2 2.81Å; D69-E72 HydrophobicContact CB-CB 4.5Å; D69-E72 PolarHBondContact O-N 2.87Å; D69-E72 VanDerWaalsContact O-N 3.1Å; E72-N74 PolarHBondContact O-N 2.83Å; E72-Q75 HydrophobicContact CB-CB 3.84Å; E72-Q75 HydrophobicContact CB-CG 4.42Å; E72-Q75 PolarHBondContact O-N 3.42Å; E72-Q75 PolarHBondContact OE2-OE1 2.84Å
73	H	76.2	Confident	83.9	Confident	154 Å²	154	60.7 Å²	60.7	71%	0.713	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	129.8	-173.1	-68.9	63.4	0	0	0	112.2	Q75 Q88	H73-Q75 PolarHBondContact O-N 3.26Å; H73-Q88 PolarHBondContact O-NE2 2.91Å
74	N	87.3	Confident	84.3	Confident	38 Å²	38	62.8 Å²	62.8	20%	0.203	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	21.8	178.6	-49.2	-20.1	0	0	0	114.3	E72 Q88 A89 E90 E92 M95	E72-N74 PolarHBondContact O-N 2.83Å; N74-Q88 WeakPolarHBondContact O-CA 3.42Å; N74-Q88 WeakPolarHBondContact O-CG 3.33Å; N74-A89 VanDerWaalsContact CB-O 3.32Å; N74-A89 WeakPolarHBondContact CB-O 3.4Å; N74-A89 PolarHBondContact O-N 3.16Å; N74-E90 PolarHBondContact ND2-O 2.97Å; N74-E92 VanDerWaalsContact OD1-CA 3.29Å; N74-E92 WeakPolarHBondContact OD1-CA 3.32Å; N74-E92 WeakPolarHBondContact OD1-CB 3.37Å; N74-E92 PolarHBondContact OD1-N 3.15Å; N74-E92 VanDerWaalsContact OD1-N 3.15Å; N74-M95 VanDerWaalsContact CA-SD 3.6Å
75	Q	89.9	Confident	84.3	Confident	17 Å²	17	64.6 Å²	64.6	8%	0.079	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	140.5	-177	-170.7	-179.3	-73.8	0	0	112.4	K14 E72 H73 I86 L87 Q88 M95	K14-Q75 VanDerWaalsContact CE-OE1 3.27Å; E72-Q75 HydrophobicContact CB-CB 3.84Å; E72-Q75 HydrophobicContact CB-CG 4.42Å; E72-Q75 PolarHBondContact O-N 3.42Å; E72-Q75 PolarHBondContact OE2-OE1 2.84Å; H73-Q75 PolarHBondContact O-N 3.26Å; Q75-I86 HydrophobicContact CG-CG2 3.66Å; Q75-I86 VanDerWaalsContact NE2-CG2 3.33Å; Q75-L87 WeakPolarHBondContact CA-O 3.22Å; Q75-L87 WeakPolarHBondContact CG-O 3.36Å; Q75-Q88 HydrophobicContact CB-CB 4.44Å; Q75-Q88 HydrophobicContact CB-CG 4.34Å; Q75-Q88 HydrophobicContact CG-CB 4.44Å; Q75-M95 PolarHBondContact N-SD 2.69Å
76	F	92.7	Very high	84.6	Confident	1 Å²	1	61.4 Å²	61.4	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	150	174.5	64.3	-76.6	0	0	0	110.9	L11 H67 I68 I78 L87 M95 W98 L99	L11-F76 HydrophobicContact CD1-CZ 4.06Å; L11-F76 HydrophobicContact CD2-CE1 4.31Å; L11-F76 HydrophobicContact CD2-CZ 4.49Å; H67-F76 CarbonylContact O-C 3.59Å; H67-F76 WeakPolarHBondContact O-CA 3.49Å; I68-F76 HydrophobicContact CG1-CB 4.49Å; F76-I78 HydrophobicContact CD2-CG1 4.13Å; F76-I78 HydrophobicContact CE2-CD1 4.02Å; F76-I78 HydrophobicContact CE2-CG1 4.07Å; F76-L87 HydrophobicContact CD1-CB 4.41Å; F76-L87 WeakPolarHBondContact CD1-O 3.03Å; F76-L87 HydrophobicContact CE1-CB 3.96Å; F76-L87 HydrophobicContact CE2-CB 4.15Å; F76-L87 HydrophobicContact CE2-CD1 4.1Å; F76-L87 HydrophobicContact CZ-CB 3.83Å; F76-L87 HydrophobicContact CZ-CD1 4.15Å; F76-L87 PolarHBondContact N-O 3.18Å; F76-L87 PolarHBondContact O-N 2.95Å; F76-M95 HydrophobicContact CB-CG 4.41Å; F76-M95 HydrophobicContact CD1-CG 3.73Å; F76-M95 HydrophobicContact CE1-CG 4.4Å; F76-M95 HydrophobicContact CG-CG 4.37Å; F76-W98 HydrophobicContact CE1-CB 4.46Å; F76-W98 HydrophobicContact CZ-CB 3.97Å; F76-W98 HydrophobicContact CZ-CG 4.37Å; F76-L99 HydrophobicContact CB-CD1 3.94Å; F76-L99 HydrophobicContact CB-CD2 4.02Å; F76-L99 HydrophobicContact CB-CG 4.23Å; F76-L99 HydrophobicContact CD2-CD2 3.65Å; F76-L99 HydrophobicContact CD2-CG 4.07Å; F76-L99 HydrophobicContact CE2-CD2 4.37Å; F76-L99 HydrophobicContact CG-CD1 4.3Å; F76-L99 HydrophobicContact CG-CD2 4.05Å; F76-L99 HydrophobicContact CG-CG 4.13Å
77	S	91.1	Very high	84.7	Confident	7 Å²	7	60.1 Å²	60.1	5%	0.049	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	139.7	174.5	76.3	0	0	0	0	111.9	F66 H67 E84 H85	F66-S77 WeakPolarHBondContact CA-O 3.24Å; H67-S77 PolarHBondContact N-O 3.05Å; H67-S77 PolarHBondContact O-N 3.11Å; S77-E84 WeakPolarHBondContact CB-OE1 3.17Å; S77-E84 PolarHBondContact OG-OE1 2.68Å; S77-E84 VanDerWaalsContact OG-OE1 3.11Å; S77-H85 CarbonylContact C-O 3.58Å; S77-H85 VanDerWaalsContact CA-O 3.3Å; S77-H85 WeakPolarHBondContact CA-O 3.15Å
78	I	92.8	Very high	85	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	113.5	174.4	-49.8	-178.6	0	0	0	106.9	L39 I59 I61 A64 F66 F76 H85 L87 L102	L39-I78 HydrophobicContact CD2-CD1 3.86Å; I59-I78 HydrophobicContact CG2-CG2 4.09Å; I61-I78 HydrophobicContact CD1-CG2 4.27Å; A64-I78 HydrophobicContact CB-CG2 3.76Å; F66-I78 HydrophobicContact CD1-CB 4.49Å; F66-I78 HydrophobicContact CD1-CD1 4.49Å; F66-I78 HydrophobicContact CD1-CG1 3.96Å; F66-I78 HydrophobicContact CD1-CG2 4.22Å; F66-I78 HydrophobicContact CE1-CD1 4.18Å; F66-I78 HydrophobicContact CE1-CG1 4.09Å; F66-I78 HydrophobicContact CE1-CG2 3.96Å; F76-I78 HydrophobicContact CD2-CG1 4.13Å; F76-I78 HydrophobicContact CE2-CD1 4.02Å; F76-I78 HydrophobicContact CE2-CG1 4.07Å; I78-H85 HydrophobicContact CB-CB 4.45Å; I78-H85 PolarHBondContact N-O 3.35Å; I78-H85 WeakPolarHBondContact O-CB 3.31Å; I78-H85 PolarHBondContact O-N 2.84Å; I78-L87 HydrophobicContact CD1-CD1 3.77Å; I78-L87 HydrophobicContact CG1-CD1 4.36Å; I78-L102 HydrophobicContact CD1-CD1 4.06Å
79	I	88.6	Confident	85.4	Confident	68 Å²	68	54.3 Å²	54.3	35%	0.349	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	112.1	173.7	-55.2	172.8	0	0	0	107.4	A64 V65 K83 E84	A64-I79 CarbonylContact C-O 3.57Å; A64-I79 VanDerWaalsContact CA-O 3.29Å; A64-I79 WeakPolarHBondContact CA-O 3.13Å; V65-I79 HydrophobicContact CB-CB 4.48Å; V65-I79 PolarHBondContact N-O 3.29Å; V65-I79 PolarHBondContact O-N 2.82Å; I79-K83 WeakPolarHBondContact CA-O 3.43Å; I79-E84 HydrophobicContact CG1-CB 4.18Å; I79-E84 HydrophobicContact CG1-CG 4.03Å
80	S	87.7	Confident	85.8	Confident	4 Å²	4	58 Å²	58	3%	0.028	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	140.1	179.3	-173.9	0	0	0	0	110.3	N60 G82 K83	N60-S80 VanDerWaalsContact O-CB 3.29Å; N60-S80 WeakPolarHBondContact O-CB 3.23Å; N60-S80 PolarHBondContact O-OG 3.37Å; S80-G82 PolarHBondContact O-N 3.45Å; S80-G82 VanDerWaalsContact O-N 3.12Å; S80-K83 PolarHBondContact N-O 2.8Å; S80-K83 PolarHBondContact O-N 2.88Å; S80-K83 VanDerWaalsContact O-O 3.11Å
81	D	82.9	Confident	86.4	Confident	94 Å²	94	55.2 Å²	55.2	50%	0.503	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	38.9	-177.9	-53.8	-33.5	0	0	0	113.2	K83 Y128	D81-K83 PolarHBondContact O-N 2.85Å; D81-Y128 PolarHBondContact OD1-OH 3Å; D81-Y128 VanDerWaalsContact OD1-OH 3.12Å
82	G	79.2	Confident	86.8	Confident	74 Å²	74	57.3 Å²	57.3	76%	0.763	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	1.4	-177.9	0	0	0	0	0	115.6	S80	S80-G82 PolarHBondContact O-N 3.45Å; S80-G82 VanDerWaalsContact O-N 3.12Å
83	K	81.9	Confident	86.9	Confident	144 Å²	144	59.4 Å²	59.4	63%	0.626	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.6	178.7	-68.2	177	-176	168	0	110.8	I79 S80 D81 H85	I79-K83 WeakPolarHBondContact CA-O 3.43Å; S80-K83 PolarHBondContact N-O 2.8Å; S80-K83 PolarHBondContact O-N 2.88Å; S80-K83 VanDerWaalsContact O-O 3.11Å; D81-K83 PolarHBondContact O-N 2.85Å; K83-H85 PolarHBondContact O-CD2 3.41Å
84	E	88.5	Confident	87.4	Confident	79 Å²	79	53.4 Å²	53.4	37%	0.369	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	126.4	172.9	-175.5	179.9	-152.7	0	0	110.7	T16 S77 I79 I86	T16-E84 WeakPolarHBondContact CB-O 3.35Å; T16-E84 VanDerWaalsContact CG2-O 3.31Å; T16-E84 WeakPolarHBondContact CG2-O 3.29Å; T16-E84 PolarHBondContact OG1-O 3.47Å; S77-E84 WeakPolarHBondContact CB-OE1 3.17Å; S77-E84 PolarHBondContact OG-OE1 2.68Å; S77-E84 VanDerWaalsContact OG-OE1 3.11Å; I79-E84 HydrophobicContact CG1-CB 4.18Å; I79-E84 HydrophobicContact CG1-CG 4.03Å; E84-I86 HydrophobicContact CG-CG1 4.24Å
85	H	89.3	Confident	87.6	Confident	38 Å²	38	52.1 Å²	52.1	18%	0.176	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	107.8	176	-61.9	-84.3	0	0	0	109.8	I59 S77 I78 K83	I59-H85 HydrophobicContact CD1-CB 3.84Å; S77-H85 CarbonylContact C-O 3.58Å; S77-H85 VanDerWaalsContact CA-O 3.3Å; S77-H85 WeakPolarHBondContact CA-O 3.15Å; I78-H85 HydrophobicContact CB-CB 4.45Å; I78-H85 PolarHBondContact N-O 3.35Å; I78-H85 WeakPolarHBondContact O-CB 3.31Å; I78-H85 PolarHBondContact O-N 2.84Å; K83-H85 PolarHBondContact O-CD2 3.41Å
86	I	90.8	Very high	87.4	Confident	18 Å²	18	55.1 Å²	55.1	9%	0.092	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	119.9	177.6	-57.9	173.1	0	0	0	109.1	K14 T16 Q75 E84	K14-I86 HydrophobicContact CB-CB 4.19Å; K14-I86 HydrophobicContact CB-CG2 4.07Å; K14-I86 HydrophobicContact CD-CG2 4.3Å; K14-I86 PolarHBondContact N-O 2.79Å; T16-I86 HydrophobicContact CG2-CB 4.4Å; T16-I86 HydrophobicContact CG2-CD1 3.67Å; T16-I86 HydrophobicContact CG2-CG1 3.75Å; Q75-I86 HydrophobicContact CG-CG2 3.66Å; Q75-I86 VanDerWaalsContact NE2-CG2 3.33Å; E84-I86 HydrophobicContact CG-CG1 4.24Å
87	L	93.4	Very high	87.2	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.9	-177.8	-59.6	177.1	0	0	0	110	L11 N12 Y30 L39 Q75 F76 I78	L11-L87 HydrophobicContact CD1-CB 4.45Å; L11-L87 HydrophobicContact CD1-CD1 4.04Å; N12-L87 CarbonylContact O-C 3.47Å; N12-L87 WeakPolarHBondContact O-CA 3.25Å; Y30-L87 HydrophobicContact CE1-CD2 4.28Å; Y30-L87 HydrophobicContact CE2-CD2 4.2Å; Y30-L87 WeakPolarHBondContact OH-CD2 3.23Å; L39-L87 HydrophobicContact CD2-CD1 4.25Å; Q75-L87 WeakPolarHBondContact CA-O 3.22Å; Q75-L87 WeakPolarHBondContact CG-O 3.36Å; F76-L87 HydrophobicContact CD1-CB 4.41Å; F76-L87 WeakPolarHBondContact CD1-O 3.03Å; F76-L87 HydrophobicContact CE1-CB 3.96Å; F76-L87 HydrophobicContact CE2-CB 4.15Å; F76-L87 HydrophobicContact CE2-CD1 4.1Å; F76-L87 HydrophobicContact CZ-CB 3.83Å; F76-L87 HydrophobicContact CZ-CD1 4.15Å; F76-L87 PolarHBondContact N-O 3.18Å; F76-L87 PolarHBondContact O-N 2.95Å; I78-L87 HydrophobicContact CD1-CD1 3.77Å; I78-L87 HydrophobicContact CG1-CD1 4.36Å
88	Q	91.6	Very high	87.3	Confident	47 Å²	47	60.2 Å²	60.2	22%	0.22	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	127.7	177.6	-172.9	-179	16.3	0	0	110	N12 H73 N74 Q75	N12-Q88 HydrophobicContact CB-CB 4.2Å; N12-Q88 PolarHBondContact N-O 3.07Å; N12-Q88 PolarHBondContact O-N 2.8Å; H73-Q88 PolarHBondContact O-NE2 2.91Å; N74-Q88 WeakPolarHBondContact O-CA 3.42Å; N74-Q88 WeakPolarHBondContact O-CG 3.33Å; Q75-Q88 HydrophobicContact CB-CB 4.44Å; Q75-Q88 HydrophobicContact CB-CG 4.34Å; Q75-Q88 HydrophobicContact CG-CB 4.44Å
89	A	91.3	Very high	87.3	Confident	5 Å²	5	60.7 Å²	60.7	4%	0.041	33%	0.326	C	S	.	.			trans	-90.2	163.7	176.3	0	0	0	0	0	111.3	L11 N74 A94 M95	L11-A89 HydrophobicContact CD2-CB 3.84Å; N74-A89 VanDerWaalsContact CB-O 3.32Å; N74-A89 WeakPolarHBondContact CB-O 3.4Å; N74-A89 PolarHBondContact O-N 3.16Å; A89-A94 HydrophobicContact CB-CB 4.09Å; A89-M95 HydrophobicContact CB-CB 3.9Å
90	E	83.9	Confident	87.2	Confident	146 Å²	146	63.5 Å²	63.5	68%	0.682	34%	0.337	S	S	*	.	S	Bend	trans	-72.1	-38.2	-177.8	-170.5	164.2	-179	0	0	112.2	R27 N74	R27-E90 IonicContact NH2-OE2 3.23Å; N74-E90 PolarHBondContact ND2-O 2.97Å
91	T	85	Confident	87.2	Confident	68 Å²	68	64.8 Å²	64.8	42%	0.417	34%	0.344	S	S	.	.	S	Bend	trans	-129	159.9	177.9	64.1	0	0	0	0	110.8	D93 A94 M95	T91-D93 VanDerWaalsContact C-N 3.31Å; T91-A94 PolarHBondContact O-N 3.31Å; T91-A94 WeakPolarHBondContact OG1-CB 3.47Å; T91-A94 PolarHBondContact OG1-N 2.83Å; T91-A94 VanDerWaalsContact OG1-N 3.16Å; T91-M95 PolarHBondContact O-N 3.24Å
92	E	80.5	Confident	87.7	Confident	117 Å²	117	60.3 Å²	60.3	55%	0.547	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-43	175.1	-170	176.4	178.9	0	0	110.9	N74 A94 M95 L96	N74-E92 VanDerWaalsContact OD1-CA 3.29Å; N74-E92 WeakPolarHBondContact OD1-CA 3.32Å; N74-E92 WeakPolarHBondContact OD1-CB 3.37Å; N74-E92 PolarHBondContact OD1-N 3.15Å; N74-E92 VanDerWaalsContact OD1-N 3.15Å; E92-A94 VanDerWaalsContact C-N 3.29Å; E92-A94 PolarHBondContact O-N 2.99Å; E92-M95 HydrophobicContact CG-CE 4.2Å; E92-M95 WeakPolarHBondContact O-CB 3.47Å; E92-M95 PolarHBondContact O-N 3.42Å; E92-M95 VanDerWaalsContact O-N 3.09Å; E92-L96 HydrophobicContact CG-CD1 4.28Å; E92-L96 WeakPolarHBondContact O-CG 3.35Å; E92-L96 PolarHBondContact O-N 2.81Å
93	D	80.8	Confident	88.2	Confident	128 Å²	128	60.8 Å²	60.8	68%	0.684	30%	0.303	S	S	*	.	H	α-helix	trans	-57.7	-42.1	175.4	-63.7	-31.4	0	0	0	112.1	T91 L96 L97	T91-D93 VanDerWaalsContact C-N 3.31Å; D93-L96 PolarHBondContact O-N 3.1Å; D93-L97 WeakPolarHBondContact O-CB 3.41Å; D93-L97 PolarHBondContact O-N 2.79Å
94	A	86.6	Confident	88.3	Confident	28 Å²	28	56.2 Å²	56.2	23%	0.231	29%	0.287	C	S	.	.	H	α-helix	trans	-66	-41.7	176.7	0	0	0	0	0	111.3	A89 T91 E92 L97 W98	A89-A94 HydrophobicContact CB-CB 4.09Å; T91-A94 PolarHBondContact O-N 3.31Å; T91-A94 WeakPolarHBondContact OG1-CB 3.47Å; T91-A94 PolarHBondContact OG1-N 2.83Å; T91-A94 VanDerWaalsContact OG1-N 3.16Å; E92-A94 VanDerWaalsContact C-N 3.29Å; E92-A94 PolarHBondContact O-N 2.99Å; A94-L97 PolarHBondContact O-N 2.93Å; A94-W98 PolarHBondContact O-N 3.36Å
95	M	92.3	Very high	88.2	Confident	11 Å²	11	55.8 Å²	55.8	5%	0.054	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-49.6	174.7	175.4	-175.2	72.8	0	0	111.2	I68 N74 Q75 F76 A89 T91 E92 L97 W98 L99	I68-M95 HydrophobicContact CG2-CE 4.41Å; I68-M95 HydrophobicContact CG2-SD 4.44Å; N74-M95 VanDerWaalsContact CA-SD 3.6Å; Q75-M95 PolarHBondContact N-SD 2.69Å; F76-M95 HydrophobicContact CB-CG 4.41Å; F76-M95 HydrophobicContact CD1-CG 3.73Å; F76-M95 HydrophobicContact CE1-CG 4.4Å; F76-M95 HydrophobicContact CG-CG 4.37Å; A89-M95 HydrophobicContact CB-CB 3.9Å; T91-M95 PolarHBondContact O-N 3.24Å; E92-M95 HydrophobicContact CG-CE 4.2Å; E92-M95 WeakPolarHBondContact O-CB 3.47Å; E92-M95 PolarHBondContact O-N 3.42Å; E92-M95 VanDerWaalsContact O-N 3.09Å; M95-L97 VanDerWaalsContact C-N 3.32Å; M95-L97 PolarHBondContact O-N 3.14Å; M95-W98 PolarHBondContact O-N 3.23Å; M95-L99 HydrophobicContact CG-CD1 3.94Å; M95-L99 PolarHBondContact O-N 2.9Å
96	L	85.4	Confident	88.2	Confident	80 Å²	80	56.2 Å²	56.2	42%	0.419	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-38.5	-179.5	-68.8	175	0	0	0	111.5	E92 D93 L99 H100	E92-L96 HydrophobicContact CG-CD1 4.28Å; E92-L96 WeakPolarHBondContact O-CG 3.35Å; E92-L96 PolarHBondContact O-N 2.81Å; D93-L96 PolarHBondContact O-N 3.1Å; L96-L99 PolarHBondContact O-N 2.81Å; L96-H100 WeakPolarHBondContact O-CB 3.39Å; L96-H100 PolarHBondContact O-N 2.79Å
97	L	87.2	Confident	87.9	Confident	100 Å²	100	58.2 Å²	58.2	52%	0.524	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-46.7	174.2	-175	69.3	0	0	0	111.9	L7 D93 A94 M95 H100 V101	L7-L97 HydrophobicContact CD1-CD2 4.4Å; L7-L97 HydrophobicContact CD1-CG 4.47Å; D93-L97 WeakPolarHBondContact O-CB 3.41Å; D93-L97 PolarHBondContact O-N 2.79Å; A94-L97 PolarHBondContact O-N 2.93Å; M95-L97 VanDerWaalsContact C-N 3.32Å; M95-L97 PolarHBondContact O-N 3.14Å; L97-H100 PolarHBondContact O-N 2.75Å; L97-V101 HydrophobicContact CD1-CG2 4.44Å; L97-V101 WeakPolarHBondContact O-CG2 3.47Å; L97-V101 PolarHBondContact O-N 2.8Å; L97-V101 VanDerWaalsContact O-N 3.1Å
98	W	93.9	Very high	87.2	Confident	14 Å²	14	62.6 Å²	62.6	5%	0.053	31%	0.314	C	S	.	.	H	α-helix	trans	-58.3	-49.8	176.2	-86.5	106.3	0	0	0	111.5	L7 L11 F32 L39 F76 A94 M95 L102	L7-W98 HydrophobicContact CD1-CD2 4.49Å; L7-W98 HydrophobicContact CD2-CD2 3.94Å; L7-W98 HydrophobicContact CD2-CE3 3.3Å; L7-W98 HydrophobicContact CD2-CH2 4.26Å; L7-W98 HydrophobicContact CD2-CZ3 3.49Å; L7-W98 VanDerWaalsContact CD2-CZ3 3.49Å; L7-W98 HydrophobicContact CG-CD2 4.2Å; L7-W98 HydrophobicContact CG-CE3 3.82Å; L7-W98 HydrophobicContact CG-CH2 3.92Å; L7-W98 HydrophobicContact CG-CZ2 4.3Å; L7-W98 HydrophobicContact CG-CZ3 3.66Å; L11-W98 HydrophobicContact CD1-CD2 4.08Å; L11-W98 HydrophobicContact CD1-CE3 4.47Å; L11-W98 HydrophobicContact CD1-CG 4.49Å; L11-W98 HydrophobicContact CD1-CZ2 4.12Å; L11-W98 HydrophobicContact CG-CZ2 4.41Å; F32-W98 HydrophobicContact CB-CZ3 4.32Å; L39-W98 HydrophobicContact CD1-CE3 4.47Å; L39-W98 HydrophobicContact CD1-CH2 4.06Å; L39-W98 HydrophobicContact CD1-CZ3 3.53Å; F76-W98 HydrophobicContact CE1-CB 4.46Å; F76-W98 HydrophobicContact CZ-CB 3.97Å; F76-W98 HydrophobicContact CZ-CG 4.37Å; A94-W98 PolarHBondContact O-N 3.36Å; M95-W98 PolarHBondContact O-N 3.23Å; W98-L102 HydrophobicContact CE3-CD1 4.06Å; W98-L102 HydrophobicContact CE3-CG 4.37Å; W98-L102 WeakPolarHBondContact O-CB 3.23Å; W98-L102 WeakPolarHBondContact O-CG 3.32Å; W98-L102 PolarHBondContact O-N 3.34Å
99	L	92	Very high	86.5	Confident	11 Å²	11	60.8 Å²	60.8	6%	0.058	31%	0.307	C	S	.	.	H	α-helix	trans	-63.9	-44.8	-179.4	-76	168.5	0	0	0	112.3	F66 I68 F76 M95 L96 V101 Q103	F66-L99 HydrophobicContact CB-CD2 3.91Å; F66-L99 HydrophobicContact CD1-CD2 4.1Å; F66-L99 HydrophobicContact CG-CD2 4.26Å; I68-L99 HydrophobicContact CD1-CD1 3.38Å; I68-L99 HydrophobicContact CG1-CD1 3.49Å; I68-L99 VanDerWaalsContact CG1-CD1 3.49Å; F76-L99 HydrophobicContact CB-CD1 3.94Å; F76-L99 HydrophobicContact CB-CD2 4.02Å; F76-L99 HydrophobicContact CB-CG 4.23Å; F76-L99 HydrophobicContact CD2-CD2 3.65Å; F76-L99 HydrophobicContact CD2-CG 4.07Å; F76-L99 HydrophobicContact CE2-CD2 4.37Å; F76-L99 HydrophobicContact CG-CD1 4.3Å; F76-L99 HydrophobicContact CG-CD2 4.05Å; F76-L99 HydrophobicContact CG-CG 4.13Å; M95-L99 HydrophobicContact CG-CD1 3.94Å; M95-L99 PolarHBondContact O-N 2.9Å; L96-L99 PolarHBondContact O-N 2.81Å; L99-V101 PolarHBondContact O-N 2.82Å; L99-Q103 WeakPolarHBondContact O-CB 3.47Å; L99-Q103 PolarHBondContact O-N 2.85Å
100	H	86.2	Confident	85.6	Confident	127 Å²	127	62.9 Å²	62.9	59%	0.588	32%	0.319	S	S	*	.	H	α-helix	trans	-59.1	-49.6	-179.9	180	68.4	0	0	0	111.6	L96 L97 T104	L96-H100 WeakPolarHBondContact O-CB 3.39Å; L96-H100 PolarHBondContact O-N 2.79Å; L97-H100 PolarHBondContact O-N 2.75Å; H100-T104 VanDerWaalsContact O-CB 3.26Å; H100-T104 WeakPolarHBondContact O-CB 3.39Å; H100-T104 PolarHBondContact O-N 2.94Å; H100-T104 PolarHBondContact O-OG1 2.74Å
101	V	88.4	Confident	84.7	Confident	30 Å²	30	62.2 Å²	62.2	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-67.4	-47.6	-178.2	176	0	0	0	0	111.2	L7 F32 L97 L99 Q103 T104 R105	L7-V101 HydrophobicContact CD2-CB 3.77Å; L7-V101 HydrophobicContact CD2-CG1 3.76Å; L7-V101 HydrophobicContact CD2-CG2 4.34Å; F32-V101 HydrophobicContact CD1-CG1 4.5Å; L97-V101 HydrophobicContact CD1-CG2 4.44Å; L97-V101 WeakPolarHBondContact O-CG2 3.47Å; L97-V101 PolarHBondContact O-N 2.8Å; L97-V101 VanDerWaalsContact O-N 3.1Å; L99-V101 PolarHBondContact O-N 2.82Å; V101-Q103 PolarHBondContact O-N 2.79Å; V101-T104 PolarHBondContact O-N 2.99Å; V101-R105 WeakPolarHBondContact O-CG 3.33Å; V101-R105 PolarHBondContact O-N 2.86Å
102	L	93.4	Very high	83.8	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.7	-42.7	-178.2	-67.3	175.6	0	0	0	112	F32 L39 I61 F66 I78 W98 R106	F32-L102 HydrophobicContact CB-CD2 4.28Å; F32-L102 HydrophobicContact CD1-CD2 4.02Å; F32-L102 HydrophobicContact CD2-CD2 3.45Å; F32-L102 VanDerWaalsContact CD2-CD2 3.45Å; F32-L102 HydrophobicContact CE1-CD2 4.18Å; F32-L102 HydrophobicContact CE2-CD2 3.66Å; F32-L102 HydrophobicContact CG-CD2 3.64Å; F32-L102 HydrophobicContact CZ-CD2 4.01Å; L39-L102 HydrophobicContact CD2-CD1 4.23Å; I61-L102 HydrophobicContact CD1-CD2 4.38Å; I61-L102 HydrophobicContact CG1-CD2 4.26Å; F66-L102 HydrophobicContact CE1-CB 3.77Å; F66-L102 HydrophobicContact CE1-CD1 4.17Å; F66-L102 HydrophobicContact CZ-CB 3.71Å; I78-L102 HydrophobicContact CD1-CD1 4.06Å; W98-L102 HydrophobicContact CE3-CD1 4.06Å; W98-L102 HydrophobicContact CE3-CG 4.37Å; W98-L102 WeakPolarHBondContact O-CB 3.23Å; W98-L102 WeakPolarHBondContact O-CG 3.32Å; W98-L102 PolarHBondContact O-N 3.34Å; L102-R106 WeakPolarHBondContact O-CB 3.45Å; L102-R106 PolarHBondContact O-N 3.19Å
103	Q	89.2	Confident	82.7	Confident	85 Å²	85	59.4 Å²	59.4	40%	0.397	31%	0.308	S	S	.	.	H	α-helix	trans	-68.1	-39.7	179	-173.9	169.5	-17.8	0	0	112	F66 L99 V101 N107	F66-Q103 HydrophobicContact CD2-CB 4.12Å; F66-Q103 HydrophobicContact CD2-CG 4.33Å; F66-Q103 HydrophobicContact CE2-CB 4.11Å; L99-Q103 WeakPolarHBondContact O-CB 3.47Å; L99-Q103 PolarHBondContact O-N 2.85Å; V101-Q103 PolarHBondContact O-N 2.79Å; Q103-N107 WeakPolarHBondContact O-CB 3.25Å; Q103-N107 PolarHBondContact O-N 2.85Å; Q103-N107 PolarHBondContact O-ND2 3.29Å; Q103-N107 PolarHBondContact O-OD1 3.06Å
104	T	85.6	Confident	81	Confident	47 Å²	47	60 Å²	60	29%	0.288	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-49.9	177	-58.9	0	0	0	0	110.7	H100 V101 R106 N107 E108	H100-T104 VanDerWaalsContact O-CB 3.26Å; H100-T104 WeakPolarHBondContact O-CB 3.39Å; H100-T104 PolarHBondContact O-N 2.94Å; H100-T104 PolarHBondContact O-OG1 2.74Å; V101-T104 PolarHBondContact O-N 2.99Å; T104-R106 PolarHBondContact O-N 3.15Å; T104-N107 PolarHBondContact O-N 2.93Å; T104-N107 VanDerWaalsContact O-N 3.13Å; T104-E108 WeakPolarHBondContact O-CG 3.36Å; T104-E108 PolarHBondContact O-N 3.31Å
105	R	85.3	Confident	78.9	Confident	71 Å²	71	62.9 Å²	62.9	27%	0.268	33%	0.326	S	S	.	.	H	α-helix	trans	-67.9	-33.6	-179.5	-63	-46.9	-173.6	84.1	11.9	113.6	F32 E34 L37 V101 E108 A109	F32-R105 HydrophobicContact CE1-CB 4.02Å; F32-R105 HydrophobicContact CE1-CG 3.89Å; F32-R105 HydrophobicContact CZ-CB 3.99Å; F32-R105 HydrophobicContact CZ-CG 4.38Å; E34-R105 IonicContact OE1-CZ 2.88Å; E34-R105 IonicContact OE1-NH1 3.29Å; E34-R105 IonicContact OE1-NH2 3.95Å; E34-R105 PolarHBondContact OE1-NH2 3.27Å; E34-R105 IonicContact OE2-CZ 2.83Å; E34-R105 IonicContact OE2-NH1 3.88Å; E34-R105 PolarHBondContact OE2-NH1 2.75Å; E34-R105 IonicContact OE2-NH2 2.71Å; E34-R105 PolarHBondContact OE2-NH2 2.83Å; L37-R105 HydrophobicContact CD2-CB 3.92Å; V101-R105 WeakPolarHBondContact O-CG 3.33Å; V101-R105 PolarHBondContact O-N 2.86Å; R105-E108 WeakPolarHBondContact CD-OE2 3.41Å; R105-E108 IonicContact NE-OE2 3.65Å; R105-A109 PolarHBondContact O-N 2.9Å; R105-A109 VanDerWaalsContact O-N 3.16Å
106	R	90.4	Very high	76.2	Confident	46 Å²	46	68.5 Å²	68.5	17%	0.174	36%	0.356	C	S	.	.	H	α-helix	trans	-59.5	-49.2	168.8	180	-157	66.2	-175.4	0.1	111	I61 A64 F66 L102 T104 E108 A109 V110	I61-R106 HydrophobicContact CG2-CB 3.9Å; I61-R106 WeakPolarHBondContact O-CG 3.48Å; A64-R106 WeakPolarHBondContact O-CD 3.17Å; A64-R106 PolarHBondContact O-NH1 2.9Å; F66-R106 HydrophobicContact CE2-CB 4.41Å; L102-R106 WeakPolarHBondContact O-CB 3.45Å; L102-R106 PolarHBondContact O-N 3.19Å; T104-R106 PolarHBondContact O-N 3.15Å; R106-E108 VanDerWaalsContact C-N 3.32Å; R106-E108 PolarHBondContact O-N 3.5Å; R106-A109 PolarHBondContact O-N 3.45Å; R106-V110 HydrophobicContact CG-CG2 4.4Å; R106-V110 WeakPolarHBondContact O-CG2 3.26Å; R106-V110 PolarHBondContact O-N 3.4Å
107	N	83.3	Confident	73.8	Confident	61 Å²	61	71.2 Å²	71.2	33%	0.326	37%	0.371	S	S	.	.	H	α-helix	trans	-62.3	-41.3	-176.8	-69.8	-12.5	0	0	0	111.8	Q103 T104 A109 V110 Q111	Q103-N107 WeakPolarHBondContact O-CB 3.25Å; Q103-N107 PolarHBondContact O-N 2.85Å; Q103-N107 PolarHBondContact O-ND2 3.29Å; Q103-N107 PolarHBondContact O-OD1 3.06Å; T104-N107 PolarHBondContact O-N 2.93Å; T104-N107 VanDerWaalsContact O-N 3.13Å; N107-A109 VanDerWaalsContact C-N 3.33Å; N107-A109 PolarHBondContact O-N 3.38Å; N107-V110 PolarHBondContact O-N 2.52Å; N107-Q111 WeakPolarHBondContact O-CG 3.33Å; N107-Q111 PolarHBondContact O-N 3.1Å
108	E	79.8	Confident	71.2	Confident	93 Å²	93	72 Å²	72	44%	0.435	39%	0.385	S	S	.	.	H	α-helix	trans	-59.1	-43.5	174.7	-71.6	172.6	177.8	0	0	111.6	T104 R105 R106 Q111 T112	T104-E108 WeakPolarHBondContact O-CG 3.36Å; T104-E108 PolarHBondContact O-N 3.31Å; R105-E108 WeakPolarHBondContact CD-OE2 3.41Å; R105-E108 IonicContact NE-OE2 3.65Å; R106-E108 VanDerWaalsContact C-N 3.32Å; R106-E108 PolarHBondContact O-N 3.5Å; E108-Q111 PolarHBondContact O-N 2.74Å; E108-T112 PolarHBondContact O-N 3.45Å; E108-T112 PolarHBondContact O-OG1 3.05Å
109	A	76.4	Confident	68.1	Low	9 Å²	9	76.1 Å²	76.1	7%	0.074	42%	0.415	C	S	.	.	H	α-helix	trans	-67.6	-36.7	178.4	0	0	0	0	0	113.8	L37 R105 R106 N107 Q111 T112 S113	L37-A109 HydrophobicContact CD1-CB 3.29Å; R105-A109 PolarHBondContact O-N 2.9Å; R105-A109 VanDerWaalsContact O-N 3.16Å; R106-A109 PolarHBondContact O-N 3.45Å; N107-A109 VanDerWaalsContact C-N 3.33Å; N107-A109 PolarHBondContact O-N 3.38Å; A109-Q111 VanDerWaalsContact C-N 3.32Å; A109-T112 WeakPolarHBondContact CA-OG1 3.32Å; A109-T112 PolarHBondContact O-OG1 3.19Å; A109-S113 PolarHBondContact O-N 3.09Å; A109-S113 VanDerWaalsContact O-N 3.11Å; A109-S113 PolarHBondContact O-OG 2.79Å
110	V	72.6	Confident	65.6	Low	48 Å²	48	80.8 Å²	80.8	29%	0.291	45%	0.446	S	S	.	.	H	α-helix	trans	-66.1	-38.4	174	174	0	0	0	0	110.4	R106 N107 S113 E114	R106-V110 HydrophobicContact CG-CG2 4.4Å; R106-V110 WeakPolarHBondContact O-CG2 3.26Å; R106-V110 PolarHBondContact O-N 3.4Å; N107-V110 PolarHBondContact O-N 2.52Å; V110-S113 WeakPolarHBondContact CA-OG 3.28Å; V110-S113 PolarHBondContact O-OG 2.78Å; V110-E114 PolarHBondContact O-N 2.79Å
111	Q	65.3	Low	63	Low	133 Å²	133	82.2 Å²	82.2	62%	0.621	46%	0.458	S	S	*	.	H	α-helix	trans	-69.7	-39.1	177.4	-73	177.6	2.5	0	0	113	N107 E108 A109 E114 S115	N107-Q111 WeakPolarHBondContact O-CG 3.33Å; N107-Q111 PolarHBondContact O-N 3.1Å; E108-Q111 PolarHBondContact O-N 2.74Å; A109-Q111 VanDerWaalsContact C-N 3.32Å; Q111-E114 PolarHBondContact O-N 3.43Å; Q111-S115 PolarHBondContact O-N 2.76Å
112	T	65.9	Low	60.3	Low	82 Å²	82	87 Å²	87	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-68.9	-36.7	177.5	50	0	0	0	0	112.4	E108 A109 E114 S115 D116	E108-T112 PolarHBondContact O-N 3.45Å; E108-T112 PolarHBondContact O-OG1 3.05Å; A109-T112 WeakPolarHBondContact CA-OG1 3.32Å; A109-T112 PolarHBondContact O-OG1 3.19Å; T112-E114 VanDerWaalsContact C-N 3.29Å; T112-E114 PolarHBondContact O-N 2.7Å; T112-S115 PolarHBondContact O-N 3.49Å; T112-S115 PolarHBondContact O-OG 3.06Å; T112-D116 PolarHBondContact O-N 3.37Å
113	S	56.9	Low	57.6	Low	44 Å²	44	94.1 Å²	94.1	31%	0.308	52%	0.521	S	S	.	.	H	α-helix	trans	-68.8	-25.4	174.7	52.5	0	0	0	0	113.3	A109 V110 N117	A109-S113 PolarHBondContact O-N 3.09Å; A109-S113 VanDerWaalsContact O-N 3.11Å; A109-S113 PolarHBondContact O-OG 2.79Å; V110-S113 WeakPolarHBondContact CA-OG 3.28Å; V110-S113 PolarHBondContact O-OG 2.78Å; S113-N117 PolarHBondContact O-ND2 3.09Å
114	E	44.5	Very low	54.9	Low	140 Å²	140	94.3 Å²	94.3	65%	0.654	53%	0.532	S	S	*	.	H	α-helix	trans	-72.8	-27.2	170.9	-76.8	-178.9	176	0	0	112.9	V110 Q111 T112	V110-E114 PolarHBondContact O-N 2.79Å; Q111-E114 PolarHBondContact O-N 3.43Å; T112-E114 VanDerWaalsContact C-N 3.29Å; T112-E114 PolarHBondContact O-N 2.7Å
115	S	42.1	Very low	52.3	Low	89 Å²	89	97.6 Å²	97.6	62%	0.622	55%	0.547	S	S	*	.	H	α-helix	trans	-82.8	-25.4	178.1	52.3	0	0	0	0	115.2	Q111 T112	Q111-S115 PolarHBondContact O-N 2.76Å; T112-S115 PolarHBondContact O-N 3.49Å; T112-S115 PolarHBondContact O-OG 3.06Å
116	D	37.4	Very low	49.9	Very low	128 Å²	128	98.8 Å²	98.8	68%	0.684	56%	0.563	S	S	*	*			trans	-99.6	8.1	-173.5	-78.4	-19.3	0	0	0	114.9	T112 S118	T112-D116 PolarHBondContact O-N 3.37Å; D116-S118 PolarHBondContact O-N 3.44Å
117	N	34.2	Very low	47.1	Very low	138 Å²	138	102.9 Å²	102.9	74%	0.738	59%	0.588	S	S	*	*			trans	-75.8	74.4	174.7	-77.2	-33.4	0	0	0	112.3	S113	S113-N117 PolarHBondContact O-ND2 3.09Å
118	S	31.4	Very low	44.7	Very low	116 Å²	116	105.5 Å²	105.5	81%	0.811	59%	0.594	S	S	*	*			trans	-127.7	51.3	158.8	61.6	0	0	0	0	110.7	D116	D116-S118 PolarHBondContact O-N 3.44Å
119	S	30.5	Very low	42.4	Very low	100 Å²	100	108.1 Å²	108.1	70%	0.699	60%	0.604	S	S	*	*			trans	-157	112.3	160	-173.5	0	0	0	0	110.1
120	P	38.2	Very low	40.3	Very low	109 Å²	109	112.2 Å²	112.2	71%	0.708	62%	0.624	S	S	*	*			trans	-82.7	116.9	172	31.7	-25.1	0	0	0	107.6
121	N	32.3	Very low	38.3	Very low	157 Å²	157	118 Å²	118	84%	0.84	65%	0.646	S	S	*	*			trans	159.2	79.2	153.3	-79.6	-15	0	0	0	108.9
122	D	31.4	Very low	36.7	Very low	131 Å²	131	120.3 Å²	120.3	70%	0.701	65%	0.648	S	S	*	*			trans	-152.3	101.6	154.9	-157.5	-18.5	0	0	0	108.8	S124	D122-S124 PolarHBondContact O-N 2.68Å; D122-S124 PolarHBondContact OD1-OG 2.83Å
123	D	37.1	Very low	35.1	Very low	149 Å²	149	121.9 Å²	121.9	80%	0.797	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-79	12.8	-170.3	-84.7	-25.8	0	0	0	114	L125 T126	D123-L125 VanDerWaalsContact C-N 3.35Å; D123-T126 PolarHBondContact O-OG1 2.87Å
124	S	33.2	Very low	33.8	Very low	90 Å²	90	125.3 Å²	125.3	63%	0.629	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-85.4	-1.4	177.1	63.4	0	0	0	0	114.6	D122	D122-S124 PolarHBondContact O-N 2.68Å; D122-S124 PolarHBondContact OD1-OG 2.83Å
125	L	29.2	Very low	33.3	Very low	115 Å²	115	123 Å²	123	60%	0.602	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-94.8	16.5	-178.7	-127.8	94.4	0	0	0	115.1	D123	D123-L125 VanDerWaalsContact C-N 3.35Å
126	T	35.2	Very low	32.6	Very low	97 Å²	97	123.6 Å²	123.6	60%	0.595	66%	0.66	S	S	*	*	H	α-helix	trans	-79.4	-34.4	-174.8	-39.2	0	0	0	0	112.5	D123	D123-T126 PolarHBondContact O-OG1 2.87Å
127	D	33.1	Very low	32.3	Very low	131 Å²	131	125.1 Å²	125.1	70%	0.701	67%	0.665	S	S	*	*	H	α-helix	trans	-74.8	-29.7	179.9	-81.9	-18.2	0	0	0	113.4	L130 F131	D127-L130 PolarHBondContact O-N 2.82Å; D127-F131 PolarHBondContact O-N 2.59Å
128	Y	32.1	Very low	32.1	Very low	116 Å²	116	127.4 Å²	127.4	46%	0.455	67%	0.668	S	S	.	*	H	α-helix	trans	-74.3	-30.9	179.5	-104.6	-84.2	0	0	0	113.2	D81 R132	D81-Y128 PolarHBondContact OD1-OH 3Å; D81-Y128 VanDerWaalsContact OD1-OH 3.12Å; Y128-R132 PolarHBondContact O-N 2.68Å
129	K	32.3	Very low	32	Very low	148 Å²	148	129.7 Å²	129.7	64%	0.643	67%	0.668	S	S	*	*	H	α-helix	trans	-71.3	-32.4	172.7	-81.1	-176.8	178.1	174.5	0	112.1	R132 Q133	K129-R132 PolarHBondContact O-N 2.86Å; K129-Q133 WeakPolarHBondContact O-CB 3.35Å; K129-Q133 PolarHBondContact O-N 3.47Å
130	L	31.2	Very low	31.6	Very low	95 Å²	95	133.7 Å²	133.7	50%	0.497	68%	0.676	S	S	.	*	H	α-helix	trans	-69.1	-35.5	179.1	-157.4	73.2	0	0	0	112.3	D127 Q133 N134	D127-L130 PolarHBondContact O-N 2.82Å; L130-Q133 PolarHBondContact O-N 2.71Å; L130-N134 PolarHBondContact O-N 2.97Å
131	F	31.9	Very low	31	Very low	171 Å²	171	134.8 Å²	134.8	75%	0.75	67%	0.673	S	S	*	*	H	α-helix	trans	-71.2	-34.9	174.7	-111	-83.3	0	0	0	113.2	D127 S135	D127-F131 PolarHBondContact O-N 2.59Å; F131-S135 PolarHBondContact O-N 3.02Å
132	R	30.3	Very low	30.7	Very low	180 Å²	180	132.8 Å²	132.8	68%	0.679	67%	0.671	S	S	*	*	H	α-helix	trans	-69.3	-39.9	170.2	-109.9	-168.8	-172.9	-170.9	5.7	111.9	Y128 K129 N134 S135 L136	Y128-R132 PolarHBondContact O-N 2.68Å; K129-R132 PolarHBondContact O-N 2.86Å; R132-N134 PolarHBondContact O-N 2.76Å; R132-S135 PolarHBondContact O-N 3.21Å; R132-S135 VanDerWaalsContact O-N 3.16Å; R132-L136 WeakPolarHBondContact O-CB 3.48Å; R132-L136 PolarHBondContact O-N 2.74Å
133	Q	31.9	Very low	30.4	Very low	115 Å²	115	133.6 Å²	133.6	54%	0.537	67%	0.674	S	S	.	*	H	α-helix	trans	-64.6	-37.9	178	-90.7	-175.9	-21.8	0	0	112.5	K129 L130 S135 L136 M137	K129-Q133 WeakPolarHBondContact O-CB 3.35Å; K129-Q133 PolarHBondContact O-N 3.47Å; L130-Q133 PolarHBondContact O-N 2.71Å; Q133-S135 VanDerWaalsContact C-N 3.25Å; Q133-S135 PolarHBondContact O-N 2.9Å; Q133-L136 PolarHBondContact O-N 2.88Å; Q133-M137 WeakPolarHBondContact O-CB 3.3Å; Q133-M137 PolarHBondContact O-N 2.82Å
134	N	31.4	Very low	29.8	Very low	117 Å²	117	132.4 Å²	132.4	63%	0.626	68%	0.675	S	S	*	*	H	α-helix	trans	-69.9	-21.3	175	-77.1	-25.4	0	0	0	113.7	L130 R132	L130-N134 PolarHBondContact O-N 2.97Å; R132-N134 PolarHBondContact O-N 2.76Å
135	S	32.7	Very low	29.4	Very low	91 Å²	91	134.2 Å²	134.2	64%	0.636	68%	0.682	S	S	*	*	H	α-helix	trans	-84.9	-31.2	170.4	-174.3	0	0	0	0	113.3	F131 R132 Q133	F131-S135 PolarHBondContact O-N 3.02Å; R132-S135 PolarHBondContact O-N 3.21Å; R132-S135 VanDerWaalsContact O-N 3.16Å; Q133-S135 VanDerWaalsContact C-N 3.25Å; Q133-S135 PolarHBondContact O-N 2.9Å
136	L	28	Very low	29.1	Very low	101 Å²	101	140.7 Å²	140.7	53%	0.529	70%	0.699	S	S	.	*	H	α-helix	trans	-95.9	-21.1	-175.3	-90.6	151.9	0	0	0	114.7	R132 Q133 K138 M139	R132-L136 WeakPolarHBondContact O-CB 3.48Å; R132-L136 PolarHBondContact O-N 2.74Å; Q133-L136 PolarHBondContact O-N 2.88Å; L136-K138 PolarHBondContact O-N 2.93Å; L136-M139 PolarHBondContact O-N 3.25Å
137	M	30.3	Very low	28.7	Very low	160 Å²	160	140.4 Å²	140.4	79%	0.788	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-5.7	169.7	-98.3	-169.4	162.4	0	0	113.3	Q133 M139	Q133-M137 WeakPolarHBondContact O-CB 3.3Å; Q133-M137 PolarHBondContact O-N 2.82Å; M137-M139 VanDerWaalsContact C-N 3.27Å
138	K	30.5	Very low	28.2	Very low	187 Å²	187	139.1 Å²	139.1	81%	0.813	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-3.9	165.1	-86.6	-176.6	176.2	175.9	0	114.7	L136	L136-K138 PolarHBondContact O-N 2.93Å
139	M	28.4	Very low	28	Very low	163 Å²	163	139.6 Å²	139.6	80%	0.803	72%	0.724	S	S	*	*	S	Bend	trans	-145.3	67.1	178.5	-76.9	-174.6	126.4	0	0	112	L136 M137	L136-M139 PolarHBondContact O-N 3.25Å; M137-M139 VanDerWaalsContact C-N 3.27Å
140	Q	23.7	Very low	27.6	Very low	184 Å²	184	140.5 Å²	140.5	86%	0.86	73%	0.734	S	S	*	*			trans	-164.4	82.8	155.7	-112.2	166.1	-6.3	0	0	109.8
141	M	24.5	Very low	27.2	Very low	133 Å²	133	143.7 Å²	143.7	66%	0.655	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-94.4	120.3	159.1	-79.5	-68.3	-165.1	0	0	107.8	T428	M141-T428 VanDerWaalsContact CE-CB 3.43Å; M141-T428 HydrophobicContact CE-CG2 3.71Å; M141-T428 WeakPolarHBondContact CE-OG1 3.42Å
142	S	27.1	Very low	26.7	Very low	115 Å²	115	140.7 Å²	140.7	80%	0.804	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-66.3	131.9	177.3	45.3	0	0	0	0	111.9
143	I	23.3	Very low	26.4	Very low	148 Å²	148	137.3 Å²	137.3	76%	0.759	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-67.7	124.5	178.6	-61.6	156.4	0	0	0	110	T145	I143-T145 PolarHBondContact O-N 3.05Å
144	P	24.7	Very low	25.9	Very low	124 Å²	124	139.1 Å²	139.1	81%	0.805	77%	0.768	S	S	*	*			trans	-86.1	100.2	167.9	22.6	-11.1	0	0	0	109.5	R146	P144-R146 PolarHBondContact O-N 3.23Å
145	T	26.4	Very low	25.6	Very low	128 Å²	128	138 Å²	138	79%	0.785	77%	0.769	S	S	*	*			trans	-72.1	106.1	174	-20	0	0	0	0	109.5	I143 A147	I143-T145 PolarHBondContact O-N 3.05Å; T145-A147 PolarHBondContact O-N 3.25Å; T145-A147 VanDerWaalsContact O-N 3.12Å
146	R	22.2	Very low	25.2	Very low	251 Å²	251	140.3 Å²	140.3	95%	0.947	78%	0.775	S	S	*	*			trans	-75	91.4	172.2	-174.2	179.8	-179.3	179.7	0	109	P144	P144-R146 PolarHBondContact O-N 3.23Å
147	A	26.3	Very low	25	Very low	90 Å²	90	143.2 Å²	143.2	74%	0.744	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-99.8	126.2	167.9	0	0	0	0	0	109.8	T145	T145-A147 PolarHBondContact O-N 3.25Å; T145-A147 VanDerWaalsContact O-N 3.12Å
148	S	23.9	Very low	24.5	Very low	105 Å²	105	140.4 Å²	140.4	73%	0.734	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-63	150.3	-179.9	-4.1	0	0	0	0	112.3	I150	S148-I150 PolarHBondContact O-N 2.82Å
149	P	26.5	Very low	24.2	Very low	125 Å²	125	136.8 Å²	136.8	81%	0.812	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-80.2	121.9	-169	32.2	-31.6	0	0	0	110.9
150	I	23.3	Very low	23.9	Very low	167 Å²	167	138.2 Å²	138.2	86%	0.856	78%	0.782	S	S	*	*			trans	-111.1	121.2	162.7	-61.4	176.8	0	0	0	106.7	S148 S152	S148-I150 PolarHBondContact O-N 2.82Å; I150-S152 PolarHBondContact O-N 2.82Å
151	I	23.9	Very low	23.9	Very low	162 Å²	162	136 Å²	136	83%	0.831	78%	0.776	S	S	*	*			trans	-59.7	125.8	-174	-68.2	163.7	0	0	0	110
152	S	21.3	Very low	23.9	Very low	108 Å²	108	137.6 Å²	137.6	76%	0.755	79%	0.787	S	S	*	*			trans	-76.2	131.6	172.7	48.7	0	0	0	0	111	I150	I150-S152 PolarHBondContact O-N 2.82Å
153	S	23.7	Very low	23.7	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	79%	0.79	S	S	*	*			trans	-142.8	100.6	152.7	64.9	0	0	0	0	108.9
154	D	22.5	Very low	23.8	Very low	153 Å²	153	136 Å²	136	82%	0.818	79%	0.787	S	S	*	*			trans	41.8	124.4	136	-61.5	-20.9	0	0	0	121
155	S	23.5	Very low	23.7	Very low	94 Å²	94	135.5 Å²	135.5	66%	0.657	79%	0.786	S	S	*	*				128.6	128.5	114.9	68	0	0	0	0	115.6
156	N	24.7	Very low	23.5	Very low	140 Å²	140	137.7 Å²	137.7	75%	0.749	79%	0.792	S	S	*	*			trans	71.1	144	149.4	-53.4	-16.3	0	0	0	116.6
157	E	23.2	Very low	23.6	Very low	162 Å²	162	137.1 Å²	137.1	76%	0.757	79%	0.79	S	S	*	*			cis	-173.3	147.3	-7.4	-116.8	179.2	162.9	0	0	102.7
158	S	20.9	Very low	23.5	Very low	100 Å²	100	138 Å²	138	70%	0.699	79%	0.791	S	S	*	*			trans	21.2	124.7	153.2	62.6	0	0	0	0	121
159	S	23.9	Very low	23.3	Very low	111 Å²	111	145 Å²	145	78%	0.776	80%	0.801	S	S	*	*				-176.1	118.2	121.9	36.3	0	0	0	0	114.1
160	F	23.3	Very low	23.2	Very low	193 Å²	193	148.7 Å²	148.7	85%	0.846	80%	0.804	S	S	*	*			trans	50.7	110.9	137.2	-76.1	-88.4	0	0	0	122.7
161	N	23.1	Very low	23.2	Very low	137 Å²	137	145.9 Å²	145.9	73%	0.733	80%	0.799	S	S	*	*				19.3	121	124.5	-83.8	-14.6	0	0	0	118.1
162	N	24.9	Very low	23.2	Very low	168 Å²	168	144 Å²	144	90%	0.898	80%	0.801	S	S	*	*			trans	-153.8	120.2	130.8	-104.4	-24.4	0	0	0	112.7	G164	N162-G164 PolarHBondContact O-N 2.96Å
163	N	23	Very low	23.3	Very low	163 Å²	163	143.4 Å²	143.4	87%	0.872	80%	0.796	S	S	*	*			trans	-65.6	117.2	170.8	-75.5	-39.3	0	0	0	110.5
164	G	24.1	Very low	23.4	Very low	66 Å²	66	147.2 Å²	147.2	68%	0.68	80%	0.802	S	S	*	*			trans	-122.5	77.6	170	0	0	0	0	0	111	N162 L166	N162-G164 PolarHBondContact O-N 2.96Å; G164-L166 PolarHBondContact O-N 2.81Å; G164-L166 VanDerWaalsContact O-N 3.09Å
165	S	23.1	Very low	23.7	Very low	113 Å²	113	148.7 Å²	148.7	79%	0.79	80%	0.804	S	S	*	*			trans	-66.1	98.8	173.1	-177.9	0	0	0	0	110.4	R167	S165-R167 PolarHBondContact O-N 3.14Å
166	L	23.1	Very low	23.9	Very low	175 Å²	175	151.1 Å²	151.1	92%	0.916	81%	0.809	S	S	*	*			trans	-77.4	97.2	166.1	-91.6	102.7	0	0	0	109.6	G164 S168	G164-L166 PolarHBondContact O-N 2.81Å; G164-L166 VanDerWaalsContact O-N 3.09Å; L166-S168 PolarHBondContact O-N 2.91Å
167	R	22.7	Very low	23.9	Very low	238 Å²	238	151 Å²	151	90%	0.898	81%	0.808	S	S	*	*			trans	-59	118.3	169.8	-92.7	177.1	166.6	178.3	-3.8	111.1	S165	S165-R167 PolarHBondContact O-N 3.14Å
168	S	24.2	Very low	24.1	Very low	109 Å²	109	150.4 Å²	150.4	76%	0.762	81%	0.81	S	S	*	*			trans	-65.8	123.6	168.5	48.7	0	0	0	0	111.5	L166 K170	L166-S168 PolarHBondContact O-N 2.91Å; S168-K170 PolarHBondContact O-N 2.78Å
169	R	20.8	Very low	24.4	Very low	253 Å²	253	154 Å²	154	96%	0.955	81%	0.813	S	S	*	*			trans	-88.3	105.6	171.7	-127.3	174.1	-179.8	163.8	-1	108.3	S171	R169-S171 PolarHBondContact O-N 2.97Å
170	K	24.8	Very low	24.5	Very low	201 Å²	201	155 Å²	155	87%	0.874	81%	0.809	S	S	*	*			trans	-59.6	120.6	171.6	-68.4	178.1	173.4	-177.7	0	110	S168	S168-K170 PolarHBondContact O-N 2.78Å
171	S	23.5	Very low	24.7	Very low	108 Å²	108	152.5 Å²	152.5	76%	0.755	80%	0.803	S	S	*	*			trans	-90.8	116.2	168.6	46.6	0	0	0	0	109.7	R169 S173	R169-S171 PolarHBondContact O-N 2.97Å; S171-S173 PolarHBondContact O-N 2.89Å
172	S	23.3	Very low	24.9	Very low	123 Å²	123	155.1 Å²	155.1	86%	0.86	81%	0.808	S	S	*	*			trans	-86.3	99	177.9	52.4	0	0	0	0	110.4
173	S	23.6	Very low	25	Very low	95 Å²	95	155.3 Å²	155.3	66%	0.664	80%	0.803	S	S	*	*			trans	-148.8	38.7	174.3	34.4	0	0	0	0	113.1	S171	S171-S173 PolarHBondContact O-N 2.89Å
174	H	25.8	Very low	25	Very low	189 Å²	189	155.6 Å²	155.6	88%	0.875	80%	0.804	S	S	*	*			trans	-117.3	23.4	179.3	-95.8	32.4	0	0	0	115.7
175	Q	27.6	Very low	24.9	Very low	185 Å²	185	157.3 Å²	157.3	86%	0.864	81%	0.806	S	S	*	*	S	Bend	trans	-120.5	2.8	176.9	-77.4	-170.3	-9.9	0	0	116.9
176	N	27.3	Very low	24.9	Very low	144 Å²	144	159 Å²	159	77%	0.77	81%	0.805	S	S	*	*	S	Bend	trans	-102.9	-5.8	177.9	-80.4	-14.9	0	0	0	115.9
177	L	25.3	Very low	25	Very low	139 Å²	139	157.6 Å²	157.6	73%	0.728	80%	0.798	S	S	*	*	G	3₁₀ helix	trans	-78.2	-29.2	-179.9	-150.9	78.8	0	0	0	113.3	K179 L180	L177-K179 VanDerWaalsContact C-N 3.33Å; L177-K179 PolarHBondContact O-N 2.92Å; L177-L180 PolarHBondContact O-N 2.86Å
178	N	27.3	Very low	25	Very low	149 Å²	149	155.7 Å²	155.7	80%	0.797	80%	0.799	S	S	*	*	G	3₁₀ helix	trans	-82.3	-2.1	-175.1	-79.8	-13.8	0	0	0	115.3
179	K	28.3	Very low	24.9	Very low	175 Å²	175	158 Å²	158	76%	0.761	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-91.3	-14.5	168.9	-88.1	-175.6	176.4	176.5	0	113.7	L177	L177-K179 VanDerWaalsContact C-N 3.33Å; L177-K179 PolarHBondContact O-N 2.92Å
180	L	26	Very low	24.9	Very low	131 Å²	131	151.9 Å²	151.9	69%	0.686	79%	0.786	S	S	*	*	S	Bend	trans	-84.7	-18.7	-173.6	-141.3	83.7	0	0	0	114.1	L177	L177-L180 PolarHBondContact O-N 2.86Å
181	I	27.7	Very low	24.8	Very low	141 Å²	141	150.3 Å²	150.3	72%	0.723	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-9.5	-173.1	-64.6	178	0	0	0	113.4
182	K	27.2	Very low	24.8	Very low	193 Å²	193	153.8 Å²	153.8	84%	0.839	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	9.8	-175.9	-102.5	-177.4	-179.9	177.6	0	116.6
183	Q	26.7	Very low	24.7	Very low	171 Å²	171	156.9 Å²	156.9	80%	0.799	79%	0.792	S	S	*	*	S	Bend	trans	-132.2	19	-171.2	-129.7	165.2	-3.8	0	0	116.2
184	L	23.3	Very low	24.6	Very low	169 Å²	169	157.5 Å²	157.5	89%	0.885	80%	0.796	S	S	*	*			trans	-119.5	41.8	177.4	-77.3	166.3	0	0	0	113.2
185	S	22.2	Very low	24.4	Very low	103 Å²	103	159.5 Å²	159.5	72%	0.72	80%	0.798	S	S	*	*	S	Bend	trans	-131.6	130.1	163.3	-175.7	0	0	0	0	107.9
186	I	23.3	Very low	24.2	Very low	149 Å²	149	158.6 Å²	158.6	76%	0.764	80%	0.799	S	S	*	*	S	Bend	trans	92.7	89.9	-179.8	-49.7	160.9	0	0	0	113.1
187	D	24.1	Very low	23.9	Very low	145 Å²	145	158.9 Å²	158.9	78%	0.775	80%	0.801	S	S	*	*				159.9	111.7	126.6	-82.6	-26.6	0	0	0	109.9
188	Q	23.3	Very low	23.9	Very low	197 Å²	197	160.6 Å²	160.6	92%	0.921	81%	0.81	S	S	*	*			trans	171.3	111.8	143.1	-95.2	168.4	27.1	0	0	111.3
189	M	20.6	Very low	23.7	Very low	159 Å²	159	161.8 Å²	161.8	78%	0.783	81%	0.811	S	S	*	*			trans	-140.7	139.8	157.2	-78.5	-161.1	83.6	0	0	109.8
190	N	21.8	Very low	23.4	Very low	124 Å²	124	162 Å²	162	66%	0.663	82%	0.819	S	S	*	*			trans	75.5	110.5	160.9	-61.6	-12.6	0	0	0	118.7
191	D	23.6	Very low	23.1	Very low	168 Å²	168	162.7 Å²	162.7	90%	0.898	82%	0.823	S	S	*	*				-160.3	125.4	110.2	-91.4	-26.6	0	0	0	111.3
192	H	22.5	Very low	22.9	Very low	181 Å²	181	163.1 Å²	163.1	84%	0.838	83%	0.825	S	S	*	*			trans	-106	131.9	176.2	-91.3	-80.8	0	0	0	109
193	Q	21	Very low	22.6	Very low	188 Å²	188	161.1 Å²	161.1	88%	0.879	82%	0.823	S	S	*	*			trans	-142.8	136.9	153.1	-80.6	-156	-11.9	0	0	112.6
194	S	21.5	Very low	22.3	Very low	108 Å²	108	161.5 Å²	161.5	76%	0.755	83%	0.825	S	S	*	*			trans	-82.5	149	-175.5	49	0	0	0	0	114
195	Y	22.1	Very low	22.3	Very low	230 Å²	230	160.5 Å²	160.5	90%	0.902	83%	0.826	S	S	*	*			trans	-136.4	138.3	161.3	-94.8	-85.6	0	0	0	112.1
196	N	23.1	Very low	22.2	Very low	167 Å²	167	159.9 Å²	159.9	89%	0.893	82%	0.822	S	S	*	*			trans	-87.7	142.9	-170.1	-101.2	-22	0	0	0	113.4
197	N	21.6	Very low	22.1	Very low	150 Å²	150	160.4 Å²	160.4	80%	0.802	83%	0.825	S	S	*	*			trans	-88.4	144.8	173.6	-81.2	-28.8	0	0	0	112.3
198	N	24.6	Very low	21.9	Very low	174 Å²	174	165 Å²	165	93%	0.93	83%	0.832	S	S	*	*			trans	-140.1	128.4	161.6	-94.9	-24.1	0	0	0	111
199	H	22.2	Very low	21.8	Very low	174 Å²	174	163 Å²	163	81%	0.806	83%	0.825	S	S	*	*			trans	-85.5	144	-175.6	-104.5	-90.6	0	0	0	112.8
200	L	22.1	Very low	21.8	Very low	179 Å²	179	159.9 Å²	159.9	94%	0.937	82%	0.82	S	S	*	*			trans	-152.1	137.1	157.2	-104.4	143.9	0	0	0	111.4
201	L	20.9	Very low	21.8	Very low	146 Å²	146	160.2 Å²	160.2	76%	0.764	83%	0.829	S	S	*	*			trans	-90.2	149.4	-174.6	-119.3	87.7	0	0	0	111.8
202	I	22.3	Very low	21.8	Very low	151 Å²	151	158 Å²	158	77%	0.774	82%	0.815	S	S	*	*				161.6	128.3	129.9	-79.9	157.1	0	0	0	113.4
203	D	21.4	Very low	21.8	Very low	150 Å²	150	155.1 Å²	155.1	80%	0.802	81%	0.806	S	S	*	*			trans	56.2	116	152.8	-63.7	-15.6	0	0	0	125.6
204	H	20.4	Very low	21.9	Very low	180 Å²	180	153.6 Å²	153.6	83%	0.833	80%	0.799	S	S	*	*			trans	-74.4	129.5	176.2	-70.6	-94.1	0	0	0	113.2
205	T	22.5	Very low	22	Very low	147 Å²	147	153.7 Å²	153.7	90%	0.902	80%	0.799	S	S	*	*			trans	-103.7	96	150.9	46.2	0	0	0	0	108.5
206	S	21.3	Very low	22	Very low	90 Å²	90	150 Å²	150	63%	0.629	79%	0.792	S	S	*	*			trans	-77.7	113.4	-179.8	37.6	0	0	0	0	111
207	L	22	Very low	22.1	Very low	160 Å²	160	150.1 Å²	150.1	84%	0.838	79%	0.793	S	S	*	*			trans	-105.2	110.9	158	-82.5	161.6	0	0	0	106.9	I209	L207-I209 PolarHBondContact O-N 3.47Å
208	W	19.3	Very low	22.2	Very low	243 Å²	243	149.8 Å²	149.8	92%	0.92	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-63	117.8	-178.8	-75.6	59.5	0	0	0	110.1
209	I	21.2	Very low	22.1	Very low	153 Å²	153	147.4 Å²	147.4	79%	0.785	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-103.5	124.7	166.6	-63	174.2	0	0	0	106.6	L207	L207-I209 PolarHBondContact O-N 3.47Å
210	S	20.3	Very low	22	Very low	95 Å²	95	144.3 Å²	144.3	66%	0.664	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69.9	148.2	175.6	51	0	0	0	0	111.4	I212	S210-I212 PolarHBondContact O-N 3.39Å
211	P	22.6	Very low	22	Very low	131 Å²	131	141 Å²	141	85%	0.851	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-67.9	128	-172.4	-12.7	28	0	0	0	111.9
212	I	23.5	Very low	22	Very low	120 Å²	120	139.5 Å²	139.5	62%	0.615	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-85.5	128	177.2	-66.2	169.2	0	0	0	109	S210 I1156	S210-I212 PolarHBondContact O-N 3.39Å; I212-I1156 HydrophobicContact CD1-CG1 4.46Å
213	D	22.3	Very low	21.9	Very low	121 Å²	121	137.9 Å²	137.9	65%	0.647	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-77.7	132	173.9	-88	-41.2	0	0	0	111.7	K942	D213-K942 IonicContact OD1-NZ 3.04Å; D213-K942 PolarHBondContact OD1-NZ 2.85Å; D213-K942 VanDerWaalsContact OD1-NZ 3.09Å
214	H	22.6	Very low	21.9	Very low	157 Å²	157	137.5 Å²	137.5	73%	0.727	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-78.5	119.5	-179.1	-75.3	-76.1	0	0	0	111.9
215	S	23.1	Very low	21.9	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	79%	0.791	S	S	*	*			trans	-128.1	102.7	150.8	56.5	0	0	0	0	108.3
216	M	22.1	Very low	21.9	Very low	154 Å²	154	133.6 Å²	133.6	76%	0.759	78%	0.783	S	S	*	*			trans	-132.8	124	173.1	-85.2	-159.8	157.9	0	0	108.7
217	N	25.9	Very low	22	Very low	169 Å²	169	136 Å²	136	90%	0.904	80%	0.795	S	S	*	*			trans	-166.1	89.8	143.6	-98.9	-15	0	0	0	108
218	T	23.1	Very low	22	Very low	143 Å²	143	134.6 Å²	134.6	88%	0.877	79%	0.793	S	S	*	*			trans	-103.6	123.6	159.8	47.4	0	0	0	0	108.3
219	S	22.1	Very low	22.1	Very low	123 Å²	123	130.3 Å²	130.3	86%	0.86	79%	0.788	S	S	*	*			trans	-74.6	129	-178.7	33.7	0	0	0	0	111.5
220	S	22	Very low	22.2	Very low	110 Å²	110	134.3 Å²	134.3	77%	0.769	80%	0.795	S	S	*	*			trans	-154.3	110	150.5	51	0	0	0	0	111.8
221	S	20.7	Very low	22.4	Very low	108 Å²	108	137.9 Å²	137.9	76%	0.755	81%	0.806	S	S	*	*			trans	42.9	122.6	143.2	57.9	0	0	0	0	123.1
222	S	20.7	Very low	22.4	Very low	115 Å²	115	140 Å²	140	80%	0.804	81%	0.81	S	S	*	*			trans	68	106.4	136.9	66.9	0	0	0	0	120.5
223	S	21.4	Very low	22.3	Very low	118 Å²	118	143.2 Å²	143.2	83%	0.825	82%	0.824	S	S	*	*			trans	-163.9	133.1	134.6	53.7	0	0	0	0	111.6
224	T	22	Very low	22.3	Very low	141 Å²	141	148.9 Å²	148.9	87%	0.865	84%	0.837	S	S	*	*			trans	-56.2	137	179.8	40.4	0	0	0	0	114.3
225	T	20.3	Very low	22.3	Very low	140 Å²	140	152.8 Å²	152.8	86%	0.859	85%	0.845	S	S	*	*			trans	-67.2	116.7	173.7	45.8	0	0	0	0	112.2
226	S	22	Very low	22.3	Very low	105 Å²	105	156 Å²	156	73%	0.734	85%	0.853	S	S	*	*			trans	-119.2	102.4	157	59.5	0	0	0	0	108.6	T228	S226-T228 PolarHBondContact O-N 3.17Å
227	T	22.6	Very low	22.2	Very low	141 Å²	141	153.7 Å²	153.7	87%	0.865	85%	0.852	S	S	*	*			trans	-71.7	106.9	172.3	17.2	0	0	0	0	109.7
228	T	22	Very low	22	Very low	131 Å²	131	157.2 Å²	157.2	80%	0.804	85%	0.854	S	S	*	*			trans	-124.3	91	162.8	51.1	0	0	0	0	108.7	S226	S226-T228 PolarHBondContact O-N 3.17Å
229	N	22.1	Very low	21.9	Very low	152 Å²	152	157.2 Å²	157.2	81%	0.813	85%	0.849	S	S	*	*			trans	-132.2	109.2	165.3	-111.2	-18.5	0	0	0	105
230	Y	23.9	Very low	21.9	Very low	237 Å²	237	162.1 Å²	162.1	93%	0.929	85%	0.848	S	S	*	*			trans	164.4	50.7	153.7	-90.6	-63.1	0	0	0	112.9
231	D	22.6	Very low	22	Very low	170 Å²	170	161.9 Å²	161.9	91%	0.909	85%	0.847	S	S	*	*			trans	-129	22.5	172.7	-114.6	-11	0	0	0	115.3
232	L	23.6	Very low	22.1	Very low	176 Å²	176	163.9 Å²	163.9	92%	0.921	85%	0.849	S	S	*	*	S	Bend	trans	-110.4	12.7	-177.9	-100.5	159.6	0	0	0	116.4
233	M	22.3	Very low	22.3	Very low	187 Å²	187	163.9 Å²	163.9	92%	0.921	85%	0.849	S	S	*	*	S	Bend	trans	-122.5	38.6	-178.7	-93.4	-82.1	-96.3	0	0	114.7
234	R	22.3	Very low	22.5	Very low	241 Å²	241	168.5 Å²	168.5	91%	0.909	85%	0.85	S	S	*	*	S	Bend	trans	-153	51.9	170.6	-126.6	-175.2	-153	-167.7	8	115.8
235	R	22.2	Very low	22.7	Very low	239 Å²	239	168.2 Å²	168.2	90%	0.902	84%	0.843	S	S	*	*			trans	-142.8	36.5	168.1	-73.6	-164.8	-179.5	172.4	2	115.2
236	L	22	Very low	23.2	Very low	176 Å²	176	165.2 Å²	165.2	92%	0.921	83%	0.828	S	S	*	*			trans	-118.6	73.5	171	-71.2	174.6	0	0	0	111.1
237	S	21.3	Very low	23.7	Very low	105 Å²	105	165.5 Å²	165.5	73%	0.734	82%	0.821	S	S	*	*			trans	179.9	82.8	154.2	58.2	0	0	0	0	110.2
238	Y	21.3	Very low	24.2	Very low	244 Å²	244	165.3 Å²	165.3	96%	0.957	81%	0.813	S	S	*	*			trans	-141.3	109.9	147.7	-103.8	-78.3	0	0	0	108.4
239	N	21.7	Very low	24.6	Very low	143 Å²	143	165 Å²	165	77%	0.765	81%	0.805	S	S	*	*			trans	-85.5	146.4	-177.4	-114.2	-32.8	0	0	0	110
240	R	21.2	Very low	24.9	Very low	225 Å²	225	164.7 Å²	164.7	85%	0.849	80%	0.797	S	S	*	*			trans	81.7	138.1	143.7	-72.9	-178	177.8	-172.7	-1	121.4
241	S	23	Very low	25.3	Very low	105 Å²	105	160.4 Å²	160.4	73%	0.734	79%	0.785	S	S	*	*			trans	68	99.8	152.4	58.3	0	0	0	0	117.6
242	N	24.8	Very low	25.6	Very low	150 Å²	150	158.5 Å²	158.5	80%	0.802	77%	0.771	S	S	*	*				-144.9	115.6	128.7	-90.8	-26	0	0	0	109.1
243	S	24.7	Very low	26	Very low	115 Å²	115	153.9 Å²	153.9	80%	0.804	75%	0.75	S	S	*	*			trans	-60.5	128.3	171.9	53.7	0	0	0	0	110.3
244	Y	24	Very low	26.5	Very low	216 Å²	216	150.5 Å²	150.5	85%	0.847	74%	0.735	S	S	*	*			trans	-130.8	141.1	164.8	-89.8	-80.2	0	0	0	110.5
245	D	27.4	Very low	27.1	Very low	134 Å²	134	143.7 Å²	143.7	72%	0.717	72%	0.717	S	S	*	*			trans	-46.8	136.2	-159.1	-88	-54.5	0	0	0	118	D247	D245-D247 PolarHBondContact O-N 3.09Å
246	S	29.8	Very low	27.4	Very low	78 Å²	78	137.7 Å²	137.7	55%	0.545	70%	0.702	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.7	5.9	-176.8	87.5	0	0	0	0	115.6
247	D	32.6	Very low	27.9	Very low	110 Å²	110	134.6 Å²	134.6	59%	0.588	69%	0.686	S	S	*	*	H	α-helix	trans	-87.1	-18	-174.7	-73.9	-17.5	0	0	0	114	D245	D245-D247 PolarHBondContact O-N 3.09Å
248	I	33	Very low	28.6	Very low	137 Å²	137	135.2 Å²	135.2	70%	0.703	68%	0.68	S	S	*	*	H	α-helix	trans	-78.3	-29.6	176.3	-61.8	176.2	0	0	0	111.6
249	I	29.9	Very low	29.1	Very low	124 Å²	124	129.2 Å²	129.2	64%	0.636	66%	0.663	S	S	*	*	H	α-helix	trans	-75.3	-30.1	179.7	-63	178.7	0	0	0	111.6	Q251 H252 V253	I249-Q251 VanDerWaalsContact C-N 3.3Å; I249-Q251 PolarHBondContact O-N 3.29Å; I249-H252 PolarHBondContact O-N 2.88Å; I249-V253 HydrophobicContact CG2-CG2 4.27Å; I249-V253 WeakPolarHBondContact O-CG2 3.4Å; I249-V253 PolarHBondContact O-N 2.99Å
250	K	29.8	Very low	29.5	Very low	146 Å²	146	127.6 Å²	127.6	64%	0.635	66%	0.655	S	S	*	*	H	α-helix	trans	-68.6	-28	177.2	-82.9	-179.3	-179.9	167.3	0	113.3
251	Q	32.1	Very low	30	Very low	147 Å²	147	123.5 Å²	123.5	69%	0.687	65%	0.65	S	S	*	*	H	α-helix	trans	-79.7	-35.3	179.2	-149.9	156.3	-4.4	0	0	111.8	I249	I249-Q251 VanDerWaalsContact C-N 3.3Å; I249-Q251 PolarHBondContact O-N 3.29Å
252	H	29	Very low	30.5	Very low	131 Å²	131	126.4 Å²	126.4	61%	0.606	65%	0.649	S	S	*	*	H	α-helix	trans	-75.7	-24.7	178.7	-109.1	54.1	0	0	0	114.9	I249	I249-H252 PolarHBondContact O-N 2.88Å
253	V	31.7	Very low	30.8	Very low	79 Å²	79	122.1 Å²	122.1	48%	0.479	63%	0.631	S	S	.	*	H	α-helix	trans	-76.5	-24.6	176.9	174.7	0	0	0	0	112.3	I249	I249-V253 HydrophobicContact CG2-CG2 4.27Å; I249-V253 WeakPolarHBondContact O-CG2 3.4Å; I249-V253 PolarHBondContact O-N 2.99Å
254	N	33.8	Very low	31.1	Very low	115 Å²	115	123 Å²	123	62%	0.615	63%	0.626	S	S	*	*	H	α-helix	trans	-74.2	-33.5	174.8	-84.7	-15.6	0	0	0	112.8
255	D	32.9	Very low	31.5	Very low	99 Å²	99	121.2 Å²	121.2	53%	0.529	62%	0.622	S	S	.	*	H	α-helix	trans	-75.1	-27.2	-179.9	-68.9	-20.3	0	0	0	112.5
256	L	29.7	Very low	31.8	Very low	112 Å²	112	121.8 Å²	121.8	59%	0.586	62%	0.624	S	S	*	*	H	α-helix	trans	-77.7	-21.6	178	-79.1	165	0	0	0	114.3	I258	L256-I258 VanDerWaalsContact C-N 3.34Å
257	N	32.1	Very low	31.7	Very low	111 Å²	111	125.4 Å²	125.4	59%	0.594	64%	0.637	S	S	*	*	H	α-helix	trans	-78.8	-15.3	175.3	-84.2	-28	0	0	0	113.7
258	I	35.6	Very low	31.6	Very low	118 Å²	118	124.7 Å²	124.7	61%	0.605	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-21	176.6	-62.8	176.9	0	0	0	111.6	L256	L256-I258 VanDerWaalsContact C-N 3.34Å
259	I	31.6	Very low	31.6	Very low	118 Å²	118	127.5 Å²	127.5	61%	0.605	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-26.5	-176	-62.9	177.3	0	0	0	112.2	D261	I259-D261 VanDerWaalsContact C-N 3.35Å; I259-D261 PolarHBondContact O-N 2.83Å
260	N	30.2	Very low	31.4	Very low	110 Å²	110	126.1 Å²	126.1	59%	0.588	65%	0.649	S	S	*	*	H	α-helix	trans	-77	-15.5	-176.9	-118.5	0.9	0	0	0	114.9	S263	N260-S263 PolarHBondContact O-OG 3.43Å
261	D	32.5	Very low	31.2	Very low	138 Å²	138	126.5 Å²	126.5	74%	0.738	66%	0.658	S	S	*	*	H	α-helix	trans	-87.3	-13.3	178.3	-99.3	-9.3	0	0	0	114.1	I259	I259-D261 VanDerWaalsContact C-N 3.35Å; I259-D261 PolarHBondContact O-N 2.83Å
262	K	33.8	Very low	30.9	Very low	167 Å²	167	126.9 Å²	126.9	73%	0.726	67%	0.665	S	S	*	*	H	α-helix	trans	-93.2	-24.7	179	-79.8	-175.2	178	176.2	0	114.1
263	S	30.1	Very low	30.7	Very low	60 Å²	60	131.2 Å²	131.2	42%	0.42	68%	0.677	S	S	.	*	H	α-helix	trans	-78.8	-25.4	-177.5	43.4	0	0	0	0	113.8	N260 K265	N260-S263 PolarHBondContact O-OG 3.43Å; S263-K265 PolarHBondContact O-N 3.15Å
264	I	32.1	Very low	30.3	Very low	134 Å²	134	135.9 Å²	135.9	69%	0.687	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-15.5	180	-63	179.7	0	0	0	112.9
265	K	33	Very low	29.8	Very low	178 Å²	178	137.3 Å²	137.3	77%	0.774	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-9.9	178.8	-99.7	179	179.3	172	0	115.7	S263	S263-K265 PolarHBondContact O-N 3.15Å
266	L	32	Very low	29.3	Very low	145 Å²	145	139.3 Å²	139.3	76%	0.759	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-14.8	-176.6	-86.8	155.3	0	0	0	114.5
267	L	28.5	Very low	29	Very low	154 Å²	154	143.8 Å²	143.8	81%	0.806	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	4.8	179.2	-84.3	157.6	0	0	0	114.9
268	S	31.5	Very low	28.5	Very low	95 Å²	95	143.9 Å²	143.9	66%	0.664	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	14.2	-178.9	62.6	0	0	0	0	115.6
269	K	31.7	Very low	27.9	Very low	196 Å²	196	143.4 Å²	143.4	85%	0.852	75%	0.75	S	S	*	*	S	Bend	trans	-118.6	9.3	-177.2	-96.2	-174.6	177.4	-177.5	0	117.7
270	S	26.5	Very low	27.5	Very low	95 Å²	95	143.1 Å²	143.1	66%	0.664	76%	0.758	S	S	*	*	S	Bend	trans	-121.8	16.8	-174.5	47.4	0	0	0	0	117
271	N	25	Very low	27.1	Very low	155 Å²	155	142.9 Å²	142.9	83%	0.829	77%	0.765	S	S	*	*			trans	-118.5	18.9	178.3	-88.9	-8.9	0	0	0	116.3	Y273	N271-Y273 PolarHBondContact O-N 3.48Å
272	N	26	Very low	26.6	Very low	155 Å²	155	141 Å²	141	83%	0.829	76%	0.763	S	S	*	*			trans	-99	51.5	-179.2	-80	-13.8	0	0	0	114.6
273	Y	23.8	Very low	26	Very low	222 Å²	222	138.2 Å²	138.2	87%	0.871	76%	0.764	S	S	*	*			trans	-134.4	76.6	163	-82.8	-78.6	0	0	0	110.4	N271	N271-Y273 PolarHBondContact O-N 3.48Å
274	L	24.5	Very low	25.7	Very low	176 Å²	176	140.8 Å²	140.8	92%	0.921	78%	0.782	S	S	*	*			trans	-153.4	109.9	152.9	-105.1	143.2	0	0	0	107.8
275	I	22.8	Very low	25.2	Very low	145 Å²	145	141.5 Å²	141.5	74%	0.744	79%	0.787	S	S	*	*			trans	-78.3	131	-174	-75.9	170.3	0	0	0	110
276	N	22.1	Very low	24.9	Very low	142 Å²	142	140.1 Å²	140.1	76%	0.759	79%	0.789	S	S	*	*			trans	34.1	109.6	144.7	-58.7	-23.1	0	0	0	119.2
277	Q	24.8	Very low	24.5	Very low	205 Å²	205	141.9 Å²	141.9	96%	0.958	79%	0.79	S	S	*	*				-135.4	129.3	127.5	-73.9	-167.6	-4.9	0	0	110
278	S	20.6	Very low	24.2	Very low	114 Å²	114	141.1 Å²	141.1	80%	0.797	79%	0.786	S	S	*	*			trans	-92.3	138.3	-170.4	46	0	0	0	0	112.6
279	S	23.5	Very low	23.7	Very low	108 Å²	108	145.7 Å²	145.7	76%	0.755	79%	0.789	S	S	*	*			trans	171.1	116.7	131.3	52.1	0	0	0	0	112.6
280	S	22	Very low	23.3	Very low	112 Å²	112	143.4 Å²	143.4	78%	0.783	78%	0.782	S	S	*	*			trans	34	137.8	136.8	56	0	0	0	0	119.9
281	S	21.5	Very low	23	Very low	104 Å²	104	149.1 Å²	149.1	73%	0.727	79%	0.789	S	S	*	*			cis	177.4	169.6	21.4	36.9	0	0	0	0	109.7
282	S	22.9	Very low	22.9	Very low	100 Å²	100	149 Å²	149	70%	0.699	79%	0.788	S	S	*	*			trans	73.3	99	160.1	46.4	0	0	0	0	118.6
283	S	21.1	Very low	22.8	Very low	107 Å²	107	153.2 Å²	153.2	75%	0.748	79%	0.792	S	S	*	*				67.5	116.6	90.6	67.9	0	0	0	0	113.3
284	S	23.3	Very low	22.6	Very low	114 Å²	114	149.9 Å²	149.9	80%	0.797	79%	0.788	S	S	*	*				-172	132.6	79.8	-55.8	0	0	0	0	113.4
285	N	21.3	Very low	22.5	Very low	149 Å²	149	148.8 Å²	148.8	80%	0.797	78%	0.78	S	S	*	*			trans	-26.6	146	163	-64.9	-39.7	0	0	0	121.4
286	N	27	Very low	22.5	Very low	150 Å²	150	148.7 Å²	148.7	80%	0.802	78%	0.781	S	S	*	*				-171.3	102.4	121.8	-90.1	-25	0	0	0	111.2
287	K	24.4	Very low	22.6	Very low	181 Å²	181	149 Å²	149	79%	0.787	78%	0.782	S	S	*	*				63.4	86.1	102.6	-75.1	-172.7	177.5	178.7	0	114.9
288	I	21	Very low	22.7	Very low	139 Å²	139	144.2 Å²	144.2	71%	0.713	77%	0.768	S	S	*	*				62.4	132.9	89.7	-35.1	151.4	0	0	0	117.6
289	Y	21.7	Very low	22.7	Very low	190 Å²	190	146.5 Å²	146.5	75%	0.745	77%	0.77	S	S	*	*			trans	114.1	98.5	143.5	-82.3	-76.1	0	0	0	119.4
290	H	22.9	Very low	22.6	Very low	149 Å²	149	149.9 Å²	149.9	69%	0.69	77%	0.774	S	S	*	*				64.8	130.5	120.4	-86.8	-93.2	0	0	0	124.5
291	R	21.6	Very low	22.5	Very low	215 Å²	215	153.5 Å²	153.5	81%	0.811	78%	0.778	S	S	*	*			trans	91.4	108.2	131.4	-105.5	178.8	174.1	143.3	-2.3	120.7
292	N	23	Very low	22.6	Very low	153 Å²	153	157.4 Å²	157.4	82%	0.818	79%	0.785	S	S	*	*			trans	25.2	111.9	130.1	-67.9	-4.7	0	0	0	118.2
293	R	21.9	Very low	22.5	Very low	242 Å²	242	161.2 Å²	161.2	91%	0.913	79%	0.792	S	S	*	*			trans	-148.9	114.2	138	-130.4	175.6	-176	176.8	-0.2	111
294	I	20.2	Very low	22.6	Very low	152 Å²	152	163.1 Å²	163.1	78%	0.779	79%	0.794	S	S	*	*			trans	-63.3	124.7	165.3	-66.9	164.5	0	0	0	107.3
295	M	22.6	Very low	22.7	Very low	154 Å²	154	166.5 Å²	166.5	76%	0.759	80%	0.797	S	S	*	*			trans	-118.2	105.4	167.9	-79.9	-77.6	-82.3	0	0	107.4	L297	M295-L297 HydrophobicContact CE-CD1 4.04Å
296	N	22.6	Very low	23	Very low	143 Å²	143	165.3 Å²	165.3	77%	0.765	79%	0.791	S	S	*	*			trans	-68.8	139	157.2	-72.6	-28.6	0	0	0	108.5
297	L	24.1	Very low	22.9	Very low	147 Å²	147	167.9 Å²	167.9	77%	0.77	79%	0.791	S	S	*	*			trans	-170.3	155.2	158.7	-98.8	146.1	0	0	0	107.9	M295	M295-L297 HydrophobicContact CE-CD1 4.04Å
298	P	27.9	Very low	23.2	Very low	105 Å²	105	164 Å²	164	68%	0.682	79%	0.786	S	S	*	*				-114.6	166	-116.2	23.8	-3.5	0	0	0	113.9	E300	P298-E300 PolarHBondContact O-N 3.39Å
299	I	20	Very low	23.7	Very low	162 Å²	162	162.2 Å²	162.2	83%	0.831	78%	0.777	S	S	*	*			trans	-69.5	111.8	172.5	-61.2	160.2	0	0	0	107.7
300	E	21.3	Very low	24	Very low	180 Å²	180	158.5 Å²	158.5	84%	0.841	77%	0.769	S	S	*	*			trans	-106.4	124.7	161.2	-81.6	-175.9	166.6	0	0	108.4	P298 E302	P298-E300 PolarHBondContact O-N 3.39Å; E300-E302 PolarHBondContact O-N 2.72Å
301	E	20.8	Very low	24.2	Very low	187 Å²	187	156.9 Å²	156.9	87%	0.874	77%	0.766	S	S	*	*			trans	-74.7	106.4	177	-65.1	172.3	154	0	0	108.5
302	E	22.2	Very low	24.7	Very low	187 Å²	187	152.7 Å²	152.7	87%	0.874	76%	0.756	S	S	*	*			trans	-112.5	100.7	161.4	-81.6	-169.9	157	0	0	108.9	E300 N304	E300-E302 PolarHBondContact O-N 2.72Å; E302-N304 PolarHBondContact O-N 2.95Å
303	E	22.3	Very low	25	Very low	180 Å²	180	152.5 Å²	152.5	84%	0.841	75%	0.748	S	S	*	*			trans	-51.4	123.9	151.3	-62.4	176.6	148.5	0	0	108.3
304	N	23.4	Very low	25.3	Very low	146 Å²	146	145.6 Å²	145.6	78%	0.781	73%	0.728	S	S	*	*			trans	-175.5	111.6	139.1	-91.7	-37.8	0	0	0	111.6	E302 D306	E302-N304 PolarHBondContact O-N 2.95Å; N304-D306 PolarHBondContact O-N 3.15Å
305	E	25.6	Very low	25.8	Very low	185 Å²	185	141 Å²	141	86%	0.864	71%	0.709	S	S	*	*			trans	7.8	89	142.5	-59.8	-175.9	159.4	0	0	117.7
306	D	27.4	Very low	26.2	Very low	125 Å²	125	139.1 Å²	139.1	67%	0.668	70%	0.703	S	S	*	*			trans	-145.5	23	160	-103.8	-24.4	0	0	0	113.6	N304 S308	N304-D306 PolarHBondContact O-N 3.15Å; D306-S308 VanDerWaalsContact C-N 3.35Å
307	Y	24.4	Very low	26.6	Very low	204 Å²	204	139.7 Å²	139.7	80%	0.8	70%	0.701	S	S	*	*	H	α-helix	trans	-86.2	3.1	175.9	-99.4	-82.2	0	0	0	114.9
308	S	30.4	Very low	26.9	Very low	99 Å²	99	138.2 Å²	138.2	69%	0.692	69%	0.692	S	S	*	*	H	α-helix	trans	-85.5	-25.9	175.1	-169.9	0	0	0	0	113.5	D306	D306-S308 VanDerWaalsContact C-N 3.35Å
309	I	31.5	Very low	27.1	Very low	101 Å²	101	138.1 Å²	138.1	52%	0.518	69%	0.686	S	S	.	*	H	α-helix	trans	-89.2	-24	-172.8	-60.6	175.4	0	0	0	111.9	K313	I309-K313 PolarHBondContact O-N 3.16Å
310	L	27.4	Very low	27.7	Very low	112 Å²	112	132.5 Å²	132.5	59%	0.586	67%	0.668	S	S	*	*	H	α-helix	trans	-75.7	-33.1	178.8	-144.8	82.6	0	0	0	112.6	E312 K313 L314	L310-E312 VanDerWaalsContact C-N 3.34Å; L310-K313 PolarHBondContact O-N 3.07Å; L310-L314 WeakPolarHBondContact O-CB 3.12Å; L310-L314 PolarHBondContact O-N 3.03Å
311	N	28.4	Very low	28.2	Very low	116 Å²	116	131.4 Å²	131.4	62%	0.62	66%	0.663	S	S	*	*	H	α-helix	trans	-71.6	-28.7	176.7	-90.9	-16.9	0	0	0	112.8	S315	N311-S315 VanDerWaalsContact O-CB 3.28Å; N311-S315 WeakPolarHBondContact O-CB 3.34Å; N311-S315 PolarHBondContact O-N 3.15Å; N311-S315 PolarHBondContact O-OG 3.11Å
312	E	32.3	Very low	28.8	Very low	126 Å²	126	128.4 Å²	128.4	59%	0.589	65%	0.653	S	S	*	*	H	α-helix	trans	-77.4	-29.8	177.4	-146.5	178.6	-170.8	0	0	112.3	L310 S315 N316	L310-E312 VanDerWaalsContact C-N 3.34Å; E312-S315 PolarHBondContact O-OG 3.33Å; E312-N316 WeakPolarHBondContact O-CB 3.31Å; E312-N316 VanDerWaalsContact O-CG 3.3Å; E312-N316 PolarHBondContact O-N 2.9Å; E312-N316 PolarHBondContact O-ND2 2.82Å; E312-N316 VanDerWaalsContact O-ND2 3.13Å
313	K	29.2	Very low	29.1	Very low	150 Å²	150	127.5 Å²	127.5	65%	0.652	64%	0.641	S	S	*	*	H	α-helix	trans	-76.5	-35.2	171.6	-81.9	-177.4	176	175.1	0	112.9	I309 L310 Q317	I309-K313 PolarHBondContact O-N 3.16Å; L310-K313 PolarHBondContact O-N 3.07Å; K313-Q317 PolarHBondContact O-N 3.35Å
314	L	27.9	Very low	29.8	Very low	96 Å²	96	121.9 Å²	121.9	50%	0.503	62%	0.622	S	S	.	*	H	α-helix	trans	-74.4	-33.7	176.2	-134.8	79.3	0	0	0	112.4	L310 N316 I318	L310-L314 WeakPolarHBondContact O-CB 3.12Å; L310-L314 PolarHBondContact O-N 3.03Å; L314-N316 VanDerWaalsContact C-N 3.29Å; L314-N316 PolarHBondContact O-N 3.41Å; L314-I318 HydrophobicContact CG-CD1 4.36Å; L314-I318 PolarHBondContact O-N 3.05Å
315	S	29.7	Very low	30.1	Very low	55 Å²	55	122 Å²	122	39%	0.385	62%	0.617	S	S	.	*	H	α-helix	trans	-70.7	-25.2	175	71.2	0	0	0	0	113.4	N311 E312 N319	N311-S315 VanDerWaalsContact O-CB 3.28Å; N311-S315 WeakPolarHBondContact O-CB 3.34Å; N311-S315 PolarHBondContact O-N 3.15Å; N311-S315 PolarHBondContact O-OG 3.11Å; E312-S315 PolarHBondContact O-OG 3.33Å; S315-N319 PolarHBondContact O-ND2 2.71Å; S315-N319 VanDerWaalsContact O-ND2 3.12Å
316	N	32.1	Very low	30.3	Very low	116 Å²	116	118.4 Å²	118.4	62%	0.62	60%	0.604	S	S	*	*	H	α-helix	trans	-87.4	-23.7	178.3	-74.6	-22.1	0	0	0	113.7	E312 L314	E312-N316 WeakPolarHBondContact O-CB 3.31Å; E312-N316 VanDerWaalsContact O-CG 3.3Å; E312-N316 PolarHBondContact O-N 2.9Å; E312-N316 PolarHBondContact O-ND2 2.82Å; E312-N316 VanDerWaalsContact O-ND2 3.13Å; L314-N316 VanDerWaalsContact C-N 3.29Å; L314-N316 PolarHBondContact O-N 3.41Å
317	Q	29.8	Very low	30.5	Very low	154 Å²	154	120.7 Å²	120.7	72%	0.72	60%	0.603	S	S	*	*	H	α-helix	trans	-85.3	-29.6	175.2	-83.7	-174.1	-30.4	0	0	114.1	K313	K313-Q317 PolarHBondContact O-N 3.35Å
318	I	30.8	Very low	31.1	Very low	117 Å²	117	115.2 Å²	115.2	60%	0.6	59%	0.591	S	S	*	*	H	α-helix	trans	-81.3	-17.1	-178.9	-64.5	175.1	0	0	0	112.7	L314	L314-I318 HydrophobicContact CG-CD1 4.36Å; L314-I318 PolarHBondContact O-N 3.05Å
319	N	31.9	Very low	31.1	Very low	103 Å²	103	114.5 Å²	114.5	55%	0.551	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-0.5	-178.2	-77.9	-42.1	0	0	0	115.7	S315	S315-N319 PolarHBondContact O-ND2 2.71Å; S315-N319 VanDerWaalsContact O-ND2 3.12Å
320	G	32.4	Very low	31	Very low	43 Å²	43	115 Å²	115	44%	0.443	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.7	-52.7	-177.3	0	0	0	0	0	114.7
321	E	33.2	Very low	31.3	Very low	158 Å²	158	115.8 Å²	115.8	74%	0.738	58%	0.583	S	S	*	*	H	α-helix	trans	-87	-32.8	-164.8	-70.9	-175.2	158.6	0	0	114.1	R323 S324	E321-R323 VanDerWaalsContact C-N 3.35Å; E321-R323 PolarHBondContact O-N 2.79Å; E321-S324 PolarHBondContact O-OG 3.44Å; E321-S324 VanDerWaalsContact O-OG 3.05Å
322	N	31.7	Very low	31.6	Very low	123 Å²	123	114.6 Å²	114.6	66%	0.658	58%	0.579	S	S	*	*	H	α-helix	trans	-76.9	-21.8	177.7	-77.5	-25.9	0	0	0	113.2	L326	N322-L326 WeakPolarHBondContact O-CB 3.4Å; N322-L326 WeakPolarHBondContact O-CD1 3.37Å; N322-L326 PolarHBondContact O-N 3.08Å
323	R	30.2	Very low	31.5	Very low	168 Å²	168	114.3 Å²	114.3	63%	0.634	58%	0.581	S	S	*	*	H	α-helix	trans	-81	-28	175.2	-94.6	-175.5	174.3	-178	0.4	113.4	E321 R327	E321-R323 VanDerWaalsContact C-N 3.35Å; E321-R323 PolarHBondContact O-N 2.79Å; R323-R327 VanDerWaalsContact O-CB 3.25Å; R323-R327 WeakPolarHBondContact O-CB 3.29Å; R323-R327 PolarHBondContact O-N 2.86Å
324	S	35.9	Very low	31.7	Very low	63 Å²	63	111.6 Å²	111.6	44%	0.441	57%	0.574	S	S	.	*	H	α-helix	trans	-70.7	-43.1	177.6	64.1	0	0	0	0	110.9	E321 R327 T328	E321-S324 PolarHBondContact O-OG 3.44Å; E321-S324 VanDerWaalsContact O-OG 3.05Å; S324-R327 PolarHBondContact O-N 3.42Å; S324-T328 PolarHBondContact O-N 2.99Å; S324-T328 PolarHBondContact O-OG1 3.49Å
325	H	29.5	Very low	32	Very low	147 Å²	147	111.6 Å²	111.6	68%	0.681	57%	0.574	S	S	*	*	H	α-helix	trans	-68.3	-39.1	177.7	-96.8	-47.7	0	0	0	113.6	T328 T329	H325-T328 PolarHBondContact O-N 3.08Å; H325-T329 PolarHBondContact O-N 3.07Å; H325-T329 VanDerWaalsContact O-N 3.1Å; H325-T329 PolarHBondContact O-OG1 2.83Å
326	L	30.4	Very low	32	Very low	111 Å²	111	115.9 Å²	115.9	58%	0.581	59%	0.592	S	S	*	*	H	α-helix	trans	-71	-34.2	174.5	-77.3	166.8	0	0	0	112.6	N322 T329 M330	N322-L326 WeakPolarHBondContact O-CB 3.4Å; N322-L326 WeakPolarHBondContact O-CD1 3.37Å; N322-L326 PolarHBondContact O-N 3.08Å; L326-T329 PolarHBondContact O-OG1 3.26Å; L326-M330 VanDerWaalsContact O-CB 3.29Å; L326-M330 WeakPolarHBondContact O-CB 3.34Å; L326-M330 PolarHBondContact O-N 3.48Å
327	R	32.5	Very low	31.9	Very low	173 Å²	173	114.6 Å²	114.6	65%	0.653	59%	0.592	S	S	*	*	H	α-helix	trans	-70.4	-31.8	171.7	-91.5	-176.1	171.8	170.7	-2.2	112.7	R323 S324 K331	R323-R327 VanDerWaalsContact O-CB 3.25Å; R323-R327 WeakPolarHBondContact O-CB 3.29Å; R323-R327 PolarHBondContact O-N 2.86Å; S324-R327 PolarHBondContact O-N 3.42Å; R327-K331 WeakPolarHBondContact O-CA 3.4Å; R327-K331 WeakPolarHBondContact O-CB 3.31Å; R327-K331 VanDerWaalsContact O-CG 3.28Å; R327-K331 WeakPolarHBondContact O-CG 3.3Å; R327-K331 PolarHBondContact O-N 2.89Å
328	T	36.9	Very low	31.9	Very low	88 Å²	88	115.2 Å²	115.2	54%	0.54	60%	0.595	S	S	.	*	H	α-helix	trans	-71.2	-40.2	176.3	-52.3	0	0	0	0	110.8	S324 H325 V332	S324-T328 PolarHBondContact O-N 2.99Å; S324-T328 PolarHBondContact O-OG1 3.49Å; H325-T328 PolarHBondContact O-N 3.08Å; T328-V332 VanDerWaalsContact O-CG2 3.24Å; T328-V332 WeakPolarHBondContact O-CG2 3.18Å; T328-V332 PolarHBondContact O-N 2.91Å; T328-V332 VanDerWaalsContact O-N 3.13Å
329	T	29.5	Very low	31.7	Very low	85 Å²	85	115.6 Å²	115.6	52%	0.521	60%	0.599	S	S	.	*	H	α-helix	trans	-71.8	-39.4	175.3	25.4	0	0	0	0	112.9	H325 L326 V332 L333	H325-T329 PolarHBondContact O-N 3.07Å; H325-T329 VanDerWaalsContact O-N 3.1Å; H325-T329 PolarHBondContact O-OG1 2.83Å; L326-T329 PolarHBondContact O-OG1 3.26Å; T329-V332 PolarHBondContact O-N 2.85Å; T329-L333 PolarHBondContact O-N 2.84Å
330	M	29.7	Very low	31.4	Very low	110 Å²	110	120.2 Å²	120.2	54%	0.542	61%	0.614	S	S	.	*	H	α-helix	trans	-71.5	-35.6	173.7	-77.5	178.6	70.9	0	0	112.8	L326 V332 L333 D334	L326-M330 VanDerWaalsContact O-CB 3.29Å; L326-M330 WeakPolarHBondContact O-CB 3.34Å; L326-M330 PolarHBondContact O-N 3.48Å; M330-V332 VanDerWaalsContact C-N 3.27Å; M330-V332 PolarHBondContact O-N 2.83Å; M330-L333 CarbonylContact O-C 3.49Å; M330-L333 PolarHBondContact O-N 2.8Å; M330-L333 VanDerWaalsContact O-N 3.12Å; M330-D334 WeakPolarHBondContact O-CB 3.1Å; M330-D334 PolarHBondContact O-N 3.41Å
331	K	34	Very low	31	Very low	130 Å²	130	123.8 Å²	123.8	57%	0.565	63%	0.63	S	S	*	*	H	α-helix	trans	-65.9	-30.1	173.4	-83.3	-173.8	170.3	-170.9	0	112.5	R327 L333 N335	R327-K331 WeakPolarHBondContact O-CA 3.4Å; R327-K331 WeakPolarHBondContact O-CB 3.31Å; R327-K331 VanDerWaalsContact O-CG 3.28Å; R327-K331 WeakPolarHBondContact O-CG 3.3Å; R327-K331 PolarHBondContact O-N 2.89Å; K331-L333 VanDerWaalsContact C-N 3.32Å; K331-N335 WeakPolarHBondContact O-CB 3.38Å; K331-N335 PolarHBondContact O-N 3.17Å; K331-N335 PolarHBondContact O-ND2 2.85Å
332	V	34.7	Very low	30.6	Very low	91 Å²	91	124.3 Å²	124.3	55%	0.552	63%	0.633	S	S	*	*	H	α-helix	trans	-68.7	-34.3	173	171.4	0	0	0	0	111	T328 T329 M330 L336	T328-V332 VanDerWaalsContact O-CG2 3.24Å; T328-V332 WeakPolarHBondContact O-CG2 3.18Å; T328-V332 PolarHBondContact O-N 2.91Å; T328-V332 VanDerWaalsContact O-N 3.13Å; T329-V332 PolarHBondContact O-N 2.85Å; M330-V332 VanDerWaalsContact C-N 3.27Å; M330-V332 PolarHBondContact O-N 2.83Å; V332-L336 WeakPolarHBondContact O-CD1 3.42Å; V332-L336 WeakPolarHBondContact O-CG 3.47Å
333	L	30.7	Very low	30.3	Very low	120 Å²	120	124 Å²	124	63%	0.628	64%	0.635	S	S	*	*	H	α-helix	trans	-80.7	-37.7	177.2	-76	162.3	0	0	0	113.3	T329 M330 K331 L336	T329-L333 PolarHBondContact O-N 2.84Å; M330-L333 CarbonylContact O-C 3.49Å; M330-L333 PolarHBondContact O-N 2.8Å; M330-L333 VanDerWaalsContact O-N 3.12Å; K331-L333 VanDerWaalsContact C-N 3.32Å; L333-L336 PolarHBondContact O-N 2.81Å
334	D	31.8	Very low	30	Very low	93 Å²	93	122.8 Å²	122.8	50%	0.497	64%	0.641	S	S	.	*	H	α-helix	trans	-76.3	-36.1	178.7	-73.6	-20.2	0	0	0	111.8	M330 L336 S337 E338	M330-D334 WeakPolarHBondContact O-CB 3.1Å; M330-D334 PolarHBondContact O-N 3.41Å; D334-L336 PolarHBondContact O-N 3.29Å; D334-S337 PolarHBondContact O-N 2.75Å; D334-S337 PolarHBondContact O-OG 2.87Å; D334-E338 PolarHBondContact O-N 3.4Å
335	N	34.4	Very low	29.4	Very low	96 Å²	96	127 Å²	127	51%	0.513	66%	0.659	S	S	.	*	H	α-helix	trans	-67.5	-15.8	174.6	-75.5	-15.7	0	0	0	113.2	K331 S337	K331-N335 WeakPolarHBondContact O-CB 3.38Å; K331-N335 PolarHBondContact O-N 3.17Å; K331-N335 PolarHBondContact O-ND2 2.85Å; N335-S337 VanDerWaalsContact C-N 3.31Å
336	L	30.9	Very low	29.1	Very low	145 Å²	145	128.4 Å²	128.4	76%	0.759	67%	0.666	S	S	*	*	H	α-helix	trans	-80.6	-12.5	170.9	-75.3	168.7	0	0	0	112.8	V332 L333 D334	V332-L336 WeakPolarHBondContact O-CD1 3.42Å; V332-L336 WeakPolarHBondContact O-CG 3.47Å; L333-L336 PolarHBondContact O-N 2.81Å; D334-L336 PolarHBondContact O-N 3.29Å
337	S	29.7	Very low	28.9	Very low	89 Å²	89	133.1 Å²	133.1	62%	0.622	68%	0.682	S	S	*	*	H	α-helix	trans	-96.6	-23.6	178.9	75.1	0	0	0	0	114.5	D334 N335	D334-S337 PolarHBondContact O-N 2.75Å; D334-S337 PolarHBondContact O-OG 2.87Å; N335-S337 VanDerWaalsContact C-N 3.31Å
338	E	29.8	Very low	28.5	Very low	166 Å²	166	134 Å²	134	78%	0.776	69%	0.693	S	S	*	*	H	α-helix	trans	-119.3	-3.8	-173.8	-78.6	-168.3	158.8	0	0	117.5	D334 K340	D334-E338 PolarHBondContact O-N 3.4Å; E338-K340 PolarHBondContact O-N 2.9Å
339	N	25.1	Very low	28	Very low	126 Å²	126	138.5 Å²	138.5	67%	0.674	71%	0.708	S	S	*	*			trans	-82.6	84.5	171.4	-80.1	-21.9	0	0	0	111.8	C341	N339-C341 PolarHBondContact O-N 3.39Å
340	K	26.3	Very low	27.8	Very low	199 Å²	199	142.5 Å²	142.5	87%	0.865	73%	0.725	S	S	*	*			trans	-54.3	100.4	150.1	-76.9	178.5	177.1	173.5	0	107.9	E338 Q342	E338-K340 PolarHBondContact O-N 2.9Å; K340-Q342 PolarHBondContact O-N 2.92Å
341	C	23.2	Very low	27.4	Very low	118 Å²	118	145.7 Å²	145.7	80%	0.797	74%	0.741	S	S	*	*			trans	-57	99.2	170.2	-91.4	0	0	0	0	110.3	N339 V343	N339-C341 PolarHBondContact O-N 3.39Å; C341-V343 PolarHBondContact O-N 2.9Å
342	Q	25.1	Very low	27.2	Very low	170 Å²	170	144.9 Å²	144.9	79%	0.794	75%	0.749	S	S	*	*			trans	-67.7	110	144.8	-81.8	179	-25.1	0	0	106.7	K340 N344	K340-Q342 PolarHBondContact O-N 2.92Å; Q342-N344 VanDerWaalsContact C-N 3.3Å; Q342-N344 PolarHBondContact O-N 2.84Å
343	V	25	Very low	26.8	Very low	116 Å²	116	150 Å²	150	70%	0.703	77%	0.767	S	S	*	*			trans	-71.9	88.4	172.8	178.1	0	0	0	0	107.3	C341 N345	C341-V343 PolarHBondContact O-N 2.9Å; V343-N345 PolarHBondContact O-N 3.23Å
344	N	23.9	Very low	26.6	Very low	143 Å²	143	151.4 Å²	151.4	77%	0.765	78%	0.775	S	S	*	*			trans	-83.8	104.3	163.4	-93.8	-10.8	0	0	0	108.3	Q342 Q346	Q342-N344 VanDerWaalsContact C-N 3.3Å; Q342-N344 PolarHBondContact O-N 2.84Å; N344-Q346 PolarHBondContact O-N 3.09Å
345	N	24.3	Very low	26.2	Very low	150 Å²	150	154.6 Å²	154.6	80%	0.802	79%	0.792	S	S	*	*			trans	-64.3	93.4	167.1	-76.2	-34.1	0	0	0	109.4	V343	V343-N345 PolarHBondContact O-N 3.23Å
346	Q	23.4	Very low	25.7	Very low	178 Å²	178	157.3 Å²	157.3	83%	0.832	81%	0.806	S	S	*	*			trans	-132.2	121.8	157.3	-70.4	-166.6	-7.2	0	0	109.7	N344 E348	N344-Q346 PolarHBondContact O-N 3.09Å; Q346-E348 PolarHBondContact O-N 3.39Å
347	K	26.4	Very low	25.4	Very low	210 Å²	210	158.1 Å²	158.1	91%	0.913	81%	0.809	S	S	*	*			trans	-56.6	114.9	-179.7	-70.3	169.2	171.4	176.8	0	109.5	E349	K347-E349 PolarHBondContact O-N 3.23Å
348	E	23.8	Very low	25.2	Very low	190 Å²	190	157 Å²	157	89%	0.888	81%	0.812	S	S	*	*			trans	-77.3	108.9	169.2	-76.9	180	152	0	0	109.6	Q346	Q346-E348 PolarHBondContact O-N 3.39Å
349	E	25.4	Very low	25	Very low	184 Å²	184	156.8 Å²	156.8	86%	0.86	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-69.9	133.6	159.9	-82.6	177.5	148.5	0	0	109.8	K347	K347-E349 PolarHBondContact O-N 3.23Å
350	L	26.5	Very low	25.1	Very low	169 Å²	169	158 Å²	158	89%	0.885	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-63.1	132.1	-176.3	-74.7	97.5	0	0	0	112.8
351	M	21.8	Very low	25	Very low	176 Å²	176	152.8 Å²	152.8	87%	0.867	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-68.7	133.3	166.4	-76	-85	117.6	0	0	110.9
352	P	27.9	Very low	24.9	Very low	114 Å²	114	157.3 Å²	157.3	74%	0.74	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-87.9	118.6	-178.9	33.1	-29.5	0	0	0	111
353	E	26.3	Very low	24.9	Very low	197 Å²	197	157.1 Å²	157.1	92%	0.921	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-83	137.7	166.7	-87.3	-169.8	159.7	0	0	111.6	N355	E353-N355 PolarHBondContact O-N 3.34Å
354	N	26.5	Very low	24.9	Very low	151 Å²	151	158.4 Å²	158.4	81%	0.807	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-61.5	119.1	-169.6	-70.7	-53.2	0	0	0	114.3	L356	N354-L356 PolarHBondContact O-N 2.96Å
355	N	24.6	Very low	25	Very low	159 Å²	159	154.9 Å²	154.9	85%	0.85	82%	0.822	S	S	*	*			trans	-0.2	104.1	135.1	-71.2	-25.7	0	0	0	115.8	E353	E353-N355 PolarHBondContact O-N 3.34Å
356	L	23	Very low	24.9	Very low	154 Å²	154	156.7 Å²	156.7	81%	0.806	83%	0.825	S	S	*	*			trans	-146.1	121.6	150.3	-104.4	156.8	0	0	0	109.1	N354	N354-L356 PolarHBondContact O-N 2.96Å
357	I	24.9	Very low	25.1	Very low	161 Å²	161	156.1 Å²	156.1	83%	0.826	83%	0.826	S	S	*	*	S	Bend	trans	96.3	112.4	153.5	-52.4	156.3	0	0	0	116.3
358	G	26.3	Very low	25	Very low	67 Å²	67	153.3 Å²	153.3	69%	0.691	82%	0.821	S	S	*	*			trans	105.4	80	130.5	0	0	0	0	0	115.6	D360	G358-D360 PolarHBondContact O-N 2.94Å
359	N	24.9	Very low	25.2	Very low	161 Å²	161	148.1 Å²	148.1	86%	0.861	82%	0.819	S	S	*	*			trans	-50.7	119.3	148	-76.6	-24.9	0	0	0	108.7
360	D	27	Very low	25.3	Very low	152 Å²	152	148 Å²	148	81%	0.813	82%	0.818	S	S	*	*			trans	-161	88.5	139.9	-91.4	-23.6	0	0	0	109.1	G358	G358-D360 PolarHBondContact O-N 2.94Å
361	S	24.3	Very low	25.2	Very low	88 Å²	88	145.3 Å²	145.3	62%	0.615	81%	0.814	S	S	*	*			trans	12.5	122.4	135.2	46.6	0	0	0	0	119.6
362	Y	22.3	Very low	25.3	Very low	214 Å²	214	148.2 Å²	148.2	84%	0.839	82%	0.815	S	S	*	*				60.1	110.9	125.7	-70.4	-82.2	0	0	0	119
363	L	23.7	Very low	25.2	Very low	165 Å²	165	151.6 Å²	151.6	86%	0.864	82%	0.821	S	S	*	*				162	130.2	111	-91.5	148.2	0	0	0	109.6
364	V	26.5	Very low	25.2	Very low	144 Å²	144	148.6 Å²	148.6	87%	0.873	82%	0.815	S	S	*	*			trans	147.5	97.1	147.9	176.3	0	0	0	0	103.9
365	G	25.5	Very low	25.3	Very low	68 Å²	68	145.9 Å²	145.9	70%	0.701	81%	0.808	S	S	*	*				105.8	65.8	57.8	0	0	0	0	0	107.8
366	E	22.7	Very low	25.3	Very low	189 Å²	189	146.2 Å²	146.2	88%	0.883	81%	0.81	S	S	*	*			trans	-72.4	130.7	168.3	-76.6	178.5	146.4	0	0	109.7
367	I	26.6	Very low	25.6	Very low	165 Å²	165	144.6 Å²	144.6	85%	0.846	81%	0.807	S	S	*	*			trans	-121.4	97.9	164.2	-64.7	179.1	0	0	0	107.6
368	N	25.4	Very low	25.7	Very low	151 Å²	151	143.6 Å²	143.6	81%	0.807	80%	0.803	S	S	*	*			trans	6.5	122.8	141.6	-63.6	-23.1	0	0	0	118.5
369	G	27.9	Very low	25.6	Very low	81 Å²	81	145.1 Å²	145.1	84%	0.835	80%	0.803	S	S	*	*			trans	-129.6	104.7	160	0	0	0	0	0	109.8
370	E	26.7	Very low	25.6	Very low	183 Å²	183	143.1 Å²	143.1	86%	0.855	80%	0.797	S	S	*	*			trans	-44.6	121.9	-172.6	-66.8	169	157.1	0	0	117.1
371	S	23.4	Very low	25.6	Very low	112 Å²	112	145 Å²	145	78%	0.783	80%	0.801	S	S	*	*			trans	-77.4	119.3	153.7	40.3	0	0	0	0	110.2
372	R	25.2	Very low	25.6	Very low	237 Å²	237	146.6 Å²	146.6	89%	0.894	81%	0.812	S	S	*	*			trans	-99.9	108.9	166.5	-103.8	-179.4	176.1	160.5	1.6	109.8
373	E	24.6	Very low	25.7	Very low	184 Å²	184	144.2 Å²	144.2	86%	0.86	81%	0.814	S	S	*	*			trans	-65.7	135.8	169.9	-62.9	170.6	148.9	0	0	110.8
374	V	28	Very low	25.8	Very low	134 Å²	134	145.5 Å²	145.5	81%	0.812	82%	0.815	S	S	*	*			trans	-117.4	93.4	157.5	178.7	0	0	0	0	107
375	S	27.2	Very low	25.7	Very low	94 Å²	94	148.3 Å²	148.3	66%	0.657	82%	0.816	S	S	*	*			trans	19.1	103.4	148.8	57.6	0	0	0	0	118.3
376	N	25.4	Very low	25.6	Very low	167 Å²	167	152.5 Å²	152.5	89%	0.893	82%	0.823	S	S	*	*			trans	-66.1	133.4	147.9	-76.3	-35.8	0	0	0	110
377	T	28.2	Very low	25.8	Very low	119 Å²	119	152.2 Å²	152.2	73%	0.73	82%	0.821	S	S	*	*			trans	-129	109.6	162.2	50.6	0	0	0	0	109.2
378	D	27.5	Very low	25.8	Very low	141 Å²	141	151 Å²	151	75%	0.754	82%	0.822	S	S	*	*			trans	67.2	105.3	134.2	-60.6	-15.1	0	0	0	120.8
379	S	24.6	Very low	25.7	Very low	99 Å²	99	152.7 Å²	152.7	69%	0.692	83%	0.825	S	S	*	*				41.9	125.8	117.6	71.5	0	0	0	0	117.4
380	T	25.6	Very low	25.6	Very low	118 Å²	118	158.5 Å²	158.5	72%	0.724	83%	0.827	S	S	*	*				-172.4	142.9	57.1	36.5	0	0	0	0	110.2
381	E	26	Very low	25.6	Very low	191 Å²	191	158.5 Å²	158.5	89%	0.893	83%	0.827	S	S	*	*			trans	55	99.5	145.2	-64.6	176.2	174.8	0	0	119
382	S	24.8	Very low	25.7	Very low	123 Å²	123	160.4 Å²	160.4	86%	0.86	83%	0.829	S	S	*	*			trans	-136.2	88.4	156.1	46.1	0	0	0	0	109.5
383	D	24.5	Very low	25.7	Very low	163 Å²	163	159.7 Å²	159.7	87%	0.872	83%	0.827	S	S	*	*			trans	-90	153.8	156	-85.2	-38.6	0	0	0	108.8
384	E	26.4	Very low	25.8	Very low	192 Å²	192	158.5 Å²	158.5	90%	0.897	83%	0.827	S	S	*	*			trans	90.4	65.5	178.1	-55.6	-167.1	159.2	0	0	117.4	N386	E384-N386 PolarHBondContact O-N 2.89Å
385	F	22.5	Very low	25.7	Very low	203 Å²	203	158.6 Å²	158.6	89%	0.89	83%	0.827	S	S	*	*			trans	-74.8	103.6	147.8	-116.4	-94.2	0	0	0	109.2
386	N	24	Very low	25.7	Very low	156 Å²	156	161.7 Å²	161.7	83%	0.834	84%	0.835	S	S	*	*			trans	-153.2	130.9	157.9	-103.9	-31.8	0	0	0	111.9	E384	E384-N386 PolarHBondContact O-N 2.89Å
387	Q	26.4	Very low	25.7	Very low	184 Å²	184	158.6 Å²	158.6	86%	0.86	83%	0.826	S	S	*	*			trans	89.8	74.5	169.5	-56.9	-176.5	6.8	0	0	117.7
388	T	26.8	Very low	25.4	Very low	139 Å²	139	164.7 Å²	164.7	85%	0.853	84%	0.836	S	S	*	*			trans	-65.6	135.3	152.6	29.6	0	0	0	0	112
389	E	24.9	Very low	25.1	Very low	186 Å²	186	162.5 Å²	162.5	87%	0.869	83%	0.832	S	S	*	*			trans	-67.7	150.6	-177	-66.3	172.6	134.6	0	0	113.8	E391	E389-E391 PolarHBondContact O-N 2.9Å
390	K	25.3	Very low	25.1	Very low	204 Å²	204	164.4 Å²	164.4	89%	0.887	83%	0.834	S	S	*	*			trans	-78.7	107.4	171.6	-70.2	169.8	175.1	171.7	0	109.1
391	E	26.7	Very low	25.2	Very low	183 Å²	183	167 Å²	167	86%	0.855	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-80.8	121.2	168.4	-72.2	-173.2	158.8	0	0	110.9	E389	E389-E391 PolarHBondContact O-N 2.9Å
392	N	25.9	Very low	25	Very low	152 Å²	152	166.7 Å²	166.7	81%	0.813	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-67.7	130.9	176.3	-84.4	-40.5	0	0	0	111	N394	N392-N394 PolarHBondContact O-N 3.03Å
393	Y	25.4	Very low	24.9	Very low	222 Å²	222	169.8 Å²	169.8	87%	0.871	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-62.7	118.5	171.7	-80.3	-101	0	0	0	111.2	V395	Y393-V395 PolarHBondContact O-N 2.61Å
394	N	25.7	Very low	25	Very low	159 Å²	159	171.3 Å²	171.3	85%	0.85	84%	0.837	S	S	*	*			trans	-65.4	108.3	171.7	-80.8	-35.5	0	0	0	111.1	N392 I396	N392-N394 PolarHBondContact O-N 3.03Å; N394-I396 PolarHBondContact O-N 3.23Å
395	V	27.2	Very low	24.8	Very low	135 Å²	135	168.5 Å²	168.5	82%	0.818	83%	0.828	S	S	*	*			trans	-78.3	107.4	166.8	175.2	0	0	0	0	107.9	Y393 S397	Y393-V395 PolarHBondContact O-N 2.61Å; V395-S397 PolarHBondContact O-N 3.45Å
396	I	25.3	Very low	24.9	Very low	159 Å²	159	165.3 Å²	165.3	82%	0.815	82%	0.82	S	S	*	*			trans	-68	110.3	176.1	-64.9	169.6	0	0	0	108.7	N394	N394-I396 PolarHBondContact O-N 3.23Å
397	S	25.9	Very low	24.9	Very low	102 Å²	102	162.7 Å²	162.7	71%	0.713	81%	0.814	S	S	*	*			trans	-72.4	126.3	175.4	40.7	0	0	0	0	111.3	V395	V395-S397 PolarHBondContact O-N 3.45Å
398	R	22.2	Very low	24.7	Very low	248 Å²	248	162.7 Å²	162.7	94%	0.936	81%	0.814	S	S	*	*			trans	-79.7	117.2	167.2	-76.8	175.1	168.5	169.1	-4.2	109.4
399	S	22	Very low	24.8	Very low	95 Å²	95	164.5 Å²	164.5	66%	0.664	82%	0.817	S	S	*	*			trans	-160.4	134.6	156.2	51.8	0	0	0	0	110.8
400	D	24.3	Very low	24.7	Very low	139 Å²	139	160.5 Å²	160.5	74%	0.743	81%	0.809	S	S	*	*			trans	73.2	91.7	157.4	-54.1	-28.5	0	0	0	118.9
401	N	27.2	Very low	24.6	Very low	173 Å²	173	159.8 Å²	159.8	93%	0.925	81%	0.809	S	S	*	*			trans	-139.7	88.1	138.8	-90	-31.4	0	0	0	109.2
402	K	22.7	Very low	24.6	Very low	184 Å²	184	154.5 Å²	154.5	80%	0.8	80%	0.804	S	S	*	*			trans	-75.3	134.4	153	-77	174.8	172.8	174.3	0	107.6
403	F	22.1	Very low	24.8	Very low	188 Å²	188	153 Å²	153	83%	0.825	80%	0.802	S	S	*	*			trans	162.6	142.1	134.2	-98.4	-78.5	0	0	0	111.5
404	F	27.4	Very low	24.6	Very low	194 Å²	194	151 Å²	151	85%	0.851	80%	0.801	S	S	*	*			trans	76.9	89.6	-175.4	-64.4	-79.8	0	0	0	114.3
405	N	21.6	Very low	24.7	Very low	134 Å²	134	150.6 Å²	150.6	72%	0.717	80%	0.799	S	S	*	*			cis	71.6	127.1	48.9	-124.7	53.2	0	0	0	114.4
406	D	24.2	Very low	24.5	Very low	136 Å²	136	149.1 Å²	149.1	73%	0.727	80%	0.795	S	S	*	*			trans	77.9	128.4	164	-45.9	-35.2	0	0	0	115.8
407	S	23.4	Very low	24.5	Very low	101 Å²	101	146.7 Å²	146.7	71%	0.706	79%	0.792	S	S	*	*			cis	-166.7	138.3	22.2	27.9	0	0	0	0	110.2
408	E	23.5	Very low	24.5	Very low	183 Å²	183	151.1 Å²	151.1	86%	0.855	80%	0.801	S	S	*	*			trans	48.1	106.3	136.6	-59	178.1	164.4	0	0	120
409	I	27.4	Very low	24.5	Very low	178 Å²	178	150.2 Å²	150.2	91%	0.913	80%	0.798	S	S	*	*				-137.6	122.6	126.2	-61	-173.3	0	0	0	110
410	S	23.8	Very low	24.7	Very low	101 Å²	101	154.9 Å²	154.9	71%	0.706	81%	0.809	S	S	*	*			trans	-54.8	139.2	177	171.2	0	0	0	0	115.4
411	E	23.2	Very low	24.5	Very low	189 Å²	189	154.1 Å²	154.1	88%	0.883	81%	0.813	S	S	*	*			trans	-1	138.9	145.5	-61.4	-179.8	158.1	0	0	119.7
412	G	26.8	Very low	24.5	Very low	73 Å²	73	152.5 Å²	152.5	75%	0.753	81%	0.809	S	S	*	*			trans	173.7	107.6	158.1	0	0	0	0	0	112.6
413	P	29.2	Very low	24.7	Very low	120 Å²	120	147.3 Å²	147.3	78%	0.779	81%	0.808	S	S	*	*			trans	-94.9	149.8	-158.5	36	-32.8	0	0	0	114.7
414	Q	22.6	Very low	24.9	Very low	181 Å²	181	147.2 Å²	147.2	85%	0.846	81%	0.811	S	S	*	*			trans	29.2	112.2	136.9	-62.5	-179.5	-26	0	0	117.7
415	D	25.9	Very low	24.9	Very low	150 Å²	150	147.4 Å²	147.4	80%	0.802	81%	0.814	S	S	*	*				-155.6	113.1	117.2	-117.7	-28	0	0	0	113.8
416	S	24.4	Very low	25.1	Very low	104 Å²	104	148 Å²	148	73%	0.727	81%	0.814	S	S	*	*			trans	26.8	92.6	137.9	57.3	0	0	0	0	119.9
417	S	25.6	Very low	25.3	Very low	108 Å²	108	145.2 Å²	145.2	76%	0.755	81%	0.805	S	S	*	*			trans	-142	103.2	141.1	69.7	0	0	0	0	109.7	R419	S417-R419 PolarHBondContact O-N 3.47Å
418	E	24.5	Very low	25.8	Very low	194 Å²	194	144.4 Å²	144.4	91%	0.907	80%	0.796	S	S	*	*			trans	-57	99.5	175.7	-68	174.6	145	0	0	110.9
419	R	23	Very low	26.1	Very low	230 Å²	230	137.8 Å²	137.8	87%	0.868	78%	0.777	S	S	*	*			trans	-114.9	94.6	152.3	-74.5	-173.2	-177	-178.8	2.5	106.5	S417 C421	S417-R419 PolarHBondContact O-N 3.47Å; R419-C421 PolarHBondContact O-N 3.17Å
420	Q	25.1	Very low	26.4	Very low	193 Å²	193	134.4 Å²	134.4	90%	0.902	76%	0.757	S	S	*	*			trans	-59.8	110.8	169.5	-81.3	179.4	-13.5	0	0	108.5	T422	Q420-T422 PolarHBondContact O-N 3Å
421	C	21.3	Very low	26.8	Very low	123 Å²	123	136.8 Å²	136.8	83%	0.831	75%	0.752	S	S	*	*			trans	-53.4	125.4	176.1	-83.9	0	0	0	0	111.3	R419 G423	R419-C421 PolarHBondContact O-N 3.17Å; C421-G423 PolarHBondContact O-N 2.88Å
422	T	26.8	Very low	27.1	Very low	138 Å²	138	132.4 Å²	132.4	85%	0.847	73%	0.734	S	S	*	*			trans	-49.8	112.6	160.5	46.3	0	0	0	0	110.7	Q420 Q424	Q420-T422 PolarHBondContact O-N 3Å; T422-Q424 PolarHBondContact O-N 2.79Å
423	G	26.8	Very low	27.4	Very low	75 Å²	75	133.3 Å²	133.3	77%	0.773	73%	0.725	S	S	*	*			trans	-64.9	119.6	175.6	0	0	0	0	0	112.1	C421	C421-G423 PolarHBondContact O-N 2.88Å
424	Q	26.8	Very low	27.5	Very low	187 Å²	187	131.4 Å²	131.4	87%	0.874	71%	0.714	S	S	*	*			trans	11.6	109.2	154.6	-70.7	170.9	-17.5	0	0	117.2	T422 M426	T422-Q424 PolarHBondContact O-N 2.79Å; Q424-M426 PolarHBondContact O-N 3.16Å; Q424-M426 VanDerWaalsContact O-N 3.09Å
425	Q	26.7	Very low	27.9	Very low	198 Å²	198	127.8 Å²	127.8	93%	0.925	70%	0.697	S	S	*	*			trans	-61.6	106.3	166	-73.2	178	-21.6	0	0	110.1	S427	Q425-S427 PolarHBondContact O-N 3.28Å
426	M	26.2	Very low	28	Very low	147 Å²	147	126 Å²	126	72%	0.724	69%	0.687	S	S	*	*			trans	-54.2	128.5	164.7	-72.1	-95.8	-67.9	0	0	109.7	Q424 E430	Q424-M426 PolarHBondContact O-N 3.16Å; Q424-M426 VanDerWaalsContact O-N 3.09Å; M426-E430 HydrophobicContact CE-CB 4.32Å
427	S	29	Very low	28.3	Very low	76 Å²	76	124.3 Å²	124.3	53%	0.531	68%	0.675	S	S	.	*			trans	-68.3	142.9	-177.8	87.9	0	0	0	0	111	Q425 G429 E430	Q425-S427 PolarHBondContact O-N 3.28Å; S427-G429 PolarHBondContact O-N 2.85Å; S427-E430 PolarHBondContact O-N 2.9Å
428	T	32.7	Very low	28.6	Very low	85 Å²	85	122.5 Å²	122.5	52%	0.521	67%	0.667	S	S	.	*	H	α-helix	trans	-59.3	-15.5	-172.7	48.3	0	0	0	0	114.8	M141 L432	M141-T428 VanDerWaalsContact CE-CB 3.43Å; M141-T428 HydrophobicContact CE-CG2 3.71Å; M141-T428 WeakPolarHBondContact CE-OG1 3.42Å; T428-L432 PolarHBondContact O-N 2.88Å
429	G	30.6	Very low	28.8	Very low	43 Å²	43	121.7 Å²	121.7	44%	0.443	66%	0.661	S	S	.	*	H	α-helix	trans	-69.9	-33.7	173.9	0	0	0	0	0	113.9	S427 T433	S427-G429 PolarHBondContact O-N 2.85Å; G429-T433 PolarHBondContact O-N 3.26Å; G429-T433 PolarHBondContact O-OG1 3.3Å
430	E	33.4	Very low	29	Very low	108 Å²	108	119.7 Å²	119.7	51%	0.505	66%	0.655	S	S	.	*	H	α-helix	trans	-78.9	-29.6	-179.8	-71.3	179.7	152.2	0	0	112.1	M426 S427 T433 S434	M426-E430 HydrophobicContact CE-CB 4.32Å; S427-E430 PolarHBondContact O-N 2.9Å; E430-T433 WeakPolarHBondContact CA-OG1 3.39Å; E430-T433 PolarHBondContact O-OG1 3.38Å; E430-S434 WeakPolarHBondContact O-CB 3.48Å; E430-S434 PolarHBondContact O-N 3.01Å
431	Y	31.3	Very low	29	Very low	151 Å²	151	117.9 Å²	117.9	59%	0.592	65%	0.646	S	S	*	*	H	α-helix	trans	-67.2	-39.3	173.1	-172.4	-101	0	0	0	112.2	S434 Q435	Y431-S434 PolarHBondContact O-N 3.17Å; Y431-Q435 HydrophobicContact CE1-CG 4.15Å; Y431-Q435 PolarHBondContact O-N 3.49Å; Y431-Q435 PolarHBondContact OH-NE2 3.33Å
432	L	29.4	Very low	29.2	Very low	96 Å²	96	116.8 Å²	116.8	50%	0.503	64%	0.64	S	S	.	*	H	α-helix	trans	-73	-34.9	179.4	-73.8	171	0	0	0	112.8	T428 Q435 L436	T428-L432 PolarHBondContact O-N 2.88Å; L432-Q435 PolarHBondContact O-N 2.61Å; L432-L436 WeakPolarHBondContact O-CB 3.38Å; L432-L436 WeakPolarHBondContact O-CG 3.38Å; L432-L436 PolarHBondContact O-N 2.87Å
433	T	33.3	Very low	29.4	Very low	92 Å²	92	113.8 Å²	113.8	56%	0.564	62%	0.624	S	S	*	*	H	α-helix	trans	-69.6	-36.3	173.4	32.1	0	0	0	0	111.7	G429 E430 S437	G429-T433 PolarHBondContact O-N 3.26Å; G429-T433 PolarHBondContact O-OG1 3.3Å; E430-T433 WeakPolarHBondContact CA-OG1 3.39Å; E430-T433 PolarHBondContact O-OG1 3.38Å; T433-S437 WeakPolarHBondContact O-CB 3.38Å; T433-S437 PolarHBondContact O-N 3.14Å
434	S	32.9	Very low	29.5	Very low	80 Å²	80	118 Å²	118	56%	0.559	63%	0.628	S	S	*	*	H	α-helix	trans	-64.4	-42.6	172.2	-173.4	0	0	0	0	112.7	E430 Y431 A438	E430-S434 WeakPolarHBondContact O-CB 3.48Å; E430-S434 PolarHBondContact O-N 3.01Å; Y431-S434 PolarHBondContact O-N 3.17Å; S434-A438 PolarHBondContact O-N 2.94Å
435	Q	30.1	Very low	29.7	Very low	105 Å²	105	113.7 Å²	113.7	49%	0.491	61%	0.609	S	S	.	*	H	α-helix	trans	-73.1	-35.4	178.8	-74.6	-140.6	-8.5	0	0	114.2	Y431 L432 A438 K439	Y431-Q435 HydrophobicContact CE1-CG 4.15Å; Y431-Q435 PolarHBondContact O-N 3.49Å; Y431-Q435 PolarHBondContact OH-NE2 3.33Å; L432-Q435 PolarHBondContact O-N 2.61Å; Q435-A438 PolarHBondContact O-N 3Å; Q435-K439 PolarHBondContact O-N 2.66Å; Q435-K439 VanDerWaalsContact O-N 3.15Å
436	L	28.6	Very low	29.7	Very low	112 Å²	112	111.1 Å²	111.1	59%	0.586	60%	0.601	S	S	*	*	H	α-helix	trans	-71.7	-33.4	175.3	-73.9	168.3	0	0	0	111.7	L432 A438 K439	L432-L436 WeakPolarHBondContact O-CB 3.38Å; L432-L436 WeakPolarHBondContact O-CG 3.38Å; L432-L436 PolarHBondContact O-N 2.87Å; L436-A438 VanDerWaalsContact C-N 3.34Å; L436-K439 PolarHBondContact O-N 2.91Å
437	S	30.8	Very low	29.7	Very low	69 Å²	69	112.8 Å²	112.8	48%	0.483	61%	0.607	S	S	.	*	H	α-helix	trans	-62.4	-39.8	169.4	178	0	0	0	0	111.9	T433	T433-S437 WeakPolarHBondContact O-CB 3.38Å; T433-S437 PolarHBondContact O-N 3.14Å
438	A	30.3	Very low	29.7	Very low	70 Å²	70	116 Å²	116	58%	0.579	62%	0.618	S	S	*	*	H	α-helix	trans	-72	-28.2	179.8	0	0	0	0	0	113.3	S434 Q435 L436	S434-A438 PolarHBondContact O-N 2.94Å; Q435-A438 PolarHBondContact O-N 3Å; L436-A438 VanDerWaalsContact C-N 3.34Å
439	K	30.6	Very low	29.4	Very low	178 Å²	178	117.9 Å²	117.9	77%	0.774	63%	0.632	S	S	*	*	H	α-helix	trans	-81.4	-17	-174.9	-141.2	178	-175	-174.8	0	114.6	Q435 L436	Q435-K439 PolarHBondContact O-N 2.66Å; Q435-K439 VanDerWaalsContact O-N 3.15Å; L436-K439 PolarHBondContact O-N 2.91Å
440	Y	25.8	Very low	29.3	Very low	188 Å²	188	125.9 Å²	125.9	74%	0.737	65%	0.649	S	S	*	*	S	Bend	trans	-114.9	10.5	-178.9	-80.7	-78.8	0	0	0	114.5	S442	Y440-S442 PolarHBondContact O-N 3.4Å
441	Q	24.9	Very low	29	Very low	154 Å²	154	127.3 Å²	127.3	72%	0.72	67%	0.665	S	S	*	*			trans	-80.3	62.8	169	-82	-179	-20.5	0	0	111.7	S443	Q441-S443 VanDerWaalsContact C-N 3.29Å; Q441-S443 PolarHBondContact O-N 3.09Å; Q441-S443 VanDerWaalsContact O-N 3.16Å
442	S	25.3	Very low	28.7	Very low	101 Å²	101	129.7 Å²	129.7	71%	0.706	68%	0.679	S	S	*	*			trans	-77.8	86.4	155	44.5	0	0	0	0	108.7	Y440	Y440-S442 PolarHBondContact O-N 3.4Å
443	S	31.1	Very low	28.7	Very low	74 Å²	74	129.6 Å²	129.6	52%	0.517	69%	0.686	S	S	.	*			trans	13.4	113.6	144.1	53.6	0	0	0	0	119.1	Q441	Q441-S443 VanDerWaalsContact C-N 3.29Å; Q441-S443 PolarHBondContact O-N 3.09Å; Q441-S443 VanDerWaalsContact O-N 3.16Å
444	I	29.7	Very low	28.6	Very low	165 Å²	165	133.4 Å²	133.4	85%	0.846	70%	0.703	S	S	*	*			trans	-115.7	108.9	145.1	-66.8	174.6	0	0	0	105.9
445	I	30.3	Very low	28.5	Very low	95 Å²	95	133.6 Å²	133.6	49%	0.487	70%	0.704	S	S	.	*			trans	-85.6	131.9	-177.5	-69.6	173.5	0	0	0	109.3	Q447 A479	I445-Q447 PolarHBondContact O-N 2.85Å; I445-A479 HydrophobicContact CD1-CB 4.27Å
446	L	27.2	Very low	28.5	Very low	145 Å²	145	135.8 Å²	135.8	76%	0.759	72%	0.72	S	S	*	*			trans	-48.8	116.4	173.5	-67.9	143.6	0	0	0	112.4	F564	L446-F564 HydrophobicContact CD1-CZ 4.47Å
447	Q	27.2	Very low	28.6	Very low	181 Å²	181	137.3 Å²	137.3	85%	0.846	73%	0.727	S	S	*	*			trans	-112.9	134.5	150	-76.2	-169.1	-10.2	0	0	108.8	I445	I445-Q447 PolarHBondContact O-N 2.85Å
448	N	27.9	Very low	28.8	Very low	143 Å²	143	141.6 Å²	141.6	77%	0.765	74%	0.744	S	S	*	*			trans	-33.4	129	-174.8	-100.1	-38.3	0	0	0	113.6	R450	N448-R450 PolarHBondContact O-N 3.49Å
449	P	27.5	Very low	28.9	Very low	125 Å²	125	145.8 Å²	145.8	81%	0.812	76%	0.756	S	S	*	*			trans	-75.6	74.1	177.3	33.5	-32.9	0	0	0	109.2	T451	P449-T451 PolarHBondContact O-N 3.12Å
450	R	26.8	Very low	29.1	Very low	212 Å²	212	145.6 Å²	145.6	80%	0.8	76%	0.758	S	S	*	*			trans	-86.1	97.4	155.6	-76.2	-170.6	178.7	-178.3	0.1	106	N448 F452	N448-R450 PolarHBondContact O-N 3.49Å; R450-F452 PolarHBondContact O-N 2.87Å
451	T	28.1	Very low	29.8	Very low	137 Å²	137	144.2 Å²	144.2	84%	0.84	76%	0.763	S	S	*	*			trans	3.9	87.3	155.3	53.1	0	0	0	0	113.3	P449 S453	P449-T451 PolarHBondContact O-N 3.12Å; T451-S453 PolarHBondContact O-N 2.91Å
452	F	25.5	Very low	30.5	Very low	201 Å²	201	146.5 Å²	146.5	88%	0.882	77%	0.774	S	S	*	*			trans	-72.6	106.3	164.9	-85.3	-89	0	0	0	106.5	R450	R450-F452 PolarHBondContact O-N 2.87Å
453	S	29.5	Very low	31.5	Very low	94 Å²	94	148 Å²	148	66%	0.657	77%	0.774	S	S	*	*			trans	-78.1	130.9	160.1	50	0	0	0	0	108	T451 S455	T451-S453 PolarHBondContact O-N 2.91Å; S453-S455 PolarHBondContact O-N 2.79Å
454	D	30.5	Very low	32.3	Very low	173 Å²	173	147.3 Å²	147.3	93%	0.925	77%	0.769	S	S	*	*	S	Bend	trans	-67.1	32.6	-167.6	-101.5	-22.9	0	0	0	116.7
455	S	29.8	Very low	33.7	Very low	83 Å²	83	144 Å²	144	58%	0.58	76%	0.758	S	S	*	*			trans	-134.2	103.9	172.5	60.2	0	0	0	0	108.6	S453	S453-S455 PolarHBondContact O-N 2.79Å
456	D	30.2	Very low	35.3	Very low	152 Å²	152	145 Å²	145	81%	0.813	76%	0.764	S	S	*	*			trans	148.7	69.9	154.1	-70.1	-13.1	0	0	0	108.8
457	I	32.5	Very low	37.5	Very low	143 Å²	143	141.6 Å²	141.6	73%	0.733	75%	0.747	S	S	*	*			trans	-103.8	82.7	161.2	-58.3	176.7	0	0	0	105.8	L459	I457-L459 HydrophobicContact CG2-CD1 4.24Å; I457-L459 PolarHBondContact O-N 2.92Å; I457-L459 VanDerWaalsContact O-N 3.14Å
458	D	33.3	Very low	39.4	Very low	159 Å²	159	140.2 Å²	140.2	85%	0.85	74%	0.735	S	S	*	*			trans	-70.6	103.7	165.9	-88.2	-25.4	0	0	0	108.2	E460	D458-E460 VanDerWaalsContact C-N 3.29Å; D458-E460 PolarHBondContact O-N 3.45Å; D458-E460 VanDerWaalsContact O-N 3.08Å
459	L	32.7	Very low	41.6	Very low	158 Å²	158	137.4 Å²	137.4	83%	0.827	72%	0.719	S	S	*	*			trans	-82.8	61.7	-173.4	-160.9	88.9	0	0	0	111	I457	I457-L459 HydrophobicContact CG2-CD1 4.24Å; I457-L459 PolarHBondContact O-N 2.92Å; I457-L459 VanDerWaalsContact O-N 3.14Å
460	E	34.3	Very low	43.9	Very low	174 Å²	174	139.9 Å²	139.9	81%	0.813	71%	0.712	S	S	*	*			trans	-150.3	88.7	173.6	-104.1	178.2	-157.1	0	0	110.3	D458	D458-E460 VanDerWaalsContact C-N 3.29Å; D458-E460 PolarHBondContact O-N 3.45Å; D458-E460 VanDerWaalsContact O-N 3.08Å
461	N	40.9	Very low	46.5	Very low	159 Å²	159	135.3 Å²	135.3	85%	0.85	70%	0.7	S	S	*	*			trans	177.2	75.2	150.5	-87	-37.9	0	0	0	109.3	L463	N461-L463 PolarHBondContact O-N 2.87Å
462	E	40.4	Very low	48.7	Very low	202 Å²	202	132.4 Å²	132.4	94%	0.944	68%	0.679	S	S	*	*			trans	-67.4	95.9	172.2	-72.4	-172	157.6	0	0	110.2
463	L	45.6	Very low	51.4	Low	133 Å²	133	129.8 Å²	129.8	70%	0.696	67%	0.667	S	S	*	*			trans	-66.7	136.3	164.6	-92.2	119.1	0	0	0	110	N461 D467	N461-L463 PolarHBondContact O-N 2.87Å; L463-D467 HydrophobicContact CD2-CB 4.41Å
464	S	48.8	Very low	53.8	Low	60 Å²	60	128.3 Å²	128.3	42%	0.42	66%	0.661	S	S	.	*			trans	-50.5	132.6	179.5	175.5	0	0	0	0	111.4	N466 D467 Y468	S464-N466 PolarHBondContact O-N 3.11Å; S464-D467 PolarHBondContact O-N 3.37Å; S464-Y468 PolarHBondContact O-N 3.37Å
465	P	57.8	Low	56.3	Low	96 Å²	96	124 Å²	124	62%	0.623	64%	0.635	S	S	*	*	H	α-helix	trans	-51.5	-28.5	-177	-28.2	32.8	0	0	0	114.4	I469	P465-I469 WeakPolarHBondContact O-CD1 3.46Å; P465-I469 VanDerWaalsContact O-CG1 3.24Å; P465-I469 WeakPolarHBondContact O-CG1 3.4Å; P465-I469 PolarHBondContact O-N 2.8Å; P465-I469 VanDerWaalsContact O-N 3.1Å
466	N	64.1	Low	58.7	Low	115 Å²	115	124.2 Å²	124.2	62%	0.615	63%	0.629	S	S	*	*	H	α-helix	trans	-71.3	-31.7	178.9	-78.6	-44	0	0	0	113.8	S464 R470	S464-N466 PolarHBondContact O-N 3.11Å; N466-R470 PolarHBondContact O-N 2.82Å; N466-R470 VanDerWaalsContact O-N 3.14Å
467	D	73.6	Confident	61.3	Low	74 Å²	74	121.9 Å²	121.9	40%	0.396	61%	0.613	S	S	.	*	H	α-helix	trans	-77	-39	177.7	-68.2	-35.5	0	0	0	110.4	L463 S464 I469 R470 E471	L463-D467 HydrophobicContact CD2-CB 4.41Å; S464-D467 PolarHBondContact O-N 3.37Å; D467-I469 VanDerWaalsContact C-N 3.33Å; D467-I469 PolarHBondContact O-N 2.91Å; D467-R470 WeakPolarHBondContact O-CB 3.28Å; D467-R470 PolarHBondContact O-N 2.79Å; D467-E471 WeakPolarHBondContact O-CB 3.38Å; D467-E471 PolarHBondContact O-N 3.3Å
468	Y	67.4	Low	63.7	Low	152 Å²	152	118.8 Å²	118.8	60%	0.596	60%	0.604	S	S	*	*	H	α-helix	trans	-59.3	-42.9	172.3	-171.5	-109.3	0	0	0	112.2	S464 R470 E471 L472	S464-Y468 PolarHBondContact O-N 3.37Å; Y468-R470 VanDerWaalsContact C-N 3.31Å; Y468-R470 PolarHBondContact O-N 3.07Å; Y468-E471 PolarHBondContact O-N 3.34Å; Y468-L472 HydrophobicContact CD1-CD1 3.71Å; Y468-L472 HydrophobicContact CE1-CD1 3.38Å; Y468-L472 HydrophobicContact CE1-CG 4.29Å; Y468-L472 HydrophobicContact CG-CD1 4.47Å; Y468-L472 WeakPolarHBondContact O-CB 3.43Å; Y468-L472 WeakPolarHBondContact O-CG 3.37Å; Y468-L472 PolarHBondContact O-N 2.82Å
469	I	74.4	Confident	65.8	Low	83 Å²	83	113.2 Å²	113.2	43%	0.426	58%	0.58	S	S	.	*	H	α-helix	trans	-64.6	-35.5	174.5	-69.5	167.3	0	0	0	111.6	P465 D467 K473	P465-I469 WeakPolarHBondContact O-CD1 3.46Å; P465-I469 VanDerWaalsContact O-CG1 3.24Å; P465-I469 WeakPolarHBondContact O-CG1 3.4Å; P465-I469 PolarHBondContact O-N 2.8Å; P465-I469 VanDerWaalsContact O-N 3.1Å; D467-I469 VanDerWaalsContact C-N 3.33Å; D467-I469 PolarHBondContact O-N 2.91Å; I469-K473 HydrophobicContact CG2-CD 4.49Å; I469-K473 WeakPolarHBondContact O-CG 3.12Å; I469-K473 PolarHBondContact O-N 2.82Å; I469-K473 VanDerWaalsContact O-N 3.1Å
470	R	76.4	Confident	68.3	Low	178 Å²	178	109.6 Å²	109.6	67%	0.672	56%	0.561	S	S	*	*	H	α-helix	trans	-69.9	-43.9	178.9	-169.4	-177.2	-63.6	-175.4	4.2	111.5	N466 D467 Y468 K473 A474	N466-R470 PolarHBondContact O-N 2.82Å; N466-R470 VanDerWaalsContact O-N 3.14Å; D467-R470 WeakPolarHBondContact O-CB 3.28Å; D467-R470 PolarHBondContact O-N 2.79Å; Y468-R470 VanDerWaalsContact C-N 3.31Å; Y468-R470 PolarHBondContact O-N 3.07Å; R470-K473 PolarHBondContact O-N 2.79Å; R470-A474 PolarHBondContact O-N 2.87Å
471	E	80.2	Confident	70.7	Confident	116 Å²	116	105.8 Å²	105.8	54%	0.542	55%	0.546	S	S	.	.	H	α-helix	trans	-57.2	-50.3	174.1	-170.3	78	-150.7	0	0	110.6	D467 Y468 K473 A474 Q475	D467-E471 WeakPolarHBondContact O-CB 3.38Å; D467-E471 PolarHBondContact O-N 3.3Å; Y468-E471 PolarHBondContact O-N 3.34Å; E471-K473 VanDerWaalsContact C-N 3.32Å; E471-K473 PolarHBondContact O-N 2.88Å; E471-A474 PolarHBondContact O-N 2.96Å; E471-A474 VanDerWaalsContact O-N 3.13Å; E471-Q475 WeakPolarHBondContact O-CG 3.42Å; E471-Q475 PolarHBondContact O-N 2.94Å
472	L	75.5	Confident	72.7	Confident	76 Å²	76	107 Å²	107	40%	0.398	54%	0.539	S	S	.	.	H	α-helix	trans	-59.5	-39.9	178.1	-80.4	169	0	0	0	112.8	Y468 Q475 L476	Y468-L472 HydrophobicContact CD1-CD1 3.71Å; Y468-L472 HydrophobicContact CE1-CD1 3.38Å; Y468-L472 HydrophobicContact CE1-CG 4.29Å; Y468-L472 HydrophobicContact CG-CD1 4.47Å; Y468-L472 WeakPolarHBondContact O-CB 3.43Å; Y468-L472 WeakPolarHBondContact O-CG 3.37Å; Y468-L472 PolarHBondContact O-N 2.82Å; L472-Q475 PolarHBondContact O-N 2.89Å; L472-L476 WeakPolarHBondContact O-CB 3.47Å; L472-L476 PolarHBondContact O-N 2.78Å
473	K	81.4	Confident	74.6	Confident	146 Å²	146	101.2 Å²	101.2	64%	0.635	51%	0.512	S	S	*	.	H	α-helix	trans	-66.2	-40.1	175.6	-78.4	-178.4	179.5	-177.8	0	112.5	I469 R470 E471 L476 Q477	I469-K473 HydrophobicContact CG2-CD 4.49Å; I469-K473 WeakPolarHBondContact O-CG 3.12Å; I469-K473 PolarHBondContact O-N 2.82Å; I469-K473 VanDerWaalsContact O-N 3.1Å; R470-K473 PolarHBondContact O-N 2.79Å; E471-K473 VanDerWaalsContact C-N 3.32Å; E471-K473 PolarHBondContact O-N 2.88Å; K473-L476 PolarHBondContact O-N 3.32Å; K473-Q477 PolarHBondContact O-N 2.87Å; K473-Q477 VanDerWaalsContact O-N 3.08Å
474	A	80.8	Confident	76.3	Confident	63 Å²	63	97.7 Å²	97.7	52%	0.521	50%	0.502	S	S	.	.	H	α-helix	trans	-65.8	-40.9	177.3	0	0	0	0	0	111.6	R470 E471 Q477 S478	R470-A474 PolarHBondContact O-N 2.87Å; E471-A474 PolarHBondContact O-N 2.96Å; E471-A474 VanDerWaalsContact O-N 3.13Å; A474-Q477 PolarHBondContact O-N 3.36Å; A474-S478 PolarHBondContact O-N 3.33Å
475	Q	81.4	Confident	78	Confident	83 Å²	83	101.9 Å²	101.9	39%	0.388	51%	0.51	S	S	.	.	H	α-helix	trans	-65.6	-40.4	175.9	-69.3	179.8	10.1	0	0	112.1	E471 L472 Q477 S478 A479	E471-Q475 WeakPolarHBondContact O-CG 3.42Å; E471-Q475 PolarHBondContact O-N 2.94Å; L472-Q475 PolarHBondContact O-N 2.89Å; Q475-Q477 PolarHBondContact O-N 3.41Å; Q475-S478 PolarHBondContact O-N 2.78Å; Q475-A479 WeakPolarHBondContact O-CB 3.29Å; Q475-A479 PolarHBondContact O-N 3.36Å
476	L	82.2	Confident	79.2	Confident	86 Å²	86	101.1 Å²	101.1	45%	0.45	50%	0.5	S	S	.	.	H	α-helix	trans	-61	-44.3	175	-178.8	64.4	0	0	0	111.7	L472 K473 A479 L480	L472-L476 WeakPolarHBondContact O-CB 3.47Å; L472-L476 PolarHBondContact O-N 2.78Å; K473-L476 PolarHBondContact O-N 3.32Å; L476-A479 PolarHBondContact O-N 3.01Å; L476-L480 HydrophobicContact CG-CD1 4.28Å; L476-L480 WeakPolarHBondContact O-CG 3.48Å; L476-L480 PolarHBondContact O-N 2.92Å
477	Q	84.3	Confident	79.9	Confident	104 Å²	104	103.6 Å²	103.6	49%	0.486	50%	0.501	S	S	.	.	H	α-helix	trans	-63.1	-44.5	178.5	-170.2	60.7	45.5	0	0	111.5	K473 A474 Q475 A479 L480 D481	K473-Q477 PolarHBondContact O-N 2.87Å; K473-Q477 VanDerWaalsContact O-N 3.08Å; A474-Q477 PolarHBondContact O-N 3.36Å; Q475-Q477 PolarHBondContact O-N 3.41Å; Q477-A479 VanDerWaalsContact C-N 3.31Å; Q477-A479 PolarHBondContact O-N 2.93Å; Q477-L480 PolarHBondContact O-N 2.78Å; Q477-D481 PolarHBondContact NE2-OD1 3.21Å; Q477-D481 VanDerWaalsContact NE2-OD1 3.09Å; Q477-D481 VanDerWaalsContact O-CG 3.22Å; Q477-D481 PolarHBondContact O-N 3.47Å
478	S	82.6	Confident	80.3	Confident	78 Å²	78	105.9 Å²	105.9	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-60.7	-38.6	176.2	-176.8	0	0	0	0	112.8	A474 Q475 R482	A474-S478 PolarHBondContact O-N 3.33Å; Q475-S478 PolarHBondContact O-N 2.78Å; S478-R482 WeakPolarHBondContact O-CB 3.45Å; S478-R482 PolarHBondContact O-N 2.92Å
479	A	77.1	Confident	81	Confident	41 Å²	41	101.4 Å²	101.4	34%	0.339	49%	0.494	S	S	.	.	H	α-helix	trans	-67.1	-41.8	176.3	0	0	0	0	0	112.4	I445 Q475 L476 Q477 R482 E483	I445-A479 HydrophobicContact CD1-CB 4.27Å; Q475-A479 WeakPolarHBondContact O-CB 3.29Å; Q475-A479 PolarHBondContact O-N 3.36Å; L476-A479 PolarHBondContact O-N 3.01Å; Q477-A479 VanDerWaalsContact C-N 3.31Å; Q477-A479 PolarHBondContact O-N 2.93Å; A479-R482 PolarHBondContact O-N 2.88Å; A479-E483 PolarHBondContact O-N 2.91Å
480	L	84.7	Confident	81	Confident	82 Å²	82	102.3 Å²	102.3	43%	0.429	50%	0.5	S	S	.	.	H	α-helix	trans	-63.9	-42.5	175.8	-72.8	170.5	0	0	0	111.9	L476 Q477 R482 E483 A484	L476-L480 HydrophobicContact CG-CD1 4.28Å; L476-L480 WeakPolarHBondContact O-CG 3.48Å; L476-L480 PolarHBondContact O-N 2.92Å; Q477-L480 PolarHBondContact O-N 2.78Å; L480-R482 VanDerWaalsContact C-N 3.31Å; L480-R482 PolarHBondContact O-N 2.83Å; L480-E483 PolarHBondContact O-N 3.15Å; L480-A484 PolarHBondContact O-N 2.91Å
481	D	85.2	Confident	81.3	Confident	94 Å²	94	97 Å²	97	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-64.5	-38.6	177.2	-64.9	-18.2	0	0	0	111	Q477 A484 Y485	Q477-D481 PolarHBondContact NE2-OD1 3.21Å; Q477-D481 VanDerWaalsContact NE2-OD1 3.09Å; Q477-D481 VanDerWaalsContact O-CG 3.22Å; Q477-D481 PolarHBondContact O-N 3.47Å; D481-A484 PolarHBondContact O-N 3.16Å; D481-Y485 PolarHBondContact O-N 2.79Å
482	R	82.3	Confident	81.3	Confident	184 Å²	184	96.3 Å²	96.3	69%	0.694	49%	0.49	S	S	*	.	H	α-helix	trans	-66	-40.9	174.7	-172.5	171.6	-177.5	154.6	-0.6	112.2	S478 A479 L480 Y485 L486	S478-R482 WeakPolarHBondContact O-CB 3.45Å; S478-R482 PolarHBondContact O-N 2.92Å; A479-R482 PolarHBondContact O-N 2.88Å; L480-R482 VanDerWaalsContact C-N 3.31Å; L480-R482 PolarHBondContact O-N 2.83Å; R482-Y485 PolarHBondContact O-N 3.02Å; R482-L486 HydrophobicContact CG-CD1 4.43Å; R482-L486 VanDerWaalsContact O-CG 3.3Å; R482-L486 WeakPolarHBondContact O-CG 3.34Å; R482-L486 PolarHBondContact O-N 3.46Å
483	E	81.7	Confident	81.3	Confident	82 Å²	82	100.9 Å²	100.9	38%	0.383	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-45.6	175.4	-169.1	-168.5	164.1	0	0	111.3	A479 L480 Y485 L486 R487	A479-E483 PolarHBondContact O-N 2.91Å; L480-E483 PolarHBondContact O-N 3.15Å; E483-Y485 VanDerWaalsContact C-N 3.32Å; E483-Y485 PolarHBondContact O-N 2.78Å; E483-L486 PolarHBondContact O-N 2.66Å; E483-R487 WeakPolarHBondContact O-CG 3.34Å; E483-R487 PolarHBondContact O-N 2.96Å; E483-R487 IonicContact OE1-CZ 3.92Å; E483-R487 IonicContact OE1-NE 2.77Å; E483-R487 PolarHBondContact OE1-NE 2.66Å; E483-R487 IonicContact OE1-NH2 2.7Å; E483-R487 PolarHBondContact OE1-NH2 2.86Å
484	A	80.8	Confident	81.2	Confident	59 Å²	59	99.2 Å²	99.2	49%	0.488	50%	0.496	S	S	.	.	H	α-helix	trans	-58.8	-43.5	177.3	0	0	0	0	0	111.8	L480 D481 R487 Q488	L480-A484 PolarHBondContact O-N 2.91Å; D481-A484 PolarHBondContact O-N 3.16Å; A484-R487 PolarHBondContact O-N 2.95Å; A484-Q488 PolarHBondContact O-N 3.26Å
485	Y	83.7	Confident	81.1	Confident	148 Å²	148	98.5 Å²	98.5	58%	0.58	49%	0.49	S	S	*	.	H	α-helix	trans	-61.7	-44	174.9	177.8	-102.8	0	0	0	112.6	D481 R482 E483 Q488 M489	D481-Y485 PolarHBondContact O-N 2.79Å; R482-Y485 PolarHBondContact O-N 3.02Å; E483-Y485 VanDerWaalsContact C-N 3.32Å; E483-Y485 PolarHBondContact O-N 2.78Å; Y485-Q488 PolarHBondContact O-N 3.27Å; Y485-M489 HydrophobicContact CD1-CE 4.23Å; Y485-M489 HydrophobicContact CE1-CE 3.75Å; Y485-M489 PolarHBondContact O-N 3.35Å
486	L	82.8	Confident	81	Confident	80 Å²	80	96 Å²	96	42%	0.419	49%	0.486	S	S	.	.	H	α-helix	trans	-64.3	-41	177.7	-71	174.3	0	0	0	112.1	R482 E483 Q488 M489 L490	R482-L486 HydrophobicContact CG-CD1 4.43Å; R482-L486 VanDerWaalsContact O-CG 3.3Å; R482-L486 WeakPolarHBondContact O-CG 3.34Å; R482-L486 PolarHBondContact O-N 3.46Å; E483-L486 PolarHBondContact O-N 2.66Å; L486-Q488 VanDerWaalsContact C-N 3.35Å; L486-Q488 PolarHBondContact O-N 3.43Å; L486-M489 HydrophobicContact CD2-CE 3.56Å; L486-M489 PolarHBondContact O-N 3.38Å; L486-L490 PolarHBondContact O-N 3.49Å
487	R	79.9	Confident	80.6	Confident	166 Å²	166	97.3 Å²	97.3	63%	0.626	49%	0.491	S	S	*	.	H	α-helix	trans	-61.9	-41.5	175.4	-73.5	-175.1	-176.7	-163.7	1	111.9	E483 A484 L490 S491	E483-R487 WeakPolarHBondContact O-CG 3.34Å; E483-R487 PolarHBondContact O-N 2.96Å; E483-R487 IonicContact OE1-CZ 3.92Å; E483-R487 IonicContact OE1-NE 2.77Å; E483-R487 PolarHBondContact OE1-NE 2.66Å; E483-R487 IonicContact OE1-NH2 2.7Å; E483-R487 PolarHBondContact OE1-NH2 2.86Å; A484-R487 PolarHBondContact O-N 2.95Å; R487-L490 PolarHBondContact O-N 2.93Å; R487-S491 PolarHBondContact O-N 3.2Å
488	Q	82.5	Confident	80.2	Confident	122 Å²	122	100.4 Å²	100.4	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-63.9	-41.8	175	-172	179.8	5.4	0	0	111.7	A484 Y485 L486 L490 S491 N492	A484-Q488 PolarHBondContact O-N 3.26Å; Y485-Q488 PolarHBondContact O-N 3.27Å; L486-Q488 VanDerWaalsContact C-N 3.35Å; L486-Q488 PolarHBondContact O-N 3.43Å; Q488-L490 VanDerWaalsContact C-N 3.35Å; Q488-L490 PolarHBondContact O-N 3.17Å; Q488-S491 PolarHBondContact O-N 3.49Å; Q488-N492 PolarHBondContact O-N 2.82Å
489	M	80.6	Confident	80.1	Confident	58 Å²	58	101.6 Å²	101.6	29%	0.286	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-39	178.2	-154	-163.6	-23.4	0	0	112.3	Y485 L486 N492 R493	Y485-M489 HydrophobicContact CD1-CE 4.23Å; Y485-M489 HydrophobicContact CE1-CE 3.75Å; Y485-M489 PolarHBondContact O-N 3.35Å; L486-M489 HydrophobicContact CD2-CE 3.56Å; L486-M489 PolarHBondContact O-N 3.38Å; M489-N492 PolarHBondContact O-N 2.81Å; M489-R493 PolarHBondContact O-N 3.22Å
490	L	75.5	Confident	79.9	Confident	103 Å²	103	104.5 Å²	104.5	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-48.2	173.6	-79.7	165.2	0	0	0	111.1	L486 R487 Q488 N492 R493 E494	L486-L490 PolarHBondContact O-N 3.49Å; R487-L490 PolarHBondContact O-N 2.93Å; Q488-L490 VanDerWaalsContact C-N 3.35Å; Q488-L490 PolarHBondContact O-N 3.17Å; L490-N492 VanDerWaalsContact C-N 3.28Å; L490-N492 PolarHBondContact O-N 3.46Å; L490-R493 PolarHBondContact O-N 3.48Å; L490-E494 WeakPolarHBondContact O-CG 3.09Å; L490-E494 PolarHBondContact O-N 3.4Å
491	S	81.8	Confident	79.5	Confident	66 Å²	66	105.1 Å²	105.1	46%	0.462	51%	0.508	S	S	.	.	H	α-helix	trans	-58.1	-39.6	176.5	-178.6	0	0	0	0	112.5	R487 Q488 A495	R487-S491 PolarHBondContact O-N 3.2Å; Q488-S491 PolarHBondContact O-N 3.49Å; S491-A495 PolarHBondContact O-N 3.04Å
492	N	79.7	Confident	79.1	Confident	102 Å²	102	106.5 Å²	106.5	55%	0.545	51%	0.512	S	S	.	.	H	α-helix	trans	-67.8	-37.8	176.3	-72.7	-13.7	0	0	0	111.9	Q488 M489 L490 A495 G496	Q488-N492 PolarHBondContact O-N 2.82Å; M489-N492 PolarHBondContact O-N 2.81Å; L490-N492 VanDerWaalsContact C-N 3.28Å; L490-N492 PolarHBondContact O-N 3.46Å; N492-A495 PolarHBondContact O-N 2.62Å; N492-G496 PolarHBondContact O-N 2.75Å
493	R	77.1	Confident	79	Confident	172 Å²	172	102.8 Å²	102.8	65%	0.649	50%	0.501	S	S	*	.	H	α-helix	trans	-68.6	-41.4	175.6	-81.8	-172.6	163.9	132.9	-2.4	112.3	M489 L490 A495 G496 M497	M489-R493 PolarHBondContact O-N 3.22Å; L490-R493 PolarHBondContact O-N 3.48Å; R493-A495 VanDerWaalsContact C-N 3.3Å; R493-A495 PolarHBondContact O-N 3.46Å; R493-G496 PolarHBondContact O-N 2.64Å; R493-M497 WeakPolarHBondContact O-CB 3.11Å; R493-M497 PolarHBondContact O-N 2.97Å
494	E	77.8	Confident	78.6	Confident	111 Å²	111	102 Å²	102	52%	0.519	50%	0.501	S	S	.	.	H	α-helix	trans	-63	-36.6	174.7	-73.1	176.1	175	0	0	111.9	L490 M497 R498	L490-E494 WeakPolarHBondContact O-CG 3.09Å; L490-E494 PolarHBondContact O-N 3.4Å; E494-M497 PolarHBondContact O-N 3.47Å; E494-R498 WeakPolarHBondContact O-CG 3.34Å; E494-R498 PolarHBondContact O-N 2.79Å
495	A	79	Confident	78.3	Confident	48 Å²	48	104.4 Å²	104.4	40%	0.397	50%	0.502	S	S	.	.	H	α-helix	trans	-64.2	-45.7	172	0	0	0	0	0	112	S491 N492 R493 M497 R498 E499	S491-A495 PolarHBondContact O-N 3.04Å; N492-A495 PolarHBondContact O-N 2.62Å; R493-A495 VanDerWaalsContact C-N 3.3Å; R493-A495 PolarHBondContact O-N 3.46Å; A495-M497 VanDerWaalsContact C-N 3.32Å; A495-M497 PolarHBondContact O-N 2.8Å; A495-R498 PolarHBondContact O-N 3.23Å; A495-E499 PolarHBondContact O-N 2.79Å
496	G	80.1	Confident	77.8	Confident	29 Å²	29	101.7 Å²	101.7	30%	0.299	50%	0.498	S	S	.	.	H	α-helix	trans	-65	-34.8	176.5	0	0	0	0	0	113.3	N492 R493 E499 I500	N492-G496 PolarHBondContact O-N 2.75Å; R493-G496 PolarHBondContact O-N 2.64Å; G496-E499 PolarHBondContact O-N 2.58Å; G496-I500 WeakPolarHBondContact O-CG1 3.3Å; G496-I500 PolarHBondContact O-N 2.8Å
497	M	73.4	Confident	77	Confident	114 Å²	114	102.4 Å²	102.4	56%	0.562	50%	0.501	S	S	*	.	H	α-helix	trans	-68.2	-43.1	176.3	-157.4	150.6	63.5	0	0	111	R493 E494 A495 E499 I500 D501	R493-M497 WeakPolarHBondContact O-CB 3.11Å; R493-M497 PolarHBondContact O-N 2.97Å; E494-M497 PolarHBondContact O-N 3.47Å; A495-M497 VanDerWaalsContact C-N 3.32Å; A495-M497 PolarHBondContact O-N 2.8Å; M497-E499 VanDerWaalsContact C-N 3.31Å; M497-E499 PolarHBondContact O-N 3.46Å; M497-I500 PolarHBondContact O-N 3.48Å; M497-I500 VanDerWaalsContact O-N 3.13Å; M497-D501 PolarHBondContact O-N 2.82Å
498	R	76.8	Confident	76.2	Confident	170 Å²	170	100 Å²	100	64%	0.642	50%	0.497	S	S	*	.	H	α-helix	trans	-59.5	-38.2	171.6	-78	-171.4	-73.1	-174.8	-3.9	113.1	E494 A495 I500 D501 Q502	E494-R498 WeakPolarHBondContact O-CG 3.34Å; E494-R498 PolarHBondContact O-N 2.79Å; A495-R498 PolarHBondContact O-N 3.23Å; R498-I500 VanDerWaalsContact C-N 3.34Å; R498-D501 PolarHBondContact O-N 2.92Å; R498-Q502 WeakPolarHBondContact O-CB 3.14Å; R498-Q502 PolarHBondContact O-N 2.76Å
499	E	80	Confident	75.3	Confident	102 Å²	102	98.4 Å²	98.4	48%	0.477	49%	0.492	S	S	.	.	H	α-helix	trans	-66.3	-37.3	176.1	-161.7	-163.4	153	0	0	111.9	A495 G496 M497 K503	A495-E499 PolarHBondContact O-N 2.79Å; G496-E499 PolarHBondContact O-N 2.58Å; M497-E499 VanDerWaalsContact C-N 3.31Å; M497-E499 PolarHBondContact O-N 3.46Å; E499-K503 WeakPolarHBondContact O-CG 3.26Å; E499-K503 PolarHBondContact O-N 2.88Å; E499-K503 WeakPolarHBondContact OE1-CE 3.46Å; E499-K503 IonicContact OE1-NZ 3.9Å; E499-K503 PolarHBondContact OE1-NZ 2.8Å
500	I	73.8	Confident	74.3	Confident	102 Å²	102	100.7 Å²	100.7	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-68	-46.2	174.6	-69	168.5	0	0	0	110.3	G496 M497 R498 Q502 K503 V504	G496-I500 WeakPolarHBondContact O-CG1 3.3Å; G496-I500 PolarHBondContact O-N 2.8Å; M497-I500 PolarHBondContact O-N 3.48Å; M497-I500 VanDerWaalsContact O-N 3.13Å; R498-I500 VanDerWaalsContact C-N 3.34Å; I500-Q502 VanDerWaalsContact C-N 3.26Å; I500-Q502 PolarHBondContact O-N 2.76Å; I500-K503 CarbonylContact O-C 3.59Å; I500-K503 WeakPolarHBondContact O-CA 3.3Å; I500-K503 WeakPolarHBondContact O-CB 3.4Å; I500-K503 PolarHBondContact O-N 2.82Å; I500-V504 HydrophobicContact CG2-CG2 4.27Å; I500-V504 WeakPolarHBondContact O-CG2 3.45Å; I500-V504 PolarHBondContact O-N 2.9Å
501	D	75.9	Confident	73.3	Confident	96 Å²	96	101.9 Å²	101.9	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-58.4	-41.8	177.6	-68.4	-24.4	0	0	0	110.8	M497 R498 K503 V504 E505	M497-D501 PolarHBondContact O-N 2.82Å; R498-D501 PolarHBondContact O-N 2.92Å; D501-K503 VanDerWaalsContact C-N 3.33Å; D501-K503 PolarHBondContact O-N 3.36Å; D501-V504 PolarHBondContact O-N 2.9Å; D501-E505 WeakPolarHBondContact O-CB 3.49Å; D501-E505 PolarHBondContact O-N 2.81Å
502	Q	76.6	Confident	71.9	Confident	122 Å²	122	106.1 Å²	106.1	57%	0.57	52%	0.522	S	S	*	.	H	α-helix	trans	-66	-34.3	175.9	-154.3	172	32.3	0	0	112.4	R498 I500 N506	R498-Q502 WeakPolarHBondContact O-CB 3.14Å; R498-Q502 PolarHBondContact O-N 2.76Å; I500-Q502 VanDerWaalsContact C-N 3.26Å; I500-Q502 PolarHBondContact O-N 2.76Å; Q502-N506 WeakPolarHBondContact O-CB 2.85Å; Q502-N506 PolarHBondContact O-N 2.94Å; Q502-N506 PolarHBondContact O-ND2 3.04Å
503	K	78.8	Confident	70.6	Confident	107 Å²	107	110 Å²	110	47%	0.465	53%	0.534	S	S	.	.	H	α-helix	trans	-70.1	-39.2	172.7	-76.3	172.4	-173.2	164.8	0	112	E499 I500 D501 N506 I507	E499-K503 WeakPolarHBondContact O-CG 3.26Å; E499-K503 PolarHBondContact O-N 2.88Å; E499-K503 WeakPolarHBondContact OE1-CE 3.46Å; E499-K503 IonicContact OE1-NZ 3.9Å; E499-K503 PolarHBondContact OE1-NZ 2.8Å; I500-K503 CarbonylContact O-C 3.59Å; I500-K503 WeakPolarHBondContact O-CA 3.3Å; I500-K503 WeakPolarHBondContact O-CB 3.4Å; I500-K503 PolarHBondContact O-N 2.82Å; D501-K503 VanDerWaalsContact C-N 3.33Å; D501-K503 PolarHBondContact O-N 3.36Å; K503-N506 PolarHBondContact O-N 2.76Å; K503-I507 VanDerWaalsContact O-CG1 3.25Å; K503-I507 WeakPolarHBondContact O-CG1 3.49Å; K503-I507 PolarHBondContact O-N 3.41Å
504	V	73.9	Confident	68.9	Low	65 Å²	65	107 Å²	107	39%	0.394	53%	0.531	S	S	.	.	H	α-helix	trans	-64.8	-46.8	175.7	173	0	0	0	0	109.8	I500 D501 N506 I507 E508	I500-V504 HydrophobicContact CG2-CG2 4.27Å; I500-V504 WeakPolarHBondContact O-CG2 3.45Å; I500-V504 PolarHBondContact O-N 2.9Å; D501-V504 PolarHBondContact O-N 2.9Å; V504-N506 VanDerWaalsContact C-N 3.3Å; V504-N506 PolarHBondContact O-N 3.24Å; V504-I507 PolarHBondContact O-N 2.78Å; V504-E508 HydrophobicContact CG1-CG 4.39Å; V504-E508 WeakPolarHBondContact O-CG 3.42Å; V504-E508 PolarHBondContact O-N 2.84Å
505	E	74.5	Confident	67.2	Low	109 Å²	109	109.4 Å²	109.4	51%	0.509	55%	0.547	S	S	.	.	H	α-helix	trans	-59.7	-39.8	175.1	-173.2	-179	-171.9	0	0	111.8	D501 E508 N509	D501-E505 WeakPolarHBondContact O-CB 3.49Å; D501-E505 PolarHBondContact O-N 2.81Å; E505-E508 PolarHBondContact O-N 2.87Å; E505-N509 VanDerWaalsContact O-CB 3.26Å; E505-N509 WeakPolarHBondContact O-CB 3.47Å; E505-N509 VanDerWaalsContact O-CG 3.23Å; E505-N509 PolarHBondContact O-N 2.93Å; E505-N509 PolarHBondContact O-ND2 2.75Å; E505-N509 VanDerWaalsContact O-ND2 3.09Å
506	N	73.2	Confident	65.4	Low	91 Å²	91	111.3 Å²	111.3	49%	0.487	56%	0.558	S	S	.	*	H	α-helix	trans	-64.8	-38.5	173.8	-75.1	-29.4	0	0	0	112.6	Q502 K503 V504 I510	Q502-N506 WeakPolarHBondContact O-CB 2.85Å; Q502-N506 PolarHBondContact O-N 2.94Å; Q502-N506 PolarHBondContact O-ND2 3.04Å; K503-N506 PolarHBondContact O-N 2.76Å; V504-N506 VanDerWaalsContact C-N 3.3Å; V504-N506 PolarHBondContact O-N 3.24Å; N506-I510 WeakPolarHBondContact O-CD1 3.25Å; N506-I510 VanDerWaalsContact O-CG1 3.23Å; N506-I510 WeakPolarHBondContact O-CG1 3.27Å; N506-I510 PolarHBondContact O-N 3.44Å
507	I	66.1	Low	63.6	Low	96 Å²	96	114.6 Å²	114.6	49%	0.492	58%	0.576	S	S	.	*	H	α-helix	trans	-68.2	-45.7	176.4	-69.7	163.8	0	0	0	110.1	K503 V504 N509 I510 E511	K503-I507 VanDerWaalsContact O-CG1 3.25Å; K503-I507 WeakPolarHBondContact O-CG1 3.49Å; K503-I507 PolarHBondContact O-N 3.41Å; V504-I507 PolarHBondContact O-N 2.78Å; I507-N509 VanDerWaalsContact C-N 3.3Å; I507-N509 PolarHBondContact O-N 3.08Å; I507-I510 PolarHBondContact O-N 2.76Å; I507-I510 VanDerWaalsContact O-N 3.1Å; I507-E511 PolarHBondContact O-N 2.62Å
508	E	63.8	Low	62.2	Low	114 Å²	114	118.7 Å²	118.7	53%	0.533	59%	0.591	S	S	.	*	H	α-helix	trans	-61.4	-38.6	176.3	-72.5	-178.7	169.9	0	0	111.3	V504 E505 I510 E511 M512	V504-E508 HydrophobicContact CG1-CG 4.39Å; V504-E508 WeakPolarHBondContact O-CG 3.42Å; V504-E508 PolarHBondContact O-N 2.84Å; E505-E508 PolarHBondContact O-N 2.87Å; E508-I510 VanDerWaalsContact C-N 3.34Å; E508-I510 PolarHBondContact O-N 3.4Å; E508-E511 PolarHBondContact O-N 2.83Å; E508-M512 WeakPolarHBondContact O-CB 3.17Å; E508-M512 VanDerWaalsContact O-CG 3.22Å; E508-M512 WeakPolarHBondContact O-CG 3.36Å; E508-M512 PolarHBondContact O-N 3.38Å
509	N	62.9	Low	60.6	Low	89 Å²	89	119.5 Å²	119.5	48%	0.476	60%	0.599	S	S	.	*	H	α-helix	trans	-68.4	-29.8	174.6	-78.6	-36.4	0	0	0	113.4	E505 I507 K513	E505-N509 VanDerWaalsContact O-CB 3.26Å; E505-N509 WeakPolarHBondContact O-CB 3.47Å; E505-N509 VanDerWaalsContact O-CG 3.23Å; E505-N509 PolarHBondContact O-N 2.93Å; E505-N509 PolarHBondContact O-ND2 2.75Å; E505-N509 VanDerWaalsContact O-ND2 3.09Å; I507-N509 VanDerWaalsContact C-N 3.3Å; I507-N509 PolarHBondContact O-N 3.08Å; N509-K513 PolarHBondContact O-N 2.64Å
510	I	59.6	Low	58.9	Low	106 Å²	106	120.9 Å²	120.9	54%	0.544	61%	0.609	S	S	.	*	H	α-helix	trans	-74.8	-43.6	172.6	-69.2	164.4	0	0	0	109.9	N506 I507 E508 M512 K513 D514	N506-I510 WeakPolarHBondContact O-CD1 3.25Å; N506-I510 VanDerWaalsContact O-CG1 3.23Å; N506-I510 WeakPolarHBondContact O-CG1 3.27Å; N506-I510 PolarHBondContact O-N 3.44Å; I507-I510 PolarHBondContact O-N 2.76Å; I507-I510 VanDerWaalsContact O-N 3.1Å; E508-I510 VanDerWaalsContact C-N 3.34Å; E508-I510 PolarHBondContact O-N 3.4Å; I510-M512 VanDerWaalsContact C-N 3.34Å; I510-M512 PolarHBondContact O-N 2.97Å; I510-K513 PolarHBondContact O-N 3.04Å; I510-D514 PolarHBondContact O-N 2.88Å
511	E	54.2	Low	57.8	Low	129 Å²	129	120.1 Å²	120.1	60%	0.603	61%	0.611	S	S	*	*	H	α-helix	trans	-65.6	-34.7	177.8	-75.8	-171.6	160.6	0	0	112.5	I507 E508 K513 D514	I507-E511 PolarHBondContact O-N 2.62Å; E508-E511 PolarHBondContact O-N 2.83Å; E511-K513 VanDerWaalsContact C-N 3.31Å; E511-K513 PolarHBondContact O-N 3.11Å; E511-D514 CarbonylContact O-C 3.53Å
512	M	53	Low	56.5	Low	154 Å²	154	125 Å²	125	76%	0.759	63%	0.627	S	S	*	*	H	α-helix	trans	-71.9	-22.6	175.5	-72.8	-75.6	-78.5	0	0	113.3	E508 I510	E508-M512 WeakPolarHBondContact O-CB 3.17Å; E508-M512 VanDerWaalsContact O-CG 3.22Å; E508-M512 WeakPolarHBondContact O-CG 3.36Å; E508-M512 PolarHBondContact O-N 3.38Å; I510-M512 VanDerWaalsContact C-N 3.34Å; I510-M512 PolarHBondContact O-N 2.97Å
513	K	52.7	Low	55.4	Low	185 Å²	185	127.1 Å²	127.1	80%	0.804	64%	0.643	S	S	*	*	H	α-helix	trans	-89.6	-30.1	174	-85.8	-177.1	176.2	175.2	0	113.4	N509 I510 E511	N509-K513 PolarHBondContact O-N 2.64Å; I510-K513 PolarHBondContact O-N 3.04Å; E511-K513 VanDerWaalsContact C-N 3.31Å; E511-K513 PolarHBondContact O-N 3.11Å
514	D	41.2	Very low	54.3	Low	108 Å²	108	124.8 Å²	124.8	58%	0.578	64%	0.635	S	S	*	*			trans	-108.6	70.2	-179.5	-77.9	-26.6	0	0	0	111.6	I510 E511 S516	I510-D514 PolarHBondContact O-N 2.88Å; E511-D514 CarbonylContact O-C 3.53Å; D514-S516 PolarHBondContact O-N 2.98Å
515	N	41.5	Very low	54	Low	161 Å²	161	124.7 Å²	124.7	86%	0.861	64%	0.637	S	S	*	*			trans	-68.9	45.7	161.9	-97.7	-24.6	0	0	0	112
516	S	41.3	Very low	53.9	Low	89 Å²	89	124.7 Å²	124.7	62%	0.622	65%	0.646	S	S	*	*			trans	-114	111.9	173.9	78.6	0	0	0	0	110.1	D514 F518	D514-S516 PolarHBondContact O-N 2.98Å; S516-F518 PolarHBondContact O-N 2.84Å
517	S	43.1	Very low	54	Low	97 Å²	97	126 Å²	126	68%	0.678	65%	0.653	S	S	*	*			trans	-29.3	125.5	177.8	60.2	0	0	0	0	115.1	K519	S517-K519 PolarHBondContact O-N 3.26Å
518	F	42.5	Very low	54.4	Low	201 Å²	201	127.6 Å²	127.6	88%	0.882	66%	0.656	S	S	*	*			trans	-33.7	100.8	167.8	-134.1	-97.6	0	0	0	112.3	S516 L520	S516-F518 PolarHBondContact O-N 2.84Å; F518-L520 PolarHBondContact O-N 2.82Å
519	K	43.7	Very low	54.9	Low	186 Å²	186	126 Å²	126	81%	0.809	65%	0.651	S	S	*	*			trans	-89.5	101.3	174.2	-75.3	-177.8	-176	171.3	0	109.2	S517	S517-K519 PolarHBondContact O-N 3.26Å
520	L	43.9	Very low	55.5	Low	131 Å²	131	130.4 Å²	130.4	69%	0.686	66%	0.661	S	S	*	*			trans	-54	125.8	166.1	-141.6	84.5	0	0	0	108.7	F518 K522	F518-L520 PolarHBondContact O-N 2.82Å; L520-K522 PolarHBondContact O-N 3.49Å
521	P	51.2	Low	56.4	Low	86 Å²	86	130 Å²	130	56%	0.558	66%	0.66	S	S	*	*			trans	-62.1	110.9	-179.6	-20.8	31.5	0	0	0	110	N523 I524	P521-N523 PolarHBondContact O-N 3.29Å; P521-I524 HydrophobicContact CB-CD1 3.94Å; P521-I524 HydrophobicContact CB-CG1 4.19Å; P521-I524 HydrophobicContact CG-CD1 3.92Å
522	K	48.6	Very low	57.5	Low	198 Å²	198	127.6 Å²	127.6	86%	0.861	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	117	175.4	-65.5	-178.6	178.3	-177.9	0	107.5	L520	L520-K522 PolarHBondContact O-N 3.49Å
523	N	53.1	Low	58.8	Low	167 Å²	167	124.4 Å²	124.4	89%	0.893	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	101.5	34.9	179.7	-50.5	-16.7	0	0	0	116.9	P521	P521-N523 PolarHBondContact O-N 3.29Å
524	I	55.8	Low	60.1	Low	59 Å²	59	121.5 Å²	121.5	30%	0.303	62%	0.624	S	S	.	*			trans	-79.7	125.7	160.8	-67.2	170.3	0	0	0	108.6	P521 K528 L529	P521-I524 HydrophobicContact CB-CD1 3.94Å; P521-I524 HydrophobicContact CB-CG1 4.19Å; P521-I524 HydrophobicContact CG-CD1 3.92Å; I524-K528 HydrophobicContact CG2-CB 4.02Å; I524-K528 HydrophobicContact CG2-CG 4.4Å; I524-L529 HydrophobicContact CG2-CB 3.97Å; I524-L529 HydrophobicContact CG2-CD1 4.3Å
525	S	68.7	Low	62	Low	62 Å²	62	119.8 Å²	119.8	43%	0.434	62%	0.615	S	S	.	*			trans	-64.7	146.1	175.2	66.2	0	0	0	0	110.4	N527 K528 L529	S525-N527 PolarHBondContact O-N 3.25Å; S525-N527 VanDerWaalsContact O-N 3.09Å; S525-K528 PolarHBondContact O-N 3.2Å; S525-K528 WeakPolarHBondContact OG-CB 3.45Å; S525-K528 PolarHBondContact OG-N 2.88Å; S525-L529 PolarHBondContact O-N 3.34Å; S525-L529 VanDerWaalsContact O-N 3.08Å
526	P	71.3	Confident	63.8	Low	109 Å²	109	119 Å²	119	71%	0.708	60%	0.601	S	S	*	*	H	α-helix	trans	-52.6	-35.4	179.7	-25.1	31.9	0	0	0	113.1	L529 R530	P526-L529 PolarHBondContact O-N 3.35Å; P526-R530 WeakPolarHBondContact O-CB 3.36Å; P526-R530 PolarHBondContact O-N 3.36Å
527	N	75.6	Confident	65.7	Low	118 Å²	118	118.8 Å²	118.8	63%	0.631	59%	0.59	S	S	*	*	H	α-helix	trans	-64.8	-46.4	176.7	-66	-4.3	0	0	0	111.6	S525 L529 R530 D531	S525-N527 PolarHBondContact O-N 3.25Å; S525-N527 VanDerWaalsContact O-N 3.09Å; N527-L529 VanDerWaalsContact C-N 3.31Å; N527-L529 PolarHBondContact O-N 3.36Å; N527-R530 WeakPolarHBondContact O-CB 3.23Å; N527-R530 PolarHBondContact O-N 3.16Å; N527-R530 VanDerWaalsContact O-N 3.12Å; N527-D531 PolarHBondContact O-N 2.77Å
528	K	75.6	Confident	67.5	Low	130 Å²	130	119.9 Å²	119.9	57%	0.565	58%	0.584	S	S	*	*	H	α-helix	trans	-67.7	-32.6	-179.6	-167.8	168.9	-173.9	175.8	0	112.3	I524 S525 M532	I524-K528 HydrophobicContact CG2-CB 4.02Å; I524-K528 HydrophobicContact CG2-CG 4.4Å; S525-K528 PolarHBondContact O-N 3.2Å; S525-K528 WeakPolarHBondContact OG-CB 3.45Å; S525-K528 PolarHBondContact OG-N 2.88Å; K528-M532 WeakPolarHBondContact O-CB 3.46Å; K528-M532 VanDerWaalsContact O-CG 3.26Å; K528-M532 WeakPolarHBondContact O-CG 3.31Å; K528-M532 PolarHBondContact O-N 2.99Å
529	L	73	Confident	69.4	Low	80 Å²	80	115 Å²	115	42%	0.419	56%	0.563	S	S	.	*	H	α-helix	trans	-66.4	-42.2	171.9	-165.7	80.2	0	0	0	111.1	I524 S525 P526 N527 M532 I533	I524-L529 HydrophobicContact CG2-CB 3.97Å; I524-L529 HydrophobicContact CG2-CD1 4.3Å; S525-L529 PolarHBondContact O-N 3.34Å; S525-L529 VanDerWaalsContact O-N 3.08Å; P526-L529 PolarHBondContact O-N 3.35Å; N527-L529 VanDerWaalsContact C-N 3.31Å; N527-L529 PolarHBondContact O-N 3.36Å; L529-M532 PolarHBondContact O-N 3.27Å; L529-I533 HydrophobicContact CD2-CD1 4.41Å; L529-I533 HydrophobicContact CG-CD1 4.19Å; L529-I533 VanDerWaalsContact O-CG1 3.27Å; L529-I533 WeakPolarHBondContact O-CG1 3.48Å; L529-I533 PolarHBondContact O-N 3.02Å
530	R	76.1	Confident	71.2	Confident	182 Å²	182	112.7 Å²	112.7	69%	0.687	56%	0.555	S	S	*	*	H	α-helix	trans	-62.8	-45.4	176.8	-166	174.9	-172.8	165.5	2.1	111.5	P526 N527 M532 I533 E534	P526-R530 WeakPolarHBondContact O-CB 3.36Å; P526-R530 PolarHBondContact O-N 3.36Å; N527-R530 WeakPolarHBondContact O-CB 3.23Å; N527-R530 PolarHBondContact O-N 3.16Å; N527-R530 VanDerWaalsContact O-N 3.12Å; R530-M532 VanDerWaalsContact C-N 3.31Å; R530-M532 PolarHBondContact O-N 3.01Å; R530-I533 PolarHBondContact O-N 3.28Å; R530-E534 PolarHBondContact O-N 2.9Å
531	D	79.1	Confident	73.1	Confident	99 Å²	99	113.9 Å²	113.9	53%	0.529	55%	0.551	S	S	.	*	H	α-helix	trans	-60.1	-41.7	175.7	-61.2	-20.7	0	0	0	111.3	N527 E534 D535	N527-D531 PolarHBondContact O-N 2.77Å; D531-E534 PolarHBondContact O-N 2.78Å; D531-D535 WeakPolarHBondContact O-CB 3.48Å; D531-D535 PolarHBondContact O-N 3.46Å
532	M	77.7	Confident	74.7	Confident	78 Å²	78	113.7 Å²	113.7	38%	0.384	54%	0.544	S	S	.	.	H	α-helix	trans	-63.9	-44.6	175.3	-75	177.8	67.3	0	0	111.7	K528 L529 R530 E534 D535 Y536	K528-M532 WeakPolarHBondContact O-CB 3.46Å; K528-M532 VanDerWaalsContact O-CG 3.26Å; K528-M532 WeakPolarHBondContact O-CG 3.31Å; K528-M532 PolarHBondContact O-N 2.99Å; L529-M532 PolarHBondContact O-N 3.27Å; R530-M532 VanDerWaalsContact C-N 3.31Å; R530-M532 PolarHBondContact O-N 3.01Å; M532-E534 VanDerWaalsContact C-N 3.31Å; M532-E534 PolarHBondContact O-N 3.41Å; M532-D535 PolarHBondContact O-N 2.78Å; M532-Y536 HydrophobicContact CE-CE2 4.18Å; M532-Y536 WeakPolarHBondContact O-CB 3.46Å; M532-Y536 WeakPolarHBondContact O-CD2 3.18Å; M532-Y536 PolarHBondContact O-N 3.12Å
533	I	78.8	Confident	76.3	Confident	87 Å²	87	109.7 Å²	109.7	45%	0.446	53%	0.531	S	S	.	.	H	α-helix	trans	-60.5	-43.6	177.4	-69.8	164.8	0	0	0	110.1	L529 R530 Y536 E537	L529-I533 HydrophobicContact CD2-CD1 4.41Å; L529-I533 HydrophobicContact CG-CD1 4.19Å; L529-I533 VanDerWaalsContact O-CG1 3.27Å; L529-I533 WeakPolarHBondContact O-CG1 3.48Å; L529-I533 PolarHBondContact O-N 3.02Å; R530-I533 PolarHBondContact O-N 3.28Å; I533-Y536 PolarHBondContact O-N 2.9Å; I533-E537 HydrophobicContact CG2-CG 4.48Å; I533-E537 WeakPolarHBondContact O-CG 3.24Å; I533-E537 PolarHBondContact O-N 2.87Å
534	E	81.3	Confident	77.6	Confident	124 Å²	124	108.9 Å²	108.9	58%	0.579	52%	0.517	S	S	*	.	H	α-helix	trans	-64.8	-42.5	179	-135.9	171.6	-170.2	0	0	112	R530 D531 M532 E537 Q538	R530-E534 PolarHBondContact O-N 2.9Å; D531-E534 PolarHBondContact O-N 2.78Å; M532-E534 VanDerWaalsContact C-N 3.31Å; M532-E534 PolarHBondContact O-N 3.41Å; E534-E537 PolarHBondContact O-N 2.9Å; E534-Q538 WeakPolarHBondContact O-CB 3.46Å; E534-Q538 PolarHBondContact O-N 2.97Å
535	D	80.2	Confident	79	Confident	71 Å²	71	115.1 Å²	115.1	38%	0.38	54%	0.537	S	S	.	.	H	α-helix	trans	-63.3	-40.5	173.9	-176.6	51	0	0	0	111.9	D531 M532 Q538 K539	D531-D535 WeakPolarHBondContact O-CB 3.48Å; D531-D535 PolarHBondContact O-N 3.46Å; M532-D535 PolarHBondContact O-N 2.78Å; D535-Q538 PolarHBondContact O-N 2.83Å; D535-K539 WeakPolarHBondContact O-CB 3.47Å; D535-K539 WeakPolarHBondContact O-CG 3.47Å; D535-K539 PolarHBondContact O-N 2.86Å; D535-K539 IonicContact OD1-NZ 2.78Å; D535-K539 WeakPolarHBondContact OD2-CE 3.38Å; D535-K539 IonicContact OD2-NZ 3.76Å; D535-K539 PolarHBondContact OD2-NZ 2.81Å
536	Y	78.4	Confident	79.9	Confident	146 Å²	146	118.3 Å²	118.3	57%	0.573	54%	0.543	S	S	*	.	H	α-helix	trans	-67	-43	175.3	-84.1	-65.3	0	0	0	112.4	M532 I533 Q538 K539 Q540	M532-Y536 HydrophobicContact CE-CE2 4.18Å; M532-Y536 WeakPolarHBondContact O-CB 3.46Å; M532-Y536 WeakPolarHBondContact O-CD2 3.18Å; M532-Y536 PolarHBondContact O-N 3.12Å; I533-Y536 PolarHBondContact O-N 2.9Å; Y536-Q538 VanDerWaalsContact C-N 3.29Å; Y536-Q538 PolarHBondContact O-N 2.91Å; Y536-K539 PolarHBondContact O-N 2.89Å; Y536-Q540 WeakPolarHBondContact O-CB 3.42Å; Y536-Q540 PolarHBondContact O-N 2.77Å
537	E	81.3	Confident	80.5	Confident	83 Å²	83	117.6 Å²	117.6	39%	0.388	53%	0.533	S	S	.	.	H	α-helix	trans	-60.7	-41.1	173.5	-78.2	-170.6	-167.6	0	0	111.3	I533 E534 Q540 R541	I533-E537 HydrophobicContact CG2-CG 4.48Å; I533-E537 WeakPolarHBondContact O-CG 3.24Å; I533-E537 PolarHBondContact O-N 2.87Å; E534-E537 PolarHBondContact O-N 2.9Å; E537-Q540 PolarHBondContact O-N 2.51Å; E537-R541 VanDerWaalsContact O-CG 3.31Å; E537-R541 WeakPolarHBondContact O-CG 3.41Å; E537-R541 PolarHBondContact O-N 3.29Å; E537-R541 IonicContact OE2-NH2 3.02Å; E537-R541 PolarHBondContact OE2-NH2 3.2Å
538	Q	81.7	Confident	81	Confident	120 Å²	120	115.8 Å²	115.8	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-65.9	-44.5	177.8	-167.1	172.1	2.5	0	0	111.3	E534 D535 Y536 Q540 R541 I542	E534-Q538 WeakPolarHBondContact O-CB 3.46Å; E534-Q538 PolarHBondContact O-N 2.97Å; D535-Q538 PolarHBondContact O-N 2.83Å; Y536-Q538 VanDerWaalsContact C-N 3.29Å; Y536-Q538 PolarHBondContact O-N 2.91Å; Q538-Q540 VanDerWaalsContact C-N 3.34Å; Q538-Q540 PolarHBondContact O-N 2.53Å; Q538-R541 PolarHBondContact O-N 3.22Å; Q538-I542 HydrophobicContact CG-CD1 4.3Å; Q538-I542 VanDerWaalsContact O-CG1 3.3Å; Q538-I542 WeakPolarHBondContact O-CG1 3.25Å; Q538-I542 PolarHBondContact O-N 3.49Å
539	K	82.9	Confident	81.7	Confident	99 Å²	99	116 Å²	116	43%	0.43	52%	0.522	S	S	.	.	H	α-helix	trans	-59.8	-43.4	172.4	-77.7	169.8	178.7	160.6	0	111.7	D535 Y536 R541 I542 L543	D535-K539 WeakPolarHBondContact O-CB 3.47Å; D535-K539 WeakPolarHBondContact O-CG 3.47Å; D535-K539 PolarHBondContact O-N 2.86Å; D535-K539 IonicContact OD1-NZ 2.78Å; D535-K539 WeakPolarHBondContact OD2-CE 3.38Å; D535-K539 IonicContact OD2-NZ 3.76Å; D535-K539 PolarHBondContact OD2-NZ 2.81Å; Y536-K539 PolarHBondContact O-N 2.89Å; K539-R541 PolarHBondContact O-N 2.95Å; K539-I542 PolarHBondContact O-N 2.78Å; K539-L543 WeakPolarHBondContact O-CB 3.39Å; K539-L543 VanDerWaalsContact O-CG 3.32Å; K539-L543 WeakPolarHBondContact O-CG 3.4Å; K539-L543 PolarHBondContact O-N 2.84Å
540	Q	81.1	Confident	82.3	Confident	137 Å²	137	117 Å²	117	64%	0.64	53%	0.527	S	S	*	.	H	α-helix	trans	-61.3	-43.9	177	-170.9	-177.2	5.4	0	0	111.3	Y536 E537 Q538 I542 L543 Y544	Y536-Q540 WeakPolarHBondContact O-CB 3.42Å; Y536-Q540 PolarHBondContact O-N 2.77Å; E537-Q540 PolarHBondContact O-N 2.51Å; Q538-Q540 VanDerWaalsContact C-N 3.34Å; Q538-Q540 PolarHBondContact O-N 2.53Å; Q540-I542 PolarHBondContact O-N 2.87Å; Q540-L543 PolarHBondContact O-N 3.02Å; Q540-Y544 WeakPolarHBondContact O-CB 3.26Å; Q540-Y544 PolarHBondContact O-N 2.88Å
541	R	83.5	Confident	82.8	Confident	157 Å²	157	111.1 Å²	111.1	59%	0.592	51%	0.509	S	S	*	.	H	α-helix	trans	-63.1	-41.1	175.6	-70.4	177.2	-152.6	175.4	10.1	112.2	E537 Q538 K539 Y544 R545	E537-R541 VanDerWaalsContact O-CG 3.31Å; E537-R541 WeakPolarHBondContact O-CG 3.41Å; E537-R541 PolarHBondContact O-N 3.29Å; E537-R541 IonicContact OE2-NH2 3.02Å; E537-R541 PolarHBondContact OE2-NH2 3.2Å; Q538-R541 PolarHBondContact O-N 3.22Å; K539-R541 PolarHBondContact O-N 2.95Å; R541-Y544 PolarHBondContact O-N 2.87Å; R541-R545 WeakPolarHBondContact O-CG 3.33Å; R541-R545 PolarHBondContact O-N 3.13Å
542	I	84.6	Confident	83.2	Confident	82 Å²	82	109.5 Å²	109.5	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-45.3	177	-68.2	165.4	0	0	0	110.6	Q538 K539 Q540 R545 K546	Q538-I542 HydrophobicContact CG-CD1 4.3Å; Q538-I542 VanDerWaalsContact O-CG1 3.3Å; Q538-I542 WeakPolarHBondContact O-CG1 3.25Å; Q538-I542 PolarHBondContact O-N 3.49Å; K539-I542 PolarHBondContact O-N 2.78Å; Q540-I542 PolarHBondContact O-N 2.87Å; I542-R545 PolarHBondContact O-N 3.12Å; I542-K546 HydrophobicContact CG2-CD 4.39Å; I542-K546 WeakPolarHBondContact O-CG 3.06Å; I542-K546 PolarHBondContact O-N 3.32Å
543	L	81.9	Confident	83.7	Confident	113 Å²	113	109.5 Å²	109.5	59%	0.592	50%	0.501	S	S	*	.	H	α-helix	trans	-64.4	-41.5	177.5	-71.9	172	0	0	0	111.7	K539 Q540 R545 K546 N547	K539-L543 WeakPolarHBondContact O-CB 3.39Å; K539-L543 VanDerWaalsContact O-CG 3.32Å; K539-L543 WeakPolarHBondContact O-CG 3.4Å; K539-L543 PolarHBondContact O-N 2.84Å; Q540-L543 PolarHBondContact O-N 3.02Å; L543-R545 PolarHBondContact O-N 3.36Å; L543-K546 PolarHBondContact O-N 3.14Å; L543-N547 WeakPolarHBondContact O-CB 3.34Å; L543-N547 PolarHBondContact O-N 2.76Å
544	Y	81.9	Confident	84.1	Confident	151 Å²	151	110.3 Å²	110.3	59%	0.592	51%	0.506	S	S	*	.	H	α-helix	trans	-60	-44.3	175.3	-174.6	-97.5	0	0	0	111.8	Q540 R541 N547 Q548	Q540-Y544 WeakPolarHBondContact O-CB 3.26Å; Q540-Y544 PolarHBondContact O-N 2.88Å; R541-Y544 PolarHBondContact O-N 2.87Å; Y544-N547 PolarHBondContact O-N 3.27Å; Y544-Q548 HydrophobicContact CD1-CG 4.16Å; Y544-Q548 HydrophobicContact CE1-CG 3.81Å; Y544-Q548 WeakPolarHBondContact O-CB 3.44Å; Y544-Q548 WeakPolarHBondContact O-CG 3.19Å; Y544-Q548 PolarHBondContact O-N 3.44Å; Y544-Q548 PolarHBondContact OH-NE2 3.17Å; Y544-Q548 VanDerWaalsContact OH-NE2 3.11Å
545	R	85.2	Confident	84.3	Confident	190 Å²	190	113 Å²	113	72%	0.717	51%	0.51	S	S	*	.	H	α-helix	trans	-63.1	-42.4	174.6	-75.4	-178.9	-178.6	169.1	0.7	112.6	R541 I542 L543 N547 Q548 F549	R541-R545 WeakPolarHBondContact O-CG 3.33Å; R541-R545 PolarHBondContact O-N 3.13Å; I542-R545 PolarHBondContact O-N 3.12Å; L543-R545 PolarHBondContact O-N 3.36Å; R545-N547 VanDerWaalsContact C-N 3.35Å; R545-Q548 PolarHBondContact O-N 2.87Å; R545-F549 WeakPolarHBondContact O-CB 3.38Å; R545-F549 PolarHBondContact O-N 2.55Å
546	K	86.1	Confident	84.7	Confident	129 Å²	129	114.8 Å²	114.8	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-62.4	-42.4	175.5	-76	-178.3	176.1	-177.7	0	111.6	I542 L543 F549 L550	I542-K546 HydrophobicContact CG2-CD 4.39Å; I542-K546 WeakPolarHBondContact O-CG 3.06Å; I542-K546 PolarHBondContact O-N 3.32Å; L543-K546 PolarHBondContact O-N 3.14Å; K546-F549 PolarHBondContact O-N 3.35Å; K546-L550 WeakPolarHBondContact O-CB 3.36Å; K546-L550 WeakPolarHBondContact O-CD1 3.06Å; K546-L550 PolarHBondContact O-N 2.66Å
547	N	84	Confident	85.2	Confident	93 Å²	93	112.4 Å²	112.4	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-65.7	-44.3	178.6	-163.1	-10.4	0	0	0	111.2	L543 Y544 R545 F549 L550 I551	L543-N547 WeakPolarHBondContact O-CB 3.34Å; L543-N547 PolarHBondContact O-N 2.76Å; Y544-N547 PolarHBondContact O-N 3.27Å; R545-N547 VanDerWaalsContact C-N 3.35Å; N547-F549 VanDerWaalsContact C-N 3.34Å; N547-F549 PolarHBondContact O-N 3.25Å; N547-L550 PolarHBondContact O-N 2.68Å; N547-I551 VanDerWaalsContact O-CG1 3.31Å; N547-I551 WeakPolarHBondContact O-CG1 2.87Å; N547-I551 PolarHBondContact O-N 2.88Å; N547-I551 WeakPolarHBondContact OD1-CD1 3.3Å
548	Q	87.3	Confident	85.4	Confident	81 Å²	81	111.1 Å²	111.1	38%	0.379	52%	0.517	S	S	.	.	H	α-helix	trans	-59.1	-42.5	173.4	-74.6	-70.3	-15.4	0	0	112.6	Y544 R545 I551 T552	Y544-Q548 HydrophobicContact CD1-CG 4.16Å; Y544-Q548 HydrophobicContact CE1-CG 3.81Å; Y544-Q548 WeakPolarHBondContact O-CB 3.44Å; Y544-Q548 WeakPolarHBondContact O-CG 3.19Å; Y544-Q548 PolarHBondContact O-N 3.44Å; Y544-Q548 PolarHBondContact OH-NE2 3.17Å; Y544-Q548 VanDerWaalsContact OH-NE2 3.11Å; R545-Q548 PolarHBondContact O-N 2.87Å; Q548-I551 PolarHBondContact O-N 3.06Å; Q548-T552 PolarHBondContact O-N 3.06Å; Q548-T552 PolarHBondContact O-OG1 3.34Å
549	F	89.6	Confident	85.7	Confident	135 Å²	135	108.8 Å²	108.8	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-60.9	-48.8	173.6	177.6	-95.2	0	0	0	111.5	R545 K546 N547 I551 T552 E553	R545-F549 WeakPolarHBondContact O-CB 3.38Å; R545-F549 PolarHBondContact O-N 2.55Å; K546-F549 PolarHBondContact O-N 3.35Å; N547-F549 VanDerWaalsContact C-N 3.34Å; N547-F549 PolarHBondContact O-N 3.25Å; F549-I551 PolarHBondContact O-N 3.13Å; F549-T552 PolarHBondContact O-N 3.23Å; F549-T552 VanDerWaalsContact O-N 3.16Å; F549-E553 PolarHBondContact O-N 3.45Å
550	L	85.1	Confident	85.9	Confident	99 Å²	99	108.1 Å²	108.1	52%	0.518	51%	0.514	S	S	.	.	H	α-helix	trans	-59.3	-43.9	177.6	-88.5	147.9	0	0	0	112.7	K546 N547 T552 E553 I554	K546-L550 WeakPolarHBondContact O-CB 3.36Å; K546-L550 WeakPolarHBondContact O-CD1 3.06Å; K546-L550 PolarHBondContact O-N 2.66Å; N547-L550 PolarHBondContact O-N 2.68Å; L550-T552 VanDerWaalsContact C-N 3.29Å; L550-T552 PolarHBondContact O-N 2.8Å; L550-E553 PolarHBondContact O-N 2.9Å; L550-I554 WeakPolarHBondContact O-CB 3.35Å; L550-I554 WeakPolarHBondContact O-CD1 3.31Å; L550-I554 WeakPolarHBondContact O-CG1 3.33Å; L550-I554 PolarHBondContact O-N 3.38Å
551	I	86.7	Confident	86.2	Confident	60 Å²	60	108.9 Å²	108.9	31%	0.308	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-41	176.5	-69.7	165.6	0	0	0	110.8	N547 Q548 F549 R555	N547-I551 VanDerWaalsContact O-CG1 3.31Å; N547-I551 WeakPolarHBondContact O-CG1 2.87Å; N547-I551 PolarHBondContact O-N 2.88Å; N547-I551 WeakPolarHBondContact OD1-CD1 3.3Å; Q548-I551 PolarHBondContact O-N 3.06Å; F549-I551 PolarHBondContact O-N 3.13Å; I551-R555 WeakPolarHBondContact O-CG 3.48Å; I551-R555 PolarHBondContact O-N 3.36Å
552	T	88.1	Confident	86.4	Confident	65 Å²	65	109 Å²	109	40%	0.399	52%	0.517	S	S	.	.	H	α-helix	trans	-66.2	-47.8	178.7	-48.9	0	0	0	0	110.7	Q548 F549 L550 I554 R555 E556	Q548-T552 PolarHBondContact O-N 3.06Å; Q548-T552 PolarHBondContact O-OG1 3.34Å; F549-T552 PolarHBondContact O-N 3.23Å; F549-T552 VanDerWaalsContact O-N 3.16Å; L550-T552 VanDerWaalsContact C-N 3.29Å; L550-T552 PolarHBondContact O-N 2.8Å; T552-I554 PolarHBondContact O-N 3.33Å; T552-R555 WeakPolarHBondContact O-CB 3.46Å; T552-R555 PolarHBondContact O-N 3.41Å; T552-E556 PolarHBondContact O-N 3.5Å
553	E	87.8	Confident	86.6	Confident	77 Å²	77	111 Å²	111	36%	0.36	53%	0.526	S	S	.	.	H	α-helix	trans	-59.9	-43.6	176.1	-167.1	75.1	-165.6	0	0	111.8	F549 L550 R555 E556 L557	F549-E553 PolarHBondContact O-N 3.45Å; L550-E553 PolarHBondContact O-N 2.9Å; E553-R555 VanDerWaalsContact C-N 3.32Å; E553-R555 PolarHBondContact O-N 3.02Å; E553-E556 PolarHBondContact O-N 3.4Å; E553-L557 HydrophobicContact CG-CD1 4.12Å; E553-L557 WeakPolarHBondContact O-CB 3.48Å; E553-L557 VanDerWaalsContact O-CG 3.29Å; E553-L557 WeakPolarHBondContact O-CG 3.42Å; E553-L557 PolarHBondContact O-N 3.15Å
554	I	87.3	Confident	86.8	Confident	105 Å²	105	111.8 Å²	111.8	54%	0.538	52%	0.524	S	S	.	.	H	α-helix	trans	-62.2	-40.5	177	-71.5	166.2	0	0	0	110.8	L550 T552 A558	L550-I554 WeakPolarHBondContact O-CB 3.35Å; L550-I554 WeakPolarHBondContact O-CD1 3.31Å; L550-I554 WeakPolarHBondContact O-CG1 3.33Å; L550-I554 PolarHBondContact O-N 3.38Å; T552-I554 PolarHBondContact O-N 3.33Å; I554-A558 VanDerWaalsContact O-CB 3.24Å; I554-A558 WeakPolarHBondContact O-CB 3.34Å; I554-A558 PolarHBondContact O-N 3.38Å
555	R	86.4	Confident	87.1	Confident	179 Å²	179	107.6 Å²	107.6	68%	0.675	52%	0.515	S	S	*	.	H	α-helix	trans	-65.2	-42.6	176.2	-76.1	174.8	179.2	174.1	0.7	111.9	I551 T552 E553 A558 S559	I551-R555 WeakPolarHBondContact O-CG 3.48Å; I551-R555 PolarHBondContact O-N 3.36Å; T552-R555 WeakPolarHBondContact O-CB 3.46Å; T552-R555 PolarHBondContact O-N 3.41Å; E553-R555 VanDerWaalsContact C-N 3.32Å; E553-R555 PolarHBondContact O-N 3.02Å; R555-A558 PolarHBondContact O-N 2.74Å; R555-S559 WeakPolarHBondContact O-CB 3.21Å; R555-S559 PolarHBondContact O-N 2.96Å
556	E	88.1	Confident	87.2	Confident	110 Å²	110	101 Å²	101	51%	0.514	49%	0.494	S	S	.	.	H	α-helix	trans	-64.5	-46.1	176.3	-71.8	-175.8	-173.7	0	0	111.6	T552 E553 A558 S559 I560	T552-E556 PolarHBondContact O-N 3.5Å; E553-E556 PolarHBondContact O-N 3.4Å; E556-A558 VanDerWaalsContact C-N 3.34Å; E556-A558 PolarHBondContact O-N 2.87Å; E556-S559 WeakPolarHBondContact O-CB 3.25Å; E556-S559 PolarHBondContact O-N 2.65Å; E556-I560 WeakPolarHBondContact O-CG1 3.41Å; E556-I560 PolarHBondContact O-N 3.24Å
557	L	88	Confident	87.3	Confident	96 Å²	96	100.6 Å²	100.6	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-63	-38.8	176.2	-71.3	173.7	0	0	0	112.4	E553 I560 K561	E553-L557 HydrophobicContact CG-CD1 4.12Å; E553-L557 WeakPolarHBondContact O-CB 3.48Å; E553-L557 VanDerWaalsContact O-CG 3.29Å; E553-L557 WeakPolarHBondContact O-CG 3.42Å; E553-L557 PolarHBondContact O-N 3.15Å; L557-I560 PolarHBondContact O-N 2.84Å; L557-K561 WeakPolarHBondContact O-CB 3.43Å; L557-K561 PolarHBondContact O-N 3.43Å
558	A	86.3	Confident	87.3	Confident	56 Å²	56	99.3 Å²	99.3	46%	0.463	49%	0.492	S	S	.	.	H	α-helix	trans	-64.4	-40.8	174.4	0	0	0	0	0	111.8	I554 R555 E556 K561 Y562	I554-A558 VanDerWaalsContact O-CB 3.24Å; I554-A558 WeakPolarHBondContact O-CB 3.34Å; I554-A558 PolarHBondContact O-N 3.38Å; R555-A558 PolarHBondContact O-N 2.74Å; E556-A558 VanDerWaalsContact C-N 3.34Å; E556-A558 PolarHBondContact O-N 2.87Å; A558-K561 PolarHBondContact O-N 3.27Å; A558-Y562 WeakPolarHBondContact O-CB 3.37Å; A558-Y562 PolarHBondContact O-N 2.81Å
559	S	88.7	Confident	87.4	Confident	71 Å²	71	100 Å²	100	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-47	174.4	-178.5	0	0	0	0	111.8	R555 E556 K561 Y562 M563	R555-S559 WeakPolarHBondContact O-CB 3.21Å; R555-S559 PolarHBondContact O-N 2.96Å; E556-S559 WeakPolarHBondContact O-CB 3.25Å; E556-S559 PolarHBondContact O-N 2.65Å; S559-K561 PolarHBondContact O-N 2.72Å; S559-Y562 PolarHBondContact O-N 3.49Å; S559-M563 VanDerWaalsContact O-CG 3.28Å; S559-M563 WeakPolarHBondContact O-CG 3.4Å; S559-M563 PolarHBondContact O-N 3.28Å
560	I	86.9	Confident	87.3	Confident	85 Å²	85	99.6 Å²	99.6	44%	0.436	50%	0.496	S	S	.	.	H	α-helix	trans	-61.2	-45.2	176.5	-69.1	168.7	0	0	0	110.7	E556 L557 Y562 M563 F564	E556-I560 WeakPolarHBondContact O-CG1 3.41Å; E556-I560 PolarHBondContact O-N 3.24Å; L557-I560 PolarHBondContact O-N 2.84Å; I560-Y562 VanDerWaalsContact C-N 3.35Å; I560-Y562 PolarHBondContact O-N 3.25Å; I560-M563 WeakPolarHBondContact O-CB 3.41Å; I560-M563 PolarHBondContact O-N 3.39Å; I560-F564 HydrophobicContact CG2-CD2 3.59Å; I560-F564 HydrophobicContact CG2-CE2 3.4Å; I560-F564 WeakPolarHBondContact O-CD2 3.38Å; I560-F564 PolarHBondContact O-N 3.33Å
561	K	86	Confident	87.5	Confident	153 Å²	153	99.4 Å²	99.4	67%	0.665	49%	0.494	S	S	*	.	H	α-helix	trans	-59.3	-45.5	176.1	-177.3	178.2	177.9	-180	0	111.4	L557 A558 S559 F564 T565	L557-K561 WeakPolarHBondContact O-CB 3.43Å; L557-K561 PolarHBondContact O-N 3.43Å; A558-K561 PolarHBondContact O-N 3.27Å; S559-K561 PolarHBondContact O-N 2.72Å; K561-F564 PolarHBondContact O-N 3.11Å; K561-T565 WeakPolarHBondContact O-CG2 3.33Å; K561-T565 PolarHBondContact O-N 3.31Å; K561-T565 PolarHBondContact O-OG1 3.16Å
562	Y	88.1	Confident	87.5	Confident	160 Å²	160	99.7 Å²	99.7	63%	0.627	50%	0.501	S	S	*	.	H	α-helix	trans	-59.3	-46.8	176.4	178.9	-97.7	0	0	0	111.5	A558 S559 I560 F564 T565 D566	A558-Y562 WeakPolarHBondContact O-CB 3.37Å; A558-Y562 PolarHBondContact O-N 2.81Å; S559-Y562 PolarHBondContact O-N 3.49Å; I560-Y562 VanDerWaalsContact C-N 3.35Å; I560-Y562 PolarHBondContact O-N 3.25Å; Y562-F564 PolarHBondContact O-N 3.23Å; Y562-T565 WeakPolarHBondContact CA-OG1 3.32Å; Y562-T565 PolarHBondContact O-N 3.09Å; Y562-T565 PolarHBondContact O-OG1 3.01Å; Y562-D566 WeakPolarHBondContact O-CB 3.5Å; Y562-D566 PolarHBondContact O-N 3.12Å
563	M	88.6	Confident	87.5	Confident	123 Å²	123	103.6 Å²	103.6	61%	0.606	51%	0.512	S	S	*	.	H	α-helix	trans	-58	-44.4	176.1	-70.5	-109.1	-69.7	0	0	112.4	S559 I560 D566 H567	S559-M563 VanDerWaalsContact O-CG 3.28Å; S559-M563 WeakPolarHBondContact O-CG 3.4Å; S559-M563 PolarHBondContact O-N 3.28Å; I560-M563 WeakPolarHBondContact O-CB 3.41Å; I560-M563 PolarHBondContact O-N 3.39Å; M563-D566 PolarHBondContact O-N 3.21Å; M563-H567 WeakPolarHBondContact O-CB 3.49Å; M563-H567 PolarHBondContact O-N 3.17Å
564	F	87.2	Confident	87.5	Confident	129 Å²	129	106.2 Å²	106.2	57%	0.566	52%	0.52	S	S	*	.	H	α-helix	trans	-64.8	-40.4	176	-81.8	-65.6	0	0	0	112.5	L446 I560 K561 Y562 S568	L446-F564 HydrophobicContact CD1-CZ 4.47Å; I560-F564 HydrophobicContact CG2-CD2 3.59Å; I560-F564 HydrophobicContact CG2-CE2 3.4Å; I560-F564 WeakPolarHBondContact O-CD2 3.38Å; I560-F564 PolarHBondContact O-N 3.33Å; K561-F564 PolarHBondContact O-N 3.11Å; Y562-F564 PolarHBondContact O-N 3.23Å; F564-S568 VanDerWaalsContact O-CB 3.25Å; F564-S568 WeakPolarHBondContact O-CB 3.16Å; F564-S568 PolarHBondContact O-N 2.95Å
565	T	87.1	Confident	87.5	Confident	64 Å²	64	105 Å²	105	39%	0.393	51%	0.514	S	S	.	.	H	α-helix	trans	-67.1	-40.8	176	50.8	0	0	0	0	112.4	K561 Y562 S568 N569	K561-T565 WeakPolarHBondContact O-CG2 3.33Å; K561-T565 PolarHBondContact O-N 3.31Å; K561-T565 PolarHBondContact O-OG1 3.16Å; Y562-T565 WeakPolarHBondContact CA-OG1 3.32Å; Y562-T565 PolarHBondContact O-N 3.09Å; Y562-T565 PolarHBondContact O-OG1 3.01Å; T565-S568 PolarHBondContact O-N 3.01Å; T565-N569 WeakPolarHBondContact O-CB 3.43Å; T565-N569 PolarHBondContact O-N 3.46Å; T565-N569 PolarHBondContact O-ND2 3.11Å
566	D	87.9	Confident	87.3	Confident	52 Å²	52	102.4 Å²	102.4	28%	0.278	51%	0.509	S	S	.	.	H	α-helix	trans	-64.7	-44.8	175.8	179.6	56.8	0	0	0	111.2	Y562 M563 S568 N569 K570	Y562-D566 WeakPolarHBondContact O-CB 3.5Å; Y562-D566 PolarHBondContact O-N 3.12Å; M563-D566 PolarHBondContact O-N 3.21Å; D566-S568 PolarHBondContact O-N 3.37Å; D566-N569 PolarHBondContact O-N 2.66Å; D566-K570 WeakPolarHBondContact O-CB 3.48Å; D566-K570 WeakPolarHBondContact O-CG 3.41Å; D566-K570 PolarHBondContact O-N 3.19Å; D566-K570 WeakPolarHBondContact OD1-CE 3.48Å; D566-K570 IonicContact OD1-NZ 2.68Å; D566-K570 WeakPolarHBondContact OD2-CE 3.38Å; D566-K570 IonicContact OD2-NZ 2.69Å; D566-K570 PolarHBondContact OD2-NZ 3.38Å
567	H	88.1	Confident	87.1	Confident	120 Å²	120	105 Å²	105	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-62.6	-43	174.9	-172.8	-84.2	0	0	0	112	M563 N569 K570 M571	M563-H567 WeakPolarHBondContact O-CB 3.49Å; M563-H567 PolarHBondContact O-N 3.17Å; H567-N569 VanDerWaalsContact C-N 3.34Å; H567-N569 PolarHBondContact O-N 3.45Å; H567-K570 PolarHBondContact O-N 2.87Å; H567-M571 VanDerWaalsContact O-CB 3.27Å; H567-M571 WeakPolarHBondContact O-CB 3.32Å; H567-M571 PolarHBondContact O-N 2.61Å
568	S	85.1	Confident	87	Confident	66 Å²	66	104 Å²	104	46%	0.462	51%	0.509	S	S	.	.	H	α-helix	trans	-61.7	-40.9	175.8	-175.8	0	0	0	0	112	F564 T565 D566 S572	F564-S568 VanDerWaalsContact O-CB 3.25Å; F564-S568 WeakPolarHBondContact O-CB 3.16Å; F564-S568 PolarHBondContact O-N 2.95Å; T565-S568 PolarHBondContact O-N 3.01Å; D566-S568 PolarHBondContact O-N 3.37Å; S568-S572 WeakPolarHBondContact O-CB 3.48Å; S568-S572 PolarHBondContact O-N 3.05Å; S568-S572 PolarHBondContact O-OG 3.31Å
569	N	88.1	Confident	86.9	Confident	94 Å²	94	105.7 Å²	105.7	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-66.7	-45	175.2	-73.2	-24.5	0	0	0	112.1	T565 D566 H567 S572 K573	T565-N569 WeakPolarHBondContact O-CB 3.43Å; T565-N569 PolarHBondContact O-N 3.46Å; T565-N569 PolarHBondContact O-ND2 3.11Å; D566-N569 PolarHBondContact O-N 2.66Å; H567-N569 VanDerWaalsContact C-N 3.34Å; H567-N569 PolarHBondContact O-N 3.45Å; N569-S572 PolarHBondContact O-N 3.33Å; N569-K573 WeakPolarHBondContact O-CG 3.29Å; N569-K573 PolarHBondContact O-N 2.84Å
570	K	88.3	Confident	86.6	Confident	127 Å²	127	105.5 Å²	105.5	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-60.8	-45	175.3	-76.7	171.7	176.3	166.3	0	111.3	D566 H567 K573 Y574	D566-K570 WeakPolarHBondContact O-CB 3.48Å; D566-K570 WeakPolarHBondContact O-CG 3.41Å; D566-K570 PolarHBondContact O-N 3.19Å; D566-K570 WeakPolarHBondContact OD1-CE 3.48Å; D566-K570 IonicContact OD1-NZ 2.68Å; D566-K570 WeakPolarHBondContact OD2-CE 3.38Å; D566-K570 IonicContact OD2-NZ 2.69Å; D566-K570 PolarHBondContact OD2-NZ 3.38Å; H567-K570 PolarHBondContact O-N 2.87Å; K570-K573 PolarHBondContact O-N 3.18Å; K570-Y574 WeakPolarHBondContact O-CB 3.19Å; K570-Y574 PolarHBondContact O-N 3.11Å
571	M	88.7	Confident	86.6	Confident	95 Å²	95	105.1 Å²	105.1	47%	0.468	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-42.6	176.9	-171.1	62.8	174	0	0	111.7	H567 K573 Y574 I575	H567-M571 VanDerWaalsContact O-CB 3.27Å; H567-M571 WeakPolarHBondContact O-CB 3.32Å; H567-M571 PolarHBondContact O-N 2.61Å; M571-K573 PolarHBondContact O-N 3.36Å; M571-Y574 WeakPolarHBondContact O-CB 3.43Å; M571-Y574 PolarHBondContact O-N 2.97Å; M571-Y574 HydrophobicContact SD-CD1 4.39Å; M571-I575 HydrophobicContact CE-CD1 4.28Å; M571-I575 HydrophobicContact CE-CG1 4.45Å; M571-I575 HydrophobicContact CG-CD1 4.11Å; M571-I575 WeakPolarHBondContact O-CG1 3.3Å; M571-I575 PolarHBondContact O-N 3.33Å
572	S	87.5	Confident	86.6	Confident	66 Å²	66	99.2 Å²	99.2	46%	0.462	48%	0.482	S	S	.	.	H	α-helix	trans	-62.4	-42.6	176.4	-60.7	0	0	0	0	111.9	S568 N569 Y574 I575 Q576	S568-S572 WeakPolarHBondContact O-CB 3.48Å; S568-S572 PolarHBondContact O-N 3.05Å; S568-S572 PolarHBondContact O-OG 3.31Å; N569-S572 PolarHBondContact O-N 3.33Å; S572-Y574 VanDerWaalsContact C-N 3.35Å; S572-I575 PolarHBondContact O-N 2.8Å; S572-Q576 WeakPolarHBondContact O-CB 3.45Å; S572-Q576 PolarHBondContact O-N 3.35Å
573	K	86.4	Confident	86.6	Confident	147 Å²	147	92.6 Å²	92.6	64%	0.639	46%	0.456	S	S	*	.	H	α-helix	trans	-62.2	-40.5	173	-73.3	176.9	-178.7	-178.9	0	112	N569 K570 M571 Q576 R577	N569-K573 WeakPolarHBondContact O-CG 3.29Å; N569-K573 PolarHBondContact O-N 2.84Å; K570-K573 PolarHBondContact O-N 3.18Å; M571-K573 PolarHBondContact O-N 3.36Å; K573-Q576 PolarHBondContact O-N 3.03Å; K573-R577 WeakPolarHBondContact O-CB 3.41Å; K573-R577 PolarHBondContact O-N 3.2Å
574	Y	88.3	Confident	86.5	Confident	133 Å²	133	91.9 Å²	91.9	52%	0.522	45%	0.45	S	S	.	.	H	α-helix	trans	-65.1	-46.1	177	-177.5	-109.8	0	0	0	112.1	K570 M571 S572 Q576 R577 L578	K570-Y574 WeakPolarHBondContact O-CB 3.19Å; K570-Y574 PolarHBondContact O-N 3.11Å; M571-Y574 WeakPolarHBondContact O-CB 3.43Å; M571-Y574 PolarHBondContact O-N 2.97Å; M571-Y574 HydrophobicContact SD-CD1 4.39Å; S572-Y574 VanDerWaalsContact C-N 3.35Å; Y574-Q576 VanDerWaalsContact C-N 3.32Å; Y574-Q576 PolarHBondContact O-N 3.26Å; Y574-R577 WeakPolarHBondContact O-CB 3.49Å; Y574-R577 PolarHBondContact O-N 3.16Å; Y574-L578 HydrophobicContact CD1-CD1 3.91Å; Y574-L578 HydrophobicContact CD1-CG 4.47Å; Y574-L578 HydrophobicContact CE1-CD1 3.36Å; Y574-L578 HydrophobicContact CE1-CG 4.08Å; Y574-L578 HydrophobicContact CE2-CD1 4.45Å; Y574-L578 HydrophobicContact CE2-CG 4.34Å; Y574-L578 PolarHBondContact O-N 3.45Å
575	I	87.8	Confident	86.5	Confident	80 Å²	80	94.3 Å²	94.3	41%	0.41	46%	0.455	S	S	.	.	H	α-helix	trans	-60.5	-42	174.9	-68.9	168	0	0	0	111	M571 S572 R577 L578 N579	M571-I575 HydrophobicContact CE-CD1 4.28Å; M571-I575 HydrophobicContact CE-CG1 4.45Å; M571-I575 HydrophobicContact CG-CD1 4.11Å; M571-I575 WeakPolarHBondContact O-CG1 3.3Å; M571-I575 PolarHBondContact O-N 3.33Å; S572-I575 PolarHBondContact O-N 2.8Å; I575-R577 VanDerWaalsContact C-N 3.35Å; I575-R577 PolarHBondContact O-N 3.44Å; I575-L578 PolarHBondContact O-N 2.99Å; I575-N579 WeakPolarHBondContact O-CB 3.41Å; I575-N579 PolarHBondContact O-N 2.89Å; I575-N579 PolarHBondContact O-ND2 3.35Å; I575-N579 VanDerWaalsContact O-ND2 3.16Å
576	Q	82.4	Confident	86.6	Confident	123 Å²	123	95 Å²	95	58%	0.575	45%	0.451	S	S	*	.	H	α-helix	trans	-61.8	-43.2	176.1	-172.1	178.8	5.4	0	0	111.7	S572 K573 Y574 N579 M580	S572-Q576 WeakPolarHBondContact O-CB 3.45Å; S572-Q576 PolarHBondContact O-N 3.35Å; K573-Q576 PolarHBondContact O-N 3.03Å; Y574-Q576 VanDerWaalsContact C-N 3.32Å; Y574-Q576 PolarHBondContact O-N 3.26Å; Q576-N579 PolarHBondContact O-N 2.82Å; Q576-M580 WeakPolarHBondContact O-CG 3.49Å; Q576-M580 PolarHBondContact O-N 3.47Å
577	R	83.3	Confident	86.6	Confident	165 Å²	165	94.7 Å²	94.7	62%	0.623	45%	0.445	S	S	*	.	H	α-helix	trans	-62	-47.1	175.7	-176.2	178.1	178	156.6	2.4	112.1	K573 Y574 I575 N579 M580 E581	K573-R577 WeakPolarHBondContact O-CB 3.41Å; K573-R577 PolarHBondContact O-N 3.2Å; Y574-R577 WeakPolarHBondContact O-CB 3.49Å; Y574-R577 PolarHBondContact O-N 3.16Å; I575-R577 VanDerWaalsContact C-N 3.35Å; I575-R577 PolarHBondContact O-N 3.44Å; R577-N579 VanDerWaalsContact C-N 3.33Å; R577-N579 PolarHBondContact O-N 3.26Å; R577-M580 WeakPolarHBondContact O-CB 3.41Å; R577-M580 PolarHBondContact O-N 3.29Å; R577-E581 IonicContact NE-OE1 2.84Å; R577-E581 PolarHBondContact NE-OE1 3.39Å; R577-E581 PolarHBondContact O-N 2.9Å
578	L	86.2	Confident	86.5	Confident	76 Å²	76	92 Å²	92	40%	0.398	43%	0.433	S	S	.	.	H	α-helix	trans	-61.6	-40.4	176.9	-73.8	179	0	0	0	112.2	Y574 I575 M580 E581 G582	Y574-L578 HydrophobicContact CD1-CD1 3.91Å; Y574-L578 HydrophobicContact CD1-CG 4.47Å; Y574-L578 HydrophobicContact CE1-CD1 3.36Å; Y574-L578 HydrophobicContact CE1-CG 4.08Å; Y574-L578 HydrophobicContact CE2-CD1 4.45Å; Y574-L578 HydrophobicContact CE2-CG 4.34Å; Y574-L578 PolarHBondContact O-N 3.45Å; I575-L578 PolarHBondContact O-N 2.99Å; L578-M580 VanDerWaalsContact C-N 3.34Å; L578-M580 PolarHBondContact O-N 3.48Å; L578-E581 PolarHBondContact O-N 2.88Å; L578-G582 PolarHBondContact O-N 2.87Å
579	N	84.2	Confident	86.6	Confident	91 Å²	91	93.5 Å²	93.5	49%	0.487	43%	0.429	S	S	.	.	H	α-helix	trans	-62.5	-41.6	175.5	-79.7	-40.4	0	0	0	111.9	I575 Q576 R577 G582 F583	I575-N579 WeakPolarHBondContact O-CB 3.41Å; I575-N579 PolarHBondContact O-N 2.89Å; I575-N579 PolarHBondContact O-ND2 3.35Å; I575-N579 VanDerWaalsContact O-ND2 3.16Å; Q576-N579 PolarHBondContact O-N 2.82Å; R577-N579 VanDerWaalsContact C-N 3.33Å; R577-N579 PolarHBondContact O-N 3.26Å; N579-G582 PolarHBondContact O-N 2.96Å; N579-F583 HydrophobicContact CB-CE2 4.48Å; N579-F583 WeakPolarHBondContact O-CD2 3.46Å; N579-F583 PolarHBondContact O-N 3.36Å
580	M	83.1	Confident	86.5	Confident	67 Å²	67	89 Å²	89	33%	0.33	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-45	174.9	-74.3	177.9	47.2	0	0	112.3	Q576 R577 L578 G582 F583 K584 L680 S681	Q576-M580 WeakPolarHBondContact O-CG 3.49Å; Q576-M580 PolarHBondContact O-N 3.47Å; R577-M580 WeakPolarHBondContact O-CB 3.41Å; R577-M580 PolarHBondContact O-N 3.29Å; L578-M580 VanDerWaalsContact C-N 3.34Å; L578-M580 PolarHBondContact O-N 3.48Å; M580-G582 VanDerWaalsContact C-N 3.29Å; M580-G582 PolarHBondContact O-N 3.4Å; M580-F583 PolarHBondContact O-N 3.4Å; M580-K584 PolarHBondContact O-N 3.37Å; M580-L680 WeakPolarHBondContact O-CD2 3.39Å; M580-S681 WeakPolarHBondContact CE-OG 3.42Å; M580-S681 PolarHBondContact SD-OG 3.3Å
581	E	85.8	Confident	86.2	Confident	77 Å²	77	85.7 Å²	85.7	36%	0.36	39%	0.391	S	S	.	.	H	α-helix	trans	-60.9	-40.5	174.8	-73.7	176.1	-169.3	0	0	110.9	R577 L578 F583 K584 W585	R577-E581 IonicContact NE-OE1 2.84Å; R577-E581 PolarHBondContact NE-OE1 3.39Å; R577-E581 PolarHBondContact O-N 2.9Å; L578-E581 PolarHBondContact O-N 2.88Å; E581-F583 PolarHBondContact O-N 3.38Å; E581-K584 WeakPolarHBondContact O-CB 3.43Å; E581-K584 PolarHBondContact O-N 3.39Å; E581-W585 PolarHBondContact O-N 2.84Å
582	G	87.4	Confident	85.8	Confident	29 Å²	29	86.1 Å²	86.1	30%	0.299	39%	0.394	S	S	.	.	H	α-helix	trans	-59.7	-44.1	173.6	0	0	0	0	0	113.6	L578 N579 M580 R586	L578-G582 PolarHBondContact O-N 2.87Å; N579-G582 PolarHBondContact O-N 2.96Å; M580-G582 VanDerWaalsContact C-N 3.29Å; M580-G582 PolarHBondContact O-N 3.4Å; G582-R586 WeakPolarHBondContact O-CB 3.44Å; G582-R586 VanDerWaalsContact O-CG 3.3Å; G582-R586 WeakPolarHBondContact O-CG 3.3Å; G582-R586 PolarHBondContact O-N 2.8Å
583	F	86.7	Confident	85.3	Confident	21 Å²	21	83.3 Å²	83.3	9%	0.092	37%	0.374	C	S	.	.	H	α-helix	trans	-65.1	-39.7	173.8	-69.6	-56	0	0	0	112.5	N579 M580 E581 R586 R587 Y676 Q679 L680	N579-F583 HydrophobicContact CB-CE2 4.48Å; N579-F583 WeakPolarHBondContact O-CD2 3.46Å; N579-F583 PolarHBondContact O-N 3.36Å; M580-F583 PolarHBondContact O-N 3.4Å; E581-F583 PolarHBondContact O-N 3.38Å; F583-R586 PolarHBondContact O-N 3.09Å; F583-R587 WeakPolarHBondContact O-CB 3.43Å; F583-R587 PolarHBondContact O-N 2.76Å; F583-Y676 AromaticContact CD1-CD1 3.83Å; F583-Y676 HydrophobicContact CD1-CD1 3.83Å; F583-Y676 HydrophobicContact CD1-CE1 4.23Å; F583-Y676 HydrophobicContact CE1-CD1 4.48Å; F583-Q679 HydrophobicContact CD1-CB 4.1Å; F583-Q679 HydrophobicContact CD1-CG 4.4Å; F583-Q679 HydrophobicContact CD2-CB 4.06Å; F583-Q679 HydrophobicContact CE1-CB 4.36Å; F583-Q679 HydrophobicContact CE1-CG 4.33Å; F583-Q679 HydrophobicContact CE2-CB 4.33Å; F583-Q679 HydrophobicContact CG-CB 3.98Å; F583-Q679 HydrophobicContact CZ-CB 4.49Å; F583-L680 HydrophobicContact CB-CD2 3.96Å; F583-L680 HydrophobicContact CB-CG 4.43Å
584	K	86.3	Confident	84.8	Confident	108 Å²	108	77.4 Å²	77.4	47%	0.47	35%	0.349	S	S	.	.	H	α-helix	trans	-59.2	-50.3	176.6	-176.8	-176.4	177.3	-179.3	0	110.5	M580 E581 R586 R587 E588 L680	M580-K584 PolarHBondContact O-N 3.37Å; E581-K584 WeakPolarHBondContact O-CB 3.43Å; E581-K584 PolarHBondContact O-N 3.39Å; K584-R586 PolarHBondContact O-N 3.3Å; K584-R587 WeakPolarHBondContact O-CB 3.16Å; K584-R587 PolarHBondContact O-N 3.18Å; K584-E588 WeakPolarHBondContact O-CG 3.35Å; K584-E588 PolarHBondContact O-N 3.07Å; K584-L680 HydrophobicContact CB-CD2 4.1Å
585	W	88.4	Confident	83.9	Confident	179 Å²	179	72.8 Å²	72.8	68%	0.678	34%	0.338	S	S	*	.	H	α-helix	trans	-65.2	-37.5	179.2	-72	118.6	0	0	0	113	E581 E588 Y589	E581-W585 PolarHBondContact O-N 2.84Å; W585-E588 PolarHBondContact O-N 3.06Å; W585-Y589 WeakPolarHBondContact O-CB 3.31Å; W585-Y589 PolarHBondContact O-N 3.05Å
586	R	89.4	Confident	82.8	Confident	80 Å²	80	71.8 Å²	71.8	30%	0.302	34%	0.338	S	S	.	.	H	α-helix	trans	-63.5	-41.8	173.3	-73.8	169.3	176.9	173.9	-17	112.4	G582 F583 K584 Y589 V590 E628 Y676	G582-R586 WeakPolarHBondContact O-CB 3.44Å; G582-R586 VanDerWaalsContact O-CG 3.3Å; G582-R586 WeakPolarHBondContact O-CG 3.3Å; G582-R586 PolarHBondContact O-N 2.8Å; F583-R586 PolarHBondContact O-N 3.09Å; K584-R586 PolarHBondContact O-N 3.3Å; R586-Y589 PolarHBondContact O-N 2.88Å; R586-V590 WeakPolarHBondContact O-CG2 3.22Å; R586-V590 PolarHBondContact O-N 2.83Å; R586-E628 IonicContact CZ-OE1 3.86Å; R586-E628 IonicContact CZ-OE2 3.33Å; R586-E628 IonicContact NH1-OE1 2.82Å; R586-E628 PolarHBondContact NH1-OE1 3.33Å; R586-E628 IonicContact NH2-OE1 3.48Å; R586-E628 PolarHBondContact NH2-OE1 3.1Å; R586-E628 IonicContact NH2-OE2 2.78Å; R586-E628 PolarHBondContact NH2-OE2 2.69Å; R586-Y676 HydrophobicContact CB-CD1 4.27Å; R586-Y676 HydrophobicContact CB-CD2 4.08Å; R586-Y676 HydrophobicContact CB-CE1 4.12Å; R586-Y676 HydrophobicContact CB-CE2 3.91Å; R586-Y676 HydrophobicContact CB-CG 4.26Å
587	R	87.7	Confident	81.9	Confident	45 Å²	45	67.1 Å²	67.1	17%	0.17	32%	0.317	C	S	.	.	H	α-helix	trans	-58.4	-51.9	173.9	-175.9	-167.7	69.5	-176.8	2.7	111.2	F583 K584 Y589 V590 K591 Y673 T677 L680	F583-R587 WeakPolarHBondContact O-CB 3.43Å; F583-R587 PolarHBondContact O-N 2.76Å; K584-R587 WeakPolarHBondContact O-CB 3.16Å; K584-R587 PolarHBondContact O-N 3.18Å; R587-Y589 VanDerWaalsContact C-N 3.3Å; R587-Y589 PolarHBondContact O-N 3.26Å; R587-V590 PolarHBondContact O-N 2.89Å; R587-K591 PolarHBondContact O-N 3.41Å; R587-Y673 HydrophobicContact CG-CD2 3.6Å; R587-Y673 HydrophobicContact CG-CE2 3.41Å; R587-Y673 VanDerWaalsContact CG-CE2 3.41Å; R587-Y673 HydrophobicContact CG-CG 4.48Å; R587-T677 VanDerWaalsContact CD-OG1 3.26Å; R587-T677 WeakPolarHBondContact CD-OG1 3.27Å; R587-L680 VanDerWaalsContact NH1-CD1 3.27Å
588	E	85.1	Confident	80.4	Confident	63 Å²	63	61 Å²	61	29%	0.294	31%	0.305	S	S	.	.	H	α-helix	trans	-63.4	-37.7	179	-64.4	-45.7	129.2	0	0	112	K584 W585 K591 L592	K584-E588 WeakPolarHBondContact O-CG 3.35Å; K584-E588 PolarHBondContact O-N 3.07Å; W585-E588 PolarHBondContact O-N 3.06Å; E588-K591 PolarHBondContact O-N 2.99Å; E588-L592 WeakPolarHBondContact O-CB 3.47Å; E588-L592 PolarHBondContact O-N 3.23Å
589	Y	86.9	Confident	78.2	Confident	97 Å²	97	61.1 Å²	61.1	38%	0.38	32%	0.316	S	S	.	.	H	α-helix	trans	-65.9	-44.3	177.3	-174.5	-109.5	0	0	0	112.4	W585 R586 R587 K591 L592 L593 L621 L625	W585-Y589 WeakPolarHBondContact O-CB 3.31Å; W585-Y589 PolarHBondContact O-N 3.05Å; R586-Y589 PolarHBondContact O-N 2.88Å; R587-Y589 VanDerWaalsContact C-N 3.3Å; R587-Y589 PolarHBondContact O-N 3.26Å; Y589-K591 VanDerWaalsContact C-N 3.31Å; Y589-K591 PolarHBondContact O-N 3Å; Y589-L592 WeakPolarHBondContact O-CB 3.5Å; Y589-L592 PolarHBondContact O-N 2.91Å; Y589-L593 HydrophobicContact CD1-CD1 3.92Å; Y589-L593 HydrophobicContact CD1-CG 4.36Å; Y589-L593 HydrophobicContact CE1-CD1 3.5Å; Y589-L593 VanDerWaalsContact CE1-CD1 3.5Å; Y589-L593 HydrophobicContact CE1-CD2 4.43Å; Y589-L593 HydrophobicContact CE1-CG 4.01Å; Y589-L593 WeakPolarHBondContact O-CG 3.49Å; Y589-L593 PolarHBondContact O-N 3Å; Y589-L621 HydrophobicContact CE1-CD2 3.56Å; Y589-L621 HydrophobicContact CE1-CG 4.35Å; Y589-L621 WeakPolarHBondContact OH-CD2 3.21Å; Y589-L625 HydrophobicContact CD1-CD1 4.45Å
590	V	87.1	Confident	76.2	Confident	1 Å²	1	59 Å²	59	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-61.5	-40.9	174.5	170.2	0	0	0	0	111.2	R586 R587 L593 Q594 L625 C669 L672 Y676	R586-V590 WeakPolarHBondContact O-CG2 3.22Å; R586-V590 PolarHBondContact O-N 2.83Å; R587-V590 PolarHBondContact O-N 2.89Å; V590-L593 WeakPolarHBondContact O-CB 3.05Å; V590-L593 PolarHBondContact O-N 3.28Å; V590-Q594 WeakPolarHBondContact O-CB 3.08Å; V590-Q594 PolarHBondContact O-N 3.35Å; V590-L625 HydrophobicContact CG2-CD1 4.19Å; V590-C669 HydrophobicContact CG1-CB 4.15Å; V590-C669 WeakPolarHBondContact CG1-O 3.45Å; V590-L672 HydrophobicContact CG1-CB 3.97Å; V590-L672 HydrophobicContact CG2-CB 4.24Å; V590-L672 HydrophobicContact CG2-CD1 4.48Å; V590-Y676 HydrophobicContact CG2-CD2 4.19Å; V590-Y676 HydrophobicContact CG2-CE2 3.87Å
591	K	82	Confident	74	Confident	57 Å²	57	63.5 Å²	63.5	25%	0.248	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-42.9	176	-170	178.8	-175	172.7	0	112	R587 E588 Y589 Q594 A595 Y673 D952	R587-K591 PolarHBondContact O-N 3.41Å; E588-K591 PolarHBondContact O-N 2.99Å; Y589-K591 VanDerWaalsContact C-N 3.31Å; Y589-K591 PolarHBondContact O-N 3Å; K591-Q594 PolarHBondContact O-N 3.13Å; K591-A595 PolarHBondContact O-N 3.44Å; K591-Y673 HydrophobicContact CB-CD2 4.06Å; K591-Y673 HydrophobicContact CB-CE2 4.06Å; K591-Y673 HydrophobicContact CD-CE2 3.93Å; K591-Y673 HydrophobicContact CG-CE2 4.29Å; K591-D952 WeakPolarHBondContact CE-OD2 3.44Å; K591-D952 IonicContact NZ-OD2 3.88Å; K591-D952 PolarHBondContact NZ-OD2 3.19Å
592	L	79.1	Confident	71.5	Confident	103 Å²	103	63.9 Å²	63.9	54%	0.539	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-44.8	174.2	-177.8	66.4	0	0	0	111.3	E588 Y589 Q594 A595 C596	E588-L592 WeakPolarHBondContact O-CB 3.47Å; E588-L592 PolarHBondContact O-N 3.23Å; Y589-L592 WeakPolarHBondContact O-CB 3.5Å; Y589-L592 PolarHBondContact O-N 2.91Å; L592-Q594 VanDerWaalsContact C-N 3.34Å; L592-Q594 PolarHBondContact O-N 3.36Å; L592-A595 PolarHBondContact O-N 3.08Å; L592-C596 PolarHBondContact O-N 3.03Å; L592-C596 PolarHBondContact O-SG 3.44Å
593	L	78	Confident	68.9	Low	8 Å²	8	67.8 Å²	67.8	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-59.2	-44.9	175.5	-72.9	177.2	0	0	0	111.7	Y589 V590 A595 C596 L597 Y618 L621 I622	Y589-L593 HydrophobicContact CD1-CD1 3.92Å; Y589-L593 HydrophobicContact CD1-CG 4.36Å; Y589-L593 HydrophobicContact CE1-CD1 3.5Å; Y589-L593 VanDerWaalsContact CE1-CD1 3.5Å; Y589-L593 HydrophobicContact CE1-CD2 4.43Å; Y589-L593 HydrophobicContact CE1-CG 4.01Å; Y589-L593 WeakPolarHBondContact O-CG 3.49Å; Y589-L593 PolarHBondContact O-N 3Å; V590-L593 WeakPolarHBondContact O-CB 3.05Å; V590-L593 PolarHBondContact O-N 3.28Å; L593-A595 VanDerWaalsContact C-N 3.29Å; L593-A595 PolarHBondContact O-N 3Å; L593-C596 PolarHBondContact O-N 3Å; L593-C596 VanDerWaalsContact O-N 3.15Å; L593-L597 WeakPolarHBondContact O-CD1 3.05Å; L593-L597 VanDerWaalsContact O-CG 3.3Å; L593-L597 WeakPolarHBondContact O-CG 3.45Å; L593-L597 PolarHBondContact O-N 3.04Å; L593-Y618 HydrophobicContact CD2-CD1 3.44Å; L593-Y618 VanDerWaalsContact CD2-CD1 3.44Å; L593-Y618 HydrophobicContact CD2-CE1 3.68Å; L593-Y618 HydrophobicContact CD2-CG 4.31Å; L593-L621 HydrophobicContact CD1-CD2 4.44Å; L593-I622 HydrophobicContact CD1-CG1 4.2Å
594	Q	76.4	Confident	66.9	Low	23 Å²	23	72.3 Å²	72.3	11%	0.107	38%	0.381	C	S	.	.	H	α-helix	trans	-60.9	-37.6	176.5	-168.3	179.4	6.7	0	0	112.4	V590 K591 L592 H666 C669	V590-Q594 WeakPolarHBondContact O-CB 3.08Å; V590-Q594 PolarHBondContact O-N 3.35Å; K591-Q594 PolarHBondContact O-N 3.13Å; L592-Q594 VanDerWaalsContact C-N 3.34Å; L592-Q594 PolarHBondContact O-N 3.36Å; Q594-H666 PolarHBondContact O-CE1 3.15Å; Q594-C669 HydrophobicContact CB-CB 4.05Å; Q594-C669 HydrophobicContact CG-CB 4.12Å
595	A	68.3	Low	64.6	Low	35 Å²	35	74.9 Å²	74.9	29%	0.289	39%	0.394	S	S	.	.	H	α-helix	trans	-71.2	-31.4	175.2	0	0	0	0	0	113	K591 L592 L593 D950	K591-A595 PolarHBondContact O-N 3.44Å; L592-A595 PolarHBondContact O-N 3.08Å; L593-A595 VanDerWaalsContact C-N 3.29Å; L593-A595 PolarHBondContact O-N 3Å; A595-D950 HydrophobicContact CB-CB 4.07Å
596	C	65.6	Low	62	Low	60 Å²	60	73.8 Å²	73.8	41%	0.405	40%	0.396	S	S	.	.	H	α-helix	trans	-84.6	-22.7	179.3	-67.9	0	0	0	0	113.9	L592 L593 G598 A599	L592-C596 PolarHBondContact O-N 3.03Å; L592-C596 PolarHBondContact O-SG 3.44Å; L593-C596 PolarHBondContact O-N 3Å; L593-C596 VanDerWaalsContact O-N 3.15Å; C596-G598 PolarHBondContact O-N 3.38Å; C596-A599 PolarHBondContact O-N 3.03Å
597	L	62.9	Low	59.4	Low	25 Å²	25	77.1 Å²	77.1	13%	0.131	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	95.9	174.8	-81.2	156.3	0	0	0	109.6	L593 I622 I665 H666	L593-L597 WeakPolarHBondContact O-CD1 3.05Å; L593-L597 VanDerWaalsContact O-CG 3.3Å; L593-L597 WeakPolarHBondContact O-CG 3.45Å; L593-L597 PolarHBondContact O-N 3.04Å; L597-I622 HydrophobicContact CD1-CD1 4.22Å; L597-I665 HydrophobicContact CD1-CG2 3.45Å; L597-I665 VanDerWaalsContact CD1-CG2 3.45Å; L597-I665 HydrophobicContact CD2-CG2 3.73Å; L597-I665 HydrophobicContact CG-CG2 4.26Å; L597-H666 VanDerWaalsContact CB-CE1 3.48Å; L597-H666 WeakPolarHBondContact CB-CE1 3.48Å
598	G	51.8	Low	56.9	Low	36 Å²	36	77.5 Å²	77.5	37%	0.371	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	118.4	-14.1	-177.3	0	0	0	0	0	115.9	C596 L947	C596-G598 PolarHBondContact O-N 3.38Å; G598-L947 VanDerWaalsContact O-CD1 3.25Å; G598-L947 WeakPolarHBondContact O-CD1 3.43Å
599	A	40.2	Very low	54.2	Low	78 Å²	78	81.8 Å²	81.8	65%	0.645	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-79.7	124.6	-179.6	0	0	0	0	0	111.8	C596	C596-A599 PolarHBondContact O-N 3.03Å
600	T	41.5	Very low	51.9	Low	46 Å²	46	81.4 Å²	81.4	28%	0.282	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-91.7	147.8	-174.1	46.5	0	0	0	0	114.3	F610	T600-F610 HydrophobicContact CG2-CB 4.38Å; T600-F610 HydrophobicContact CG2-CD1 3.4Å; T600-F610 HydrophobicContact CG2-CE1 3.94Å; T600-F610 HydrophobicContact CG2-CG 4.16Å
601	Q	36.8	Very low	49.4	Very low	162 Å²	162	84.1 Å²	84.1	76%	0.757	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-97.4	149.8	157.6	-135.7	177.5	28	0	0	109.9
602	T	34.8	Very low	47.5	Very low	85 Å²	85	86.1 Å²	86.1	52%	0.521	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-97.8	120.2	-173.2	46.2	0	0	0	0	110.8	E930	T602-E930 WeakPolarHBondContact CG2-OE2 3.14Å
603	D	32.4	Very low	45.6	Very low	111 Å²	111	89.8 Å²	89.8	59%	0.594	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-88.2	127.8	170.2	-171.5	-24.6	0	0	0	109.4	H605	D603-H605 VanDerWaalsContact C-N 3.28Å; D603-H605 PolarHBondContact O-N 3.47Å; D603-H605 PolarHBondContact OD1-N 2.92Å
604	P	44.2	Very low	44.1	Very low	117 Å²	117	90.5 Å²	90.5	76%	0.76	49%	0.486	S	S	*	.	S	Bend	trans	-64.4	-19.9	-175.4	20.9	-32.3	0	0	0	115.8
605	H	37.1	Very low	43.1	Very low	161 Å²	161	91.1 Å²	91.1	75%	0.745	49%	0.488	S	S	*	.	S	Bend	trans	-98.9	-31.4	-173.3	-76.8	-66.6	0	0	0	115.6	D603	D603-H605 VanDerWaalsContact C-N 3.28Å; D603-H605 PolarHBondContact O-N 3.47Å; D603-H605 PolarHBondContact OD1-N 2.92Å
606	H	34.6	Very low	42.9	Very low	156 Å²	156	94.7 Å²	94.7	72%	0.722	50%	0.503	S	S	*	.	S	Bend	trans	-132.5	95.5	180	-76.4	28.8	0	0	0	110.1	L608	H606-L608 PolarHBondContact O-N 3.47Å
607	R	35.3	Very low	42.9	Very low	151 Å²	151	101.7 Å²	101.7	57%	0.57	52%	0.52	S	S	*	.	S	Bend	trans	-50.8	116.4	176.7	-81.8	176.2	163.1	130.7	1.5	111.3	E930 S932	R607-E930 PolarHBondContact NE-O 2.94Å; R607-E930 PolarHBondContact NH2-O 2.96Å; R607-S932 VanDerWaalsContact CZ-OG 3.31Å; R607-S932 PolarHBondContact NH1-OG 3.22Å
608	L	35.3	Very low	43.3	Very low	53 Å²	53	104.6 Å²	104.6	28%	0.277	53%	0.53	S	S	.	.			trans	79.1	86.7	170.6	-62.2	161.3	0	0	0	117.1	H606 F610 S936	H606-L608 PolarHBondContact O-N 3.47Å; L608-F610 HydrophobicContact CD2-CE2 4.48Å; L608-F610 HydrophobicContact CD2-CZ 4.41Å; L608-S936 VanDerWaalsContact CD1-CB 3.46Å
609	M	28.5	Very low	44.2	Very low	152 Å²	152	105.9 Å²	105.9	75%	0.749	53%	0.526	S	S	*	.			trans	-114.8	121	142.8	-75.3	-68	-71.2	0	0	108	S611	M609-S611 PolarHBondContact O-N 2.67Å
610	F	39.2	Very low	46.1	Very low	89 Å²	89	106.5 Å²	106.5	39%	0.39	52%	0.518	S	S	.	.			trans	-69.5	79.8	162.1	-66.8	-84.9	0	0	0	106.7	T600 L608 D612 A943	T600-F610 HydrophobicContact CG2-CB 4.38Å; T600-F610 HydrophobicContact CG2-CD1 3.4Å; T600-F610 HydrophobicContact CG2-CE1 3.94Å; T600-F610 HydrophobicContact CG2-CG 4.16Å; L608-F610 HydrophobicContact CD2-CE2 4.48Å; L608-F610 HydrophobicContact CD2-CZ 4.41Å; F610-D612 PolarHBondContact O-N 2.85Å; F610-A943 HydrophobicContact CD1-CB 4.46Å; F610-A943 HydrophobicContact CE1-CB 3.42Å; F610-A943 VanDerWaalsContact CE1-CB 3.42Å; F610-A943 HydrophobicContact CE2-CB 4.18Å; F610-A943 HydrophobicContact CZ-CB 3.25Å
611	S	34.1	Very low	48	Very low	59 Å²	59	106.7 Å²	106.7	41%	0.413	52%	0.517	S	S	.	.			trans	-78.5	120.6	176	71	0	0	0	0	107.9	M609 Y613	M609-S611 PolarHBondContact O-N 2.67Å; S611-Y613 PolarHBondContact O-N 3.06Å
612	D	41.9	Very low	50.2	Low	99 Å²	99	99 Å²	99	53%	0.529	48%	0.482	S	S	.	.			trans	-52.8	55.9	162.7	-87.5	-18.4	0	0	0	111.7	F610 G614 K615	F610-D612 PolarHBondContact O-N 2.85Å; D612-G614 PolarHBondContact O-N 2.86Å; D612-K615 HydrophobicContact CB-CB 3.68Å; D612-K615 HydrophobicContact CB-CD 4Å; D612-K615 HydrophobicContact CB-CG 4.32Å; D612-K615 WeakPolarHBondContact O-CB 3.16Å; D612-K615 PolarHBondContact O-N 2.87Å; D612-K615 IonicContact OD1-NZ 2.64Å; D612-K615 VanDerWaalsContact OD2-CD 3.32Å; D612-K615 WeakPolarHBondContact OD2-CD 3.3Å; D612-K615 VanDerWaalsContact OD2-CE 3.27Å; D612-K615 WeakPolarHBondContact OD2-CE 3.33Å; D612-K615 IonicContact OD2-NZ 2.66Å; D612-K615 PolarHBondContact OD2-NZ 3.45Å
613	Y	38.3	Very low	52.6	Low	179 Å²	179	96.2 Å²	96.2	70%	0.702	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	115.8	-169.5	-158.2	-85.9	0	0	0	109	S611 K615 Y618	S611-Y613 PolarHBondContact O-N 3.06Å; Y613-K615 PolarHBondContact O-N 3.46Å; Y613-Y618 WeakPolarHBondContact O-CD2 3.38Å; Y613-Y618 WeakPolarHBondContact O-CE2 3.49Å
614	G	46.2	Very low	55.2	Low	24 Å²	24	97 Å²	97	25%	0.247	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	19.4	-176.7	0	0	0	0	0	114.4	D612 D616 R617 Y618	D612-G614 PolarHBondContact O-N 2.86Å; G614-D616 PolarHBondContact O-N 3.39Å; G614-D616 VanDerWaalsContact O-N 3.16Å; G614-R617 CarbonylContact O-C 3.58Å; G614-R617 WeakPolarHBondContact O-CA 3.32Å; G614-R617 WeakPolarHBondContact O-CB 3.45Å; G614-R617 PolarHBondContact O-N 3.1Å; G614-Y618 VanDerWaalsContact O-CD2 3.29Å; G614-Y618 WeakPolarHBondContact O-CD2 3.44Å; G614-Y618 PolarHBondContact O-N 3.48Å
615	K	56.4	Low	57.3	Low	35 Å²	35	92.3 Å²	92.3	15%	0.152	43%	0.434	C	S	.	.	H	α-helix	trans	-50.8	-42	177.7	-169.5	-163.2	-139.6	174.6	0	111.6	D612 Y613 Y618 K619 E661 I665	D612-K615 HydrophobicContact CB-CB 3.68Å; D612-K615 HydrophobicContact CB-CD 4Å; D612-K615 HydrophobicContact CB-CG 4.32Å; D612-K615 WeakPolarHBondContact O-CB 3.16Å; D612-K615 PolarHBondContact O-N 2.87Å; D612-K615 IonicContact OD1-NZ 2.64Å; D612-K615 VanDerWaalsContact OD2-CD 3.32Å; D612-K615 WeakPolarHBondContact OD2-CD 3.3Å; D612-K615 VanDerWaalsContact OD2-CE 3.27Å; D612-K615 WeakPolarHBondContact OD2-CE 3.33Å; D612-K615 IonicContact OD2-NZ 2.66Å; D612-K615 PolarHBondContact OD2-NZ 3.45Å; Y613-K615 PolarHBondContact O-N 3.46Å; K615-Y618 PolarHBondContact O-N 2.98Å; K615-K619 WeakPolarHBondContact O-CA 3.31Å; K615-K619 WeakPolarHBondContact O-CB 3.41Å; K615-K619 PolarHBondContact O-N 2.85Å; K615-E661 WeakPolarHBondContact CE-OE2 3.29Å; K615-E661 IonicContact NZ-OE2 3.86Å; K615-E661 PolarHBondContact NZ-OE2 3.41Å; K615-I665 HydrophobicContact CG-CD1 4.37Å
616	D	63	Low	59.8	Low	111 Å²	111	84.6 Å²	84.6	59%	0.594	40%	0.398	S	S	*	.	H	α-helix	trans	-64.6	-40.3	173.7	-67.3	-37	0	0	0	112.5	G614 N620	G614-D616 PolarHBondContact O-N 3.39Å; G614-D616 VanDerWaalsContact O-N 3.16Å; D616-N620 WeakPolarHBondContact O-CB 3.24Å; D616-N620 PolarHBondContact O-N 3.16Å; D616-N620 PolarHBondContact O-ND2 2.92Å; D616-N620 VanDerWaalsContact O-ND2 3.16Å; D616-N620 PolarHBondContact O-OD1 3.41Å
617	R	67.1	Low	62.3	Low	206 Å²	206	80.9 Å²	80.9	78%	0.777	38%	0.384	S	S	*	.	H	α-helix	trans	-64.7	-48.9	175.4	-71.6	-172	178.4	-177.5	0	112.1	G614 N620 L621	G614-R617 CarbonylContact O-C 3.58Å; G614-R617 WeakPolarHBondContact O-CA 3.32Å; G614-R617 WeakPolarHBondContact O-CB 3.45Å; G614-R617 PolarHBondContact O-N 3.1Å; R617-N620 PolarHBondContact O-N 3.45Å; R617-L621 VanDerWaalsContact O-CB 3.27Å; R617-L621 WeakPolarHBondContact O-CB 3.4Å; R617-L621 PolarHBondContact O-N 2.77Å
618	Y	69.7	Low	64.8	Low	87 Å²	87	76.7 Å²	76.7	34%	0.341	37%	0.37	S	S	.	.	H	α-helix	trans	-67.4	-39.9	178.9	-63.6	-51	0	0	0	111.5	L593 Y613 G614 K615 L621 I622	L593-Y618 HydrophobicContact CD2-CD1 3.44Å; L593-Y618 VanDerWaalsContact CD2-CD1 3.44Å; L593-Y618 HydrophobicContact CD2-CE1 3.68Å; L593-Y618 HydrophobicContact CD2-CG 4.31Å; Y613-Y618 WeakPolarHBondContact O-CD2 3.38Å; Y613-Y618 WeakPolarHBondContact O-CE2 3.49Å; G614-Y618 VanDerWaalsContact O-CD2 3.29Å; G614-Y618 WeakPolarHBondContact O-CD2 3.44Å; G614-Y618 PolarHBondContact O-N 3.48Å; K615-Y618 PolarHBondContact O-N 2.98Å; Y618-L621 PolarHBondContact O-N 2.71Å; Y618-I622 VanDerWaalsContact O-CB 3.29Å; Y618-I622 WeakPolarHBondContact O-CB 3.49Å; Y618-I622 WeakPolarHBondContact O-CD1 3.44Å; Y618-I622 WeakPolarHBondContact O-CG1 3.5Å; Y618-I622 PolarHBondContact O-N 2.8Å
619	K	71.5	Confident	67.4	Low	62 Å²	62	74.2 Å²	74.2	27%	0.27	36%	0.358	S	S	.	.	H	α-helix	trans	-62.1	-46.1	174	179	-177.3	178.2	179.4	0	111.2	K615 L621 I622 S623 M639 E661	K615-K619 WeakPolarHBondContact O-CA 3.31Å; K615-K619 WeakPolarHBondContact O-CB 3.41Å; K615-K619 PolarHBondContact O-N 2.85Å; K619-L621 VanDerWaalsContact C-N 3.34Å; K619-I622 PolarHBondContact O-N 2.99Å; K619-S623 VanDerWaalsContact O-CB 3.27Å; K619-S623 WeakPolarHBondContact O-CB 3.41Å; K619-S623 PolarHBondContact O-N 3.33Å; K619-M639 HydrophobicContact CG-CE 3.98Å; K619-E661 WeakPolarHBondContact CD-OE1 3.49Å; K619-E661 VanDerWaalsContact CE-OE1 3.31Å; K619-E661 WeakPolarHBondContact CE-OE1 3.38Å; K619-E661 IonicContact NZ-OE1 2.78Å; K619-E661 PolarHBondContact NZ-OE1 3.25Å
620	N	79.1	Confident	70.2	Confident	91 Å²	91	70.8 Å²	70.8	49%	0.487	34%	0.337	S	S	.	.	H	α-helix	trans	-62.4	-44.9	176.1	-69.5	-14.2	0	0	0	110.5	D616 R617 S623 E624	D616-N620 WeakPolarHBondContact O-CB 3.24Å; D616-N620 PolarHBondContact O-N 3.16Å; D616-N620 PolarHBondContact O-ND2 2.92Å; D616-N620 VanDerWaalsContact O-ND2 3.16Å; D616-N620 PolarHBondContact O-OD1 3.41Å; R617-N620 PolarHBondContact O-N 3.45Å; N620-S623 WeakPolarHBondContact O-CB 3.49Å; N620-S623 PolarHBondContact O-N 2.81Å; N620-E624 WeakPolarHBondContact O-CG 3.36Å; N620-E624 PolarHBondContact O-N 2.76Å
621	L	82.2	Confident	72.6	Confident	51 Å²	51	75.9 Å²	75.9	27%	0.267	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-43.8	178.3	-173.3	61.2	0	0	0	112.6	Y589 L593 R617 Y618 K619 S623 E624 L625	Y589-L621 HydrophobicContact CE1-CD2 3.56Å; Y589-L621 HydrophobicContact CE1-CG 4.35Å; Y589-L621 WeakPolarHBondContact OH-CD2 3.21Å; L593-L621 HydrophobicContact CD1-CD2 4.44Å; R617-L621 VanDerWaalsContact O-CB 3.27Å; R617-L621 WeakPolarHBondContact O-CB 3.4Å; R617-L621 PolarHBondContact O-N 2.77Å; Y618-L621 PolarHBondContact O-N 2.71Å; K619-L621 VanDerWaalsContact C-N 3.34Å; L621-S623 VanDerWaalsContact C-N 3.32Å; L621-E624 PolarHBondContact O-N 2.84Å; L621-L625 HydrophobicContact CG-CD1 4.44Å; L621-L625 WeakPolarHBondContact O-CB 3.28Å; L621-L625 VanDerWaalsContact O-CG 3.3Å; L621-L625 WeakPolarHBondContact O-CG 3.27Å; L621-L625 PolarHBondContact O-N 3.34Å
622	I	83.3	Confident	75.1	Confident	1 Å²	1	79.2 Å²	79.2	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-63	-41.8	174.2	-70.8	163.9	0	0	0	109.6	L593 L597 Y618 K619 L625 L626 I665 C669 L672	L593-I622 HydrophobicContact CD1-CG1 4.2Å; L597-I622 HydrophobicContact CD1-CD1 4.22Å; Y618-I622 VanDerWaalsContact O-CB 3.29Å; Y618-I622 WeakPolarHBondContact O-CB 3.49Å; Y618-I622 WeakPolarHBondContact O-CD1 3.44Å; Y618-I622 WeakPolarHBondContact O-CG1 3.5Å; Y618-I622 PolarHBondContact O-N 2.8Å; K619-I622 PolarHBondContact O-N 2.99Å; I622-L625 PolarHBondContact O-N 3.39Å; I622-L626 WeakPolarHBondContact O-CB 3.46Å; I622-L626 PolarHBondContact O-N 3.49Å; I622-I665 HydrophobicContact CD1-CG2 3.64Å; I622-C669 WeakPolarHBondContact CD1-SG 3.49Å; I622-L672 HydrophobicContact CG2-CD1 4.12Å
623	S	84.9	Confident	77.2	Confident	25 Å²	25	75.7 Å²	75.7	18%	0.175	34%	0.341	C	S	.	.	H	α-helix	trans	-61.8	-43.7	176	-164.7	0	0	0	0	111.8	K619 N620 L621 L626 D627	K619-S623 VanDerWaalsContact O-CB 3.27Å; K619-S623 WeakPolarHBondContact O-CB 3.41Å; K619-S623 PolarHBondContact O-N 3.33Å; N620-S623 WeakPolarHBondContact O-CB 3.49Å; N620-S623 PolarHBondContact O-N 2.81Å; L621-S623 VanDerWaalsContact C-N 3.32Å; S623-L626 PolarHBondContact O-N 3Å; S623-D627 WeakPolarHBondContact O-CB 3.38Å; S623-D627 VanDerWaalsContact O-CG 3.26Å; S623-D627 PolarHBondContact O-N 2.98Å
624	E	87.1	Confident	79.5	Confident	127 Å²	127	72 Å²	72	59%	0.593	34%	0.339	S	S	*	.	H	α-helix	trans	-63.6	-45.3	176.8	-75	176.1	-165.7	0	0	111.9	N620 L621 L626 D627 E628	N620-E624 WeakPolarHBondContact O-CG 3.36Å; N620-E624 PolarHBondContact O-N 2.76Å; L621-E624 PolarHBondContact O-N 2.84Å; E624-L626 VanDerWaalsContact C-N 3.32Å; E624-L626 PolarHBondContact O-N 3.45Å; E624-D627 PolarHBondContact O-N 3.28Å; E624-E628 PolarHBondContact O-N 2.89Å
625	L	89	Confident	81.2	Confident	19 Å²	19	75.6 Å²	75.6	10%	0.099	36%	0.36	C	S	.	.	H	α-helix	trans	-62.8	-40.2	175.5	-71.1	173.3	0	0	0	111.5	Y589 V590 L621 I622 E628 A629 L672	Y589-L625 HydrophobicContact CD1-CD1 4.45Å; V590-L625 HydrophobicContact CG2-CD1 4.19Å; L621-L625 HydrophobicContact CG-CD1 4.44Å; L621-L625 WeakPolarHBondContact O-CB 3.28Å; L621-L625 VanDerWaalsContact O-CG 3.3Å; L621-L625 WeakPolarHBondContact O-CG 3.27Å; L621-L625 PolarHBondContact O-N 3.34Å; I622-L625 PolarHBondContact O-N 3.39Å; L625-E628 PolarHBondContact O-N 3.29Å; L625-A629 WeakPolarHBondContact O-CB 3.39Å; L625-A629 PolarHBondContact O-N 3.13Å; L625-L672 HydrophobicContact CB-CD1 4.07Å
626	L	88.7	Confident	82.7	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-65	-44	176.1	-161.1	79.9	0	0	0	111	I622 S623 E624 E628 A629 R630 P637 M639 L672	I622-L626 WeakPolarHBondContact O-CB 3.46Å; I622-L626 PolarHBondContact O-N 3.49Å; S623-L626 PolarHBondContact O-N 3Å; E624-L626 VanDerWaalsContact C-N 3.32Å; E624-L626 PolarHBondContact O-N 3.45Å; L626-E628 PolarHBondContact O-N 3.28Å; L626-A629 PolarHBondContact O-N 3.41Å; L626-R630 VanDerWaalsContact O-CB 3.3Å; L626-R630 WeakPolarHBondContact O-CB 3.39Å; L626-R630 WeakPolarHBondContact O-CG 3.31Å; L626-R630 PolarHBondContact O-N 3.04Å; L626-P637 HydrophobicContact CD1-CG 4.33Å; L626-P637 WeakPolarHBondContact CD2-O 3.49Å; L626-P637 WeakPolarHBondContact CG-O 3.42Å; L626-M639 HydrophobicContact CD2-CG 4.04Å; L626-L672 HydrophobicContact CB-CD1 4.4Å; L626-L672 HydrophobicContact CD1-CD1 4.13Å; L626-L672 HydrophobicContact CD1-CD2 4.09Å; L626-L672 HydrophobicContact CD1-CG 3.77Å
627	D	87.9	Confident	83.6	Confident	78 Å²	78	69.1 Å²	69.1	42%	0.417	33%	0.328	S	S	.	.	H	α-helix	trans	-67.7	-33.6	177.3	-72.9	-24.1	0	0	0	112.3	S623 E624 R631	S623-D627 WeakPolarHBondContact O-CB 3.38Å; S623-D627 VanDerWaalsContact O-CG 3.26Å; S623-D627 PolarHBondContact O-N 2.98Å; E624-D627 PolarHBondContact O-N 3.28Å; D627-R631 PolarHBondContact O-N 3.01Å; D627-R631 PolarHBondContact O-NE 3.36Å
628	E	87.3	Confident	84.2	Confident	62 Å²	62	60.6 Å²	60.6	29%	0.29	30%	0.3	S	S	.	.	H	α-helix	trans	-65.7	-47.2	169.1	-168.7	-171.7	158.8	0	0	111.7	R586 E624 L625 L626 R630 R631	R586-E628 IonicContact CZ-OE1 3.86Å; R586-E628 IonicContact CZ-OE2 3.33Å; R586-E628 IonicContact NH1-OE1 2.82Å; R586-E628 PolarHBondContact NH1-OE1 3.33Å; R586-E628 IonicContact NH2-OE1 3.48Å; R586-E628 PolarHBondContact NH2-OE1 3.1Å; R586-E628 IonicContact NH2-OE2 2.78Å; R586-E628 PolarHBondContact NH2-OE2 2.69Å; E624-E628 PolarHBondContact O-N 2.89Å; L625-E628 PolarHBondContact O-N 3.29Å; L626-E628 PolarHBondContact O-N 3.28Å; E628-R630 VanDerWaalsContact C-N 3.34Å; E628-R630 PolarHBondContact O-N 3.02Å; E628-R631 WeakPolarHBondContact O-CB 3.22Å; E628-R631 PolarHBondContact O-N 2.95Å
629	A	89.4	Confident	84.6	Confident	2 Å²	2	57.6 Å²	57.6	2%	0.017	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-39.7	179.1	0	0	0	0	0	111.8	L625 L626 R631 K632 D633 L636 L672 F675	L625-A629 WeakPolarHBondContact O-CB 3.39Å; L625-A629 PolarHBondContact O-N 3.13Å; L626-A629 PolarHBondContact O-N 3.41Å; A629-R631 PolarHBondContact O-N 3.11Å; A629-K632 WeakPolarHBondContact O-CA 3.23Å; A629-K632 PolarHBondContact O-N 3.33Å; A629-D633 PolarHBondContact O-N 3.08Å; A629-L636 HydrophobicContact CB-CD1 3.45Å; A629-L636 VanDerWaalsContact CB-CD1 3.45Å; A629-L672 HydrophobicContact CB-CD2 3.74Å; A629-F675 HydrophobicContact CB-CD1 3.66Å; A629-F675 HydrophobicContact CB-CE1 3.57Å; A629-F675 HydrophobicContact CB-CG 4.24Å; A629-F675 HydrophobicContact CB-CZ 4.07Å
630	R	88.8	Confident	84.8	Confident	80 Å²	80	60.9 Å²	60.9	30%	0.302	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-26.2	176.6	-77.9	173.3	71.3	104.3	9.8	114	L626 E628 K632 D633 L636 P637	L626-R630 VanDerWaalsContact O-CB 3.3Å; L626-R630 WeakPolarHBondContact O-CB 3.39Å; L626-R630 WeakPolarHBondContact O-CG 3.31Å; L626-R630 PolarHBondContact O-N 3.04Å; E628-R630 VanDerWaalsContact C-N 3.34Å; E628-R630 PolarHBondContact O-N 3.02Å; R630-K632 PolarHBondContact O-N 2.91Å; R630-D633 WeakPolarHBondContact CA-O 3.36Å; R630-D633 CarbonylContact O-C 3.53Å; R630-L636 HydrophobicContact CG-CB 3.84Å; R630-L636 PolarHBondContact NH1-O 3.09Å; R630-P637 PolarHBondContact NH1-O 3.09Å
631	R	88.7	Confident	84.5	Confident	196 Å²	196	61.2 Å²	61.2	74%	0.74	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-24.3	172.4	-75.7	178.9	-99.5	155.3	-8	112.4	D627 E628 A629	D627-R631 PolarHBondContact O-N 3.01Å; D627-R631 PolarHBondContact O-NE 3.36Å; E628-R631 WeakPolarHBondContact O-CB 3.22Å; E628-R631 PolarHBondContact O-N 2.95Å; A629-R631 PolarHBondContact O-N 3.11Å
632	K	85.7	Confident	84	Confident	128 Å²	128	61 Å²	61	56%	0.557	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-39.7	174.9	-67.3	-173.8	174.7	-171.3	0	112.8	A629 R630 F675	A629-K632 WeakPolarHBondContact O-CA 3.23Å; A629-K632 PolarHBondContact O-N 3.33Å; R630-K632 PolarHBondContact O-N 2.91Å; K632-F675 HydrophobicContact CB-CE2 4.24Å; K632-F675 HydrophobicContact CB-CZ 3.97Å; K632-F675 HydrophobicContact CD-CZ 4.21Å
633	D	87	Confident	83.4	Confident	26 Å²	26	71.6 Å²	71.6	14%	0.139	35%	0.353	C	S	.	.			trans	-127.6	89.6	179.9	-174.2	-5.5	0	0	0	110.4	A629 R630 S635 L636 F675 R678	A629-D633 PolarHBondContact O-N 3.08Å; R630-D633 WeakPolarHBondContact CA-O 3.36Å; R630-D633 CarbonylContact O-C 3.53Å; D633-S635 PolarHBondContact O-N 3.21Å; D633-S635 VanDerWaalsContact OD1-CB 3.32Å; D633-S635 WeakPolarHBondContact OD1-CB 3.47Å; D633-S635 PolarHBondContact OD1-N 3.23Å; D633-S635 VanDerWaalsContact OD1-N 3.16Å; D633-S635 PolarHBondContact OD1-OG 3.38Å; D633-L636 HydrophobicContact CB-CD1 4.17Å; D633-L636 HydrophobicContact CB-CG 4.26Å; D633-L636 PolarHBondContact O-N 2.96Å; D633-F675 HydrophobicContact CB-CD2 3.9Å; D633-F675 HydrophobicContact CB-CE2 3.69Å; D633-R678 IonicContact OD2-CZ 2.88Å; D633-R678 IonicContact OD2-NH1 3.72Å; D633-R678 PolarHBondContact OD2-NH1 2.82Å; D633-R678 IonicContact OD2-NH2 3.7Å; D633-R678 PolarHBondContact OD2-NH2 3.32Å
634	P	86.1	Confident	82.7	Confident	100 Å²	100	76.9 Å²	76.9	65%	0.649	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-10.5	-178.8	-22.5	33.1	0	0	0	114.7	L636	P634-L636 VanDerWaalsContact C-N 3.29Å
635	S	83.2	Confident	82	Confident	100 Å²	100	72.7 Å²	72.7	70%	0.699	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-13.7	179.7	76.8	0	0	0	0	113.6	D633	D633-S635 PolarHBondContact O-N 3.21Å; D633-S635 VanDerWaalsContact OD1-CB 3.32Å; D633-S635 WeakPolarHBondContact OD1-CB 3.47Å; D633-S635 PolarHBondContact OD1-N 3.23Å; D633-S635 VanDerWaalsContact OD1-N 3.16Å; D633-S635 PolarHBondContact OD1-OG 3.38Å
636	L	86.1	Confident	81.6	Confident	5 Å²	5	76.4 Å²	76.4	3%	0.026	39%	0.392	C	S	.	.	S	Bend	trans	-63.1	149.5	177.8	-70.7	171.3	0	0	0	111.9	A629 R630 D633 P634 Q671 F675	A629-L636 HydrophobicContact CB-CD1 3.45Å; A629-L636 VanDerWaalsContact CB-CD1 3.45Å; R630-L636 HydrophobicContact CG-CB 3.84Å; R630-L636 PolarHBondContact NH1-O 3.09Å; D633-L636 HydrophobicContact CB-CD1 4.17Å; D633-L636 HydrophobicContact CB-CG 4.26Å; D633-L636 PolarHBondContact O-N 2.96Å; P634-L636 VanDerWaalsContact C-N 3.29Å; L636-Q671 HydrophobicContact CD2-CB 4.09Å; L636-F675 HydrophobicContact CD1-CB 4.2Å; L636-F675 HydrophobicContact CD1-CD2 3.92Å; L636-F675 HydrophobicContact CD1-CE2 4.49Å; L636-F675 HydrophobicContact CD1-CG 3.97Å; L636-F675 HydrophobicContact CD2-CB 4.24Å
637	P	82.9	Confident	81.3	Confident	6 Å²	6	81.1 Å²	81.1	4%	0.039	41%	0.41	C	S	.	.			trans	-63.3	168.8	-178.2	27.8	-35.8	0	0	0	112.4	L626 R630 Y667 Q671	L626-P637 HydrophobicContact CD1-CG 4.33Å; L626-P637 WeakPolarHBondContact CD2-O 3.49Å; L626-P637 WeakPolarHBondContact CG-O 3.42Å; R630-P637 PolarHBondContact NH1-O 3.09Å; P637-Y667 HydrophobicContact CB-CD1 4.46Å; P637-Y667 HydrophobicContact CB-CE1 3.79Å; P637-Y667 HydrophobicContact CG-CD1 4.28Å; P637-Y667 HydrophobicContact CG-CE1 3.74Å; P637-Q671 HydrophobicContact CG-CB 4.13Å; P637-Q671 HydrophobicContact CG-CG 3.97Å
638	S	79.8	Confident	81	Confident	27 Å²	27	79.4 Å²	79.4	19%	0.189	40%	0.4	C	S	.	.			trans	-115.6	142.9	170	-173.6	0	0	0	0	109.2	I640 Y658	S638-I640 PolarHBondContact O-N 3.18Å; S638-I640 PolarHBondContact OG-N 3.45Å; S638-I640 VanDerWaalsContact OG-N 3.14Å; S638-Y658 PolarHBondContact O-OH 3.12Å
639	M	78.1	Confident	80.9	Confident	23 Å²	23	79.5 Å²	79.5	11%	0.113	40%	0.404	C	S	.	.	S	Bend	trans	-66.6	-21.3	168.5	-69.4	-56.2	-68.9	0	0	112.3	K619 L626 I664 I665 S668	K619-M639 HydrophobicContact CG-CE 3.98Å; L626-M639 HydrophobicContact CD2-CG 4.04Å; M639-I664 HydrophobicContact CE-CG2 4.16Å; M639-I664 HydrophobicContact SD-CG2 4Å; M639-I665 HydrophobicContact CE-CG1 3.71Å; M639-S668 PolarHBondContact SD-OG 3.29Å
640	I	76.5	Confident	80.7	Confident	131 Å²	131	80.7 Å²	80.7	67%	0.672	41%	0.41	S	S	*	.	S	Bend	trans	-87.4	121.1	176.5	-56.9	172.6	0	0	0	108.3	S638 P642	S638-I640 PolarHBondContact O-N 3.18Å; S638-I640 PolarHBondContact OG-N 3.45Å; S638-I640 VanDerWaalsContact OG-N 3.14Å; I640-P642 WeakPolarHBondContact O-CD 3.43Å
641	K	72.1	Confident	80.4	Confident	99 Å²	99	84.3 Å²	84.3	43%	0.43	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-54.2	119.9	177.5	-179.6	-179.7	174.4	176.5	0	110.7	D646 Y658	K641-D646 WeakPolarHBondContact CE-OD1 3.43Å; K641-D646 IonicContact NZ-OD1 3.27Å; K641-D646 PolarHBondContact NZ-OD1 2.85Å; K641-Y658 HydrophobicContact CB-CD1 3.98Å; K641-Y658 HydrophobicContact CB-CD2 4.32Å; K641-Y658 HydrophobicContact CB-CE1 4.31Å; K641-Y658 HydrophobicContact CB-CG 3.96Å; K641-Y658 HydrophobicContact CD-CG 4.43Å; K641-Y658 HydrophobicContact CG-CD1 4.47Å; K641-Y658 HydrophobicContact CG-CD2 3.95Å; K641-Y658 HydrophobicContact CG-CE2 4.42Å; K641-Y658 HydrophobicContact CG-CG 3.95Å
642	P	71.4	Confident	80.4	Confident	47 Å²	47	76.5 Å²	76.5	31%	0.305	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-69	148.2	173.2	28	-32.6	0	0	0	110.3	I640 T644 A645 Y658	I640-P642 WeakPolarHBondContact O-CD 3.43Å; P642-T644 PolarHBondContact O-N 2.74Å; P642-T644 VanDerWaalsContact O-N 3.09Å; P642-A645 HydrophobicContact CG-CB 4.14Å; P642-Y658 VanDerWaalsContact CD-OH 3.25Å; P642-Y658 WeakPolarHBondContact CD-OH 3.28Å; P642-Y658 HydrophobicContact CG-CE2 4.33Å
643	K	69.7	Low	80.5	Confident	222 Å²	222	70.8 Å²	70.8	97%	0.965	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.7	-178.4	-68.9	-174.6	179.1	-179	0	114
644	T	70.3	Confident	80.6	Confident	137 Å²	137	70.1 Å²	70.1	84%	0.84	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-12.5	-169.7	51.6	0	0	0	0	114.5	P642	P642-T644 PolarHBondContact O-N 2.74Å; P642-T644 VanDerWaalsContact O-N 3.09Å
645	A	73.2	Confident	80.7	Confident	38 Å²	38	67.8 Å²	67.8	31%	0.314	35%	0.352	S	S	.	.			trans	-137.5	129.5	-175	0	0	0	0	0	111.7	P642	P642-A645 HydrophobicContact CG-CB 4.14Å
646	D	80.4	Confident	80.8	Confident	97 Å²	97	64.6 Å²	64.6	52%	0.519	33%	0.326	S	S	.	.	S	Bend	trans	-85.8	-15.1	179	-71.5	-34.4	0	0	0	113.4	K641 Y658	K641-D646 WeakPolarHBondContact CE-OD1 3.43Å; K641-D646 IonicContact NZ-OD1 3.27Å; K641-D646 PolarHBondContact NZ-OD1 2.85Å; D646-Y658 WeakPolarHBondContact O-CD2 3.4Å; D646-Y658 PolarHBondContact O-N 3.27Å; D646-Y658 VanDerWaalsContact O-N 3.1Å
647	Y	82.2	Confident	80.5	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	-151.5	157.4	-177.3	54.2	-93.8	0	0	0	111.4	V649 K655 H656	Y647-V649 HydrophobicContact CD2-CG2 3.89Å; Y647-V649 HydrophobicContact CE2-CG2 3.76Å; Y647-K655 HydrophobicContact CD2-CB 3.79Å; Y647-K655 HydrophobicContact CD2-CD 4.03Å; Y647-K655 HydrophobicContact CD2-CG 3.72Å; Y647-K655 HydrophobicContact CE1-CD 4.37Å; Y647-K655 HydrophobicContact CE2-CB 4.3Å; Y647-K655 HydrophobicContact CE2-CD 3.69Å; Y647-K655 HydrophobicContact CE2-CG 3.72Å; Y647-K655 HydrophobicContact CG-CB 4.13Å; Y647-K655 HydrophobicContact CG-CG 4.43Å; Y647-H656 CarbonylContact C-O 3.56Å; Y647-H656 WeakPolarHBondContact CA-O 3.11Å; Y647-H656 WeakPolarHBondContact CB-O 3.26Å
648	H	82.4	Confident	80.2	Confident	43 Å²	43	67.5 Å²	67.5	20%	0.199	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	150.7	163.7	-83.2	-73.8	0	0	0	110.5	K655 H656 Y658 Y667	H648-K655 CarbonylContact O-C 3.53Å; H648-K655 VanDerWaalsContact O-CA 3.3Å; H648-K655 WeakPolarHBondContact O-CA 3.17Å; H648-H656 PolarHBondContact N-O 3.25Å; H648-H656 PolarHBondContact O-N 3.39Å; H648-Y658 AromaticContact CD2-CE2 3.67Å; H648-Y658 AromaticContact CD2-CZ 3.54Å; H648-Y658 PolarHBondContact CD2-OH 2.76Å; H648-Y658 VanDerWaalsContact CD2-OH 3.23Å; H648-Y658 AromaticContact NE2-CE2 3.96Å; H648-Y658 AromaticContact NE2-CZ 3.6Å; H648-Y658 PolarHBondContact NE2-OH 2.88Å; H648-Y667 HydrophobicContact CB-CD1 4.11Å; H648-Y667 HydrophobicContact CB-CE1 3.58Å; H648-Y667 AromaticContact CG-CE1 3.66Å
649	V	84.7	Confident	79.8	Confident	63 Å²	63	73.9 Å²	73.9	38%	0.382	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.2	171.1	-175.9	0	0	0	0	107.4	Y647 F654 K655 V775	Y647-V649 HydrophobicContact CD2-CG2 3.89Å; Y647-V649 HydrophobicContact CE2-CG2 3.76Å; V649-F654 WeakPolarHBondContact CA-O 3.27Å; V649-K655 HydrophobicContact CG2-CG 4.31Å; V649-V775 HydrophobicContact CG1-CG1 3.91Å; V649-V775 HydrophobicContact CG2-CG1 4.11Å
650	D	85.1	Confident	79.6	Confident	27 Å²	27	76.4 Å²	76.4	14%	0.144	39%	0.387	C	S	.	.			trans	-79.5	177.5	175.6	70.1	20	0	0	0	112.6	Y652 G653 F654 H656 Y667	D650-Y652 PolarHBondContact O-N 2.76Å; D650-Y652 WeakPolarHBondContact OD1-CA 3.41Å; D650-Y652 PolarHBondContact OD1-N 3.44Å; D650-G653 PolarHBondContact O-N 3.49Å; D650-G653 PolarHBondContact OD1-N 2.58Å; D650-F654 PolarHBondContact N-O 3.31Å; D650-F654 PolarHBondContact OD1-N 3.35Å; D650-F654 WeakPolarHBondContact OD2-CB 3.19Å; D650-H656 IonicContact OD2-CD2 3.54Å; D650-H656 IonicContact OD2-CE1 3.65Å; D650-H656 IonicContact OD2-NE2 3.04Å; D650-H656 PolarHBondContact OD2-NE2 3.2Å; D650-Y667 HydrophobicContact CB-CD2 4.06Å; D650-Y667 HydrophobicContact CB-CE2 3.82Å
651	F	82.5	Confident	79.3	Confident	157 Å²	157	73 Å²	73	69%	0.689	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.2	-179.1	-73.8	-78.4	0	0	0	114.2
652	Y	88.1	Confident	79.3	Confident	31 Å²	31	70.9 Å²	70.9	12%	0.122	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-4.6	176.7	-52	-69.9	0	0	0	112.5	D650 I716 N774 F818 F895 E896 I899	D650-Y652 PolarHBondContact O-N 2.76Å; D650-Y652 WeakPolarHBondContact OD1-CA 3.41Å; D650-Y652 PolarHBondContact OD1-N 3.44Å; Y652-I716 HydrophobicContact CD1-CD1 4.04Å; Y652-I716 HydrophobicContact CE1-CD1 3.44Å; Y652-I716 VanDerWaalsContact CE1-CD1 3.44Å; Y652-I716 HydrophobicContact CE1-CG1 4.28Å; Y652-N774 PolarHBondContact O-ND2 2.93Å; Y652-F818 AromaticContact CD1-CE1 3.78Å; Y652-F818 HydrophobicContact CD1-CE1 3.78Å; Y652-F818 AromaticContact CD1-CZ 3.69Å; Y652-F818 HydrophobicContact CD1-CZ 3.69Å; Y652-F818 AromaticContact CE1-CE1 3.74Å; Y652-F818 HydrophobicContact CE1-CE1 3.74Å; Y652-F818 AromaticContact CE1-CZ 3.76Å; Y652-F818 HydrophobicContact CE1-CZ 3.76Å; Y652-F895 AromaticContact CD1-CE1 3.74Å; Y652-F895 HydrophobicContact CD1-CE1 3.74Å; Y652-F895 AromaticContact CD2-CD1 3.74Å; Y652-F895 HydrophobicContact CD2-CD1 3.74Å; Y652-F895 AromaticContact CD2-CE1 3.73Å; Y652-F895 HydrophobicContact CD2-CE1 3.73Å; Y652-F895 HydrophobicContact CE1-CE1 4.17Å; Y652-F895 HydrophobicContact CE2-CD1 4.08Å; Y652-F895 HydrophobicContact CE2-CE1 4.16Å; Y652-F895 AromaticContact CG-CD1 3.99Å; Y652-F895 HydrophobicContact CG-CD1 3.99Å; Y652-F895 AromaticContact CG-CE1 3.48Å; Y652-F895 HydrophobicContact CG-CE1 3.48Å; Y652-F895 VanDerWaalsContact CG-CE1 3.48Å; Y652-F895 HydrophobicContact CG-CZ 4.47Å; Y652-E896 VanDerWaalsContact CE2-OE1 3.23Å; Y652-E896 WeakPolarHBondContact CE2-OE1 3.42Å; Y652-E896 PolarHBondContact OH-OE2 3.13Å; Y652-I899 HydrophobicContact CE1-CD1 4.17Å; Y652-I899 HydrophobicContact CE2-CD1 4.47Å; Y652-I899 WeakPolarHBondContact OH-CD1 3.31Å
653	G	88.3	Confident	79.3	Confident	8 Å²	8	70.5 Å²	70.5	8%	0.082	36%	0.362	C	S	.	.			trans	92.9	6.7	-179.6	0	0	0	0	0	114.7	D650 N774 V775	D650-G653 PolarHBondContact O-N 3.49Å; D650-G653 PolarHBondContact OD1-N 2.58Å; G653-N774 CarbonylContact O-C 3.48Å; G653-N774 WeakPolarHBondContact O-CA 3.33Å; G653-V775 PolarHBondContact O-N 3.03Å
654	F	90.4	Very high	79.7	Confident	13 Å²	13	60.1 Å²	60.1	6%	0.057	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-78.5	137.4	177.3	-66.9	-78.2	0	0	0	112.1	V649 D650 H656 M771 N773 N774 L817 F895	V649-F654 WeakPolarHBondContact CA-O 3.27Å; D650-F654 PolarHBondContact N-O 3.31Å; D650-F654 PolarHBondContact OD1-N 3.35Å; D650-F654 WeakPolarHBondContact OD2-CB 3.19Å; F654-H656 PolarHBondContact O-CD2 3.48Å; F654-M771 HydrophobicContact CE1-CG 4.37Å; F654-M771 HydrophobicContact CZ-CE 4.49Å; F654-M771 HydrophobicContact CZ-SD 4.21Å; F654-N773 WeakPolarHBondContact CA-O 3.4Å; F654-N774 HydrophobicContact CD1-CB 3.83Å; F654-N774 HydrophobicContact CE1-CB 3.79Å; F654-N774 HydrophobicContact CZ-CB 4.45Å; F654-L817 HydrophobicContact CE2-CD1 4.25Å; F654-L817 HydrophobicContact CZ-CD1 4.2Å; F654-F895 HydrophobicContact CD2-CD1 4.31Å; F654-F895 HydrophobicContact CD2-CG 4.3Å; F654-F895 HydrophobicContact CE2-CB 4.43Å; F654-F895 AromaticContact CE2-CD1 3.75Å; F654-F895 HydrophobicContact CE2-CD1 3.75Å; F654-F895 AromaticContact CE2-CD2 3.48Å; F654-F895 HydrophobicContact CE2-CD2 3.48Å; F654-F895 VanDerWaalsContact CE2-CD2 3.48Å; F654-F895 AromaticContact CE2-CE1 3.8Å; F654-F895 HydrophobicContact CE2-CE1 3.8Å; F654-F895 AromaticContact CE2-CE2 3.53Å; F654-F895 HydrophobicContact CE2-CE2 3.53Å; F654-F895 AromaticContact CE2-CG 3.6Å; F654-F895 HydrophobicContact CE2-CG 3.6Å; F654-F895 AromaticContact CE2-CZ 3.7Å; F654-F895 HydrophobicContact CE2-CZ 3.7Å; F654-F895 AromaticContact CZ-CD2 3.63Å; F654-F895 HydrophobicContact CZ-CD2 3.63Å; F654-F895 AromaticContact CZ-CE2 3.66Å; F654-F895 HydrophobicContact CZ-CE2 3.66Å; F654-F895 HydrophobicContact CZ-CG 4.18Å; F654-F895 HydrophobicContact CZ-CZ 4.24Å
655	K	87.9	Confident	80.2	Confident	51 Å²	51	53.7 Å²	53.7	22%	0.222	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	112.2	178.4	-60	177.4	-175.5	-178.7	0	110.5	Y647 H648 V649 N773 V775 D778	Y647-K655 HydrophobicContact CD2-CB 3.79Å; Y647-K655 HydrophobicContact CD2-CD 4.03Å; Y647-K655 HydrophobicContact CD2-CG 3.72Å; Y647-K655 HydrophobicContact CE1-CD 4.37Å; Y647-K655 HydrophobicContact CE2-CB 4.3Å; Y647-K655 HydrophobicContact CE2-CD 3.69Å; Y647-K655 HydrophobicContact CE2-CG 3.72Å; Y647-K655 HydrophobicContact CG-CB 4.13Å; Y647-K655 HydrophobicContact CG-CG 4.43Å; H648-K655 CarbonylContact O-C 3.53Å; H648-K655 VanDerWaalsContact O-CA 3.3Å; H648-K655 WeakPolarHBondContact O-CA 3.17Å; V649-K655 HydrophobicContact CG2-CG 4.31Å; K655-N773 WeakPolarHBondContact CB-O 3.16Å; K655-N773 WeakPolarHBondContact CG-O 3.3Å; K655-N773 PolarHBondContact N-O 3.14Å; K655-V775 HydrophobicContact CG-CG1 4.2Å; K655-D778 WeakPolarHBondContact CE-OD2 3.41Å; K655-D778 IonicContact NZ-OD2 3.92Å; K655-D778 PolarHBondContact NZ-OD2 3.43Å
656	H	84.7	Confident	80.4	Confident	33 Å²	33	53.2 Å²	53.2	15%	0.153	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	99.1	173.3	-61.7	-76	0	0	0	109.5	Y647 H648 D650 F654 I664 Y667	Y647-H656 CarbonylContact C-O 3.56Å; Y647-H656 WeakPolarHBondContact CA-O 3.11Å; Y647-H656 WeakPolarHBondContact CB-O 3.26Å; H648-H656 PolarHBondContact N-O 3.25Å; H648-H656 PolarHBondContact O-N 3.39Å; D650-H656 IonicContact OD2-CD2 3.54Å; D650-H656 IonicContact OD2-CE1 3.65Å; D650-H656 IonicContact OD2-NE2 3.04Å; D650-H656 PolarHBondContact OD2-NE2 3.2Å; F654-H656 PolarHBondContact O-CD2 3.48Å; H656-I664 HydrophobicContact CB-CD1 3.95Å; H656-I664 VanDerWaalsContact O-CD1 3.29Å; H656-I664 WeakPolarHBondContact O-CD1 3.49Å; H656-Y667 HydrophobicContact CB-CG 4.45Å; H656-Y667 AromaticContact CD2-CD2 3.68Å; H656-Y667 AromaticContact CD2-CG 4Å
657	S	79	Confident	80.5	Confident	37 Å²	37	49.7 Å²	49.7	26%	0.259	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	136.6	-177.2	179.3	0	0	0	0	112.2	L659 N660	S657-L659 PolarHBondContact O-N 2.63Å; S657-L659 VanDerWaalsContact O-N 3.15Å; S657-L659 WeakPolarHBondContact OG-CB 3.34Å; S657-L659 PolarHBondContact OG-N 2.69Å; S657-L659 VanDerWaalsContact OG-N 3.16Å; S657-N660 CarbonylContact O-C 3.55Å; S657-N660 PolarHBondContact O-N 3.24Å
658	Y	76.9	Confident	80.7	Confident	34 Å²	34	45 Å²	45	13%	0.133	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-13.7	170.8	-77.2	-80.1	0	0	0	113.9	S638 K641 P642 D646 H648 N660 I664	S638-Y658 PolarHBondContact O-OH 3.12Å; K641-Y658 HydrophobicContact CB-CD1 3.98Å; K641-Y658 HydrophobicContact CB-CD2 4.32Å; K641-Y658 HydrophobicContact CB-CE1 4.31Å; K641-Y658 HydrophobicContact CB-CG 3.96Å; K641-Y658 HydrophobicContact CD-CG 4.43Å; K641-Y658 HydrophobicContact CG-CD1 4.47Å; K641-Y658 HydrophobicContact CG-CD2 3.95Å; K641-Y658 HydrophobicContact CG-CE2 4.42Å; K641-Y658 HydrophobicContact CG-CG 3.95Å; P642-Y658 VanDerWaalsContact CD-OH 3.25Å; P642-Y658 WeakPolarHBondContact CD-OH 3.28Å; P642-Y658 HydrophobicContact CG-CE2 4.33Å; D646-Y658 WeakPolarHBondContact O-CD2 3.4Å; D646-Y658 PolarHBondContact O-N 3.27Å; D646-Y658 VanDerWaalsContact O-N 3.1Å; H648-Y658 AromaticContact CD2-CE2 3.67Å; H648-Y658 AromaticContact CD2-CZ 3.54Å; H648-Y658 PolarHBondContact CD2-OH 2.76Å; H648-Y658 VanDerWaalsContact CD2-OH 3.23Å; H648-Y658 AromaticContact NE2-CE2 3.96Å; H648-Y658 AromaticContact NE2-CZ 3.6Å; H648-Y658 PolarHBondContact NE2-OH 2.88Å; Y658-N660 VanDerWaalsContact C-N 3.29Å; Y658-I664 HydrophobicContact CD1-CD1 4.13Å; Y658-I664 HydrophobicContact CD1-CG1 3.95Å; Y658-I664 HydrophobicContact CD1-CG2 4.34Å; Y658-I664 HydrophobicContact CD2-CD1 4.45Å; Y658-I664 HydrophobicContact CE1-CD1 4.16Å; Y658-I664 HydrophobicContact CE1-CG1 4.35Å; Y658-I664 HydrophobicContact CE1-CG2 4.23Å; Y658-I664 HydrophobicContact CE2-CD1 4.48Å; Y658-I664 HydrophobicContact CG-CD1 4.3Å; Y658-I664 HydrophobicContact CG-CG1 4.25Å
659	L	72.3	Confident	80.8	Confident	161 Å²	161	43 Å²	43	84%	0.843	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-23.9	170.5	-61.8	171.7	0	0	0	112.2	S657	S657-L659 PolarHBondContact O-N 2.63Å; S657-L659 VanDerWaalsContact O-N 3.15Å; S657-L659 WeakPolarHBondContact OG-CB 3.34Å; S657-L659 PolarHBondContact OG-N 2.69Å; S657-L659 VanDerWaalsContact OG-N 3.16Å
660	N	72.8	Confident	80.9	Confident	77 Å²	77	41.7 Å²	41.7	41%	0.412	21%	0.211	S	C	.	.			trans	-105.9	88.5	175.1	-170.9	-12.8	0	0	0	109.5	S657 Y658 T662 S663 I664	S657-N660 CarbonylContact O-C 3.55Å; S657-N660 PolarHBondContact O-N 3.24Å; Y658-N660 VanDerWaalsContact C-N 3.29Å; N660-T662 VanDerWaalsContact C-N 3.25Å; N660-T662 PolarHBondContact O-N 3.09Å; N660-T662 PolarHBondContact OD1-N 3.03Å; N660-S663 VanDerWaalsContact CG-OG 3.27Å; N660-S663 PolarHBondContact ND2-OG 2.56Å; N660-S663 WeakPolarHBondContact O-CB 3.18Å; N660-S663 PolarHBondContact O-N 2.65Å; N660-S663 VanDerWaalsContact O-N 3.11Å; N660-S663 PolarHBondContact OD1-N 3.16Å; N660-I664 PolarHBondContact O-N 3.1Å
661	E	70.1	Confident	81	Confident	60 Å²	60	41.5 Å²	41.5	28%	0.28	21%	0.209	S	C	.	.	H	α-helix	trans	-54.7	-40.5	-177.1	-173.9	175.9	-145	0	0	112.6	K615 K619 S663 I664 I665	K615-E661 WeakPolarHBondContact CE-OE2 3.29Å; K615-E661 IonicContact NZ-OE2 3.86Å; K615-E661 PolarHBondContact NZ-OE2 3.41Å; K619-E661 WeakPolarHBondContact CD-OE1 3.49Å; K619-E661 VanDerWaalsContact CE-OE1 3.31Å; K619-E661 WeakPolarHBondContact CE-OE1 3.38Å; K619-E661 IonicContact NZ-OE1 2.78Å; K619-E661 PolarHBondContact NZ-OE1 3.25Å; E661-S663 PolarHBondContact O-N 3.19Å; E661-I664 PolarHBondContact O-N 3.35Å; E661-I665 HydrophobicContact CG-CD1 3.85Å; E661-I665 HydrophobicContact CG-CG1 4.38Å; E661-I665 VanDerWaalsContact O-CG1 3.27Å; E661-I665 WeakPolarHBondContact O-CG1 3.45Å; E661-I665 PolarHBondContact O-N 3.37Å
662	T	72.2	Confident	81.2	Confident	54 Å²	54	34 Å²	34	33%	0.331	18%	0.176	S	C	.	.	H	α-helix	trans	-61.6	-43.5	178.9	-54	0	0	0	0	111.6	N660 I665 H666	N660-T662 VanDerWaalsContact C-N 3.25Å; N660-T662 PolarHBondContact O-N 3.09Å; N660-T662 PolarHBondContact OD1-N 3.03Å; T662-I665 PolarHBondContact O-N 3.03Å; T662-H666 PolarHBondContact O-CD2 2.89Å; T662-H666 PolarHBondContact O-N 3.09Å
663	S	71.4	Confident	81.2	Confident	38 Å²	38	34.9 Å²	34.9	27%	0.266	18%	0.179	S	C	.	.	H	α-helix	trans	-62.2	-43.2	176.2	-65.1	0	0	0	0	112.3	N660 E661 H666 Y667	N660-S663 VanDerWaalsContact CG-OG 3.27Å; N660-S663 PolarHBondContact ND2-OG 2.56Å; N660-S663 WeakPolarHBondContact O-CB 3.18Å; N660-S663 PolarHBondContact O-N 2.65Å; N660-S663 VanDerWaalsContact O-N 3.11Å; N660-S663 PolarHBondContact OD1-N 3.16Å; E661-S663 PolarHBondContact O-N 3.19Å; S663-H666 PolarHBondContact O-N 3.04Å; S663-Y667 WeakPolarHBondContact O-CB 3.01Å; S663-Y667 PolarHBondContact O-N 2.97Å
664	I	79.8	Confident	81	Confident	4 Å²	4	37 Å²	37	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-66.4	-37.7	177.3	-76.1	-63.9	0	0	0	112.3	M639 H656 Y658 N660 E661 S668	M639-I664 HydrophobicContact CE-CG2 4.16Å; M639-I664 HydrophobicContact SD-CG2 4Å; H656-I664 HydrophobicContact CB-CD1 3.95Å; H656-I664 VanDerWaalsContact O-CD1 3.29Å; H656-I664 WeakPolarHBondContact O-CD1 3.49Å; Y658-I664 HydrophobicContact CD1-CD1 4.13Å; Y658-I664 HydrophobicContact CD1-CG1 3.95Å; Y658-I664 HydrophobicContact CD1-CG2 4.34Å; Y658-I664 HydrophobicContact CD2-CD1 4.45Å; Y658-I664 HydrophobicContact CE1-CD1 4.16Å; Y658-I664 HydrophobicContact CE1-CG1 4.35Å; Y658-I664 HydrophobicContact CE1-CG2 4.23Å; Y658-I664 HydrophobicContact CE2-CD1 4.48Å; Y658-I664 HydrophobicContact CG-CD1 4.3Å; Y658-I664 HydrophobicContact CG-CG1 4.25Å; N660-I664 PolarHBondContact O-N 3.1Å; E661-I664 PolarHBondContact O-N 3.35Å; I664-S668 VanDerWaalsContact O-CB 3.31Å; I664-S668 WeakPolarHBondContact O-CB 3.08Å; I664-S668 PolarHBondContact O-N 3.27Å; I664-S668 PolarHBondContact O-OG 3.26Å
665	I	79.6	Confident	80.9	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-65.5	-48.5	177.4	-67.4	168.7	0	0	0	109.6	L597 K615 I622 M639 E661 T662 Y667 S668 C669	L597-I665 HydrophobicContact CD1-CG2 3.45Å; L597-I665 VanDerWaalsContact CD1-CG2 3.45Å; L597-I665 HydrophobicContact CD2-CG2 3.73Å; L597-I665 HydrophobicContact CG-CG2 4.26Å; K615-I665 HydrophobicContact CG-CD1 4.37Å; I622-I665 HydrophobicContact CD1-CG2 3.64Å; M639-I665 HydrophobicContact CE-CG1 3.71Å; E661-I665 HydrophobicContact CG-CD1 3.85Å; E661-I665 HydrophobicContact CG-CG1 4.38Å; E661-I665 VanDerWaalsContact O-CG1 3.27Å; E661-I665 WeakPolarHBondContact O-CG1 3.45Å; E661-I665 PolarHBondContact O-N 3.37Å; T662-I665 PolarHBondContact O-N 3.03Å; I665-Y667 PolarHBondContact O-N 3.04Å; I665-S668 PolarHBondContact O-N 3.46Å; I665-C669 PolarHBondContact O-N 3.14Å; I665-C669 PolarHBondContact O-SG 2.97Å
666	H	77.7	Confident	81	Confident	29 Å²	29	34.2 Å²	34.2	13%	0.134	18%	0.176	C	C	.	.	H	α-helix	trans	-60.4	-44.5	177.3	-81.3	-68.4	0	0	0	112.2	Q594 L597 T662 S663 S668 C669 Q670 N949	Q594-H666 PolarHBondContact O-CE1 3.15Å; L597-H666 VanDerWaalsContact CB-CE1 3.48Å; L597-H666 WeakPolarHBondContact CB-CE1 3.48Å; T662-H666 PolarHBondContact O-CD2 2.89Å; T662-H666 PolarHBondContact O-N 3.09Å; S663-H666 PolarHBondContact O-N 3.04Å; H666-S668 VanDerWaalsContact C-N 3.34Å; H666-S668 PolarHBondContact O-N 3.41Å; H666-C669 WeakPolarHBondContact O-CB 3.4Å; H666-C669 PolarHBondContact O-N 3.44Å; H666-Q670 PolarHBondContact O-N 3.09Å; H666-N949 PolarHBondContact CE1-ND2 2.94Å
667	Y	82.9	Confident	80.9	Confident	23 Å²	23	33.4 Å²	33.4	9%	0.09	17%	0.174	C	C	.	.	H	α-helix	trans	-57.7	-46.6	173.7	173.1	-107.5	0	0	0	111.5	P637 H648 D650 H656 S663 I665 C669 Q670 Q671	P637-Y667 HydrophobicContact CB-CD1 4.46Å; P637-Y667 HydrophobicContact CB-CE1 3.79Å; P637-Y667 HydrophobicContact CG-CD1 4.28Å; P637-Y667 HydrophobicContact CG-CE1 3.74Å; H648-Y667 HydrophobicContact CB-CD1 4.11Å; H648-Y667 HydrophobicContact CB-CE1 3.58Å; H648-Y667 AromaticContact CG-CE1 3.66Å; D650-Y667 HydrophobicContact CB-CD2 4.06Å; D650-Y667 HydrophobicContact CB-CE2 3.82Å; H656-Y667 HydrophobicContact CB-CG 4.45Å; H656-Y667 AromaticContact CD2-CD2 3.68Å; H656-Y667 AromaticContact CD2-CG 4Å; S663-Y667 WeakPolarHBondContact O-CB 3.01Å; S663-Y667 PolarHBondContact O-N 2.97Å; I665-Y667 PolarHBondContact O-N 3.04Å; Y667-C669 PolarHBondContact O-N 3.26Å; Y667-Q670 WeakPolarHBondContact O-CB 3.15Å; Y667-Q670 PolarHBondContact O-N 3.41Å; Y667-Q671 HydrophobicContact CD1-CG 4.4Å; Y667-Q671 HydrophobicContact CD2-CG 4.25Å; Y667-Q671 HydrophobicContact CE1-CG 4Å; Y667-Q671 HydrophobicContact CE2-CG 3.8Å; Y667-Q671 WeakPolarHBondContact O-CG 3.4Å; Y667-Q671 PolarHBondContact O-N 3.15Å
668	S	85.8	Confident	81.1	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.007	19%	0.187	C	C	.	.	H	α-helix	trans	-64.3	-39.2	179.2	-57.4	0	0	0	0	112.5	M639 I664 I665 H666 Q671 L672	M639-S668 PolarHBondContact SD-OG 3.29Å; I664-S668 VanDerWaalsContact O-CB 3.31Å; I664-S668 WeakPolarHBondContact O-CB 3.08Å; I664-S668 PolarHBondContact O-N 3.27Å; I664-S668 PolarHBondContact O-OG 3.26Å; I665-S668 PolarHBondContact O-N 3.46Å; H666-S668 VanDerWaalsContact C-N 3.34Å; H666-S668 PolarHBondContact O-N 3.41Å; S668-Q671 PolarHBondContact O-N 2.68Å; S668-L672 WeakPolarHBondContact O-CB 3.36Å; S668-L672 WeakPolarHBondContact O-CG 3.31Å; S668-L672 PolarHBondContact O-N 2.79Å
669	C	85.6	Confident	81.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.9	-45.3	172	-75.6	0	0	0	0	111.5	V590 Q594 I622 I665 H666 Y667 L672 Y673	V590-C669 HydrophobicContact CG1-CB 4.15Å; V590-C669 WeakPolarHBondContact CG1-O 3.45Å; Q594-C669 HydrophobicContact CB-CB 4.05Å; Q594-C669 HydrophobicContact CG-CB 4.12Å; I622-C669 WeakPolarHBondContact CD1-SG 3.49Å; I665-C669 PolarHBondContact O-N 3.14Å; I665-C669 PolarHBondContact O-SG 2.97Å; H666-C669 WeakPolarHBondContact O-CB 3.4Å; H666-C669 PolarHBondContact O-N 3.44Å; Y667-C669 PolarHBondContact O-N 3.26Å; C669-L672 PolarHBondContact O-N 2.95Å; C669-Y673 WeakPolarHBondContact O-CB 3.48Å; C669-Y673 PolarHBondContact O-N 3.26Å
670	Q	84.9	Confident	81.8	Confident	36 Å²	36	33.7 Å²	33.7	17%	0.168	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-47.3	177.8	-169.8	62.4	37.5	0	0	111.3	H666 Y667 L672 Y673 D674	H666-Q670 PolarHBondContact O-N 3.09Å; Y667-Q670 WeakPolarHBondContact O-CB 3.15Å; Y667-Q670 PolarHBondContact O-N 3.41Å; Q670-L672 VanDerWaalsContact C-N 3.3Å; Q670-L672 PolarHBondContact O-N 2.9Å; Q670-Y673 WeakPolarHBondContact O-CB 3.39Å; Q670-Y673 PolarHBondContact O-N 3.11Å; Q670-Y673 VanDerWaalsContact O-N 3.17Å; Q670-D674 PolarHBondContact NE2-OD1 2.92Å; Q670-D674 PolarHBondContact O-N 3.34Å
671	Q	87.6	Confident	81.2	Confident	22 Å²	22	34.4 Å²	34.4	10%	0.103	17%	0.173	C	C	.	.	H	α-helix	trans	-62.7	-36.4	177.9	-62.6	-58.5	110.5	0	0	112.6	L636 P637 Y667 S668 F675	L636-Q671 HydrophobicContact CD2-CB 4.09Å; P637-Q671 HydrophobicContact CG-CB 4.13Å; P637-Q671 HydrophobicContact CG-CG 3.97Å; Y667-Q671 HydrophobicContact CD1-CG 4.4Å; Y667-Q671 HydrophobicContact CD2-CG 4.25Å; Y667-Q671 HydrophobicContact CE1-CG 4Å; Y667-Q671 HydrophobicContact CE2-CG 3.8Å; Y667-Q671 WeakPolarHBondContact O-CG 3.4Å; Y667-Q671 PolarHBondContact O-N 3.15Å; S668-Q671 PolarHBondContact O-N 2.68Å; Q671-F675 WeakPolarHBondContact O-CB 3.35Å; Q671-F675 PolarHBondContact O-N 3.35Å
672	L	88.1	Confident	80.7	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-67.4	-42.9	173.7	-85.1	173.9	0	0	0	112.1	V590 I622 L625 L626 A629 S668 C669 Q670 D674 F675 Y676	V590-L672 HydrophobicContact CG1-CB 3.97Å; V590-L672 HydrophobicContact CG2-CB 4.24Å; V590-L672 HydrophobicContact CG2-CD1 4.48Å; I622-L672 HydrophobicContact CG2-CD1 4.12Å; L625-L672 HydrophobicContact CB-CD1 4.07Å; L626-L672 HydrophobicContact CB-CD1 4.4Å; L626-L672 HydrophobicContact CD1-CD1 4.13Å; L626-L672 HydrophobicContact CD1-CD2 4.09Å; L626-L672 HydrophobicContact CD1-CG 3.77Å; A629-L672 HydrophobicContact CB-CD2 3.74Å; S668-L672 WeakPolarHBondContact O-CB 3.36Å; S668-L672 WeakPolarHBondContact O-CG 3.31Å; S668-L672 PolarHBondContact O-N 2.79Å; C669-L672 PolarHBondContact O-N 2.95Å; Q670-L672 VanDerWaalsContact C-N 3.3Å; Q670-L672 PolarHBondContact O-N 2.9Å; L672-D674 VanDerWaalsContact C-N 3.34Å; L672-D674 PolarHBondContact O-N 3.42Å; L672-F675 PolarHBondContact O-N 3.44Å; L672-Y676 HydrophobicContact CB-CE2 4.38Å; L672-Y676 HydrophobicContact CD2-CE2 4.06Å; L672-Y676 WeakPolarHBondContact O-CD2 3.44Å; L672-Y676 PolarHBondContact O-N 3.38Å
673	Y	87.6	Confident	80.3	Confident	50 Å²	50	33.1 Å²	33.1	20%	0.196	19%	0.187	C	C	.	.	H	α-helix	trans	-58.9	-47.3	176.2	179.5	-94.3	0	0	0	110.9	R587 K591 C669 Q670 F675 Y676 T677	R587-Y673 HydrophobicContact CG-CD2 3.6Å; R587-Y673 HydrophobicContact CG-CE2 3.41Å; R587-Y673 VanDerWaalsContact CG-CE2 3.41Å; R587-Y673 HydrophobicContact CG-CG 4.48Å; K591-Y673 HydrophobicContact CB-CD2 4.06Å; K591-Y673 HydrophobicContact CB-CE2 4.06Å; K591-Y673 HydrophobicContact CD-CE2 3.93Å; K591-Y673 HydrophobicContact CG-CE2 4.29Å; C669-Y673 WeakPolarHBondContact O-CB 3.48Å; C669-Y673 PolarHBondContact O-N 3.26Å; Q670-Y673 WeakPolarHBondContact O-CB 3.39Å; Q670-Y673 PolarHBondContact O-N 3.11Å; Q670-Y673 VanDerWaalsContact O-N 3.17Å; Y673-F675 VanDerWaalsContact C-N 3.35Å; Y673-F675 PolarHBondContact O-N 3.34Å; Y673-Y676 PolarHBondContact O-N 2.92Å; Y673-T677 WeakPolarHBondContact O-CB 3.14Å; Y673-T677 PolarHBondContact O-N 3.05Å; Y673-T677 PolarHBondContact O-OG1 3.32Å
674	D	84.6	Confident	80.2	Confident	51 Å²	51	34.5 Å²	34.5	27%	0.273	19%	0.192	S	C	.	.	H	α-helix	trans	-65.8	-37.9	177.8	-66.1	-16.3	0	0	0	111.9	Q670 L672 R678	Q670-D674 PolarHBondContact NE2-OD1 2.92Å; Q670-D674 PolarHBondContact O-N 3.34Å; L672-D674 VanDerWaalsContact C-N 3.34Å; L672-D674 PolarHBondContact O-N 3.42Å; D674-R678 WeakPolarHBondContact O-CG 3.37Å; D674-R678 PolarHBondContact O-N 3.14Å; D674-R678 PolarHBondContact O-NE 3.33Å
675	F	88.2	Confident	80	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-60.3	-52.1	173.6	171.3	-98.9	0	0	0	111.6	A629 K632 D633 L636 Q671 L672 Y673 T677 R678 Q679	A629-F675 HydrophobicContact CB-CD1 3.66Å; A629-F675 HydrophobicContact CB-CE1 3.57Å; A629-F675 HydrophobicContact CB-CG 4.24Å; A629-F675 HydrophobicContact CB-CZ 4.07Å; K632-F675 HydrophobicContact CB-CE2 4.24Å; K632-F675 HydrophobicContact CB-CZ 3.97Å; K632-F675 HydrophobicContact CD-CZ 4.21Å; D633-F675 HydrophobicContact CB-CD2 3.9Å; D633-F675 HydrophobicContact CB-CE2 3.69Å; L636-F675 HydrophobicContact CD1-CB 4.2Å; L636-F675 HydrophobicContact CD1-CD2 3.92Å; L636-F675 HydrophobicContact CD1-CE2 4.49Å; L636-F675 HydrophobicContact CD1-CG 3.97Å; L636-F675 HydrophobicContact CD2-CB 4.24Å; Q671-F675 WeakPolarHBondContact O-CB 3.35Å; Q671-F675 PolarHBondContact O-N 3.35Å; L672-F675 PolarHBondContact O-N 3.44Å; Y673-F675 VanDerWaalsContact C-N 3.35Å; Y673-F675 PolarHBondContact O-N 3.34Å; F675-T677 VanDerWaalsContact C-N 3.31Å; F675-T677 PolarHBondContact O-N 3.4Å; F675-R678 PolarHBondContact O-N 3.46Å; F675-Q679 HydrophobicContact CE1-CG 4.13Å; F675-Q679 HydrophobicContact CE2-CG 4.34Å; F675-Q679 HydrophobicContact CZ-CG 4.01Å; F675-Q679 WeakPolarHBondContact O-CG 3.33Å; F675-Q679 PolarHBondContact O-N 3.41Å
676	Y	88.5	Confident	80.1	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-66.7	-34	-179.3	-67.3	-50.9	0	0	0	112.5	F583 R586 V590 L672 Y673 R678 Q679 L680	F583-Y676 AromaticContact CD1-CD1 3.83Å; F583-Y676 HydrophobicContact CD1-CD1 3.83Å; F583-Y676 HydrophobicContact CD1-CE1 4.23Å; F583-Y676 HydrophobicContact CE1-CD1 4.48Å; R586-Y676 HydrophobicContact CB-CD1 4.27Å; R586-Y676 HydrophobicContact CB-CD2 4.08Å; R586-Y676 HydrophobicContact CB-CE1 4.12Å; R586-Y676 HydrophobicContact CB-CE2 3.91Å; R586-Y676 HydrophobicContact CB-CG 4.26Å; V590-Y676 HydrophobicContact CG2-CD2 4.19Å; V590-Y676 HydrophobicContact CG2-CE2 3.87Å; L672-Y676 HydrophobicContact CB-CE2 4.38Å; L672-Y676 HydrophobicContact CD2-CE2 4.06Å; L672-Y676 WeakPolarHBondContact O-CD2 3.44Å; L672-Y676 PolarHBondContact O-N 3.38Å; Y673-Y676 PolarHBondContact O-N 2.92Å; Y676-R678 VanDerWaalsContact C-N 3.35Å; Y676-R678 PolarHBondContact O-N 2.88Å; Y676-Q679 PolarHBondContact O-N 2.58Å; Y676-Q679 VanDerWaalsContact O-N 3.16Å; Y676-L680 PolarHBondContact O-N 3.33Å
677	T	84.2	Confident	80.3	Confident	16 Å²	16	44.6 Å²	44.6	10%	0.098	24%	0.239	C	C	.	.	H	α-helix	trans	-61.7	-42.2	173.5	-59.3	0	0	0	0	111.5	R587 Y673 F675 Q679 L680 D684	R587-T677 VanDerWaalsContact CD-OG1 3.26Å; R587-T677 WeakPolarHBondContact CD-OG1 3.27Å; Y673-T677 WeakPolarHBondContact O-CB 3.14Å; Y673-T677 PolarHBondContact O-N 3.05Å; Y673-T677 PolarHBondContact O-OG1 3.32Å; F675-T677 VanDerWaalsContact C-N 3.31Å; F675-T677 PolarHBondContact O-N 3.4Å; T677-Q679 VanDerWaalsContact C-N 3.25Å; T677-Q679 PolarHBondContact O-N 3.15Å; T677-L680 PolarHBondContact O-N 3.32Å; T677-D684 HydrophobicContact CG2-CB 3.95Å
678	R	83	Confident	80.2	Confident	142 Å²	142	50.4 Å²	50.4	54%	0.536	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-23.3	174.5	-73.9	-179.9	-72.1	143.6	-4.9	114.1	D633 D674 F675 Y676	D633-R678 IonicContact OD2-CZ 2.88Å; D633-R678 IonicContact OD2-NH1 3.72Å; D633-R678 PolarHBondContact OD2-NH1 2.82Å; D633-R678 IonicContact OD2-NH2 3.7Å; D633-R678 PolarHBondContact OD2-NH2 3.32Å; D674-R678 WeakPolarHBondContact O-CG 3.37Å; D674-R678 PolarHBondContact O-N 3.14Å; D674-R678 PolarHBondContact O-NE 3.33Å; F675-R678 PolarHBondContact O-N 3.46Å; Y676-R678 VanDerWaalsContact C-N 3.35Å; Y676-R678 PolarHBondContact O-N 2.88Å
679	Q	82.9	Confident	80.1	Confident	74 Å²	74	55.6 Å²	55.6	35%	0.346	28%	0.281	S	S	.	.	H	α-helix	trans	-82.6	-15.4	179.2	-63.2	-56.7	-61.7	0	0	113.6	F583 F675 Y676 T677	F583-Q679 HydrophobicContact CD1-CB 4.1Å; F583-Q679 HydrophobicContact CD1-CG 4.4Å; F583-Q679 HydrophobicContact CD2-CB 4.06Å; F583-Q679 HydrophobicContact CE1-CB 4.36Å; F583-Q679 HydrophobicContact CE1-CG 4.33Å; F583-Q679 HydrophobicContact CE2-CB 4.33Å; F583-Q679 HydrophobicContact CG-CB 3.98Å; F583-Q679 HydrophobicContact CZ-CB 4.49Å; F675-Q679 HydrophobicContact CE1-CG 4.13Å; F675-Q679 HydrophobicContact CE2-CG 4.34Å; F675-Q679 HydrophobicContact CZ-CG 4.01Å; F675-Q679 WeakPolarHBondContact O-CG 3.33Å; F675-Q679 PolarHBondContact O-N 3.41Å; Y676-Q679 PolarHBondContact O-N 2.58Å; Y676-Q679 VanDerWaalsContact O-N 3.16Å; T677-Q679 VanDerWaalsContact C-N 3.25Å; T677-Q679 PolarHBondContact O-N 3.15Å
680	L	80	Confident	80.1	Confident	23 Å²	23	55.6 Å²	55.6	12%	0.12	28%	0.281	C	S	.	.	S	Bend	trans	-79.1	130.8	178.9	-68.3	167.3	0	0	0	109.8	M580 F583 K584 R587 Y676 T677 G682 G683	M580-L680 WeakPolarHBondContact O-CD2 3.39Å; F583-L680 HydrophobicContact CB-CD2 3.96Å; F583-L680 HydrophobicContact CB-CG 4.43Å; K584-L680 HydrophobicContact CB-CD2 4.1Å; R587-L680 VanDerWaalsContact NH1-CD1 3.27Å; Y676-L680 PolarHBondContact O-N 3.33Å; T677-L680 PolarHBondContact O-N 3.32Å; L680-G682 PolarHBondContact O-N 2.76Å; L680-G683 PolarHBondContact O-N 3.38Å
681	S	60.6	Low	80.1	Confident	91 Å²	91	55.6 Å²	55.6	64%	0.636	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.8	-177.1	50.3	0	0	0	0	114.4	M580 G683	M580-S681 WeakPolarHBondContact CE-OG 3.42Å; M580-S681 PolarHBondContact SD-OG 3.3Å; S681-G683 VanDerWaalsContact C-N 3.34Å
682	G	60.6	Low	79.9	Confident	56 Å²	56	57.7 Å²	57.7	58%	0.577	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.7	171.3	0	0	0	0	0	114.4	L680	L680-G682 PolarHBondContact O-N 2.76Å
683	G	62.5	Low	79.4	Confident	32 Å²	32	59.2 Å²	59.2	33%	0.33	30%	0.301	S	S	.	.			trans	58.9	-155.7	-172.6	0	0	0	0	0	112.8	L680 S681 E685	L680-G683 PolarHBondContact O-N 3.38Å; S681-G683 VanDerWaalsContact C-N 3.34Å; G683-E685 PolarHBondContact O-N 3.05Å
684	D	69.3	Low	79	Confident	66 Å²	66	60.8 Å²	60.8	35%	0.353	31%	0.312	S	S	.	.			trans	-80.4	109.5	165.9	178.9	5.6	0	0	0	108.4	T677 N686 F687 Y688	T677-D684 HydrophobicContact CG2-CB 3.95Å; D684-N686 PolarHBondContact O-N 2.99Å; D684-N686 VanDerWaalsContact O-N 3.13Å; D684-N686 VanDerWaalsContact OD1-CB 3.26Å; D684-N686 WeakPolarHBondContact OD1-CB 3.41Å; D684-N686 PolarHBondContact OD1-N 2.94Å; D684-F687 HydrophobicContact CB-CB 3.74Å; D684-F687 WeakPolarHBondContact O-CA 3.25Å; D684-F687 VanDerWaalsContact O-CB 3.3Å; D684-F687 WeakPolarHBondContact O-CB 3.39Å; D684-F687 PolarHBondContact O-N 2.79Å; D684-Y688 PolarHBondContact O-N 2.73Å
685	E	76.1	Confident	78.8	Confident	155 Å²	155	63 Å²	63	72%	0.724	33%	0.328	S	S	*	.	H	α-helix	trans	-52.2	-35.3	177.6	-72.3	179.6	-179.9	0	0	111.5	G683 Y688 R689	G683-E685 PolarHBondContact O-N 3.05Å; E685-Y688 PolarHBondContact O-N 3.43Å; E685-R689 VanDerWaalsContact O-CG 3.32Å; E685-R689 WeakPolarHBondContact O-CG 3.35Å; E685-R689 PolarHBondContact O-N 2.78Å
686	N	81.1	Confident	78.2	Confident	24 Å²	24	66.4 Å²	66.4	13%	0.128	34%	0.344	C	S	.	.	H	α-helix	trans	-67.6	-43.5	177	-174.3	45.5	0	0	0	111.1	D684 Y688 R689 W690 S712 G713	D684-N686 PolarHBondContact O-N 2.99Å; D684-N686 VanDerWaalsContact O-N 3.13Å; D684-N686 VanDerWaalsContact OD1-CB 3.26Å; D684-N686 WeakPolarHBondContact OD1-CB 3.41Å; D684-N686 PolarHBondContact OD1-N 2.94Å; N686-Y688 VanDerWaalsContact C-N 3.32Å; N686-Y688 PolarHBondContact O-N 3.35Å; N686-R689 PolarHBondContact O-N 2.87Å; N686-W690 VanDerWaalsContact O-CD1 3.25Å; N686-W690 PolarHBondContact O-N 2.88Å; N686-S712 PolarHBondContact ND2-O 3.12Å; N686-S712 WeakPolarHBondContact OD1-CB 3.23Å; N686-S712 PolarHBondContact OD1-OG 2.95Å; N686-G713 PolarHBondContact ND2-O 3.22Å; N686-G713 PolarHBondContact OD1-O 2.96Å
687	F	81.6	Confident	76.7	Confident	68 Å²	68	71 Å²	71	30%	0.298	38%	0.382	S	S	.	.	H	α-helix	trans	-58.5	-42.4	172.2	-179	-91.7	0	0	0	112.1	D684 W690 T691 P715 Y718	D684-F687 HydrophobicContact CB-CB 3.74Å; D684-F687 WeakPolarHBondContact O-CA 3.25Å; D684-F687 VanDerWaalsContact O-CB 3.3Å; D684-F687 WeakPolarHBondContact O-CB 3.39Å; D684-F687 PolarHBondContact O-N 2.79Å; F687-W690 PolarHBondContact O-N 3.02Å; F687-T691 VanDerWaalsContact CE1-OG1 3.31Å; F687-T691 WeakPolarHBondContact CE1-OG1 3.36Å; F687-T691 WeakPolarHBondContact O-CB 3.15Å; F687-T691 PolarHBondContact O-N 2.92Å; F687-T691 PolarHBondContact O-OG1 3.15Å; F687-P715 HydrophobicContact CB-CG 4.36Å; F687-P715 HydrophobicContact CD2-CB 3.85Å; F687-P715 HydrophobicContact CD2-CG 4.13Å; F687-Y718 AromaticContact CD2-CE2 3.9Å; F687-Y718 HydrophobicContact CD2-CE2 3.9Å; F687-Y718 HydrophobicContact CE2-CD2 4.33Å; F687-Y718 AromaticContact CE2-CE2 3.5Å; F687-Y718 HydrophobicContact CE2-CE2 3.5Å; F687-Y718 VanDerWaalsContact CE2-CE2 3.5Å; F687-Y718 AromaticContact CE2-CZ 4Å; F687-Y718 HydrophobicContact CZ-CE2 4.01Å
688	Y	82	Confident	75.6	Confident	145 Å²	145	78.1 Å²	78.1	57%	0.569	42%	0.42	S	S	*	.	H	α-helix	trans	-62.6	-45.6	176.3	-179.7	-91.1	0	0	0	111.6	D684 E685 N686 W690 T691 E692	D684-Y688 PolarHBondContact O-N 2.73Å; E685-Y688 PolarHBondContact O-N 3.43Å; N686-Y688 VanDerWaalsContact C-N 3.32Å; N686-Y688 PolarHBondContact O-N 3.35Å; Y688-W690 VanDerWaalsContact C-N 3.33Å; Y688-W690 PolarHBondContact O-N 3.35Å; Y688-T691 PolarHBondContact O-N 2.75Å; Y688-T691 VanDerWaalsContact O-N 3.16Å; Y688-E692 HydrophobicContact CE1-CB 4.34Å; Y688-E692 WeakPolarHBondContact CE1-OE2 3.46Å; Y688-E692 WeakPolarHBondContact O-CB 3.28Å; Y688-E692 PolarHBondContact O-N 2.92Å
689	R	83.2	Confident	74.7	Confident	110 Å²	110	78.4 Å²	78.4	42%	0.415	42%	0.421	S	S	.	.	H	α-helix	trans	-59.7	-41.9	177.1	-71.9	176.6	70.2	-168.3	-0.7	112.3	E685 N686 L693 L709	E685-R689 VanDerWaalsContact O-CG 3.32Å; E685-R689 WeakPolarHBondContact O-CG 3.35Å; E685-R689 PolarHBondContact O-N 2.78Å; N686-R689 PolarHBondContact O-N 2.87Å; R689-L693 VanDerWaalsContact O-CB 3.22Å; R689-L693 WeakPolarHBondContact O-CB 3.31Å; R689-L693 PolarHBondContact O-N 3.02Å; R689-L693 VanDerWaalsContact O-N 3.09Å; R689-L709 HydrophobicContact CB-CD2 3.85Å
690	W	86.5	Confident	73.8	Confident	1 Å²	1	83.5 Å²	83.5	0%	0.004	44%	0.444	C	S	.	.	H	α-helix	trans	-66.1	-42.4	173.8	-84.1	99.6	0	0	0	112.6	N686 F687 Y688 L693 L694 L706 L709 G713 V714 P715 Y718 V722	N686-W690 VanDerWaalsContact O-CD1 3.25Å; N686-W690 PolarHBondContact O-N 2.88Å; F687-W690 PolarHBondContact O-N 3.02Å; Y688-W690 VanDerWaalsContact C-N 3.33Å; Y688-W690 PolarHBondContact O-N 3.35Å; W690-L693 PolarHBondContact O-N 2.82Å; W690-L694 HydrophobicContact CE3-CD1 4.22Å; W690-L694 HydrophobicContact CE3-CG 4.39Å; W690-L694 WeakPolarHBondContact O-CB 3.49Å; W690-L694 VanDerWaalsContact O-CG 3.28Å; W690-L694 WeakPolarHBondContact O-CG 3.06Å; W690-L694 PolarHBondContact O-N 3.01Å; W690-L706 HydrophobicContact CH2-CD1 3.86Å; W690-L706 HydrophobicContact CZ3-CD1 4.34Å; W690-L709 HydrophobicContact CH2-CB 4.31Å; W690-L709 HydrophobicContact CZ2-CB 3.64Å; W690-G713 PolarHBondContact NE1-O 3.46Å; W690-V714 HydrophobicContact CH2-CG2 4.02Å; W690-V714 HydrophobicContact CZ2-CB 4.28Å; W690-V714 HydrophobicContact CZ2-CG1 4.37Å; W690-V714 HydrophobicContact CZ2-CG2 3.63Å; W690-P715 HydrophobicContact CB-CG 4.13Å; W690-P715 HydrophobicContact CG-CG 4Å; W690-Y718 HydrophobicContact CB-CD2 3.93Å; W690-Y718 HydrophobicContact CB-CE2 4.18Å; W690-V722 HydrophobicContact CE3-CG2 4.12Å; W690-V722 HydrophobicContact CH2-CG1 3.92Å; W690-V722 HydrophobicContact CH2-CG2 3.96Å; W690-V722 HydrophobicContact CZ3-CG1 4.22Å; W690-V722 HydrophobicContact CZ3-CG2 3.46Å; W690-V722 VanDerWaalsContact CZ3-CG2 3.46Å
691	T	84.1	Confident	73.2	Confident	35 Å²	35	85.7 Å²	85.7	22%	0.215	46%	0.456	C	S	.	.	H	α-helix	trans	-62.7	-48.6	178.4	-55.5	0	0	0	0	110.9	F687 Y688 L693 L694 T695 Y718	F687-T691 VanDerWaalsContact CE1-OG1 3.31Å; F687-T691 WeakPolarHBondContact CE1-OG1 3.36Å; F687-T691 WeakPolarHBondContact O-CB 3.15Å; F687-T691 PolarHBondContact O-N 2.92Å; F687-T691 PolarHBondContact O-OG1 3.15Å; Y688-T691 PolarHBondContact O-N 2.75Å; Y688-T691 VanDerWaalsContact O-N 3.16Å; T691-L693 VanDerWaalsContact C-N 3.3Å; T691-L693 PolarHBondContact O-N 2.87Å; T691-L694 PolarHBondContact O-N 2.78Å; T691-T695 HydrophobicContact CG2-CG2 4.26Å; T691-T695 WeakPolarHBondContact O-CB 3.36Å; T691-T695 VanDerWaalsContact O-CG2 3.27Å; T691-T695 WeakPolarHBondContact O-CG2 3.36Å; T691-T695 PolarHBondContact O-N 3.23Å; T691-T695 PolarHBondContact O-OG1 2.94Å; T691-Y718 PolarHBondContact OG1-OH 2.91Å; T691-Y718 VanDerWaalsContact OG1-OH 3.12Å
692	E	82.6	Confident	74.2	Confident	67 Å²	67	84.8 Å²	84.8	31%	0.313	45%	0.447	S	S	.	.	H	α-helix	trans	-56.2	-46.5	176.9	-177	179.7	-176.3	0	0	110.9	Y688 T695 Q696	Y688-E692 HydrophobicContact CE1-CB 4.34Å; Y688-E692 WeakPolarHBondContact CE1-OE2 3.46Å; Y688-E692 WeakPolarHBondContact O-CB 3.28Å; Y688-E692 PolarHBondContact O-N 2.92Å; E692-T695 PolarHBondContact O-N 3.09Å; E692-T695 PolarHBondContact O-OG1 3.14Å; E692-Q696 WeakPolarHBondContact O-CB 3.22Å; E692-Q696 WeakPolarHBondContact O-CG 3.44Å; E692-Q696 PolarHBondContact O-N 3.37Å; E692-Q696 VanDerWaalsContact O-N 3.07Å; E692-Q696 PolarHBondContact OE1-NE2 3.45Å
693	L	78.1	Confident	75.4	Confident	32 Å²	32	89.4 Å²	89.4	17%	0.168	45%	0.447	C	S	.	.	H	α-helix	trans	-67.4	-42.1	-179.5	-177.7	153	0	0	0	113.5	R689 W690 T691 T695 L701 L709	R689-L693 VanDerWaalsContact O-CB 3.22Å; R689-L693 WeakPolarHBondContact O-CB 3.31Å; R689-L693 PolarHBondContact O-N 3.02Å; R689-L693 VanDerWaalsContact O-N 3.09Å; W690-L693 PolarHBondContact O-N 2.82Å; T691-L693 VanDerWaalsContact C-N 3.3Å; T691-L693 PolarHBondContact O-N 2.87Å; L693-T695 VanDerWaalsContact C-N 3.35Å; L693-L701 HydrophobicContact CD1-CD1 3.41Å; L693-L701 VanDerWaalsContact CD1-CD1 3.41Å; L693-L701 HydrophobicContact CD1-CD2 4.21Å; L693-L701 HydrophobicContact CD1-CG 4.19Å; L693-L701 HydrophobicContact CD2-CD1 3.49Å; L693-L701 VanDerWaalsContact CD2-CD1 3.49Å; L693-L701 HydrophobicContact CD2-CD2 3.92Å; L693-L701 HydrophobicContact CD2-CG 4.33Å; L693-L701 HydrophobicContact CG-CD1 3.29Å; L693-L701 HydrophobicContact CG-CD2 4.46Å; L693-L701 HydrophobicContact CG-CG 4.42Å; L693-L709 HydrophobicContact CD1-CD1 3.11Å; L693-L709 HydrophobicContact CG-CD1 4.49Å
694	L	79.1	Confident	76.5	Confident	82 Å²	82	90.8 Å²	90.8	43%	0.429	46%	0.455	S	S	.	.	H	α-helix	trans	-76.6	-21.6	-179.6	-67.9	173	0	0	0	113	W690 T691 Y718	W690-L694 HydrophobicContact CE3-CD1 4.22Å; W690-L694 HydrophobicContact CE3-CG 4.39Å; W690-L694 WeakPolarHBondContact O-CB 3.49Å; W690-L694 VanDerWaalsContact O-CG 3.28Å; W690-L694 WeakPolarHBondContact O-CG 3.06Å; W690-L694 PolarHBondContact O-N 3.01Å; T691-L694 PolarHBondContact O-N 2.78Å; L694-Y718 HydrophobicContact CD1-CD1 3.4Å; L694-Y718 HydrophobicContact CD1-CD2 4.03Å; L694-Y718 HydrophobicContact CD1-CE1 3.87Å; L694-Y718 HydrophobicContact CD1-CE2 4.44Å; L694-Y718 HydrophobicContact CD1-CG 3.49Å; L694-Y718 VanDerWaalsContact CD1-CG 3.49Å
695	T	80.2	Confident	77.3	Confident	99 Å²	99	90.8 Å²	90.8	61%	0.607	46%	0.455	S	S	*	.	H	α-helix	trans	-89.4	-26.2	177.2	52.1	0	0	0	0	113.6	T691 E692 L693 A697	T691-T695 HydrophobicContact CG2-CG2 4.26Å; T691-T695 WeakPolarHBondContact O-CB 3.36Å; T691-T695 VanDerWaalsContact O-CG2 3.27Å; T691-T695 WeakPolarHBondContact O-CG2 3.36Å; T691-T695 PolarHBondContact O-N 3.23Å; T691-T695 PolarHBondContact O-OG1 2.94Å; E692-T695 PolarHBondContact O-N 3.09Å; E692-T695 PolarHBondContact O-OG1 3.14Å; L693-T695 VanDerWaalsContact C-N 3.35Å; T695-A697 PolarHBondContact O-N 3.2Å
696	Q	75.5	Confident	77.9	Confident	74 Å²	74	84.2 Å²	84.2	35%	0.346	43%	0.425	S	S	.	.			trans	-75	86.1	176.5	-75.3	174.4	10	0	0	111	E692 N698 R699	E692-Q696 WeakPolarHBondContact O-CB 3.22Å; E692-Q696 WeakPolarHBondContact O-CG 3.44Å; E692-Q696 PolarHBondContact O-N 3.37Å; E692-Q696 VanDerWaalsContact O-N 3.07Å; E692-Q696 PolarHBondContact OE1-NE2 3.45Å; Q696-N698 PolarHBondContact O-N 2.93Å; Q696-R699 HydrophobicContact CB-CB 4.32Å; Q696-R699 PolarHBondContact O-N 3.27Å; Q696-R699 VanDerWaalsContact OE1-CD 3.29Å
697	A	56.7	Low	78.4	Confident	98 Å²	98	85.2 Å²	85.2	81%	0.81	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-17.8	-176.5	0	0	0	0	0	115.8	T695	T695-A697 PolarHBondContact O-N 3.2Å
698	N	61.2	Low	78.9	Confident	166 Å²	166	85.3 Å²	85.3	89%	0.888	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	6.9	-172.1	-73.8	-6.2	0	0	0	114.8	Q696	Q696-N698 PolarHBondContact O-N 2.93Å
699	R	64.1	Low	79.3	Confident	149 Å²	149	78.7 Å²	78.7	56%	0.562	41%	0.409	S	S	*	.			trans	-93.7	116	-179.4	-158.5	171.5	177.7	-177.1	-2	109.9	Q696 L701	Q696-R699 HydrophobicContact CB-CB 4.32Å; Q696-R699 PolarHBondContact O-N 3.27Å; Q696-R699 VanDerWaalsContact OE1-CD 3.29Å; R699-L701 PolarHBondContact O-N 3.11Å
700	E	64.3	Low	79.7	Confident	180 Å²	180	73.4 Å²	73.4	84%	0.841	39%	0.389	S	S	*	.			trans	-62.3	117.9	169.8	-72.8	-176.2	173.7	0	0	108.9	T702	E700-T702 PolarHBondContact O-N 3.25Å
701	L	68.6	Low	80	Confident	69 Å²	69	76.3 Å²	76.3	36%	0.361	40%	0.4	S	S	.	.			trans	-76.4	110.9	179.3	-137.7	76.5	0	0	0	109.9	L693 R699 L706	L693-L701 HydrophobicContact CD1-CD1 3.41Å; L693-L701 VanDerWaalsContact CD1-CD1 3.41Å; L693-L701 HydrophobicContact CD1-CD2 4.21Å; L693-L701 HydrophobicContact CD1-CG 4.19Å; L693-L701 HydrophobicContact CD2-CD1 3.49Å; L693-L701 VanDerWaalsContact CD2-CD1 3.49Å; L693-L701 HydrophobicContact CD2-CD2 3.92Å; L693-L701 HydrophobicContact CD2-CG 4.33Å; L693-L701 HydrophobicContact CG-CD1 3.29Å; L693-L701 HydrophobicContact CG-CD2 4.46Å; L693-L701 HydrophobicContact CG-CG 4.42Å; R699-L701 PolarHBondContact O-N 3.11Å; L701-L706 HydrophobicContact CD2-CB 3.99Å; L701-L706 HydrophobicContact CD2-CD1 3.8Å; L701-L706 HydrophobicContact CD2-CD2 4.25Å; L701-L706 HydrophobicContact CD2-CG 4.22Å
702	T	81.7	Confident	80.3	Confident	72 Å²	72	76.4 Å²	76.4	44%	0.442	40%	0.402	S	S	.	.			trans	-71.1	144.5	171.2	79.4	0	0	0	0	109.2	E700 A704 D705 L706	E700-T702 PolarHBondContact O-N 3.25Å; T702-A704 PolarHBondContact O-N 3.45Å; T702-D705 PolarHBondContact O-N 3.44Å; T702-D705 VanDerWaalsContact O-N 3.17Å; T702-D705 PolarHBondContact OG1-N 3.5Å; T702-D705 PolarHBondContact OG1-OD2 2.84Å; T702-L706 PolarHBondContact O-N 2.93Å
703	R	84.6	Confident	80.7	Confident	154 Å²	154	73.4 Å²	73.4	58%	0.581	39%	0.39	S	S	*	.	H	α-helix	trans	-56.9	-34.6	176	-174.7	174	-175.8	142.1	8.6	111.8	L706 E707 L907	R703-L706 PolarHBondContact O-N 3.38Å; R703-E707 IonicContact NE-OE1 2.81Å; R703-E707 WeakPolarHBondContact O-CG 3.49Å; R703-E707 PolarHBondContact O-N 3.44Å; R703-L907 PolarHBondContact NH2-O 2.89Å; R703-L907 VanDerWaalsContact NH2-O 3.16Å
704	A	86.6	Confident	81.4	Confident	61 Å²	61	72 Å²	72	50%	0.504	38%	0.382	S	S	.	.	H	α-helix	trans	-65.3	-42.1	178.6	0	0	0	0	0	112.4	T702 L706 E707 V708	T702-A704 PolarHBondContact O-N 3.45Å; A704-L706 VanDerWaalsContact C-N 3.33Å; A704-E707 PolarHBondContact O-N 3.28Å; A704-V708 WeakPolarHBondContact O-CG2 3.32Å; A704-V708 PolarHBondContact O-N 3.41Å; A704-V708 VanDerWaalsContact O-N 3.08Å
705	D	86	Confident	81.9	Confident	66 Å²	66	68.7 Å²	68.7	35%	0.353	37%	0.366	S	S	.	.	H	α-helix	trans	-63.4	-42.8	176	-65.8	-42.5	0	0	0	110.9	T702 E707 V708 L709	T702-D705 PolarHBondContact O-N 3.44Å; T702-D705 VanDerWaalsContact O-N 3.17Å; T702-D705 PolarHBondContact OG1-N 3.5Å; T702-D705 PolarHBondContact OG1-OD2 2.84Å; D705-E707 PolarHBondContact O-N 3.21Å; D705-V708 PolarHBondContact O-N 2.67Å; D705-L709 WeakPolarHBondContact O-CD1 3.42Å; D705-L709 WeakPolarHBondContact O-CG 3.43Å; D705-L709 PolarHBondContact O-N 2.81Å; D705-L709 VanDerWaalsContact O-N 3.1Å
706	L	88.2	Confident	82.1	Confident	16 Å²	16	67.1 Å²	67.1	8%	0.084	35%	0.353	C	S	.	.	H	α-helix	trans	-64.6	-39	177.5	-170.7	58	0	0	0	112	W690 L701 T702 R703 A704 L709 C710 M725 L726 L907	W690-L706 HydrophobicContact CH2-CD1 3.86Å; W690-L706 HydrophobicContact CZ3-CD1 4.34Å; L701-L706 HydrophobicContact CD2-CB 3.99Å; L701-L706 HydrophobicContact CD2-CD1 3.8Å; L701-L706 HydrophobicContact CD2-CD2 4.25Å; L701-L706 HydrophobicContact CD2-CG 4.22Å; T702-L706 PolarHBondContact O-N 2.93Å; R703-L706 PolarHBondContact O-N 3.38Å; A704-L706 VanDerWaalsContact C-N 3.33Å; L706-L709 PolarHBondContact O-N 2.95Å; L706-C710 WeakPolarHBondContact O-CB 3.07Å; L706-C710 PolarHBondContact O-N 2.79Å; L706-M725 HydrophobicContact CD2-CE 4.41Å; L706-L726 HydrophobicContact CD2-CD2 4.05Å; L706-L907 HydrophobicContact CB-CD2 4.32Å; L706-L907 HydrophobicContact CD2-CD1 3.55Å; L706-L907 HydrophobicContact CD2-CD2 4.43Å; L706-L907 HydrophobicContact CG-CD1 3.93Å; L706-L907 HydrophobicContact CG-CD2 3.86Å
707	E	92	Very high	82.7	Confident	45 Å²	45	69.7 Å²	69.7	21%	0.21	37%	0.365	C	S	.	.	H	α-helix	trans	-60.6	-46.1	173.8	-78.9	179.1	-158.6	0	0	111.9	R703 A704 D705 L709 R711 L907 E908	R703-E707 IonicContact NE-OE1 2.81Å; R703-E707 WeakPolarHBondContact O-CG 3.49Å; R703-E707 PolarHBondContact O-N 3.44Å; A704-E707 PolarHBondContact O-N 3.28Å; D705-E707 PolarHBondContact O-N 3.21Å; E707-L709 VanDerWaalsContact C-N 3.26Å; E707-L709 PolarHBondContact O-N 3.46Å; E707-R711 VanDerWaalsContact O-CB 3.22Å; E707-R711 WeakPolarHBondContact O-CB 3.44Å; E707-R711 WeakPolarHBondContact O-CD 3.38Å; E707-R711 WeakPolarHBondContact O-CG 3.38Å; E707-R711 PolarHBondContact O-N 3.2Å; E707-R711 IonicContact OE2-CZ 3.04Å; E707-R711 IonicContact OE2-NH1 3.84Å; E707-R711 IonicContact OE2-NH2 2.67Å; E707-R711 PolarHBondContact OE2-NH2 3.02Å; E707-L907 HydrophobicContact CB-CD2 4.3Å; E707-L907 HydrophobicContact CG-CD2 3.86Å; E707-E908 HydrophobicContact CG-CG 4.07Å
708	V	90.8	Very high	84.3	Confident	70 Å²	70	67.8 Å²	67.8	42%	0.424	34%	0.337	S	S	.	.	H	α-helix	trans	-60.6	-39.4	178.2	172.3	0	0	0	0	111	A704 D705 S712	A704-V708 WeakPolarHBondContact O-CG2 3.32Å; A704-V708 PolarHBondContact O-N 3.41Å; A704-V708 VanDerWaalsContact O-N 3.08Å; D705-V708 PolarHBondContact O-N 2.67Å; V708-S712 PolarHBondContact O-N 2.84Å; V708-S712 PolarHBondContact O-OG 2.83Å
709	L	90.5	Very high	85.8	Confident	6 Å²	6	60.4 Å²	60.4	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-77.1	-42	-177.6	-70.1	166.4	0	0	0	113.7	R689 W690 L693 D705 L706 E707 R711 S712 G713	R689-L709 HydrophobicContact CB-CD2 3.85Å; W690-L709 HydrophobicContact CH2-CB 4.31Å; W690-L709 HydrophobicContact CZ2-CB 3.64Å; L693-L709 HydrophobicContact CD1-CD1 3.11Å; L693-L709 HydrophobicContact CG-CD1 4.49Å; D705-L709 WeakPolarHBondContact O-CD1 3.42Å; D705-L709 WeakPolarHBondContact O-CG 3.43Å; D705-L709 PolarHBondContact O-N 2.81Å; D705-L709 VanDerWaalsContact O-N 3.1Å; L706-L709 PolarHBondContact O-N 2.95Å; E707-L709 VanDerWaalsContact C-N 3.26Å; E707-L709 PolarHBondContact O-N 3.46Å; L709-R711 VanDerWaalsContact C-N 3.26Å; L709-R711 PolarHBondContact O-N 3.08Å; L709-S712 WeakPolarHBondContact CA-OG 3.38Å; L709-S712 PolarHBondContact O-N 2.98Å; L709-S712 VanDerWaalsContact O-N 3.09Å; L709-S712 PolarHBondContact O-OG 2.89Å; L709-G713 PolarHBondContact O-N 3.18Å
710	C	92	Very high	87.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-38	172.3	-75.2	0	0	0	0	110.6	L706 S712 G713 R900 L907	L706-C710 WeakPolarHBondContact O-CB 3.07Å; L706-C710 PolarHBondContact O-N 2.79Å; C710-S712 VanDerWaalsContact C-N 3.31Å; C710-S712 PolarHBondContact O-N 2.65Å; C710-G713 PolarHBondContact O-N 2.81Å; C710-R900 PolarHBondContact O-NH1 2.75Å; C710-L907 HydrophobicContact CB-CD2 3.89Å
711	R	93.8	Very high	88.6	Confident	61 Å²	61	51.4 Å²	51.4	23%	0.23	27%	0.274	C	S	.	.	H	α-helix	trans	-68.6	-23.4	173	-69.4	171.7	-169.4	151.5	5.5	113.1	E707 L709 R900 V904 E908 I955	E707-R711 VanDerWaalsContact O-CB 3.22Å; E707-R711 WeakPolarHBondContact O-CB 3.44Å; E707-R711 WeakPolarHBondContact O-CD 3.38Å; E707-R711 WeakPolarHBondContact O-CG 3.38Å; E707-R711 PolarHBondContact O-N 3.2Å; E707-R711 IonicContact OE2-CZ 3.04Å; E707-R711 IonicContact OE2-NH1 3.84Å; E707-R711 IonicContact OE2-NH2 2.67Å; E707-R711 PolarHBondContact OE2-NH2 3.02Å; L709-R711 VanDerWaalsContact C-N 3.26Å; L709-R711 PolarHBondContact O-N 3.08Å; R711-R900 VanDerWaalsContact C-NH2 3.34Å; R711-R900 PolarHBondContact O-NH2 2.93Å; R711-V904 HydrophobicContact CG-CG1 4.31Å; R711-V904 HydrophobicContact CG-CG2 4.06Å; R711-E908 IonicContact CZ-OE1 3.15Å; R711-E908 IonicContact CZ-OE2 3.51Å; R711-E908 IonicContact NE-OE1 2.67Å; R711-E908 PolarHBondContact NE-OE1 3.41Å; R711-E908 IonicContact NE-OE2 3.09Å; R711-E908 IonicContact NH2-OE1 2.65Å; R711-E908 PolarHBondContact NH2-OE1 3.01Å; R711-E908 IonicContact NH2-OE2 3.31Å; R711-E908 PolarHBondContact NH2-OE2 3.19Å; R711-I955 HydrophobicContact CB-CG2 4.17Å; R711-I955 WeakPolarHBondContact O-CD1 3.44Å
712	S	89.6	Confident	89.8	Confident	37 Å²	37	48.2 Å²	48.2	26%	0.259	26%	0.258	S	S	.	.	H	α-helix	trans	-87.2	-19.6	172.3	61.5	0	0	0	0	114.5	N686 V708 L709 C710 R900	N686-S712 PolarHBondContact ND2-O 3.12Å; N686-S712 WeakPolarHBondContact OD1-CB 3.23Å; N686-S712 PolarHBondContact OD1-OG 2.95Å; V708-S712 PolarHBondContact O-N 2.84Å; V708-S712 PolarHBondContact O-OG 2.83Å; L709-S712 WeakPolarHBondContact CA-OG 3.38Å; L709-S712 PolarHBondContact O-N 2.98Å; L709-S712 VanDerWaalsContact O-N 3.09Å; L709-S712 PolarHBondContact O-OG 2.89Å; C710-S712 VanDerWaalsContact C-N 3.31Å; C710-S712 PolarHBondContact O-N 2.65Å; S712-R900 PolarHBondContact O-NH2 2.89Å
713	G	91.4	Very high	90.5	Very high	5 Å²	5	44.8 Å²	44.8	5%	0.052	24%	0.237	C	C	.	.			trans	128.2	125.9	-180	0	0	0	0	0	111.3	N686 W690 L709 C710 P715	N686-G713 PolarHBondContact ND2-O 3.22Å; N686-G713 PolarHBondContact OD1-O 2.96Å; W690-G713 PolarHBondContact NE1-O 3.46Å; L709-G713 PolarHBondContact O-N 3.18Å; C710-G713 PolarHBondContact O-N 2.81Å; G713-P715 WeakPolarHBondContact O-CD 3.37Å
714	V	92	Very high	91	Very high	2 Å²	2	42 Å²	42	1%	0.012	23%	0.226	C	C	.	.			trans	-82.5	120.2	162.4	-173.2	0	0	0	0	107.4	W690 R719 V722 D903	W690-V714 HydrophobicContact CH2-CG2 4.02Å; W690-V714 HydrophobicContact CZ2-CB 4.28Å; W690-V714 HydrophobicContact CZ2-CG1 4.37Å; W690-V714 HydrophobicContact CZ2-CG2 3.63Å; V714-R719 HydrophobicContact CG1-CB 4.06Å; V714-R719 HydrophobicContact CG1-CG 4.37Å; V714-R719 PolarHBondContact O-NE 3.29Å; V714-R719 PolarHBondContact O-NH2 2.86Å; V714-V722 HydrophobicContact CG1-CB 3.98Å; V714-V722 HydrophobicContact CG1-CG1 4.27Å; V714-V722 HydrophobicContact CG1-CG2 3.94Å; V714-V722 HydrophobicContact CG2-CG1 4.12Å; V714-D903 HydrophobicContact CG2-CB 3.86Å; V714-D903 VanDerWaalsContact CG2-CG 3.44Å; V714-D903 WeakPolarHBondContact CG2-OD1 3.31Å; V714-D903 PolarHBondContact N-OD2 3.25Å
715	P	89.9	Confident	91.3	Very high	12 Å²	12	43.7 Å²	43.7	8%	0.078	23%	0.225	C	C	.	.			trans	-61.7	148.2	174.9	-21.8	32.4	0	0	0	111.3	F687 W690 G713 Q717 Y718 R719	F687-P715 HydrophobicContact CB-CG 4.36Å; F687-P715 HydrophobicContact CD2-CB 3.85Å; F687-P715 HydrophobicContact CD2-CG 4.13Å; W690-P715 HydrophobicContact CB-CG 4.13Å; W690-P715 HydrophobicContact CG-CG 4Å; G713-P715 WeakPolarHBondContact O-CD 3.37Å; P715-Q717 VanDerWaalsContact C-N 3.25Å; P715-Q717 PolarHBondContact O-N 2.87Å; P715-Q717 VanDerWaalsContact O-N 3.16Å; P715-Y718 HydrophobicContact CB-CD2 4.07Å; P715-Y718 HydrophobicContact CG-CD2 4.1Å; P715-Y718 PolarHBondContact O-N 2.82Å; P715-R719 PolarHBondContact O-N 2.79Å
716	I	85.3	Confident	91.7	Very high	67 Å²	67	41.5 Å²	41.5	34%	0.344	21%	0.213	S	C	.	.	H	α-helix	trans	-57.6	-36	-172.1	-167.6	165.9	0	0	0	113.5	Y652 Y718 R719	Y652-I716 HydrophobicContact CD1-CD1 4.04Å; Y652-I716 HydrophobicContact CE1-CD1 3.44Å; Y652-I716 VanDerWaalsContact CE1-CD1 3.44Å; Y652-I716 HydrophobicContact CE1-CG1 4.28Å; I716-Y718 PolarHBondContact O-N 2.86Å; I716-R719 PolarHBondContact O-N 3.12Å
717	Q	86.6	Confident	92.1	Very high	128 Å²	128	40.8 Å²	40.8	60%	0.598	21%	0.209	S	C	*	.	H	α-helix	trans	-67.6	-24.9	-179.1	-54.7	84.2	-6.5	0	0	112.7	P715	P715-Q717 VanDerWaalsContact C-N 3.25Å; P715-Q717 PolarHBondContact O-N 2.87Å; P715-Q717 VanDerWaalsContact O-N 3.16Å
718	Y	90.9	Very high	92.2	Very high	57 Å²	57	40.7 Å²	40.7	22%	0.224	21%	0.209	C	C	.	.	H	α-helix	trans	-103.4	-12.7	-179.1	-58	-52	0	0	0	112.5	F687 W690 T691 L694 P715 I716 E720 G721 V722	F687-Y718 AromaticContact CD2-CE2 3.9Å; F687-Y718 HydrophobicContact CD2-CE2 3.9Å; F687-Y718 HydrophobicContact CE2-CD2 4.33Å; F687-Y718 AromaticContact CE2-CE2 3.5Å; F687-Y718 HydrophobicContact CE2-CE2 3.5Å; F687-Y718 VanDerWaalsContact CE2-CE2 3.5Å; F687-Y718 AromaticContact CE2-CZ 4Å; F687-Y718 HydrophobicContact CZ-CE2 4.01Å; W690-Y718 HydrophobicContact CB-CD2 3.93Å; W690-Y718 HydrophobicContact CB-CE2 4.18Å; T691-Y718 PolarHBondContact OG1-OH 2.91Å; T691-Y718 VanDerWaalsContact OG1-OH 3.12Å; L694-Y718 HydrophobicContact CD1-CD1 3.4Å; L694-Y718 HydrophobicContact CD1-CD2 4.03Å; L694-Y718 HydrophobicContact CD1-CE1 3.87Å; L694-Y718 HydrophobicContact CD1-CE2 4.44Å; L694-Y718 HydrophobicContact CD1-CG 3.49Å; L694-Y718 VanDerWaalsContact CD1-CG 3.49Å; P715-Y718 HydrophobicContact CB-CD2 4.07Å; P715-Y718 HydrophobicContact CG-CD2 4.1Å; P715-Y718 PolarHBondContact O-N 2.82Å; I716-Y718 PolarHBondContact O-N 2.86Å; Y718-E720 PolarHBondContact O-N 2.84Å; Y718-G721 PolarHBondContact O-N 3.35Å; Y718-G721 VanDerWaalsContact O-N 3.13Å; Y718-V722 WeakPolarHBondContact O-CB 3.37Å; Y718-V722 VanDerWaalsContact O-CG2 3.31Å; Y718-V722 WeakPolarHBondContact O-CG2 3.3Å; Y718-V722 PolarHBondContact O-N 2.88Å
719	R	94.1	Very high	92.3	Very high	11 Å²	11	40 Å²	40	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-45.6	-172.8	-165.4	174.1	-67.2	126	-1.7	113.4	V714 P715 I716 G721 V722 W723 F818 D903	V714-R719 HydrophobicContact CG1-CB 4.06Å; V714-R719 HydrophobicContact CG1-CG 4.37Å; V714-R719 PolarHBondContact O-NE 3.29Å; V714-R719 PolarHBondContact O-NH2 2.86Å; P715-R719 PolarHBondContact O-N 2.79Å; I716-R719 PolarHBondContact O-N 3.12Å; R719-G721 VanDerWaalsContact C-N 3.33Å; R719-G721 PolarHBondContact O-N 3.23Å; R719-V722 PolarHBondContact O-N 3.38Å; R719-W723 HydrophobicContact CG-CD2 3.93Å; R719-W723 HydrophobicContact CG-CG 4.09Å; R719-W723 HydrophobicContact CG-CZ2 4.01Å; R719-W723 VanDerWaalsContact O-CB 3.29Å; R719-W723 WeakPolarHBondContact O-CB 3.1Å; R719-W723 PolarHBondContact O-N 3.24Å; R719-F818 HydrophobicContact CG-CD1 4.38Å; R719-D903 IonicContact NE-OD1 2.58Å
720	E	94.2	Very high	92.4	Very high	92 Å²	92	44.6 Å²	44.6	43%	0.43	24%	0.237	S	C	.	.	H	α-helix	trans	-54	-50.8	174.2	175	174	-174.5	0	0	111.1	Y718 R724 F818 L819	Y718-E720 PolarHBondContact O-N 2.84Å; E720-R724 WeakPolarHBondContact O-CB 3.44Å; E720-R724 PolarHBondContact O-N 3.47Å; E720-F818 WeakPolarHBondContact CB-O 3.42Å; E720-F818 WeakPolarHBondContact CG-O 3.45Å; E720-L819 HydrophobicContact CG-CD2 4.36Å
721	G	92.7	Very high	92.5	Very high	48 Å²	48	44.6 Å²	44.6	50%	0.495	24%	0.237	S	C	.	.	H	α-helix	trans	-65.5	-44.9	-178.1	0	0	0	0	0	113.2	Y718 R719 M725	Y718-G721 PolarHBondContact O-N 3.35Å; Y718-G721 VanDerWaalsContact O-N 3.13Å; R719-G721 VanDerWaalsContact C-N 3.33Å; R719-G721 PolarHBondContact O-N 3.23Å; G721-M725 VanDerWaalsContact O-CB 3.32Å; G721-M725 WeakPolarHBondContact O-CB 3.44Å; G721-M725 PolarHBondContact O-N 3.47Å
722	V	92.8	Very high	92.4	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.018	25%	0.249	C	C	.	.	H	α-helix	trans	-67.6	-49.3	-179	173.1	0	0	0	0	111	W690 V714 Y718 R719 R724 M725 L726	W690-V722 HydrophobicContact CE3-CG2 4.12Å; W690-V722 HydrophobicContact CH2-CG1 3.92Å; W690-V722 HydrophobicContact CH2-CG2 3.96Å; W690-V722 HydrophobicContact CZ3-CG1 4.22Å; W690-V722 HydrophobicContact CZ3-CG2 3.46Å; W690-V722 VanDerWaalsContact CZ3-CG2 3.46Å; V714-V722 HydrophobicContact CG1-CB 3.98Å; V714-V722 HydrophobicContact CG1-CG1 4.27Å; V714-V722 HydrophobicContact CG1-CG2 3.94Å; V714-V722 HydrophobicContact CG2-CG1 4.12Å; Y718-V722 WeakPolarHBondContact O-CB 3.37Å; Y718-V722 VanDerWaalsContact O-CG2 3.31Å; Y718-V722 WeakPolarHBondContact O-CG2 3.3Å; Y718-V722 PolarHBondContact O-N 2.88Å; R719-V722 PolarHBondContact O-N 3.38Å; V722-R724 VanDerWaalsContact C-N 3.32Å; V722-R724 PolarHBondContact O-N 3.41Å; V722-M725 WeakPolarHBondContact O-CB 3.27Å; V722-M725 PolarHBondContact O-N 3.02Å; V722-L726 HydrophobicContact CG1-CD1 4.09Å; V722-L726 HydrophobicContact CG1-CG 4.44Å; V722-L726 WeakPolarHBondContact O-CG 3.49Å; V722-L726 PolarHBondContact O-N 2.89Å
723	W	96.6	Very high	92.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.7	-45.1	178.5	-74.6	16.9	0	0	0	110.8	R719 M725 L726 I727 V814 F818 L819 W902 D903 L906	R719-W723 HydrophobicContact CG-CD2 3.93Å; R719-W723 HydrophobicContact CG-CG 4.09Å; R719-W723 HydrophobicContact CG-CZ2 4.01Å; R719-W723 VanDerWaalsContact O-CB 3.29Å; R719-W723 WeakPolarHBondContact O-CB 3.1Å; R719-W723 PolarHBondContact O-N 3.24Å; W723-M725 VanDerWaalsContact C-N 3.33Å; W723-M725 PolarHBondContact O-N 3.04Å; W723-L726 PolarHBondContact O-N 3.05Å; W723-I727 HydrophobicContact CB-CD1 4.44Å; W723-I727 WeakPolarHBondContact O-CB 3.48Å; W723-I727 VanDerWaalsContact O-CD1 3.25Å; W723-I727 WeakPolarHBondContact O-CD1 3.49Å; W723-I727 VanDerWaalsContact O-CG1 3.24Å; W723-I727 WeakPolarHBondContact O-CG1 3.48Å; W723-I727 PolarHBondContact O-N 2.82Å; W723-V814 HydrophobicContact CH2-CG1 4.38Å; W723-V814 HydrophobicContact CZ3-CG1 4.47Å; W723-F818 HydrophobicContact CE3-CB 4.1Å; W723-F818 HydrophobicContact CE3-CD2 4.23Å; W723-F818 HydrophobicContact CE3-CG 4.41Å; W723-F818 AromaticContact CH2-CD2 3.68Å; W723-F818 HydrophobicContact CH2-CD2 3.68Å; W723-F818 AromaticContact CH2-CE2 3.95Å; W723-F818 HydrophobicContact CH2-CE2 3.95Å; W723-F818 HydrophobicContact CH2-CG 4.43Å; W723-F818 HydrophobicContact CZ3-CB 4.15Å; W723-F818 AromaticContact CZ3-CD2 3.44Å; W723-F818 HydrophobicContact CZ3-CD2 3.44Å; W723-F818 VanDerWaalsContact CZ3-CD2 3.44Å; W723-F818 HydrophobicContact CZ3-CE2 4.18Å; W723-F818 HydrophobicContact CZ3-CG 4.05Å; W723-L819 HydrophobicContact CB-CD2 4.22Å; W723-W902 HydrophobicContact CE3-CE3 4.31Å; W723-W902 HydrophobicContact CH2-CB 3.74Å; W723-W902 HydrophobicContact CH2-CD2 4.06Å; W723-W902 AromaticContact CH2-CE3 3.58Å; W723-W902 HydrophobicContact CH2-CE3 3.58Å; W723-W902 HydrophobicContact CH2-CG 4.17Å; W723-W902 HydrophobicContact CH2-CZ3 4.47Å; W723-W902 HydrophobicContact CZ2-CB 3.53Å; W723-W902 HydrophobicContact CZ2-CE3 4.32Å; W723-W902 HydrophobicContact CZ2-CG 4.43Å; W723-W902 HydrophobicContact CZ3-CD2 4.47Å; W723-W902 AromaticContact CZ3-CE3 3.56Å; W723-W902 HydrophobicContact CZ3-CE3 3.56Å; W723-W902 HydrophobicContact CZ3-CZ3 4.07Å; W723-D903 PolarHBondContact NE1-OD1 3.08Å; W723-L906 HydrophobicContact CB-CD1 4.01Å; W723-L906 HydrophobicContact CD2-CD1 3.47Å; W723-L906 VanDerWaalsContact CD2-CD1 3.47Å; W723-L906 HydrophobicContact CE3-CD1 3.94Å; W723-L906 HydrophobicContact CG-CD1 3.51Å; W723-L906 HydrophobicContact CZ2-CD1 4.46Å
724	R	95.6	Very high	92.6	Very high	95 Å²	95	53.2 Å²	53.2	36%	0.358	28%	0.275	S	S	.	.	H	α-helix	trans	-57.9	-45.6	175.3	-173.3	178	-177.5	-141.2	-11	111.7	E720 V722 I727 H728 L819 D823	E720-R724 WeakPolarHBondContact O-CB 3.44Å; E720-R724 PolarHBondContact O-N 3.47Å; V722-R724 VanDerWaalsContact C-N 3.32Å; V722-R724 PolarHBondContact O-N 3.41Å; R724-I727 PolarHBondContact O-N 3.24Å; R724-H728 VanDerWaalsContact O-CB 3.23Å; R724-H728 WeakPolarHBondContact O-CB 3.38Å; R724-H728 PolarHBondContact O-CD2 3.37Å; R724-H728 PolarHBondContact O-N 3.15Å; R724-L819 HydrophobicContact CB-CD2 4.16Å; R724-D823 IonicContact CZ-OD1 3.18Å; R724-D823 IonicContact NE-OD1 3.43Å; R724-D823 PolarHBondContact NE-OD1 3.06Å; R724-D823 IonicContact NE-OD2 2.62Å; R724-D823 PolarHBondContact NE-OD2 2.95Å
725	M	92.9	Very high	92.7	Very high	97 Å²	97	54.9 Å²	54.9	48%	0.478	28%	0.283	S	S	.	.	H	α-helix	trans	-58.7	-46.9	176.7	179.3	-166.9	74.5	0	0	111.9	L706 G721 V722 W723 G729	L706-M725 HydrophobicContact CD2-CE 4.41Å; G721-M725 VanDerWaalsContact O-CB 3.32Å; G721-M725 WeakPolarHBondContact O-CB 3.44Å; G721-M725 PolarHBondContact O-N 3.47Å; V722-M725 WeakPolarHBondContact O-CB 3.27Å; V722-M725 PolarHBondContact O-N 3.02Å; W723-M725 VanDerWaalsContact C-N 3.33Å; W723-M725 PolarHBondContact O-N 3.04Å; M725-G729 PolarHBondContact O-N 3.29Å
726	L	94.3	Very high	92.8	Very high	20 Å²	20	60.6 Å²	60.6	11%	0.105	31%	0.309	C	S	.	.	H	α-helix	trans	-62.5	-47.3	-180	-67.2	173.5	0	0	0	111.7	L706 V722 W723 G729 E730 L906 L907	L706-L726 HydrophobicContact CD2-CD2 4.05Å; V722-L726 HydrophobicContact CG1-CD1 4.09Å; V722-L726 HydrophobicContact CG1-CG 4.44Å; V722-L726 WeakPolarHBondContact O-CG 3.49Å; V722-L726 PolarHBondContact O-N 2.89Å; W723-L726 PolarHBondContact O-N 3.05Å; L726-G729 PolarHBondContact O-N 3.07Å; L726-E730 PolarHBondContact O-N 2.7Å; L726-E730 VanDerWaalsContact O-N 3.13Å; L726-L906 HydrophobicContact CD1-CB 4.01Å; L726-L907 HydrophobicContact CD1-CB 4.26Å; L726-L907 HydrophobicContact CD2-CB 4.42Å; L726-L907 HydrophobicContact CD2-CD1 3.75Å
727	I	95.7	Very high	93.1	Very high	1 Å²	1	64 Å²	64	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-67	-47.3	-178.6	-67.1	157.7	0	0	0	111.1	W723 R724 G729 E730 L731 L819 W826 C827 A830 L906	W723-I727 HydrophobicContact CB-CD1 4.44Å; W723-I727 WeakPolarHBondContact O-CB 3.48Å; W723-I727 VanDerWaalsContact O-CD1 3.25Å; W723-I727 WeakPolarHBondContact O-CD1 3.49Å; W723-I727 VanDerWaalsContact O-CG1 3.24Å; W723-I727 WeakPolarHBondContact O-CG1 3.48Å; W723-I727 PolarHBondContact O-N 2.82Å; R724-I727 PolarHBondContact O-N 3.24Å; I727-G729 VanDerWaalsContact C-N 3.28Å; I727-G729 PolarHBondContact O-N 3.39Å; I727-E730 PolarHBondContact O-N 3.13Å; I727-L731 HydrophobicContact CG2-CD1 4.22Å; I727-L731 WeakPolarHBondContact O-CB 3.31Å; I727-L731 PolarHBondContact O-N 3.5Å; I727-L819 HydrophobicContact CD1-CD1 3.76Å; I727-W826 HydrophobicContact CG2-CB 4.22Å; I727-C827 HydrophobicContact CD1-CB 3.58Å; I727-C827 WeakPolarHBondContact CD1-SG 3.35Å; I727-C827 HydrophobicContact CG1-CB 4.48Å; I727-A830 HydrophobicContact CG2-CB 3.97Å; I727-L906 HydrophobicContact CG1-CD2 4.33Å
728	H	94.8	Very high	93.4	Very high	43 Å²	43	62.1 Å²	62.1	20%	0.199	32%	0.316	C	S	.	.	H	α-helix	trans	-67	-33.2	179	-77.1	-134.9	0	0	0	111.2	R724 L731 H732 M735 D823	R724-H728 VanDerWaalsContact O-CB 3.23Å; R724-H728 WeakPolarHBondContact O-CB 3.38Å; R724-H728 PolarHBondContact O-CD2 3.37Å; R724-H728 PolarHBondContact O-N 3.15Å; H728-L731 PolarHBondContact O-N 3.48Å; H728-H732 VanDerWaalsContact O-CA 3.27Å; H728-H732 WeakPolarHBondContact O-CA 3.23Å; H728-H732 WeakPolarHBondContact O-CB 3.11Å; H728-H732 PolarHBondContact O-N 3.26Å; H728-M735 HydrophobicContact CB-SD 4.36Å; H728-M735 VanDerWaalsContact CE1-CE 3.4Å; H728-M735 WeakPolarHBondContact CE1-CE 3.49Å; H728-D823 IonicContact CD2-OD1 2.85Å; H728-D823 IonicContact CE1-OD1 3.37Å; H728-D823 PolarHBondContact CE1-OD1 3.18Å; H728-D823 VanDerWaalsContact CE1-OD1 3.25Å; H728-D823 IonicContact NE2-OD1 3.48Å; H728-D823 PolarHBondContact NE2-OD1 2.92Å
729	G	91.9	Very high	93.1	Very high	55 Å²	55	60.4 Å²	60.4	57%	0.567	32%	0.315	S	S	*	.	H	α-helix	trans	-59.4	-49.1	172.9	0	0	0	0	0	112	M725 L726 I727	M725-G729 PolarHBondContact O-N 3.29Å; L726-G729 PolarHBondContact O-N 3.07Å; I727-G729 VanDerWaalsContact C-N 3.28Å; I727-G729 PolarHBondContact O-N 3.39Å
730	E	92.8	Very high	92.7	Very high	102 Å²	102	65.2 Å²	65.2	48%	0.477	35%	0.348	S	S	.	.	H	α-helix	trans	-69.2	-34	177.7	-85.1	-63.2	176.4	0	0	113.7	L726 I727 F835	L726-E730 PolarHBondContact O-N 2.7Å; L726-E730 VanDerWaalsContact O-N 3.13Å; I727-E730 PolarHBondContact O-N 3.13Å; E730-F835 HydrophobicContact CG-CE1 3.91Å; E730-F835 HydrophobicContact CG-CZ 4.15Å
731	L	94.9	Very high	92.3	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-95.9	5.6	-177.8	-64.7	-176.2	0	0	0	114.6	I727 H728 Q733 L734 M735 W826 I829 A830 R834	I727-L731 HydrophobicContact CG2-CD1 4.22Å; I727-L731 WeakPolarHBondContact O-CB 3.31Å; I727-L731 PolarHBondContact O-N 3.5Å; H728-L731 PolarHBondContact O-N 3.48Å; L731-Q733 VanDerWaalsContact C-N 3.31Å; L731-Q733 PolarHBondContact O-N 2.93Å; L731-Q733 VanDerWaalsContact O-N 3.15Å; L731-L734 HydrophobicContact CD2-CD2 4.09Å; L731-L734 PolarHBondContact O-N 2.97Å; L731-M735 HydrophobicContact CB-CG 4.02Å; L731-M735 HydrophobicContact CB-SD 4.03Å; L731-M735 WeakPolarHBondContact O-CG 3.29Å; L731-M735 PolarHBondContact O-N 3.13Å; L731-W826 HydrophobicContact CD1-CB 4.13Å; L731-W826 HydrophobicContact CD1-CE3 4Å; L731-W826 WeakPolarHBondContact CD1-O 3.24Å; L731-I829 HydrophobicContact CD1-CB 4.18Å; L731-I829 HydrophobicContact CD1-CG2 4.04Å; L731-I829 HydrophobicContact CD2-CG2 4.17Å; L731-A830 HydrophobicContact CD1-CB 3.79Å; L731-A830 HydrophobicContact CD2-CB 4.4Å; L731-A830 HydrophobicContact CG-CB 4Å; L731-R834 HydrophobicContact CD2-CG 3.59Å
732	H	92.2	Very high	92.3	Very high	104 Å²	104	66.9 Å²	66.9	48%	0.481	35%	0.345	S	S	.	.	H	α-helix	trans	-50.3	-48	-171.5	178.1	-98.3	0	0	0	113.1	H728 Q736	H728-H732 VanDerWaalsContact O-CA 3.27Å; H728-H732 WeakPolarHBondContact O-CA 3.23Å; H728-H732 WeakPolarHBondContact O-CB 3.11Å; H728-H732 PolarHBondContact O-N 3.26Å; H732-Q736 PolarHBondContact CE1-NE2 3.46Å; H732-Q736 PolarHBondContact NE2-NE2 3.16Å; H732-Q736 VanDerWaalsContact NE2-NE2 3.12Å; H732-Q736 WeakPolarHBondContact O-CG 3.35Å; H732-Q736 PolarHBondContact O-N 3.32Å; H732-Q736 VanDerWaalsContact O-N 3.1Å
733	Q	92.3	Very high	92.3	Very high	154 Å²	154	66.8 Å²	66.8	72%	0.72	34%	0.344	S	S	*	.	H	α-helix	trans	-65.4	-42.6	178.8	-63.8	179.9	10.4	0	0	112.3	L731 Q736 I737	L731-Q733 VanDerWaalsContact C-N 3.31Å; L731-Q733 PolarHBondContact O-N 2.93Å; L731-Q733 VanDerWaalsContact O-N 3.15Å; Q733-Q736 PolarHBondContact O-N 3.39Å; Q733-I737 WeakPolarHBondContact O-CD1 3.47Å; Q733-I737 VanDerWaalsContact O-CG1 3.27Å; Q733-I737 WeakPolarHBondContact O-CG1 3.38Å; Q733-I737 PolarHBondContact O-N 3.38Å; Q733-I737 VanDerWaalsContact O-N 3.11Å
734	L	92.7	Very high	91.9	Very high	25 Å²	25	70 Å²	70	13%	0.131	36%	0.361	C	S	.	.	H	α-helix	trans	-65.6	-43.6	-179.7	-177.7	65.2	0	0	0	111.1	L731 Q736 I737 K738 W826 I829	L731-L734 HydrophobicContact CD2-CD2 4.09Å; L731-L734 PolarHBondContact O-N 2.97Å; L734-Q736 VanDerWaalsContact C-N 3.34Å; L734-Q736 PolarHBondContact O-N 3.15Å; L734-I737 PolarHBondContact O-N 3.45Å; L734-K738 HydrophobicContact CD1-CG 4.23Å; L734-K738 HydrophobicContact CG-CG 4.45Å; L734-K738 WeakPolarHBondContact O-CB 3.44Å; L734-K738 WeakPolarHBondContact O-CG 3.45Å; L734-K738 PolarHBondContact O-N 3.18Å; L734-W826 HydrophobicContact CD2-CZ3 4.3Å; L734-W826 HydrophobicContact CG-CZ3 4.42Å; L734-I829 HydrophobicContact CD2-CG2 3.88Å
735	M	93.1	Very high	91.5	Very high	37 Å²	37	67 Å²	67	18%	0.182	36%	0.361	C	S	.	.	H	α-helix	trans	-64	-38.4	178.8	-66.8	176.3	77.5	0	0	111.7	H728 L731 G739 W826	H728-M735 HydrophobicContact CB-SD 4.36Å; H728-M735 VanDerWaalsContact CE1-CE 3.4Å; H728-M735 WeakPolarHBondContact CE1-CE 3.49Å; L731-M735 HydrophobicContact CB-CG 4.02Å; L731-M735 HydrophobicContact CB-SD 4.03Å; L731-M735 WeakPolarHBondContact O-CG 3.29Å; L731-M735 PolarHBondContact O-N 3.13Å; M735-G739 PolarHBondContact O-N 3.07Å; M735-W826 HydrophobicContact CE-CD2 4.13Å; M735-W826 HydrophobicContact CE-CG 4.06Å; M735-W826 HydrophobicContact CG-CD2 3.93Å; M735-W826 HydrophobicContact CG-CE3 3.88Å; M735-W826 HydrophobicContact CG-CH2 3.97Å; M735-W826 HydrophobicContact CG-CZ2 4.04Å; M735-W826 HydrophobicContact CG-CZ3 3.9Å; M735-W826 HydrophobicContact SD-CD2 4.31Å; M735-W826 HydrophobicContact SD-CG 4.42Å
736	Q	91.4	Very high	91.4	Very high	133 Å²	133	62.7 Å²	62.7	62%	0.621	34%	0.339	S	S	*	.	H	α-helix	trans	-64	-42.8	173.8	-75.5	-171.5	-6	0	0	112.6	H732 Q733 L734	H732-Q736 PolarHBondContact CE1-NE2 3.46Å; H732-Q736 PolarHBondContact NE2-NE2 3.16Å; H732-Q736 VanDerWaalsContact NE2-NE2 3.12Å; H732-Q736 WeakPolarHBondContact O-CG 3.35Å; H732-Q736 PolarHBondContact O-N 3.32Å; H732-Q736 VanDerWaalsContact O-N 3.1Å; Q733-Q736 PolarHBondContact O-N 3.39Å; L734-Q736 VanDerWaalsContact C-N 3.34Å; L734-Q736 PolarHBondContact O-N 3.15Å
737	I	93.1	Very high	90.9	Very high	138 Å²	138	63.6 Å²	63.6	71%	0.708	34%	0.344	S	S	*	.	H	α-helix	trans	-65.6	-41.3	179.5	-68.5	164	0	0	0	111.2	Q733 L734	Q733-I737 WeakPolarHBondContact O-CD1 3.47Å; Q733-I737 VanDerWaalsContact O-CG1 3.27Å; Q733-I737 WeakPolarHBondContact O-CG1 3.38Å; Q733-I737 PolarHBondContact O-N 3.38Å; Q733-I737 VanDerWaalsContact O-N 3.11Å; L734-I737 PolarHBondContact O-N 3.45Å
738	K	91.5	Very high	90.3	Very high	88 Å²	88	70.4 Å²	70.4	38%	0.383	38%	0.376	S	S	.	.	H	α-helix	trans	-79.8	-27.8	-177.3	-66.6	-61.4	-171.4	174.2	0	113.3	L734 Y742 W826	L734-K738 HydrophobicContact CD1-CG 4.23Å; L734-K738 HydrophobicContact CG-CG 4.45Å; L734-K738 WeakPolarHBondContact O-CB 3.44Å; L734-K738 WeakPolarHBondContact O-CG 3.45Å; L734-K738 PolarHBondContact O-N 3.18Å; K738-Y742 HydrophobicContact CB-CD1 3.79Å; K738-Y742 HydrophobicContact CB-CD2 4.11Å; K738-Y742 HydrophobicContact CB-CE1 4.3Å; K738-Y742 HydrophobicContact CB-CG 3.67Å; K738-Y742 HydrophobicContact CD-CD1 4.34Å; K738-Y742 HydrophobicContact CD-CD2 4.11Å; K738-Y742 HydrophobicContact CD-CE1 4.03Å; K738-Y742 HydrophobicContact CD-CE2 3.84Å; K738-Y742 HydrophobicContact CD-CG 4.37Å; K738-Y742 HydrophobicContact CG-CD1 4.02Å; K738-Y742 HydrophobicContact CG-CD2 4.48Å; K738-Y742 HydrophobicContact CG-CE1 4.01Å; K738-Y742 HydrophobicContact CG-CG 4.25Å; K738-W826 HydrophobicContact CB-CH2 4.19Å; K738-W826 HydrophobicContact CG-CH2 4.47Å
739	G	85.7	Confident	89.6	Confident	21 Å²	21	72.6 Å²	72.6	22%	0.216	39%	0.386	C	S	.	.			trans	80.6	168	179.9	0	0	0	0	0	114.1	M735 L741 Y742	M735-G739 PolarHBondContact O-N 3.07Å; G739-L741 PolarHBondContact O-N 2.97Å; G739-Y742 WeakPolarHBondContact O-CB 3.26Å; G739-Y742 PolarHBondContact O-N 3.01Å
740	P	84.6	Confident	88.7	Confident	113 Å²	113	70.3 Å²	70.3	73%	0.734	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-16.7	-169	29.4	-36.3	0	0	0	114.9
741	L	87.3	Confident	87.3	Confident	131 Å²	131	69.7 Å²	69.7	69%	0.686	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	4.3	179.9	-64.9	174.9	0	0	0	112.9	G739 Y743 N744 G745	G739-L741 PolarHBondContact O-N 2.97Å; L741-Y743 PolarHBondContact O-N 3.42Å; L741-N744 PolarHBondContact O-N 2.98Å; L741-G745 PolarHBondContact O-N 2.75Å
742	Y	93	Very high	85.8	Confident	44 Å²	44	78 Å²	78	17%	0.173	41%	0.406	C	S	.	.	H	α-helix	trans	-60.2	-48.4	-170.2	-177.2	-121.9	0	0	0	113.3	K738 G739 N744 G745 L746 H798 F825 W826	K738-Y742 HydrophobicContact CB-CD1 3.79Å; K738-Y742 HydrophobicContact CB-CD2 4.11Å; K738-Y742 HydrophobicContact CB-CE1 4.3Å; K738-Y742 HydrophobicContact CB-CG 3.67Å; K738-Y742 HydrophobicContact CD-CD1 4.34Å; K738-Y742 HydrophobicContact CD-CD2 4.11Å; K738-Y742 HydrophobicContact CD-CE1 4.03Å; K738-Y742 HydrophobicContact CD-CE2 3.84Å; K738-Y742 HydrophobicContact CD-CG 4.37Å; K738-Y742 HydrophobicContact CG-CD1 4.02Å; K738-Y742 HydrophobicContact CG-CD2 4.48Å; K738-Y742 HydrophobicContact CG-CE1 4.01Å; K738-Y742 HydrophobicContact CG-CG 4.25Å; G739-Y742 WeakPolarHBondContact O-CB 3.26Å; G739-Y742 PolarHBondContact O-N 3.01Å; Y742-N744 PolarHBondContact O-N 3.48Å; Y742-G745 PolarHBondContact O-N 3.07Å; Y742-L746 HydrophobicContact CD1-CD1 4.08Å; Y742-L746 HydrophobicContact CE1-CD1 3.65Å; Y742-L746 HydrophobicContact CE1-CG 4.44Å; Y742-L746 HydrophobicContact CE2-CD1 4.22Å; Y742-L746 HydrophobicContact CE2-CD2 4.09Å; Y742-L746 HydrophobicContact CE2-CG 4.14Å; Y742-L746 WeakPolarHBondContact O-CG 3.12Å; Y742-L746 PolarHBondContact O-N 3.44Å; Y742-H798 AromaticContact CE1-CE1 3.92Å; Y742-H798 AromaticContact CE1-ND1 3.36Å; Y742-H798 WeakPolarHBondContact CE1-ND1 3.44Å; Y742-H798 AromaticContact CZ-ND1 3.52Å; Y742-H798 PolarHBondContact OH-ND1 3.03Å; Y742-F825 HydrophobicContact CD1-CE1 4.25Å; Y742-F825 HydrophobicContact CD1-CZ 4.41Å; Y742-F825 HydrophobicContact CE1-CE1 4.4Å; Y742-F825 HydrophobicContact CE1-CZ 4.16Å; Y742-W826 AromaticContact CD1-CH2 3.73Å; Y742-W826 HydrophobicContact CD1-CH2 3.73Å; Y742-W826 HydrophobicContact CD1-CZ2 4.15Å; Y742-W826 HydrophobicContact CE1-CH2 4.38Å
743	Y	92.4	Very high	84.4	Confident	1 Å²	1	74.8 Å²	74.8	0%	0.004	39%	0.393	C	S	.	.	H	α-helix	trans	-60.1	-45	179.9	173.1	-108.5	0	0	0	112.3	L741 L746 L747 A794 K821 E822 F825	L741-Y743 PolarHBondContact O-N 3.42Å; Y743-L746 PolarHBondContact O-N 2.73Å; Y743-L747 HydrophobicContact CD1-CD1 4.33Å; Y743-L747 HydrophobicContact CE1-CD1 3.7Å; Y743-L747 HydrophobicContact CE1-CG 4.49Å; Y743-L747 HydrophobicContact CE2-CD1 4.44Å; Y743-L747 HydrophobicContact CE2-CG 4.49Å; Y743-L747 PolarHBondContact O-N 2.93Å; Y743-A794 HydrophobicContact CD2-CB 3.75Å; Y743-A794 HydrophobicContact CE2-CB 3.54Å; Y743-K821 HydrophobicContact CE1-CD 4.17Å; Y743-K821 HydrophobicContact CE1-CG 4.06Å; Y743-E822 HydrophobicContact CD1-CB 3.98Å; Y743-E822 HydrophobicContact CD1-CG 4.11Å; Y743-E822 HydrophobicContact CE1-CB 4.38Å; Y743-E822 HydrophobicContact CG-CB 4.38Å; Y743-E822 HydrophobicContact CG-CG 4.12Å; Y743-F825 HydrophobicContact CD2-CB 3.7Å; Y743-F825 AromaticContact CD2-CD1 3.62Å; Y743-F825 HydrophobicContact CD2-CD1 3.62Å; Y743-F825 AromaticContact CD2-CD2 3.89Å; Y743-F825 HydrophobicContact CD2-CD2 3.89Å; Y743-F825 HydrophobicContact CD2-CE1 4.16Å; Y743-F825 HydrophobicContact CD2-CE2 4.4Å; Y743-F825 AromaticContact CD2-CG 3.45Å; Y743-F825 HydrophobicContact CD2-CG 3.45Å; Y743-F825 VanDerWaalsContact CD2-CG 3.45Å; Y743-F825 HydrophobicContact CE2-CB 3.68Å; Y743-F825 HydrophobicContact CE2-CD1 4.45Å; Y743-F825 HydrophobicContact CE2-CD2 4.13Å; Y743-F825 AromaticContact CE2-CG 3.85Å; Y743-F825 HydrophobicContact CE2-CG 3.85Å; Y743-F825 HydrophobicContact CG-CD1 4.26Å; Y743-F825 HydrophobicContact CG-CG 4.46Å
744	N	88	Confident	83	Confident	67 Å²	67	73.2 Å²	73.2	36%	0.358	39%	0.393	S	S	.	.	H	α-helix	trans	-65.8	-40	178.5	-66.1	-32.7	0	0	0	111.6	L741 Y742 L746 L747 E748	L741-N744 PolarHBondContact O-N 2.98Å; Y742-N744 PolarHBondContact O-N 3.48Å; N744-L746 VanDerWaalsContact C-N 3.29Å; N744-L746 PolarHBondContact O-N 3.38Å; N744-L747 PolarHBondContact O-N 3.42Å; N744-L747 VanDerWaalsContact O-N 3.15Å; N744-E748 PolarHBondContact O-N 3.31Å; N744-E748 VanDerWaalsContact O-N 3.13Å
745	G	87.1	Confident	81.4	Confident	33 Å²	33	76 Å²	76	34%	0.34	41%	0.408	S	S	.	.	H	α-helix	trans	-59.6	-38.4	175.1	0	0	0	0	0	113	L741 Y742 L747 E748 E749	L741-G745 PolarHBondContact O-N 2.75Å; Y742-G745 PolarHBondContact O-N 3.07Å; G745-L747 PolarHBondContact O-N 3.27Å; G745-E748 PolarHBondContact O-N 3.15Å; G745-E749 WeakPolarHBondContact O-CB 3.2Å; G745-E749 PolarHBondContact O-N 2.9Å
746	L	89.7	Confident	79.8	Confident	5 Å²	5	74.3 Å²	74.3	3%	0.026	40%	0.4	C	S	.	.	H	α-helix	trans	-65.4	-37.1	175.6	-67.1	171.2	0	0	0	112.7	Y742 Y743 N744 E749 F750 A794 I797 H798 F825	Y742-L746 HydrophobicContact CD1-CD1 4.08Å; Y742-L746 HydrophobicContact CE1-CD1 3.65Å; Y742-L746 HydrophobicContact CE1-CG 4.44Å; Y742-L746 HydrophobicContact CE2-CD1 4.22Å; Y742-L746 HydrophobicContact CE2-CD2 4.09Å; Y742-L746 HydrophobicContact CE2-CG 4.14Å; Y742-L746 WeakPolarHBondContact O-CG 3.12Å; Y742-L746 PolarHBondContact O-N 3.44Å; Y743-L746 PolarHBondContact O-N 2.73Å; N744-L746 VanDerWaalsContact C-N 3.29Å; N744-L746 PolarHBondContact O-N 3.38Å; L746-E749 PolarHBondContact O-N 2.94Å; L746-F750 PolarHBondContact O-N 3.24Å; L746-F750 VanDerWaalsContact O-N 3.09Å; L746-A794 HydrophobicContact CB-CB 4.12Å; L746-A794 HydrophobicContact CD1-CB 4.36Å; L746-I797 HydrophobicContact CD2-CB 4.06Å; L746-I797 HydrophobicContact CD2-CG2 3.62Å; L746-I797 WeakPolarHBondContact O-CD1 3.43Å; L746-H798 HydrophobicContact CD1-CB 4.14Å; L746-F825 HydrophobicContact CD1-CE1 4.38Å; L746-F825 HydrophobicContact CD1-CE2 3.98Å; L746-F825 HydrophobicContact CD1-CZ 3.49Å; L746-F825 VanDerWaalsContact CD1-CZ 3.49Å
747	L	85.5	Confident	78.5	Confident	39 Å²	39	70.7 Å²	70.7	20%	0.204	39%	0.393	C	S	.	.	H	α-helix	trans	-67.3	-38.5	177.3	-67	178.7	0	0	0	112.1	Y743 N744 G745 F750 E790 A794	Y743-L747 HydrophobicContact CD1-CD1 4.33Å; Y743-L747 HydrophobicContact CE1-CD1 3.7Å; Y743-L747 HydrophobicContact CE1-CG 4.49Å; Y743-L747 HydrophobicContact CE2-CD1 4.44Å; Y743-L747 HydrophobicContact CE2-CG 4.49Å; Y743-L747 PolarHBondContact O-N 2.93Å; N744-L747 PolarHBondContact O-N 3.42Å; N744-L747 VanDerWaalsContact O-N 3.15Å; G745-L747 PolarHBondContact O-N 3.27Å; L747-F750 PolarHBondContact O-N 3.01Å; L747-E790 HydrophobicContact CD1-CB 4.31Å; L747-E790 HydrophobicContact CD1-CG 4.44Å; L747-E790 HydrophobicContact CD2-CB 3.81Å; L747-E790 HydrophobicContact CD2-CG 4.24Å; L747-E790 VanDerWaalsContact CD2-O 3.25Å; L747-E790 WeakPolarHBondContact CD2-O 3.48Å; L747-A794 HydrophobicContact CD2-CB 4.03Å
748	E	82.7	Confident	77.4	Confident	144 Å²	144	70.5 Å²	70.5	67%	0.673	39%	0.389	S	S	*	.	H	α-helix	trans	-64.9	-46	174.8	-69.3	174.6	-176.4	0	0	110.8	N744 G745 F750 S751	N744-E748 PolarHBondContact O-N 3.31Å; N744-E748 VanDerWaalsContact O-N 3.13Å; G745-E748 PolarHBondContact O-N 3.15Å; E748-F750 PolarHBondContact O-N 3.29Å; E748-S751 PolarHBondContact O-N 2.98Å; E748-S751 PolarHBondContact O-OG 2.82Å
749	E	80.5	Confident	76.6	Confident	90 Å²	90	68.1 Å²	68.1	42%	0.421	38%	0.379	S	S	.	.	H	α-helix	trans	-60.1	-32.2	177.7	-164.4	-169.3	143.8	0	0	112.6	G745 L746 S751 E752 N753 I797	G745-E749 WeakPolarHBondContact O-CB 3.2Å; G745-E749 PolarHBondContact O-N 2.9Å; L746-E749 PolarHBondContact O-N 2.94Å; E749-S751 PolarHBondContact O-N 3.13Å; E749-S751 VanDerWaalsContact O-N 3.14Å; E749-E752 PolarHBondContact O-N 3Å; E749-N753 HydrophobicContact CG-CB 4.39Å; E749-N753 WeakPolarHBondContact O-CB 3.49Å; E749-N753 PolarHBondContact O-N 3.45Å; E749-N753 PolarHBondContact OE1-ND2 3.26Å; E749-I797 HydrophobicContact CB-CD1 4.36Å; E749-I797 WeakPolarHBondContact OE1-CG2 3.29Å
750	F	72.2	Confident	76.1	Confident	7 Å²	7	72 Å²	72	3%	0.031	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.9	-178.5	-168.4	-89.5	0	0	0	114.5	L746 L747 E748 E752 A756 R760 Q793 I797	L746-F750 PolarHBondContact O-N 3.24Å; L746-F750 VanDerWaalsContact O-N 3.09Å; L747-F750 PolarHBondContact O-N 3.01Å; E748-F750 PolarHBondContact O-N 3.29Å; F750-E752 VanDerWaalsContact C-N 3.34Å; F750-A756 HydrophobicContact CD1-CB 4.42Å; F750-A756 HydrophobicContact CD2-CB 3.25Å; F750-A756 HydrophobicContact CE1-CB 4.4Å; F750-A756 HydrophobicContact CE2-CB 3.2Å; F750-A756 HydrophobicContact CG-CB 3.86Å; F750-A756 HydrophobicContact CZ-CB 3.8Å; F750-A756 WeakPolarHBondContact CZ-O 3.36Å; F750-R760 HydrophobicContact CE1-CB 4.27Å; F750-R760 HydrophobicContact CE1-CG 4.11Å; F750-R760 HydrophobicContact CZ-CB 3.86Å; F750-R760 HydrophobicContact CZ-CG 4.17Å; F750-R760 PolarHBondContact O-NH2 2.92Å; F750-Q793 HydrophobicContact CD1-CB 4.2Å; F750-Q793 HydrophobicContact CD1-CG 4.1Å; F750-Q793 HydrophobicContact CD2-CB 3.55Å; F750-Q793 HydrophobicContact CD2-CG 3.99Å; F750-Q793 HydrophobicContact CE1-CB 4.16Å; F750-Q793 HydrophobicContact CE1-CG 3.61Å; F750-Q793 HydrophobicContact CE2-CB 3.54Å; F750-Q793 HydrophobicContact CE2-CG 3.51Å; F750-Q793 HydrophobicContact CG-CB 3.94Å; F750-Q793 HydrophobicContact CG-CG 4.31Å; F750-Q793 HydrophobicContact CZ-CB 3.9Å; F750-Q793 HydrophobicContact CZ-CG 3.34Å; F750-I797 VanDerWaalsContact CA-CD1 3.44Å; F750-I797 HydrophobicContact CB-CD1 3.53Å; F750-I797 HydrophobicContact CD2-CD1 3.59Å; F750-I797 HydrophobicContact CD2-CG1 4.03Å; F750-I797 HydrophobicContact CG-CD1 4.03Å
751	S	63.9	Low	75.4	Confident	88 Å²	88	71.2 Å²	71.2	62%	0.615	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-30.7	175.9	66.3	0	0	0	0	112.8	E748 E749	E748-S751 PolarHBondContact O-N 2.98Å; E748-S751 PolarHBondContact O-OG 2.82Å; E749-S751 PolarHBondContact O-N 3.13Å; E749-S751 VanDerWaalsContact O-N 3.14Å
752	E	63.1	Low	74.8	Confident	176 Å²	176	67.1 Å²	67.1	82%	0.822	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-20.1	-174.8	-59.7	-170.6	165.6	0	0	113.6	E749 F750 T754	E749-E752 PolarHBondContact O-N 3Å; F750-E752 VanDerWaalsContact C-N 3.34Å; E752-T754 PolarHBondContact O-N 3.04Å
753	N	62.8	Low	74.5	Confident	37 Å²	37	65 Å²	65	20%	0.198	34%	0.339	C	S	.	.			trans	-79	121.9	-171.8	-169	-33.8	0	0	0	112.9	E749 L755 A756 A757	E749-N753 HydrophobicContact CG-CB 4.39Å; E749-N753 WeakPolarHBondContact O-CB 3.49Å; E749-N753 PolarHBondContact O-N 3.45Å; E749-N753 PolarHBondContact OE1-ND2 3.26Å; N753-L755 VanDerWaalsContact C-N 3.34Å; N753-L755 PolarHBondContact O-N 3.23Å; N753-L755 WeakPolarHBondContact OD1-CB 3.19Å; N753-L755 PolarHBondContact OD1-N 2.81Å; N753-A756 HydrophobicContact CB-CB 4.03Å; N753-A756 WeakPolarHBondContact O-CB 3.27Å; N753-A756 PolarHBondContact O-N 2.78Å; N753-A757 PolarHBondContact O-N 2.85Å
754	T	63.7	Low	74	Confident	120 Å²	120	67.5 Å²	67.5	74%	0.736	36%	0.356	S	S	*	.	H	α-helix	trans	-66	-31.9	-179	-8.8	0	0	0	0	113.3	E752 A757	E752-T754 PolarHBondContact O-N 3.04Å; T754-A757 WeakPolarHBondContact O-CB 3.29Å; T754-A757 PolarHBondContact O-N 3.02Å
755	L	58.7	Low	73.7	Confident	84 Å²	84	68 Å²	68	44%	0.44	36%	0.358	S	S	.	.	H	α-helix	trans	-70.2	-37	177	-68.3	170.5	0	0	0	111.1	N753 A757 Q758	N753-L755 VanDerWaalsContact C-N 3.34Å; N753-L755 PolarHBondContact O-N 3.23Å; N753-L755 WeakPolarHBondContact OD1-CB 3.19Å; N753-L755 PolarHBondContact OD1-N 2.81Å; L755-A757 PolarHBondContact O-N 2.98Å; L755-Q758 WeakPolarHBondContact O-CB 3.41Å; L755-Q758 PolarHBondContact O-N 2.85Å; L755-Q758 VanDerWaalsContact O-N 3.1Å
756	A	59.4	Low	73.7	Confident	2 Å²	2	66.4 Å²	66.4	2%	0.017	34%	0.342	C	S	.	.	H	α-helix	trans	-58.8	-34.1	174.4	0	0	0	0	0	112.3	F750 N753 Q758 H759 R760 I797	F750-A756 HydrophobicContact CD1-CB 4.42Å; F750-A756 HydrophobicContact CD2-CB 3.25Å; F750-A756 HydrophobicContact CE1-CB 4.4Å; F750-A756 HydrophobicContact CE2-CB 3.2Å; F750-A756 HydrophobicContact CG-CB 3.86Å; F750-A756 HydrophobicContact CZ-CB 3.8Å; F750-A756 WeakPolarHBondContact CZ-O 3.36Å; N753-A756 HydrophobicContact CB-CB 4.03Å; N753-A756 WeakPolarHBondContact O-CB 3.27Å; N753-A756 PolarHBondContact O-N 2.78Å; A756-Q758 VanDerWaalsContact C-N 3.27Å; A756-Q758 PolarHBondContact O-N 3.44Å; A756-H759 PolarHBondContact O-N 3.5Å; A756-R760 WeakPolarHBondContact O-CB 3.47Å; A756-R760 PolarHBondContact O-N 2.83Å; A756-I797 HydrophobicContact CB-CD1 4.27Å; A756-I797 HydrophobicContact CB-CG1 4.27Å
757	A	64.7	Low	73.7	Confident	56 Å²	56	66.6 Å²	66.6	46%	0.463	34%	0.343	S	S	.	.	H	α-helix	trans	-61.7	-33	176.8	0	0	0	0	0	112.9	N753 T754 L755	N753-A757 PolarHBondContact O-N 2.85Å; T754-A757 WeakPolarHBondContact O-CB 3.29Å; T754-A757 PolarHBondContact O-N 3.02Å; L755-A757 PolarHBondContact O-N 2.98Å
758	Q	68.8	Low	73.8	Confident	135 Å²	135	68.9 Å²	68.9	63%	0.631	36%	0.355	S	S	*	.	H	α-helix	trans	-66	-43.1	178.2	-62.5	-177.5	-17.4	0	0	111.4	L755 A756	L755-Q758 WeakPolarHBondContact O-CB 3.41Å; L755-Q758 PolarHBondContact O-N 2.85Å; L755-Q758 VanDerWaalsContact O-N 3.1Å; A756-Q758 VanDerWaalsContact C-N 3.27Å; A756-Q758 PolarHBondContact O-N 3.44Å
759	H	75.2	Confident	74	Confident	38 Å²	38	65.7 Å²	65.7	18%	0.176	34%	0.337	C	S	.	.	H	α-helix	trans	-83.7	-24.9	-179.2	-62.2	-60.3	0	0	0	113.5	A756 R761 Q762 I763 Y804	A756-H759 PolarHBondContact O-N 3.5Å; H759-R761 PolarHBondContact O-N 3.16Å; H759-R761 VanDerWaalsContact O-N 3.13Å; H759-Q762 PolarHBondContact O-N 2.99Å; H759-Q762 VanDerWaalsContact O-N 3.09Å; H759-I763 HydrophobicContact CB-CD1 4.26Å; H759-I763 WeakPolarHBondContact O-CG1 3.33Å; H759-I763 PolarHBondContact O-N 3.17Å; H759-Y804 PolarHBondContact ND1-N 2.74Å
760	R	74.2	Confident	74.5	Confident	102 Å²	102	61.4 Å²	61.4	39%	0.385	32%	0.317	S	S	.	.	H	α-helix	trans	-49.6	-42.7	-179.5	-173.5	179.9	-71.4	-172.4	-4	112.1	F750 A756 S764	F750-R760 HydrophobicContact CE1-CB 4.27Å; F750-R760 HydrophobicContact CE1-CG 4.11Å; F750-R760 HydrophobicContact CZ-CB 3.86Å; F750-R760 HydrophobicContact CZ-CG 4.17Å; F750-R760 PolarHBondContact O-NH2 2.92Å; A756-R760 WeakPolarHBondContact O-CB 3.47Å; A756-R760 PolarHBondContact O-N 2.83Å; R760-S764 WeakPolarHBondContact O-CB 3.4Å; R760-S764 PolarHBondContact O-N 3.43Å; R760-S764 PolarHBondContact O-OG 2.97Å
761	R	70.4	Confident	75.3	Confident	97 Å²	97	61 Å²	61	37%	0.366	32%	0.315	S	S	.	.	H	α-helix	trans	-66.7	-50.2	-179.8	-168.5	-172.1	-169.2	104.8	22.8	111.9	H759 I763 S764 L765 Y1150	H759-R761 PolarHBondContact O-N 3.16Å; H759-R761 VanDerWaalsContact O-N 3.13Å; R761-I763 VanDerWaalsContact C-N 3.32Å; R761-I763 PolarHBondContact O-N 2.77Å; R761-S764 WeakPolarHBondContact O-CB 3.4Å; R761-S764 PolarHBondContact O-N 3.44Å; R761-L765 WeakPolarHBondContact O-CG 3.28Å; R761-L765 PolarHBondContact O-N 2.99Å; R761-L765 VanDerWaalsContact O-N 3.09Å; R761-Y1150 PolarHBondContact NH1-O 3.03Å
762	Q	75.7	Confident	76.4	Confident	44 Å²	44	60.4 Å²	60.4	21%	0.206	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-41.4	-179.2	-169.7	65.1	34.1	0	0	111.3	H759 L765 D766 Y804	H759-Q762 PolarHBondContact O-N 2.99Å; H759-Q762 VanDerWaalsContact O-N 3.09Å; Q762-L765 PolarHBondContact O-N 3.12Å; Q762-D766 PolarHBondContact O-N 3.26Å; Q762-Y804 HydrophobicContact CB-CD1 4.13Å; Q762-Y804 HydrophobicContact CB-CE1 4.35Å; Q762-Y804 HydrophobicContact CG-CD1 3.82Å; Q762-Y804 HydrophobicContact CG-CE1 3.72Å
763	I	86	Confident	77.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.3	-51.8	173.3	-67.8	167.9	0	0	0	109.5	H759 R761 L765 D766 L767 Q789 L792 Q793 Y804	H759-I763 HydrophobicContact CB-CD1 4.26Å; H759-I763 WeakPolarHBondContact O-CG1 3.33Å; H759-I763 PolarHBondContact O-N 3.17Å; R761-I763 VanDerWaalsContact C-N 3.32Å; R761-I763 PolarHBondContact O-N 2.77Å; I763-L765 VanDerWaalsContact C-N 3.27Å; I763-L765 PolarHBondContact O-N 3.47Å; I763-D766 PolarHBondContact O-N 3.28Å; I763-L767 HydrophobicContact CG2-CD2 4.19Å; I763-L767 HydrophobicContact CG2-CG 4.39Å; I763-L767 WeakPolarHBondContact O-CG 3.32Å; I763-L767 PolarHBondContact O-N 3.22Å; I763-L767 VanDerWaalsContact O-N 3.08Å; I763-Q789 HydrophobicContact CG2-CG 4.39Å; I763-L792 HydrophobicContact CD1-CB 4.02Å; I763-L792 HydrophobicContact CG1-CB 4.19Å; I763-L792 HydrophobicContact CG2-CB 4.08Å; I763-L792 HydrophobicContact CG2-CD1 4.06Å; I763-Q793 HydrophobicContact CD1-CG 3.98Å; I763-Y804 HydrophobicContact CD1-CD2 4.42Å; I763-Y804 HydrophobicContact CD1-CG 4.28Å; I763-Y804 HydrophobicContact CG1-CD1 3.92Å; I763-Y804 HydrophobicContact CG1-CD2 3.84Å; I763-Y804 HydrophobicContact CG1-CE1 4.3Å; I763-Y804 HydrophobicContact CG1-CE2 4.22Å; I763-Y804 HydrophobicContact CG1-CG 3.67Å
764	S	82.7	Confident	78.9	Confident	54 Å²	54	54 Å²	54	38%	0.378	28%	0.28	S	S	.	.	H	α-helix	trans	-57.8	-36.9	-177.3	-57	0	0	0	0	113.3	R760 R761 D766	R760-S764 WeakPolarHBondContact O-CB 3.4Å; R760-S764 PolarHBondContact O-N 3.43Å; R760-S764 PolarHBondContact O-OG 2.97Å; R761-S764 WeakPolarHBondContact O-CB 3.4Å; R761-S764 PolarHBondContact O-N 3.44Å; S764-D766 VanDerWaalsContact C-N 3.34Å
765	L	81.2	Confident	80.2	Confident	76 Å²	76	50.9 Å²	50.9	40%	0.398	26%	0.261	S	S	.	.	H	α-helix	trans	-69.1	-32.4	175.9	-68.6	172.8	0	0	0	112.8	R761 Q762 I763 T1152	R761-L765 WeakPolarHBondContact O-CG 3.28Å; R761-L765 PolarHBondContact O-N 2.99Å; R761-L765 VanDerWaalsContact O-N 3.09Å; Q762-L765 PolarHBondContact O-N 3.12Å; I763-L765 VanDerWaalsContact C-N 3.27Å; I763-L765 PolarHBondContact O-N 3.47Å; L765-T1152 HydrophobicContact CD1-CG2 4.07Å
766	D	87	Confident	81.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-81.8	-23.9	-177.7	-73.6	-7.2	0	0	0	112.9	Q762 I763 S764 L768 R769 T770 Y804 N809	Q762-D766 PolarHBondContact O-N 3.26Å; I763-D766 PolarHBondContact O-N 3.28Å; S764-D766 VanDerWaalsContact C-N 3.34Å; D766-L768 PolarHBondContact O-N 3.28Å; D766-R769 VanDerWaalsContact O-CG 3.31Å; D766-R769 WeakPolarHBondContact O-CG 3.34Å; D766-R769 PolarHBondContact O-N 3.21Å; D766-R769 IonicContact OD1-CZ 2.79Å; D766-R769 IonicContact OD1-NE 2.91Å; D766-R769 PolarHBondContact OD1-NE 3.45Å; D766-R769 IonicContact OD1-NH2 2.87Å; D766-R769 PolarHBondContact OD1-NH2 2.98Å; D766-R769 IonicContact OD2-NH2 2.66Å; D766-R769 PolarHBondContact OD2-NH2 2.96Å; D766-R769 VanDerWaalsContact OD2-NH2 3.12Å; D766-T770 PolarHBondContact O-N 3.49Å; D766-T770 PolarHBondContact O-OG1 3.37Å; D766-Y804 WeakPolarHBondContact CB-OH 3.42Å; D766-Y804 WeakPolarHBondContact OD2-CE1 3.29Å; D766-Y804 PolarHBondContact OD2-OH 3.49Å; D766-N809 HydrophobicContact CB-CB 4.32Å
767	L	89.7	Confident	83.4	Confident	10 Å²	10	49.7 Å²	49.7	5%	0.052	25%	0.253	C	S	.	.	H	α-helix	trans	-53.1	-58.2	-178.1	-69.6	-179.8	0	0	0	113.1	I763 R769 T770 V785 L788 Q789	I763-L767 HydrophobicContact CG2-CD2 4.19Å; I763-L767 HydrophobicContact CG2-CG 4.39Å; I763-L767 WeakPolarHBondContact O-CG 3.32Å; I763-L767 PolarHBondContact O-N 3.22Å; I763-L767 VanDerWaalsContact O-N 3.08Å; L767-R769 VanDerWaalsContact C-N 3.28Å; L767-R769 PolarHBondContact O-N 2.93Å; L767-T770 PolarHBondContact O-N 3.25Å; L767-V785 HydrophobicContact CB-CG1 3.93Å; L767-V785 HydrophobicContact CD1-CG1 3.93Å; L767-V785 HydrophobicContact CD2-CG1 4.49Å; L767-V785 HydrophobicContact CG-CG1 4.3Å; L767-L788 HydrophobicContact CD2-CB 4.14Å; L767-L788 HydrophobicContact CD2-CD2 3.9Å; L767-L788 HydrophobicContact CD2-CG 3.83Å; L767-Q789 HydrophobicContact CD1-CB 3.8Å; L767-Q789 HydrophobicContact CD1-CG 4.02Å; L767-Q789 HydrophobicContact CD2-CB 3.94Å
768	L	86.9	Confident	84.4	Confident	87 Å²	87	49.3 Å²	49.3	46%	0.455	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-14.6	-172.5	-65.3	178.8	0	0	0	114.4	D766 I780	D766-L768 PolarHBondContact O-N 3.28Å; L768-I780 HydrophobicContact CD2-CB 3.95Å; L768-I780 HydrophobicContact CD2-CG1 4.42Å
769	R	87.4	Confident	85.3	Confident	76 Å²	76	46.2 Å²	46.2	29%	0.287	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-1.8	174.4	67.5	179	-166.6	80.5	5.8	113	D766 L767 Q806	D766-R769 VanDerWaalsContact O-CG 3.31Å; D766-R769 WeakPolarHBondContact O-CG 3.34Å; D766-R769 PolarHBondContact O-N 3.21Å; D766-R769 IonicContact OD1-CZ 2.79Å; D766-R769 IonicContact OD1-NE 2.91Å; D766-R769 PolarHBondContact OD1-NE 3.45Å; D766-R769 IonicContact OD1-NH2 2.87Å; D766-R769 PolarHBondContact OD1-NH2 2.98Å; D766-R769 IonicContact OD2-NH2 2.66Å; D766-R769 PolarHBondContact OD2-NH2 2.96Å; D766-R769 VanDerWaalsContact OD2-NH2 3.12Å; L767-R769 VanDerWaalsContact C-N 3.28Å; L767-R769 PolarHBondContact O-N 2.93Å; R769-Q806 VanDerWaalsContact NH2-CG 3.34Å
770	T	90.9	Very high	85.6	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	-91.1	116.9	179.2	-57.6	0	0	0	0	109.9	D766 L767 F777 L788 N809 F810 A813	D766-T770 PolarHBondContact O-N 3.49Å; D766-T770 PolarHBondContact O-OG1 3.37Å; L767-T770 PolarHBondContact O-N 3.25Å; T770-F777 VanDerWaalsContact O-CB 3.27Å; T770-F777 WeakPolarHBondContact O-CB 3.47Å; T770-L788 HydrophobicContact CG2-CD2 3.85Å; T770-N809 HydrophobicContact CG2-CB 4.42Å; T770-N809 PolarHBondContact OG1-ND2 2.89Å; T770-F810 HydrophobicContact CG2-CD1 3.96Å; T770-F810 HydrophobicContact CG2-CE1 4.35Å; T770-A813 HydrophobicContact CG2-CB 3.45Å; T770-A813 VanDerWaalsContact CG2-CB 3.45Å
771	M	89.2	Confident	86	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	48.3	49.6	-177.1	-67	-179.2	179.3	0	0	114.5	F654 N773 N774 F777 A813 V814 L817 Y890 F895	F654-M771 HydrophobicContact CE1-CG 4.37Å; F654-M771 HydrophobicContact CZ-CE 4.49Å; F654-M771 HydrophobicContact CZ-SD 4.21Å; M771-N773 PolarHBondContact O-N 3.06Å; M771-N774 HydrophobicContact CB-CB 3.98Å; M771-N774 WeakPolarHBondContact O-CB 3.47Å; M771-N774 PolarHBondContact O-N 3.11Å; M771-F777 HydrophobicContact CB-CB 4.25Å; M771-F777 HydrophobicContact CB-CD2 3.81Å; M771-F777 HydrophobicContact CB-CG 4.27Å; M771-F777 HydrophobicContact SD-CD2 3.98Å; M771-F777 HydrophobicContact SD-CE2 3.79Å; M771-A813 HydrophobicContact CE-CB 4.01Å; M771-A813 HydrophobicContact CG-CB 4.43Å; M771-A813 HydrophobicContact SD-CB 3.89Å; M771-V814 HydrophobicContact CE-CB 4.22Å; M771-V814 HydrophobicContact CE-CG2 3.41Å; M771-V814 VanDerWaalsContact CE-CG2 3.41Å; M771-L817 HydrophobicContact CE-CD1 3.75Å; M771-L817 HydrophobicContact SD-CD1 3.8Å; M771-L817 HydrophobicContact SD-CG 4.25Å; M771-Y890 HydrophobicContact CE-CD2 3.83Å; M771-Y890 HydrophobicContact CE-CE2 3.29Å; M771-Y890 HydrophobicContact CG-CE2 3.75Å; M771-Y890 WeakPolarHBondContact CG-OH 3.43Å; M771-Y890 HydrophobicContact SD-CE2 4.35Å; M771-F895 HydrophobicContact CE-CE2 4.45Å
772	P	87.6	Confident	86.8	Confident	74 Å²	74	47.8 Å²	47.8	48%	0.481	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.1	-174	28.5	-36.6	0	0	0	113.7	D778	P772-D778 WeakPolarHBondContact O-CB 3.41Å
773	N	86.2	Confident	87.4	Confident	78 Å²	78	49.7 Å²	49.7	42%	0.417	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	1.6	174.8	63.1	-28	0	0	0	113.6	F654 K655 M771	F654-N773 WeakPolarHBondContact CA-O 3.4Å; K655-N773 WeakPolarHBondContact CB-O 3.16Å; K655-N773 WeakPolarHBondContact CG-O 3.3Å; K655-N773 PolarHBondContact N-O 3.14Å; M771-N773 PolarHBondContact O-N 3.06Å
774	N	92.3	Very high	87.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-103.2	133.6	177.4	-170.9	-66.2	0	0	0	111	Y652 G653 F654 M771 Q776 F777 D778	Y652-N774 PolarHBondContact O-ND2 2.93Å; G653-N774 CarbonylContact O-C 3.48Å; G653-N774 WeakPolarHBondContact O-CA 3.33Å; F654-N774 HydrophobicContact CD1-CB 3.83Å; F654-N774 HydrophobicContact CE1-CB 3.79Å; F654-N774 HydrophobicContact CZ-CB 4.45Å; M771-N774 HydrophobicContact CB-CB 3.98Å; M771-N774 WeakPolarHBondContact O-CB 3.47Å; M771-N774 PolarHBondContact O-N 3.11Å; N774-Q776 PolarHBondContact O-N 2.78Å; N774-Q776 WeakPolarHBondContact OD1-CB 3.38Å; N774-Q776 PolarHBondContact OD1-N 3.05Å; N774-F777 HydrophobicContact CB-CD2 4.09Å; N774-F777 CarbonylContact O-C 3.24Å; N774-F777 PolarHBondContact O-N 2.68Å; N774-D778 WeakPolarHBondContact O-CB 3.49Å; N774-D778 PolarHBondContact O-N 2.87Å
775	V	91.2	Very high	88.1	Confident	55 Å²	55	47.3 Å²	47.3	33%	0.333	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.4	-178	-63.3	0	0	0	0	114.6	V649 G653 K655	V649-V775 HydrophobicContact CG1-CG1 3.91Å; V649-V775 HydrophobicContact CG2-CG1 4.11Å; G653-V775 PolarHBondContact O-N 3.03Å; K655-V775 HydrophobicContact CG-CG1 4.2Å
776	Q	90.5	Very high	88.6	Confident	62 Å²	62	49.3 Å²	49.3	29%	0.29	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-18.2	176.4	-63.3	-166.7	-13.3	0	0	113	N774 A782 G784 V785	N774-Q776 PolarHBondContact O-N 2.78Å; N774-Q776 WeakPolarHBondContact OD1-CB 3.38Å; N774-Q776 PolarHBondContact OD1-N 3.05Å; Q776-A782 VanDerWaalsContact O-CB 3.25Å; Q776-A782 WeakPolarHBondContact O-CB 3.4Å; Q776-G784 CarbonylContact O-C 3.56Å; Q776-G784 WeakPolarHBondContact O-CA 3.4Å; Q776-G784 PolarHBondContact O-N 3.26Å; Q776-V785 PolarHBondContact O-N 3.03Å
777	F	93.3	Very high	89	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	5	-171.8	-51.7	-79.9	0	0	0	114.2	T770 M771 N774 N779 G784 V785 L788 A813 L816 L817	T770-F777 VanDerWaalsContact O-CB 3.27Å; T770-F777 WeakPolarHBondContact O-CB 3.47Å; M771-F777 HydrophobicContact CB-CB 4.25Å; M771-F777 HydrophobicContact CB-CD2 3.81Å; M771-F777 HydrophobicContact CB-CG 4.27Å; M771-F777 HydrophobicContact SD-CD2 3.98Å; M771-F777 HydrophobicContact SD-CE2 3.79Å; N774-F777 HydrophobicContact CB-CD2 4.09Å; N774-F777 CarbonylContact O-C 3.24Å; N774-F777 PolarHBondContact O-N 2.68Å; F777-N779 VanDerWaalsContact C-N 3.33Å; F777-N779 PolarHBondContact O-N 2.73Å; F777-G784 VanDerWaalsContact CE1-C 3.48Å; F777-G784 VanDerWaalsContact CE1-O 3.31Å; F777-G784 WeakPolarHBondContact CE1-O 3.18Å; F777-V785 HydrophobicContact CB-CG2 4.4Å; F777-L788 HydrophobicContact CD1-CD2 4.25Å; F777-L788 HydrophobicContact CE1-CB 4.09Å; F777-L788 HydrophobicContact CE1-CD2 4.28Å; F777-A813 HydrophobicContact CE1-CB 4.37Å; F777-A813 HydrophobicContact CE2-CB 4.46Å; F777-A813 HydrophobicContact CZ-CB 4.11Å; F777-L816 HydrophobicContact CE1-CD1 4.49Å; F777-L816 HydrophobicContact CZ-CB 4.18Å; F777-L817 HydrophobicContact CE2-CD2 3.83Å; F777-L817 HydrophobicContact CE2-CG 4.35Å
778	D	87.1	Confident	89.4	Confident	47 Å²	47	53 Å²	53	25%	0.251	28%	0.278	S	S	.	.	S	Bend	trans	-74.2	-16.3	-169.1	63.5	1.5	0	0	0	115.3	K655 P772 N774	K655-D778 WeakPolarHBondContact CE-OD2 3.41Å; K655-D778 IonicContact NZ-OD2 3.92Å; K655-D778 PolarHBondContact NZ-OD2 3.43Å; P772-D778 WeakPolarHBondContact O-CB 3.41Å; N774-D778 WeakPolarHBondContact O-CB 3.49Å; N774-D778 PolarHBondContact O-N 2.87Å
779	N	86.8	Confident	89.7	Confident	70 Å²	70	51.6 Å²	51.6	37%	0.374	27%	0.269	S	S	.	.	S	Bend	trans	-152.1	167	179.7	71.8	72	0	0	0	111.2	F777 D781 A782 V785	F777-N779 VanDerWaalsContact C-N 3.33Å; F777-N779 PolarHBondContact O-N 2.73Å; N779-D781 VanDerWaalsContact C-N 3.28Å; N779-D781 PolarHBondContact O-N 2.85Å; N779-D781 WeakPolarHBondContact OD1-CA 3.31Å; N779-D781 WeakPolarHBondContact OD1-CB 3.48Å; N779-D781 PolarHBondContact OD1-N 3Å; N779-A782 WeakPolarHBondContact O-CB 3.35Å; N779-A782 PolarHBondContact O-N 3.2Å; N779-A782 VanDerWaalsContact O-N 3.11Å; N779-A782 PolarHBondContact OD1-N 3.35Å; N779-V785 VanDerWaalsContact O-CG2 3.24Å; N779-V785 WeakPolarHBondContact O-CG2 3.34Å
780	I	82.1	Confident	90	Very high	117 Å²	117	49.6 Å²	49.6	60%	0.6	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-27.6	-173.3	-161.1	161.1	0	0	0	113.9	L768 A782	L768-I780 HydrophobicContact CD2-CB 3.95Å; L768-I780 HydrophobicContact CD2-CG1 4.42Å; I780-A782 VanDerWaalsContact C-N 3.29Å
781	D	82.1	Confident	90.2	Very high	148 Å²	148	49.6 Å²	49.6	79%	0.791	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-1.2	178.7	-55.5	-47.8	0	0	0	111.8	N779	N779-D781 VanDerWaalsContact C-N 3.28Å; N779-D781 PolarHBondContact O-N 2.85Å; N779-D781 WeakPolarHBondContact OD1-CA 3.31Å; N779-D781 WeakPolarHBondContact OD1-CB 3.48Å; N779-D781 PolarHBondContact OD1-N 3Å
782	A	87.7	Confident	90.5	Very high	5 Å²	5	49.7 Å²	49.7	4%	0.041	26%	0.263	C	S	.	.			trans	-69.7	136.5	-179.6	0	0	0	0	0	110.4	Q776 N779 I780 G784 V785	Q776-A782 VanDerWaalsContact O-CB 3.25Å; Q776-A782 WeakPolarHBondContact O-CB 3.4Å; N779-A782 WeakPolarHBondContact O-CB 3.35Å; N779-A782 PolarHBondContact O-N 3.2Å; N779-A782 VanDerWaalsContact O-N 3.11Å; N779-A782 PolarHBondContact OD1-N 3.35Å; I780-A782 VanDerWaalsContact C-N 3.29Å; A782-G784 PolarHBondContact O-N 2.84Å; A782-G784 VanDerWaalsContact O-N 3.14Å; A782-V785 HydrophobicContact CB-CG2 4.31Å; A782-V785 WeakPolarHBondContact O-CB 3.35Å; A782-V785 PolarHBondContact O-N 3.18Å
783	P	88.4	Confident	90.8	Very high	84 Å²	84	47.1 Å²	47.1	55%	0.545	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-24	-171.3	26	-35.4	0	0	0	113.5	K787	P783-K787 VanDerWaalsContact O-CG 3.28Å; P783-K787 WeakPolarHBondContact O-CG 3.24Å; P783-K787 PolarHBondContact O-N 3.19Å
784	G	91.7	Very high	91.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-73	-32.3	175.6	0	0	0	0	0	112.5	Q776 F777 A782 K787 L788	Q776-G784 CarbonylContact O-C 3.56Å; Q776-G784 WeakPolarHBondContact O-CA 3.4Å; Q776-G784 PolarHBondContact O-N 3.26Å; F777-G784 VanDerWaalsContact CE1-C 3.48Å; F777-G784 VanDerWaalsContact CE1-O 3.31Å; F777-G784 WeakPolarHBondContact CE1-O 3.18Å; A782-G784 PolarHBondContact O-N 2.84Å; A782-G784 VanDerWaalsContact O-N 3.14Å; G784-K787 PolarHBondContact O-N 3.34Å; G784-L788 VanDerWaalsContact O-CB 3.24Å; G784-L788 WeakPolarHBondContact O-CB 3.23Å; G784-L788 PolarHBondContact O-N 3.42Å
785	V	92	Very high	91.2	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-61.7	-47.2	176.7	173	0	0	0	0	111.1	L767 Q776 F777 N779 A782 L788 Q789	L767-V785 HydrophobicContact CB-CG1 3.93Å; L767-V785 HydrophobicContact CD1-CG1 3.93Å; L767-V785 HydrophobicContact CD2-CG1 4.49Å; L767-V785 HydrophobicContact CG-CG1 4.3Å; Q776-V785 PolarHBondContact O-N 3.03Å; F777-V785 HydrophobicContact CB-CG2 4.4Å; N779-V785 VanDerWaalsContact O-CG2 3.24Å; N779-V785 WeakPolarHBondContact O-CG2 3.34Å; A782-V785 HydrophobicContact CB-CG2 4.31Å; A782-V785 WeakPolarHBondContact O-CB 3.35Å; A782-V785 PolarHBondContact O-N 3.18Å; V785-L788 PolarHBondContact O-N 2.93Å; V785-Q789 WeakPolarHBondContact O-CB 3.27Å; V785-Q789 PolarHBondContact O-N 3.45Å
786	Q	90.9	Very high	91.2	Very high	118 Å²	118	41.1 Å²	41.1	55%	0.551	21%	0.211	S	C	*	.	H	α-helix	trans	-62.7	-45.4	176.9	-174.3	-176	-9.5	0	0	111.6	L788 Q789 E790	Q786-L788 VanDerWaalsContact C-N 3.32Å; Q786-L788 PolarHBondContact O-N 2.96Å; Q786-Q789 WeakPolarHBondContact O-CB 3.21Å; Q786-Q789 PolarHBondContact O-N 3.1Å; Q786-E790 PolarHBondContact NE2-OE1 3.49Å; Q786-E790 VanDerWaalsContact NE2-OE1 3.11Å; Q786-E790 WeakPolarHBondContact O-CG 3.36Å; Q786-E790 PolarHBondContact O-N 3Å
787	K	95.5	Very high	91.2	Very high	89 Å²	89	39 Å²	39	39%	0.387	20%	0.201	S	C	.	.	H	α-helix	trans	-61.2	-41.1	177	-69.3	171	-173.7	177.6	0	111.9	P783 G784 E790 V791 L816	P783-K787 VanDerWaalsContact O-CG 3.28Å; P783-K787 WeakPolarHBondContact O-CG 3.24Å; P783-K787 PolarHBondContact O-N 3.19Å; G784-K787 PolarHBondContact O-N 3.34Å; K787-E790 PolarHBondContact O-N 3.41Å; K787-V791 VanDerWaalsContact O-CG2 3.32Å; K787-V791 WeakPolarHBondContact O-CG2 3.48Å; K787-V791 PolarHBondContact O-N 2.98Å; K787-L816 HydrophobicContact CB-CD1 4.11Å; K787-L816 HydrophobicContact CB-CD2 3.95Å
788	L	96.6	Very high	91.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.8	-44.4	177	179.4	61.8	0	0	0	111	L767 T770 F777 G784 V785 Q786 V791 L792 A812 A813 L816	L767-L788 HydrophobicContact CD2-CB 4.14Å; L767-L788 HydrophobicContact CD2-CD2 3.9Å; L767-L788 HydrophobicContact CD2-CG 3.83Å; T770-L788 HydrophobicContact CG2-CD2 3.85Å; F777-L788 HydrophobicContact CD1-CD2 4.25Å; F777-L788 HydrophobicContact CE1-CB 4.09Å; F777-L788 HydrophobicContact CE1-CD2 4.28Å; G784-L788 VanDerWaalsContact O-CB 3.24Å; G784-L788 WeakPolarHBondContact O-CB 3.23Å; G784-L788 PolarHBondContact O-N 3.42Å; V785-L788 PolarHBondContact O-N 2.93Å; Q786-L788 VanDerWaalsContact C-N 3.32Å; Q786-L788 PolarHBondContact O-N 2.96Å; L788-V791 PolarHBondContact O-N 3.4Å; L788-L792 HydrophobicContact CD1-CD1 3.87Å; L788-L792 HydrophobicContact CD1-CG 4.07Å; L788-L792 HydrophobicContact CG-CD1 3.94Å; L788-L792 HydrophobicContact CG-CG 4.49Å; L788-L792 WeakPolarHBondContact O-CB 3.3Å; L788-L792 VanDerWaalsContact O-CG 3.27Å; L788-L792 WeakPolarHBondContact O-CG 3.28Å; L788-L792 PolarHBondContact O-N 3.39Å; L788-A812 HydrophobicContact CD1-CB 3.56Å; L788-A813 HydrophobicContact CD1-CB 4.29Å; L788-A813 HydrophobicContact CD2-CB 4.47Å; L788-L816 VanDerWaalsContact CA-CD1 3.45Å; L788-L816 HydrophobicContact CB-CD1 3.85Å; L788-L816 HydrophobicContact CD1-CD1 4.11Å
789	Q	93.6	Very high	91.2	Very high	56 Å²	56	39.8 Å²	39.8	26%	0.262	20%	0.204	S	C	.	.	H	α-helix	trans	-57.2	-52.7	174.2	-174.5	175	9.3	0	0	111	I763 L767 V785 Q786 V791 L792 Q793	I763-Q789 HydrophobicContact CG2-CG 4.39Å; L767-Q789 HydrophobicContact CD1-CB 3.8Å; L767-Q789 HydrophobicContact CD1-CG 4.02Å; L767-Q789 HydrophobicContact CD2-CB 3.94Å; V785-Q789 WeakPolarHBondContact O-CB 3.27Å; V785-Q789 PolarHBondContact O-N 3.45Å; Q786-Q789 WeakPolarHBondContact O-CB 3.21Å; Q786-Q789 PolarHBondContact O-N 3.1Å; Q789-V791 PolarHBondContact O-N 2.92Å; Q789-L792 PolarHBondContact O-N 3.42Å; Q789-Q793 HydrophobicContact CG-CG 4.24Å; Q789-Q793 VanDerWaalsContact CG-NE2 3.3Å; Q789-Q793 VanDerWaalsContact NE2-NE2 3.16Å; Q789-Q793 VanDerWaalsContact O-CB 3.25Å; Q789-Q793 WeakPolarHBondContact O-CB 3.48Å; Q789-Q793 WeakPolarHBondContact O-CG 3.12Å; Q789-Q793 PolarHBondContact O-N 2.91Å
790	E	93.9	Very high	91	Very high	35 Å²	35	39.9 Å²	39.9	16%	0.164	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-46.4	179.2	-72	175.1	-163.2	0	0	112	L747 Q786 K787 Q793 A794 K821	L747-E790 HydrophobicContact CD1-CB 4.31Å; L747-E790 HydrophobicContact CD1-CG 4.44Å; L747-E790 HydrophobicContact CD2-CB 3.81Å; L747-E790 HydrophobicContact CD2-CG 4.24Å; L747-E790 VanDerWaalsContact CD2-O 3.25Å; L747-E790 WeakPolarHBondContact CD2-O 3.48Å; Q786-E790 PolarHBondContact NE2-OE1 3.49Å; Q786-E790 VanDerWaalsContact NE2-OE1 3.11Å; Q786-E790 WeakPolarHBondContact O-CG 3.36Å; Q786-E790 PolarHBondContact O-N 3Å; K787-E790 PolarHBondContact O-N 3.41Å; E790-Q793 PolarHBondContact O-N 3.16Å; E790-A794 WeakPolarHBondContact O-CB 3.48Å; E790-A794 PolarHBondContact O-N 2.82Å; E790-K821 WeakPolarHBondContact OE2-CD 3.45Å; E790-K821 IonicContact OE2-NZ 2.76Å; E790-K821 PolarHBondContact OE2-NZ 2.98Å
791	V	96.6	Very high	91	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.2	-47.4	179.4	170	0	0	0	0	112.2	K787 L788 Q789 Q793 A794 Y795 A812 L816 K821 A824 F825 L828	K787-V791 VanDerWaalsContact O-CG2 3.32Å; K787-V791 WeakPolarHBondContact O-CG2 3.48Å; K787-V791 PolarHBondContact O-N 2.98Å; L788-V791 PolarHBondContact O-N 3.4Å; Q789-V791 PolarHBondContact O-N 2.92Å; V791-Q793 VanDerWaalsContact C-N 3.34Å; V791-A794 PolarHBondContact O-N 3.46Å; V791-Y795 PolarHBondContact O-N 2.87Å; V791-A812 HydrophobicContact CG1-CB 4.1Å; V791-L816 HydrophobicContact CG2-CD1 4.47Å; V791-L816 HydrophobicContact CG2-CD2 4.25Å; V791-K821 HydrophobicContact CG2-CB 4.24Å; V791-K821 VanDerWaalsContact CG2-O 3.26Å; V791-K821 WeakPolarHBondContact CG2-O 3.31Å; V791-A824 HydrophobicContact CG2-CB 4.42Å; V791-F825 HydrophobicContact CG1-CB 4.23Å; V791-F825 HydrophobicContact CG2-CB 4.45Å; V791-L828 HydrophobicContact CG1-CD2 4.21Å
792	L	95.2	Very high	91.2	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-36.7	-179.5	-67.6	175.7	0	0	0	112.1	I763 L788 Q789 Y795 S796 Y804 M808 N809 A812 L828	I763-L792 HydrophobicContact CD1-CB 4.02Å; I763-L792 HydrophobicContact CG1-CB 4.19Å; I763-L792 HydrophobicContact CG2-CB 4.08Å; I763-L792 HydrophobicContact CG2-CD1 4.06Å; L788-L792 HydrophobicContact CD1-CD1 3.87Å; L788-L792 HydrophobicContact CD1-CG 4.07Å; L788-L792 HydrophobicContact CG-CD1 3.94Å; L788-L792 HydrophobicContact CG-CG 4.49Å; L788-L792 WeakPolarHBondContact O-CB 3.3Å; L788-L792 VanDerWaalsContact O-CG 3.27Å; L788-L792 WeakPolarHBondContact O-CG 3.28Å; L788-L792 PolarHBondContact O-N 3.39Å; Q789-L792 PolarHBondContact O-N 3.42Å; L792-Y795 PolarHBondContact O-N 3.35Å; L792-S796 WeakPolarHBondContact O-CB 3.29Å; L792-S796 PolarHBondContact O-N 3.07Å; L792-Y804 HydrophobicContact CB-CD2 4.4Å; L792-Y804 HydrophobicContact CB-CE2 4.48Å; L792-Y804 HydrophobicContact CD1-CE2 3.83Å; L792-Y804 HydrophobicContact CD2-CD2 4.12Å; L792-Y804 HydrophobicContact CD2-CE2 3.78Å; L792-Y804 HydrophobicContact CG-CE2 4.23Å; L792-M808 HydrophobicContact CD2-CB 4.23Å; L792-N809 HydrophobicContact CD1-CB 3.99Å; L792-A812 HydrophobicContact CD2-CB 3.81Å; L792-A812 HydrophobicContact CG-CB 4.35Å; L792-L828 HydrophobicContact CD2-CD2 4.21Å
793	Q	92.2	Very high	91.1	Very high	21 Å²	21	36.4 Å²	36.4	10%	0.098	18%	0.184	C	C	.	.	H	α-helix	trans	-65.5	-48.4	175.9	-74.4	-179.6	-13.3	0	0	111.4	F750 I763 Q789 E790 V791 Y795 S796 I797	F750-Q793 HydrophobicContact CD1-CB 4.2Å; F750-Q793 HydrophobicContact CD1-CG 4.1Å; F750-Q793 HydrophobicContact CD2-CB 3.55Å; F750-Q793 HydrophobicContact CD2-CG 3.99Å; F750-Q793 HydrophobicContact CE1-CB 4.16Å; F750-Q793 HydrophobicContact CE1-CG 3.61Å; F750-Q793 HydrophobicContact CE2-CB 3.54Å; F750-Q793 HydrophobicContact CE2-CG 3.51Å; F750-Q793 HydrophobicContact CG-CB 3.94Å; F750-Q793 HydrophobicContact CG-CG 4.31Å; F750-Q793 HydrophobicContact CZ-CB 3.9Å; F750-Q793 HydrophobicContact CZ-CG 3.34Å; I763-Q793 HydrophobicContact CD1-CG 3.98Å; Q789-Q793 HydrophobicContact CG-CG 4.24Å; Q789-Q793 VanDerWaalsContact CG-NE2 3.3Å; Q789-Q793 VanDerWaalsContact NE2-NE2 3.16Å; Q789-Q793 VanDerWaalsContact O-CB 3.25Å; Q789-Q793 WeakPolarHBondContact O-CB 3.48Å; Q789-Q793 WeakPolarHBondContact O-CG 3.12Å; Q789-Q793 PolarHBondContact O-N 2.91Å; E790-Q793 PolarHBondContact O-N 3.16Å; V791-Q793 VanDerWaalsContact C-N 3.34Å; Q793-Y795 VanDerWaalsContact C-N 3.3Å; Q793-Y795 PolarHBondContact O-N 3.49Å; Q793-S796 PolarHBondContact O-N 3.4Å; Q793-S796 VanDerWaalsContact O-N 3.16Å; Q793-S796 PolarHBondContact O-OG 3.11Å; Q793-I797 PolarHBondContact O-N 3.27Å
794	A	93	Very high	91.2	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58	-43.8	175.7	0	0	0	0	0	111.4	Y743 L746 L747 E790 V791 S796 I797 H798 F825	Y743-A794 HydrophobicContact CD2-CB 3.75Å; Y743-A794 HydrophobicContact CE2-CB 3.54Å; L746-A794 HydrophobicContact CB-CB 4.12Å; L746-A794 HydrophobicContact CD1-CB 4.36Å; L747-A794 HydrophobicContact CD2-CB 4.03Å; E790-A794 WeakPolarHBondContact O-CB 3.48Å; E790-A794 PolarHBondContact O-N 2.82Å; V791-A794 PolarHBondContact O-N 3.46Å; A794-S796 PolarHBondContact O-N 2.87Å; A794-I797 PolarHBondContact O-N 2.97Å; A794-H798 WeakPolarHBondContact O-CB 3.43Å; A794-H798 PolarHBondContact O-N 3.18Å; A794-F825 HydrophobicContact CB-CD2 3.82Å; A794-F825 HydrophobicContact CB-CE2 3.8Å
795	Y	94.2	Very high	91	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-40.3	176.8	-176.4	-90.9	0	0	0	112.8	V791 L792 Q793 I797 H798 N799 M808 L828 I829 L832	V791-Y795 PolarHBondContact O-N 2.87Å; L792-Y795 PolarHBondContact O-N 3.35Å; Q793-Y795 VanDerWaalsContact C-N 3.3Å; Q793-Y795 PolarHBondContact O-N 3.49Å; Y795-I797 PolarHBondContact O-N 3.42Å; Y795-I797 VanDerWaalsContact O-N 3.15Å; Y795-H798 WeakPolarHBondContact O-CB 3.36Å; Y795-H798 PolarHBondContact O-N 2.96Å; Y795-H798 VanDerWaalsContact O-N 3.13Å; Y795-N799 PolarHBondContact O-N 3.46Å; Y795-N799 VanDerWaalsContact O-N 3.09Å; Y795-M808 HydrophobicContact CD1-SD 4.09Å; Y795-M808 HydrophobicContact CE1-CE 3.88Å; Y795-M808 HydrophobicContact CE1-SD 3.79Å; Y795-L828 HydrophobicContact CD1-CD2 4.31Å; Y795-L828 HydrophobicContact CD2-CD2 3.89Å; Y795-L828 HydrophobicContact CD2-CG 4.02Å; Y795-L828 HydrophobicContact CE2-CG 4.42Å; Y795-L828 HydrophobicContact CG-CD2 3.68Å; Y795-L828 HydrophobicContact CG-CG 4.28Å; Y795-I829 HydrophobicContact CD2-CG1 3.98Å; Y795-I829 HydrophobicContact CE2-CG1 4.11Å; Y795-L832 HydrophobicContact CD1-CD1 4.41Å; Y795-L832 HydrophobicContact CD2-CD1 4.44Å; Y795-L832 HydrophobicContact CE1-CD1 3.7Å; Y795-L832 HydrophobicContact CE2-CB 4.37Å; Y795-L832 HydrophobicContact CE2-CD1 3.72Å; Y795-L832 WeakPolarHBondContact OH-CB 3.1Å; Y795-L832 VanDerWaalsContact OH-CD1 3.3Å; Y795-L832 WeakPolarHBondContact OH-CD1 3.36Å
796	S	91.6	Very high	90.4	Very high	4 Å²	4	38.7 Å²	38.7	3%	0.028	19%	0.19	C	C	.	.	H	α-helix	trans	-60.7	-26.8	-179.8	74.1	0	0	0	0	113.8	L792 Q793 A794	L792-S796 WeakPolarHBondContact O-CB 3.29Å; L792-S796 PolarHBondContact O-N 3.07Å; Q793-S796 PolarHBondContact O-N 3.4Å; Q793-S796 VanDerWaalsContact O-N 3.16Å; Q793-S796 PolarHBondContact O-OG 3.11Å; A794-S796 PolarHBondContact O-N 2.87Å
797	I	90.3	Very high	90.1	Very high	17 Å²	17	33.4 Å²	33.4	9%	0.087	17%	0.167	C	C	.	.	H	α-helix	trans	-87.3	-42.7	174	-61.6	174.6	0	0	0	110.7	L746 E749 F750 A756 Q793 A794 Y795 N799 S800	L746-I797 HydrophobicContact CD2-CB 4.06Å; L746-I797 HydrophobicContact CD2-CG2 3.62Å; L746-I797 WeakPolarHBondContact O-CD1 3.43Å; E749-I797 HydrophobicContact CB-CD1 4.36Å; E749-I797 WeakPolarHBondContact OE1-CG2 3.29Å; F750-I797 VanDerWaalsContact CA-CD1 3.44Å; F750-I797 HydrophobicContact CB-CD1 3.53Å; F750-I797 HydrophobicContact CD2-CD1 3.59Å; F750-I797 HydrophobicContact CD2-CG1 4.03Å; F750-I797 HydrophobicContact CG-CD1 4.03Å; A756-I797 HydrophobicContact CB-CD1 4.27Å; A756-I797 HydrophobicContact CB-CG1 4.27Å; Q793-I797 PolarHBondContact O-N 3.27Å; A794-I797 PolarHBondContact O-N 2.97Å; Y795-I797 PolarHBondContact O-N 3.42Å; Y795-I797 VanDerWaalsContact O-N 3.15Å; I797-N799 PolarHBondContact O-N 3.46Å; I797-S800 PolarHBondContact O-N 3.34Å
798	H	91.8	Very high	90	Very high	30 Å²	30	29.2 Å²	29.2	14%	0.139	15%	0.149	C	C	.	.	H	α-helix	trans	-48.1	-46.6	178.2	177.3	65.9	0	0	0	111.9	Y742 L746 A794 Y795 F825 E833	Y742-H798 AromaticContact CE1-CE1 3.92Å; Y742-H798 AromaticContact CE1-ND1 3.36Å; Y742-H798 WeakPolarHBondContact CE1-ND1 3.44Å; Y742-H798 AromaticContact CZ-ND1 3.52Å; Y742-H798 PolarHBondContact OH-ND1 3.03Å; L746-H798 HydrophobicContact CD1-CB 4.14Å; A794-H798 WeakPolarHBondContact O-CB 3.43Å; A794-H798 PolarHBondContact O-N 3.18Å; Y795-H798 WeakPolarHBondContact O-CB 3.36Å; Y795-H798 PolarHBondContact O-N 2.96Å; Y795-H798 VanDerWaalsContact O-N 3.13Å; H798-F825 HydrophobicContact CB-CE2 4.21Å; H798-F825 HydrophobicContact CB-CZ 4.22Å; H798-E833 IonicContact CD2-OE1 3.12Å; H798-E833 IonicContact NE2-OE1 2.68Å; H798-E833 IonicContact NE2-OE2 3.02Å
799	N	89.1	Confident	89.9	Confident	34 Å²	34	29.2 Å²	29.2	18%	0.182	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.3	72.2	177.8	-167	-27.1	0	0	0	110.6	Y795 I797 K801 I802 G803 E833	Y795-N799 PolarHBondContact O-N 3.46Å; Y795-N799 VanDerWaalsContact O-N 3.09Å; I797-N799 PolarHBondContact O-N 3.46Å; N799-K801 PolarHBondContact O-N 2.85Å; N799-K801 VanDerWaalsContact O-N 3.07Å; N799-I802 PolarHBondContact O-N 3.37Å; N799-I802 VanDerWaalsContact O-N 3.07Å; N799-I802 PolarHBondContact OD1-N 3.43Å; N799-G803 PolarHBondContact O-N 3.16Å; N799-E833 PolarHBondContact ND2-OE1 3.39Å
800	S	83.3	Confident	89.9	Confident	73 Å²	73	28 Å²	28	51%	0.51	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.3	-178.7	59.7	0	0	0	0	115.2	I797	I797-S800 PolarHBondContact O-N 3.34Å
801	K	82.3	Confident	90	Very high	162 Å²	162	26.3 Å²	26.3	70%	0.704	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-37.6	174.1	-179.2	-174.5	172.9	-165.9	0	111.8	N799	N799-K801 PolarHBondContact O-N 2.85Å; N799-K801 VanDerWaalsContact O-N 3.07Å
802	I	84.9	Confident	90.1	Very high	34 Å²	34	26.3 Å²	26.3	17%	0.174	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-42.3	176.3	-63.4	176.9	0	0	0	109.9	N799 Y804 M808 F841	N799-I802 PolarHBondContact O-N 3.37Å; N799-I802 VanDerWaalsContact O-N 3.07Å; N799-I802 PolarHBondContact OD1-N 3.43Å; I802-Y804 PolarHBondContact O-N 3.16Å; I802-M808 HydrophobicContact CG2-CE 3.6Å; I802-F841 HydrophobicContact CG2-CB 4.1Å
803	G	87.1	Confident	90.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.			trans	66.5	-121.3	-174.4	0	0	0	0	0	110.9	N799	N799-G803 PolarHBondContact O-N 3.16Å
804	Y	89.7	Confident	90.3	Very high	14 Å²	14	25.2 Å²	25.2	6%	0.055	13%	0.13	C	C	.	.			trans	-113.7	128.5	173.9	176.2	-100.8	0	0	0	111.2	H759 Q762 I763 D766 L792 I802 M808 N809	H759-Y804 PolarHBondContact ND1-N 2.74Å; Q762-Y804 HydrophobicContact CB-CD1 4.13Å; Q762-Y804 HydrophobicContact CB-CE1 4.35Å; Q762-Y804 HydrophobicContact CG-CD1 3.82Å; Q762-Y804 HydrophobicContact CG-CE1 3.72Å; I763-Y804 HydrophobicContact CD1-CD2 4.42Å; I763-Y804 HydrophobicContact CD1-CG 4.28Å; I763-Y804 HydrophobicContact CG1-CD1 3.92Å; I763-Y804 HydrophobicContact CG1-CD2 3.84Å; I763-Y804 HydrophobicContact CG1-CE1 4.3Å; I763-Y804 HydrophobicContact CG1-CE2 4.22Å; I763-Y804 HydrophobicContact CG1-CG 3.67Å; D766-Y804 WeakPolarHBondContact CB-OH 3.42Å; D766-Y804 WeakPolarHBondContact OD2-CE1 3.29Å; D766-Y804 PolarHBondContact OD2-OH 3.49Å; L792-Y804 HydrophobicContact CB-CD2 4.4Å; L792-Y804 HydrophobicContact CB-CE2 4.48Å; L792-Y804 HydrophobicContact CD1-CE2 3.83Å; L792-Y804 HydrophobicContact CD2-CD2 4.12Å; L792-Y804 HydrophobicContact CD2-CE2 3.78Å; L792-Y804 HydrophobicContact CG-CE2 4.23Å; I802-Y804 PolarHBondContact O-N 3.16Å; Y804-M808 HydrophobicContact CD2-CB 4.29Å; Y804-M808 HydrophobicContact CD2-SD 4.34Å; Y804-M808 HydrophobicContact CE2-CB 3.96Å; Y804-N809 WeakPolarHBondContact OH-CB 3.37Å; Y804-N809 PolarHBondContact OH-OD1 3.32Å
805	C	86.4	Confident	90.5	Very high	31 Å²	31	25.2 Å²	25.2	21%	0.209	13%	0.13	C	C	.	.			trans	-115.8	137.3	171.5	-169.1	0	0	0	0	110.3	G807 M808 F841	C805-G807 PolarHBondContact O-N 2.75Å; C805-M808 HydrophobicContact CB-CE 3.6Å; C805-M808 HydrophobicContact CB-CG 4.42Å; C805-M808 HydrophobicContact CB-SD 4.08Å; C805-M808 PolarHBondContact N-SD 2.89Å; C805-M808 WeakPolarHBondContact O-CB 3.41Å; C805-M808 WeakPolarHBondContact O-CG 3.32Å; C805-M808 PolarHBondContact O-N 2.81Å; C805-M808 VanDerWaalsContact O-N 3.15Å; C805-F841 HydrophobicContact CB-CB 3.98Å; C805-F841 HydrophobicContact CB-CD1 3.84Å; C805-F841 HydrophobicContact CB-CG 4.36Å
806	Q	80.2	Confident	90.7	Very high	92 Å²	92	25.8 Å²	25.8	43%	0.43	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	128.6	177.9	-170.4	178.3	3.4	0	0	110.4	R769	R769-Q806 VanDerWaalsContact NH2-CG 3.34Å
807	G	84	Confident	90.8	Very high	7 Å²	7	26.9 Å²	26.9	7%	0.072	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	114	-29.7	-172.2	0	0	0	0	0	112.9	C805 N809 F810	C805-G807 PolarHBondContact O-N 2.75Å; G807-N809 VanDerWaalsContact CA-OD1 3.3Å; G807-N809 WeakPolarHBondContact CA-OD1 3.47Å; G807-N809 PolarHBondContact N-OD1 3.41Å; G807-N809 PolarHBondContact O-N 3.01Å; G807-F810 PolarHBondContact O-N 3.4Å; G807-F810 VanDerWaalsContact O-N 3.15Å
808	M	93.5	Very high	91	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62	-31	175.2	-66.7	177	176.6	0	0	112.5	L792 Y795 I802 Y804 C805 F810 I811 A812 L832 F841	L792-M808 HydrophobicContact CD2-CB 4.23Å; Y795-M808 HydrophobicContact CD1-SD 4.09Å; Y795-M808 HydrophobicContact CE1-CE 3.88Å; Y795-M808 HydrophobicContact CE1-SD 3.79Å; I802-M808 HydrophobicContact CG2-CE 3.6Å; Y804-M808 HydrophobicContact CD2-CB 4.29Å; Y804-M808 HydrophobicContact CD2-SD 4.34Å; Y804-M808 HydrophobicContact CE2-CB 3.96Å; C805-M808 HydrophobicContact CB-CE 3.6Å; C805-M808 HydrophobicContact CB-CG 4.42Å; C805-M808 HydrophobicContact CB-SD 4.08Å; C805-M808 PolarHBondContact N-SD 2.89Å; C805-M808 WeakPolarHBondContact O-CB 3.41Å; C805-M808 WeakPolarHBondContact O-CG 3.32Å; C805-M808 PolarHBondContact O-N 2.81Å; C805-M808 VanDerWaalsContact O-N 3.15Å; M808-F810 VanDerWaalsContact C-N 3.25Å; M808-F810 PolarHBondContact O-N 3.48Å; M808-I811 PolarHBondContact O-N 3.02Å; M808-A812 WeakPolarHBondContact O-CB 3.39Å; M808-A812 PolarHBondContact O-N 2.69Å; M808-L832 HydrophobicContact CE-CD1 3.86Å; M808-L832 HydrophobicContact CG-CD1 4Å; M808-L832 HydrophobicContact SD-CD1 4.02Å; M808-F841 HydrophobicContact CE-CB 3.43Å; M808-F841 VanDerWaalsContact CE-CB 3.43Å; M808-F841 HydrophobicContact CE-CD1 3.91Å; M808-F841 HydrophobicContact CE-CD2 4.27Å; M808-F841 HydrophobicContact CE-CG 3.61Å; M808-F841 HydrophobicContact CG-CD1 4.18Å; M808-F841 HydrophobicContact CG-CE1 4.21Å
809	N	94.4	Very high	91.2	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-54.9	-38.8	174.4	58.8	-55	0	0	0	112.8	D766 T770 L792 Y804 G807 A813	D766-N809 HydrophobicContact CB-CB 4.32Å; T770-N809 HydrophobicContact CG2-CB 4.42Å; T770-N809 PolarHBondContact OG1-ND2 2.89Å; L792-N809 HydrophobicContact CD1-CB 3.99Å; Y804-N809 WeakPolarHBondContact OH-CB 3.37Å; Y804-N809 PolarHBondContact OH-OD1 3.32Å; G807-N809 VanDerWaalsContact CA-OD1 3.3Å; G807-N809 WeakPolarHBondContact CA-OD1 3.47Å; G807-N809 PolarHBondContact N-OD1 3.41Å; G807-N809 PolarHBondContact O-N 3.01Å; N809-A813 VanDerWaalsContact O-CB 3.23Å; N809-A813 WeakPolarHBondContact O-CB 3.33Å; N809-A813 PolarHBondContact O-N 3.13Å
810	F	94.9	Very high	91.6	Very high	30 Å²	30	30.5 Å²	30.5	13%	0.132	15%	0.148	C	C	.	.	H	α-helix	trans	-71.3	-41.4	-179.6	-60.6	-55.2	0	0	0	111.9	T770 G807 M808 A813 V814 A887 Y890	T770-F810 HydrophobicContact CG2-CD1 3.96Å; T770-F810 HydrophobicContact CG2-CE1 4.35Å; G807-F810 PolarHBondContact O-N 3.4Å; G807-F810 VanDerWaalsContact O-N 3.15Å; M808-F810 VanDerWaalsContact C-N 3.25Å; M808-F810 PolarHBondContact O-N 3.48Å; F810-A813 PolarHBondContact O-N 2.94Å; F810-V814 WeakPolarHBondContact O-CG2 3.26Å; F810-V814 PolarHBondContact O-N 2.89Å; F810-A887 HydrophobicContact CD2-CB 4.48Å; F810-Y890 HydrophobicContact CB-CD1 3.54Å; F810-Y890 HydrophobicContact CB-CE1 4.11Å; F810-Y890 HydrophobicContact CB-CG 3.96Å; F810-Y890 AromaticContact CD1-CD1 3.43Å; F810-Y890 HydrophobicContact CD1-CD1 3.43Å; F810-Y890 VanDerWaalsContact CD1-CD1 3.43Å; F810-Y890 AromaticContact CD1-CE1 3.11Å; F810-Y890 HydrophobicContact CD1-CE1 3.11Å; F810-Y890 HydrophobicContact CD1-CG 4.48Å; F810-Y890 AromaticContact CD1-CZ 3.98Å; F810-Y890 HydrophobicContact CD2-CD1 4.25Å; F810-Y890 HydrophobicContact CE1-CD1 4.15Å; F810-Y890 AromaticContact CE1-CE1 3.57Å; F810-Y890 HydrophobicContact CE1-CE1 3.57Å; F810-Y890 AromaticContact CG-CD1 3.48Å; F810-Y890 HydrophobicContact CG-CD1 3.48Å; F810-Y890 VanDerWaalsContact CG-CD1 3.48Å; F810-Y890 AromaticContact CG-CE1 3.72Å; F810-Y890 HydrophobicContact CG-CE1 3.72Å; F810-Y890 HydrophobicContact CG-CG 4.39Å; F810-Y890 HydrophobicContact CZ-CE1 4.46Å
811	I	96.2	Very high	92.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-49.3	175.8	-60.5	172.9	0	0	0	109.8	M808 A813 V814 A815 L828 I831 L832 F841 L886 V888 W902	M808-I811 PolarHBondContact O-N 3.02Å; I811-A813 VanDerWaalsContact C-N 3.33Å; I811-A813 PolarHBondContact O-N 2.83Å; I811-V814 PolarHBondContact O-N 2.91Å; I811-A815 PolarHBondContact O-N 3.05Å; I811-L828 HydrophobicContact CB-CD1 4.02Å; I811-L828 HydrophobicContact CG2-CD1 3.75Å; I811-I831 HydrophobicContact CD1-CG2 4.17Å; I811-I831 HydrophobicContact CG2-CB 4.37Å; I811-I831 HydrophobicContact CG2-CD1 3.55Å; I811-I831 HydrophobicContact CG2-CG2 4.18Å; I811-L832 HydrophobicContact CD1-CD2 3.99Å; I811-F841 HydrophobicContact CD1-CZ 4.13Å; I811-L886 WeakPolarHBondContact CD1-O 3.3Å; I811-V888 HydrophobicContact CD1-CG2 4.27Å; I811-V888 HydrophobicContact CG1-CG2 4.29Å; I811-W902 HydrophobicContact CG2-CH2 3.89Å; I811-W902 HydrophobicContact CG2-CZ2 4.39Å
812	A	97.5	Very high	92.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.5	-39.5	179.5	0	0	0	0	0	112.1	L788 V791 L792 M808 A815 L816 L828	L788-A812 HydrophobicContact CD1-CB 3.56Å; V791-A812 HydrophobicContact CG1-CB 4.1Å; L792-A812 HydrophobicContact CD2-CB 3.81Å; L792-A812 HydrophobicContact CG-CB 4.35Å; M808-A812 WeakPolarHBondContact O-CB 3.39Å; M808-A812 PolarHBondContact O-N 2.69Å; A812-A815 PolarHBondContact O-N 3.45Å; A812-L816 WeakPolarHBondContact O-CB 3.25Å; A812-L816 VanDerWaalsContact O-CG 3.31Å; A812-L816 WeakPolarHBondContact O-CG 3.28Å; A812-L816 PolarHBondContact O-N 3.41Å; A812-L828 HydrophobicContact CB-CD2 4.36Å
813	A	96.9	Very high	93.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-65.9	-43.6	177.4	0	0	0	0	0	112.5	T770 M771 F777 L788 N809 F810 I811 A815 L816 L817	T770-A813 HydrophobicContact CG2-CB 3.45Å; T770-A813 VanDerWaalsContact CG2-CB 3.45Å; M771-A813 HydrophobicContact CE-CB 4.01Å; M771-A813 HydrophobicContact CG-CB 4.43Å; M771-A813 HydrophobicContact SD-CB 3.89Å; F777-A813 HydrophobicContact CE1-CB 4.37Å; F777-A813 HydrophobicContact CE2-CB 4.46Å; F777-A813 HydrophobicContact CZ-CB 4.11Å; L788-A813 HydrophobicContact CD1-CB 4.29Å; L788-A813 HydrophobicContact CD2-CB 4.47Å; N809-A813 VanDerWaalsContact O-CB 3.23Å; N809-A813 WeakPolarHBondContact O-CB 3.33Å; N809-A813 PolarHBondContact O-N 3.13Å; F810-A813 PolarHBondContact O-N 2.94Å; I811-A813 VanDerWaalsContact C-N 3.33Å; I811-A813 PolarHBondContact O-N 2.83Å; A813-A815 VanDerWaalsContact C-N 3.33Å; A813-A815 PolarHBondContact O-N 3.11Å; A813-L816 PolarHBondContact O-N 3.02Å; A813-L817 PolarHBondContact O-N 2.98Å
814	V	96	Very high	93.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.9	-43.4	174.6	175.7	0	0	0	0	110.8	W723 M771 F810 I811 L816 L817 F818 Y890 L898 W902	W723-V814 HydrophobicContact CH2-CG1 4.38Å; W723-V814 HydrophobicContact CZ3-CG1 4.47Å; M771-V814 HydrophobicContact CE-CB 4.22Å; M771-V814 HydrophobicContact CE-CG2 3.41Å; M771-V814 VanDerWaalsContact CE-CG2 3.41Å; F810-V814 WeakPolarHBondContact O-CG2 3.26Å; F810-V814 PolarHBondContact O-N 2.89Å; I811-V814 PolarHBondContact O-N 2.91Å; V814-L816 VanDerWaalsContact C-N 3.34Å; V814-L816 PolarHBondContact O-N 3.27Å; V814-L817 PolarHBondContact O-N 3.44Å; V814-F818 WeakPolarHBondContact O-CD2 3.44Å; V814-Y890 HydrophobicContact CG2-CD2 3.64Å; V814-Y890 HydrophobicContact CG2-CE2 4.36Å; V814-Y890 HydrophobicContact CG2-CG 4.34Å; V814-L898 HydrophobicContact CG2-CD2 4.01Å; V814-W902 HydrophobicContact CB-CH2 3.7Å; V814-W902 HydrophobicContact CB-CZ2 3.73Å; V814-W902 HydrophobicContact CB-CZ3 4.23Å; V814-W902 HydrophobicContact CG1-CD2 3.8Å; V814-W902 HydrophobicContact CG1-CE3 3.83Å; V814-W902 HydrophobicContact CG1-CH2 3.66Å; V814-W902 HydrophobicContact CG1-CZ2 3.63Å; V814-W902 HydrophobicContact CG1-CZ3 3.76Å; V814-W902 HydrophobicContact CG2-CZ2 4.24Å
815	A	97.2	Very high	94.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.2	-43.4	176	0	0	0	0	0	111.9	I811 A812 A813 L817 F818 L819 A824 C827	I811-A815 PolarHBondContact O-N 3.05Å; A812-A815 PolarHBondContact O-N 3.45Å; A813-A815 VanDerWaalsContact C-N 3.33Å; A813-A815 PolarHBondContact O-N 3.11Å; A815-L817 PolarHBondContact O-N 2.75Å; A815-F818 PolarHBondContact O-N 3.1Å; A815-F818 VanDerWaalsContact O-N 3.13Å; A815-L819 HydrophobicContact CB-CD1 4.45Å; A815-L819 VanDerWaalsContact O-CB 3.28Å; A815-L819 WeakPolarHBondContact O-CB 3.44Å; A815-L819 PolarHBondContact O-N 3.1Å; A815-A824 HydrophobicContact CB-CB 3.88Å; A815-C827 HydrophobicContact CB-CB 3.96Å
816	L	97.2	Very high	94.8	Very high	13 Å²	13	22.4 Å²	22.4	7%	0.068	10%	0.101	C	C	.	.	H	α-helix	trans	-66.1	-19	-179.8	-78.8	169.9	0	0	0	114.8	F777 K787 L788 V791 A812 A813 V814 F818 K821 A824	F777-L816 HydrophobicContact CE1-CD1 4.49Å; F777-L816 HydrophobicContact CZ-CB 4.18Å; K787-L816 HydrophobicContact CB-CD1 4.11Å; K787-L816 HydrophobicContact CB-CD2 3.95Å; L788-L816 VanDerWaalsContact CA-CD1 3.45Å; L788-L816 HydrophobicContact CB-CD1 3.85Å; L788-L816 HydrophobicContact CD1-CD1 4.11Å; V791-L816 HydrophobicContact CG2-CD1 4.47Å; V791-L816 HydrophobicContact CG2-CD2 4.25Å; A812-L816 WeakPolarHBondContact O-CB 3.25Å; A812-L816 VanDerWaalsContact O-CG 3.31Å; A812-L816 WeakPolarHBondContact O-CG 3.28Å; A812-L816 PolarHBondContact O-N 3.41Å; A813-L816 PolarHBondContact O-N 3.02Å; V814-L816 VanDerWaalsContact C-N 3.34Å; V814-L816 PolarHBondContact O-N 3.27Å; L816-F818 VanDerWaalsContact C-N 3.27Å; L816-K821 HydrophobicContact CD2-CB 4.25Å; L816-A824 HydrophobicContact CD2-CB 3.7Å; L816-A824 HydrophobicContact CG-CB 3.86Å
817	L	94.6	Very high	95.7	Very high	27 Å²	27	18 Å²	18	14%	0.141	8%	0.08	C	C	.	.	H	α-helix	trans	-69.8	-26.2	173.5	-70	178.2	0	0	0	112.7	F654 M771 F777 A813 V814 A815 F895	F654-L817 HydrophobicContact CE2-CD1 4.25Å; F654-L817 HydrophobicContact CZ-CD1 4.2Å; M771-L817 HydrophobicContact CE-CD1 3.75Å; M771-L817 HydrophobicContact SD-CD1 3.8Å; M771-L817 HydrophobicContact SD-CG 4.25Å; F777-L817 HydrophobicContact CE2-CD2 3.83Å; F777-L817 HydrophobicContact CE2-CG 4.35Å; A813-L817 PolarHBondContact O-N 2.98Å; V814-L817 PolarHBondContact O-N 3.44Å; A815-L817 PolarHBondContact O-N 2.75Å; L817-F895 HydrophobicContact CD1-CE2 3.79Å; L817-F895 HydrophobicContact CD1-CZ 3.49Å; L817-F895 VanDerWaalsContact CD1-CZ 3.49Å
818	F	94.4	Very high	96.3	Very high	20 Å²	20	17.7 Å²	17.7	9%	0.088	8%	0.077	C	C	.	.	H	α-helix	trans	-121.4	-18.2	-174.4	-58.8	-74.6	0	0	0	113.7	Y652 R719 E720 W723 V814 A815 L816 F895 I899	Y652-F818 AromaticContact CD1-CE1 3.78Å; Y652-F818 HydrophobicContact CD1-CE1 3.78Å; Y652-F818 AromaticContact CD1-CZ 3.69Å; Y652-F818 HydrophobicContact CD1-CZ 3.69Å; Y652-F818 AromaticContact CE1-CE1 3.74Å; Y652-F818 HydrophobicContact CE1-CE1 3.74Å; Y652-F818 AromaticContact CE1-CZ 3.76Å; Y652-F818 HydrophobicContact CE1-CZ 3.76Å; R719-F818 HydrophobicContact CG-CD1 4.38Å; E720-F818 WeakPolarHBondContact CB-O 3.42Å; E720-F818 WeakPolarHBondContact CG-O 3.45Å; W723-F818 HydrophobicContact CE3-CB 4.1Å; W723-F818 HydrophobicContact CE3-CD2 4.23Å; W723-F818 HydrophobicContact CE3-CG 4.41Å; W723-F818 AromaticContact CH2-CD2 3.68Å; W723-F818 HydrophobicContact CH2-CD2 3.68Å; W723-F818 AromaticContact CH2-CE2 3.95Å; W723-F818 HydrophobicContact CH2-CE2 3.95Å; W723-F818 HydrophobicContact CH2-CG 4.43Å; W723-F818 HydrophobicContact CZ3-CB 4.15Å; W723-F818 AromaticContact CZ3-CD2 3.44Å; W723-F818 HydrophobicContact CZ3-CD2 3.44Å; W723-F818 VanDerWaalsContact CZ3-CD2 3.44Å; W723-F818 HydrophobicContact CZ3-CE2 4.18Å; W723-F818 HydrophobicContact CZ3-CG 4.05Å; V814-F818 WeakPolarHBondContact O-CD2 3.44Å; A815-F818 PolarHBondContact O-N 3.1Å; A815-F818 VanDerWaalsContact O-N 3.13Å; L816-F818 VanDerWaalsContact C-N 3.27Å; F818-F895 HydrophobicContact CE2-CZ 4.07Å; F818-F895 HydrophobicContact CZ-CE1 4.14Å; F818-F895 HydrophobicContact CZ-CZ 4.11Å; F818-I899 HydrophobicContact CE2-CG2 3.87Å; F818-I899 HydrophobicContact CZ-CG2 3.78Å
819	L	96.5	Very high	96.4	Very high	8 Å²	8	17.7 Å²	17.7	4%	0.042	8%	0.077	C	C	.	.	S	Bend	trans	-123.2	150.9	-173.9	-57.3	176.8	0	0	0	110.9	E720 W723 R724 I727 A815 D823 A824 C827	E720-L819 HydrophobicContact CG-CD2 4.36Å; W723-L819 HydrophobicContact CB-CD2 4.22Å; R724-L819 HydrophobicContact CB-CD2 4.16Å; I727-L819 HydrophobicContact CD1-CD1 3.76Å; A815-L819 HydrophobicContact CB-CD1 4.45Å; A815-L819 VanDerWaalsContact O-CB 3.28Å; A815-L819 WeakPolarHBondContact O-CB 3.44Å; A815-L819 PolarHBondContact O-N 3.1Å; L819-D823 HydrophobicContact CB-CB 3.98Å; L819-A824 HydrophobicContact CB-CB 4.31Å; L819-C827 HydrophobicContact CD1-CB 3.8Å
820	R	95.5	Very high	96.6	Very high	130 Å²	130	17.7 Å²	17.7	49%	0.491	8%	0.077	S	C	.	.			trans	-66.6	157.8	171	-58.1	174.6	-59.4	163.5	8	109.9	E822 D823 A824	R820-E822 VanDerWaalsContact C-N 3.3Å; R820-E822 PolarHBondContact O-N 2.79Å; R820-E822 VanDerWaalsContact O-N 3.14Å; R820-D823 IonicContact CZ-OD2 3.52Å; R820-D823 VanDerWaalsContact CZ-OD2 3.28Å; R820-D823 IonicContact NE-OD2 2.8Å; R820-D823 PolarHBondContact NE-OD2 2.83Å; R820-D823 IonicContact NH2-OD1 3.21Å; R820-D823 IonicContact NH2-OD2 3.38Å; R820-D823 PolarHBondContact NH2-OD2 3.09Å; R820-D823 CarbonylContact O-C 3.6Å; R820-D823 PolarHBondContact O-N 3.34Å; R820-A824 WeakPolarHBondContact O-CB 3.1Å; R820-A824 PolarHBondContact O-N 3.43Å
821	K	95.5	Very high	96.6	Very high	76 Å²	76	16.3 Å²	16.3	33%	0.33	7%	0.07	S	C	.	.	H	α-helix	trans	-51.7	-42.4	-173.4	64.4	178.3	-171.3	170.3	0	114.7	Y743 E790 V791 L816 A824 F825	Y743-K821 HydrophobicContact CE1-CD 4.17Å; Y743-K821 HydrophobicContact CE1-CG 4.06Å; E790-K821 WeakPolarHBondContact OE2-CD 3.45Å; E790-K821 IonicContact OE2-NZ 2.76Å; E790-K821 PolarHBondContact OE2-NZ 2.98Å; V791-K821 HydrophobicContact CG2-CB 4.24Å; V791-K821 VanDerWaalsContact CG2-O 3.26Å; V791-K821 WeakPolarHBondContact CG2-O 3.31Å; L816-K821 HydrophobicContact CD2-CB 4.25Å; K821-A824 PolarHBondContact O-N 3.14Å; K821-F825 PolarHBondContact O-N 3.43Å
822	E	96.1	Very high	96.6	Very high	61 Å²	61	16.6 Å²	16.6	29%	0.285	7%	0.072	S	C	.	.	H	α-helix	trans	-69.4	-44.3	177.4	-176	-178.9	175.1	0	0	111.9	Y743 R820 A824 F825 W826	Y743-E822 HydrophobicContact CD1-CB 3.98Å; Y743-E822 HydrophobicContact CD1-CG 4.11Å; Y743-E822 HydrophobicContact CE1-CB 4.38Å; Y743-E822 HydrophobicContact CG-CB 4.38Å; Y743-E822 HydrophobicContact CG-CG 4.12Å; R820-E822 VanDerWaalsContact C-N 3.3Å; R820-E822 PolarHBondContact O-N 2.79Å; R820-E822 VanDerWaalsContact O-N 3.14Å; E822-A824 VanDerWaalsContact C-N 3.27Å; E822-A824 PolarHBondContact O-N 3.44Å; E822-F825 WeakPolarHBondContact O-CB 3.25Å; E822-F825 PolarHBondContact O-N 2.81Å; E822-W826 PolarHBondContact O-N 2.99Å
823	D	97.4	Very high	96.4	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-64	-34.1	176.1	-65.5	-56.7	0	0	0	111.3	R724 H728 L819 R820 W826 C827	R724-D823 IonicContact CZ-OD1 3.18Å; R724-D823 IonicContact NE-OD1 3.43Å; R724-D823 PolarHBondContact NE-OD1 3.06Å; R724-D823 IonicContact NE-OD2 2.62Å; R724-D823 PolarHBondContact NE-OD2 2.95Å; H728-D823 IonicContact CD2-OD1 2.85Å; H728-D823 IonicContact CE1-OD1 3.37Å; H728-D823 PolarHBondContact CE1-OD1 3.18Å; H728-D823 VanDerWaalsContact CE1-OD1 3.25Å; H728-D823 IonicContact NE2-OD1 3.48Å; H728-D823 PolarHBondContact NE2-OD1 2.92Å; L819-D823 HydrophobicContact CB-CB 3.98Å; R820-D823 IonicContact CZ-OD2 3.52Å; R820-D823 VanDerWaalsContact CZ-OD2 3.28Å; R820-D823 IonicContact NE-OD2 2.8Å; R820-D823 PolarHBondContact NE-OD2 2.83Å; R820-D823 IonicContact NH2-OD1 3.21Å; R820-D823 IonicContact NH2-OD2 3.38Å; R820-D823 PolarHBondContact NH2-OD2 3.09Å; R820-D823 CarbonylContact O-C 3.6Å; R820-D823 PolarHBondContact O-N 3.34Å; D823-W826 PolarHBondContact O-N 3.46Å; D823-C827 WeakPolarHBondContact O-CB 3.5Å; D823-C827 PolarHBondContact O-N 3.25Å
824	A	97.9	Very high	96.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-68.9	-35.3	173.9	0	0	0	0	0	112.5	V791 A815 L816 L819 R820 K821 E822 C827 L828	V791-A824 HydrophobicContact CG2-CB 4.42Å; A815-A824 HydrophobicContact CB-CB 3.88Å; L816-A824 HydrophobicContact CD2-CB 3.7Å; L816-A824 HydrophobicContact CG-CB 3.86Å; L819-A824 HydrophobicContact CB-CB 4.31Å; R820-A824 WeakPolarHBondContact O-CB 3.1Å; R820-A824 PolarHBondContact O-N 3.43Å; K821-A824 PolarHBondContact O-N 3.14Å; E822-A824 VanDerWaalsContact C-N 3.27Å; E822-A824 PolarHBondContact O-N 3.44Å; A824-C827 WeakPolarHBondContact O-CB 3.47Å; A824-C827 PolarHBondContact O-N 3.23Å; A824-L828 PolarHBondContact O-N 3.41Å
825	F	97.8	Very high	96.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.3	-46.8	170.1	163.8	-99.9	0	0	0	111.7	Y742 Y743 L746 V791 A794 H798 K821 E822 C827 L828 I829	Y742-F825 HydrophobicContact CD1-CE1 4.25Å; Y742-F825 HydrophobicContact CD1-CZ 4.41Å; Y742-F825 HydrophobicContact CE1-CE1 4.4Å; Y742-F825 HydrophobicContact CE1-CZ 4.16Å; Y743-F825 HydrophobicContact CD2-CB 3.7Å; Y743-F825 AromaticContact CD2-CD1 3.62Å; Y743-F825 HydrophobicContact CD2-CD1 3.62Å; Y743-F825 AromaticContact CD2-CD2 3.89Å; Y743-F825 HydrophobicContact CD2-CD2 3.89Å; Y743-F825 HydrophobicContact CD2-CE1 4.16Å; Y743-F825 HydrophobicContact CD2-CE2 4.4Å; Y743-F825 AromaticContact CD2-CG 3.45Å; Y743-F825 HydrophobicContact CD2-CG 3.45Å; Y743-F825 VanDerWaalsContact CD2-CG 3.45Å; Y743-F825 HydrophobicContact CE2-CB 3.68Å; Y743-F825 HydrophobicContact CE2-CD1 4.45Å; Y743-F825 HydrophobicContact CE2-CD2 4.13Å; Y743-F825 AromaticContact CE2-CG 3.85Å; Y743-F825 HydrophobicContact CE2-CG 3.85Å; Y743-F825 HydrophobicContact CG-CD1 4.26Å; Y743-F825 HydrophobicContact CG-CG 4.46Å; L746-F825 HydrophobicContact CD1-CE1 4.38Å; L746-F825 HydrophobicContact CD1-CE2 3.98Å; L746-F825 HydrophobicContact CD1-CZ 3.49Å; L746-F825 VanDerWaalsContact CD1-CZ 3.49Å; V791-F825 HydrophobicContact CG1-CB 4.23Å; V791-F825 HydrophobicContact CG2-CB 4.45Å; A794-F825 HydrophobicContact CB-CD2 3.82Å; A794-F825 HydrophobicContact CB-CE2 3.8Å; H798-F825 HydrophobicContact CB-CE2 4.21Å; H798-F825 HydrophobicContact CB-CZ 4.22Å; K821-F825 PolarHBondContact O-N 3.43Å; E822-F825 WeakPolarHBondContact O-CB 3.25Å; E822-F825 PolarHBondContact O-N 2.81Å; F825-C827 VanDerWaalsContact C-N 3.32Å; F825-C827 PolarHBondContact O-N 3.13Å; F825-L828 WeakPolarHBondContact O-CB 3Å; F825-L828 PolarHBondContact O-N 3.25Å; F825-I829 HydrophobicContact CD1-CD1 4.07Å; F825-I829 HydrophobicContact CD2-CD1 4.37Å; F825-I829 HydrophobicContact CE1-CD1 3.46Å; F825-I829 VanDerWaalsContact CE1-CD1 3.46Å; F825-I829 HydrophobicContact CE2-CD1 3.82Å; F825-I829 HydrophobicContact CE2-CG1 4.47Å; F825-I829 HydrophobicContact CG-CD1 4.5Å; F825-I829 HydrophobicContact CZ-CD1 3.33Å; F825-I829 HydrophobicContact CZ-CG1 4.42Å; F825-I829 PolarHBondContact O-N 3.39Å
826	W	97.8	Very high	95.9	Very high	3 Å²	3	27 Å²	27	1%	0.011	12%	0.115	C	C	.	.	H	α-helix	trans	-65.1	-35.8	174.5	-66.9	117.1	0	0	0	112.3	I727 L731 L734 M735 K738 Y742 E822 D823 L828 I829 A830	I727-W826 HydrophobicContact CG2-CB 4.22Å; L731-W826 HydrophobicContact CD1-CB 4.13Å; L731-W826 HydrophobicContact CD1-CE3 4Å; L731-W826 WeakPolarHBondContact CD1-O 3.24Å; L734-W826 HydrophobicContact CD2-CZ3 4.3Å; L734-W826 HydrophobicContact CG-CZ3 4.42Å; M735-W826 HydrophobicContact CE-CD2 4.13Å; M735-W826 HydrophobicContact CE-CG 4.06Å; M735-W826 HydrophobicContact CG-CD2 3.93Å; M735-W826 HydrophobicContact CG-CE3 3.88Å; M735-W826 HydrophobicContact CG-CH2 3.97Å; M735-W826 HydrophobicContact CG-CZ2 4.04Å; M735-W826 HydrophobicContact CG-CZ3 3.9Å; M735-W826 HydrophobicContact SD-CD2 4.31Å; M735-W826 HydrophobicContact SD-CG 4.42Å; K738-W826 HydrophobicContact CB-CH2 4.19Å; K738-W826 HydrophobicContact CG-CH2 4.47Å; Y742-W826 AromaticContact CD1-CH2 3.73Å; Y742-W826 HydrophobicContact CD1-CH2 3.73Å; Y742-W826 HydrophobicContact CD1-CZ2 4.15Å; Y742-W826 HydrophobicContact CE1-CH2 4.38Å; E822-W826 PolarHBondContact O-N 2.99Å; D823-W826 PolarHBondContact O-N 3.46Å; W826-L828 PolarHBondContact O-N 2.94Å; W826-I829 HydrophobicContact CE3-CD1 3.73Å; W826-I829 HydrophobicContact CZ3-CD1 3.89Å; W826-I829 PolarHBondContact O-N 3.37Å; W826-A830 PolarHBondContact O-N 2.95Å
827	C	97.9	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	-57.7	-48.5	172.1	-173.5	0	0	0	0	111.3	I727 A815 L819 D823 A824 F825 I829 A830 I831	I727-C827 HydrophobicContact CD1-CB 3.58Å; I727-C827 WeakPolarHBondContact CD1-SG 3.35Å; I727-C827 HydrophobicContact CG1-CB 4.48Å; A815-C827 HydrophobicContact CB-CB 3.96Å; L819-C827 HydrophobicContact CD1-CB 3.8Å; D823-C827 WeakPolarHBondContact O-CB 3.5Å; D823-C827 PolarHBondContact O-N 3.25Å; A824-C827 WeakPolarHBondContact O-CB 3.47Å; A824-C827 PolarHBondContact O-N 3.23Å; F825-C827 VanDerWaalsContact C-N 3.32Å; F825-C827 PolarHBondContact O-N 3.13Å; C827-I829 VanDerWaalsContact C-N 3.32Å; C827-I829 PolarHBondContact O-N 3.29Å; C827-A830 PolarHBondContact O-N 3.46Å; C827-I831 WeakPolarHBondContact O-CG1 3.31Å; C827-I831 PolarHBondContact O-N 3.5Å
828	L	97.2	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.8	-44.5	177.8	-173.4	63.7	0	0	0	111	V791 L792 Y795 I811 A812 A824 F825 W826 I831 L832	V791-L828 HydrophobicContact CG1-CD2 4.21Å; L792-L828 HydrophobicContact CD2-CD2 4.21Å; Y795-L828 HydrophobicContact CD1-CD2 4.31Å; Y795-L828 HydrophobicContact CD2-CD2 3.89Å; Y795-L828 HydrophobicContact CD2-CG 4.02Å; Y795-L828 HydrophobicContact CE2-CG 4.42Å; Y795-L828 HydrophobicContact CG-CD2 3.68Å; Y795-L828 HydrophobicContact CG-CG 4.28Å; I811-L828 HydrophobicContact CB-CD1 4.02Å; I811-L828 HydrophobicContact CG2-CD1 3.75Å; A812-L828 HydrophobicContact CB-CD2 4.36Å; A824-L828 PolarHBondContact O-N 3.41Å; F825-L828 WeakPolarHBondContact O-CB 3Å; F825-L828 PolarHBondContact O-N 3.25Å; W826-L828 PolarHBondContact O-N 2.94Å; L828-I831 PolarHBondContact O-N 3.1Å; L828-L832 HydrophobicContact CD1-CD1 3.57Å; L828-L832 HydrophobicContact CD1-CG 3.98Å; L828-L832 HydrophobicContact CG-CD1 3.75Å; L828-L832 HydrophobicContact CG-CG 4.34Å; L828-L832 WeakPolarHBondContact O-CB 3.45Å; L828-L832 WeakPolarHBondContact O-CG 3.35Å; L828-L832 PolarHBondContact O-N 2.81Å
829	I	96.5	Very high	94.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61	-46.9	174.9	-68	169.5	0	0	0	111.6	L731 L734 Y795 F825 W826 C827 I831 L832 E833	L731-I829 HydrophobicContact CD1-CB 4.18Å; L731-I829 HydrophobicContact CD1-CG2 4.04Å; L731-I829 HydrophobicContact CD2-CG2 4.17Å; L734-I829 HydrophobicContact CD2-CG2 3.88Å; Y795-I829 HydrophobicContact CD2-CG1 3.98Å; Y795-I829 HydrophobicContact CE2-CG1 4.11Å; F825-I829 HydrophobicContact CD1-CD1 4.07Å; F825-I829 HydrophobicContact CD2-CD1 4.37Å; F825-I829 HydrophobicContact CE1-CD1 3.46Å; F825-I829 VanDerWaalsContact CE1-CD1 3.46Å; F825-I829 HydrophobicContact CE2-CD1 3.82Å; F825-I829 HydrophobicContact CE2-CG1 4.47Å; F825-I829 HydrophobicContact CG-CD1 4.5Å; F825-I829 HydrophobicContact CZ-CD1 3.33Å; F825-I829 HydrophobicContact CZ-CG1 4.42Å; F825-I829 PolarHBondContact O-N 3.39Å; W826-I829 HydrophobicContact CE3-CD1 3.73Å; W826-I829 HydrophobicContact CZ3-CD1 3.89Å; W826-I829 PolarHBondContact O-N 3.37Å; C827-I829 VanDerWaalsContact C-N 3.32Å; C827-I829 PolarHBondContact O-N 3.29Å; I829-I831 VanDerWaalsContact C-N 3.31Å; I829-I831 PolarHBondContact O-N 3.37Å; I829-L832 PolarHBondContact O-N 2.8Å; I829-E833 HydrophobicContact CG2-CB 4.45Å; I829-E833 HydrophobicContact CG2-CG 4.36Å; I829-E833 WeakPolarHBondContact O-CB 3.19Å; I829-E833 PolarHBondContact O-N 3.24Å
830	A	96.6	Very high	94.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.146	C	C	.	.	I	π-helix	trans	-59.4	-44.8	-179.9	0	0	0	0	0	111.2	I727 L731 W826 C827 R834 F835	I727-A830 HydrophobicContact CG2-CB 3.97Å; L731-A830 HydrophobicContact CD1-CB 3.79Å; L731-A830 HydrophobicContact CD2-CB 4.4Å; L731-A830 HydrophobicContact CG-CB 4Å; W826-A830 PolarHBondContact O-N 2.95Å; C827-A830 PolarHBondContact O-N 3.46Å; A830-R834 CarbonylContact O-C 3.45Å; A830-R834 WeakPolarHBondContact O-CA 3.41Å; A830-R834 VanDerWaalsContact O-CB 3.29Å; A830-R834 WeakPolarHBondContact O-CB 3.21Å; A830-R834 PolarHBondContact O-N 3.03Å; A830-F835 HydrophobicContact CB-CE2 4.08Å; A830-F835 PolarHBondContact O-N 3.36Å
831	I	96.5	Very high	94	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.125	C	C	.	.	I	π-helix	trans	-64.7	-49.5	179.3	-65.1	177.7	0	0	0	110.9	I811 C827 L828 I829 F835 L836 V888 W902 F905 L906	I811-I831 HydrophobicContact CD1-CG2 4.17Å; I811-I831 HydrophobicContact CG2-CB 4.37Å; I811-I831 HydrophobicContact CG2-CD1 3.55Å; I811-I831 HydrophobicContact CG2-CG2 4.18Å; C827-I831 WeakPolarHBondContact O-CG1 3.31Å; C827-I831 PolarHBondContact O-N 3.5Å; L828-I831 PolarHBondContact O-N 3.1Å; I829-I831 VanDerWaalsContact C-N 3.31Å; I829-I831 PolarHBondContact O-N 3.37Å; I831-F835 HydrophobicContact CG1-CD2 4.05Å; I831-L836 HydrophobicContact CG2-CD1 3.98Å; I831-L836 HydrophobicContact CG2-CG 4.36Å; I831-L836 VanDerWaalsContact O-CB 3.28Å; I831-L836 WeakPolarHBondContact O-CB 3.28Å; I831-L836 VanDerWaalsContact O-CG 3.28Å; I831-L836 WeakPolarHBondContact O-CG 3.45Å; I831-L836 PolarHBondContact O-N 2.67Å; I831-V888 HydrophobicContact CG2-CG2 4.29Å; I831-W902 HydrophobicContact CD1-CH2 3.73Å; I831-W902 HydrophobicContact CD1-CZ2 4.44Å; I831-W902 HydrophobicContact CD1-CZ3 3.81Å; I831-F905 HydrophobicContact CD1-CE1 4.15Å; I831-F905 HydrophobicContact CG1-CE1 3.9Å; I831-F905 HydrophobicContact CG2-CE1 4.09Å; I831-F905 HydrophobicContact CG2-CZ 4.09Å; I831-L906 HydrophobicContact CD1-CD2 4.28Å; I831-L906 HydrophobicContact CG1-CD2 4.26Å
832	L	94.6	Very high	93.3	Very high	7 Å²	7	25.8 Å²	25.8	4%	0.037	12%	0.119	C	C	.	.	I	π-helix	trans	-78.9	-30	-171.4	-61.9	-174.9	0	0	0	114	Y795 M808 I811 L828 I829 L836 F841	Y795-L832 HydrophobicContact CD1-CD1 4.41Å; Y795-L832 HydrophobicContact CD2-CD1 4.44Å; Y795-L832 HydrophobicContact CE1-CD1 3.7Å; Y795-L832 HydrophobicContact CE2-CB 4.37Å; Y795-L832 HydrophobicContact CE2-CD1 3.72Å; Y795-L832 WeakPolarHBondContact OH-CB 3.1Å; Y795-L832 VanDerWaalsContact OH-CD1 3.3Å; Y795-L832 WeakPolarHBondContact OH-CD1 3.36Å; M808-L832 HydrophobicContact CE-CD1 3.86Å; M808-L832 HydrophobicContact CG-CD1 4Å; M808-L832 HydrophobicContact SD-CD1 4.02Å; I811-L832 HydrophobicContact CD1-CD2 3.99Å; L828-L832 HydrophobicContact CD1-CD1 3.57Å; L828-L832 HydrophobicContact CD1-CG 3.98Å; L828-L832 HydrophobicContact CG-CD1 3.75Å; L828-L832 HydrophobicContact CG-CG 4.34Å; L828-L832 WeakPolarHBondContact O-CB 3.45Å; L828-L832 WeakPolarHBondContact O-CG 3.35Å; L828-L832 PolarHBondContact O-N 2.81Å; I829-L832 PolarHBondContact O-N 2.8Å; L832-L836 HydrophobicContact CD2-CD1 4.28Å; L832-F841 HydrophobicContact CD2-CD2 3.48Å; L832-F841 VanDerWaalsContact CD2-CD2 3.48Å; L832-F841 HydrophobicContact CD2-CE2 3.11Å; L832-F841 HydrophobicContact CD2-CG 4.44Å; L832-F841 HydrophobicContact CD2-CZ 3.8Å
833	E	93.5	Very high	92.1	Very high	57 Å²	57	29.6 Å²	29.6	27%	0.266	15%	0.153	S	C	.	.	I	π-helix	trans	-115	-16.1	-171.8	-53.9	-166.7	170.5	0	0	114.4	H798 N799 I829	H798-E833 IonicContact CD2-OE1 3.12Å; H798-E833 IonicContact NE2-OE1 2.68Å; H798-E833 IonicContact NE2-OE2 3.02Å; N799-E833 PolarHBondContact ND2-OE1 3.39Å; I829-E833 HydrophobicContact CG2-CB 4.45Å; I829-E833 HydrophobicContact CG2-CG 4.36Å; I829-E833 WeakPolarHBondContact O-CB 3.19Å; I829-E833 PolarHBondContact O-N 3.24Å
834	R	93.6	Very high	91	Very high	137 Å²	137	30.3 Å²	30.3	52%	0.517	16%	0.161	S	C	.	.	I	π-helix	trans	-116.2	-45.9	179.9	-56.9	-63.8	173.1	170.8	-5.2	113.4	L731 A830	L731-R834 HydrophobicContact CD2-CG 3.59Å; A830-R834 CarbonylContact O-C 3.45Å; A830-R834 WeakPolarHBondContact O-CA 3.41Å; A830-R834 VanDerWaalsContact O-CB 3.29Å; A830-R834 WeakPolarHBondContact O-CB 3.21Å; A830-R834 PolarHBondContact O-N 3.03Å
835	F	93.7	Very high	90.4	Very high	19 Å²	19	32.2 Å²	32.2	8%	0.083	17%	0.171	C	C	.	.	I	π-helix	trans	-84.2	-46.5	-177.4	-61.1	-38.6	0	0	0	112.6	E730 A830 I831 F905 L906 S910	E730-F835 HydrophobicContact CG-CE1 3.91Å; E730-F835 HydrophobicContact CG-CZ 4.15Å; A830-F835 HydrophobicContact CB-CE2 4.08Å; A830-F835 PolarHBondContact O-N 3.36Å; I831-F835 HydrophobicContact CG1-CD2 4.05Å; F835-F905 HydrophobicContact CB-CE2 4.29Å; F835-F905 HydrophobicContact CB-CZ 3.88Å; F835-F905 HydrophobicContact CD2-CE1 4.16Å; F835-F905 HydrophobicContact CD2-CZ 4.26Å; F835-F905 HydrophobicContact CG-CZ 4.44Å; F835-L906 HydrophobicContact CD2-CD2 4.38Å; F835-L906 HydrophobicContact CE2-CD2 3.76Å; F835-L906 WeakPolarHBondContact CZ-O 3.3Å; F835-S910 VanDerWaalsContact O-CB 3.25Å; F835-S910 WeakPolarHBondContact O-CB 3.27Å; F835-S910 PolarHBondContact O-OG 3.38Å
836	L	93.8	Very high	89.9	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.026	17%	0.173	C	C	.	.	S	Bend	trans	-84.8	149.8	174.5	-62.2	175.5	0	0	0	110.5	I831 L832 Y840 F841 L913	I831-L836 HydrophobicContact CG2-CD1 3.98Å; I831-L836 HydrophobicContact CG2-CG 4.36Å; I831-L836 VanDerWaalsContact O-CB 3.28Å; I831-L836 WeakPolarHBondContact O-CB 3.28Å; I831-L836 VanDerWaalsContact O-CG 3.28Å; I831-L836 WeakPolarHBondContact O-CG 3.45Å; I831-L836 PolarHBondContact O-N 2.67Å; L832-L836 HydrophobicContact CD2-CD1 4.28Å; L836-Y840 HydrophobicContact CB-CD2 4.31Å; L836-Y840 HydrophobicContact CB-CG 4.13Å; L836-Y840 HydrophobicContact CD1-CD1 3.94Å; L836-Y840 HydrophobicContact CD1-CE1 4.31Å; L836-Y840 HydrophobicContact CD1-CG 4.34Å; L836-Y840 HydrophobicContact CD2-CD1 4.44Å; L836-Y840 HydrophobicContact CD2-CE1 4.2Å; L836-Y840 HydrophobicContact CD2-CE2 4.39Å; L836-F841 HydrophobicContact CD1-CE2 3.79Å; L836-L913 HydrophobicContact CD2-CD1 3.99Å
837	P	91.1	Very high	89.6	Confident	30 Å²	30	33.2 Å²	33.2	20%	0.195	18%	0.176	C	C	.	.			trans	-55	148.3	171.7	-25.4	31.8	0	0	0	113.4	N839 Y840 D847	P837-N839 VanDerWaalsContact C-N 3.27Å; P837-N839 PolarHBondContact O-N 3.15Å; P837-N839 VanDerWaalsContact O-N 3.1Å; P837-Y840 HydrophobicContact CB-CD2 4.18Å; P837-Y840 HydrophobicContact CG-CD2 3.95Å; P837-Y840 HydrophobicContact CG-CE2 4.14Å; P837-Y840 WeakPolarHBondContact O-CB 3.5Å; P837-Y840 PolarHBondContact O-N 3.12Å; P837-Y840 VanDerWaalsContact O-N 3.11Å; P837-D847 HydrophobicContact CB-CB 3.66Å; P837-D847 VanDerWaalsContact CB-OD2 3.26Å; P837-D847 WeakPolarHBondContact CB-OD2 3.33Å; P837-D847 HydrophobicContact CG-CB 4.26Å
838	E	85.4	Confident	89.3	Confident	136 Å²	136	33.2 Å²	33.2	64%	0.636	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	-36.2	-172.2	-169.5	-170.2	155.5	0	0	114.4
839	N	84.5	Confident	89.1	Confident	31 Å²	31	36.6 Å²	36.6	17%	0.166	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	25.6	-175.3	-56	-73.5	0	0	0	113	P837 F841 N842 I846 D847	P837-N839 VanDerWaalsContact C-N 3.27Å; P837-N839 PolarHBondContact O-N 3.15Å; P837-N839 VanDerWaalsContact O-N 3.1Å; N839-F841 PolarHBondContact O-N 3.11Å; N839-N842 HydrophobicContact CB-CB 4.42Å; N839-N842 PolarHBondContact O-OD1 3.18Å; N839-I846 HydrophobicContact CB-CG2 3.85Å; N839-D847 VanDerWaalsContact CA-OD2 3.25Å; N839-D847 WeakPolarHBondContact CA-OD2 3.45Å; N839-D847 HydrophobicContact CB-CB 4.46Å; N839-D847 WeakPolarHBondContact CB-OD2 3.41Å; N839-D847 PolarHBondContact N-OD2 3.22Å
840	Y	89.9	Confident	89.1	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.008	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-43	-178.4	-136.3	-104.9	0	0	0	113.4	L836 P837 L845 D847 A848 D851 F885 L886	L836-Y840 HydrophobicContact CB-CD2 4.31Å; L836-Y840 HydrophobicContact CB-CG 4.13Å; L836-Y840 HydrophobicContact CD1-CD1 3.94Å; L836-Y840 HydrophobicContact CD1-CE1 4.31Å; L836-Y840 HydrophobicContact CD1-CG 4.34Å; L836-Y840 HydrophobicContact CD2-CD1 4.44Å; L836-Y840 HydrophobicContact CD2-CE1 4.2Å; L836-Y840 HydrophobicContact CD2-CE2 4.39Å; P837-Y840 HydrophobicContact CB-CD2 4.18Å; P837-Y840 HydrophobicContact CG-CD2 3.95Å; P837-Y840 HydrophobicContact CG-CE2 4.14Å; P837-Y840 WeakPolarHBondContact O-CB 3.5Å; P837-Y840 PolarHBondContact O-N 3.12Å; P837-Y840 VanDerWaalsContact O-N 3.11Å; Y840-L845 WeakPolarHBondContact O-CA 3.29Å; Y840-L845 VanDerWaalsContact O-CD2 3.28Å; Y840-L845 WeakPolarHBondContact O-CD2 3.27Å; Y840-D847 HydrophobicContact CD2-CB 3.81Å; Y840-D847 HydrophobicContact CE2-CB 4.48Å; Y840-A848 HydrophobicContact CD1-CB 3.82Å; Y840-A848 HydrophobicContact CD2-CB 4.26Å; Y840-A848 HydrophobicContact CE1-CB 3.64Å; Y840-A848 HydrophobicContact CE2-CB 4.12Å; Y840-A848 HydrophobicContact CG-CB 4.14Å; Y840-D851 HydrophobicContact CE2-CB 4.27Å; Y840-D851 WeakPolarHBondContact CE2-OD2 3.34Å; Y840-D851 PolarHBondContact OH-OD2 2.95Å; Y840-F885 HydrophobicContact CE1-CB 4.37Å; Y840-F885 WeakPolarHBondContact OH-CB 3.22Å; Y840-F885 WeakPolarHBondContact OH-CD2 3.21Å; Y840-L886 HydrophobicContact CD1-CD2 3.84Å; Y840-L886 HydrophobicContact CE1-CD2 3.94Å
841	F	86.7	Confident	89.1	Confident	8 Å²	8	36.7 Å²	36.7	4%	0.035	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	20.7	-176.4	-69.9	-89.9	0	0	0	113.4	I802 C805 M808 I811 L832 L836 N839 L886	I802-F841 HydrophobicContact CG2-CB 4.1Å; C805-F841 HydrophobicContact CB-CB 3.98Å; C805-F841 HydrophobicContact CB-CD1 3.84Å; C805-F841 HydrophobicContact CB-CG 4.36Å; M808-F841 HydrophobicContact CE-CB 3.43Å; M808-F841 VanDerWaalsContact CE-CB 3.43Å; M808-F841 HydrophobicContact CE-CD1 3.91Å; M808-F841 HydrophobicContact CE-CD2 4.27Å; M808-F841 HydrophobicContact CE-CG 3.61Å; M808-F841 HydrophobicContact CG-CD1 4.18Å; M808-F841 HydrophobicContact CG-CE1 4.21Å; I811-F841 HydrophobicContact CD1-CZ 4.13Å; L832-F841 HydrophobicContact CD2-CD2 3.48Å; L832-F841 VanDerWaalsContact CD2-CD2 3.48Å; L832-F841 HydrophobicContact CD2-CE2 3.11Å; L832-F841 HydrophobicContact CD2-CG 4.44Å; L832-F841 HydrophobicContact CD2-CZ 3.8Å; L836-F841 HydrophobicContact CD1-CE2 3.79Å; N839-F841 PolarHBondContact O-N 3.11Å; F841-L886 HydrophobicContact CD1-CD2 4.31Å; F841-L886 HydrophobicContact CE1-CB 4.49Å; F841-L886 HydrophobicContact CE1-CD2 3.83Å; F841-L886 HydrophobicContact CZ-CD2 3.99Å; F841-L886 WeakPolarHBondContact CZ-O 3.3Å
842	N	80.5	Confident	89.1	Confident	41 Å²	41	36.9 Å²	36.9	22%	0.219	19%	0.194	C	C	.	.	S	Bend	trans	-68.6	170.5	174.1	79.6	1.2	0	0	0	111.3	N839 G844 L845 I846	N839-N842 HydrophobicContact CB-CB 4.42Å; N839-N842 PolarHBondContact O-OD1 3.18Å; N842-G844 PolarHBondContact O-N 3.25Å; N842-G844 WeakPolarHBondContact OD1-CA 3.25Å; N842-G844 PolarHBondContact OD1-N 3.24Å; N842-L845 PolarHBondContact O-N 3.25Å; N842-L845 WeakPolarHBondContact OD1-CA 3.5Å; N842-L845 PolarHBondContact OD1-N 2.99Å; N842-I846 PolarHBondContact OD1-N 3.37Å; N842-I846 VanDerWaalsContact OD1-N 3.13Å
843	S	71.5	Confident	89.2	Confident	141 Å²	141	38.9 Å²	38.9	99%	0.986	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-20	-179.5	55.3	0	0	0	0	115.4
844	G	74	Confident	89.4	Confident	19 Å²	19	36.1 Å²	36.1	20%	0.196	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-7.3	176.2	0	0	0	0	0	114.8	N842 I846 Q849 M986	N842-G844 PolarHBondContact O-N 3.25Å; N842-G844 WeakPolarHBondContact OD1-CA 3.25Å; N842-G844 PolarHBondContact OD1-N 3.24Å; G844-I846 PolarHBondContact O-N 3.48Å; G844-Q849 PolarHBondContact O-NE2 2.96Å; G844-M986 WeakPolarHBondContact O-CE 3.38Å
845	L	85.3	Confident	89.6	Confident	41 Å²	41	29.6 Å²	29.6	22%	0.215	17%	0.167	C	C	.	.			trans	47.4	39.8	-167.4	-55.5	175.9	0	0	0	112.2	Y840 N842 D847 A848 Q849 L886	Y840-L845 WeakPolarHBondContact O-CA 3.29Å; Y840-L845 VanDerWaalsContact O-CD2 3.28Å; Y840-L845 WeakPolarHBondContact O-CD2 3.27Å; N842-L845 PolarHBondContact O-N 3.25Å; N842-L845 WeakPolarHBondContact OD1-CA 3.5Å; N842-L845 PolarHBondContact OD1-N 2.99Å; L845-D847 PolarHBondContact O-N 2.93Å; L845-A848 HydrophobicContact CB-CB 4.17Å; L845-A848 WeakPolarHBondContact O-CB 3.39Å; L845-A848 PolarHBondContact O-N 3.31Å; L845-A848 VanDerWaalsContact O-N 3.16Å; L845-Q849 WeakPolarHBondContact O-CG 3.27Å; L845-Q849 PolarHBondContact O-N 3.11Å; L845-L886 HydrophobicContact CD1-CD1 4.17Å; L845-L886 HydrophobicContact CD2-CD2 4.4Å
846	I	86.7	Confident	89.8	Confident	8 Å²	8	31.6 Å²	31.6	4%	0.041	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-43.3	-163	-156	171.7	0	0	0	111.7	N839 N842 G844 A848 Q849 V850 Y979 L982 M986	N839-I846 HydrophobicContact CB-CG2 3.85Å; N842-I846 PolarHBondContact OD1-N 3.37Å; N842-I846 VanDerWaalsContact OD1-N 3.13Å; G844-I846 PolarHBondContact O-N 3.48Å; I846-A848 VanDerWaalsContact C-N 3.32Å; I846-A848 PolarHBondContact O-N 2.88Å; I846-Q849 WeakPolarHBondContact O-CB 3.22Å; I846-Q849 PolarHBondContact O-N 3.29Å; I846-V850 VanDerWaalsContact O-CG2 3.31Å; I846-V850 WeakPolarHBondContact O-CG2 3.12Å; I846-V850 PolarHBondContact O-N 2.56Å; I846-Y979 HydrophobicContact CD1-CE2 4.46Å; I846-Y979 HydrophobicContact CG2-CD2 4.18Å; I846-Y979 HydrophobicContact CG2-CE2 3.62Å; I846-L982 HydrophobicContact CD1-CB 4.36Å; I846-L982 HydrophobicContact CG1-CB 4.14Å; I846-M986 HydrophobicContact CB-SD 4.16Å; I846-M986 HydrophobicContact CD1-SD 3.55Å; I846-M986 VanDerWaalsContact CD1-SD 3.55Å; I846-M986 HydrophobicContact CG1-CE 4.49Å; I846-M986 HydrophobicContact CG1-SD 3.74Å
847	D	91.4	Very high	89.9	Confident	15 Å²	15	34 Å²	34	8%	0.08	19%	0.187	C	C	.	.	H	α-helix	trans	-72.1	-30	179.5	-70.7	-14.3	0	0	0	111.7	P837 N839 Y840 L845 Q849 V850 D851 Y979	P837-D847 HydrophobicContact CB-CB 3.66Å; P837-D847 VanDerWaalsContact CB-OD2 3.26Å; P837-D847 WeakPolarHBondContact CB-OD2 3.33Å; P837-D847 HydrophobicContact CG-CB 4.26Å; N839-D847 VanDerWaalsContact CA-OD2 3.25Å; N839-D847 WeakPolarHBondContact CA-OD2 3.45Å; N839-D847 HydrophobicContact CB-CB 4.46Å; N839-D847 WeakPolarHBondContact CB-OD2 3.41Å; N839-D847 PolarHBondContact N-OD2 3.22Å; Y840-D847 HydrophobicContact CD2-CB 3.81Å; Y840-D847 HydrophobicContact CE2-CB 4.48Å; L845-D847 PolarHBondContact O-N 2.93Å; D847-Q849 VanDerWaalsContact C-N 3.35Å; D847-V850 WeakPolarHBondContact O-CB 3.49Å; D847-V850 PolarHBondContact O-N 3.33Å; D847-D851 PolarHBondContact O-N 2.91Å; D847-Y979 WeakPolarHBondContact OD1-CD2 3.45Å; D847-Y979 WeakPolarHBondContact OD1-CE2 3.31Å
848	A	93.5	Very high	90.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.6	-40.8	171.9	0	0	0	0	0	110.9	Y840 L845 I846 D851 Q852 L882 L886	Y840-A848 HydrophobicContact CD1-CB 3.82Å; Y840-A848 HydrophobicContact CD2-CB 4.26Å; Y840-A848 HydrophobicContact CE1-CB 3.64Å; Y840-A848 HydrophobicContact CE2-CB 4.12Å; Y840-A848 HydrophobicContact CG-CB 4.14Å; L845-A848 HydrophobicContact CB-CB 4.17Å; L845-A848 WeakPolarHBondContact O-CB 3.39Å; L845-A848 PolarHBondContact O-N 3.31Å; L845-A848 VanDerWaalsContact O-N 3.16Å; I846-A848 VanDerWaalsContact C-N 3.32Å; I846-A848 PolarHBondContact O-N 2.88Å; A848-D851 PolarHBondContact O-N 3.22Å; A848-Q852 WeakPolarHBondContact O-CG 3.38Å; A848-Q852 PolarHBondContact O-N 2.89Å; A848-Q852 VanDerWaalsContact O-N 3.11Å; A848-L882 HydrophobicContact CB-CD1 3.71Å; A848-L886 HydrophobicContact CB-CD2 3.9Å
849	Q	92.6	Very high	90.8	Very high	71 Å²	71	26.2 Å²	26.2	33%	0.332	15%	0.148	S	C	.	.	H	α-helix	trans	-66.2	-37.7	173.4	-67.8	-179.2	19.8	0	0	112.4	G844 L845 I846 D847 Q852 L853 L982	G844-Q849 PolarHBondContact O-NE2 2.96Å; L845-Q849 WeakPolarHBondContact O-CG 3.27Å; L845-Q849 PolarHBondContact O-N 3.11Å; I846-Q849 WeakPolarHBondContact O-CB 3.22Å; I846-Q849 PolarHBondContact O-N 3.29Å; D847-Q849 VanDerWaalsContact C-N 3.35Å; Q849-Q852 WeakPolarHBondContact O-CB 3.22Å; Q849-Q852 PolarHBondContact O-N 3.16Å; Q849-L853 PolarHBondContact O-N 2.72Å; Q849-L853 VanDerWaalsContact O-N 3.15Å; Q849-L982 HydrophobicContact CB-CD1 3.9Å
850	V	95.6	Very high	91.3	Very high	2 Å²	2	29 Å²	29	1%	0.012	16%	0.16	C	C	.	.	H	α-helix	trans	-57.7	-50.3	172.3	165	0	0	0	0	110.1	I846 D847 Q852 L853 V854 R975 H978 Y979 L982	I846-V850 VanDerWaalsContact O-CG2 3.31Å; I846-V850 WeakPolarHBondContact O-CG2 3.12Å; I846-V850 PolarHBondContact O-N 2.56Å; D847-V850 WeakPolarHBondContact O-CB 3.49Å; D847-V850 PolarHBondContact O-N 3.33Å; V850-Q852 PolarHBondContact O-N 3.39Å; V850-L853 WeakPolarHBondContact O-CB 3.07Å; V850-L853 PolarHBondContact O-N 3.3Å; V850-V854 HydrophobicContact CG1-CG2 4.42Å; V850-V854 WeakPolarHBondContact O-CG2 3.47Å; V850-V854 PolarHBondContact O-N 3.15Å; V850-R975 HydrophobicContact CG1-CB 3.98Å; V850-R975 HydrophobicContact CG1-CG 4.05Å; V850-R975 WeakPolarHBondContact CG1-O 3.41Å; V850-H978 HydrophobicContact CG1-CB 4Å; V850-H978 HydrophobicContact CG2-CB 4.33Å; V850-Y979 HydrophobicContact CG2-CD2 4.28Å; V850-L982 HydrophobicContact CG2-CD1 3.77Å
851	D	96.5	Very high	91.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.9	-34	177.3	-86.2	3.9	0	0	0	112.2	Y840 D847 A848 L853 V854 L855 F885 F914 R975	Y840-D851 HydrophobicContact CE2-CB 4.27Å; Y840-D851 WeakPolarHBondContact CE2-OD2 3.34Å; Y840-D851 PolarHBondContact OH-OD2 2.95Å; D847-D851 PolarHBondContact O-N 2.91Å; A848-D851 PolarHBondContact O-N 3.22Å; D851-L853 PolarHBondContact O-N 2.59Å; D851-V854 PolarHBondContact O-N 3.31Å; D851-L855 VanDerWaalsContact O-CB 3.31Å; D851-L855 WeakPolarHBondContact O-CB 3.3Å; D851-L855 PolarHBondContact O-N 3.49Å; D851-F885 HydrophobicContact CB-CD2 3.98Å; D851-F885 HydrophobicContact CB-CE2 4.14Å; D851-F914 HydrophobicContact CB-CE1 4.32Å; D851-F914 HydrophobicContact CB-CZ 3.94Å; D851-F914 WeakPolarHBondContact O-CE1 3.42Å; D851-R975 IonicContact OD1-CZ 3.22Å; D851-R975 IonicContact OD1-NE 2.82Å; D851-R975 PolarHBondContact OD1-NE 3.03Å; D851-R975 IonicContact OD1-NH2 3.76Å; D851-R975 PolarHBondContact OD1-NH2 2.89Å; D851-R975 IonicContact OD2-CZ 2.63Å; D851-R975 IonicContact OD2-NE 2.71Å; D851-R975 IonicContact OD2-NH2 3.7Å; D851-R975 PolarHBondContact OD2-NH2 2.92Å
852	Q	97.4	Very high	92.1	Very high	5 Å²	5	35.8 Å²	35.8	2%	0.023	19%	0.19	C	C	.	.	H	α-helix	trans	-66.3	-35.3	174.1	-63.5	-41.8	-63	0	0	113.4	A848 Q849 V850 K856 S878 T881 L882	A848-Q852 WeakPolarHBondContact O-CG 3.38Å; A848-Q852 PolarHBondContact O-N 2.89Å; A848-Q852 VanDerWaalsContact O-N 3.11Å; Q849-Q852 WeakPolarHBondContact O-CB 3.22Å; Q849-Q852 PolarHBondContact O-N 3.16Å; V850-Q852 PolarHBondContact O-N 3.39Å; Q852-K856 WeakPolarHBondContact O-CG 3.31Å; Q852-K856 PolarHBondContact O-N 2.9Å; Q852-K856 VanDerWaalsContact O-N 3.09Å; Q852-S878 WeakPolarHBondContact CB-OG 3.32Å; Q852-T881 PolarHBondContact OE1-OG1 2.97Å; Q852-L882 HydrophobicContact CG-CB 4.16Å; Q852-L882 HydrophobicContact CG-CD1 3.89Å
853	L	96.5	Very high	92.8	Very high	48 Å²	48	34 Å²	34	25%	0.251	18%	0.181	S	C	.	.	H	α-helix	trans	-69.6	-42.5	174.1	-64.5	179.5	0	0	0	111.2	Q849 V850 D851 L855 K856 E857 H978 L982	Q849-L853 PolarHBondContact O-N 2.72Å; Q849-L853 VanDerWaalsContact O-N 3.15Å; V850-L853 WeakPolarHBondContact O-CB 3.07Å; V850-L853 PolarHBondContact O-N 3.3Å; D851-L853 PolarHBondContact O-N 2.59Å; L853-L855 VanDerWaalsContact C-N 3.33Å; L853-L855 PolarHBondContact O-N 3.09Å; L853-K856 HydrophobicContact CD2-CD 4.39Å; L853-K856 WeakPolarHBondContact O-CB 3.19Å; L853-K856 PolarHBondContact O-N 3.23Å; L853-E857 PolarHBondContact O-N 3.2Å; L853-E857 VanDerWaalsContact O-N 3.12Å; L853-H978 HydrophobicContact CB-CB 4.36Å; L853-H978 HydrophobicContact CD1-CB 4.08Å; L853-L982 HydrophobicContact CD1-CD1 3.64Å; L853-L982 HydrophobicContact CD1-CD2 4.28Å; L853-L982 HydrophobicContact CD1-CG 3.96Å; L853-L982 HydrophobicContact CG-CD1 4.49Å
854	V	97.3	Very high	94	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.9	-44	174.3	179.4	0	0	0	0	110.5	V850 D851 K856 E857 I858 F914 I971 R974 R975	V850-V854 HydrophobicContact CG1-CG2 4.42Å; V850-V854 WeakPolarHBondContact O-CG2 3.47Å; V850-V854 PolarHBondContact O-N 3.15Å; D851-V854 PolarHBondContact O-N 3.31Å; V854-K856 VanDerWaalsContact C-N 3.32Å; V854-K856 PolarHBondContact O-N 3.27Å; V854-E857 WeakPolarHBondContact O-CB 3.42Å; V854-E857 PolarHBondContact O-N 3.17Å; V854-E857 VanDerWaalsContact O-N 3.14Å; V854-I858 HydrophobicContact CG1-CD1 4.07Å; V854-I858 HydrophobicContact CG1-CG1 4.47Å; V854-I858 WeakPolarHBondContact O-CG1 3.4Å; V854-I858 PolarHBondContact O-N 2.98Å; V854-F914 HydrophobicContact CB-CE1 3.89Å; V854-F914 HydrophobicContact CB-CZ 4.26Å; V854-F914 HydrophobicContact CG1-CD1 4.46Å; V854-F914 HydrophobicContact CG1-CE1 3.78Å; V854-F914 HydrophobicContact CG1-CZ 4.09Å; V854-I971 HydrophobicContact CG1-CG2 4.36Å; V854-R974 HydrophobicContact CG1-CB 4.24Å; V854-R974 HydrophobicContact CG2-CB 3.89Å; V854-R975 HydrophobicContact CG2-CG 4.09Å
855	L	97.8	Very high	95.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.8	-43.5	176.3	178.2	63.4	0	0	0	111.4	D851 L853 E857 I858 V859 T881 F885 F914 A917 V918	D851-L855 VanDerWaalsContact O-CB 3.31Å; D851-L855 WeakPolarHBondContact O-CB 3.3Å; D851-L855 PolarHBondContact O-N 3.49Å; L853-L855 VanDerWaalsContact C-N 3.33Å; L853-L855 PolarHBondContact O-N 3.09Å; L855-E857 VanDerWaalsContact C-N 3.3Å; L855-E857 PolarHBondContact O-N 3.03Å; L855-I858 PolarHBondContact O-N 3.16Å; L855-V859 HydrophobicContact CD1-CG2 4.18Å; L855-V859 HydrophobicContact CG-CG2 4.34Å; L855-V859 WeakPolarHBondContact O-CB 3.34Å; L855-V859 VanDerWaalsContact O-CG2 3.3Å; L855-V859 WeakPolarHBondContact O-CG2 3.48Å; L855-V859 PolarHBondContact O-N 2.69Å; L855-T881 HydrophobicContact CD2-CG2 3.96Å; L855-F885 HydrophobicContact CD1-CZ 4.35Å; L855-F885 HydrophobicContact CD2-CE1 4.48Å; L855-F885 HydrophobicContact CD2-CZ 3.98Å; L855-F914 HydrophobicContact CB-CD1 4.02Å; L855-F914 HydrophobicContact CB-CE1 4.13Å; L855-F914 HydrophobicContact CD1-CD1 4.13Å; L855-A917 HydrophobicContact CD1-CB 3.86Å; L855-A917 HydrophobicContact CD2-CB 4.21Å; L855-V918 HydrophobicContact CD1-CG2 3.85Å
856	K	97	Very high	95.7	Very high	60 Å²	60	35.5 Å²	35.5	26%	0.261	17%	0.165	S	C	.	.	H	α-helix	trans	-60.1	-38.7	176.2	-76.7	167.3	174.6	163.8	0	112.6	Q852 L853 V854 H860 D876 I877 S878	Q852-K856 WeakPolarHBondContact O-CG 3.31Å; Q852-K856 PolarHBondContact O-N 2.9Å; Q852-K856 VanDerWaalsContact O-N 3.09Å; L853-K856 HydrophobicContact CD2-CD 4.39Å; L853-K856 WeakPolarHBondContact O-CB 3.19Å; L853-K856 PolarHBondContact O-N 3.23Å; V854-K856 VanDerWaalsContact C-N 3.32Å; V854-K856 PolarHBondContact O-N 3.27Å; K856-H860 WeakPolarHBondContact O-CB 3.46Å; K856-H860 PolarHBondContact O-N 2.87Å; K856-D876 WeakPolarHBondContact CE-OD1 3.28Å; K856-D876 IonicContact NZ-OD1 3.6Å; K856-D876 PolarHBondContact NZ-OD1 2.77Å; K856-D876 IonicContact NZ-OD2 3.19Å; K856-D876 PolarHBondContact NZ-OD2 3.15Å; K856-I877 HydrophobicContact CG-CD1 4.3Å; K856-I877 HydrophobicContact CG-CG1 4.23Å; K856-S878 WeakPolarHBondContact CE-OG 3.33Å; K856-S878 PolarHBondContact NZ-OG 3.35Å
857	E	96.8	Very high	96.1	Very high	57 Å²	57	35.7 Å²	35.7	27%	0.266	17%	0.167	S	C	.	.	H	α-helix	trans	-65.4	-45.2	174.3	-69.7	-179.7	173	0	0	111.5	L853 V854 L855 V859 H860 E861 R974 H978	L853-E857 PolarHBondContact O-N 3.2Å; L853-E857 VanDerWaalsContact O-N 3.12Å; V854-E857 WeakPolarHBondContact O-CB 3.42Å; V854-E857 PolarHBondContact O-N 3.17Å; V854-E857 VanDerWaalsContact O-N 3.14Å; L855-E857 VanDerWaalsContact C-N 3.3Å; L855-E857 PolarHBondContact O-N 3.03Å; E857-V859 VanDerWaalsContact C-N 3.34Å; E857-V859 PolarHBondContact O-N 3.28Å; E857-H860 WeakPolarHBondContact O-CB 3.49Å; E857-H860 PolarHBondContact O-N 3.44Å; E857-H860 VanDerWaalsContact O-N 3.12Å; E857-E861 WeakPolarHBondContact O-CG 3.39Å; E857-E861 PolarHBondContact O-N 2.95Å; E857-R974 VanDerWaalsContact OE2-CD 3.23Å; E857-R974 WeakPolarHBondContact OE2-CD 3.48Å; E857-R974 IonicContact OE2-NE 3.11Å; E857-H978 VanDerWaalsContact CD-NE2 3.27Å; E857-H978 IonicContact OE1-CD2 3.53Å; E857-H978 IonicContact OE1-CE1 2.88Å; E857-H978 PolarHBondContact OE1-CE1 3.23Å; E857-H978 VanDerWaalsContact OE1-CE1 3.23Å; E857-H978 IonicContact OE1-NE2 3.78Å; E857-H978 PolarHBondContact OE1-NE2 2.82Å; E857-H978 IonicContact OE2-NE2 3.82Å
858	I	97.6	Very high	96.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64	-41.2	178.1	-58.2	174.3	0	0	0	110.6	V854 L855 H860 E861 K862 F914 V918 F965 P966	V854-I858 HydrophobicContact CG1-CD1 4.07Å; V854-I858 HydrophobicContact CG1-CG1 4.47Å; V854-I858 WeakPolarHBondContact O-CG1 3.4Å; V854-I858 PolarHBondContact O-N 2.98Å; L855-I858 PolarHBondContact O-N 3.16Å; I858-H860 VanDerWaalsContact C-N 3.3Å; I858-H860 PolarHBondContact O-N 3Å; I858-E861 PolarHBondContact O-N 3.44Å; I858-K862 HydrophobicContact CG2-CG 4.02Å; I858-K862 VanDerWaalsContact O-CB 3.27Å; I858-K862 WeakPolarHBondContact O-CB 3.37Å; I858-K862 WeakPolarHBondContact O-CG 3.25Å; I858-K862 PolarHBondContact O-N 3.06Å; I858-F914 HydrophobicContact CD1-CB 4.02Å; I858-F914 HydrophobicContact CD1-CD1 3.78Å; I858-F914 HydrophobicContact CD1-CE1 4.48Å; I858-F914 HydrophobicContact CD1-CG 4.03Å; I858-V918 HydrophobicContact CB-CG2 4.42Å; I858-V918 HydrophobicContact CG2-CG2 3.79Å; I858-F965 HydrophobicContact CD1-CE1 4.45Å; I858-F965 HydrophobicContact CD1-CZ 4.31Å; I858-F965 HydrophobicContact CG2-CE2 3.9Å; I858-F965 HydrophobicContact CG2-CZ 3.87Å; I858-P966 HydrophobicContact CD1-CG 4.38Å; I858-P966 HydrophobicContact CG1-CG 4.15Å; I858-P966 HydrophobicContact CG2-CG 4.45Å
859	V	97.3	Very high	96.5	Very high	2 Å²	2	39 Å²	39	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-63.4	-37.9	174.1	171.2	0	0	0	0	110.9	L855 E857 L863 I877 V918 L921	L855-V859 HydrophobicContact CD1-CG2 4.18Å; L855-V859 HydrophobicContact CG-CG2 4.34Å; L855-V859 WeakPolarHBondContact O-CB 3.34Å; L855-V859 VanDerWaalsContact O-CG2 3.3Å; L855-V859 WeakPolarHBondContact O-CG2 3.48Å; L855-V859 PolarHBondContact O-N 2.69Å; E857-V859 VanDerWaalsContact C-N 3.34Å; E857-V859 PolarHBondContact O-N 3.28Å; V859-L863 HydrophobicContact CG1-CB 4.41Å; V859-L863 CarbonylContact O-C 3.53Å; V859-L863 VanDerWaalsContact O-CA 3.27Å; V859-L863 WeakPolarHBondContact O-CA 3.41Å; V859-L863 WeakPolarHBondContact O-CB 3.46Å; V859-L863 PolarHBondContact O-N 3.16Å; V859-I877 HydrophobicContact CG2-CD1 4.14Å; V859-V918 HydrophobicContact CG2-CG2 4.08Å; V859-L921 HydrophobicContact CG1-CD1 4.48Å; V859-L921 HydrophobicContact CG2-CD1 3.69Å
860	H	96.6	Very high	96.6	Very high	89 Å²	89	36 Å²	36	41%	0.412	18%	0.176	S	C	.	.	H	α-helix	trans	-63.6	-41.1	174.9	-174.3	59.9	0	0	0	112.4	K856 E857 I858 P864 S867	K856-H860 WeakPolarHBondContact O-CB 3.46Å; K856-H860 PolarHBondContact O-N 2.87Å; E857-H860 WeakPolarHBondContact O-CB 3.49Å; E857-H860 PolarHBondContact O-N 3.44Å; E857-H860 VanDerWaalsContact O-N 3.12Å; I858-H860 VanDerWaalsContact C-N 3.3Å; I858-H860 PolarHBondContact O-N 3Å; H860-P864 WeakPolarHBondContact O-CA 3.5Å; H860-P864 WeakPolarHBondContact O-CB 3.34Å; H860-S867 PolarHBondContact ND1-OG 3.32Å; H860-S867 VanDerWaalsContact ND1-OG 3.16Å
861	E	95.7	Very high	96.6	Very high	98 Å²	98	42.8 Å²	42.8	46%	0.458	21%	0.205	S	C	.	.	H	α-helix	trans	-73.5	-41.6	178.9	-70.5	173.1	166.4	0	0	112.9	E857 I858 R974	E857-E861 WeakPolarHBondContact O-CG 3.39Å; E857-E861 PolarHBondContact O-N 2.95Å; I858-E861 PolarHBondContact O-N 3.44Å; E861-R974 VanDerWaalsContact CD-NH2 3.3Å; E861-R974 IonicContact OE1-CZ 3.12Å; E861-R974 IonicContact OE1-NH1 2.65Å; E861-R974 PolarHBondContact OE1-NH1 3.16Å; E861-R974 IonicContact OE1-NH2 3.74Å; E861-R974 PolarHBondContact OE1-NH2 2.82Å; E861-R974 IonicContact OE2-CZ 2.69Å; E861-R974 IonicContact OE2-NH1 2.76Å; E861-R974 PolarHBondContact OE2-NH1 3.36Å; E861-R974 IonicContact OE2-NH2 2.72Å; E861-R974 PolarHBondContact OE2-NH2 2.91Å
862	K	95.9	Very high	96.4	Very high	54 Å²	54	50.3 Å²	50.3	24%	0.235	23%	0.233	C	C	.	.	H	α-helix	trans	-90.7	-32.1	-172.6	-67.1	-68.8	172	-177.8	0	113.7	I858 P864 V918 L962 P964	I858-K862 HydrophobicContact CG2-CG 4.02Å; I858-K862 VanDerWaalsContact O-CB 3.27Å; I858-K862 WeakPolarHBondContact O-CB 3.37Å; I858-K862 WeakPolarHBondContact O-CG 3.25Å; I858-K862 PolarHBondContact O-N 3.06Å; K862-P864 VanDerWaalsContact C-CD 3.46Å; K862-V918 HydrophobicContact CB-CG1 3.96Å; K862-V918 HydrophobicContact CG-CG1 4.41Å; K862-L962 HydrophobicContact CB-CD2 4.28Å; K862-L962 HydrophobicContact CD-CD2 4.27Å; K862-L962 WeakPolarHBondContact CE-O 3.34Å; K862-L962 HydrophobicContact CG-CD2 4.44Å; K862-L962 PolarHBondContact NZ-O 3.1Å; K862-P964 VanDerWaalsContact CE-O 3.3Å; K862-P964 WeakPolarHBondContact CE-O 3.46Å; K862-P964 PolarHBondContact NZ-O 2.95Å
863	L	96.6	Very high	96.2	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.016	24%	0.238	C	C	.	.			trans	-132.4	58.9	-175.4	-48.6	174.2	0	0	0	109.9	V859 R865 L866 S867 V918 L921 K922	V859-L863 HydrophobicContact CG1-CB 4.41Å; V859-L863 CarbonylContact O-C 3.53Å; V859-L863 VanDerWaalsContact O-CA 3.27Å; V859-L863 WeakPolarHBondContact O-CA 3.41Å; V859-L863 WeakPolarHBondContact O-CB 3.46Å; V859-L863 PolarHBondContact O-N 3.16Å; L863-R865 VanDerWaalsContact C-N 3.28Å; L863-R865 PolarHBondContact O-N 3.33Å; L863-L866 HydrophobicContact CB-CB 4.05Å; L863-L866 HydrophobicContact CD1-CD2 4.12Å; L863-L866 PolarHBondContact O-N 3.27Å; L863-S867 PolarHBondContact O-N 2.79Å; L863-V918 HydrophobicContact CD1-CG1 4.12Å; L863-V918 HydrophobicContact CG-CG1 4.35Å; L863-L921 HydrophobicContact CD1-CB 3.62Å; L863-K922 HydrophobicContact CD1-CB 4.22Å; L863-K922 HydrophobicContact CD2-CB 3.72Å; L863-K922 HydrophobicContact CD2-CD 4.22Å; L863-K922 HydrophobicContact CD2-CG 3.9Å
864	P	97.1	Very high	95.9	Very high	66 Å²	66	52.2 Å²	52.2	43%	0.429	26%	0.26	S	S	.	.	H	α-helix	trans	-60.5	-34.6	-171.4	22.6	-34.1	0	0	0	113.4	H860 K862 S867 S868	H860-P864 WeakPolarHBondContact O-CA 3.5Å; H860-P864 WeakPolarHBondContact O-CB 3.34Å; K862-P864 VanDerWaalsContact C-CD 3.46Å; P864-S867 PolarHBondContact O-N 3.47Å; P864-S868 WeakPolarHBondContact O-CB 3.26Å; P864-S868 PolarHBondContact O-N 2.86Å; P864-S868 PolarHBondContact O-OG 3.17Å
865	R	97.2	Very high	95.6	Very high	168 Å²	168	53 Å²	53	63%	0.634	26%	0.263	S	S	*	.	H	α-helix	trans	-61.2	-48.5	174.6	-68	176.7	67.3	-165.8	-1.8	111.1	L863 S868 H869 L929	L863-R865 VanDerWaalsContact C-N 3.28Å; L863-R865 PolarHBondContact O-N 3.33Å; R865-S868 PolarHBondContact O-N 3.46Å; R865-H869 WeakPolarHBondContact O-CB 3.31Å; R865-H869 PolarHBondContact O-N 3.5Å; R865-L929 HydrophobicContact CB-CD1 4.2Å; R865-L929 HydrophobicContact CB-CD2 4.32Å
866	L	96.4	Very high	95.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-42.3	178.8	-175.1	61.4	0	0	0	111.6	L863 S868 H869 L870 L921 Q925 L928 L929 F937	L863-L866 HydrophobicContact CB-CB 4.05Å; L863-L866 HydrophobicContact CD1-CD2 4.12Å; L863-L866 PolarHBondContact O-N 3.27Å; L866-S868 VanDerWaalsContact C-N 3.3Å; L866-S868 PolarHBondContact O-N 3.5Å; L866-H869 WeakPolarHBondContact O-CB 3.49Å; L866-H869 PolarHBondContact O-N 2.96Å; L866-L870 HydrophobicContact CG-CD1 4.2Å; L866-L870 WeakPolarHBondContact O-CB 3.32Å; L866-L870 VanDerWaalsContact O-CG 3.28Å; L866-L870 WeakPolarHBondContact O-CG 3.46Å; L866-L870 PolarHBondContact O-N 2.96Å; L866-L921 HydrophobicContact CD2-CB 4.04Å; L866-L921 HydrophobicContact CD2-CD2 4.36Å; L866-Q925 HydrophobicContact CB-CG 4.31Å; L866-L928 HydrophobicContact CD1-CB 3.82Å; L866-L928 HydrophobicContact CD1-CD1 4.39Å; L866-L928 HydrophobicContact CD2-CD1 4.25Å; L866-L929 HydrophobicContact CD1-CD2 4.42Å; L866-F937 HydrophobicContact CD1-CE2 4.12Å
867	S	96	Very high	95.1	Very high	11 Å²	11	54 Å²	54	8%	0.077	27%	0.272	C	S	.	.	H	α-helix	trans	-57.3	-42.9	174.6	-177.4	0	0	0	0	112.2	H860 L863 P864 L870 K871	H860-S867 PolarHBondContact ND1-OG 3.32Å; H860-S867 VanDerWaalsContact ND1-OG 3.16Å; L863-S867 PolarHBondContact O-N 2.79Å; P864-S867 PolarHBondContact O-N 3.47Å; S867-L870 PolarHBondContact O-N 3.33Å; S867-K871 WeakPolarHBondContact O-CG 3.23Å; S867-K871 PolarHBondContact O-N 3.41Å; S867-K871 VanDerWaalsContact O-N 3.08Å
868	S	96.6	Very high	94.9	Very high	68 Å²	68	52.2 Å²	52.2	48%	0.476	27%	0.265	S	S	.	.	H	α-helix	trans	-68.1	-38.5	177.7	-57	0	0	0	0	111.8	P864 R865 L866 K871 R872	P864-S868 WeakPolarHBondContact O-CB 3.26Å; P864-S868 PolarHBondContact O-N 2.86Å; P864-S868 PolarHBondContact O-OG 3.17Å; R865-S868 PolarHBondContact O-N 3.46Å; L866-S868 VanDerWaalsContact C-N 3.3Å; L866-S868 PolarHBondContact O-N 3.5Å; S868-K871 PolarHBondContact O-N 3.43Å; S868-R872 WeakPolarHBondContact O-CB 3.27Å; S868-R872 PolarHBondContact O-N 2.91Å
869	H	96.4	Very high	94.5	Very high	16 Å²	16	56 Å²	56	7%	0.074	30%	0.297	C	S	.	.	H	α-helix	trans	-64	-45.4	175.1	-172	74.9	0	0	0	112.5	R865 L866 K871 R872 L873 L928 L929 Q931	R865-H869 WeakPolarHBondContact O-CB 3.31Å; R865-H869 PolarHBondContact O-N 3.5Å; L866-H869 WeakPolarHBondContact O-CB 3.49Å; L866-H869 PolarHBondContact O-N 2.96Å; H869-K871 PolarHBondContact O-N 3.06Å; H869-R872 PolarHBondContact CE1-NH2 3.49Å; H869-R872 PolarHBondContact ND1-NH2 2.84Å; H869-R872 WeakPolarHBondContact O-CB 3.49Å; H869-R872 PolarHBondContact O-N 3.44Å; H869-L873 WeakPolarHBondContact O-CG 3.22Å; H869-L873 PolarHBondContact O-N 3.34Å; H869-L928 PolarHBondContact NE2-O 2.83Å; H869-L928 VanDerWaalsContact NE2-O 3.13Å; H869-L929 HydrophobicContact CB-CD2 3.71Å; H869-L929 PolarHBondContact CE1-O 3.27Å; H869-L929 PolarHBondContact NE2-O 3.26Å; H869-Q931 PolarHBondContact CE1-O 3.17Å; H869-Q931 PolarHBondContact NE2-O 3.34Å
870	L	95.1	Very high	94.1	Very high	10 Å²	10	57 Å²	57	5%	0.052	30%	0.303	C	S	.	.	H	α-helix	trans	-56.4	-48.2	173.9	-74.9	166.2	0	0	0	111.5	L866 S867 R872 L873 G874 I875 I877 F937	L866-L870 HydrophobicContact CG-CD1 4.2Å; L866-L870 WeakPolarHBondContact O-CB 3.32Å; L866-L870 VanDerWaalsContact O-CG 3.28Å; L866-L870 WeakPolarHBondContact O-CG 3.46Å; L866-L870 PolarHBondContact O-N 2.96Å; S867-L870 PolarHBondContact O-N 3.33Å; L870-R872 PolarHBondContact O-N 3.34Å; L870-L873 PolarHBondContact O-N 2.83Å; L870-G874 PolarHBondContact O-N 3.41Å; L870-I875 HydrophobicContact CD2-CB 3.8Å; L870-I875 HydrophobicContact CD2-CG2 3.54Å; L870-I875 PolarHBondContact O-N 3.34Å; L870-I877 HydrophobicContact CD1-CG2 3.49Å; L870-I877 VanDerWaalsContact CD1-CG2 3.49Å; L870-I877 HydrophobicContact CD2-CG2 3.51Å; L870-I877 HydrophobicContact CG-CG2 4.13Å; L870-F937 HydrophobicContact CD2-CE1 3.64Å; L870-F937 HydrophobicContact CD2-CE2 3.91Å; L870-F937 HydrophobicContact CD2-CZ 3.29Å; L870-F937 HydrophobicContact CG-CZ 4.26Å
871	K	94	Very high	94	Very high	143 Å²	143	52.8 Å²	52.8	62%	0.622	28%	0.283	S	S	*	.	H	α-helix	trans	-59.8	-43.7	175.7	-72.7	176.3	-177	178.6	0	112	S867 S868 H869 L873 G874	S867-K871 WeakPolarHBondContact O-CG 3.23Å; S867-K871 PolarHBondContact O-N 3.41Å; S867-K871 VanDerWaalsContact O-N 3.08Å; S868-K871 PolarHBondContact O-N 3.43Å; H869-K871 PolarHBondContact O-N 3.06Å; K871-L873 VanDerWaalsContact C-N 3.31Å; K871-L873 PolarHBondContact O-N 2.94Å; K871-G874 PolarHBondContact O-N 2.83Å; K871-G874 VanDerWaalsContact O-N 3.11Å
872	R	94.2	Very high	93.9	Very high	159 Å²	159	50.2 Å²	50.2	60%	0.6	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-36.2	178.7	-174	179.6	62.5	74.5	0.1	112.5	S868 H869 L870 G874	S868-R872 WeakPolarHBondContact O-CB 3.27Å; S868-R872 PolarHBondContact O-N 2.91Å; H869-R872 PolarHBondContact CE1-NH2 3.49Å; H869-R872 PolarHBondContact ND1-NH2 2.84Å; H869-R872 WeakPolarHBondContact O-CB 3.49Å; H869-R872 PolarHBondContact O-N 3.44Å; L870-R872 PolarHBondContact O-N 3.34Å; R872-G874 VanDerWaalsContact C-N 3.32Å
873	L	91.5	Very high	93.7	Very high	25 Å²	25	51 Å²	51	13%	0.131	28%	0.28	C	S	.	.	H	α-helix	trans	-83.8	-4.9	176.6	-64.1	-179.2	0	0	0	113.4	H869 L870 K871 I875 S932 T934 F937	H869-L873 WeakPolarHBondContact O-CG 3.22Å; H869-L873 PolarHBondContact O-N 3.34Å; L870-L873 PolarHBondContact O-N 2.83Å; K871-L873 VanDerWaalsContact C-N 3.31Å; K871-L873 PolarHBondContact O-N 2.94Å; L873-I875 HydrophobicContact CB-CD1 3.64Å; L873-I875 HydrophobicContact CB-CG1 3.66Å; L873-I875 HydrophobicContact CD1-CD1 3.72Å; L873-I875 HydrophobicContact CG-CD1 4.34Å; L873-I875 PolarHBondContact O-N 3.2Å; L873-S932 WeakPolarHBondContact CD2-O 3.4Å; L873-T934 HydrophobicContact CB-CG2 4.31Å; L873-T934 WeakPolarHBondContact O-CG2 3.36Å; L873-F937 HydrophobicContact CD1-CB 4.48Å; L873-F937 HydrophobicContact CD1-CD2 4.39Å
874	G	91	Very high	93.6	Very high	68 Å²	68	51.1 Å²	51.1	70%	0.701	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	26.7	-174.6	0	0	0	0	0	113.3	L870 K871 R872	L870-G874 PolarHBondContact O-N 3.41Å; K871-G874 PolarHBondContact O-N 2.83Å; K871-G874 VanDerWaalsContact O-N 3.11Å; R872-G874 VanDerWaalsContact C-N 3.32Å
875	I	91.6	Very high	93.5	Very high	15 Å²	15	48 Å²	48	8%	0.077	26%	0.259	C	S	.	.			trans	-91.5	122.4	-176	-63.9	178.3	0	0	0	109.7	L870 L873 T934 F937 W938	L870-I875 HydrophobicContact CD2-CB 3.8Å; L870-I875 HydrophobicContact CD2-CG2 3.54Å; L870-I875 PolarHBondContact O-N 3.34Å; L873-I875 HydrophobicContact CB-CD1 3.64Å; L873-I875 HydrophobicContact CB-CG1 3.66Å; L873-I875 HydrophobicContact CD1-CD1 3.72Å; L873-I875 HydrophobicContact CG-CD1 4.34Å; L873-I875 PolarHBondContact O-N 3.2Å; I875-T934 HydrophobicContact CD1-CG2 4.11Å; I875-T934 HydrophobicContact CG1-CG2 3.81Å; I875-F937 HydrophobicContact CD1-CB 3.63Å; I875-F937 HydrophobicContact CD1-CD1 3.45Å; I875-F937 VanDerWaalsContact CD1-CD1 3.45Å; I875-F937 HydrophobicContact CD1-CD2 4.15Å; I875-F937 HydrophobicContact CD1-CE1 4.18Å; I875-F937 HydrophobicContact CD1-CG 3.46Å; I875-F937 VanDerWaalsContact CD1-CG 3.46Å; I875-F937 HydrophobicContact CG2-CD1 4.1Å; I875-F937 HydrophobicContact CG2-CE1 4.01Å; I875-W938 HydrophobicContact CG2-CH2 3.73Å; I875-W938 HydrophobicContact CG2-CZ2 3.43Å; I875-W938 VanDerWaalsContact CG2-CZ2 3.43Å; I875-W938 HydrophobicContact CG2-CZ3 4.44Å
876	D	92	Very high	93.3	Very high	77 Å²	77	40.9 Å²	40.9	41%	0.412	23%	0.234	S	C	.	.			trans	-96.8	105.8	167.8	-170.1	-14.4	0	0	0	110.7	K856 S878 A879 W938	K856-D876 WeakPolarHBondContact CE-OD1 3.28Å; K856-D876 IonicContact NZ-OD1 3.6Å; K856-D876 PolarHBondContact NZ-OD1 2.77Å; K856-D876 IonicContact NZ-OD2 3.19Å; K856-D876 PolarHBondContact NZ-OD2 3.15Å; D876-S878 PolarHBondContact O-N 2.96Å; D876-S878 VanDerWaalsContact O-N 3.11Å; D876-S878 WeakPolarHBondContact OD1-CB 3.47Å; D876-S878 PolarHBondContact OD1-N 2.84Å; D876-S878 PolarHBondContact OD1-OG 2.91Å; D876-S878 VanDerWaalsContact OD1-OG 3.05Å; D876-A879 WeakPolarHBondContact O-CB 3.49Å; D876-A879 PolarHBondContact O-N 2.99Å; D876-A879 VanDerWaalsContact O-N 3.14Å; D876-W938 VanDerWaalsContact O-CH2 3.31Å; D876-W938 WeakPolarHBondContact O-CH2 3.35Å
877	I	92.6	Very high	93.1	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.031	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.3	178.6	59.6	171.8	0	0	0	113.8	K856 V859 L870 A879 V880 T881 L921	K856-I877 HydrophobicContact CG-CD1 4.3Å; K856-I877 HydrophobicContact CG-CG1 4.23Å; V859-I877 HydrophobicContact CG2-CD1 4.14Å; L870-I877 HydrophobicContact CD1-CG2 3.49Å; L870-I877 VanDerWaalsContact CD1-CG2 3.49Å; L870-I877 HydrophobicContact CD2-CG2 3.51Å; L870-I877 HydrophobicContact CG-CG2 4.13Å; I877-A879 PolarHBondContact O-N 3.38Å; I877-V880 PolarHBondContact O-N 2.85Å; I877-T881 HydrophobicContact CB-CG2 4.34Å; I877-T881 PolarHBondContact O-N 3.19Å; I877-T881 PolarHBondContact O-OG1 3.41Å; I877-L921 HydrophobicContact CD1-CD1 4.47Å
878	S	92	Very high	93.1	Very high	18 Å²	18	40.4 Å²	40.4	13%	0.126	23%	0.23	C	C	.	.	H	α-helix	trans	-58.2	-22	177.2	-57.2	0	0	0	0	112.9	Q852 K856 D876 V880 T881 L882	Q852-S878 WeakPolarHBondContact CB-OG 3.32Å; K856-S878 WeakPolarHBondContact CE-OG 3.33Å; K856-S878 PolarHBondContact NZ-OG 3.35Å; D876-S878 PolarHBondContact O-N 2.96Å; D876-S878 VanDerWaalsContact O-N 3.11Å; D876-S878 WeakPolarHBondContact OD1-CB 3.47Å; D876-S878 PolarHBondContact OD1-N 2.84Å; D876-S878 PolarHBondContact OD1-OG 2.91Å; D876-S878 VanDerWaalsContact OD1-OG 3.05Å; S878-V880 PolarHBondContact O-N 3.4Å; S878-T881 WeakPolarHBondContact CA-OG1 3.48Å; S878-L882 WeakPolarHBondContact O-CB 3.43Å; S878-L882 PolarHBondContact O-N 3.44Å
879	A	89.1	Confident	93.1	Very high	80 Å²	80	37.1 Å²	37.1	66%	0.661	21%	0.208	S	C	*	.	H	α-helix	trans	-61.1	-22.2	174.1	0	0	0	0	0	113.5	D876 I877 W938	D876-A879 WeakPolarHBondContact O-CB 3.49Å; D876-A879 PolarHBondContact O-N 2.99Å; D876-A879 VanDerWaalsContact O-N 3.14Å; I877-A879 PolarHBondContact O-N 3.38Å; A879-W938 HydrophobicContact CB-CH2 3.91Å; A879-W938 HydrophobicContact CB-CZ2 4.15Å
880	V	88	Confident	92.9	Very high	23 Å²	23	37.4 Å²	37.4	14%	0.139	21%	0.208	C	C	.	.	H	α-helix	trans	-118.3	-43	178.6	173.2	0	0	0	0	111.2	I877 S878 L882 N883 W884 W938	I877-V880 PolarHBondContact O-N 2.85Å; S878-V880 PolarHBondContact O-N 3.4Å; V880-L882 PolarHBondContact O-N 3.08Å; V880-N883 PolarHBondContact O-N 2.88Å; V880-W884 HydrophobicContact CG1-CZ2 3.66Å; V880-W884 PolarHBondContact O-N 3.16Å; V880-W938 HydrophobicContact CB-CZ3 4Å; V880-W938 HydrophobicContact CG2-CE3 3.75Å; V880-W938 HydrophobicContact CG2-CH2 4.12Å; V880-W938 HydrophobicContact CG2-CZ3 3.34Å
881	T	94.3	Very high	92.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-70.2	-18	-175.4	57.2	0	0	0	0	113.5	Q852 L855 I877 S878 W884 F885	Q852-T881 PolarHBondContact OE1-OG1 2.97Å; L855-T881 HydrophobicContact CD2-CG2 3.96Å; I877-T881 HydrophobicContact CB-CG2 4.34Å; I877-T881 PolarHBondContact O-N 3.19Å; I877-T881 PolarHBondContact O-OG1 3.41Å; S878-T881 WeakPolarHBondContact CA-OG1 3.48Å; T881-W884 HydrophobicContact CG2-CD2 4.16Å; T881-W884 HydrophobicContact CG2-CE3 3.73Å; T881-W884 HydrophobicContact CG2-CH2 4.02Å; T881-W884 HydrophobicContact CG2-CZ2 4.4Å; T881-W884 HydrophobicContact CG2-CZ3 3.68Å; T881-W884 WeakPolarHBondContact O-CB 3.48Å; T881-W884 PolarHBondContact O-N 2.9Å; T881-F885 PolarHBondContact O-N 3.31Å
882	L	93.7	Very high	92.2	Very high	45 Å²	45	35.7 Å²	35.7	24%	0.236	21%	0.207	C	C	.	.	H	α-helix	trans	-62.4	-46.1	171.8	-179.3	64.3	0	0	0	111.2	A848 Q852 S878 V880 W884 F885 L886	A848-L882 HydrophobicContact CB-CD1 3.71Å; Q852-L882 HydrophobicContact CG-CB 4.16Å; Q852-L882 HydrophobicContact CG-CD1 3.89Å; S878-L882 WeakPolarHBondContact O-CB 3.43Å; S878-L882 PolarHBondContact O-N 3.44Å; V880-L882 PolarHBondContact O-N 3.08Å; L882-W884 VanDerWaalsContact C-N 3.29Å; L882-W884 PolarHBondContact O-N 3.5Å; L882-F885 PolarHBondContact O-N 3Å; L882-L886 HydrophobicContact CD1-CD1 4.17Å; L882-L886 HydrophobicContact CD1-CG 4.25Å; L882-L886 HydrophobicContact CD2-CD1 4.44Å; L882-L886 HydrophobicContact CG-CD1 3.87Å; L882-L886 HydrophobicContact CG-CG 4.35Å; L882-L886 WeakPolarHBondContact O-CG 3.44Å; L882-L886 PolarHBondContact O-N 3.35Å
883	N	91.4	Very high	92.1	Very high	71 Å²	71	28.8 Å²	28.8	38%	0.38	18%	0.182	S	C	.	.	H	α-helix	trans	-66.4	-33.6	178.1	-171.7	60.9	0	0	0	111.9	V880 F885 A887	V880-N883 PolarHBondContact O-N 2.88Å; N883-F885 PolarHBondContact O-N 3.18Å; N883-A887 WeakPolarHBondContact O-CB 3.04Å; N883-A887 PolarHBondContact O-N 3.27Å
884	W	95.1	Very high	91.9	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-37	174.5	-60.8	-1.6	0	0	0	111.6	V880 T881 L882 V888 F889 S892 A917 I920 L941 T945	V880-W884 HydrophobicContact CG1-CZ2 3.66Å; V880-W884 PolarHBondContact O-N 3.16Å; T881-W884 HydrophobicContact CG2-CD2 4.16Å; T881-W884 HydrophobicContact CG2-CE3 3.73Å; T881-W884 HydrophobicContact CG2-CH2 4.02Å; T881-W884 HydrophobicContact CG2-CZ2 4.4Å; T881-W884 HydrophobicContact CG2-CZ3 3.68Å; T881-W884 WeakPolarHBondContact O-CB 3.48Å; T881-W884 PolarHBondContact O-N 2.9Å; L882-W884 VanDerWaalsContact C-N 3.29Å; L882-W884 PolarHBondContact O-N 3.5Å; W884-V888 CarbonylContact O-C 3.17Å; W884-V888 WeakPolarHBondContact O-CA 3.24Å; W884-V888 PolarHBondContact O-N 3.16Å; W884-F889 HydrophobicContact CB-CD1 3.94Å; W884-F889 HydrophobicContact CB-CE1 3.79Å; W884-F889 HydrophobicContact CB-CG 4.45Å; W884-F889 HydrophobicContact CB-CZ 4.17Å; W884-F889 HydrophobicContact CD2-CD1 4.34Å; W884-F889 AromaticContact CD2-CE1 3.82Å; W884-F889 HydrophobicContact CD2-CE1 3.82Å; W884-F889 HydrophobicContact CE3-CD1 4.49Å; W884-F889 AromaticContact CE3-CE1 3.55Å; W884-F889 HydrophobicContact CE3-CE1 3.55Å; W884-F889 HydrophobicContact CE3-CZ 4.11Å; W884-F889 HydrophobicContact CG-CD1 4.12Å; W884-F889 AromaticContact CG-CE1 3.95Å; W884-F889 HydrophobicContact CG-CE1 3.95Å; W884-F889 HydrophobicContact CZ3-CE1 4.41Å; W884-F889 PolarHBondContact O-N 3.45Å; W884-S892 VanDerWaalsContact CD1-CB 3.48Å; W884-A917 HydrophobicContact CE3-CB 4.03Å; W884-A917 HydrophobicContact CZ3-CB 4.14Å; W884-I920 HydrophobicContact CH2-CG2 4.26Å; W884-L941 HydrophobicContact CH2-CD1 4.25Å; W884-T945 HydrophobicContact CH2-CG2 3.57Å; W884-T945 HydrophobicContact CZ2-CG2 3.21Å
885	F	95.7	Very high	91.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-84.2	-44.3	-178	-72.3	13.7	0	0	0	111.3	Y840 D851 L855 T881 L882 N883 A887 V888 F889 L913 F914 A917	Y840-F885 HydrophobicContact CE1-CB 4.37Å; Y840-F885 WeakPolarHBondContact OH-CB 3.22Å; Y840-F885 WeakPolarHBondContact OH-CD2 3.21Å; D851-F885 HydrophobicContact CB-CD2 3.98Å; D851-F885 HydrophobicContact CB-CE2 4.14Å; L855-F885 HydrophobicContact CD1-CZ 4.35Å; L855-F885 HydrophobicContact CD2-CE1 4.48Å; L855-F885 HydrophobicContact CD2-CZ 3.98Å; T881-F885 PolarHBondContact O-N 3.31Å; L882-F885 PolarHBondContact O-N 3Å; N883-F885 PolarHBondContact O-N 3.18Å; F885-A887 VanDerWaalsContact C-N 3.26Å; F885-A887 PolarHBondContact O-N 3.1Å; F885-V888 PolarHBondContact O-N 3.49Å; F885-F889 HydrophobicContact CE1-CZ 4.44Å; F885-L913 HydrophobicContact CB-CD1 4.39Å; F885-L913 HydrophobicContact CD1-CB 3.93Å; F885-L913 HydrophobicContact CE1-CB 3.73Å; F885-L913 WeakPolarHBondContact CE1-O 3.25Å; F885-L913 HydrophobicContact CE2-CB 4.37Å; F885-L913 HydrophobicContact CG-CB 4.34Å; F885-L913 HydrophobicContact CG-CD1 4.3Å; F885-L913 HydrophobicContact CZ-CB 3.96Å; F885-F914 HydrophobicContact CE2-CD1 4.02Å; F885-F914 AromaticContact CE2-CE1 3.85Å; F885-F914 HydrophobicContact CE2-CE1 3.85Å; F885-F914 HydrophobicContact CE2-CG 4.48Å; F885-F914 HydrophobicContact CE2-CZ 4.18Å; F885-F914 HydrophobicContact CZ-CD1 4.05Å; F885-F914 HydrophobicContact CZ-CE1 4.36Å; F885-F914 HydrophobicContact CZ-CG 4.33Å; F885-A917 HydrophobicContact CE1-CB 3.87Å; F885-A917 HydrophobicContact CZ-CB 4.22Å
886	L	93	Very high	91.6	Very high	19 Å²	19	29.3 Å²	29.3	10%	0.099	17%	0.167	C	C	.	.	H	α-helix	trans	-59.5	-36.7	178.3	-69.8	175.2	0	0	0	112.6	I811 Y840 F841 L845 A848 L882	I811-L886 WeakPolarHBondContact CD1-O 3.3Å; Y840-L886 HydrophobicContact CD1-CD2 3.84Å; Y840-L886 HydrophobicContact CE1-CD2 3.94Å; F841-L886 HydrophobicContact CD1-CD2 4.31Å; F841-L886 HydrophobicContact CE1-CB 4.49Å; F841-L886 HydrophobicContact CE1-CD2 3.83Å; F841-L886 HydrophobicContact CZ-CD2 3.99Å; F841-L886 WeakPolarHBondContact CZ-O 3.3Å; L845-L886 HydrophobicContact CD1-CD1 4.17Å; L845-L886 HydrophobicContact CD2-CD2 4.4Å; A848-L886 HydrophobicContact CB-CD2 3.9Å; L882-L886 HydrophobicContact CD1-CD1 4.17Å; L882-L886 HydrophobicContact CD1-CG 4.25Å; L882-L886 HydrophobicContact CD2-CD1 4.44Å; L882-L886 HydrophobicContact CG-CD1 3.87Å; L882-L886 HydrophobicContact CG-CG 4.35Å; L882-L886 WeakPolarHBondContact O-CG 3.44Å; L882-L886 PolarHBondContact O-N 3.35Å
887	A	92.8	Very high	91.6	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.008	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	8.8	-179.7	0	0	0	0	0	113.3	F810 N883 F885 F889 Y890	F810-A887 HydrophobicContact CD2-CB 4.48Å; N883-A887 WeakPolarHBondContact O-CB 3.04Å; N883-A887 PolarHBondContact O-N 3.27Å; F885-A887 VanDerWaalsContact C-N 3.26Å; F885-A887 PolarHBondContact O-N 3.1Å; A887-F889 PolarHBondContact O-N 3.06Å; A887-Y890 VanDerWaalsContact O-CB 3.24Å; A887-Y890 WeakPolarHBondContact O-CB 3.39Å; A887-Y890 PolarHBondContact O-N 3.16Å
888	V	95.8	Very high	91.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	50.8	-176.5	-165.8	0	0	0	0	110.9	I811 I831 W884 F885 Y890 L898 W902 F905 L913	I811-V888 HydrophobicContact CD1-CG2 4.27Å; I811-V888 HydrophobicContact CG1-CG2 4.29Å; I831-V888 HydrophobicContact CG2-CG2 4.29Å; W884-V888 CarbonylContact O-C 3.17Å; W884-V888 WeakPolarHBondContact O-CA 3.24Å; W884-V888 PolarHBondContact O-N 3.16Å; F885-V888 PolarHBondContact O-N 3.49Å; V888-Y890 VanDerWaalsContact C-N 3.26Å; V888-Y890 PolarHBondContact O-N 2.96Å; V888-L898 WeakPolarHBondContact O-CD1 3.38Å; V888-W902 HydrophobicContact CB-CZ2 4.17Å; V888-W902 HydrophobicContact CG1-CZ2 4.43Å; V888-W902 PolarHBondContact O-NE1 3.04Å; V888-W902 VanDerWaalsContact O-NE1 3.11Å; V888-F905 HydrophobicContact CG1-CD1 3.79Å; V888-F905 HydrophobicContact CG1-CD2 4.45Å; V888-F905 HydrophobicContact CG1-CE1 3.9Å; V888-F905 HydrophobicContact CG1-CG 4.08Å; V888-F905 HydrophobicContact CG1-CZ 4.32Å; V888-F905 HydrophobicContact CG2-CE1 4.31Å; V888-F905 HydrophobicContact CG2-CZ 4.37Å; V888-L913 HydrophobicContact CG1-CD2 4.06Å
889	F	95.7	Very high	91.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	3.9	-177.3	-71.9	-88.4	0	0	0	117.2	W884 F885 A887 D891 S892 V893 L898 I901 L913 F916 A917 I920	W884-F889 HydrophobicContact CB-CD1 3.94Å; W884-F889 HydrophobicContact CB-CE1 3.79Å; W884-F889 HydrophobicContact CB-CG 4.45Å; W884-F889 HydrophobicContact CB-CZ 4.17Å; W884-F889 HydrophobicContact CD2-CD1 4.34Å; W884-F889 AromaticContact CD2-CE1 3.82Å; W884-F889 HydrophobicContact CD2-CE1 3.82Å; W884-F889 HydrophobicContact CE3-CD1 4.49Å; W884-F889 AromaticContact CE3-CE1 3.55Å; W884-F889 HydrophobicContact CE3-CE1 3.55Å; W884-F889 HydrophobicContact CE3-CZ 4.11Å; W884-F889 HydrophobicContact CG-CD1 4.12Å; W884-F889 AromaticContact CG-CE1 3.95Å; W884-F889 HydrophobicContact CG-CE1 3.95Å; W884-F889 HydrophobicContact CZ3-CE1 4.41Å; W884-F889 PolarHBondContact O-N 3.45Å; F885-F889 HydrophobicContact CE1-CZ 4.44Å; A887-F889 PolarHBondContact O-N 3.06Å; F889-D891 PolarHBondContact O-N 3.12Å; F889-S892 WeakPolarHBondContact O-CB 3.47Å; F889-S892 PolarHBondContact O-N 2.94Å; F889-S892 VanDerWaalsContact O-N 3.12Å; F889-V893 HydrophobicContact CB-CG2 4.08Å; F889-V893 HydrophobicContact CD1-CG1 4.11Å; F889-L898 VanDerWaalsContact C-CD1 3.48Å; F889-L898 HydrophobicContact CB-CD1 4.03Å; F889-I901 HydrophobicContact CB-CD1 4.05Å; F889-I901 HydrophobicContact CD1-CD1 4.39Å; F889-I901 HydrophobicContact CD2-CD1 4.17Å; F889-I901 HydrophobicContact CD2-CG2 4.01Å; F889-I901 HydrophobicContact CG-CD1 3.96Å; F889-L913 HydrophobicContact CD2-CD2 4.03Å; F889-L913 HydrophobicContact CE2-CB 4.46Å; F889-L913 HydrophobicContact CE2-CD2 3.91Å; F889-F916 HydrophobicContact CE2-CB 4.02Å; F889-F916 HydrophobicContact CZ-CB 3.92Å; F889-A917 HydrophobicContact CZ-CB 4.16Å; F889-I920 HydrophobicContact CD1-CD1 4.25Å; F889-I920 HydrophobicContact CE1-CD1 3.69Å
890	Y	93	Very high	92.2	Very high	21 Å²	21	21.9 Å²	21.9	8%	0.082	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	141.1	174.7	177.5	-89.6	0	0	0	111.3	M771 F810 V814 A887 V888 S892 L898	M771-Y890 HydrophobicContact CE-CD2 3.83Å; M771-Y890 HydrophobicContact CE-CE2 3.29Å; M771-Y890 HydrophobicContact CG-CE2 3.75Å; M771-Y890 WeakPolarHBondContact CG-OH 3.43Å; M771-Y890 HydrophobicContact SD-CE2 4.35Å; F810-Y890 HydrophobicContact CB-CD1 3.54Å; F810-Y890 HydrophobicContact CB-CE1 4.11Å; F810-Y890 HydrophobicContact CB-CG 3.96Å; F810-Y890 AromaticContact CD1-CD1 3.43Å; F810-Y890 HydrophobicContact CD1-CD1 3.43Å; F810-Y890 VanDerWaalsContact CD1-CD1 3.43Å; F810-Y890 AromaticContact CD1-CE1 3.11Å; F810-Y890 HydrophobicContact CD1-CE1 3.11Å; F810-Y890 HydrophobicContact CD1-CG 4.48Å; F810-Y890 AromaticContact CD1-CZ 3.98Å; F810-Y890 HydrophobicContact CD2-CD1 4.25Å; F810-Y890 HydrophobicContact CE1-CD1 4.15Å; F810-Y890 AromaticContact CE1-CE1 3.57Å; F810-Y890 HydrophobicContact CE1-CE1 3.57Å; F810-Y890 AromaticContact CG-CD1 3.48Å; F810-Y890 HydrophobicContact CG-CD1 3.48Å; F810-Y890 VanDerWaalsContact CG-CD1 3.48Å; F810-Y890 AromaticContact CG-CE1 3.72Å; F810-Y890 HydrophobicContact CG-CE1 3.72Å; F810-Y890 HydrophobicContact CG-CG 4.39Å; F810-Y890 HydrophobicContact CZ-CE1 4.46Å; V814-Y890 HydrophobicContact CG2-CD2 3.64Å; V814-Y890 HydrophobicContact CG2-CE2 4.36Å; V814-Y890 HydrophobicContact CG2-CG 4.34Å; A887-Y890 VanDerWaalsContact O-CB 3.24Å; A887-Y890 WeakPolarHBondContact O-CB 3.39Å; A887-Y890 PolarHBondContact O-N 3.16Å; V888-Y890 VanDerWaalsContact C-N 3.26Å; V888-Y890 PolarHBondContact O-N 2.96Å; Y890-S892 PolarHBondContact O-N 3.45Å; Y890-S892 PolarHBondContact O-OG 3.32Å; Y890-L898 HydrophobicContact CD2-CD2 3.74Å; Y890-L898 HydrophobicContact CG-CD2 4.45Å
891	D	85.5	Confident	92.6	Very high	110 Å²	110	20.9 Å²	20.9	59%	0.588	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	7.7	-175.1	-160.6	38.6	0	0	0	115.8	F889	F889-D891 PolarHBondContact O-N 3.12Å
892	S	88.3	Confident	92.8	Very high	8 Å²	8	20.9 Å²	20.9	6%	0.056	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-31.6	179.1	-53.2	0	0	0	0	112.2	W884 F889 Y890 T945	W884-S892 VanDerWaalsContact CD1-CB 3.48Å; F889-S892 WeakPolarHBondContact O-CB 3.47Å; F889-S892 PolarHBondContact O-N 2.94Å; F889-S892 VanDerWaalsContact O-N 3.12Å; Y890-S892 PolarHBondContact O-N 3.45Å; Y890-S892 PolarHBondContact O-OG 3.32Å; S892-T945 CarbonylContact O-C 3.6Å; S892-T945 VanDerWaalsContact O-C 3.24Å; S892-T945 VanDerWaalsContact O-CB 3.31Å; S892-T945 WeakPolarHBondContact O-CB 3.47Å
893	V	91.5	Very high	92.9	Very high	13 Å²	13	18.7 Å²	18.7	8%	0.079	10%	0.095	C	C	.	.	S	Bend	trans	-129	162.2	-178.8	-60	0	0	0	0	110.4	F889 T897 L898 I901 I920 T948	F889-V893 HydrophobicContact CB-CG2 4.08Å; F889-V893 HydrophobicContact CD1-CG1 4.11Å; V893-T897 HydrophobicContact CB-CG2 4.19Å; V893-T897 HydrophobicContact CG2-CG2 4.2Å; V893-L898 HydrophobicContact CG2-CB 4.06Å; V893-I901 HydrophobicContact CG2-CD1 4.2Å; V893-I920 HydrophobicContact CG1-CD1 4.07Å; V893-T948 WeakPolarHBondContact CB-OG1 3.48Å; V893-T948 WeakPolarHBondContact CG1-OG1 3.22Å
894	P	87.9	Confident	93.1	Very high	24 Å²	24	15.3 Å²	15.3	16%	0.156	8%	0.077	C	C	.	.			trans	-52.7	148.1	170.9	-25.9	35.2	0	0	0	112.3	E896 T897 L898 R946 T948 N949	P894-E896 VanDerWaalsContact C-N 3.32Å; P894-E896 PolarHBondContact O-N 3.48Å; P894-T897 WeakPolarHBondContact O-CA 3.34Å; P894-T897 VanDerWaalsContact O-CB 3.3Å; P894-T897 WeakPolarHBondContact O-CB 3.48Å; P894-T897 PolarHBondContact O-N 3.03Å; P894-L898 PolarHBondContact O-N 3.22Å; P894-R946 WeakPolarHBondContact CG-O 3.37Å; P894-T948 VanDerWaalsContact CD-OG1 3.28Å; P894-T948 WeakPolarHBondContact CD-OG1 3.18Å; P894-N949 WeakPolarHBondContact CB-OD1 3.38Å; P894-N949 WeakPolarHBondContact CG-OD1 3.15Å
895	F	89.9	Confident	93.2	Very high	37 Å²	37	15.1 Å²	15.1	16%	0.162	8%	0.077	C	C	.	.	H	α-helix	trans	-62.1	-37.1	-173.9	-171	-97.6	0	0	0	113.1	Y652 F654 M771 L817 F818 T897 L898 I899	Y652-F895 AromaticContact CD1-CE1 3.74Å; Y652-F895 HydrophobicContact CD1-CE1 3.74Å; Y652-F895 AromaticContact CD2-CD1 3.74Å; Y652-F895 HydrophobicContact CD2-CD1 3.74Å; Y652-F895 AromaticContact CD2-CE1 3.73Å; Y652-F895 HydrophobicContact CD2-CE1 3.73Å; Y652-F895 HydrophobicContact CE1-CE1 4.17Å; Y652-F895 HydrophobicContact CE2-CD1 4.08Å; Y652-F895 HydrophobicContact CE2-CE1 4.16Å; Y652-F895 AromaticContact CG-CD1 3.99Å; Y652-F895 HydrophobicContact CG-CD1 3.99Å; Y652-F895 AromaticContact CG-CE1 3.48Å; Y652-F895 HydrophobicContact CG-CE1 3.48Å; Y652-F895 VanDerWaalsContact CG-CE1 3.48Å; Y652-F895 HydrophobicContact CG-CZ 4.47Å; F654-F895 HydrophobicContact CD2-CD1 4.31Å; F654-F895 HydrophobicContact CD2-CG 4.3Å; F654-F895 HydrophobicContact CE2-CB 4.43Å; F654-F895 AromaticContact CE2-CD1 3.75Å; F654-F895 HydrophobicContact CE2-CD1 3.75Å; F654-F895 AromaticContact CE2-CD2 3.48Å; F654-F895 HydrophobicContact CE2-CD2 3.48Å; F654-F895 VanDerWaalsContact CE2-CD2 3.48Å; F654-F895 AromaticContact CE2-CE1 3.8Å; F654-F895 HydrophobicContact CE2-CE1 3.8Å; F654-F895 AromaticContact CE2-CE2 3.53Å; F654-F895 HydrophobicContact CE2-CE2 3.53Å; F654-F895 AromaticContact CE2-CG 3.6Å; F654-F895 HydrophobicContact CE2-CG 3.6Å; F654-F895 AromaticContact CE2-CZ 3.7Å; F654-F895 HydrophobicContact CE2-CZ 3.7Å; F654-F895 AromaticContact CZ-CD2 3.63Å; F654-F895 HydrophobicContact CZ-CD2 3.63Å; F654-F895 AromaticContact CZ-CE2 3.66Å; F654-F895 HydrophobicContact CZ-CE2 3.66Å; F654-F895 HydrophobicContact CZ-CG 4.18Å; F654-F895 HydrophobicContact CZ-CZ 4.24Å; M771-F895 HydrophobicContact CE-CE2 4.45Å; L817-F895 HydrophobicContact CD1-CE2 3.79Å; L817-F895 HydrophobicContact CD1-CZ 3.49Å; L817-F895 VanDerWaalsContact CD1-CZ 3.49Å; F818-F895 HydrophobicContact CE2-CZ 4.07Å; F818-F895 HydrophobicContact CZ-CE1 4.14Å; F818-F895 HydrophobicContact CZ-CZ 4.11Å; F895-T897 VanDerWaalsContact C-N 3.27Å; F895-T897 PolarHBondContact O-N 3.27Å; F895-L898 HydrophobicContact CD2-CD2 3.88Å; F895-L898 HydrophobicContact CE2-CD2 4Å; F895-L898 WeakPolarHBondContact O-CB 3.34Å; F895-L898 PolarHBondContact O-N 3.16Å; F895-L898 VanDerWaalsContact O-N 3.16Å; F895-I899 HydrophobicContact CD1-CG2 4.08Å; F895-I899 HydrophobicContact CE1-CG2 3.53Å; F895-I899 HydrophobicContact CE2-CG2 4.38Å; F895-I899 HydrophobicContact CZ-CG2 3.7Å; F895-I899 PolarHBondContact O-N 3.4Å
896	E	87.2	Confident	93.3	Very high	58 Å²	58	15.3 Å²	15.3	27%	0.271	8%	0.077	S	C	.	.	H	α-helix	trans	-62	-35.5	173.2	-66.7	-68.5	179.9	0	0	112.1	Y652 P894 I899 R900	Y652-E896 VanDerWaalsContact CE2-OE1 3.23Å; Y652-E896 WeakPolarHBondContact CE2-OE1 3.42Å; Y652-E896 PolarHBondContact OH-OE2 3.13Å; P894-E896 VanDerWaalsContact C-N 3.32Å; P894-E896 PolarHBondContact O-N 3.48Å; E896-I899 VanDerWaalsContact O-CG1 3.23Å; E896-I899 WeakPolarHBondContact O-CG1 3.42Å; E896-I899 VanDerWaalsContact OE2-CD1 3.22Å; E896-I899 WeakPolarHBondContact OE2-CD1 2.81Å; E896-R900 WeakPolarHBondContact O-CG 3.33Å
897	T	92	Very high	93.3	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-70.6	-40.7	174.2	-46.2	0	0	0	0	110.9	V893 P894 F895 R900 I901 T948 V951 L954	V893-T897 HydrophobicContact CB-CG2 4.19Å; V893-T897 HydrophobicContact CG2-CG2 4.2Å; P894-T897 WeakPolarHBondContact O-CA 3.34Å; P894-T897 VanDerWaalsContact O-CB 3.3Å; P894-T897 WeakPolarHBondContact O-CB 3.48Å; P894-T897 PolarHBondContact O-N 3.03Å; F895-T897 VanDerWaalsContact C-N 3.27Å; F895-T897 PolarHBondContact O-N 3.27Å; T897-R900 PolarHBondContact O-N 3.46Å; T897-I901 HydrophobicContact CG2-CD1 4.24Å; T897-I901 WeakPolarHBondContact O-CG1 3.49Å; T897-I901 PolarHBondContact O-N 3.39Å; T897-T948 WeakPolarHBondContact CG2-O 3.13Å; T897-T948 PolarHBondContact OG1-O 3.19Å; T897-V951 HydrophobicContact CG2-CG2 4.19Å; T897-V951 WeakPolarHBondContact OG1-CG2 3.09Å; T897-L954 HydrophobicContact CG2-CD2 3.67Å
898	L	95.4	Very high	93.4	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.01	9%	0.085	C	C	.	.	H	α-helix	trans	-57.7	-52.1	178.4	176.6	68.1	0	0	0	111.8	V814 V888 F889 Y890 V893 P894 F895 R900 I901 W902	V814-L898 HydrophobicContact CG2-CD2 4.01Å; V888-L898 WeakPolarHBondContact O-CD1 3.38Å; F889-L898 VanDerWaalsContact C-CD1 3.48Å; F889-L898 HydrophobicContact CB-CD1 4.03Å; Y890-L898 HydrophobicContact CD2-CD2 3.74Å; Y890-L898 HydrophobicContact CG-CD2 4.45Å; V893-L898 HydrophobicContact CG2-CB 4.06Å; P894-L898 PolarHBondContact O-N 3.22Å; F895-L898 HydrophobicContact CD2-CD2 3.88Å; F895-L898 HydrophobicContact CE2-CD2 4Å; F895-L898 WeakPolarHBondContact O-CB 3.34Å; F895-L898 PolarHBondContact O-N 3.16Å; F895-L898 VanDerWaalsContact O-N 3.16Å; L898-R900 PolarHBondContact O-N 3.46Å; L898-I901 WeakPolarHBondContact O-CB 3.45Å; L898-I901 PolarHBondContact O-N 3.38Å; L898-I901 VanDerWaalsContact O-N 3.15Å; L898-W902 VanDerWaalsContact O-CD1 3.24Å; L898-W902 PolarHBondContact O-N 2.79Å
899	I	95	Very high	93.2	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63.7	-31.1	-177	62	-178.8	0	0	0	112	Y652 F818 F895 E896 W902 D903	Y652-I899 HydrophobicContact CE1-CD1 4.17Å; Y652-I899 HydrophobicContact CE2-CD1 4.47Å; Y652-I899 WeakPolarHBondContact OH-CD1 3.31Å; F818-I899 HydrophobicContact CE2-CG2 3.87Å; F818-I899 HydrophobicContact CZ-CG2 3.78Å; F895-I899 HydrophobicContact CD1-CG2 4.08Å; F895-I899 HydrophobicContact CE1-CG2 3.53Å; F895-I899 HydrophobicContact CE2-CG2 4.38Å; F895-I899 HydrophobicContact CZ-CG2 3.7Å; F895-I899 PolarHBondContact O-N 3.4Å; E896-I899 VanDerWaalsContact O-CG1 3.23Å; E896-I899 WeakPolarHBondContact O-CG1 3.42Å; E896-I899 VanDerWaalsContact OE2-CD1 3.22Å; E896-I899 WeakPolarHBondContact OE2-CD1 2.81Å; I899-W902 WeakPolarHBondContact O-CB 3.31Å; I899-W902 PolarHBondContact O-N 3.42Å; I899-D903 VanDerWaalsContact O-CG 3.28Å; I899-D903 PolarHBondContact O-N 3.37Å
900	R	94.7	Very high	93.1	Very high	24 Å²	24	17.4 Å²	17.4	9%	0.091	9%	0.09	C	C	.	.	H	α-helix	trans	-74.6	-36	177.1	-63.1	-69.4	-66.1	98.4	8.7	111.8	C710 R711 S712 E896 T897 L898 W902 D903 V904 V951	C710-R900 PolarHBondContact O-NH1 2.75Å; R711-R900 VanDerWaalsContact C-NH2 3.34Å; R711-R900 PolarHBondContact O-NH2 2.93Å; S712-R900 PolarHBondContact O-NH2 2.89Å; E896-R900 WeakPolarHBondContact O-CG 3.33Å; T897-R900 PolarHBondContact O-N 3.46Å; L898-R900 PolarHBondContact O-N 3.46Å; R900-W902 VanDerWaalsContact C-N 3.28Å; R900-D903 IonicContact NH1-OD2 3.25Å; R900-D903 PolarHBondContact NH1-OD2 2.94Å; R900-D903 VanDerWaalsContact NH1-OD2 3.15Å; R900-V904 WeakPolarHBondContact O-CG2 3.5Å; R900-V904 PolarHBondContact O-N 2.82Å; R900-V951 HydrophobicContact CB-CG1 3.44Å; R900-V951 VanDerWaalsContact CB-CG1 3.44Å; R900-V951 HydrophobicContact CG-CG1 3.66Å
901	I	97.2	Very high	93.1	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-60.7	-42.8	168.2	-69.4	169.7	0	0	0	109.7	F889 V893 T897 L898 V904 F905 F916	F889-I901 HydrophobicContact CB-CD1 4.05Å; F889-I901 HydrophobicContact CD1-CD1 4.39Å; F889-I901 HydrophobicContact CD2-CD1 4.17Å; F889-I901 HydrophobicContact CD2-CG2 4.01Å; F889-I901 HydrophobicContact CG-CD1 3.96Å; V893-I901 HydrophobicContact CG2-CD1 4.2Å; T897-I901 HydrophobicContact CG2-CD1 4.24Å; T897-I901 WeakPolarHBondContact O-CG1 3.49Å; T897-I901 PolarHBondContact O-N 3.39Å; L898-I901 WeakPolarHBondContact O-CB 3.45Å; L898-I901 PolarHBondContact O-N 3.38Å; L898-I901 VanDerWaalsContact O-N 3.15Å; I901-V904 PolarHBondContact O-N 3.4Å; I901-F905 VanDerWaalsContact O-CB 3.23Å; I901-F905 WeakPolarHBondContact O-CB 3.06Å; I901-F905 PolarHBondContact O-N 2.88Å; I901-F916 HydrophobicContact CB-CD2 4.28Å; I901-F916 HydrophobicContact CB-CE2 4.11Å; I901-F916 HydrophobicContact CB-CZ 4.48Å; I901-F916 HydrophobicContact CD1-CD1 4.49Å; I901-F916 HydrophobicContact CD1-CG 4.3Å; I901-F916 HydrophobicContact CG1-CD1 4.02Å; I901-F916 HydrophobicContact CG1-CD2 3.91Å; I901-F916 HydrophobicContact CG1-CE1 4.05Å; I901-F916 HydrophobicContact CG1-CE2 3.93Å; I901-F916 HydrophobicContact CG1-CG 3.96Å; I901-F916 HydrophobicContact CG1-CZ 4Å; I901-F916 HydrophobicContact CG2-CD2 3.75Å; I901-F916 HydrophobicContact CG2-CE2 3.89Å; I901-F916 HydrophobicContact CG2-CG 4.48Å
902	W	97.6	Very high	93.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-64.9	-42.5	178.6	-84.7	54.8	0	0	0	113.5	W723 I811 V814 I831 V888 L898 I899 R900 V904 F905 L906	W723-W902 HydrophobicContact CE3-CE3 4.31Å; W723-W902 HydrophobicContact CH2-CB 3.74Å; W723-W902 HydrophobicContact CH2-CD2 4.06Å; W723-W902 AromaticContact CH2-CE3 3.58Å; W723-W902 HydrophobicContact CH2-CE3 3.58Å; W723-W902 HydrophobicContact CH2-CG 4.17Å; W723-W902 HydrophobicContact CH2-CZ3 4.47Å; W723-W902 HydrophobicContact CZ2-CB 3.53Å; W723-W902 HydrophobicContact CZ2-CE3 4.32Å; W723-W902 HydrophobicContact CZ2-CG 4.43Å; W723-W902 HydrophobicContact CZ3-CD2 4.47Å; W723-W902 AromaticContact CZ3-CE3 3.56Å; W723-W902 HydrophobicContact CZ3-CE3 3.56Å; W723-W902 HydrophobicContact CZ3-CZ3 4.07Å; I811-W902 HydrophobicContact CG2-CH2 3.89Å; I811-W902 HydrophobicContact CG2-CZ2 4.39Å; V814-W902 HydrophobicContact CB-CH2 3.7Å; V814-W902 HydrophobicContact CB-CZ2 3.73Å; V814-W902 HydrophobicContact CB-CZ3 4.23Å; V814-W902 HydrophobicContact CG1-CD2 3.8Å; V814-W902 HydrophobicContact CG1-CE3 3.83Å; V814-W902 HydrophobicContact CG1-CH2 3.66Å; V814-W902 HydrophobicContact CG1-CZ2 3.63Å; V814-W902 HydrophobicContact CG1-CZ3 3.76Å; V814-W902 HydrophobicContact CG2-CZ2 4.24Å; I831-W902 HydrophobicContact CD1-CH2 3.73Å; I831-W902 HydrophobicContact CD1-CZ2 4.44Å; I831-W902 HydrophobicContact CD1-CZ3 3.81Å; V888-W902 HydrophobicContact CB-CZ2 4.17Å; V888-W902 HydrophobicContact CG1-CZ2 4.43Å; V888-W902 PolarHBondContact O-NE1 3.04Å; V888-W902 VanDerWaalsContact O-NE1 3.11Å; L898-W902 VanDerWaalsContact O-CD1 3.24Å; L898-W902 PolarHBondContact O-N 2.79Å; I899-W902 WeakPolarHBondContact O-CB 3.31Å; I899-W902 PolarHBondContact O-N 3.42Å; R900-W902 VanDerWaalsContact C-N 3.28Å; W902-V904 PolarHBondContact O-N 3.03Å; W902-F905 PolarHBondContact O-N 3.29Å; W902-L906 HydrophobicContact CE3-CD1 4.32Å; W902-L906 WeakPolarHBondContact O-CB 3.44Å; W902-L906 WeakPolarHBondContact O-CG 3.43Å; W902-L906 PolarHBondContact O-N 3.36Å
903	D	96.3	Very high	93.9	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-51.7	-41.3	174.7	-70.6	-21.2	0	0	0	111.7	V714 R719 W723 I899 R900	V714-D903 HydrophobicContact CG2-CB 3.86Å; V714-D903 VanDerWaalsContact CG2-CG 3.44Å; V714-D903 WeakPolarHBondContact CG2-OD1 3.31Å; V714-D903 PolarHBondContact N-OD2 3.25Å; R719-D903 IonicContact NE-OD1 2.58Å; W723-D903 PolarHBondContact NE1-OD1 3.08Å; I899-D903 VanDerWaalsContact O-CG 3.28Å; I899-D903 PolarHBondContact O-N 3.37Å; R900-D903 IonicContact NH1-OD2 3.25Å; R900-D903 PolarHBondContact NH1-OD2 2.94Å; R900-D903 VanDerWaalsContact NH1-OD2 3.15Å
904	V	96.7	Very high	94.2	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-82.5	-41.9	-179.3	-174.7	0	0	0	0	111.2	R711 R900 I901 W902 L906 L907 E908 T912 F916 F959	R711-V904 HydrophobicContact CG-CG1 4.31Å; R711-V904 HydrophobicContact CG-CG2 4.06Å; R900-V904 WeakPolarHBondContact O-CG2 3.5Å; R900-V904 PolarHBondContact O-N 2.82Å; I901-V904 PolarHBondContact O-N 3.4Å; W902-V904 PolarHBondContact O-N 3.03Å; V904-L906 PolarHBondContact O-N 3.38Å; V904-L907 PolarHBondContact O-N 2.95Å; V904-E908 HydrophobicContact CG1-CB 4.45Å; V904-E908 HydrophobicContact CG1-CG 4.31Å; V904-E908 WeakPolarHBondContact CG1-OE1 3.37Å; V904-E908 WeakPolarHBondContact O-CB 3.22Å; V904-E908 PolarHBondContact O-N 3.49Å; V904-T912 HydrophobicContact CG1-CG2 3.85Å; V904-F916 HydrophobicContact CB-CE2 4.36Å; V904-F916 HydrophobicContact CB-CZ 4.39Å; V904-F916 HydrophobicContact CG2-CZ 4.48Å; V904-F959 HydrophobicContact CG1-CE1 4.49Å; V904-F959 HydrophobicContact CG1-CE2 4.09Å; V904-F959 HydrophobicContact CG1-CZ 3.6Å
905	F	97.1	Very high	94.7	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-61.3	-42.4	-180	168.9	-104.1	0	0	0	112.7	I831 F835 V888 I901 W902 L907 G909 L913	I831-F905 HydrophobicContact CD1-CE1 4.15Å; I831-F905 HydrophobicContact CG1-CE1 3.9Å; I831-F905 HydrophobicContact CG2-CE1 4.09Å; I831-F905 HydrophobicContact CG2-CZ 4.09Å; F835-F905 HydrophobicContact CB-CE2 4.29Å; F835-F905 HydrophobicContact CB-CZ 3.88Å; F835-F905 HydrophobicContact CD2-CE1 4.16Å; F835-F905 HydrophobicContact CD2-CZ 4.26Å; F835-F905 HydrophobicContact CG-CZ 4.44Å; V888-F905 HydrophobicContact CG1-CD1 3.79Å; V888-F905 HydrophobicContact CG1-CD2 4.45Å; V888-F905 HydrophobicContact CG1-CE1 3.9Å; V888-F905 HydrophobicContact CG1-CG 4.08Å; V888-F905 HydrophobicContact CG1-CZ 4.32Å; V888-F905 HydrophobicContact CG2-CE1 4.31Å; V888-F905 HydrophobicContact CG2-CZ 4.37Å; I901-F905 VanDerWaalsContact O-CB 3.23Å; I901-F905 WeakPolarHBondContact O-CB 3.06Å; I901-F905 PolarHBondContact O-N 2.88Å; W902-F905 PolarHBondContact O-N 3.29Å; F905-L907 PolarHBondContact O-N 3.41Å; F905-G909 WeakPolarHBondContact CD2-O 3.33Å; F905-G909 WeakPolarHBondContact O-CA 3.41Å; F905-G909 PolarHBondContact O-N 3.12Å; F905-L913 HydrophobicContact CD2-CD2 4Å; F905-L913 HydrophobicContact CD2-CG 4.12Å; F905-L913 HydrophobicContact CE2-CD1 4.13Å; F905-L913 HydrophobicContact CE2-CD2 4.26Å; F905-L913 HydrophobicContact CE2-CG 4.14Å
906	L	96	Very high	95	Very high	3 Å²	3	11.8 Å²	11.8	2%	0.016	6%	0.055	C	C	.	.	H	α-helix	trans	-68	-15.3	179.4	-67.8	175.9	0	0	0	113.6	W723 L726 I727 I831 F835 W902 V904	W723-L906 HydrophobicContact CB-CD1 4.01Å; W723-L906 HydrophobicContact CD2-CD1 3.47Å; W723-L906 VanDerWaalsContact CD2-CD1 3.47Å; W723-L906 HydrophobicContact CE3-CD1 3.94Å; W723-L906 HydrophobicContact CG-CD1 3.51Å; W723-L906 HydrophobicContact CZ2-CD1 4.46Å; L726-L906 HydrophobicContact CD1-CB 4.01Å; I727-L906 HydrophobicContact CG1-CD2 4.33Å; I831-L906 HydrophobicContact CD1-CD2 4.28Å; I831-L906 HydrophobicContact CG1-CD2 4.26Å; F835-L906 HydrophobicContact CD2-CD2 4.38Å; F835-L906 HydrophobicContact CE2-CD2 3.76Å; F835-L906 WeakPolarHBondContact CZ-O 3.3Å; W902-L906 HydrophobicContact CE3-CD1 4.32Å; W902-L906 WeakPolarHBondContact O-CB 3.44Å; W902-L906 WeakPolarHBondContact O-CG 3.43Å; W902-L906 PolarHBondContact O-N 3.36Å; V904-L906 PolarHBondContact O-N 3.38Å
907	L	94.5	Very high	95.5	Very high	19 Å²	19	9 Å²	9	10%	0.099	4%	0.043	C	C	.	.	H	α-helix	trans	-102.7	-44.8	177.4	175.5	66.5	0	0	0	112.9	R703 L706 E707 C710 L726 V904 F905	R703-L907 PolarHBondContact NH2-O 2.89Å; R703-L907 VanDerWaalsContact NH2-O 3.16Å; L706-L907 HydrophobicContact CB-CD2 4.32Å; L706-L907 HydrophobicContact CD2-CD1 3.55Å; L706-L907 HydrophobicContact CD2-CD2 4.43Å; L706-L907 HydrophobicContact CG-CD1 3.93Å; L706-L907 HydrophobicContact CG-CD2 3.86Å; E707-L907 HydrophobicContact CB-CD2 4.3Å; E707-L907 HydrophobicContact CG-CD2 3.86Å; C710-L907 HydrophobicContact CB-CD2 3.89Å; L726-L907 HydrophobicContact CD1-CB 4.26Å; L726-L907 HydrophobicContact CD2-CB 4.42Å; L726-L907 HydrophobicContact CD2-CD1 3.75Å; V904-L907 PolarHBondContact O-N 2.95Å; F905-L907 PolarHBondContact O-N 3.41Å
908	E	93.3	Very high	95.8	Very high	34 Å²	34	9 Å²	9	16%	0.159	4%	0.043	C	C	.	.	H	α-helix	trans	-100.8	-9.7	-171.2	-67.7	-171.9	-126.5	0	0	113.6	E707 R711 V904 T912 F959	E707-E908 HydrophobicContact CG-CG 4.07Å; R711-E908 IonicContact CZ-OE1 3.15Å; R711-E908 IonicContact CZ-OE2 3.51Å; R711-E908 IonicContact NE-OE1 2.67Å; R711-E908 PolarHBondContact NE-OE1 3.41Å; R711-E908 IonicContact NE-OE2 3.09Å; R711-E908 IonicContact NH2-OE1 2.65Å; R711-E908 PolarHBondContact NH2-OE1 3.01Å; R711-E908 IonicContact NH2-OE2 3.31Å; R711-E908 PolarHBondContact NH2-OE2 3.19Å; V904-E908 HydrophobicContact CG1-CB 4.45Å; V904-E908 HydrophobicContact CG1-CG 4.31Å; V904-E908 WeakPolarHBondContact CG1-OE1 3.37Å; V904-E908 WeakPolarHBondContact O-CB 3.22Å; V904-E908 PolarHBondContact O-N 3.49Å; E908-T912 HydrophobicContact CB-CG2 3.48Å; E908-T912 VanDerWaalsContact CB-CG2 3.48Å; E908-F959 WeakPolarHBondContact OE2-CE1 3.36Å
909	G	92.9	Very high	95.9	Very high	8 Å²	8	9 Å²	9	8%	0.082	4%	0.042	C	C	.	.			trans	83.3	-166.2	173.5	0	0	0	0	0	115.3	F905 E911 T912	F905-G909 WeakPolarHBondContact CD2-O 3.33Å; F905-G909 WeakPolarHBondContact O-CA 3.41Å; F905-G909 PolarHBondContact O-N 3.12Å; G909-E911 PolarHBondContact O-N 2.84Å; G909-T912 WeakPolarHBondContact O-CB 3.27Å; G909-T912 WeakPolarHBondContact O-CG2 3.3Å; G909-T912 PolarHBondContact O-N 3.11Å; G909-T912 PolarHBondContact O-OG1 2.61Å
910	S	93.6	Very high	95.8	Very high	4 Å²	4	9 Å²	9	3%	0.028	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-20	-171.2	63.7	0	0	0	0	115.1	F835 T912 L913 R975	F835-S910 VanDerWaalsContact O-CB 3.25Å; F835-S910 WeakPolarHBondContact O-CB 3.27Å; F835-S910 PolarHBondContact O-OG 3.38Å; S910-T912 PolarHBondContact O-N 3.1Å; S910-L913 WeakPolarHBondContact O-CB 3.25Å; S910-L913 PolarHBondContact O-N 3.25Å; S910-R975 PolarHBondContact OG-NH1 2.92Å; S910-R975 VanDerWaalsContact OG-NH1 3.11Å; S910-R975 PolarHBondContact OG-NH2 3.47Å
911	E	92	Very high	95.9	Very high	47 Å²	47	7.9 Å²	7.9	22%	0.22	4%	0.038	C	C	.	.	H	α-helix	trans	-59	-29.4	176.2	-69.5	82.2	175.3	0	0	112.1	G909 L913 F914 R915 P968 I971	G909-E911 PolarHBondContact O-N 2.84Å; E911-L913 VanDerWaalsContact C-N 3.25Å; E911-L913 PolarHBondContact O-N 3.38Å; E911-F914 PolarHBondContact O-N 3.3Å; E911-R915 PolarHBondContact O-N 2.94Å; E911-P968 HydrophobicContact CG-CB 4.41Å; E911-P968 HydrophobicContact CG-CG 4.44Å; E911-I971 HydrophobicContact CB-CD1 4.32Å; E911-I971 HydrophobicContact CG-CD1 3.85Å
912	T	95	Very high	95.8	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.006	5%	0.051	C	C	.	.	H	α-helix	trans	-62.2	-32.7	177.1	61.3	0	0	0	0	112.2	V904 E908 G909 S910 F914 R915 F916 F959	V904-T912 HydrophobicContact CG1-CG2 3.85Å; E908-T912 HydrophobicContact CB-CG2 3.48Å; E908-T912 VanDerWaalsContact CB-CG2 3.48Å; G909-T912 WeakPolarHBondContact O-CB 3.27Å; G909-T912 WeakPolarHBondContact O-CG2 3.3Å; G909-T912 PolarHBondContact O-N 3.11Å; G909-T912 PolarHBondContact O-OG1 2.61Å; S910-T912 PolarHBondContact O-N 3.1Å; T912-F914 VanDerWaalsContact C-N 3.31Å; T912-F914 PolarHBondContact O-N 2.94Å; T912-R915 WeakPolarHBondContact O-CB 3.44Å; T912-R915 PolarHBondContact O-N 3.36Å; T912-R915 VanDerWaalsContact O-N 3.1Å; T912-F916 WeakPolarHBondContact O-CD2 3.48Å; T912-F916 PolarHBondContact O-N 3.45Å; T912-F959 HydrophobicContact CG2-CZ 4.45Å
913	L	96.8	Very high	95.4	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61.5	-41.7	179.8	-58.6	180	0	0	0	111.4	L836 F885 V888 F889 F905 S910 E911 A917	L836-L913 HydrophobicContact CD2-CD1 3.99Å; F885-L913 HydrophobicContact CB-CD1 4.39Å; F885-L913 HydrophobicContact CD1-CB 3.93Å; F885-L913 HydrophobicContact CE1-CB 3.73Å; F885-L913 WeakPolarHBondContact CE1-O 3.25Å; F885-L913 HydrophobicContact CE2-CB 4.37Å; F885-L913 HydrophobicContact CG-CB 4.34Å; F885-L913 HydrophobicContact CG-CD1 4.3Å; F885-L913 HydrophobicContact CZ-CB 3.96Å; V888-L913 HydrophobicContact CG1-CD2 4.06Å; F889-L913 HydrophobicContact CD2-CD2 4.03Å; F889-L913 HydrophobicContact CE2-CB 4.46Å; F889-L913 HydrophobicContact CE2-CD2 3.91Å; F905-L913 HydrophobicContact CD2-CD2 4Å; F905-L913 HydrophobicContact CD2-CG 4.12Å; F905-L913 HydrophobicContact CE2-CD1 4.13Å; F905-L913 HydrophobicContact CE2-CD2 4.26Å; F905-L913 HydrophobicContact CE2-CG 4.14Å; S910-L913 WeakPolarHBondContact O-CB 3.25Å; S910-L913 PolarHBondContact O-N 3.25Å; E911-L913 VanDerWaalsContact C-N 3.25Å; E911-L913 PolarHBondContact O-N 3.38Å; L913-A917 WeakPolarHBondContact O-CB 3.47Å; L913-A917 PolarHBondContact O-N 2.91Å
914	F	97.7	Very high	95.1	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-64.6	-42.7	174.4	-61.1	-85.3	0	0	0	111.9	D851 V854 L855 I858 F885 E911 T912 A917 V918 F965 I971	D851-F914 HydrophobicContact CB-CE1 4.32Å; D851-F914 HydrophobicContact CB-CZ 3.94Å; D851-F914 WeakPolarHBondContact O-CE1 3.42Å; V854-F914 HydrophobicContact CB-CE1 3.89Å; V854-F914 HydrophobicContact CB-CZ 4.26Å; V854-F914 HydrophobicContact CG1-CD1 4.46Å; V854-F914 HydrophobicContact CG1-CE1 3.78Å; V854-F914 HydrophobicContact CG1-CZ 4.09Å; L855-F914 HydrophobicContact CB-CD1 4.02Å; L855-F914 HydrophobicContact CB-CE1 4.13Å; L855-F914 HydrophobicContact CD1-CD1 4.13Å; I858-F914 HydrophobicContact CD1-CB 4.02Å; I858-F914 HydrophobicContact CD1-CD1 3.78Å; I858-F914 HydrophobicContact CD1-CE1 4.48Å; I858-F914 HydrophobicContact CD1-CG 4.03Å; F885-F914 HydrophobicContact CE2-CD1 4.02Å; F885-F914 AromaticContact CE2-CE1 3.85Å; F885-F914 HydrophobicContact CE2-CE1 3.85Å; F885-F914 HydrophobicContact CE2-CG 4.48Å; F885-F914 HydrophobicContact CE2-CZ 4.18Å; F885-F914 HydrophobicContact CZ-CD1 4.05Å; F885-F914 HydrophobicContact CZ-CE1 4.36Å; F885-F914 HydrophobicContact CZ-CG 4.33Å; E911-F914 PolarHBondContact O-N 3.3Å; T912-F914 VanDerWaalsContact C-N 3.31Å; T912-F914 PolarHBondContact O-N 2.94Å; F914-A917 PolarHBondContact O-N 3.49Å; F914-V918 WeakPolarHBondContact O-CB 2.91Å; F914-V918 WeakPolarHBondContact O-CG2 3.41Å; F914-V918 PolarHBondContact O-N 3.42Å; F914-F965 HydrophobicContact CB-CE1 4.16Å; F914-F965 HydrophobicContact CB-CZ 3.95Å; F914-I971 HydrophobicContact CE2-CG2 4.06Å; F914-I971 HydrophobicContact CZ-CG2 4.38Å
915	R	97.2	Very high	94.9	Very high	46 Å²	46	18.9 Å²	18.9	17%	0.174	9%	0.085	C	C	.	.	H	α-helix	trans	-60.5	-49.5	179.4	-67.7	178.1	174.6	-84.8	2.4	110.9	E911 T912 V918 A919 A958 F959 F965	E911-R915 PolarHBondContact O-N 2.94Å; T912-R915 WeakPolarHBondContact O-CB 3.44Å; T912-R915 PolarHBondContact O-N 3.36Å; T912-R915 VanDerWaalsContact O-N 3.1Å; R915-V918 PolarHBondContact O-N 3.3Å; R915-A919 WeakPolarHBondContact O-CB 3.46Å; R915-A919 PolarHBondContact O-N 3.18Å; R915-A958 HydrophobicContact CB-CB 4.19Å; R915-A958 PolarHBondContact NH1-O 3.34Å; R915-F959 VanDerWaalsContact CD-CE1 3.46Å; R915-F965 HydrophobicContact CB-CZ 4.36Å; R915-F965 HydrophobicContact CG-CD1 3.81Å; R915-F965 HydrophobicContact CG-CD2 4.36Å; R915-F965 HydrophobicContact CG-CE1 3.55Å; R915-F965 HydrophobicContact CG-CE2 4.13Å; R915-F965 HydrophobicContact CG-CG 4.21Å; R915-F965 HydrophobicContact CG-CZ 3.72Å
916	F	97.6	Very high	94.4	Very high	1 Å²	1	24.1 Å²	24.1	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-66.3	-42.7	179.4	-72.1	-60.7	0	0	0	112.1	F889 I901 V904 T912 V918 A919 I920 L954 I955 A958 F959	F889-F916 HydrophobicContact CE2-CB 4.02Å; F889-F916 HydrophobicContact CZ-CB 3.92Å; I901-F916 HydrophobicContact CB-CD2 4.28Å; I901-F916 HydrophobicContact CB-CE2 4.11Å; I901-F916 HydrophobicContact CB-CZ 4.48Å; I901-F916 HydrophobicContact CD1-CD1 4.49Å; I901-F916 HydrophobicContact CD1-CG 4.3Å; I901-F916 HydrophobicContact CG1-CD1 4.02Å; I901-F916 HydrophobicContact CG1-CD2 3.91Å; I901-F916 HydrophobicContact CG1-CE1 4.05Å; I901-F916 HydrophobicContact CG1-CE2 3.93Å; I901-F916 HydrophobicContact CG1-CG 3.96Å; I901-F916 HydrophobicContact CG1-CZ 4Å; I901-F916 HydrophobicContact CG2-CD2 3.75Å; I901-F916 HydrophobicContact CG2-CE2 3.89Å; I901-F916 HydrophobicContact CG2-CG 4.48Å; V904-F916 HydrophobicContact CB-CE2 4.36Å; V904-F916 HydrophobicContact CB-CZ 4.39Å; V904-F916 HydrophobicContact CG2-CZ 4.48Å; T912-F916 WeakPolarHBondContact O-CD2 3.48Å; T912-F916 PolarHBondContact O-N 3.45Å; F916-V918 PolarHBondContact O-N 3.04Å; F916-A919 PolarHBondContact O-N 2.71Å; F916-I920 VanDerWaalsContact O-CG1 3.26Å; F916-I920 WeakPolarHBondContact O-CG1 3.32Å; F916-I920 PolarHBondContact O-N 2.85Å; F916-L954 HydrophobicContact CD1-CD2 4.07Å; F916-L954 HydrophobicContact CD1-CG 4.01Å; F916-L954 HydrophobicContact CE1-CD2 4.49Å; F916-L954 HydrophobicContact CE1-CG 4.37Å; F916-I955 HydrophobicContact CE1-CG1 4.01Å; F916-I955 HydrophobicContact CZ-CG1 4.36Å; F916-A958 HydrophobicContact CD1-CB 4.12Å; F916-A958 HydrophobicContact CE1-CB 4.22Å; F916-F959 HydrophobicContact CE1-CE2 4.35Å; F916-F959 HydrophobicContact CE2-CE2 4.48Å; F916-F959 AromaticContact CZ-CE2 3.96Å; F916-F959 HydrophobicContact CZ-CE2 3.96Å
917	A	97.6	Very high	93.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.6	-46.2	176.6	0	0	0	0	0	112.2	L855 W884 F885 F889 L913 F914 I920 L921	L855-A917 HydrophobicContact CD1-CB 3.86Å; L855-A917 HydrophobicContact CD2-CB 4.21Å; W884-A917 HydrophobicContact CE3-CB 4.03Å; W884-A917 HydrophobicContact CZ3-CB 4.14Å; F885-A917 HydrophobicContact CE1-CB 3.87Å; F885-A917 HydrophobicContact CZ-CB 4.22Å; F889-A917 HydrophobicContact CZ-CB 4.16Å; L913-A917 WeakPolarHBondContact O-CB 3.47Å; L913-A917 PolarHBondContact O-N 2.91Å; F914-A917 PolarHBondContact O-N 3.49Å; A917-I920 PolarHBondContact O-N 3.39Å; A917-L921 WeakPolarHBondContact O-CG 3.18Å; A917-L921 PolarHBondContact O-N 3Å; A917-L921 VanDerWaalsContact O-N 3.15Å
918	V	97.5	Very high	93.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-69	-35.7	178	179.2	0	0	0	0	111.1	L855 I858 V859 K862 L863 F914 R915 F916 L921 K922 L962	L855-V918 HydrophobicContact CD1-CG2 3.85Å; I858-V918 HydrophobicContact CB-CG2 4.42Å; I858-V918 HydrophobicContact CG2-CG2 3.79Å; V859-V918 HydrophobicContact CG2-CG2 4.08Å; K862-V918 HydrophobicContact CB-CG1 3.96Å; K862-V918 HydrophobicContact CG-CG1 4.41Å; L863-V918 HydrophobicContact CD1-CG1 4.12Å; L863-V918 HydrophobicContact CG-CG1 4.35Å; F914-V918 WeakPolarHBondContact O-CB 2.91Å; F914-V918 WeakPolarHBondContact O-CG2 3.41Å; F914-V918 PolarHBondContact O-N 3.42Å; R915-V918 PolarHBondContact O-N 3.3Å; F916-V918 PolarHBondContact O-N 3.04Å; V918-L921 PolarHBondContact O-N 2.99Å; V918-K922 VanDerWaalsContact O-CB 3.27Å; V918-K922 WeakPolarHBondContact O-CB 3.42Å; V918-K922 PolarHBondContact O-N 3.34Å; V918-L962 HydrophobicContact CB-CD1 3.99Å; V918-L962 HydrophobicContact CG1-CD1 3.73Å; V918-L962 HydrophobicContact CG1-CD2 3.74Å; V918-L962 HydrophobicContact CG1-CG 4.44Å
919	A	96.8	Very high	93.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.1	-42.8	177.1	0	0	0	0	0	112.2	R915 F916 L921 K922 R923 L954 T957 A958 L962	R915-A919 WeakPolarHBondContact O-CB 3.46Å; R915-A919 PolarHBondContact O-N 3.18Å; F916-A919 PolarHBondContact O-N 2.71Å; A919-L921 VanDerWaalsContact C-N 3.34Å; A919-L921 PolarHBondContact O-N 3.04Å; A919-K922 PolarHBondContact O-N 3.14Å; A919-R923 WeakPolarHBondContact O-CG 3.38Å; A919-R923 PolarHBondContact O-N 3.27Å; A919-L954 HydrophobicContact CB-CD1 3.7Å; A919-T957 HydrophobicContact CB-CG2 3.83Å; A919-A958 HydrophobicContact CB-CB 3.81Å; A919-L962 HydrophobicContact CB-CD1 4.12Å
920	I	94.6	Very high	93.4	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-59.8	-45.9	174.4	-67.8	170.2	0	0	0	110.3	W884 F889 V893 F916 A917 N924 T945 T948 L954	W884-I920 HydrophobicContact CH2-CG2 4.26Å; F889-I920 HydrophobicContact CD1-CD1 4.25Å; F889-I920 HydrophobicContact CE1-CD1 3.69Å; V893-I920 HydrophobicContact CG1-CD1 4.07Å; F916-I920 VanDerWaalsContact O-CG1 3.26Å; F916-I920 WeakPolarHBondContact O-CG1 3.32Å; F916-I920 PolarHBondContact O-N 2.85Å; A917-I920 PolarHBondContact O-N 3.39Å; I920-N924 PolarHBondContact O-N 3.33Å; I920-N924 PolarHBondContact O-ND2 3.15Å; I920-T945 HydrophobicContact CG2-CG2 3.67Å; I920-T948 HydrophobicContact CG1-CG2 4.24Å; I920-T948 HydrophobicContact CG2-CG2 4.41Å; I920-L954 HydrophobicContact CG1-CD1 3.77Å; I920-L954 HydrophobicContact CG1-CD2 4.49Å
921	L	95.4	Very high	93.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.9	-40.6	177.3	-68.2	173.1	0	0	0	112.3	V859 L863 L866 I877 A917 V918 A919 N924 Q925 L928 L941	V859-L921 HydrophobicContact CG1-CD1 4.48Å; V859-L921 HydrophobicContact CG2-CD1 3.69Å; L863-L921 HydrophobicContact CD1-CB 3.62Å; L866-L921 HydrophobicContact CD2-CB 4.04Å; L866-L921 HydrophobicContact CD2-CD2 4.36Å; I877-L921 HydrophobicContact CD1-CD1 4.47Å; A917-L921 WeakPolarHBondContact O-CG 3.18Å; A917-L921 PolarHBondContact O-N 3Å; A917-L921 VanDerWaalsContact O-N 3.15Å; V918-L921 PolarHBondContact O-N 2.99Å; A919-L921 VanDerWaalsContact C-N 3.34Å; A919-L921 PolarHBondContact O-N 3.04Å; L921-N924 CarbonylContact O-C 3.59Å; L921-N924 PolarHBondContact O-N 2.96Å; L921-Q925 WeakPolarHBondContact O-CA 3.47Å; L921-Q925 PolarHBondContact O-N 3.12Å; L921-L928 HydrophobicContact CD2-CD1 4.18Å; L921-L941 HydrophobicContact CD2-CD1 3.74Å
922	K	94.9	Very high	92.8	Very high	63 Å²	63	28.7 Å²	28.7	27%	0.274	14%	0.138	S	C	.	.	H	α-helix	trans	-63.9	-47.3	179.7	179.1	167.8	169.5	175.2	0	111.7	L863 V918 A919 N924 Q925 T957 E961 L962	L863-K922 HydrophobicContact CD1-CB 4.22Å; L863-K922 HydrophobicContact CD2-CB 3.72Å; L863-K922 HydrophobicContact CD2-CD 4.22Å; L863-K922 HydrophobicContact CD2-CG 3.9Å; V918-K922 VanDerWaalsContact O-CB 3.27Å; V918-K922 WeakPolarHBondContact O-CB 3.42Å; V918-K922 PolarHBondContact O-N 3.34Å; A919-K922 PolarHBondContact O-N 3.14Å; K922-N924 PolarHBondContact O-N 2.81Å; K922-Q925 VanDerWaalsContact O-CB 3.25Å; K922-Q925 WeakPolarHBondContact O-CB 3.29Å; K922-Q925 PolarHBondContact O-N 3.38Å; K922-Q925 VanDerWaalsContact O-N 3.16Å; K922-T957 HydrophobicContact CB-CG2 4.16Å; K922-T957 HydrophobicContact CD-CG2 3.84Å; K922-T957 HydrophobicContact CG-CG2 4.12Å; K922-E961 PolarHBondContact NZ-O 3.26Å; K922-L962 HydrophobicContact CD-CD2 3.52Å; K922-L962 HydrophobicContact CD-CG 4.13Å
923	R	89.6	Confident	92.3	Very high	105 Å²	105	31.4 Å²	31.4	40%	0.396	15%	0.153	S	C	.	.	H	α-helix	trans	-63.1	-25.2	-179.9	-74.3	-177.2	59.4	120.4	-1.9	113.5	A919 D950 G953 T957	A919-R923 WeakPolarHBondContact O-CG 3.38Å; A919-R923 PolarHBondContact O-N 3.27Å; R923-D950 IonicContact CZ-OD2 3.14Å; R923-D950 IonicContact NH1-OD2 2.88Å; R923-D950 PolarHBondContact NH1-OD2 3.26Å; R923-D950 IonicContact NH2-OD2 2.8Å; R923-D950 PolarHBondContact NH2-OD2 2.89Å; R923-G953 PolarHBondContact NH1-O 3.45Å; R923-G953 VanDerWaalsContact NH1-O 3.14Å; R923-T957 HydrophobicContact CG-CG2 4.09Å
924	N	89.7	Confident	91.8	Very high	33 Å²	33	34.4 Å²	34.4	18%	0.176	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	11.2	-179.6	-63.3	-80.4	0	0	0	112.5	I920 L921 K922 D926 M927 L928 A944	I920-N924 PolarHBondContact O-N 3.33Å; I920-N924 PolarHBondContact O-ND2 3.15Å; L921-N924 CarbonylContact O-C 3.59Å; L921-N924 PolarHBondContact O-N 2.96Å; K922-N924 PolarHBondContact O-N 2.81Å; N924-D926 PolarHBondContact O-N 3.47Å; N924-M927 HydrophobicContact CB-CE 4.2Å; N924-M927 PolarHBondContact O-N 3.38Å; N924-L928 HydrophobicContact CB-CD1 4.11Å; N924-L928 HydrophobicContact CB-CG 4.34Å; N924-L928 WeakPolarHBondContact O-CB 3.42Å; N924-L928 WeakPolarHBondContact O-CG 3.43Å; N924-L928 PolarHBondContact O-N 2.98Å; N924-A944 HydrophobicContact CB-CB 4.01Å; N924-A944 VanDerWaalsContact CG-CB 3.48Å; N924-A944 WeakPolarHBondContact OD1-CB 3.45Å
925	Q	92.4	Very high	91	Very high	32 Å²	32	39.5 Å²	39.5	15%	0.15	20%	0.197	C	C	.	.	H	α-helix	trans	-58.3	-47	-169.8	180	-176.2	-55.2	0	0	112.2	L866 L921 K922 L928 L929	L866-Q925 HydrophobicContact CB-CG 4.31Å; L921-Q925 WeakPolarHBondContact O-CA 3.47Å; L921-Q925 PolarHBondContact O-N 3.12Å; K922-Q925 VanDerWaalsContact O-CB 3.25Å; K922-Q925 WeakPolarHBondContact O-CB 3.29Å; K922-Q925 PolarHBondContact O-N 3.38Å; K922-Q925 VanDerWaalsContact O-N 3.16Å; Q925-L928 PolarHBondContact O-N 3.23Å; Q925-L929 HydrophobicContact CG-CD1 3.83Å; Q925-L929 HydrophobicContact CG-CG 4.24Å; Q925-L929 WeakPolarHBondContact O-CB 3.21Å; Q925-L929 VanDerWaalsContact O-CG 3.26Å; Q925-L929 WeakPolarHBondContact O-CG 3.31Å; Q925-L929 PolarHBondContact O-N 3.23Å
926	D	88	Confident	90.1	Very high	109 Å²	109	38.2 Å²	38.2	58%	0.583	20%	0.195	S	C	*	.	H	α-helix	trans	-64.9	-47.2	-175.5	-62.2	-38	0	0	0	111	N924 L928 L929 E930	N924-D926 PolarHBondContact O-N 3.47Å; D926-L928 VanDerWaalsContact C-N 3.29Å; D926-L928 PolarHBondContact O-N 2.68Å; D926-L929 PolarHBondContact O-N 2.88Å; D926-L929 VanDerWaalsContact O-N 3.16Å; D926-E930 WeakPolarHBondContact O-CG 3.42Å; D926-E930 PolarHBondContact O-N 3.5Å
927	M	83.5	Confident	89.7	Confident	34 Å²	34	38.1 Å²	38.1	17%	0.167	20%	0.195	C	C	.	.	H	α-helix	trans	-58.9	-38.8	175	-172.3	-174.5	50.3	0	0	112.2	N924 Q931 C940 A944	N924-M927 HydrophobicContact CB-CE 4.2Å; N924-M927 PolarHBondContact O-N 3.38Å; M927-Q931 WeakPolarHBondContact O-CG 3.01Å; M927-Q931 PolarHBondContact O-NE2 2.62Å; M927-C940 WeakPolarHBondContact CE-SG 3.28Å; M927-C940 VanDerWaalsContact CG-SG 3.5Å; M927-A944 HydrophobicContact CE-CB 3.98Å
928	L	90.1	Very high	89.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-71.7	-34.7	178.2	-70.9	171.4	0	0	0	112.7	L866 H869 L921 N924 Q925 D926 E930 Q931 F937 C940 L941	L866-L928 HydrophobicContact CD1-CB 3.82Å; L866-L928 HydrophobicContact CD1-CD1 4.39Å; L866-L928 HydrophobicContact CD2-CD1 4.25Å; H869-L928 PolarHBondContact NE2-O 2.83Å; H869-L928 VanDerWaalsContact NE2-O 3.13Å; L921-L928 HydrophobicContact CD2-CD1 4.18Å; N924-L928 HydrophobicContact CB-CD1 4.11Å; N924-L928 HydrophobicContact CB-CG 4.34Å; N924-L928 WeakPolarHBondContact O-CB 3.42Å; N924-L928 WeakPolarHBondContact O-CG 3.43Å; N924-L928 PolarHBondContact O-N 2.98Å; Q925-L928 PolarHBondContact O-N 3.23Å; D926-L928 VanDerWaalsContact C-N 3.29Å; D926-L928 PolarHBondContact O-N 2.68Å; L928-E930 VanDerWaalsContact C-N 3.31Å; L928-Q931 PolarHBondContact O-N 3.42Å; L928-F937 HydrophobicContact CB-CD2 4.48Å; L928-F937 HydrophobicContact CB-CE2 3.87Å; L928-F937 HydrophobicContact CD2-CD2 4.16Å; L928-F937 HydrophobicContact CD2-CE2 3.8Å; L928-F937 HydrophobicContact CD2-CZ 3.96Å; L928-F937 HydrophobicContact CG-CE2 4.3Å; L928-C940 HydrophobicContact CD2-CB 4.32Å; L928-L941 HydrophobicContact CD1-CD1 4.25Å; L928-L941 HydrophobicContact CD2-CB 4.04Å; L928-L941 HydrophobicContact CD2-CD1 4.4Å
929	L	92.3	Very high	88.2	Confident	36 Å²	36	47.5 Å²	47.5	19%	0.188	23%	0.234	C	C	.	.	H	α-helix	trans	-68.9	-29.2	177.3	-76.4	173.4	0	0	0	112.5	R865 L866 H869 Q925 D926 Q931	R865-L929 HydrophobicContact CB-CD1 4.2Å; R865-L929 HydrophobicContact CB-CD2 4.32Å; L866-L929 HydrophobicContact CD1-CD2 4.42Å; H869-L929 HydrophobicContact CB-CD2 3.71Å; H869-L929 PolarHBondContact CE1-O 3.27Å; H869-L929 PolarHBondContact NE2-O 3.26Å; Q925-L929 HydrophobicContact CG-CD1 3.83Å; Q925-L929 HydrophobicContact CG-CG 4.24Å; Q925-L929 WeakPolarHBondContact O-CB 3.21Å; Q925-L929 VanDerWaalsContact O-CG 3.26Å; Q925-L929 WeakPolarHBondContact O-CG 3.31Å; Q925-L929 PolarHBondContact O-N 3.23Å; D926-L929 PolarHBondContact O-N 2.88Å; D926-L929 VanDerWaalsContact O-N 3.16Å; L929-Q931 VanDerWaalsContact C-N 3.25Å; L929-Q931 PolarHBondContact O-N 3.39Å
930	E	89.9	Confident	87.5	Confident	84 Å²	84	47.5 Å²	47.5	39%	0.393	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-20.2	177.8	-72.2	176.5	-173.9	0	0	113.7	T602 R607 D926 L928 S932	T602-E930 WeakPolarHBondContact CG2-OE2 3.14Å; R607-E930 PolarHBondContact NE-O 2.94Å; R607-E930 PolarHBondContact NH2-O 2.96Å; D926-E930 WeakPolarHBondContact O-CG 3.42Å; D926-E930 PolarHBondContact O-N 3.5Å; L928-E930 VanDerWaalsContact C-N 3.31Å; E930-S932 PolarHBondContact O-N 2.9Å
931	Q	86.2	Confident	87.2	Confident	7 Å²	7	47.5 Å²	47.5	3%	0.033	23%	0.234	C	C	.	.			trans	-73.6	125.8	-178	-51.2	-47.8	-47.5	0	0	111	H869 M927 L928 L929 F937 C940	H869-Q931 PolarHBondContact CE1-O 3.17Å; H869-Q931 PolarHBondContact NE2-O 3.34Å; M927-Q931 WeakPolarHBondContact O-CG 3.01Å; M927-Q931 PolarHBondContact O-NE2 2.62Å; L928-Q931 PolarHBondContact O-N 3.42Å; L929-Q931 VanDerWaalsContact C-N 3.25Å; L929-Q931 PolarHBondContact O-N 3.39Å; Q931-F937 HydrophobicContact CB-CB 4.15Å; Q931-F937 HydrophobicContact CB-CD2 4.44Å; Q931-C940 HydrophobicContact CG-CB 4.1Å
932	S	85.7	Confident	86.6	Confident	50 Å²	50	51.9 Å²	51.9	35%	0.35	25%	0.253	S	S	.	.			trans	-96.2	-17.1	-176.9	53.7	0	0	0	0	114.9	R607 L873 E930	R607-S932 VanDerWaalsContact CZ-OG 3.31Å; R607-S932 PolarHBondContact NH1-OG 3.22Å; L873-S932 WeakPolarHBondContact CD2-O 3.4Å; E930-S932 PolarHBondContact O-N 2.9Å
933	D	84.5	Confident	85.7	Confident	59 Å²	59	49.7 Å²	49.7	32%	0.316	25%	0.246	S	C	.	.	S	Bend	trans	-127	158	-175.8	70.9	-84	0	0	0	111.2	I935 S936 F937	D933-I935 PolarHBondContact OD2-N 3.42Å; D933-S936 VanDerWaalsContact CG-CB 3.48Å; D933-S936 WeakPolarHBondContact OD1-CB 3.41Å; D933-S936 PolarHBondContact OD1-OG 3.15Å; D933-S936 VanDerWaalsContact OD2-CB 3.31Å; D933-S936 WeakPolarHBondContact OD2-CB 3.47Å; D933-S936 PolarHBondContact OD2-N 3.47Å; D933-S936 PolarHBondContact OD2-OG 3.5Å; D933-F937 WeakPolarHBondContact O-CB 3.38Å; D933-F937 PolarHBondContact O-N 3.46Å; D933-F937 VanDerWaalsContact O-N 3.08Å
934	T	86	Confident	85.3	Confident	62 Å²	62	45 Å²	45	38%	0.38	23%	0.23	S	C	.	.	H	α-helix	trans	-67.6	-38.4	-174	53.4	0	0	0	0	112.6	L873 I875 F937 W938	L873-T934 HydrophobicContact CB-CG2 4.31Å; L873-T934 WeakPolarHBondContact O-CG2 3.36Å; I875-T934 HydrophobicContact CD1-CG2 4.11Å; I875-T934 HydrophobicContact CG1-CG2 3.81Å; T934-F937 PolarHBondContact O-N 2.83Å; T934-W938 PolarHBondContact O-N 3.44Å
935	I	80.5	Confident	85.1	Confident	107 Å²	107	43.7 Å²	43.7	55%	0.549	22%	0.223	S	C	.	.	H	α-helix	trans	-67.6	-47.5	-177.3	-62.4	173.2	0	0	0	110	D933 W938 K939	D933-I935 PolarHBondContact OD2-N 3.42Å; I935-W938 PolarHBondContact O-N 3.2Å; I935-K939 HydrophobicContact CG2-CD 4.27Å; I935-K939 WeakPolarHBondContact O-CG 3.49Å; I935-K939 PolarHBondContact O-N 3Å
936	S	79.6	Confident	84.5	Confident	19 Å²	19	49.6 Å²	49.6	13%	0.133	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-42.8	176.4	-63.9	0	0	0	0	111.8	L608 D933 W938 K939 C940	L608-S936 VanDerWaalsContact CD1-CB 3.46Å; D933-S936 VanDerWaalsContact CG-CB 3.48Å; D933-S936 WeakPolarHBondContact OD1-CB 3.41Å; D933-S936 PolarHBondContact OD1-OG 3.15Å; D933-S936 VanDerWaalsContact OD2-CB 3.31Å; D933-S936 WeakPolarHBondContact OD2-CB 3.47Å; D933-S936 PolarHBondContact OD2-N 3.47Å; D933-S936 PolarHBondContact OD2-OG 3.5Å; S936-W938 PolarHBondContact O-N 3.39Å; S936-K939 PolarHBondContact O-N 2.94Å; S936-C940 WeakPolarHBondContact O-CB 3.47Å; S936-C940 PolarHBondContact O-N 2.97Å
937	F	88.1	Confident	84	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-56.8	-48.4	173.9	-177.4	-83.2	0	0	0	111.6	L866 L870 L873 I875 L928 Q931 D933 T934 C940 L941	L866-F937 HydrophobicContact CD1-CE2 4.12Å; L870-F937 HydrophobicContact CD2-CE1 3.64Å; L870-F937 HydrophobicContact CD2-CE2 3.91Å; L870-F937 HydrophobicContact CD2-CZ 3.29Å; L870-F937 HydrophobicContact CG-CZ 4.26Å; L873-F937 HydrophobicContact CD1-CB 4.48Å; L873-F937 HydrophobicContact CD1-CD2 4.39Å; I875-F937 HydrophobicContact CD1-CB 3.63Å; I875-F937 HydrophobicContact CD1-CD1 3.45Å; I875-F937 VanDerWaalsContact CD1-CD1 3.45Å; I875-F937 HydrophobicContact CD1-CD2 4.15Å; I875-F937 HydrophobicContact CD1-CE1 4.18Å; I875-F937 HydrophobicContact CD1-CG 3.46Å; I875-F937 VanDerWaalsContact CD1-CG 3.46Å; I875-F937 HydrophobicContact CG2-CD1 4.1Å; I875-F937 HydrophobicContact CG2-CE1 4.01Å; L928-F937 HydrophobicContact CB-CD2 4.48Å; L928-F937 HydrophobicContact CB-CE2 3.87Å; L928-F937 HydrophobicContact CD2-CD2 4.16Å; L928-F937 HydrophobicContact CD2-CE2 3.8Å; L928-F937 HydrophobicContact CD2-CZ 3.96Å; L928-F937 HydrophobicContact CG-CE2 4.3Å; Q931-F937 HydrophobicContact CB-CB 4.15Å; Q931-F937 HydrophobicContact CB-CD2 4.44Å; D933-F937 WeakPolarHBondContact O-CB 3.38Å; D933-F937 PolarHBondContact O-N 3.46Å; D933-F937 VanDerWaalsContact O-N 3.08Å; T934-F937 PolarHBondContact O-N 2.83Å; F937-C940 WeakPolarHBondContact O-CB 3.3Å; F937-C940 PolarHBondContact O-N 3.24Å; F937-L941 HydrophobicContact CE1-CB 4.42Å; F937-L941 HydrophobicContact CE1-CD2 4.04Å; F937-L941 WeakPolarHBondContact O-CB 3.35Å; F937-L941 PolarHBondContact O-N 3.26Å
938	W	86.3	Confident	84.1	Confident	64 Å²	64	45.9 Å²	45.9	24%	0.242	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-42.4	180	-73.4	126.6	0	0	0	113.1	I875 D876 A879 V880 T934 I935 S936 C940 L941 K942	I875-W938 HydrophobicContact CG2-CH2 3.73Å; I875-W938 HydrophobicContact CG2-CZ2 3.43Å; I875-W938 VanDerWaalsContact CG2-CZ2 3.43Å; I875-W938 HydrophobicContact CG2-CZ3 4.44Å; D876-W938 VanDerWaalsContact O-CH2 3.31Å; D876-W938 WeakPolarHBondContact O-CH2 3.35Å; A879-W938 HydrophobicContact CB-CH2 3.91Å; A879-W938 HydrophobicContact CB-CZ2 4.15Å; V880-W938 HydrophobicContact CB-CZ3 4Å; V880-W938 HydrophobicContact CG2-CE3 3.75Å; V880-W938 HydrophobicContact CG2-CH2 4.12Å; V880-W938 HydrophobicContact CG2-CZ3 3.34Å; T934-W938 PolarHBondContact O-N 3.44Å; I935-W938 PolarHBondContact O-N 3.2Å; S936-W938 PolarHBondContact O-N 3.39Å; W938-C940 VanDerWaalsContact C-N 3.32Å; W938-C940 PolarHBondContact O-N 3.14Å; W938-L941 HydrophobicContact CE3-CD2 4.08Å; W938-L941 HydrophobicContact CZ3-CD2 3.87Å; W938-L941 PolarHBondContact O-N 2.89Å; W938-K942 WeakPolarHBondContact O-CB 3.34Å; W938-K942 WeakPolarHBondContact O-CG 3.25Å; W938-K942 PolarHBondContact O-N 3.38Å
939	K	78.9	Confident	83.6	Confident	132 Å²	132	47.3 Å²	47.3	57%	0.574	23%	0.233	S	C	*	.	H	α-helix	trans	-59.5	-46.2	174.8	-75.1	178.7	177.8	-178.9	0	111	I935 S936 K942 A943	I935-K939 HydrophobicContact CG2-CD 4.27Å; I935-K939 WeakPolarHBondContact O-CG 3.49Å; I935-K939 PolarHBondContact O-N 3Å; S936-K939 PolarHBondContact O-N 2.94Å; K939-K942 PolarHBondContact O-N 3.47Å; K939-A943 WeakPolarHBondContact O-CB 3.19Å; K939-A943 PolarHBondContact O-N 2.93Å
940	C	81	Confident	83.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-47.1	177.9	-179.6	0	0	0	0	111.7	M927 L928 Q931 S936 F937 W938 A943 A944	M927-C940 WeakPolarHBondContact CE-SG 3.28Å; M927-C940 VanDerWaalsContact CG-SG 3.5Å; L928-C940 HydrophobicContact CD2-CB 4.32Å; Q931-C940 HydrophobicContact CG-CB 4.1Å; S936-C940 WeakPolarHBondContact O-CB 3.47Å; S936-C940 PolarHBondContact O-N 2.97Å; F937-C940 WeakPolarHBondContact O-CB 3.3Å; F937-C940 PolarHBondContact O-N 3.24Å; W938-C940 VanDerWaalsContact C-N 3.32Å; W938-C940 PolarHBondContact O-N 3.14Å; C940-A943 PolarHBondContact O-N 3.28Å; C940-A944 VanDerWaalsContact O-CB 3.25Å; C940-A944 WeakPolarHBondContact O-CB 3.43Å; C940-A944 PolarHBondContact O-N 2.94Å
941	L	87.6	Confident	82.9	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-65.3	-41.9	177.7	-177	62.2	0	0	0	113	W884 L921 L928 F937 W938 A943 A944 T945	W884-L941 HydrophobicContact CH2-CD1 4.25Å; L921-L941 HydrophobicContact CD2-CD1 3.74Å; L928-L941 HydrophobicContact CD1-CD1 4.25Å; L928-L941 HydrophobicContact CD2-CB 4.04Å; L928-L941 HydrophobicContact CD2-CD1 4.4Å; F937-L941 HydrophobicContact CE1-CB 4.42Å; F937-L941 HydrophobicContact CE1-CD2 4.04Å; F937-L941 WeakPolarHBondContact O-CB 3.35Å; F937-L941 PolarHBondContact O-N 3.26Å; W938-L941 HydrophobicContact CE3-CD2 4.08Å; W938-L941 HydrophobicContact CZ3-CD2 3.87Å; W938-L941 PolarHBondContact O-N 2.89Å; L941-A943 VanDerWaalsContact C-N 3.33Å; L941-A943 PolarHBondContact O-N 3.03Å; L941-A944 PolarHBondContact O-N 3.27Å; L941-T945 HydrophobicContact CD1-CG2 4.42Å; L941-T945 WeakPolarHBondContact O-CG2 3.19Å; L941-T945 PolarHBondContact O-N 3.42Å; L941-T945 VanDerWaalsContact O-N 3.1Å; L941-T945 PolarHBondContact O-OG1 3.36Å
942	K	83.2	Confident	83	Confident	92 Å²	92	47.8 Å²	47.8	40%	0.4	24%	0.239	S	C	.	.	H	α-helix	trans	-63.8	-38.3	175.7	-77.4	-168	174.7	-164.6	0	111.6	D213 W938 K939 T945 R946	D213-K942 IonicContact OD1-NZ 3.04Å; D213-K942 PolarHBondContact OD1-NZ 2.85Å; D213-K942 VanDerWaalsContact OD1-NZ 3.09Å; W938-K942 WeakPolarHBondContact O-CB 3.34Å; W938-K942 WeakPolarHBondContact O-CG 3.25Å; W938-K942 PolarHBondContact O-N 3.38Å; K939-K942 PolarHBondContact O-N 3.47Å; K942-T945 PolarHBondContact O-OG1 2.88Å; K942-R946 WeakPolarHBondContact O-CG 3.04Å; K942-R946 PolarHBondContact O-N 2.82Å
943	A	76.6	Confident	83.1	Confident	17 Å²	17	46 Å²	46	14%	0.14	23%	0.229	C	C	.	.	H	α-helix	trans	-69.2	-47.1	174.5	0	0	0	0	0	111.7	F610 K939 C940 L941 T945 R946 L947	F610-A943 HydrophobicContact CD1-CB 4.46Å; F610-A943 HydrophobicContact CE1-CB 3.42Å; F610-A943 VanDerWaalsContact CE1-CB 3.42Å; F610-A943 HydrophobicContact CE2-CB 4.18Å; F610-A943 HydrophobicContact CZ-CB 3.25Å; K939-A943 WeakPolarHBondContact O-CB 3.19Å; K939-A943 PolarHBondContact O-N 2.93Å; C940-A943 PolarHBondContact O-N 3.28Å; L941-A943 VanDerWaalsContact C-N 3.33Å; L941-A943 PolarHBondContact O-N 3.03Å; A943-T945 PolarHBondContact O-N 2.83Å; A943-R946 PolarHBondContact O-N 3.16Å; A943-L947 HydrophobicContact CB-CD1 4.42Å; A943-L947 WeakPolarHBondContact O-CB 3.48Å; A943-L947 WeakPolarHBondContact O-CD1 3.47Å; A943-L947 VanDerWaalsContact O-CG 3.22Å; A943-L947 WeakPolarHBondContact O-CG 3.2Å; A943-L947 PolarHBondContact O-N 3.39Å
944	A	80.1	Confident	83.5	Confident	6 Å²	6	43.3 Å²	43.3	5%	0.05	22%	0.215	C	C	.	.	H	α-helix	trans	-52.2	-41.2	178.6	0	0	0	0	0	112.6	N924 M927 C940 L941 T948	N924-A944 HydrophobicContact CB-CB 4.01Å; N924-A944 VanDerWaalsContact CG-CB 3.48Å; N924-A944 WeakPolarHBondContact OD1-CB 3.45Å; M927-A944 HydrophobicContact CE-CB 3.98Å; C940-A944 VanDerWaalsContact O-CB 3.25Å; C940-A944 WeakPolarHBondContact O-CB 3.43Å; C940-A944 PolarHBondContact O-N 2.94Å; L941-A944 PolarHBondContact O-N 3.27Å; A944-T948 VanDerWaalsContact O-CG2 3.23Å; A944-T948 WeakPolarHBondContact O-CG2 3.35Å
945	T	86.1	Confident	83.9	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.037	20%	0.2	C	C	.	.	H	α-helix	trans	-73.1	-46.2	179.4	49.5	0	0	0	0	112.4	W884 S892 I920 L941 K942 A943 L947 T948	W884-T945 HydrophobicContact CH2-CG2 3.57Å; W884-T945 HydrophobicContact CZ2-CG2 3.21Å; S892-T945 CarbonylContact O-C 3.6Å; S892-T945 VanDerWaalsContact O-C 3.24Å; S892-T945 VanDerWaalsContact O-CB 3.31Å; S892-T945 WeakPolarHBondContact O-CB 3.47Å; I920-T945 HydrophobicContact CG2-CG2 3.67Å; L941-T945 HydrophobicContact CD1-CG2 4.42Å; L941-T945 WeakPolarHBondContact O-CG2 3.19Å; L941-T945 PolarHBondContact O-N 3.42Å; L941-T945 VanDerWaalsContact O-N 3.1Å; L941-T945 PolarHBondContact O-OG1 3.36Å; K942-T945 PolarHBondContact O-OG1 2.88Å; A943-T945 PolarHBondContact O-N 2.83Å; T945-L947 PolarHBondContact O-N 3.47Å; T945-L947 VanDerWaalsContact O-N 3.16Å; T945-T948 PolarHBondContact O-N 2.81Å; T945-T948 PolarHBondContact O-OG1 2.91Å
946	R	80.7	Confident	84.5	Confident	156 Å²	156	41 Å²	41	59%	0.589	20%	0.196	S	C	*	.	H	α-helix	trans	-63.6	-18.5	176.6	-73.2	-178.5	173.8	-149.8	-5.5	114.6	P894 K942 A943	P894-R946 WeakPolarHBondContact CG-O 3.37Å; K942-R946 WeakPolarHBondContact O-CG 3.04Å; K942-R946 PolarHBondContact O-N 2.82Å; A943-R946 PolarHBondContact O-N 3.16Å
947	L	77.5	Confident	85.2	Confident	52 Å²	52	40.2 Å²	40.2	27%	0.272	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	14.9	-176.7	-62	171.5	0	0	0	113.2	G598 A943 T945 N949	G598-L947 VanDerWaalsContact O-CD1 3.25Å; G598-L947 WeakPolarHBondContact O-CD1 3.43Å; A943-L947 HydrophobicContact CB-CD1 4.42Å; A943-L947 WeakPolarHBondContact O-CB 3.48Å; A943-L947 WeakPolarHBondContact O-CD1 3.47Å; A943-L947 VanDerWaalsContact O-CG 3.22Å; A943-L947 WeakPolarHBondContact O-CG 3.2Å; A943-L947 PolarHBondContact O-N 3.39Å; T945-L947 PolarHBondContact O-N 3.47Å; T945-L947 VanDerWaalsContact O-N 3.16Å; L947-N949 PolarHBondContact O-N 3.46Å
948	T	84.4	Confident	85.6	Confident	13 Å²	13	40.2 Å²	40.2	8%	0.08	19%	0.191	C	C	.	.			trans	-74.8	54.2	178.2	48.8	0	0	0	0	113.5	V893 P894 T897 I920 A944 T945	V893-T948 WeakPolarHBondContact CB-OG1 3.48Å; V893-T948 WeakPolarHBondContact CG1-OG1 3.22Å; P894-T948 VanDerWaalsContact CD-OG1 3.28Å; P894-T948 WeakPolarHBondContact CD-OG1 3.18Å; T897-T948 WeakPolarHBondContact CG2-O 3.13Å; T897-T948 PolarHBondContact OG1-O 3.19Å; I920-T948 HydrophobicContact CG1-CG2 4.24Å; I920-T948 HydrophobicContact CG2-CG2 4.41Å; A944-T948 VanDerWaalsContact O-CG2 3.23Å; A944-T948 WeakPolarHBondContact O-CG2 3.35Å; T945-T948 PolarHBondContact O-N 2.81Å; T945-T948 PolarHBondContact O-OG1 2.91Å
949	N	80.4	Confident	86	Confident	30 Å²	30	37.8 Å²	37.8	16%	0.16	18%	0.182	C	C	.	.			trans	-75.5	-22.9	-179.3	-63.1	-59.5	0	0	0	113.7	H666 P894 L947 V951	H666-N949 PolarHBondContact CE1-ND2 2.94Å; P894-N949 WeakPolarHBondContact CB-OD1 3.38Å; P894-N949 WeakPolarHBondContact CG-OD1 3.15Å; L947-N949 PolarHBondContact O-N 3.46Å; N949-V951 PolarHBondContact O-N 3.28Å
950	D	81.8	Confident	86.7	Confident	48 Å²	48	36.4 Å²	36.4	26%	0.257	18%	0.177	S	C	.	.			trans	-79.7	81.6	175.5	174.8	26.4	0	0	0	111.1	A595 R923 G953 L954	A595-D950 HydrophobicContact CB-CB 4.07Å; R923-D950 IonicContact CZ-OD2 3.14Å; R923-D950 IonicContact NH1-OD2 2.88Å; R923-D950 PolarHBondContact NH1-OD2 3.26Å; R923-D950 IonicContact NH2-OD2 2.8Å; R923-D950 PolarHBondContact NH2-OD2 2.89Å; D950-G953 PolarHBondContact OD1-N 2.99Å; D950-G953 WeakPolarHBondContact OD2-CA 3.45Å; D950-L954 WeakPolarHBondContact O-CB 3.37Å; D950-L954 PolarHBondContact O-N 3.44Å
951	V	86.6	Confident	87.3	Confident	18 Å²	18	40.8 Å²	40.8	11%	0.109	20%	0.198	C	C	.	.	H	α-helix	trans	-69	-40.2	-176.1	-170.8	0	0	0	0	112.5	T897 R900 N949 L954 I955	T897-V951 HydrophobicContact CG2-CG2 4.19Å; T897-V951 WeakPolarHBondContact OG1-CG2 3.09Å; R900-V951 HydrophobicContact CB-CG1 3.44Å; R900-V951 VanDerWaalsContact CB-CG1 3.44Å; R900-V951 HydrophobicContact CG-CG1 3.66Å; N949-V951 PolarHBondContact O-N 3.28Å; V951-L954 WeakPolarHBondContact O-CB 3.33Å; V951-L954 PolarHBondContact O-N 2.93Å; V951-L954 VanDerWaalsContact O-N 3.15Å; V951-I955 HydrophobicContact CG1-CD1 4.15Å; V951-I955 WeakPolarHBondContact O-CG1 3.21Å; V951-I955 PolarHBondContact O-N 3Å
952	D	87.8	Confident	87.5	Confident	71 Å²	71	40.9 Å²	40.9	38%	0.38	20%	0.198	S	C	.	.	H	α-helix	trans	-67.7	-43.6	-178.6	-65.8	-43.6	0	0	0	111.2	K591 L954 I955 K956	K591-D952 WeakPolarHBondContact CE-OD2 3.44Å; K591-D952 IonicContact NZ-OD2 3.88Å; K591-D952 PolarHBondContact NZ-OD2 3.19Å; D952-L954 VanDerWaalsContact C-N 3.26Å; D952-L954 PolarHBondContact O-N 3.22Å; D952-I955 PolarHBondContact O-N 3.05Å; D952-K956 WeakPolarHBondContact O-CB 3.31Å; D952-K956 PolarHBondContact O-N 2.81Å
953	G	88	Confident	87.8	Confident	14 Å²	14	44.5 Å²	44.5	14%	0.144	21%	0.209	C	C	.	.	H	α-helix	trans	-65.5	-31.6	173	0	0	0	0	0	112	R923 D950 T957	R923-G953 PolarHBondContact NH1-O 3.45Å; R923-G953 VanDerWaalsContact NH1-O 3.14Å; D950-G953 PolarHBondContact OD1-N 2.99Å; D950-G953 WeakPolarHBondContact OD2-CA 3.45Å; G953-T957 PolarHBondContact O-N 3.33Å; G953-T957 PolarHBondContact O-OG1 3.29Å; G953-T957 VanDerWaalsContact O-OG1 3.11Å
954	L	92.7	Very high	88.4	Confident	1 Å²	1	49 Å²	49	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-45.4	174.4	177.2	64.4	0	0	0	111.3	T897 F916 A919 I920 D950 V951 D952 T957 A958	T897-L954 HydrophobicContact CG2-CD2 3.67Å; F916-L954 HydrophobicContact CD1-CD2 4.07Å; F916-L954 HydrophobicContact CD1-CG 4.01Å; F916-L954 HydrophobicContact CE1-CD2 4.49Å; F916-L954 HydrophobicContact CE1-CG 4.37Å; A919-L954 HydrophobicContact CB-CD1 3.7Å; I920-L954 HydrophobicContact CG1-CD1 3.77Å; I920-L954 HydrophobicContact CG1-CD2 4.49Å; D950-L954 WeakPolarHBondContact O-CB 3.37Å; D950-L954 PolarHBondContact O-N 3.44Å; V951-L954 WeakPolarHBondContact O-CB 3.33Å; V951-L954 PolarHBondContact O-N 2.93Å; V951-L954 VanDerWaalsContact O-N 3.15Å; D952-L954 VanDerWaalsContact C-N 3.26Å; D952-L954 PolarHBondContact O-N 3.22Å; L954-T957 PolarHBondContact O-N 3.39Å; L954-A958 VanDerWaalsContact O-CB 3.29Å; L954-A958 WeakPolarHBondContact O-CB 3.42Å; L954-A958 PolarHBondContact O-N 3.16Å
955	I	94	Very high	89	Confident	16 Å²	16	49.7 Å²	49.7	8%	0.082	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-42.9	176.2	-69.8	175.7	0	0	0	110.4	R711 F916 V951 D952 T957 A958 F959	R711-I955 HydrophobicContact CB-CG2 4.17Å; R711-I955 WeakPolarHBondContact O-CD1 3.44Å; F916-I955 HydrophobicContact CE1-CG1 4.01Å; F916-I955 HydrophobicContact CZ-CG1 4.36Å; V951-I955 HydrophobicContact CG1-CD1 4.15Å; V951-I955 WeakPolarHBondContact O-CG1 3.21Å; V951-I955 PolarHBondContact O-N 3Å; D952-I955 PolarHBondContact O-N 3.05Å; I955-T957 PolarHBondContact O-N 2.9Å; I955-A958 PolarHBondContact O-N 3.5Å; I955-F959 HydrophobicContact CG2-CD2 3.96Å; I955-F959 WeakPolarHBondContact O-CD2 3.38Å; I955-F959 PolarHBondContact O-N 3.21Å
956	K	93.2	Very high	89.3	Confident	105 Å²	105	50 Å²	50	46%	0.457	24%	0.241	S	C	.	.	H	α-helix	trans	-57.9	-48.6	174.8	-168.1	-175.5	179.8	-179.3	0	111.6	D952 A958 E960 E961	D952-K956 WeakPolarHBondContact O-CB 3.31Å; D952-K956 PolarHBondContact O-N 2.81Å; K956-A958 VanDerWaalsContact C-N 3.33Å; K956-A958 PolarHBondContact O-N 3.48Å; K956-E960 WeakPolarHBondContact CE-OE2 3.45Å; K956-E960 HydrophobicContact CG-CB 4.29Å; K956-E960 HydrophobicContact CG-CG 4.23Å; K956-E960 VanDerWaalsContact CG-OE2 3.31Å; K956-E960 WeakPolarHBondContact CG-OE2 3.23Å; K956-E960 WeakPolarHBondContact O-CA 3.44Å; K956-E960 WeakPolarHBondContact O-CB 3.32Å; K956-E960 PolarHBondContact O-N 2.93Å; K956-E961 PolarHBondContact O-N 2.98Å
957	T	94.1	Very high	89.7	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.018	24%	0.244	C	C	.	.	I	π-helix	trans	-60.9	-43.8	175.6	-60.7	0	0	0	0	111.5	A919 K922 R923 G953 L954 I955 E961 L962	A919-T957 HydrophobicContact CB-CG2 3.83Å; K922-T957 HydrophobicContact CB-CG2 4.16Å; K922-T957 HydrophobicContact CD-CG2 3.84Å; K922-T957 HydrophobicContact CG-CG2 4.12Å; R923-T957 HydrophobicContact CG-CG2 4.09Å; G953-T957 PolarHBondContact O-N 3.33Å; G953-T957 PolarHBondContact O-OG1 3.29Å; G953-T957 VanDerWaalsContact O-OG1 3.11Å; L954-T957 PolarHBondContact O-N 3.39Å; I955-T957 PolarHBondContact O-N 2.9Å; T957-E961 WeakPolarHBondContact CB-OE2 3.33Å; T957-E961 HydrophobicContact CG2-CB 4.5Å; T957-E961 WeakPolarHBondContact CG2-OE2 3.43Å; T957-E961 PolarHBondContact OG1-OE2 3.36Å; T957-L962 WeakPolarHBondContact O-CB 3.3Å; T957-L962 VanDerWaalsContact O-CG 3.26Å; T957-L962 WeakPolarHBondContact O-CG 3.39Å; T957-L962 PolarHBondContact O-N 2.96Å; T957-L962 VanDerWaalsContact O-N 3.16Å
958	A	95.9	Very high	90.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.255	C	S	.	.	I	π-helix	trans	-65.3	-39.3	-177.2	0	0	0	0	0	114.1	R915 F916 A919 L954 I955 K956	R915-A958 HydrophobicContact CB-CB 4.19Å; R915-A958 PolarHBondContact NH1-O 3.34Å; F916-A958 HydrophobicContact CD1-CB 4.12Å; F916-A958 HydrophobicContact CE1-CB 4.22Å; A919-A958 HydrophobicContact CB-CB 3.81Å; L954-A958 VanDerWaalsContact O-CB 3.29Å; L954-A958 WeakPolarHBondContact O-CB 3.42Å; L954-A958 PolarHBondContact O-N 3.16Å; I955-A958 PolarHBondContact O-N 3.5Å; K956-A958 VanDerWaalsContact C-N 3.33Å; K956-A958 PolarHBondContact O-N 3.48Å
959	F	94.4	Very high	90.5	Very high	13 Å²	13	57.5 Å²	57.5	6%	0.057	29%	0.285	C	S	.	.	I	π-helix	trans	-111.3	-17.8	-170.7	-69.9	-84.8	0	0	0	114.4	V904 E908 T912 R915 F916 I955 R963	V904-F959 HydrophobicContact CG1-CE1 4.49Å; V904-F959 HydrophobicContact CG1-CE2 4.09Å; V904-F959 HydrophobicContact CG1-CZ 3.6Å; E908-F959 WeakPolarHBondContact OE2-CE1 3.36Å; T912-F959 HydrophobicContact CG2-CZ 4.45Å; R915-F959 VanDerWaalsContact CD-CE1 3.46Å; F916-F959 HydrophobicContact CE1-CE2 4.35Å; F916-F959 HydrophobicContact CE2-CE2 4.48Å; F916-F959 AromaticContact CZ-CE2 3.96Å; F916-F959 HydrophobicContact CZ-CE2 3.96Å; I955-F959 HydrophobicContact CG2-CD2 3.96Å; I955-F959 WeakPolarHBondContact O-CD2 3.38Å; I955-F959 PolarHBondContact O-N 3.21Å; F959-R963 WeakPolarHBondContact O-CG 3.47Å; F959-R963 PolarHBondContact O-NE 3.43Å; F959-R963 PolarHBondContact O-NH2 2.88Å
960	E	94.1	Very high	91.1	Very high	102 Å²	102	59.7 Å²	59.7	48%	0.477	30%	0.296	S	S	.	.	I	π-helix	trans	-111.5	-61.3	178.9	-52.5	-177.3	-175.7	0	0	111.1	K956 L962 R963	K956-E960 WeakPolarHBondContact CE-OE2 3.45Å; K956-E960 HydrophobicContact CG-CB 4.29Å; K956-E960 HydrophobicContact CG-CG 4.23Å; K956-E960 VanDerWaalsContact CG-OE2 3.31Å; K956-E960 WeakPolarHBondContact CG-OE2 3.23Å; K956-E960 WeakPolarHBondContact O-CA 3.44Å; K956-E960 WeakPolarHBondContact O-CB 3.32Å; K956-E960 PolarHBondContact O-N 2.93Å; E960-L962 VanDerWaalsContact C-N 3.28Å; E960-L962 PolarHBondContact O-N 3.11Å; E960-R963 WeakPolarHBondContact O-CB 3.42Å; E960-R963 WeakPolarHBondContact O-CG 3.34Å; E960-R963 PolarHBondContact O-N 3.47Å; E960-R963 VanDerWaalsContact O-N 3.16Å
961	E	93.3	Very high	91.7	Very high	93 Å²	93	57.4 Å²	57.4	44%	0.435	28%	0.284	S	S	.	.	I	π-helix	trans	-72.4	-20.1	-169.7	-54.1	174.9	175.4	0	0	113.8	K922 K956 T957	K922-E961 PolarHBondContact NZ-O 3.26Å; K956-E961 PolarHBondContact O-N 2.98Å; T957-E961 WeakPolarHBondContact CB-OE2 3.33Å; T957-E961 HydrophobicContact CG2-CB 4.5Å; T957-E961 WeakPolarHBondContact CG2-OE2 3.43Å; T957-E961 PolarHBondContact OG1-OE2 3.36Å
962	L	92.9	Very high	92	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.016	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	0.3	176.8	-74.2	175.7	0	0	0	113.5	K862 V918 A919 K922 T957 E960 P964 F965	K862-L962 HydrophobicContact CB-CD2 4.28Å; K862-L962 HydrophobicContact CD-CD2 4.27Å; K862-L962 WeakPolarHBondContact CE-O 3.34Å; K862-L962 HydrophobicContact CG-CD2 4.44Å; K862-L962 PolarHBondContact NZ-O 3.1Å; V918-L962 HydrophobicContact CB-CD1 3.99Å; V918-L962 HydrophobicContact CG1-CD1 3.73Å; V918-L962 HydrophobicContact CG1-CD2 3.74Å; V918-L962 HydrophobicContact CG1-CG 4.44Å; A919-L962 HydrophobicContact CB-CD1 4.12Å; K922-L962 HydrophobicContact CD-CD2 3.52Å; K922-L962 HydrophobicContact CD-CG 4.13Å; T957-L962 WeakPolarHBondContact O-CB 3.3Å; T957-L962 VanDerWaalsContact O-CG 3.26Å; T957-L962 WeakPolarHBondContact O-CG 3.39Å; T957-L962 PolarHBondContact O-N 2.96Å; T957-L962 VanDerWaalsContact O-N 3.16Å; E960-L962 VanDerWaalsContact C-N 3.28Å; E960-L962 PolarHBondContact O-N 3.11Å; L962-P964 CarbonylContact O-C 3.56Å; L962-F965 HydrophobicContact CB-CD2 4.09Å; L962-F965 HydrophobicContact CD1-CE2 4.32Å
963	R	90.1	Very high	92.3	Very high	167 Å²	167	60.3 Å²	60.3	63%	0.63	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-66.3	146.5	177.1	-68.1	-172.7	-148.3	165.3	13.5	112	F959 E960	F959-R963 WeakPolarHBondContact O-CG 3.47Å; F959-R963 PolarHBondContact O-NE 3.43Å; F959-R963 PolarHBondContact O-NH2 2.88Å; E960-R963 WeakPolarHBondContact O-CB 3.42Å; E960-R963 WeakPolarHBondContact O-CG 3.34Å; E960-R963 PolarHBondContact O-N 3.47Å; E960-R963 VanDerWaalsContact O-N 3.16Å
964	P	88.9	Confident	92.7	Very high	113 Å²	113	61 Å²	61	73%	0.734	31%	0.309	S	S	*	.	S	Bend	cis	-74.9	125.9	-9.1	29.6	-32.8	0	0	0	111.2	K862 L962	K862-P964 VanDerWaalsContact CE-O 3.3Å; K862-P964 WeakPolarHBondContact CE-O 3.46Å; K862-P964 PolarHBondContact NZ-O 2.95Å; L962-P964 CarbonylContact O-C 3.56Å
965	F	92.9	Very high	92.8	Very high	20 Å²	20	62.7 Å²	62.7	9%	0.088	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-86.1	150.5	176.8	-157.1	-100.8	0	0	0	110.3	I858 F914 R915 L962 K967 I971	I858-F965 HydrophobicContact CD1-CE1 4.45Å; I858-F965 HydrophobicContact CD1-CZ 4.31Å; I858-F965 HydrophobicContact CG2-CE2 3.9Å; I858-F965 HydrophobicContact CG2-CZ 3.87Å; F914-F965 HydrophobicContact CB-CE1 4.16Å; F914-F965 HydrophobicContact CB-CZ 3.95Å; R915-F965 HydrophobicContact CB-CZ 4.36Å; R915-F965 HydrophobicContact CG-CD1 3.81Å; R915-F965 HydrophobicContact CG-CD2 4.36Å; R915-F965 HydrophobicContact CG-CE1 3.55Å; R915-F965 HydrophobicContact CG-CE2 4.13Å; R915-F965 HydrophobicContact CG-CG 4.21Å; R915-F965 HydrophobicContact CG-CZ 3.72Å; L962-F965 HydrophobicContact CB-CD2 4.09Å; L962-F965 HydrophobicContact CD1-CE2 4.32Å; F965-K967 PolarHBondContact O-N 3.15Å; F965-I971 HydrophobicContact CE1-CD1 4.43Å
966	P	90.7	Very high	92.8	Very high	12 Å²	12	65 Å²	65	8%	0.078	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-48.6	128.3	174.3	-31.3	37.7	0	0	0	112.1	I858 L970 I971	I858-P966 HydrophobicContact CD1-CG 4.38Å; I858-P966 HydrophobicContact CG1-CG 4.15Å; I858-P966 HydrophobicContact CG2-CG 4.45Å; P966-L970 HydrophobicContact CB-CD2 4.1Å; P966-I971 HydrophobicContact CB-CD1 4.36Å; P966-I971 HydrophobicContact CB-CG1 3.97Å
967	K	90.5	Very high	92.9	Very high	148 Å²	148	66.6 Å²	66.6	64%	0.643	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-66.3	153.6	177.8	-67	-174.5	179.5	-178.3	0	110.3	F965 Q969 L970 I971	F965-K967 PolarHBondContact O-N 3.15Å; K967-Q969 PolarHBondContact O-N 3.45Å; K967-Q969 VanDerWaalsContact O-N 3.14Å; K967-L970 WeakPolarHBondContact O-CB 3.28Å; K967-L970 PolarHBondContact O-N 2.96Å; K967-I971 PolarHBondContact O-N 3.46Å; K967-I971 VanDerWaalsContact O-N 3.11Å
968	P	88.9	Confident	92.9	Very high	78 Å²	78	67.2 Å²	67.2	51%	0.506	34%	0.343	S	S	.	.	H	α-helix	trans	-50.8	-40.7	177.9	-29.5	35.9	0	0	0	113.6	E911 L970 I971 A972	E911-P968 HydrophobicContact CG-CB 4.41Å; E911-P968 HydrophobicContact CG-CG 4.44Å; P968-L970 VanDerWaalsContact C-N 3.33Å; P968-L970 PolarHBondContact O-N 3.14Å; P968-I971 PolarHBondContact O-N 2.87Å; P968-A972 WeakPolarHBondContact O-CB 3.21Å; P968-A972 PolarHBondContact O-N 3.04Å
969	Q	90	Very high	92.7	Very high	152 Å²	152	71.3 Å²	71.3	71%	0.71	36%	0.359	S	S	*	.	H	α-helix	trans	-59.3	-40.4	176	-67.1	164.6	-13.5	0	0	112.8	K967 A972 T973	K967-Q969 PolarHBondContact O-N 3.45Å; K967-Q969 VanDerWaalsContact O-N 3.14Å; Q969-A972 PolarHBondContact O-N 3.46Å; Q969-T973 PolarHBondContact O-N 3.25Å; Q969-T973 PolarHBondContact O-OG1 3.32Å
970	L	92.6	Very high	92.6	Very high	76 Å²	76	75.5 Å²	75.5	40%	0.398	38%	0.379	S	S	.	.	H	α-helix	trans	-71.2	-39.4	178.6	179.4	58.9	0	0	0	111.3	P966 K967 P968 A972 T973 R974	P966-L970 HydrophobicContact CB-CD2 4.1Å; K967-L970 WeakPolarHBondContact O-CB 3.28Å; K967-L970 PolarHBondContact O-N 2.96Å; P968-L970 VanDerWaalsContact C-N 3.33Å; P968-L970 PolarHBondContact O-N 3.14Å; L970-A972 VanDerWaalsContact C-N 3.33Å; L970-T973 PolarHBondContact O-N 2.97Å; L970-R974 HydrophobicContact CD1-CG 4.48Å; L970-R974 WeakPolarHBondContact O-CG 3.38Å; L970-R974 PolarHBondContact O-N 3.31Å
971	I	94.1	Very high	92.3	Very high	1 Å²	1	73.2 Å²	73.2	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-61.6	-45.1	174.3	-64.9	174.1	0	0	0	109.7	V854 E911 F914 F965 P966 K967 P968 T973 R974 R975	V854-I971 HydrophobicContact CG1-CG2 4.36Å; E911-I971 HydrophobicContact CB-CD1 4.32Å; E911-I971 HydrophobicContact CG-CD1 3.85Å; F914-I971 HydrophobicContact CE2-CG2 4.06Å; F914-I971 HydrophobicContact CZ-CG2 4.38Å; F965-I971 HydrophobicContact CE1-CD1 4.43Å; P966-I971 HydrophobicContact CB-CD1 4.36Å; P966-I971 HydrophobicContact CB-CG1 3.97Å; K967-I971 PolarHBondContact O-N 3.46Å; K967-I971 VanDerWaalsContact O-N 3.11Å; P968-I971 PolarHBondContact O-N 2.87Å; I971-T973 PolarHBondContact O-N 3.41Å; I971-R974 PolarHBondContact O-N 3.13Å; I971-R975 HydrophobicContact CG2-CG 4.43Å; I971-R975 WeakPolarHBondContact O-CB 3.4Å; I971-R975 WeakPolarHBondContact O-CG 3.08Å; I971-R975 PolarHBondContact O-N 3.4Å
972	A	92.8	Very high	92	Very high	54 Å²	54	70 Å²	70	45%	0.446	36%	0.355	S	S	.	.	H	α-helix	trans	-60.1	-44.2	175.8	0	0	0	0	0	112.4	P968 Q969 L970 R974 R975 A976	P968-A972 WeakPolarHBondContact O-CB 3.21Å; P968-A972 PolarHBondContact O-N 3.04Å; Q969-A972 PolarHBondContact O-N 3.46Å; L970-A972 VanDerWaalsContact C-N 3.33Å; A972-R974 PolarHBondContact O-N 3.42Å; A972-R975 WeakPolarHBondContact O-CB 3.47Å; A972-R975 PolarHBondContact O-N 2.89Å; A972-A976 PolarHBondContact O-N 3.41Å
973	T	94.8	Very high	91.5	Very high	95 Å²	95	71 Å²	71	58%	0.583	36%	0.362	S	S	*	.	H	α-helix	trans	-61.4	-43.3	175.6	-58.5	0	0	0	0	111.9	Q969 L970 I971 A976 Y977	Q969-T973 PolarHBondContact O-N 3.25Å; Q969-T973 PolarHBondContact O-OG1 3.32Å; L970-T973 PolarHBondContact O-N 2.97Å; I971-T973 PolarHBondContact O-N 3.41Å; T973-A976 PolarHBondContact O-N 2.89Å; T973-Y977 PolarHBondContact O-N 3.24Å
974	R	96.5	Very high	91.2	Very high	30 Å²	30	68.4 Å²	68.4	11%	0.113	36%	0.356	C	S	.	.	H	α-helix	trans	-65.3	-41.2	176.4	-70.4	173.4	-179.2	-173.4	1.9	111.9	V854 E857 E861 L970 I971 A972 Y977 H978	V854-R974 HydrophobicContact CG1-CB 4.24Å; V854-R974 HydrophobicContact CG2-CB 3.89Å; E857-R974 VanDerWaalsContact OE2-CD 3.23Å; E857-R974 WeakPolarHBondContact OE2-CD 3.48Å; E857-R974 IonicContact OE2-NE 3.11Å; E861-R974 VanDerWaalsContact CD-NH2 3.3Å; E861-R974 IonicContact OE1-CZ 3.12Å; E861-R974 IonicContact OE1-NH1 2.65Å; E861-R974 PolarHBondContact OE1-NH1 3.16Å; E861-R974 IonicContact OE1-NH2 3.74Å; E861-R974 PolarHBondContact OE1-NH2 2.82Å; E861-R974 IonicContact OE2-CZ 2.69Å; E861-R974 IonicContact OE2-NH1 2.76Å; E861-R974 PolarHBondContact OE2-NH1 3.36Å; E861-R974 IonicContact OE2-NH2 2.72Å; E861-R974 PolarHBondContact OE2-NH2 2.91Å; L970-R974 HydrophobicContact CD1-CG 4.48Å; L970-R974 WeakPolarHBondContact O-CG 3.38Å; L970-R974 PolarHBondContact O-N 3.31Å; I971-R974 PolarHBondContact O-N 3.13Å; A972-R974 PolarHBondContact O-N 3.42Å; R974-Y977 PolarHBondContact O-N 2.7Å; R974-H978 PolarHBondContact O-CD2 3Å; R974-H978 PolarHBondContact O-N 3.47Å
975	R	95.1	Very high	90.6	Very high	36 Å²	36	69.5 Å²	69.5	14%	0.136	35%	0.349	C	S	.	.	H	α-helix	trans	-57.1	-50.3	173.8	-77.7	174	164.2	164.5	-10.5	110.9	V850 D851 V854 S910 I971 A972 Y977 H978 Y979	V850-R975 HydrophobicContact CG1-CB 3.98Å; V850-R975 HydrophobicContact CG1-CG 4.05Å; V850-R975 WeakPolarHBondContact CG1-O 3.41Å; D851-R975 IonicContact OD1-CZ 3.22Å; D851-R975 IonicContact OD1-NE 2.82Å; D851-R975 PolarHBondContact OD1-NE 3.03Å; D851-R975 IonicContact OD1-NH2 3.76Å; D851-R975 PolarHBondContact OD1-NH2 2.89Å; D851-R975 IonicContact OD2-CZ 2.63Å; D851-R975 IonicContact OD2-NE 2.71Å; D851-R975 IonicContact OD2-NH2 3.7Å; D851-R975 PolarHBondContact OD2-NH2 2.92Å; V854-R975 HydrophobicContact CG2-CG 4.09Å; S910-R975 PolarHBondContact OG-NH1 2.92Å; S910-R975 VanDerWaalsContact OG-NH1 3.11Å; S910-R975 PolarHBondContact OG-NH2 3.47Å; I971-R975 HydrophobicContact CG2-CG 4.43Å; I971-R975 WeakPolarHBondContact O-CB 3.4Å; I971-R975 WeakPolarHBondContact O-CG 3.08Å; I971-R975 PolarHBondContact O-N 3.4Å; A972-R975 WeakPolarHBondContact O-CB 3.47Å; A972-R975 PolarHBondContact O-N 2.89Å; R975-Y977 PolarHBondContact O-N 3.03Å; R975-H978 PolarHBondContact O-N 3.15Å; R975-Y979 WeakPolarHBondContact O-CB 3.38Å; R975-Y979 PolarHBondContact O-N 3.19Å
976	A	93.6	Very high	89.8	Confident	64 Å²	64	71.4 Å²	71.4	53%	0.529	36%	0.359	S	S	.	.	H	α-helix	trans	-59.5	-44.6	179	0	0	0	0	0	112.4	A972 T973 Y979 E980	A972-A976 PolarHBondContact O-N 3.41Å; T973-A976 PolarHBondContact O-N 2.89Å; A976-Y979 PolarHBondContact O-N 3.21Å; A976-E980 PolarHBondContact O-N 3.21Å; A976-E980 VanDerWaalsContact O-N 3.1Å
977	Y	94.7	Very high	89.1	Confident	138 Å²	138	74.6 Å²	74.6	54%	0.541	38%	0.381	S	S	.	.	H	α-helix	trans	-60	-51.3	177.2	174.4	-104.2	0	0	0	112.6	T973 R974 R975 Y979 E980 I981	T973-Y977 PolarHBondContact O-N 3.24Å; R974-Y977 PolarHBondContact O-N 2.7Å; R975-Y977 PolarHBondContact O-N 3.03Å; Y977-Y979 VanDerWaalsContact C-N 3.34Å; Y977-Y979 PolarHBondContact O-N 3.32Å; Y977-E980 PolarHBondContact O-N 2.84Å; Y977-I981 HydrophobicContact CD1-CD1 4.04Å; Y977-I981 HydrophobicContact CD2-CD1 4.5Å; Y977-I981 HydrophobicContact CE1-CD1 3.45Å; Y977-I981 VanDerWaalsContact CE1-CD1 3.45Å; Y977-I981 HydrophobicContact CE2-CD1 3.98Å; Y977-I981 VanDerWaalsContact CZ-CD1 3.43Å; Y977-I981 PolarHBondContact O-N 3.19Å
978	H	94.3	Very high	88.3	Confident	16 Å²	16	73.4 Å²	73.4	7%	0.074	38%	0.381	C	S	.	.	H	α-helix	trans	-69.1	-33.4	-179.8	-76.5	-55.4	0	0	0	112.7	V850 L853 E857 R974 R975 I981 L982	V850-H978 HydrophobicContact CG1-CB 4Å; V850-H978 HydrophobicContact CG2-CB 4.33Å; L853-H978 HydrophobicContact CB-CB 4.36Å; L853-H978 HydrophobicContact CD1-CB 4.08Å; E857-H978 VanDerWaalsContact CD-NE2 3.27Å; E857-H978 IonicContact OE1-CD2 3.53Å; E857-H978 IonicContact OE1-CE1 2.88Å; E857-H978 PolarHBondContact OE1-CE1 3.23Å; E857-H978 VanDerWaalsContact OE1-CE1 3.23Å; E857-H978 IonicContact OE1-NE2 3.78Å; E857-H978 PolarHBondContact OE1-NE2 2.82Å; E857-H978 IonicContact OE2-NE2 3.82Å; R974-H978 PolarHBondContact O-CD2 3Å; R974-H978 PolarHBondContact O-N 3.47Å; R975-H978 PolarHBondContact O-N 3.15Å; H978-I981 PolarHBondContact O-N 3Å; H978-L982 WeakPolarHBondContact O-CB 3.3Å; H978-L982 PolarHBondContact O-N 3.11Å
979	Y	92.5	Very high	87.1	Confident	86 Å²	86	75.9 Å²	75.9	34%	0.337	38%	0.384	S	S	.	.	H	α-helix	trans	-60.4	-45.5	174.2	-178.2	-93	0	0	0	111.1	I846 D847 V850 R975 A976 Y977 I981 L982 S983	I846-Y979 HydrophobicContact CD1-CE2 4.46Å; I846-Y979 HydrophobicContact CG2-CD2 4.18Å; I846-Y979 HydrophobicContact CG2-CE2 3.62Å; D847-Y979 WeakPolarHBondContact OD1-CD2 3.45Å; D847-Y979 WeakPolarHBondContact OD1-CE2 3.31Å; V850-Y979 HydrophobicContact CG2-CD2 4.28Å; R975-Y979 WeakPolarHBondContact O-CB 3.38Å; R975-Y979 PolarHBondContact O-N 3.19Å; A976-Y979 PolarHBondContact O-N 3.21Å; Y977-Y979 VanDerWaalsContact C-N 3.34Å; Y977-Y979 PolarHBondContact O-N 3.32Å; Y979-I981 VanDerWaalsContact C-N 3.3Å; Y979-I981 PolarHBondContact O-N 3.46Å; Y979-L982 PolarHBondContact O-N 2.67Å; Y979-S983 WeakPolarHBondContact O-CB 3.17Å; Y979-S983 PolarHBondContact O-N 2.84Å; Y979-S983 PolarHBondContact O-OG 3.24Å
980	E	90.4	Very high	85.8	Confident	101 Å²	101	75 Å²	75	47%	0.472	38%	0.377	S	S	.	.	H	α-helix	trans	-60.3	-41.2	177.6	-168	-176.4	170	0	0	111.6	A976 Y977 S983 K984	A976-E980 PolarHBondContact O-N 3.21Å; A976-E980 VanDerWaalsContact O-N 3.1Å; Y977-E980 PolarHBondContact O-N 2.84Å; E980-S983 WeakPolarHBondContact CA-OG 3.49Å; E980-S983 PolarHBondContact O-OG 2.94Å; E980-K984 HydrophobicContact CG-CD 4.32Å; E980-K984 WeakPolarHBondContact O-CB 3.42Å; E980-K984 WeakPolarHBondContact O-CG 3.17Å; E980-K984 PolarHBondContact O-N 3.47Å; E980-K984 VanDerWaalsContact O-N 3.12Å; E980-K984 WeakPolarHBondContact OE1-CE 3.23Å; E980-K984 IonicContact OE1-NZ 2.9Å; E980-K984 PolarHBondContact OE1-NZ 3.47Å
981	I	88.6	Confident	84.3	Confident	54 Å²	54	72.4 Å²	72.4	28%	0.277	37%	0.368	S	S	.	.	H	α-helix	trans	-66.6	-49.8	178.3	-66	171.1	0	0	0	111.2	Y977 H978 Y979 K985	Y977-I981 HydrophobicContact CD1-CD1 4.04Å; Y977-I981 HydrophobicContact CD2-CD1 4.5Å; Y977-I981 HydrophobicContact CE1-CD1 3.45Å; Y977-I981 VanDerWaalsContact CE1-CD1 3.45Å; Y977-I981 HydrophobicContact CE2-CD1 3.98Å; Y977-I981 VanDerWaalsContact CZ-CD1 3.43Å; Y977-I981 PolarHBondContact O-N 3.19Å; H978-I981 PolarHBondContact O-N 3Å; Y979-I981 VanDerWaalsContact C-N 3.3Å; Y979-I981 PolarHBondContact O-N 3.46Å; I981-K985 HydrophobicContact CG2-CD 4.26Å; I981-K985 WeakPolarHBondContact O-CG 3.39Å; I981-K985 PolarHBondContact O-N 2.88Å
982	L	86.5	Confident	82.5	Confident	25 Å²	25	79.8 Å²	79.8	13%	0.131	40%	0.397	C	S	.	.	H	α-helix	trans	-70	-40.3	-176.8	-75.1	176.6	0	0	0	111.8	I846 Q849 V850 L853 H978 Y979 K985 M986	I846-L982 HydrophobicContact CD1-CB 4.36Å; I846-L982 HydrophobicContact CG1-CB 4.14Å; Q849-L982 HydrophobicContact CB-CD1 3.9Å; V850-L982 HydrophobicContact CG2-CD1 3.77Å; L853-L982 HydrophobicContact CD1-CD1 3.64Å; L853-L982 HydrophobicContact CD1-CD2 4.28Å; L853-L982 HydrophobicContact CD1-CG 3.96Å; L853-L982 HydrophobicContact CG-CD1 4.49Å; H978-L982 WeakPolarHBondContact O-CB 3.3Å; H978-L982 PolarHBondContact O-N 3.11Å; Y979-L982 PolarHBondContact O-N 2.67Å; L982-K985 PolarHBondContact O-N 3.06Å; L982-M986 WeakPolarHBondContact O-CB 3.4Å; L982-M986 PolarHBondContact O-N 3.3Å
983	S	83.8	Confident	80.2	Confident	25 Å²	25	84.1 Å²	84.1	18%	0.175	40%	0.402	C	S	.	.	H	α-helix	trans	-64.8	-39.4	177.1	61.6	0	0	0	0	112	Y979 E980 M986 S987	Y979-S983 WeakPolarHBondContact O-CB 3.17Å; Y979-S983 PolarHBondContact O-N 2.84Å; Y979-S983 PolarHBondContact O-OG 3.24Å; E980-S983 WeakPolarHBondContact CA-OG 3.49Å; E980-S983 PolarHBondContact O-OG 2.94Å; S983-M986 PolarHBondContact O-N 3.48Å; S983-S987 WeakPolarHBondContact O-CB 3.15Å; S983-S987 PolarHBondContact O-N 3.37Å; S983-S987 PolarHBondContact O-OG 3.4Å
984	K	82.8	Confident	77.8	Confident	113 Å²	113	84.1 Å²	84.1	49%	0.491	40%	0.395	S	S	.	.	H	α-helix	trans	-62.4	-47.8	170.3	-75	175.3	-174.1	173.2	0	111.3	E980 M986 S987 I988	E980-K984 HydrophobicContact CG-CD 4.32Å; E980-K984 WeakPolarHBondContact O-CB 3.42Å; E980-K984 WeakPolarHBondContact O-CG 3.17Å; E980-K984 PolarHBondContact O-N 3.47Å; E980-K984 VanDerWaalsContact O-N 3.12Å; E980-K984 WeakPolarHBondContact OE1-CE 3.23Å; E980-K984 IonicContact OE1-NZ 2.9Å; E980-K984 PolarHBondContact OE1-NZ 3.47Å; K984-M986 PolarHBondContact O-N 3.27Å; K984-S987 PolarHBondContact O-N 3.05Å; K984-I988 WeakPolarHBondContact O-CB 3.49Å; K984-I988 WeakPolarHBondContact O-CD1 3.48Å; K984-I988 WeakPolarHBondContact O-CG1 3.5Å; K984-I988 PolarHBondContact O-N 3.21Å
985	K	77.2	Confident	75.3	Confident	135 Å²	135	86.9 Å²	86.9	59%	0.587	41%	0.413	S	S	*	.	H	α-helix	trans	-59.9	-43.4	177.3	-76.8	178.1	179.6	177.9	0	112.4	I981 L982 K989	I981-K985 HydrophobicContact CG2-CD 4.26Å; I981-K985 WeakPolarHBondContact O-CG 3.39Å; I981-K985 PolarHBondContact O-N 2.88Å; L982-K985 PolarHBondContact O-N 3.06Å; K985-K989 VanDerWaalsContact O-CB 3.28Å; K985-K989 WeakPolarHBondContact O-CB 3.29Å; K985-K989 PolarHBondContact O-N 2.96Å
986	M	75	Confident	72.9	Confident	60 Å²	60	88.7 Å²	88.7	30%	0.296	43%	0.427	S	S	.	.	H	α-helix	trans	-68.3	-38.6	176.1	-92.3	179.2	178.1	0	0	112.2	G844 I846 L982 S983 K984 K989 K990	G844-M986 WeakPolarHBondContact O-CE 3.38Å; I846-M986 HydrophobicContact CB-SD 4.16Å; I846-M986 HydrophobicContact CD1-SD 3.55Å; I846-M986 VanDerWaalsContact CD1-SD 3.55Å; I846-M986 HydrophobicContact CG1-CE 4.49Å; I846-M986 HydrophobicContact CG1-SD 3.74Å; L982-M986 WeakPolarHBondContact O-CB 3.4Å; L982-M986 PolarHBondContact O-N 3.3Å; S983-M986 PolarHBondContact O-N 3.48Å; K984-M986 PolarHBondContact O-N 3.27Å; M986-K989 PolarHBondContact O-N 3.33Å; M986-K990 WeakPolarHBondContact O-CB 3.42Å; M986-K990 PolarHBondContact O-N 2.94Å
987	S	76.3	Confident	70.3	Confident	79 Å²	79	92 Å²	92	55%	0.552	43%	0.434	S	S	*	.	H	α-helix	trans	-68.3	-40.4	177.3	-60.5	0	0	0	0	111.6	S983 K984 K990 G991	S983-S987 WeakPolarHBondContact O-CB 3.15Å; S983-S987 PolarHBondContact O-N 3.37Å; S983-S987 PolarHBondContact O-OG 3.4Å; K984-S987 PolarHBondContact O-N 3.05Å; S987-K990 PolarHBondContact O-N 3.1Å; S987-G991 PolarHBondContact O-N 3.37Å
988	I	73.2	Confident	67.8	Low	124 Å²	124	93.5 Å²	93.5	64%	0.636	44%	0.443	S	S	*	.	H	α-helix	trans	-62.9	-45.8	172	-67.8	163.3	0	0	0	109.9	K984 G991 Y992	K984-I988 WeakPolarHBondContact O-CB 3.49Å; K984-I988 WeakPolarHBondContact O-CD1 3.48Å; K984-I988 WeakPolarHBondContact O-CG1 3.5Å; K984-I988 PolarHBondContact O-N 3.21Å; I988-G991 PolarHBondContact O-N 3.26Å; I988-Y992 VanDerWaalsContact O-CB 3.3Å; I988-Y992 WeakPolarHBondContact O-CB 3.43Å; I988-Y992 PolarHBondContact O-N 3.43Å
989	K	64.7	Low	64.7	Low	130 Å²	130	99.2 Å²	99.2	57%	0.565	47%	0.47	S	S	*	.	H	α-helix	trans	-63.4	-44	178	-167.3	176.4	-178.4	-177.3	0	110.9	K985 M986 Y992 W993	K985-K989 VanDerWaalsContact O-CB 3.28Å; K985-K989 WeakPolarHBondContact O-CB 3.29Å; K985-K989 PolarHBondContact O-N 2.96Å; M986-K989 PolarHBondContact O-N 3.33Å; K989-Y992 WeakPolarHBondContact O-CB 3.3Å; K989-Y992 PolarHBondContact O-N 2.81Å; K989-W993 PolarHBondContact O-N 3.04Å
990	K	61.4	Low	61.9	Low	134 Å²	134	97.9 Å²	97.9	58%	0.583	47%	0.473	S	S	*	.	H	α-helix	trans	-64.5	-42.9	176.7	-172.9	177.7	-178.5	179.4	0	111.2	M986 S987 W993 Q994	M986-K990 WeakPolarHBondContact O-CB 3.42Å; M986-K990 PolarHBondContact O-N 2.94Å; S987-K990 PolarHBondContact O-N 3.1Å; K990-W993 CarbonylContact O-C 3.52Å; K990-W993 PolarHBondContact O-N 3.36Å; K990-Q994 HydrophobicContact CG-CG 4.37Å; K990-Q994 VanDerWaalsContact O-CB 3.28Å; K990-Q994 WeakPolarHBondContact O-CB 3.47Å; K990-Q994 VanDerWaalsContact O-CG 3.23Å; K990-Q994 WeakPolarHBondContact O-CG 3.2Å; K990-Q994 PolarHBondContact O-N 3.5Å
991	G	61.8	Low	59.5	Low	20 Å²	20	97.8 Å²	97.8	21%	0.206	48%	0.481	C	S	.	.	H	α-helix	trans	-63.2	-42.3	174	0	0	0	0	0	111.8	S987 I988 W993 Q994 N995	S987-G991 PolarHBondContact O-N 3.37Å; I988-G991 PolarHBondContact O-N 3.26Å; G991-W993 PolarHBondContact O-N 3.22Å; G991-Q994 PolarHBondContact O-N 2.83Å; G991-N995 VanDerWaalsContact O-CB 3.27Å; G991-N995 WeakPolarHBondContact O-CB 3.41Å; G991-N995 PolarHBondContact O-N 2.92Å; G991-N995 PolarHBondContact O-OD1 3.29Å
992	Y	56.4	Low	56.9	Low	157 Å²	157	102.8 Å²	102.8	62%	0.616	51%	0.508	S	S	*	.	H	α-helix	trans	-59.6	-47.4	172.3	-174.3	-95.7	0	0	0	111	I988 K989 N995 V996	I988-Y992 VanDerWaalsContact O-CB 3.3Å; I988-Y992 WeakPolarHBondContact O-CB 3.43Å; I988-Y992 PolarHBondContact O-N 3.43Å; K989-Y992 WeakPolarHBondContact O-CB 3.3Å; K989-Y992 PolarHBondContact O-N 2.81Å; Y992-N995 PolarHBondContact O-N 3.48Å; Y992-V996 HydrophobicContact CD1-CG2 4.12Å; Y992-V996 HydrophobicContact CE1-CG2 3.88Å; Y992-V996 VanDerWaalsContact O-CB 3.29Å; Y992-V996 WeakPolarHBondContact O-CB 3.46Å; Y992-V996 WeakPolarHBondContact O-CG2 3.43Å; Y992-V996 PolarHBondContact O-N 3.36Å
993	W	44	Very low	54.2	Low	145 Å²	145	109.9 Å²	109.9	55%	0.549	54%	0.541	S	S	.	.	H	α-helix	trans	-66.3	-36.2	175.8	-75	112.9	0	0	0	113.2	K989 K990 G991 M997	K989-W993 PolarHBondContact O-N 3.04Å; K990-W993 CarbonylContact O-C 3.52Å; K990-W993 PolarHBondContact O-N 3.36Å; G991-W993 PolarHBondContact O-N 3.22Å; W993-M997 VanDerWaalsContact O-CB 3.31Å; W993-M997 WeakPolarHBondContact O-CB 3.39Å; W993-M997 VanDerWaalsContact O-CG 3.27Å; W993-M997 WeakPolarHBondContact O-CG 3.27Å; W993-M997 PolarHBondContact O-N 2.62Å
994	Q	45	Very low	51.5	Low	94 Å²	94	116.6 Å²	116.6	44%	0.439	57%	0.567	S	S	.	*	H	α-helix	trans	-71.6	-36.8	177.2	-78.2	179	-18.5	0	0	112	K990 G991 M997 K998	K990-Q994 HydrophobicContact CG-CG 4.37Å; K990-Q994 VanDerWaalsContact O-CB 3.28Å; K990-Q994 WeakPolarHBondContact O-CB 3.47Å; K990-Q994 VanDerWaalsContact O-CG 3.23Å; K990-Q994 WeakPolarHBondContact O-CG 3.2Å; K990-Q994 PolarHBondContact O-N 3.5Å; G991-Q994 PolarHBondContact O-N 2.83Å; Q994-M997 CarbonylContact O-C 3.53Å; Q994-M997 PolarHBondContact O-N 2.91Å; Q994-K998 VanDerWaalsContact O-CB 3.31Å; Q994-K998 WeakPolarHBondContact O-CB 3.11Å; Q994-K998 WeakPolarHBondContact O-CG 3.49Å; Q994-K998 PolarHBondContact O-N 3.34Å
995	N	44.8	Very low	49.2	Very low	88 Å²	88	118.2 Å²	118.2	47%	0.471	58%	0.58	S	S	.	*	H	α-helix	trans	-69.6	-44.2	173.6	-68.1	0.1	0	0	0	109.6	G991 Y992 M997 K998 E999	G991-N995 VanDerWaalsContact O-CB 3.27Å; G991-N995 WeakPolarHBondContact O-CB 3.41Å; G991-N995 PolarHBondContact O-N 2.92Å; G991-N995 PolarHBondContact O-OD1 3.29Å; Y992-N995 PolarHBondContact O-N 3.48Å; N995-M997 PolarHBondContact O-N 3.32Å; N995-K998 PolarHBondContact O-N 2.9Å; N995-K998 VanDerWaalsContact O-N 3.09Å; N995-E999 VanDerWaalsContact O-CB 3.23Å; N995-E999 WeakPolarHBondContact O-CB 3.28Å; N995-E999 WeakPolarHBondContact O-CG 3.42Å; N995-E999 PolarHBondContact O-N 3.15Å
996	V	45	Very low	47.3	Very low	74 Å²	74	120.3 Å²	120.3	45%	0.448	59%	0.592	S	S	.	*	H	α-helix	trans	-59.8	-27.2	170.9	171.1	0	0	0	0	112	Y992	Y992-V996 HydrophobicContact CD1-CG2 4.12Å; Y992-V996 HydrophobicContact CE1-CG2 3.88Å; Y992-V996 VanDerWaalsContact O-CB 3.29Å; Y992-V996 WeakPolarHBondContact O-CB 3.46Å; Y992-V996 WeakPolarHBondContact O-CG2 3.43Å; Y992-V996 PolarHBondContact O-N 3.36Å
997	M	38.5	Very low	45.2	Very low	134 Å²	134	123.7 Å²	123.7	66%	0.66	61%	0.611	S	S	*	*	H	α-helix	trans	-89.7	-19.3	174.9	-77.6	-161.1	171.5	0	0	115	W993 Q994 N995	W993-M997 VanDerWaalsContact O-CB 3.31Å; W993-M997 WeakPolarHBondContact O-CB 3.39Å; W993-M997 VanDerWaalsContact O-CG 3.27Å; W993-M997 WeakPolarHBondContact O-CG 3.27Å; W993-M997 PolarHBondContact O-N 2.62Å; Q994-M997 CarbonylContact O-C 3.53Å; Q994-M997 PolarHBondContact O-N 2.91Å; N995-M997 PolarHBondContact O-N 3.32Å
998	K	42	Very low	43.3	Very low	170 Å²	170	125 Å²	125	74%	0.739	61%	0.608	S	S	*	*	H	α-helix	trans	-98.2	-24.7	177.8	-77.2	-176.7	176.2	-174.6	0	112.7	Q994 N995 S1000	Q994-K998 VanDerWaalsContact O-CB 3.31Å; Q994-K998 WeakPolarHBondContact O-CB 3.11Å; Q994-K998 WeakPolarHBondContact O-CG 3.49Å; Q994-K998 PolarHBondContact O-N 3.34Å; N995-K998 PolarHBondContact O-N 2.9Å; N995-K998 VanDerWaalsContact O-N 3.09Å; K998-S1000 PolarHBondContact O-N 3.43Å
999	E	29.5	Very low	41.5	Very low	135 Å²	135	125.2 Å²	125.2	63%	0.631	61%	0.611	S	S	*	*			trans	-82.7	66.7	173.5	-68.8	174.8	-168.2	0	0	110.3	N995	N995-E999 VanDerWaalsContact O-CB 3.23Å; N995-E999 WeakPolarHBondContact O-CB 3.28Å; N995-E999 WeakPolarHBondContact O-CG 3.42Å; N995-E999 PolarHBondContact O-N 3.15Å
1000	S	33.8	Very low	40	Very low	59 Å²	59	127.3 Å²	127.3	41%	0.413	62%	0.622	S	S	.	*	S	Bend	trans	-160.7	135.6	135.1	63.3	0	0	0	0	110.7	K998 E1065	K998-S1000 PolarHBondContact O-N 3.43Å; S1000-E1065 VanDerWaalsContact CB-OE1 3.27Å; S1000-E1065 WeakPolarHBondContact CB-OE1 3.46Å; S1000-E1065 WeakPolarHBondContact CB-OE2 3.45Å; S1000-E1065 PolarHBondContact OG-OE2 3.18Å
1001	P	38.9	Very low	38.7	Very low	98 Å²	98	125.7 Å²	125.7	64%	0.636	62%	0.623	S	S	*	*	S	Bend	cis	-135.9	95	-0.4	36.5	-13.9	0	0	0	112.8
1002	D	33.6	Very low	37.4	Very low	159 Å²	159	130.4 Å²	130.4	85%	0.85	64%	0.64	S	S	*	*	S	Bend	trans	-141.2	-13	164.5	-90.5	-34	0	0	0	115.1
1003	E	30.1	Very low	36.2	Very low	174 Å²	174	131.2 Å²	131.2	81%	0.813	65%	0.649	S	S	*	*	S	Bend	trans	-108.4	20.7	175.9	-74.8	-169.2	166.3	0	0	114.5	I1005	E1003-I1005 PolarHBondContact O-N 2.86Å
1004	F	28.5	Very low	35.5	Very low	166 Å²	166	133.8 Å²	133.8	73%	0.728	66%	0.664	S	S	*	*			trans	-80.7	7.3	173.1	-132.5	-90	0	0	0	114.3
1005	I	34.8	Very low	34.9	Very low	148 Å²	148	139 Å²	139	76%	0.759	68%	0.68	S	S	*	*	S	Bend	trans	-94	-23.7	-175.7	-65.5	-177.8	0	0	0	114.4	E1003	E1003-I1005 PolarHBondContact O-N 2.86Å
1006	E	35.8	Very low	34.3	Very low	178 Å²	178	139 Å²	139	83%	0.832	69%	0.686	S	S	*	*	S	Bend	trans	-101	-14.6	-176.2	-81.1	-168.5	157.5	0	0	116.9
1007	N	31.7	Very low	33.8	Very low	132 Å²	132	142.3 Å²	142.3	71%	0.706	71%	0.707	S	S	*	*	S	Bend	trans	-98.1	11	178.2	-83.2	-35.3	0	0	0	115.5	N1009	N1007-N1009 PolarHBondContact O-N 2.85Å
1008	Q	36.7	Very low	33.5	Very low	105 Å²	105	144.6 Å²	144.6	49%	0.491	71%	0.713	S	S	.	*	H	α-helix	trans	-66.8	-15.2	177.2	-72	-163.1	5	0	0	114.5	Q1012	Q1008-Q1012 WeakPolarHBondContact O-CG 3.45Å
1009	N	34.1	Very low	33.6	Very low	129 Å²	129	145.1 Å²	145.1	69%	0.69	72%	0.718	S	S	*	*	H	α-helix	trans	-85.1	-16.7	-176.3	-70.2	-22.1	0	0	0	115	N1007	N1007-N1009 PolarHBondContact O-N 2.85Å
1010	H	33.2	Very low	34.4	Very low	174 Å²	174	143.7 Å²	143.7	81%	0.806	72%	0.715	S	S	*	*	H	α-helix	trans	-102.6	-11.1	-178.6	-88.2	-58	0	0	0	115.9
1011	V	34.4	Very low	35.8	Very low	100 Å²	100	145.6 Å²	145.6	61%	0.606	72%	0.718	S	S	*	*	H	α-helix	trans	-97.5	-11.2	177.1	-178	0	0	0	0	113.1	H1013	V1011-H1013 VanDerWaalsContact C-N 3.28Å; V1011-H1013 PolarHBondContact O-N 3.43Å
1012	Q	34.6	Very low	37.7	Very low	120 Å²	120	141.7 Å²	141.7	56%	0.561	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-67.8	-22.4	178.5	-73.8	-175	8.2	0	0	114	Q1008	Q1008-Q1012 WeakPolarHBondContact O-CG 3.45Å
1013	H	31	Very low	40.1	Very low	173 Å²	173	135.4 Å²	135.4	80%	0.801	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-89.1	-0.7	-176	-85.5	-66.8	0	0	0	116.8	V1011	V1011-H1013 VanDerWaalsContact C-N 3.28Å; V1011-H1013 PolarHBondContact O-N 3.43Å
1014	K	29.3	Very low	42.9	Very low	199 Å²	199	127.1 Å²	127.1	87%	0.865	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-114.7	9.9	171.8	-85.7	-174.1	178	177	0	114.7	S1016	K1014-S1016 PolarHBondContact O-N 3.18Å
1015	R	33.5	Very low	45.8	Very low	204 Å²	204	119.4 Å²	119.4	77%	0.77	59%	0.588	S	S	*	*	S	Bend	trans	-75.3	-0.8	173.8	-83	-174.4	173.8	-177.8	-3.3	114.6
1016	S	31.4	Very low	48.5	Very low	87 Å²	87	112.5 Å²	112.5	61%	0.608	55%	0.553	S	S	*	*	S	Bend	trans	-121.8	105.5	176	52.3	0	0	0	0	110.3	K1014	K1014-S1016 PolarHBondContact O-N 3.18Å
1017	T	33.6	Very low	51.2	Low	145 Å²	145	104.6 Å²	104.6	89%	0.89	52%	0.517	S	S	*	.	S	Bend	trans	167.7	-0.5	146.1	36.8	0	0	0	0	115.7
1018	K	33.4	Very low	54.1	Low	181 Å²	181	99.4 Å²	99.4	79%	0.787	49%	0.49	S	S	*	.	S	Bend	trans	-127.3	122.3	156	-75.3	-173.2	176.7	-177.8	0	107.9	N1020	K1018-N1020 PolarHBondContact O-N 2.63Å
1019	E	42.9	Very low	56.7	Low	181 Å²	181	95.1 Å²	95.1	85%	0.846	47%	0.469	S	S	*	.			trans	-55.2	94.3	165.8	-67.8	177.8	156.4	0	0	107.2	Q1021	E1019-Q1021 VanDerWaalsContact C-N 3.35Å; E1019-Q1021 PolarHBondContact O-N 2.91Å
1020	N	46.2	Very low	59.3	Low	105 Å²	105	89.4 Å²	89.4	56%	0.561	44%	0.438	S	S	*	.			trans	-64.6	101.9	175	-89.4	-5.6	0	0	0	106.3	K1018 A1022	K1018-N1020 PolarHBondContact O-N 2.63Å; N1020-A1022 VanDerWaalsContact C-N 3.32Å; N1020-A1022 PolarHBondContact O-N 3.12Å
1021	Q	65.3	Low	61.7	Low	100 Å²	100	83 Å²	83	47%	0.467	41%	0.41	S	S	.	.			trans	-65.8	94.4	174.8	-69.3	179.7	-23.7	0	0	108	E1019 V1023 Y1403	E1019-Q1021 VanDerWaalsContact C-N 3.35Å; E1019-Q1021 PolarHBondContact O-N 2.91Å; Q1021-V1023 PolarHBondContact O-N 3.04Å; Q1021-Y1403 HydrophobicContact CB-CD1 3.6Å; Q1021-Y1403 HydrophobicContact CB-CE1 4.05Å; Q1021-Y1403 HydrophobicContact CB-CG 3.99Å
1022	A	77.2	Confident	64	Low	15 Å²	15	82 Å²	82	12%	0.124	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-59.4	126.3	175.7	0	0	0	0	0	109	N1020 Y1039 F1404	N1020-A1022 VanDerWaalsContact C-N 3.32Å; N1020-A1022 PolarHBondContact O-N 3.12Å; A1022-Y1039 HydrophobicContact CB-CD2 3.93Å; A1022-F1404 HydrophobicContact CB-CB 4.22Å; A1022-F1404 VanDerWaalsContact O-CB 3.29Å; A1022-F1404 WeakPolarHBondContact O-CB 3.34Å; A1022-F1404 PolarHBondContact O-N 3.43Å
1023	V	84.7	Confident	66.3	Low	27 Å²	27	80.7 Å²	80.7	16%	0.164	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	138.4	-177.1	175.3	0	0	0	0	108.3	Q1021 Q1025 Y1039 G1040 T1402 Y1403	Q1021-V1023 PolarHBondContact O-N 3.04Å; V1023-Q1025 WeakPolarHBondContact O-CG 3.12Å; V1023-Q1025 PolarHBondContact O-N 3.43Å; V1023-Y1039 CarbonylContact O-C 3.53Å; V1023-Y1039 WeakPolarHBondContact O-CA 3.29Å; V1023-Y1039 WeakPolarHBondContact O-CB 3.39Å; V1023-G1040 PolarHBondContact N-O 2.91Å; V1023-G1040 PolarHBondContact O-N 3.37Å; V1023-T1402 WeakPolarHBondContact CA-O 3.47Å; V1023-T1402 HydrophobicContact CG1-CG2 4.37Å; V1023-Y1403 HydrophobicContact CG2-CD1 3.86Å; V1023-Y1403 HydrophobicContact CG2-CE1 3.84Å
1024	I	88.1	Confident	69.1	Low	0 Å²	0	74.4 Å²	74.4	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	120.8	169.5	-58.4	179.2	0	0	0	108	I1037 R1383 F1384 C1400 T1402 F1404 A1409 V1410	I1024-I1037 HydrophobicContact CG2-CG2 3.84Å; I1024-R1383 WeakPolarHBondContact O-CD 3.36Å; I1024-R1383 PolarHBondContact O-NE 3.2Å; I1024-R1383 VanDerWaalsContact O-NE 3.16Å; I1024-F1384 HydrophobicContact CB-CE2 4.32Å; I1024-F1384 HydrophobicContact CG2-CD2 3.8Å; I1024-F1384 HydrophobicContact CG2-CE2 3.71Å; I1024-F1384 WeakPolarHBondContact O-CE2 3.35Å; I1024-C1400 HydrophobicContact CD1-CB 3.92Å; I1024-C1400 HydrophobicContact CG2-CB 4.34Å; I1024-T1402 PolarHBondContact N-O 3.48Å; I1024-F1404 HydrophobicContact CG1-CB 4.11Å; I1024-F1404 HydrophobicContact CG1-CD2 4.46Å; I1024-A1409 HydrophobicContact CD1-CB 4.33Å; I1024-V1410 HydrophobicContact CD1-CG2 4.13Å
1025	Q	89.9	Confident	72	Confident	4 Å²	4	65 Å²	65	2%	0.019	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	-38.6	-168.5	-61.2	177.6	-0.4	0	0	113.3	V1023 C1038 G1040 D1041 S1045 R1067 V1068 F1384	V1023-Q1025 WeakPolarHBondContact O-CG 3.12Å; V1023-Q1025 PolarHBondContact O-N 3.43Å; Q1025-C1038 HydrophobicContact CB-CB 4.49Å; Q1025-C1038 WeakPolarHBondContact CB-O 3.42Å; Q1025-C1038 PolarHBondContact N-O 3.25Å; Q1025-G1040 VanDerWaalsContact NE2-C 3.34Å; Q1025-D1041 PolarHBondContact NE2-O 2.99Å; Q1025-S1045 PolarHBondContact NE2-OG 3.03Å; Q1025-S1045 PolarHBondContact OE1-OG 2.85Å; Q1025-R1067 HydrophobicContact CG-CG 4.4Å; Q1025-V1068 WeakPolarHBondContact CB-O 3.44Å; Q1025-V1068 PolarHBondContact OE1-O 3.48Å; Q1025-F1384 VanDerWaalsContact C-CZ 3.49Å; Q1025-F1384 WeakPolarHBondContact O-CZ 3.35Å
1026	A	91.2	Very high	74.7	Confident	3 Å²	3	55.4 Å²	55.4	3%	0.025	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	151.9	-179.3	0	0	0	0	0	110.5	C1038 V1068 I1071	A1026-C1038 HydrophobicContact CB-CB 4.24Å; A1026-C1038 PolarHBondContact N-O 2.71Å; A1026-C1038 PolarHBondContact O-N 2.82Å; A1026-V1068 HydrophobicContact CB-CG1 3.82Å; A1026-I1071 HydrophobicContact CB-CB 3.78Å; A1026-I1071 HydrophobicContact CB-CG2 3.39Å
1027	I	93.2	Very high	77.6	Confident	12 Å²	12	51.2 Å²	51.2	6%	0.062	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	140.7	178.6	179.7	170.6	0	0	0	110.8	L1035 W1036 I1037 I1071 F1384 V1386 I1398 C1400	I1027-L1035 HydrophobicContact CD1-CD1 3.79Å; I1027-L1035 HydrophobicContact CG1-CD1 3.98Å; I1027-W1036 VanDerWaalsContact CA-O 3.25Å; I1027-W1036 WeakPolarHBondContact CA-O 3.11Å; I1027-W1036 WeakPolarHBondContact CG1-O 3.33Å; I1027-I1037 HydrophobicContact CB-CG1 4.45Å; I1027-I1037 HydrophobicContact CD1-CD1 4Å; I1027-I1037 HydrophobicContact CD1-CG1 3.87Å; I1027-I1037 HydrophobicContact CG1-CG1 4Å; I1027-I1071 VanDerWaalsContact C-CG2 3.49Å; I1027-I1071 WeakPolarHBondContact O-CG2 3.44Å; I1027-F1384 HydrophobicContact CG2-CB 3.4Å; I1027-F1384 VanDerWaalsContact CG2-CB 3.4Å; I1027-F1384 HydrophobicContact CG2-CD1 3.82Å; I1027-F1384 HydrophobicContact CG2-CD2 4.08Å; I1027-F1384 HydrophobicContact CG2-CG 3.48Å; I1027-F1384 VanDerWaalsContact CG2-CG 3.48Å; I1027-V1386 HydrophobicContact CD1-CG2 3.67Å; I1027-V1386 HydrophobicContact CG1-CG2 3.98Å; I1027-V1386 HydrophobicContact CG2-CG1 3.75Å; I1027-V1386 HydrophobicContact CG2-CG2 4.4Å; I1027-I1398 HydrophobicContact CD1-CG2 4.08Å; I1027-C1400 VanDerWaalsContact CD1-SG 3.58Å
1028	T	93	Very high	80.3	Confident	23 Å²	23	44.3 Å²	44.3	14%	0.141	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	150.4	170.8	-161.4	0	0	0	0	112.5	L1035 W1036 I1071 A1073	T1028-L1035 CarbonylContact O-C 3.41Å; T1028-L1035 VanDerWaalsContact O-CA 3.29Å; T1028-L1035 WeakPolarHBondContact O-CA 3.49Å; T1028-L1035 WeakPolarHBondContact O-CB 3.38Å; T1028-W1036 PolarHBondContact N-O 2.78Å; T1028-W1036 VanDerWaalsContact N-O 3.07Å; T1028-W1036 PolarHBondContact O-N 3.05Å; T1028-I1071 HydrophobicContact CG2-CD1 3.82Å; T1028-I1071 HydrophobicContact CG2-CG1 3.73Å; T1028-I1071 HydrophobicContact CG2-CG2 4.21Å; T1028-A1073 HydrophobicContact CG2-CB 4.04Å
1029	F	91	Very high	82.9	Confident	15 Å²	15	36.2 Å²	36.2	7%	0.066	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.9	166.7	-77.7	-84.3	0	0	0	109.6	L1035 V1052 A1073 V1386 K1388 L1396 I1398	F1029-L1035 HydrophobicContact CD1-CB 3.7Å; F1029-L1035 HydrophobicContact CD1-CD2 4.35Å; F1029-L1035 HydrophobicContact CE1-CB 3.91Å; F1029-L1035 HydrophobicContact CE1-CD2 3.68Å; F1029-L1035 HydrophobicContact CE1-CG 4.35Å; F1029-L1035 HydrophobicContact CE2-CD2 4.35Å; F1029-L1035 HydrophobicContact CG-CB 4.06Å; F1029-L1035 HydrophobicContact CZ-CB 4.45Å; F1029-L1035 HydrophobicContact CZ-CD2 3.67Å; F1029-V1052 HydrophobicContact CE1-CG2 4.12Å; F1029-A1073 VanDerWaalsContact O-CB 3.3Å; F1029-A1073 WeakPolarHBondContact O-CB 3.47Å; F1029-V1386 HydrophobicContact CD2-CB 4.23Å; F1029-V1386 HydrophobicContact CD2-CG2 4.12Å; F1029-V1386 HydrophobicContact CE2-CB 4.09Å; F1029-V1386 HydrophobicContact CE2-CG2 3.67Å; F1029-K1388 HydrophobicContact CB-CD 3.96Å; F1029-K1388 HydrophobicContact CD1-CB 3.86Å; F1029-K1388 HydrophobicContact CD1-CG 4.2Å; F1029-K1388 HydrophobicContact CD2-CB 3.92Å; F1029-K1388 HydrophobicContact CE1-CB 3.92Å; F1029-K1388 HydrophobicContact CE2-CB 3.97Å; F1029-K1388 HydrophobicContact CG-CB 3.86Å; F1029-K1388 HydrophobicContact CG-CD 4.2Å; F1029-K1388 HydrophobicContact CG-CG 4.28Å; F1029-K1388 HydrophobicContact CZ-CB 3.98Å; F1029-L1396 HydrophobicContact CE1-CD2 3.47Å; F1029-L1396 VanDerWaalsContact CE1-CD2 3.47Å; F1029-L1396 HydrophobicContact CZ-CD2 3.46Å; F1029-L1396 VanDerWaalsContact CZ-CD2 3.46Å; F1029-L1396 HydrophobicContact CZ-CG 4.16Å; F1029-I1398 HydrophobicContact CE2-CG1 4.32Å; F1029-I1398 HydrophobicContact CZ-CG1 3.79Å
1030	Y	88	Confident	85	Confident	10 Å²	10	27.7 Å²	27.7	4%	0.039	14%	0.143	C	C	.	.	S	Bend	trans	-104.7	-23	170.3	62.3	-87.8	0	0	0	112.5	H1034 W1036 E1049 N1076 I1079 V1093	Y1030-H1034 HydrophobicContact CE1-CB 3.6Å; Y1030-H1034 HydrophobicContact CE2-CB 3.78Å; Y1030-H1034 PolarHBondContact N-O 2.82Å; Y1030-H1034 WeakPolarHBondContact OH-CB 3.35Å; Y1030-W1036 AromaticContact CD1-CD1 3.78Å; Y1030-W1036 HydrophobicContact CD1-CG 4.16Å; Y1030-W1036 AromaticContact CD1-NE1 3.94Å; Y1030-W1036 AromaticContact CE1-CD1 3.23Å; Y1030-W1036 HydrophobicContact CE1-CG 4.05Å; Y1030-W1036 AromaticContact CE1-NE1 3.26Å; Y1030-W1036 VanDerWaalsContact CE1-NE1 3.26Å; Y1030-W1036 AromaticContact CZ-NE1 3.77Å; Y1030-E1049 VanDerWaalsContact OH-CD 3.31Å; Y1030-E1049 PolarHBondContact OH-OE1 2.86Å; Y1030-N1076 WeakPolarHBondContact O-CA 3.49Å; Y1030-N1076 PolarHBondContact O-OD1 2.98Å; Y1030-N1076 VanDerWaalsContact O-OD1 3.1Å; Y1030-I1079 HydrophobicContact CD1-CD1 4.03Å; Y1030-I1079 HydrophobicContact CG-CD1 4.17Å; Y1030-V1093 HydrophobicContact CD2-CG1 4.04Å; Y1030-V1093 HydrophobicContact CD2-CG2 4.2Å; Y1030-V1093 HydrophobicContact CE2-CG1 3.59Å; Y1030-V1093 HydrophobicContact CG-CG2 4.22Å
1031	D	83.9	Confident	86.4	Confident	39 Å²	39	24.5 Å²	24.5	21%	0.209	13%	0.126	C	C	.	.	S	Bend	trans	-134.6	-163.5	168.2	72.4	31.6	0	0	0	111.4	E1033 H1034 K1388	D1031-E1033 PolarHBondContact OD1-N 2.96Å; D1031-H1034 WeakPolarHBondContact OD1-CA 3.47Å; D1031-H1034 VanDerWaalsContact OD1-CB 3.31Å; D1031-H1034 WeakPolarHBondContact OD1-CB 3.31Å; D1031-H1034 IonicContact OD1-CG 3.5Å; D1031-H1034 PolarHBondContact OD1-N 2.89Å; D1031-H1034 IonicContact OD1-ND1 3.02Å; D1031-H1034 PolarHBondContact OD1-ND1 3.41Å; D1031-H1034 IonicContact OD2-CE1 2.71Å; D1031-H1034 IonicContact OD2-CG 3.55Å; D1031-H1034 IonicContact OD2-ND1 3.62Å; D1031-H1034 PolarHBondContact OD2-ND1 3.14Å; D1031-K1388 WeakPolarHBondContact O-CE 3.41Å; D1031-K1388 PolarHBondContact O-NZ 3.44Å
1032	N	83.2	Confident	86.5	Confident	79 Å²	79	28 Å²	28	42%	0.422	14%	0.139	S	C	.	.	S	Bend	trans	-82	-19.4	-177.3	-70.5	-12.7	0	0	0	114.1	K1388	N1032-K1388 WeakPolarHBondContact OD1-CE 3.37Å
1033	E	83.2	Confident	86	Confident	92 Å²	92	33.6 Å²	33.6	43%	0.43	17%	0.166	S	C	.	.	S	Bend	trans	-122.3	-11.2	-172.1	-62.5	-168.6	174.8	0	0	113.4	D1031 V1052 T1053	D1031-E1033 PolarHBondContact OD1-N 2.96Å; E1033-V1052 WeakPolarHBondContact O-CB 3.28Å; E1033-V1052 VanDerWaalsContact O-CG2 3.29Å; E1033-V1052 WeakPolarHBondContact O-CG2 3.48Å; E1033-V1052 PolarHBondContact O-N 3.11Å; E1033-T1053 HydrophobicContact CB-CG2 4.19Å; E1033-T1053 VanDerWaalsContact CD-CG2 3.48Å; E1033-T1053 HydrophobicContact CG-CG2 3.9Å; E1033-T1053 WeakPolarHBondContact OE2-CG2 3.36Å
1034	H	88.3	Confident	85.6	Confident	42 Å²	42	36 Å²	36	19%	0.194	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	139.9	-172.2	-50.1	82.8	0	0	0	111.3	Y1030 D1031 E1049 V1050	Y1030-H1034 HydrophobicContact CE1-CB 3.6Å; Y1030-H1034 HydrophobicContact CE2-CB 3.78Å; Y1030-H1034 PolarHBondContact N-O 2.82Å; Y1030-H1034 WeakPolarHBondContact OH-CB 3.35Å; D1031-H1034 WeakPolarHBondContact OD1-CA 3.47Å; D1031-H1034 VanDerWaalsContact OD1-CB 3.31Å; D1031-H1034 WeakPolarHBondContact OD1-CB 3.31Å; D1031-H1034 IonicContact OD1-CG 3.5Å; D1031-H1034 PolarHBondContact OD1-N 2.89Å; D1031-H1034 IonicContact OD1-ND1 3.02Å; D1031-H1034 PolarHBondContact OD1-ND1 3.41Å; D1031-H1034 IonicContact OD2-CE1 2.71Å; D1031-H1034 IonicContact OD2-CG 3.55Å; D1031-H1034 IonicContact OD2-ND1 3.62Å; D1031-H1034 PolarHBondContact OD2-ND1 3.14Å; H1034-E1049 IonicContact CD2-OE1 3.65Å; H1034-E1049 PolarHBondContact CD2-OE1 3.27Å; H1034-E1049 IonicContact CG-OE1 2.95Å; H1034-V1050 WeakPolarHBondContact CA-O 3.39Å
1035	L	90.2	Very high	85.5	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.8	176.5	67.3	86.4	0	0	0	110.3	I1027 T1028 F1029 I1037 E1049 V1050 V1052 I1398	I1027-L1035 HydrophobicContact CD1-CD1 3.79Å; I1027-L1035 HydrophobicContact CG1-CD1 3.98Å; T1028-L1035 CarbonylContact O-C 3.41Å; T1028-L1035 VanDerWaalsContact O-CA 3.29Å; T1028-L1035 WeakPolarHBondContact O-CA 3.49Å; T1028-L1035 WeakPolarHBondContact O-CB 3.38Å; F1029-L1035 HydrophobicContact CD1-CB 3.7Å; F1029-L1035 HydrophobicContact CD1-CD2 4.35Å; F1029-L1035 HydrophobicContact CE1-CB 3.91Å; F1029-L1035 HydrophobicContact CE1-CD2 3.68Å; F1029-L1035 HydrophobicContact CE1-CG 4.35Å; F1029-L1035 HydrophobicContact CE2-CD2 4.35Å; F1029-L1035 HydrophobicContact CG-CB 4.06Å; F1029-L1035 HydrophobicContact CZ-CB 4.45Å; F1029-L1035 HydrophobicContact CZ-CD2 3.67Å; L1035-I1037 HydrophobicContact CD1-CD1 3.9Å; L1035-I1037 HydrophobicContact CD1-CG1 3.51Å; L1035-E1049 CarbonylContact O-C 3.53Å; L1035-E1049 WeakPolarHBondContact O-CA 3.11Å; L1035-V1050 HydrophobicContact CD1-CB 3.43Å; L1035-V1050 VanDerWaalsContact CD1-CB 3.43Å; L1035-V1050 HydrophobicContact CD1-CG1 4.01Å; L1035-V1050 HydrophobicContact CD1-CG2 3.62Å; L1035-V1050 HydrophobicContact CD2-CB 4.21Å; L1035-V1050 HydrophobicContact CD2-CG1 3.94Å; L1035-V1050 HydrophobicContact CG-CB 3.56Å; L1035-V1050 HydrophobicContact CG-CG1 3.85Å; L1035-V1050 HydrophobicContact CG-CG2 4.32Å; L1035-V1050 PolarHBondContact N-O 2.99Å; L1035-V1050 PolarHBondContact O-N 3.1Å; L1035-V1052 HydrophobicContact CD2-CG2 3.81Å; L1035-V1052 HydrophobicContact CG-CG2 4.4Å; L1035-I1398 HydrophobicContact CD2-CB 4.47Å; L1035-I1398 HydrophobicContact CD2-CD1 4.4Å; L1035-I1398 HydrophobicContact CD2-CG1 3.68Å
1036	W	91.1	Very high	85.3	Confident	3 Å²	3	38.2 Å²	38.2	1%	0.011	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	138.1	174.6	-79.4	8.6	0	0	0	111.3	I1027 T1028 Y1030 I1047 S1048 I1060 I1071 I1079 Y1091 V1093	I1027-W1036 VanDerWaalsContact CA-O 3.25Å; I1027-W1036 WeakPolarHBondContact CA-O 3.11Å; I1027-W1036 WeakPolarHBondContact CG1-O 3.33Å; T1028-W1036 PolarHBondContact N-O 2.78Å; T1028-W1036 VanDerWaalsContact N-O 3.07Å; T1028-W1036 PolarHBondContact O-N 3.05Å; Y1030-W1036 AromaticContact CD1-CD1 3.78Å; Y1030-W1036 HydrophobicContact CD1-CG 4.16Å; Y1030-W1036 AromaticContact CD1-NE1 3.94Å; Y1030-W1036 AromaticContact CE1-CD1 3.23Å; Y1030-W1036 HydrophobicContact CE1-CG 4.05Å; Y1030-W1036 AromaticContact CE1-NE1 3.26Å; Y1030-W1036 VanDerWaalsContact CE1-NE1 3.26Å; Y1030-W1036 AromaticContact CZ-NE1 3.77Å; W1036-I1047 HydrophobicContact CB-CG2 4.28Å; W1036-I1047 HydrophobicContact CD2-CG2 3.83Å; W1036-I1047 HydrophobicContact CE3-CD1 4.44Å; W1036-I1047 HydrophobicContact CE3-CG2 3.73Å; W1036-I1047 HydrophobicContact CG-CG2 4.08Å; W1036-I1047 HydrophobicContact CZ3-CD1 4.24Å; W1036-I1047 HydrophobicContact CZ3-CG2 4.33Å; W1036-S1048 WeakPolarHBondContact CA-O 3.42Å; W1036-I1060 HydrophobicContact CD2-CD1 4.2Å; W1036-I1060 HydrophobicContact CH2-CD1 4.35Å; W1036-I1060 HydrophobicContact CZ2-CD1 3.66Å; W1036-I1071 HydrophobicContact CB-CD1 4.32Å; W1036-I1079 HydrophobicContact CD2-CD1 3.37Å; W1036-I1079 HydrophobicContact CE3-CB 4.37Å; W1036-I1079 HydrophobicContact CE3-CD1 3.23Å; W1036-I1079 HydrophobicContact CE3-CG1 4.37Å; W1036-I1079 HydrophobicContact CE3-CG2 4.19Å; W1036-I1079 HydrophobicContact CG-CD1 3.98Å; W1036-I1079 HydrophobicContact CH2-CD1 4.04Å; W1036-I1079 HydrophobicContact CZ2-CD1 4.19Å; W1036-I1079 HydrophobicContact CZ3-CB 4.21Å; W1036-I1079 HydrophobicContact CZ3-CD1 3.59Å; W1036-I1079 HydrophobicContact CZ3-CG1 4.43Å; W1036-I1079 HydrophobicContact CZ3-CG2 4.38Å; W1036-Y1091 AromaticContact CH2-CD1 3.3Å; W1036-Y1091 HydrophobicContact CH2-CD1 3.3Å; W1036-Y1091 AromaticContact CH2-CE1 3.51Å; W1036-Y1091 HydrophobicContact CH2-CE1 3.51Å; W1036-Y1091 HydrophobicContact CH2-CG 4.22Å; W1036-Y1091 HydrophobicContact CZ2-CE1 4.46Å; W1036-Y1091 AromaticContact CZ3-CD1 3.69Å; W1036-Y1091 HydrophobicContact CZ3-CD1 3.69Å; W1036-Y1091 HydrophobicContact CZ3-CE1 4.17Å; W1036-Y1091 HydrophobicContact CZ3-CG 4.16Å; W1036-V1093 HydrophobicContact CH2-CB 4.39Å; W1036-V1093 HydrophobicContact CH2-CG2 3.87Å; W1036-V1093 HydrophobicContact CZ2-CB 3.96Å; W1036-V1093 HydrophobicContact CZ2-CG1 3.85Å; W1036-V1093 HydrophobicContact CZ2-CG2 3.63Å
1037	I	91.1	Very high	85.2	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120	172.3	-60.7	-172.1	0	0	0	108.4	I1024 I1027 L1035 Y1039 I1047 S1048 V1050 M1057 V1410	I1024-I1037 HydrophobicContact CG2-CG2 3.84Å; I1027-I1037 HydrophobicContact CB-CG1 4.45Å; I1027-I1037 HydrophobicContact CD1-CD1 4Å; I1027-I1037 HydrophobicContact CD1-CG1 3.87Å; I1027-I1037 HydrophobicContact CG1-CG1 4Å; L1035-I1037 HydrophobicContact CD1-CD1 3.9Å; L1035-I1037 HydrophobicContact CD1-CG1 3.51Å; I1037-Y1039 HydrophobicContact CG2-CD1 4.3Å; I1037-I1047 WeakPolarHBondContact O-CA 3.18Å; I1037-S1048 PolarHBondContact N-O 3.43Å; I1037-S1048 PolarHBondContact O-N 3.28Å; I1037-V1050 HydrophobicContact CD1-CG2 3.75Å; I1037-V1050 HydrophobicContact CG1-CG2 4.1Å; I1037-M1057 HydrophobicContact CD1-SD 3.93Å; I1037-V1410 HydrophobicContact CD1-CG1 4.03Å; I1037-V1410 HydrophobicContact CD1-CG2 3.69Å
1038	C	91.3	Very high	85	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	126.9	167.6	-61.7	0	0	0	0	109.1	Q1025 A1026 Q1046 V1068	Q1025-C1038 HydrophobicContact CB-CB 4.49Å; Q1025-C1038 WeakPolarHBondContact CB-O 3.42Å; Q1025-C1038 PolarHBondContact N-O 3.25Å; A1026-C1038 HydrophobicContact CB-CB 4.24Å; A1026-C1038 PolarHBondContact N-O 2.71Å; A1026-C1038 PolarHBondContact O-N 2.82Å; C1038-Q1046 WeakPolarHBondContact CA-O 3.21Å; C1038-V1068 HydrophobicContact CB-CB 4.02Å; C1038-V1068 HydrophobicContact CB-CG1 4.23Å; C1038-V1068 HydrophobicContact CB-CG2 4.05Å
1039	Y	88.9	Confident	84.8	Confident	11 Å²	11	38.6 Å²	38.6	4%	0.043	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	152	179.1	63.2	-78.8	0	0	0	110.6	A1022 V1023 I1037 S1045 Q1046 S1048 F1404	A1022-Y1039 HydrophobicContact CB-CD2 3.93Å; V1023-Y1039 CarbonylContact O-C 3.53Å; V1023-Y1039 WeakPolarHBondContact O-CA 3.29Å; V1023-Y1039 WeakPolarHBondContact O-CB 3.39Å; I1037-Y1039 HydrophobicContact CG2-CD1 4.3Å; Y1039-S1045 CarbonylContact O-C 3.59Å; Y1039-Q1046 HydrophobicContact CD2-CB 4.46Å; Y1039-Q1046 HydrophobicContact CE1-CB 3.94Å; Y1039-Q1046 HydrophobicContact CE2-CB 3.87Å; Y1039-Q1046 VanDerWaalsContact CE2-OE1 3.28Å; Y1039-Q1046 PolarHBondContact N-O 2.9Å; Y1039-Q1046 PolarHBondContact O-N 3.36Å; Y1039-Q1046 PolarHBondContact OH-OE1 3.26Å; Y1039-S1048 WeakPolarHBondContact CE1-OG 3.36Å; Y1039-S1048 PolarHBondContact OH-OG 2.74Å; Y1039-F1404 AromaticContact CD1-CD2 3.61Å; Y1039-F1404 HydrophobicContact CD1-CD2 3.61Å; Y1039-F1404 AromaticContact CD1-CE2 3.44Å; Y1039-F1404 HydrophobicContact CD1-CE2 3.44Å; Y1039-F1404 VanDerWaalsContact CD1-CE2 3.44Å; Y1039-F1404 HydrophobicContact CD1-CG 4.4Å; Y1039-F1404 HydrophobicContact CD1-CZ 4.15Å; Y1039-F1404 HydrophobicContact CD2-CB 4.1Å; Y1039-F1404 AromaticContact CD2-CD1 3.83Å; Y1039-F1404 HydrophobicContact CD2-CD1 3.83Å; Y1039-F1404 AromaticContact CD2-CD2 3.65Å; Y1039-F1404 HydrophobicContact CD2-CD2 3.65Å; Y1039-F1404 HydrophobicContact CD2-CE1 4.11Å; Y1039-F1404 AromaticContact CD2-CE2 3.91Å; Y1039-F1404 HydrophobicContact CD2-CE2 3.91Å; Y1039-F1404 AromaticContact CD2-CG 3.58Å; Y1039-F1404 HydrophobicContact CD2-CG 3.58Å; Y1039-F1404 HydrophobicContact CD2-CZ 4.14Å; Y1039-F1404 HydrophobicContact CE1-CD2 4.16Å; Y1039-F1404 AromaticContact CE1-CE2 3.55Å; Y1039-F1404 HydrophobicContact CE1-CE2 3.55Å; Y1039-F1404 AromaticContact CE1-CZ 3.83Å; Y1039-F1404 HydrophobicContact CE1-CZ 3.83Å; Y1039-F1404 AromaticContact CE2-CD1 3.95Å; Y1039-F1404 HydrophobicContact CE2-CD1 3.95Å; Y1039-F1404 HydrophobicContact CE2-CD2 4.18Å; Y1039-F1404 AromaticContact CE2-CE1 3.79Å; Y1039-F1404 HydrophobicContact CE2-CE1 3.79Å; Y1039-F1404 AromaticContact CE2-CE2 3.99Å; Y1039-F1404 HydrophobicContact CE2-CE2 3.99Å; Y1039-F1404 HydrophobicContact CE2-CG 4.13Å; Y1039-F1404 AromaticContact CE2-CZ 3.8Å; Y1039-F1404 HydrophobicContact CE2-CZ 3.8Å; Y1039-F1404 HydrophobicContact CG-CB 4.22Å; Y1039-F1404 HydrophobicContact CG-CD1 4.4Å; Y1039-F1404 AromaticContact CG-CD2 3.35Å; Y1039-F1404 HydrophobicContact CG-CD2 3.35Å; Y1039-F1404 AromaticContact CG-CE2 3.65Å; Y1039-F1404 HydrophobicContact CG-CE2 3.65Å; Y1039-F1404 AromaticContact CG-CG 3.75Å; Y1039-F1404 HydrophobicContact CG-CG 3.75Å; Y1039-F1404 HydrophobicContact CG-CZ 4.31Å; Y1039-F1404 AromaticContact CZ-CE2 3.82Å; Y1039-F1404 AromaticContact CZ-CZ 3.63Å
1040	G	85	Confident	84.7	Confident	2 Å²	2	37.9 Å²	37.9	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.9	-159.8	-178.1	0	0	0	0	0	112.4	V1023 Q1025 Y1044	V1023-G1040 PolarHBondContact N-O 2.91Å; V1023-G1040 PolarHBondContact O-N 3.37Å; Q1025-G1040 VanDerWaalsContact NE2-C 3.34Å; G1040-Y1044 WeakPolarHBondContact CA-O 3.22Å
1041	D	76.1	Confident	84.7	Confident	38 Å²	38	39 Å²	39	20%	0.203	19%	0.187	C	C	.	.			trans	-108.9	-150.1	178.1	69	21.5	0	0	0	111.6	Q1025 L1043 Y1044	Q1025-D1041 PolarHBondContact NE2-O 2.99Å; D1041-L1043 WeakPolarHBondContact OD1-CA 3.28Å; D1041-L1043 WeakPolarHBondContact OD1-CB 3.26Å; D1041-L1043 PolarHBondContact OD1-N 2.91Å; D1041-Y1044 PolarHBondContact N-O 3.46Å; D1041-Y1044 VanDerWaalsContact N-O 3.11Å; D1041-Y1044 VanDerWaalsContact OD1-CD1 3.31Å; D1041-Y1044 WeakPolarHBondContact OD1-CD1 3.32Å; D1041-Y1044 WeakPolarHBondContact OD1-CE1 3.38Å; D1041-Y1044 PolarHBondContact OD1-N 3.38Å; D1041-Y1044 VanDerWaalsContact OD1-N 3.14Å; D1041-Y1044 WeakPolarHBondContact OD2-CE1 3.28Å
1042	K	68.1	Low	84.7	Confident	172 Å²	172	37.3 Å²	37.3	75%	0.748	18%	0.179	S	C	*	.	S	Bend	trans	-81.9	-20.8	178.9	-64.7	-177.3	-178.3	179.4	0	112.8
1043	L	67.1	Low	84.7	Confident	133 Å²	133	37.7 Å²	37.7	70%	0.696	18%	0.184	S	C	*	.	S	Bend	trans	-101	-36.5	-170.1	-62.6	174.8	0	0	0	111.8	D1041 E1065	D1041-L1043 WeakPolarHBondContact OD1-CA 3.28Å; D1041-L1043 WeakPolarHBondContact OD1-CB 3.26Å; D1041-L1043 PolarHBondContact OD1-N 2.91Å; L1043-E1065 CarbonylContact O-C 3.56Å
1044	Y	75.7	Confident	84.7	Confident	79 Å²	79	36.5 Å²	36.5	31%	0.31	19%	0.186	S	C	.	.			trans	-138.6	156.2	180	62.1	-84.9	0	0	0	112.1	G1040 D1041 Q1046 L1064	G1040-Y1044 WeakPolarHBondContact CA-O 3.22Å; D1041-Y1044 PolarHBondContact N-O 3.46Å; D1041-Y1044 VanDerWaalsContact N-O 3.11Å; D1041-Y1044 VanDerWaalsContact OD1-CD1 3.31Å; D1041-Y1044 WeakPolarHBondContact OD1-CD1 3.32Å; D1041-Y1044 WeakPolarHBondContact OD1-CE1 3.38Å; D1041-Y1044 PolarHBondContact OD1-N 3.38Å; D1041-Y1044 VanDerWaalsContact OD1-N 3.14Å; D1041-Y1044 WeakPolarHBondContact OD2-CE1 3.28Å; Y1044-Q1046 HydrophobicContact CD2-CG 4.44Å; Y1044-L1064 VanDerWaalsContact CA-O 3.28Å; Y1044-L1064 WeakPolarHBondContact CA-O 3.31Å
1045	S	85.6	Confident	84.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.9	171.3	-45.2	0	0	0	0	110	Q1025 Y1039 L1064 S1066 R1067 V1068	Q1025-S1045 PolarHBondContact NE2-OG 3.03Å; Q1025-S1045 PolarHBondContact OE1-OG 2.85Å; Y1039-S1045 CarbonylContact O-C 3.59Å; S1045-L1064 PolarHBondContact N-O 3.36Å; S1045-L1064 PolarHBondContact O-N 3.2Å; S1045-S1066 WeakPolarHBondContact CB-O 3.35Å; S1045-S1066 PolarHBondContact OG-O 3.42Å; S1045-R1067 WeakPolarHBondContact OG-CA 3.46Å; S1045-V1068 PolarHBondContact OG-N 2.76Å; S1045-V1068 VanDerWaalsContact OG-N 3.08Å
1046	Q	87.1	Confident	84.2	Confident	49 Å²	49	37.1 Å²	37.1	23%	0.229	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	153.6	169.4	-68.5	-176	-14	0	0	109.7	C1038 Y1039 Y1044 E1063	C1038-Q1046 WeakPolarHBondContact CA-O 3.21Å; Y1039-Q1046 HydrophobicContact CD2-CB 4.46Å; Y1039-Q1046 HydrophobicContact CE1-CB 3.94Å; Y1039-Q1046 HydrophobicContact CE2-CB 3.87Å; Y1039-Q1046 VanDerWaalsContact CE2-OE1 3.28Å; Y1039-Q1046 PolarHBondContact N-O 2.9Å; Y1039-Q1046 PolarHBondContact O-N 3.36Å; Y1039-Q1046 PolarHBondContact OH-OE1 3.26Å; Y1044-Q1046 HydrophobicContact CD2-CG 4.44Å; Q1046-E1063 HydrophobicContact CG-CG 4.14Å; Q1046-E1063 PolarHBondContact NE2-OE1 3Å
1047	I	88.7	Confident	83.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	127.3	174.6	-48.5	177.5	0	0	0	108.4	W1036 I1037 I1060 Y1062 L1064 L1081	W1036-I1047 HydrophobicContact CB-CG2 4.28Å; W1036-I1047 HydrophobicContact CD2-CG2 3.83Å; W1036-I1047 HydrophobicContact CE3-CD1 4.44Å; W1036-I1047 HydrophobicContact CE3-CG2 3.73Å; W1036-I1047 HydrophobicContact CG-CG2 4.08Å; W1036-I1047 HydrophobicContact CZ3-CD1 4.24Å; W1036-I1047 HydrophobicContact CZ3-CG2 4.33Å; I1037-I1047 WeakPolarHBondContact O-CA 3.18Å; I1047-I1060 HydrophobicContact CB-CD1 4.25Å; I1047-I1060 HydrophobicContact CG2-CD1 3.66Å; I1047-I1060 HydrophobicContact CG2-CG1 4.49Å; I1047-I1060 PolarHBondContact O-N 2.92Å; I1047-Y1062 HydrophobicContact CD1-CD1 4.34Å; I1047-L1064 HydrophobicContact CD1-CD1 4.01Å; I1047-L1064 HydrophobicContact CD1-CG 4.49Å; I1047-L1064 HydrophobicContact CG1-CD1 4.16Å; I1047-L1081 HydrophobicContact CD1-CD1 4.44Å
1048	S	88.6	Confident	83.6	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.007	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	135.8	167.4	-80.3	0	0	0	0	110	W1036 I1037 Y1039 Q1058 S1059	W1036-S1048 WeakPolarHBondContact CA-O 3.42Å; I1037-S1048 PolarHBondContact N-O 3.43Å; I1037-S1048 PolarHBondContact O-N 3.28Å; Y1039-S1048 WeakPolarHBondContact CE1-OG 3.36Å; Y1039-S1048 PolarHBondContact OH-OG 2.74Å; S1048-Q1058 CarbonylContact C-O 3.51Å; S1048-Q1058 VanDerWaalsContact CA-O 3.27Å; S1048-Q1058 WeakPolarHBondContact CA-O 3.36Å; S1048-S1059 WeakPolarHBondContact OG-CA 3.22Å; S1048-S1059 PolarHBondContact OG-N 3.49Å
1049	E	89.5	Confident	83.2	Confident	46 Å²	46	41.2 Å²	41.2	22%	0.215	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	137	168	-175.6	-177.8	-173.3	0	0	108.5	Y1030 H1034 L1035 M1057 Q1058 I1060	Y1030-E1049 VanDerWaalsContact OH-CD 3.31Å; Y1030-E1049 PolarHBondContact OH-OE1 2.86Å; H1034-E1049 IonicContact CD2-OE1 3.65Å; H1034-E1049 PolarHBondContact CD2-OE1 3.27Å; H1034-E1049 IonicContact CG-OE1 2.95Å; L1035-E1049 CarbonylContact O-C 3.53Å; L1035-E1049 WeakPolarHBondContact O-CA 3.11Å; E1049-M1057 CarbonylContact O-C 3.21Å; E1049-M1057 WeakPolarHBondContact O-CA 3.32Å; E1049-Q1058 PolarHBondContact N-O 2.85Å; E1049-Q1058 PolarHBondContact O-N 3.42Å; E1049-I1060 HydrophobicContact CB-CD1 4.14Å; E1049-I1060 HydrophobicContact CB-CG1 4.06Å
1050	V	88.3	Confident	82.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118	174.1	166.5	0	0	0	0	107.5	H1034 L1035 I1037 V1052 C1056 M1057 I1428	H1034-V1050 WeakPolarHBondContact CA-O 3.39Å; L1035-V1050 HydrophobicContact CD1-CB 3.43Å; L1035-V1050 VanDerWaalsContact CD1-CB 3.43Å; L1035-V1050 HydrophobicContact CD1-CG1 4.01Å; L1035-V1050 HydrophobicContact CD1-CG2 3.62Å; L1035-V1050 HydrophobicContact CD2-CB 4.21Å; L1035-V1050 HydrophobicContact CD2-CG1 3.94Å; L1035-V1050 HydrophobicContact CG-CB 3.56Å; L1035-V1050 HydrophobicContact CG-CG1 3.85Å; L1035-V1050 HydrophobicContact CG-CG2 4.32Å; L1035-V1050 PolarHBondContact N-O 2.99Å; L1035-V1050 PolarHBondContact O-N 3.1Å; I1037-V1050 HydrophobicContact CD1-CG2 3.75Å; I1037-V1050 HydrophobicContact CG1-CG2 4.1Å; V1050-V1052 HydrophobicContact CG1-CG2 4.18Å; V1050-C1056 CarbonylContact C-O 3.46Å; V1050-C1056 WeakPolarHBondContact CA-O 3.42Å; V1050-M1057 HydrophobicContact CG2-CB 3.73Å; V1050-M1057 HydrophobicContact CG2-CG 3.47Å; V1050-M1057 VanDerWaalsContact CG2-CG 3.47Å; V1050-M1057 HydrophobicContact CG2-SD 3.59Å; V1050-M1057 VanDerWaalsContact CG2-SD 3.59Å; V1050-I1428 HydrophobicContact CG1-CD1 3.53Å; V1050-I1428 HydrophobicContact CG1-CG2 3.8Å; V1050-I1428 HydrophobicContact CG2-CG2 4.46Å
1051	V	87.8	Confident	82.3	Confident	32 Å²	32	44.5 Å²	44.5	19%	0.194	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	106.6	173.3	-172.5	0	0	0	0	107.2	T1053 S1054 N1055 C1056	V1051-T1053 PolarHBondContact O-N 2.95Å; V1051-S1054 VanDerWaalsContact CB-OG 3.25Å; V1051-S1054 WeakPolarHBondContact CB-OG 3.23Å; V1051-S1054 WeakPolarHBondContact CG1-OG 3.08Å; V1051-S1054 PolarHBondContact O-N 3.12Å; V1051-S1054 PolarHBondContact O-OG 2.91Å; V1051-N1055 PolarHBondContact O-N 3.43Å; V1051-N1055 VanDerWaalsContact O-N 3.1Å; V1051-C1056 PolarHBondContact N-O 3.38Å; V1051-C1056 PolarHBondContact O-N 3.4Å; V1051-C1056 VanDerWaalsContact O-N 3.15Å
1052	V	84.1	Confident	82.3	Confident	5 Å²	5	46 Å²	46	3%	0.03	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-28.3	-169.2	-174	0	0	0	0	111.8	F1029 E1033 L1035 V1050 N1055 L1396 K1412	F1029-V1052 HydrophobicContact CE1-CG2 4.12Å; E1033-V1052 WeakPolarHBondContact O-CB 3.28Å; E1033-V1052 VanDerWaalsContact O-CG2 3.29Å; E1033-V1052 WeakPolarHBondContact O-CG2 3.48Å; E1033-V1052 PolarHBondContact O-N 3.11Å; L1035-V1052 HydrophobicContact CD2-CG2 3.81Å; L1035-V1052 HydrophobicContact CG-CG2 4.4Å; V1050-V1052 HydrophobicContact CG1-CG2 4.18Å; V1052-N1055 PolarHBondContact O-N 2.9Å; V1052-N1055 PolarHBondContact O-OD1 2.93Å; V1052-L1396 HydrophobicContact CB-CD2 3.86Å; V1052-L1396 HydrophobicContact CG1-CD1 3.37Å; V1052-L1396 HydrophobicContact CG1-CD2 3.24Å; V1052-L1396 HydrophobicContact CG1-CG 3.88Å; V1052-L1396 HydrophobicContact CG2-CD2 3.76Å; V1052-K1412 HydrophobicContact CG1-CD 3.83Å; V1052-K1412 HydrophobicContact CG1-CG 4.49Å; V1052-K1412 PolarHBondContact O-NZ 3.05Å
1053	T	83.4	Confident	82.8	Confident	86 Å²	86	42.8 Å²	42.8	53%	0.528	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-38.6	176.4	46.4	0	0	0	0	112.1	E1033 V1051	E1033-T1053 HydrophobicContact CB-CG2 4.19Å; E1033-T1053 VanDerWaalsContact CD-CG2 3.48Å; E1033-T1053 HydrophobicContact CG-CG2 3.9Å; E1033-T1053 WeakPolarHBondContact OE2-CG2 3.36Å; V1051-T1053 PolarHBondContact O-N 2.95Å
1054	S	82.1	Confident	83.5	Confident	68 Å²	68	36.9 Å²	36.9	48%	0.476	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	1.2	176.8	49.4	0	0	0	0	114.2	V1051 C1056	V1051-S1054 VanDerWaalsContact CB-OG 3.25Å; V1051-S1054 WeakPolarHBondContact CB-OG 3.23Å; V1051-S1054 WeakPolarHBondContact CG1-OG 3.08Å; V1051-S1054 PolarHBondContact O-N 3.12Å; V1051-S1054 PolarHBondContact O-OG 2.91Å; S1054-C1056 PolarHBondContact O-N 3.42Å; S1054-C1056 VanDerWaalsContact O-N 3.14Å; S1054-C1056 PolarHBondContact OG-SG 2.88Å
1055	N	83.7	Confident	83.7	Confident	27 Å²	27	39.5 Å²	39.5	14%	0.144	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	38.5	-174	-68.5	-15.2	0	0	0	112.3	V1051 V1052 K1412 E1426 Y1429	V1051-N1055 PolarHBondContact O-N 3.43Å; V1051-N1055 VanDerWaalsContact O-N 3.1Å; V1052-N1055 PolarHBondContact O-N 2.9Å; V1052-N1055 PolarHBondContact O-OD1 2.93Å; N1055-K1412 WeakPolarHBondContact OD1-CD 3.46Å; N1055-K1412 PolarHBondContact OD1-NZ 2.9Å; N1055-E1426 PolarHBondContact ND2-OE2 3.36Å; N1055-Y1429 PolarHBondContact O-N 2.72Å
1056	C	84.2	Confident	83.5	Confident	27 Å²	27	40.2 Å²	40.2	18%	0.182	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	144	-178	75.1	0	0	0	0	111.9	V1050 V1051 S1054 Y1429	V1050-C1056 CarbonylContact C-O 3.46Å; V1050-C1056 WeakPolarHBondContact CA-O 3.42Å; V1051-C1056 PolarHBondContact N-O 3.38Å; V1051-C1056 PolarHBondContact O-N 3.4Å; V1051-C1056 VanDerWaalsContact O-N 3.15Å; S1054-C1056 PolarHBondContact O-N 3.42Å; S1054-C1056 VanDerWaalsContact O-N 3.14Å; S1054-C1056 PolarHBondContact OG-SG 2.88Å; C1056-Y1429 CarbonylContact C-O 3.57Å; C1056-Y1429 VanDerWaalsContact CA-O 3.32Å; C1056-Y1429 WeakPolarHBondContact CA-O 3.43Å
1057	M	85.9	Confident	83.3	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.015	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132	175.9	-176	164.1	55.4	0	0	109.3	I1037 E1049 V1050 F1404 I1428 Y1429 V1430 F1431	I1037-M1057 HydrophobicContact CD1-SD 3.93Å; E1049-M1057 CarbonylContact O-C 3.21Å; E1049-M1057 WeakPolarHBondContact O-CA 3.32Å; V1050-M1057 HydrophobicContact CG2-CB 3.73Å; V1050-M1057 HydrophobicContact CG2-CG 3.47Å; V1050-M1057 VanDerWaalsContact CG2-CG 3.47Å; V1050-M1057 HydrophobicContact CG2-SD 3.59Å; V1050-M1057 VanDerWaalsContact CG2-SD 3.59Å; M1057-F1404 HydrophobicContact CE-CD2 4.09Å; M1057-F1404 HydrophobicContact CE-CE1 4.35Å; M1057-F1404 HydrophobicContact CE-CE2 3.2Å; M1057-F1404 HydrophobicContact CE-CZ 3.36Å; M1057-F1404 HydrophobicContact SD-CE2 3.57Å; M1057-F1404 VanDerWaalsContact SD-CE2 3.57Å; M1057-F1404 HydrophobicContact SD-CZ 4.09Å; M1057-I1428 HydrophobicContact CB-CG2 4.07Å; M1057-Y1429 PolarHBondContact N-O 2.88Å; M1057-V1430 HydrophobicContact CE-CG2 3.56Å; M1057-F1431 PolarHBondContact O-N 3.13Å
1058	Q	84.7	Confident	83.4	Confident	49 Å²	49	40.5 Å²	40.5	23%	0.229	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	133.2	-178.5	-173	176.6	61.4	0	0	110.5	S1048 E1049 I1060 F1431 R1433	S1048-Q1058 CarbonylContact C-O 3.51Å; S1048-Q1058 VanDerWaalsContact CA-O 3.27Å; S1048-Q1058 WeakPolarHBondContact CA-O 3.36Å; E1049-Q1058 PolarHBondContact N-O 2.85Å; E1049-Q1058 PolarHBondContact O-N 3.42Å; Q1058-I1060 PolarHBondContact O-N 2.94Å; Q1058-F1431 HydrophobicContact CG-CD1 4.48Å; Q1058-R1433 VanDerWaalsContact CD-NH2 3.3Å; Q1058-R1433 HydrophobicContact CG-CG 4.1Å
1059	S	83.3	Confident	83.4	Confident	38 Å²	38	42.3 Å²	42.3	27%	0.266	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	134.1	173	-173.1	0	0	0	0	110.7	S1048 G1061	S1048-S1059 WeakPolarHBondContact OG-CA 3.22Å; S1048-S1059 PolarHBondContact OG-N 3.49Å; S1059-G1061 PolarHBondContact O-N 3.19Å; S1059-G1061 PolarHBondContact OG-N 3.12Å
1060	I	80.5	Confident	83.5	Confident	16 Å²	16	40.5 Å²	40.5	8%	0.082	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	-17.3	175.9	-59.6	-178.5	0	0	0	110.7	W1036 I1047 E1049 Q1058 Y1062 N1096	W1036-I1060 HydrophobicContact CD2-CD1 4.2Å; W1036-I1060 HydrophobicContact CH2-CD1 4.35Å; W1036-I1060 HydrophobicContact CZ2-CD1 3.66Å; I1047-I1060 HydrophobicContact CB-CD1 4.25Å; I1047-I1060 HydrophobicContact CG2-CD1 3.66Å; I1047-I1060 HydrophobicContact CG2-CG1 4.49Å; I1047-I1060 PolarHBondContact O-N 2.92Å; E1049-I1060 HydrophobicContact CB-CD1 4.14Å; E1049-I1060 HydrophobicContact CB-CG1 4.06Å; Q1058-I1060 PolarHBondContact O-N 2.94Å; I1060-Y1062 VanDerWaalsContact C-N 3.3Å; I1060-N1096 WeakPolarHBondContact CG2-OD1 3.41Å
1061	G	73.5	Confident	83.8	Confident	66 Å²	66	41.6 Å²	41.6	68%	0.68	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	78.8	12	-178.3	0	0	0	0	0	114	S1059	S1059-G1061 PolarHBondContact O-N 3.19Å; S1059-G1061 PolarHBondContact OG-N 3.12Å
1062	Y	75.8	Confident	84	Confident	69 Å²	69	40.8 Å²	40.8	27%	0.271	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	125.6	175.6	-168.7	-99.1	0	0	0	110.4	I1047 I1060 L1064 Y1091	I1047-Y1062 HydrophobicContact CD1-CD1 4.34Å; I1060-Y1062 VanDerWaalsContact C-N 3.3Å; Y1062-L1064 HydrophobicContact CD1-CD2 4.35Å; Y1062-L1064 HydrophobicContact CD1-CG 4.34Å; Y1062-L1064 HydrophobicContact CE1-CD2 3.7Å; Y1062-L1064 HydrophobicContact CE1-CG 4.15Å; Y1062-Y1091 HydrophobicContact CD1-CD2 4.49Å; Y1062-Y1091 AromaticContact CD1-CE2 3.58Å; Y1062-Y1091 HydrophobicContact CD1-CE2 3.58Å; Y1062-Y1091 HydrophobicContact CD2-CE2 4.32Å; Y1062-Y1091 HydrophobicContact CE1-CD2 4.2Å; Y1062-Y1091 AromaticContact CE1-CE2 3.51Å; Y1062-Y1091 HydrophobicContact CE1-CE2 3.51Å; Y1062-Y1091 HydrophobicContact CE2-CE2 4.28Å; Y1062-Y1091 AromaticContact CG-CE2 4Å; Y1062-Y1091 HydrophobicContact CG-CE2 4Å; Y1062-Y1091 AromaticContact CZ-CE2 3.9Å
1063	E	80.2	Confident	84.4	Confident	104 Å²	104	41.4 Å²	41.4	49%	0.486	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.3	176.4	-55.7	-161.6	145.7	0	0	110.1	Q1046	Q1046-E1063 HydrophobicContact CG-CG 4.14Å; Q1046-E1063 PolarHBondContact NE2-OE1 3Å
1064	L	81.6	Confident	84.6	Confident	9 Å²	9	37.9 Å²	37.9	5%	0.047	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	132.9	170.9	-66.6	160.8	0	0	0	109.2	Y1044 S1045 I1047 Y1062 S1066 V1068 L1081 M1083	Y1044-L1064 VanDerWaalsContact CA-O 3.28Å; Y1044-L1064 WeakPolarHBondContact CA-O 3.31Å; S1045-L1064 PolarHBondContact N-O 3.36Å; S1045-L1064 PolarHBondContact O-N 3.2Å; I1047-L1064 HydrophobicContact CD1-CD1 4.01Å; I1047-L1064 HydrophobicContact CD1-CG 4.49Å; I1047-L1064 HydrophobicContact CG1-CD1 4.16Å; Y1062-L1064 HydrophobicContact CD1-CD2 4.35Å; Y1062-L1064 HydrophobicContact CD1-CG 4.34Å; Y1062-L1064 HydrophobicContact CE1-CD2 3.7Å; Y1062-L1064 HydrophobicContact CE1-CG 4.15Å; L1064-S1066 PolarHBondContact O-N 3.16Å; L1064-V1068 HydrophobicContact CD1-CG2 3.46Å; L1064-V1068 VanDerWaalsContact CD1-CG2 3.46Å; L1064-L1081 HydrophobicContact CD1-CD1 3.95Å; L1064-L1081 HydrophobicContact CD2-CD1 4.35Å; L1064-M1083 HydrophobicContact CB-CE 3.82Å; L1064-M1083 HydrophobicContact CD1-CE 4.2Å; L1064-M1083 HydrophobicContact CD1-SD 4.32Å; L1064-M1083 HydrophobicContact CD2-CE 4.4Å; L1064-M1083 HydrophobicContact CG-CE 4.38Å
1065	E	78.7	Confident	84.8	Confident	135 Å²	135	36.6 Å²	36.6	63%	0.631	21%	0.209	S	C	*	.	S	Bend	trans	-72.7	15.4	-178.2	-58.5	177	165.2	0	0	114.2	S1000 L1043	S1000-E1065 VanDerWaalsContact CB-OE1 3.27Å; S1000-E1065 WeakPolarHBondContact CB-OE1 3.46Å; S1000-E1065 WeakPolarHBondContact CB-OE2 3.45Å; S1000-E1065 PolarHBondContact OG-OE2 3.18Å; L1043-E1065 CarbonylContact O-C 3.56Å
1066	S	81.9	Confident	84.8	Confident	15 Å²	15	40.8 Å²	40.8	11%	0.105	23%	0.231	C	C	.	.	S	Bend	trans	-157.2	165.2	175.2	-171.4	0	0	0	0	110.9	S1045 L1064 M1083 S1085	S1045-S1066 WeakPolarHBondContact CB-O 3.35Å; S1045-S1066 PolarHBondContact OG-O 3.42Å; L1064-S1066 PolarHBondContact O-N 3.16Å; S1066-M1083 WeakPolarHBondContact O-CE 3.49Å; S1066-S1085 WeakPolarHBondContact CB-OG 3.33Å; S1066-S1085 VanDerWaalsContact OG-CB 3.3Å; S1066-S1085 WeakPolarHBondContact OG-CB 3.44Å; S1066-S1085 PolarHBondContact OG-N 2.99Å; S1066-S1085 PolarHBondContact OG-OG 2.7Å
1067	R	83	Confident	85	Confident	54 Å²	54	41.8 Å²	41.8	20%	0.204	23%	0.233	C	C	.	.			trans	-67.4	126.6	172.9	176.7	158.8	179.1	170.4	7.4	111.2	Q1025 S1045 M1084	Q1025-R1067 HydrophobicContact CG-CG 4.4Å; S1045-R1067 WeakPolarHBondContact OG-CA 3.46Å; R1067-M1084 HydrophobicContact CB-CB 4.27Å; R1067-M1084 HydrophobicContact CB-CG 4.12Å; R1067-M1084 HydrophobicContact CB-SD 3.95Å; R1067-M1084 VanDerWaalsContact CD-SD 3.52Å; R1067-M1084 HydrophobicContact CG-CG 4.09Å; R1067-M1084 HydrophobicContact CG-SD 3.66Å; R1067-M1084 PolarHBondContact O-N 3.2Å
1068	V	90.1	Very high	85.3	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	127.7	168.8	-178.4	0	0	0	0	108.4	Q1025 A1026 C1038 S1045 L1064 C1070 L1081 M1083	Q1025-V1068 WeakPolarHBondContact CB-O 3.44Å; Q1025-V1068 PolarHBondContact OE1-O 3.48Å; A1026-V1068 HydrophobicContact CB-CG1 3.82Å; C1038-V1068 HydrophobicContact CB-CB 4.02Å; C1038-V1068 HydrophobicContact CB-CG1 4.23Å; C1038-V1068 HydrophobicContact CB-CG2 4.05Å; S1045-V1068 PolarHBondContact OG-N 2.76Å; S1045-V1068 VanDerWaalsContact OG-N 3.08Å; L1064-V1068 HydrophobicContact CD1-CG2 3.46Å; L1064-V1068 VanDerWaalsContact CD1-CG2 3.46Å; V1068-C1070 WeakPolarHBondContact CG1-O 3.34Å; V1068-L1081 HydrophobicContact CG1-CD2 4.08Å; V1068-L1081 HydrophobicContact CG2-CD2 4.45Å; V1068-M1083 HydrophobicContact CB-SD 4.49Å; V1068-M1083 HydrophobicContact CG2-CE 4.06Å; V1068-M1083 HydrophobicContact CG2-SD 3.77Å
1069	S	89.4	Confident	85.7	Confident	38 Å²	38	39.5 Å²	39.5	27%	0.266	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-36.2	177.3	40.1	0	0	0	0	112.3	G1082 V1108	S1069-G1082 PolarHBondContact N-O 2.94Å; S1069-G1082 PolarHBondContact OG-O 3.04Å; S1069-V1108 WeakPolarHBondContact CB-O 3.25Å; S1069-V1108 PolarHBondContact OG-O 3.18Å
1070	C	91.6	Very high	86.2	Confident	9 Å²	9	37.7 Å²	37.7	6%	0.061	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	158.5	175.8	55.9	0	0	0	0	111	V1068 G1082 V1108 I1111	V1068-C1070 WeakPolarHBondContact CG1-O 3.34Å; C1070-G1082 PolarHBondContact N-O 2.75Å; C1070-G1082 PolarHBondContact O-N 3.45Å; C1070-V1108 PolarHBondContact SG-O 2.86Å; C1070-V1108 VanDerWaalsContact SG-O 3.41Å; C1070-I1111 VanDerWaalsContact SG-CD1 3.52Å
1071	I	93.8	Very high	86.8	Confident	22 Å²	22	37 Å²	37	11%	0.113	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	141.2	-177.9	-172.1	171	0	0	0	109.5	A1026 I1027 T1028 W1036 I1079 L1080 L1081	A1026-I1071 HydrophobicContact CB-CB 3.78Å; A1026-I1071 HydrophobicContact CB-CG2 3.39Å; I1027-I1071 VanDerWaalsContact C-CG2 3.49Å; I1027-I1071 WeakPolarHBondContact O-CG2 3.44Å; T1028-I1071 HydrophobicContact CG2-CD1 3.82Å; T1028-I1071 HydrophobicContact CG2-CG1 3.73Å; T1028-I1071 HydrophobicContact CG2-CG2 4.21Å; W1036-I1071 HydrophobicContact CB-CD1 4.32Å; I1071-I1079 HydrophobicContact CD1-CG2 3.77Å; I1071-I1079 HydrophobicContact CG1-CG2 3.56Å; I1071-L1080 CarbonylContact C-O 3.53Å; I1071-L1080 WeakPolarHBondContact CA-O 3.43Å; I1071-L1081 HydrophobicContact CB-CD2 4.13Å; I1071-L1081 HydrophobicContact CD1-CD2 3.58Å; I1071-L1081 HydrophobicContact CG1-CD2 3.59Å
1072	C	92.9	Very high	87.8	Confident	15 Å²	15	33.8 Å²	33.8	10%	0.101	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	124.1	-179.6	-168.3	0	0	0	0	110.4	F1074 L1080 I1111 F1113	C1072-F1074 PolarHBondContact O-N 3.37Å; C1072-L1080 PolarHBondContact N-O 3.24Å; C1072-L1080 PolarHBondContact O-N 3.36Å; C1072-I1111 HydrophobicContact CB-CB 4.06Å; C1072-I1111 HydrophobicContact CB-CG2 3.86Å; C1072-F1113 VanDerWaalsContact SG-CD1 3.54Å
1073	A	91.8	Very high	88.4	Confident	18 Å²	18	30.8 Å²	30.8	15%	0.149	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	106.5	173.3	0	0	0	0	0	109.9	T1028 F1029 I1079 F1113	T1028-A1073 HydrophobicContact CG2-CB 4.04Å; F1029-A1073 VanDerWaalsContact O-CB 3.3Å; F1029-A1073 WeakPolarHBondContact O-CB 3.47Å; A1073-I1079 HydrophobicContact CB-CG1 4.41Å; A1073-F1113 WeakPolarHBondContact O-CE1 3.06Å
1074	F	88.6	Confident	88.5	Confident	12 Å²	12	30.4 Å²	30.4	5%	0.053	16%	0.161	C	C	.	.	S	Bend	trans	-77.5	-36	-179.9	176.7	-103.9	0	0	0	111.9	C1072 I1078 L1080 F1113 Y1115 N1122 V1124 I1139	C1072-F1074 PolarHBondContact O-N 3.37Å; F1074-I1078 HydrophobicContact CB-CB 4.43Å; F1074-I1078 HydrophobicContact CB-CG2 4.28Å; F1074-I1078 HydrophobicContact CD1-CB 4.16Å; F1074-I1078 HydrophobicContact CD1-CD1 4.37Å; F1074-I1078 HydrophobicContact CD1-CG2 4.2Å; F1074-I1078 PolarHBondContact N-O 2.98Å; F1074-L1080 HydrophobicContact CB-CD1 4.06Å; F1074-L1080 HydrophobicContact CB-CG 4.03Å; F1074-L1080 HydrophobicContact CD2-CD1 4.36Å; F1074-L1080 HydrophobicContact CG-CD1 4.43Å; F1074-F1113 HydrophobicContact CD2-CB 4.17Å; F1074-F1113 HydrophobicContact CD2-CD1 4.37Å; F1074-F1113 HydrophobicContact CD2-CD2 4.31Å; F1074-F1113 HydrophobicContact CD2-CG 4.02Å; F1074-F1113 HydrophobicContact CE2-CB 4.45Å; F1074-Y1115 WeakPolarHBondContact CD1-OH 3.26Å; F1074-Y1115 HydrophobicContact CE1-CE1 4.33Å; F1074-Y1115 WeakPolarHBondContact CE1-OH 3.49Å; F1074-Y1115 AromaticContact CE2-CE1 3.96Å; F1074-Y1115 HydrophobicContact CE2-CE1 3.96Å; F1074-Y1115 HydrophobicContact CE2-CE2 4.38Å; F1074-Y1115 AromaticContact CE2-CZ 3.62Å; F1074-Y1115 VanDerWaalsContact CE2-OH 3.3Å; F1074-Y1115 WeakPolarHBondContact CE2-OH 3.5Å; F1074-Y1115 AromaticContact CZ-CE1 3.67Å; F1074-Y1115 HydrophobicContact CZ-CE1 3.67Å; F1074-Y1115 AromaticContact CZ-CZ 3.6Å; F1074-Y1115 WeakPolarHBondContact CZ-OH 3.4Å; F1074-Y1115 PolarHBondContact O-OH 3.48Å; F1074-N1122 HydrophobicContact CE2-CB 4.29Å; F1074-N1122 HydrophobicContact CZ-CB 4.19Å; F1074-V1124 HydrophobicContact CD2-CG2 4.05Å; F1074-V1124 HydrophobicContact CE2-CG2 3.97Å; F1074-I1139 HydrophobicContact CD1-CG2 4.36Å; F1074-I1139 HydrophobicContact CE1-CG2 4.08Å; F1074-I1139 HydrophobicContact CE2-CB 4.32Å; F1074-I1139 HydrophobicContact CE2-CG2 4.3Å; F1074-I1139 HydrophobicContact CZ-CB 4.12Å; F1074-I1139 HydrophobicContact CZ-CG2 4.04Å; F1074-I1139 WeakPolarHBondContact CZ-O 3.48Å
1075	S	86.3	Confident	88.5	Confident	42 Å²	42	32.1 Å²	32.1	29%	0.294	17%	0.174	S	C	.	.	S	Bend	trans	-146.2	179.6	169.6	75.5	0	0	0	0	109.7	E1077 I1078	S1075-E1077 PolarHBondContact O-N 3.14Å; S1075-E1077 VanDerWaalsContact O-N 3.16Å; S1075-E1077 PolarHBondContact OG-N 3.11Å; S1075-E1077 VanDerWaalsContact OG-N 3.15Å; S1075-I1078 PolarHBondContact N-O 3.35Å; S1075-I1078 VanDerWaalsContact N-O 3.11Å; S1075-I1078 PolarHBondContact OG-N 2.89Å
1076	N	83.6	Confident	89	Confident	114 Å²	114	30 Å²	30	61%	0.61	16%	0.163	S	C	*	.	S	Bend	trans	-65.1	-14	173.3	-61	6.4	0	0	0	112.7	Y1030	Y1030-N1076 WeakPolarHBondContact O-CA 3.49Å; Y1030-N1076 PolarHBondContact O-OD1 2.98Å; Y1030-N1076 VanDerWaalsContact O-OD1 3.1Å
1077	E	88.3	Confident	89.4	Confident	48 Å²	48	30.6 Å²	30.6	22%	0.224	16%	0.164	C	C	.	.	S	Bend	trans	-110.2	-31.8	179.2	-176	173.2	173.6	0	0	112.8	S1075 S1092 V1093 I1094 F1141	S1075-E1077 PolarHBondContact O-N 3.14Å; S1075-E1077 VanDerWaalsContact O-N 3.16Å; S1075-E1077 PolarHBondContact OG-N 3.11Å; S1075-E1077 VanDerWaalsContact OG-N 3.15Å; E1077-S1092 CarbonylContact O-C 3.44Å; E1077-S1092 VanDerWaalsContact O-CA 3.26Å; E1077-S1092 WeakPolarHBondContact O-CA 3.26Å; E1077-S1092 PolarHBondContact OE1-OG 3.35Å; E1077-V1093 PolarHBondContact O-N 3.04Å; E1077-I1094 HydrophobicContact CB-CD1 4.1Å; E1077-I1094 HydrophobicContact CB-CG1 4.43Å; E1077-I1094 HydrophobicContact CG-CB 4.18Å; E1077-I1094 HydrophobicContact CG-CD1 3.79Å; E1077-I1094 HydrophobicContact CG-CG1 3.91Å; E1077-F1141 HydrophobicContact CG-CE1 4.27Å; E1077-F1141 HydrophobicContact CG-CZ 4.06Å; E1077-F1141 WeakPolarHBondContact OE1-CE1 3.34Å; E1077-F1141 WeakPolarHBondContact OE1-CZ 3.3Å; E1077-F1141 WeakPolarHBondContact OE2-CZ 3.48Å
1078	I	91.2	Very high	89.8	Confident	5 Å²	5	28 Å²	28	3%	0.026	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.7	-173.3	-56.9	178.3	0	0	0	110.2	F1074 S1075 L1080 A1090 Y1091 I1099 F1141	F1074-I1078 HydrophobicContact CB-CB 4.43Å; F1074-I1078 HydrophobicContact CB-CG2 4.28Å; F1074-I1078 HydrophobicContact CD1-CB 4.16Å; F1074-I1078 HydrophobicContact CD1-CD1 4.37Å; F1074-I1078 HydrophobicContact CD1-CG2 4.2Å; F1074-I1078 PolarHBondContact N-O 2.98Å; S1075-I1078 PolarHBondContact N-O 3.35Å; S1075-I1078 VanDerWaalsContact N-O 3.11Å; S1075-I1078 PolarHBondContact OG-N 2.89Å; I1078-L1080 HydrophobicContact CG2-CD2 4.2Å; I1078-A1090 HydrophobicContact CG2-CB 4.24Å; I1078-Y1091 WeakPolarHBondContact CA-O 3.32Å; I1078-I1099 HydrophobicContact CB-CD1 4.43Å; I1078-I1099 HydrophobicContact CD1-CD1 4.34Å; I1078-I1099 HydrophobicContact CG1-CD1 3.89Å; I1078-I1099 HydrophobicContact CG2-CD1 4.06Å; I1078-F1141 HydrophobicContact CD1-CD1 4.35Å; I1078-F1141 HydrophobicContact CD1-CD2 4.19Å; I1078-F1141 HydrophobicContact CD1-CE1 4.19Å; I1078-F1141 HydrophobicContact CD1-CE2 4.03Å; I1078-F1141 HydrophobicContact CD1-CG 4.34Å; I1078-F1141 HydrophobicContact CD1-CZ 4.02Å; I1078-F1141 HydrophobicContact CG1-CE1 4.18Å; I1078-F1141 HydrophobicContact CG1-CZ 4.14Å
1079	I	92.8	Very high	89.9	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.8	172.3	-66.6	174.8	0	0	0	109.2	Y1030 W1036 I1071 A1073 L1081 A1090 Y1091 V1093	Y1030-I1079 HydrophobicContact CD1-CD1 4.03Å; Y1030-I1079 HydrophobicContact CG-CD1 4.17Å; W1036-I1079 HydrophobicContact CD2-CD1 3.37Å; W1036-I1079 HydrophobicContact CE3-CB 4.37Å; W1036-I1079 HydrophobicContact CE3-CD1 3.23Å; W1036-I1079 HydrophobicContact CE3-CG1 4.37Å; W1036-I1079 HydrophobicContact CE3-CG2 4.19Å; W1036-I1079 HydrophobicContact CG-CD1 3.98Å; W1036-I1079 HydrophobicContact CH2-CD1 4.04Å; W1036-I1079 HydrophobicContact CZ2-CD1 4.19Å; W1036-I1079 HydrophobicContact CZ3-CB 4.21Å; W1036-I1079 HydrophobicContact CZ3-CD1 3.59Å; W1036-I1079 HydrophobicContact CZ3-CG1 4.43Å; W1036-I1079 HydrophobicContact CZ3-CG2 4.38Å; I1071-I1079 HydrophobicContact CD1-CG2 3.77Å; I1071-I1079 HydrophobicContact CG1-CG2 3.56Å; A1073-I1079 HydrophobicContact CB-CG1 4.41Å; I1079-L1081 HydrophobicContact CG2-CD2 4.31Å; I1079-L1081 HydrophobicContact CG2-CG 4.4Å; I1079-A1090 CarbonylContact O-C 3.59Å; I1079-A1090 WeakPolarHBondContact O-CA 3.45Å; I1079-Y1091 PolarHBondContact N-O 2.93Å; I1079-Y1091 PolarHBondContact O-N 3.02Å; I1079-V1093 HydrophobicContact CD1-CG2 3.46Å; I1079-V1093 VanDerWaalsContact CD1-CG2 3.46Å; I1079-V1093 HydrophobicContact CG1-CG2 3.86Å
1080	L	94.8	Very high	90	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	132.8	175.5	-56.9	179.3	0	0	0	109.8	I1071 C1072 F1074 I1078 C1089 A1090 W1100 V1124 I1139	I1071-L1080 CarbonylContact C-O 3.53Å; I1071-L1080 WeakPolarHBondContact CA-O 3.43Å; C1072-L1080 PolarHBondContact N-O 3.24Å; C1072-L1080 PolarHBondContact O-N 3.36Å; F1074-L1080 HydrophobicContact CB-CD1 4.06Å; F1074-L1080 HydrophobicContact CB-CG 4.03Å; F1074-L1080 HydrophobicContact CD2-CD1 4.36Å; F1074-L1080 HydrophobicContact CG-CD1 4.43Å; I1078-L1080 HydrophobicContact CG2-CD2 4.2Å; L1080-C1089 CarbonylContact C-O 3.6Å; L1080-C1089 WeakPolarHBondContact CA-O 3.35Å; L1080-A1090 HydrophobicContact CD2-CB 3.67Å; L1080-W1100 HydrophobicContact CD2-CH2 3.83Å; L1080-W1100 HydrophobicContact CD2-CZ2 4.09Å; L1080-V1124 HydrophobicContact CD1-CG1 3.88Å; L1080-V1124 HydrophobicContact CD1-CG2 3.91Å; L1080-I1139 HydrophobicContact CD1-CD1 4.43Å; L1080-I1139 HydrophobicContact CD2-CG2 4.44Å
1081	L	93.8	Very high	90	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	114.4	-176.9	-64	166.2	0	0	0	108.9	I1047 L1064 V1068 I1071 I1079 M1083 C1089	I1047-L1081 HydrophobicContact CD1-CD1 4.44Å; L1064-L1081 HydrophobicContact CD1-CD1 3.95Å; L1064-L1081 HydrophobicContact CD2-CD1 4.35Å; V1068-L1081 HydrophobicContact CG1-CD2 4.08Å; V1068-L1081 HydrophobicContact CG2-CD2 4.45Å; I1071-L1081 HydrophobicContact CB-CD2 4.13Å; I1071-L1081 HydrophobicContact CD1-CD2 3.58Å; I1071-L1081 HydrophobicContact CG1-CD2 3.59Å; I1079-L1081 HydrophobicContact CG2-CD2 4.31Å; I1079-L1081 HydrophobicContact CG2-CG 4.4Å; L1081-M1083 HydrophobicContact CB-SD 4.18Å; L1081-C1089 HydrophobicContact CB-CB 4.17Å; L1081-C1089 PolarHBondContact N-O 3.09Å; L1081-C1089 PolarHBondContact O-N 3.44Å
1082	G	93.1	Very high	89.8	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	124.1	168.4	0	0	0	0	0	109.7	S1069 C1070	S1069-G1082 PolarHBondContact N-O 2.94Å; S1069-G1082 PolarHBondContact OG-O 3.04Å; C1070-G1082 PolarHBondContact N-O 2.75Å; C1070-G1082 PolarHBondContact O-N 3.45Å
1083	M	88.4	Confident	89.4	Confident	6 Å²	6	25.3 Å²	25.3	3%	0.03	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	147.1	-176.4	-50.8	-64.3	-65.2	0	0	111.2	L1064 S1066 V1068 L1081 S1085 K1086 Q1087	L1064-M1083 HydrophobicContact CB-CE 3.82Å; L1064-M1083 HydrophobicContact CD1-CE 4.2Å; L1064-M1083 HydrophobicContact CD1-SD 4.32Å; L1064-M1083 HydrophobicContact CD2-CE 4.4Å; L1064-M1083 HydrophobicContact CG-CE 4.38Å; S1066-M1083 WeakPolarHBondContact O-CE 3.49Å; V1068-M1083 HydrophobicContact CB-SD 4.49Å; V1068-M1083 HydrophobicContact CG2-CE 4.06Å; V1068-M1083 HydrophobicContact CG2-SD 3.77Å; L1081-M1083 HydrophobicContact CB-SD 4.18Å; M1083-S1085 WeakPolarHBondContact CB-OG 3.43Å; M1083-S1085 PolarHBondContact O-N 3.43Å; M1083-K1086 PolarHBondContact O-N 2.72Å; M1083-Q1087 HydrophobicContact CB-CB 4.12Å; M1083-Q1087 WeakPolarHBondContact CB-O 3.14Å; M1083-Q1087 HydrophobicContact CG-CB 4.18Å; M1083-Q1087 PolarHBondContact N-O 2.96Å
1084	M	82.9	Confident	89	Confident	95 Å²	95	30.5 Å²	30.5	47%	0.468	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-14.2	170.8	-68.7	-165.5	68.2	0	0	113.3	R1067 K1086 S1107	R1067-M1084 HydrophobicContact CB-CB 4.27Å; R1067-M1084 HydrophobicContact CB-CG 4.12Å; R1067-M1084 HydrophobicContact CB-SD 3.95Å; R1067-M1084 VanDerWaalsContact CD-SD 3.52Å; R1067-M1084 HydrophobicContact CG-CG 4.09Å; R1067-M1084 HydrophobicContact CG-SD 3.66Å; R1067-M1084 PolarHBondContact O-N 3.2Å; M1084-K1086 PolarHBondContact O-N 3.35Å; M1084-S1107 PolarHBondContact O-OG 2.87Å; M1084-S1107 VanDerWaalsContact O-OG 3.11Å
1085	S	81.1	Confident	88.7	Confident	45 Å²	45	37 Å²	37	32%	0.315	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	13.1	171.9	54.7	0	0	0	0	114	S1066 M1083	S1066-S1085 WeakPolarHBondContact CB-OG 3.33Å; S1066-S1085 VanDerWaalsContact OG-CB 3.3Å; S1066-S1085 WeakPolarHBondContact OG-CB 3.44Å; S1066-S1085 PolarHBondContact OG-N 2.99Å; S1066-S1085 PolarHBondContact OG-OG 2.7Å; M1083-S1085 WeakPolarHBondContact CB-OG 3.43Å; M1083-S1085 PolarHBondContact O-N 3.43Å
1086	K	89.6	Confident	88.6	Confident	91 Å²	91	38.7 Å²	38.7	40%	0.396	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	44.4	-177.6	-41.2	179.3	169.4	-159.1	0	112.1	M1083 M1084 I1104 D1106	M1083-K1086 PolarHBondContact O-N 2.72Å; M1084-K1086 PolarHBondContact O-N 3.35Å; K1086-I1104 WeakPolarHBondContact CB-O 3.38Å; K1086-I1104 PolarHBondContact O-N 3.46Å; K1086-D1106 VanDerWaalsContact CE-OD1 3.31Å; K1086-D1106 WeakPolarHBondContact CE-OD1 3.49Å; K1086-D1106 IonicContact NZ-OD1 2.71Å
1087	Q	89.7	Confident	88.6	Confident	28 Å²	28	35.6 Å²	35.6	13%	0.131	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.2	-178.9	-59.7	-74.2	-46.1	0	0	109	M1083 Q1101 I1102	M1083-Q1087 HydrophobicContact CB-CB 4.12Å; M1083-Q1087 WeakPolarHBondContact CB-O 3.14Å; M1083-Q1087 HydrophobicContact CG-CB 4.18Å; M1083-Q1087 PolarHBondContact N-O 2.96Å; Q1087-Q1101 HydrophobicContact CB-CG 4.08Å; Q1087-Q1101 HydrophobicContact CG-CG 4.48Å; Q1087-I1102 WeakPolarHBondContact CA-O 3.3Å; Q1087-I1102 PolarHBondContact OE1-O 3.25Å
1088	L	91.9	Very high	88.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.8	163.9	-178.9	71	0	0	0	108.1	W1100 Q1101 I1102 I1104 I1111 I1136	L1088-W1100 HydrophobicContact CD2-CH2 4.44Å; L1088-W1100 HydrophobicContact CD2-CZ3 4.44Å; L1088-W1100 HydrophobicContact CG-CZ3 4.29Å; L1088-Q1101 WeakPolarHBondContact O-CA 3.47Å; L1088-I1102 HydrophobicContact CB-CD1 4.38Å; L1088-I1102 HydrophobicContact CB-CG1 3.98Å; L1088-I1102 HydrophobicContact CD2-CD1 4.32Å; L1088-I1102 PolarHBondContact N-O 2.63Å; L1088-I1102 WeakPolarHBondContact O-CG1 3.33Å; L1088-I1102 PolarHBondContact O-N 2.82Å; L1088-I1104 HydrophobicContact CB-CD1 3.4Å; L1088-I1104 VanDerWaalsContact CB-CD1 3.4Å; L1088-I1104 HydrophobicContact CB-CG1 4.13Å; L1088-I1104 HydrophobicContact CD2-CD1 4.09Å; L1088-I1104 HydrophobicContact CG-CD1 4.33Å; L1088-I1111 HydrophobicContact CD1-CD1 3.53Å; L1088-I1111 HydrophobicContact CD1-CG1 4.48Å; L1088-I1136 HydrophobicContact CD2-CD1 3.38Å
1089	C	91.4	Very high	88.5	Confident	1 Å²	1	39 Å²	39	1%	0.007	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.3	-175	174	0	0	0	0	109.3	L1080 L1081 K1098 Q1101	L1080-C1089 CarbonylContact C-O 3.6Å; L1080-C1089 WeakPolarHBondContact CA-O 3.35Å; L1081-C1089 HydrophobicContact CB-CB 4.17Å; L1081-C1089 PolarHBondContact N-O 3.09Å; L1081-C1089 PolarHBondContact O-N 3.44Å; C1089-K1098 VanDerWaalsContact SG-CG 3.6Å; C1089-Q1101 HydrophobicContact CB-CB 4.43Å; C1089-Q1101 HydrophobicContact CB-CG 4.2Å
1090	A	92.8	Very high	88.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.6	166.8	0	0	0	0	0	110.1	I1078 I1079 L1080 I1099 W1100	I1078-A1090 HydrophobicContact CG2-CB 4.24Å; I1079-A1090 CarbonylContact O-C 3.59Å; I1079-A1090 WeakPolarHBondContact O-CA 3.45Å; L1080-A1090 HydrophobicContact CD2-CB 3.67Å; A1090-I1099 HydrophobicContact CB-CB 4.2Å; A1090-I1099 HydrophobicContact CB-CD1 4.27Å; A1090-I1099 WeakPolarHBondContact O-CB 3.49Å; A1090-I1099 PolarHBondContact O-N 3.3Å; A1090-W1100 HydrophobicContact CB-CD2 3.58Å; A1090-W1100 HydrophobicContact CB-CE3 3.87Å; A1090-W1100 HydrophobicContact CB-CG 4.27Å; A1090-W1100 HydrophobicContact CB-CH2 3.6Å; A1090-W1100 HydrophobicContact CB-CZ2 3.28Å; A1090-W1100 HydrophobicContact CB-CZ3 3.88Å; A1090-W1100 PolarHBondContact N-O 2.88Å; A1090-W1100 PolarHBondContact O-N 3.47Å
1091	Y	91	Very high	88.2	Confident	1 Å²	1	43.1 Å²	43.1	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.3	-176.3	-161.1	-76.8	0	0	0	110.1	W1036 Y1062 I1078 I1079 N1096 S1097 K1098	W1036-Y1091 AromaticContact CH2-CD1 3.3Å; W1036-Y1091 HydrophobicContact CH2-CD1 3.3Å; W1036-Y1091 AromaticContact CH2-CE1 3.51Å; W1036-Y1091 HydrophobicContact CH2-CE1 3.51Å; W1036-Y1091 HydrophobicContact CH2-CG 4.22Å; W1036-Y1091 HydrophobicContact CZ2-CE1 4.46Å; W1036-Y1091 AromaticContact CZ3-CD1 3.69Å; W1036-Y1091 HydrophobicContact CZ3-CD1 3.69Å; W1036-Y1091 HydrophobicContact CZ3-CE1 4.17Å; W1036-Y1091 HydrophobicContact CZ3-CG 4.16Å; Y1062-Y1091 HydrophobicContact CD1-CD2 4.49Å; Y1062-Y1091 AromaticContact CD1-CE2 3.58Å; Y1062-Y1091 HydrophobicContact CD1-CE2 3.58Å; Y1062-Y1091 HydrophobicContact CD2-CE2 4.32Å; Y1062-Y1091 HydrophobicContact CE1-CD2 4.2Å; Y1062-Y1091 AromaticContact CE1-CE2 3.51Å; Y1062-Y1091 HydrophobicContact CE1-CE2 3.51Å; Y1062-Y1091 HydrophobicContact CE2-CE2 4.28Å; Y1062-Y1091 AromaticContact CG-CE2 4Å; Y1062-Y1091 HydrophobicContact CG-CE2 4Å; Y1062-Y1091 AromaticContact CZ-CE2 3.9Å; I1078-Y1091 WeakPolarHBondContact CA-O 3.32Å; I1079-Y1091 PolarHBondContact N-O 2.93Å; I1079-Y1091 PolarHBondContact O-N 3.02Å; Y1091-N1096 PolarHBondContact OH-O 2.88Å; Y1091-N1096 VanDerWaalsContact OH-O 3.07Å; Y1091-N1096 PolarHBondContact OH-OD1 3.27Å; Y1091-N1096 VanDerWaalsContact OH-OD1 3.05Å; Y1091-S1097 VanDerWaalsContact CE1-N 3.32Å; Y1091-S1097 VanDerWaalsContact CZ-N 3.32Å; Y1091-S1097 PolarHBondContact OH-N 3.09Å; Y1091-K1098 HydrophobicContact CD2-CB 4.3Å
1092	S	88.9	Confident	88.1	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	117.8	175.6	174.1	0	0	0	0	109.6	E1077 I1094 R1095 N1096 S1097	E1077-S1092 CarbonylContact O-C 3.44Å; E1077-S1092 VanDerWaalsContact O-CA 3.26Å; E1077-S1092 WeakPolarHBondContact O-CA 3.26Å; E1077-S1092 PolarHBondContact OE1-OG 3.35Å; S1092-I1094 VanDerWaalsContact C-N 3.32Å; S1092-R1095 WeakPolarHBondContact OG-CB 3.22Å; S1092-R1095 WeakPolarHBondContact OG-CG 3.5Å; S1092-R1095 PolarHBondContact OG-N 3.43Å; S1092-R1095 VanDerWaalsContact OG-N 3.07Å; S1092-N1096 WeakPolarHBondContact O-CA 3.41Å; S1092-N1096 PolarHBondContact O-N 2.72Å; S1092-S1097 PolarHBondContact N-O 3.48Å; S1092-S1097 PolarHBondContact O-N 3.03Å
1093	V	85.3	Confident	87.9	Confident	26 Å²	26	47.6 Å²	47.6	16%	0.158	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-45.5	175.4	-179.9	0	0	0	0	110.3	Y1030 W1036 E1077 I1079 N1096	Y1030-V1093 HydrophobicContact CD2-CG1 4.04Å; Y1030-V1093 HydrophobicContact CD2-CG2 4.2Å; Y1030-V1093 HydrophobicContact CE2-CG1 3.59Å; Y1030-V1093 HydrophobicContact CG-CG2 4.22Å; W1036-V1093 HydrophobicContact CH2-CB 4.39Å; W1036-V1093 HydrophobicContact CH2-CG2 3.87Å; W1036-V1093 HydrophobicContact CZ2-CB 3.96Å; W1036-V1093 HydrophobicContact CZ2-CG1 3.85Å; W1036-V1093 HydrophobicContact CZ2-CG2 3.63Å; E1077-V1093 PolarHBondContact O-N 3.04Å; I1079-V1093 HydrophobicContact CD1-CG2 3.46Å; I1079-V1093 VanDerWaalsContact CD1-CG2 3.46Å; I1079-V1093 HydrophobicContact CG1-CG2 3.86Å; V1093-N1096 PolarHBondContact O-N 2.95Å
1094	I	82.9	Confident	88	Confident	126 Å²	126	47.8 Å²	47.8	65%	0.646	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-45.1	-176	-60.7	178.5	0	0	0	111.3	E1077 S1092 N1096	E1077-I1094 HydrophobicContact CB-CD1 4.1Å; E1077-I1094 HydrophobicContact CB-CG1 4.43Å; E1077-I1094 HydrophobicContact CG-CB 4.18Å; E1077-I1094 HydrophobicContact CG-CD1 3.79Å; E1077-I1094 HydrophobicContact CG-CG1 3.91Å; S1092-I1094 VanDerWaalsContact C-N 3.32Å; I1094-N1096 PolarHBondContact O-N 2.8Å
1095	R	83.5	Confident	88.1	Confident	148 Å²	148	47.9 Å²	47.9	56%	0.558	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-3.9	-179.9	-56.7	176.1	-174.5	-178.3	0.6	112.9	S1092 S1097	S1092-R1095 WeakPolarHBondContact OG-CB 3.22Å; S1092-R1095 WeakPolarHBondContact OG-CG 3.5Å; S1092-R1095 PolarHBondContact OG-N 3.43Å; S1092-R1095 VanDerWaalsContact OG-N 3.07Å; R1095-S1097 VanDerWaalsContact CB-OG 3.25Å; R1095-S1097 WeakPolarHBondContact CB-OG 3.27Å; R1095-S1097 WeakPolarHBondContact O-CB 3.27Å; R1095-S1097 PolarHBondContact O-N 2.95Å; R1095-S1097 VanDerWaalsContact O-N 3.11Å; R1095-S1097 PolarHBondContact O-OG 3.16Å
1096	N	82.6	Confident	88.6	Confident	79 Å²	79	47.2 Å²	47.2	42%	0.422	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	42.3	46	-174.1	-162.9	27.5	0	0	0	113.1	I1060 Y1091 S1092 V1093 I1094	I1060-N1096 WeakPolarHBondContact CG2-OD1 3.41Å; Y1091-N1096 PolarHBondContact OH-O 2.88Å; Y1091-N1096 VanDerWaalsContact OH-O 3.07Å; Y1091-N1096 PolarHBondContact OH-OD1 3.27Å; Y1091-N1096 VanDerWaalsContact OH-OD1 3.05Å; S1092-N1096 WeakPolarHBondContact O-CA 3.41Å; S1092-N1096 PolarHBondContact O-N 2.72Å; V1093-N1096 PolarHBondContact O-N 2.95Å; I1094-N1096 PolarHBondContact O-N 2.8Å
1097	S	84.7	Confident	88.6	Confident	48 Å²	48	43.7 Å²	43.7	34%	0.336	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	154	-172.5	47	0	0	0	0	112.6	Y1091 S1092 R1095 I1099	Y1091-S1097 VanDerWaalsContact CE1-N 3.32Å; Y1091-S1097 VanDerWaalsContact CZ-N 3.32Å; Y1091-S1097 PolarHBondContact OH-N 3.09Å; S1092-S1097 PolarHBondContact N-O 3.48Å; S1092-S1097 PolarHBondContact O-N 3.03Å; R1095-S1097 VanDerWaalsContact CB-OG 3.25Å; R1095-S1097 WeakPolarHBondContact CB-OG 3.27Å; R1095-S1097 WeakPolarHBondContact O-CB 3.27Å; R1095-S1097 PolarHBondContact O-N 2.95Å; R1095-S1097 VanDerWaalsContact O-N 3.11Å; R1095-S1097 PolarHBondContact O-OG 3.16Å; S1097-I1099 PolarHBondContact O-N 3.3Å
1098	K	87.9	Confident	88.8	Confident	89 Å²	89	42.3 Å²	42.3	39%	0.387	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	124.8	174.4	-174.1	167.8	81.1	-179.2	0	109.9	C1089 Y1091 Q1101	C1089-K1098 VanDerWaalsContact SG-CG 3.6Å; Y1091-K1098 HydrophobicContact CD2-CB 4.3Å; K1098-Q1101 HydrophobicContact CD-CB 3.99Å
1099	I	89.5	Confident	88.8	Confident	37 Å²	37	43.8 Å²	43.8	19%	0.19	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-58.1	178.7	-54.1	175	0	0	0	108.9	I1078 A1090 S1097 F1141	I1078-I1099 HydrophobicContact CB-CD1 4.43Å; I1078-I1099 HydrophobicContact CD1-CD1 4.34Å; I1078-I1099 HydrophobicContact CG1-CD1 3.89Å; I1078-I1099 HydrophobicContact CG2-CD1 4.06Å; A1090-I1099 HydrophobicContact CB-CB 4.2Å; A1090-I1099 HydrophobicContact CB-CD1 4.27Å; A1090-I1099 WeakPolarHBondContact O-CB 3.49Å; A1090-I1099 PolarHBondContact O-N 3.3Å; S1097-I1099 PolarHBondContact O-N 3.3Å; I1099-F1141 HydrophobicContact CD1-CD1 4.05Å; I1099-F1141 HydrophobicContact CD1-CE1 4.27Å; I1099-F1141 HydrophobicContact CG2-CB 4.42Å; I1099-F1141 HydrophobicContact CG2-CD1 4.36Å; I1099-F1141 WeakPolarHBondContact CG2-O 3.18Å
1100	W	92.1	Very high	89	Confident	14 Å²	14	44.7 Å²	44.7	5%	0.053	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	162.1	177.6	47.9	-108.2	0	0	0	109.6	L1080 L1088 A1090 I1102 I1139 G1140 E1142 E1143 P1144	L1080-W1100 HydrophobicContact CD2-CH2 3.83Å; L1080-W1100 HydrophobicContact CD2-CZ2 4.09Å; L1088-W1100 HydrophobicContact CD2-CH2 4.44Å; L1088-W1100 HydrophobicContact CD2-CZ3 4.44Å; L1088-W1100 HydrophobicContact CG-CZ3 4.29Å; A1090-W1100 HydrophobicContact CB-CD2 3.58Å; A1090-W1100 HydrophobicContact CB-CE3 3.87Å; A1090-W1100 HydrophobicContact CB-CG 4.27Å; A1090-W1100 HydrophobicContact CB-CH2 3.6Å; A1090-W1100 HydrophobicContact CB-CZ2 3.28Å; A1090-W1100 HydrophobicContact CB-CZ3 3.88Å; A1090-W1100 PolarHBondContact N-O 2.88Å; A1090-W1100 PolarHBondContact O-N 3.47Å; W1100-I1102 HydrophobicContact CE3-CG1 4.41Å; W1100-I1102 HydrophobicContact CE3-CG2 4.24Å; W1100-I1102 HydrophobicContact CZ3-CD1 4.33Å; W1100-I1102 HydrophobicContact CZ3-CG1 4.12Å; W1100-I1139 HydrophobicContact CH2-CD1 4.03Å; W1100-I1139 HydrophobicContact CZ2-CD1 4.26Å; W1100-I1139 HydrophobicContact CZ2-CG2 3.87Å; W1100-G1140 PolarHBondContact NE1-O 2.99Å; W1100-E1142 PolarHBondContact NE1-O 3.1Å; W1100-E1143 HydrophobicContact CB-CB 4.05Å; W1100-E1143 HydrophobicContact CB-CG 4.26Å; W1100-E1143 HydrophobicContact CG-CB 4.26Å; W1100-P1144 HydrophobicContact CH2-CG 4.5Å
1101	Q	90	Very high	89.1	Confident	72 Å²	72	45.3 Å²	45.3	34%	0.336	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	125	176.3	-178.8	-172.9	-45.9	0	0	108.4	Q1087 L1088 C1089 K1098	Q1087-Q1101 HydrophobicContact CB-CG 4.08Å; Q1087-Q1101 HydrophobicContact CG-CG 4.48Å; L1088-Q1101 WeakPolarHBondContact O-CA 3.47Å; C1089-Q1101 HydrophobicContact CB-CB 4.43Å; C1089-Q1101 HydrophobicContact CB-CG 4.2Å; K1098-Q1101 HydrophobicContact CD-CB 3.99Å
1102	I	90.1	Very high	89.2	Confident	5 Å²	5	46.5 Å²	46.5	3%	0.026	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	141.1	-176.5	58.6	169.5	0	0	0	110.5	Q1087 L1088 W1100 I1136 E1143 P1144 I1148	Q1087-I1102 WeakPolarHBondContact CA-O 3.3Å; Q1087-I1102 PolarHBondContact OE1-O 3.25Å; L1088-I1102 HydrophobicContact CB-CD1 4.38Å; L1088-I1102 HydrophobicContact CB-CG1 3.98Å; L1088-I1102 HydrophobicContact CD2-CD1 4.32Å; L1088-I1102 PolarHBondContact N-O 2.63Å; L1088-I1102 WeakPolarHBondContact O-CG1 3.33Å; L1088-I1102 PolarHBondContact O-N 2.82Å; W1100-I1102 HydrophobicContact CE3-CG1 4.41Å; W1100-I1102 HydrophobicContact CE3-CG2 4.24Å; W1100-I1102 HydrophobicContact CZ3-CD1 4.33Å; W1100-I1102 HydrophobicContact CZ3-CG1 4.12Å; I1102-I1136 HydrophobicContact CD1-CD1 3.86Å; I1102-E1143 HydrophobicContact CG2-CG 3.78Å; I1102-P1144 HydrophobicContact CD1-CG 4.1Å; I1102-I1148 HydrophobicContact CD1-CD1 3.59Å; I1102-I1148 HydrophobicContact CD1-CG1 4.45Å
1103	P	89.4	Confident	89.4	Confident	88 Å²	88	49.1 Å²	49.1	57%	0.571	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	139.7	169.7	30	-33	0	0	0	110.5
1104	I	90.1	Very high	89.7	Confident	10 Å²	10	48.2 Å²	48.2	5%	0.051	25%	0.245	C	C	.	.			trans	-122.5	158.6	174.1	-65.1	-165.4	0	0	0	108.7	K1086 L1088 D1106 V1108 L1128 V1134 Y1150	K1086-I1104 WeakPolarHBondContact CB-O 3.38Å; K1086-I1104 PolarHBondContact O-N 3.46Å; L1088-I1104 HydrophobicContact CB-CD1 3.4Å; L1088-I1104 VanDerWaalsContact CB-CD1 3.4Å; L1088-I1104 HydrophobicContact CB-CG1 4.13Å; L1088-I1104 HydrophobicContact CD2-CD1 4.09Å; L1088-I1104 HydrophobicContact CG-CD1 4.33Å; I1104-D1106 VanDerWaalsContact C-N 3.27Å; I1104-D1106 PolarHBondContact O-N 3.27Å; I1104-V1108 HydrophobicContact CD1-CG2 4.15Å; I1104-L1128 HydrophobicContact CG2-CD1 3.5Å; I1104-L1128 VanDerWaalsContact CG2-CD1 3.5Å; I1104-L1128 HydrophobicContact CG2-CD2 3.62Å; I1104-L1128 HydrophobicContact CG2-CG 4.21Å; I1104-V1134 HydrophobicContact CD1-CG1 4.47Å; I1104-V1134 HydrophobicContact CD1-CG2 4.47Å; I1104-V1134 HydrophobicContact CG2-CG2 3.78Å; I1104-Y1150 HydrophobicContact CG2-CE1 3.98Å
1105	H	86.6	Confident	90	Very high	97 Å²	97	47.2 Å²	47.2	45%	0.449	23%	0.234	S	C	.	.	S	Bend	trans	-55.4	-37.5	-177	-70.4	-174.3	0	0	0	114.4	L1128 E1132 Y1150	H1105-L1128 HydrophobicContact CB-CD1 4.13Å; H1105-E1132 WeakPolarHBondContact CB-OE2 3.45Å; H1105-E1132 IonicContact CG-OE2 3.61Å; H1105-E1132 IonicContact ND1-OE1 3.04Å; H1105-E1132 IonicContact ND1-OE2 2.68Å; H1105-E1132 PolarHBondContact ND1-OE2 3.38Å; H1105-Y1150 HydrophobicContact CB-CD1 4.35Å; H1105-Y1150 HydrophobicContact CB-CE1 3.95Å; H1105-Y1150 AromaticContact CD2-CE1 3.48Å; H1105-Y1150 VanDerWaalsContact CD2-CE1 3.48Å; H1105-Y1150 WeakPolarHBondContact CD2-CE1 3.43Å; H1105-Y1150 AromaticContact CD2-CZ 3.51Å; H1105-Y1150 AromaticContact CE1-CD1 3.53Å; H1105-Y1150 AromaticContact CE1-CD2 3.78Å; H1105-Y1150 AromaticContact CE1-CE1 3.78Å; H1105-Y1150 AromaticContact CE1-CG 3.53Å; H1105-Y1150 AromaticContact CG-CD1 3.68Å; H1105-Y1150 AromaticContact CG-CE1 3.39Å; H1105-Y1150 AromaticContact CG-CZ 3.94Å; H1105-Y1150 AromaticContact ND1-CD1 3.35Å; H1105-Y1150 VanDerWaalsContact ND1-CD1 3.35Å; H1105-Y1150 WeakPolarHBondContact ND1-CD1 3.46Å; H1105-Y1150 AromaticContact ND1-CE1 3.59Å; H1105-Y1150 AromaticContact ND1-CG 3.81Å; H1105-Y1150 AromaticContact NE2-CD1 3.96Å; H1105-Y1150 AromaticContact NE2-CD2 3.87Å; H1105-Y1150 AromaticContact NE2-CE1 3.75Å; H1105-Y1150 AromaticContact NE2-CE2 3.65Å; H1105-Y1150 AromaticContact NE2-CZ 3.59Å
1106	D	91	Very high	90.1	Very high	31 Å²	31	41.9 Å²	41.9	17%	0.166	22%	0.215	C	C	.	.	S	Bend	trans	-151.4	-178.9	179.9	-155	9.4	0	0	0	112.7	K1086 I1104 V1108 L1128 T1129 N1130	K1086-D1106 VanDerWaalsContact CE-OD1 3.31Å; K1086-D1106 WeakPolarHBondContact CE-OD1 3.49Å; K1086-D1106 IonicContact NZ-OD1 2.71Å; I1104-D1106 VanDerWaalsContact C-N 3.27Å; I1104-D1106 PolarHBondContact O-N 3.27Å; D1106-V1108 PolarHBondContact O-N 2.84Å; D1106-L1128 HydrophobicContact CB-CB 4.46Å; D1106-L1128 HydrophobicContact CB-CD1 4.48Å; D1106-T1129 PolarHBondContact OD1-OG1 3.45Å; D1106-T1129 PolarHBondContact OD2-OG1 3.12Å; D1106-N1130 HydrophobicContact CB-CB 4.01Å; D1106-N1130 WeakPolarHBondContact OD2-CB 3.5Å; D1106-N1130 PolarHBondContact OD2-N 3.35Å
1107	S	90.1	Very high	89.9	Confident	17 Å²	17	45 Å²	45	12%	0.119	23%	0.231	C	C	.	.			trans	-62.1	133.9	-179.1	-54.4	0	0	0	0	111.2	M1084 L1128 T1129	M1084-S1107 PolarHBondContact O-OG 2.87Å; M1084-S1107 VanDerWaalsContact O-OG 3.11Å; S1107-L1128 WeakPolarHBondContact O-CA 3.31Å; S1107-T1129 WeakPolarHBondContact CB-OG1 3.49Å; S1107-T1129 PolarHBondContact N-OG1 3.38Å; S1107-T1129 PolarHBondContact O-N 2.76Å; S1107-T1129 PolarHBondContact O-OG1 3.13Å
1108	V	92.6	Very high	89.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	118.3	-178.8	-171.3	0	0	0	0	110.1	S1069 C1070 I1104 D1106 I1111 A1126 G1127 L1128	S1069-V1108 WeakPolarHBondContact CB-O 3.25Å; S1069-V1108 PolarHBondContact OG-O 3.18Å; C1070-V1108 PolarHBondContact SG-O 2.86Å; C1070-V1108 VanDerWaalsContact SG-O 3.41Å; I1104-V1108 HydrophobicContact CD1-CG2 4.15Å; D1106-V1108 PolarHBondContact O-N 2.84Å; V1108-I1111 HydrophobicContact CG1-CD1 3.84Å; V1108-I1111 HydrophobicContact CG1-CG1 3.52Å; V1108-A1126 HydrophobicContact CG1-CB 3.8Å; V1108-G1127 CarbonylContact C-O 3.56Å; V1108-L1128 HydrophobicContact CB-CD2 4.26Å; V1108-L1128 HydrophobicContact CG1-CD2 4.4Å; V1108-L1128 HydrophobicContact CG2-CD2 3.85Å
1109	S	91.9	Very high	88.9	Confident	31 Å²	31	51 Å²	51	22%	0.217	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-37.8	-174.6	50	0	0	0	0	114	G1127 I1158	S1109-G1127 PolarHBondContact N-O 3.19Å; S1109-G1127 VanDerWaalsContact OG-C 3.24Å; S1109-G1127 PolarHBondContact OG-O 3.49Å; S1109-I1158 WeakPolarHBondContact CB-O 3.38Å; S1109-I1158 PolarHBondContact OG-O 3.16Å
1110	D	95.1	Very high	88.4	Confident	20 Å²	20	57.6 Å²	57.6	11%	0.107	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	148.3	178.6	-155	14.9	0	0	0	109.6	A1126 G1127 S1160 V1161 K1202	D1110-A1126 CarbonylContact O-C 3.6Å; D1110-A1126 WeakPolarHBondContact O-CA 3.29Å; D1110-G1127 PolarHBondContact O-N 2.94Å; D1110-S1160 VanDerWaalsContact OD2-CA 3.24Å; D1110-S1160 WeakPolarHBondContact OD2-CA 3.41Å; D1110-S1160 PolarHBondContact OD2-OG 2.84Å; D1110-V1161 HydrophobicContact CB-CG2 4.44Å; D1110-V1161 PolarHBondContact OD2-N 3.12Å; D1110-K1202 IonicContact OD1-NZ 3.84Å; D1110-K1202 PolarHBondContact OD1-NZ 3.16Å; D1110-K1202 IonicContact OD2-NZ 2.94Å; D1110-K1202 PolarHBondContact OD2-NZ 3.25Å
1111	I	95.4	Very high	88	Confident	12 Å²	12	58.7 Å²	58.7	6%	0.062	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.3	-178.5	-60.9	161.9	0	0	0	109.3	C1070 C1072 L1088 V1108 V1124 Y1125 A1126	C1070-I1111 VanDerWaalsContact SG-CD1 3.52Å; C1072-I1111 HydrophobicContact CB-CB 4.06Å; C1072-I1111 HydrophobicContact CB-CG2 3.86Å; L1088-I1111 HydrophobicContact CD1-CD1 3.53Å; L1088-I1111 HydrophobicContact CD1-CG1 4.48Å; V1108-I1111 HydrophobicContact CG1-CD1 3.84Å; V1108-I1111 HydrophobicContact CG1-CG1 3.52Å; I1111-V1124 HydrophobicContact CG2-CG1 3.78Å; I1111-Y1125 WeakPolarHBondContact CA-O 3.43Å; I1111-A1126 HydrophobicContact CG1-CB 4.04Å
1112	T	94.3	Very high	87.9	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	-139.9	169.3	168.2	-165	0	0	0	0	110.4	Y1125 V1161 L1168	T1112-Y1125 HydrophobicContact CG2-CD2 4.02Å; T1112-Y1125 HydrophobicContact CG2-CG 4.48Å; T1112-Y1125 PolarHBondContact N-O 2.84Å; T1112-Y1125 PolarHBondContact O-N 3.34Å; T1112-V1161 HydrophobicContact CG2-CB 4.27Å; T1112-V1161 HydrophobicContact CG2-CG1 3.62Å; T1112-L1168 HydrophobicContact CG2-CD1 3.97Å
1113	F	93.3	Very high	88	Confident	55 Å²	55	57.1 Å²	57.1	24%	0.241	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.6	179.6	65.2	-92.2	0	0	0	111.7	C1072 A1073 F1074 Y1115 K1123 V1124 L1163	C1072-F1113 VanDerWaalsContact SG-CD1 3.54Å; A1073-F1113 WeakPolarHBondContact O-CE1 3.06Å; F1074-F1113 HydrophobicContact CD2-CB 4.17Å; F1074-F1113 HydrophobicContact CD2-CD1 4.37Å; F1074-F1113 HydrophobicContact CD2-CD2 4.31Å; F1074-F1113 HydrophobicContact CD2-CG 4.02Å; F1074-F1113 HydrophobicContact CE2-CB 4.45Å; F1113-Y1115 AromaticContact CD2-CD2 3.64Å; F1113-Y1115 HydrophobicContact CD2-CD2 3.64Å; F1113-Y1115 AromaticContact CD2-CE2 3.42Å; F1113-Y1115 HydrophobicContact CD2-CE2 3.42Å; F1113-Y1115 VanDerWaalsContact CD2-CE2 3.42Å; F1113-Y1115 AromaticContact CE2-CD2 3.57Å; F1113-Y1115 HydrophobicContact CE2-CD2 3.57Å; F1113-Y1115 AromaticContact CE2-CE2 3.23Å; F1113-Y1115 HydrophobicContact CE2-CE2 3.23Å; F1113-Y1115 HydrophobicContact CZ-CE2 4.28Å; F1113-K1123 CarbonylContact C-O 3.56Å; F1113-K1123 WeakPolarHBondContact CA-O 3.13Å; F1113-V1124 HydrophobicContact CB-CG2 3.87Å; F1113-L1163 WeakPolarHBondContact O-CD2 3.19Å
1114	A	91.1	Very high	88.2	Confident	6 Å²	6	53 Å²	53	5%	0.05	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.3	172.7	0	0	0	0	0	110.2	F1116 N1122 K1123 Y1125 L1163	A1114-F1116 HydrophobicContact CB-CE1 4.3Å; A1114-F1116 HydrophobicContact CB-CE2 3.78Å; A1114-F1116 HydrophobicContact CB-CZ 3.61Å; A1114-N1122 CarbonylContact O-C 3.58Å; A1114-N1122 VanDerWaalsContact O-CA 3.31Å; A1114-N1122 WeakPolarHBondContact O-CA 3.4Å; A1114-K1123 PolarHBondContact N-O 2.94Å; A1114-K1123 PolarHBondContact O-N 2.82Å; A1114-Y1125 HydrophobicContact CB-CE2 3.8Å; A1114-L1163 HydrophobicContact CB-CD1 4.41Å; A1114-L1163 HydrophobicContact CB-CD2 3.63Å
1115	Y	88.5	Confident	88.5	Confident	106 Å²	106	52.5 Å²	52.5	42%	0.416	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	124.8	168.9	-72.5	-78.4	0	0	0	109.4	F1074 F1113 N1122	F1074-Y1115 WeakPolarHBondContact CD1-OH 3.26Å; F1074-Y1115 HydrophobicContact CE1-CE1 4.33Å; F1074-Y1115 WeakPolarHBondContact CE1-OH 3.49Å; F1074-Y1115 AromaticContact CE2-CE1 3.96Å; F1074-Y1115 HydrophobicContact CE2-CE1 3.96Å; F1074-Y1115 HydrophobicContact CE2-CE2 4.38Å; F1074-Y1115 AromaticContact CE2-CZ 3.62Å; F1074-Y1115 VanDerWaalsContact CE2-OH 3.3Å; F1074-Y1115 WeakPolarHBondContact CE2-OH 3.5Å; F1074-Y1115 AromaticContact CZ-CE1 3.67Å; F1074-Y1115 HydrophobicContact CZ-CE1 3.67Å; F1074-Y1115 AromaticContact CZ-CZ 3.6Å; F1074-Y1115 WeakPolarHBondContact CZ-OH 3.4Å; F1074-Y1115 PolarHBondContact O-OH 3.48Å; F1113-Y1115 AromaticContact CD2-CD2 3.64Å; F1113-Y1115 HydrophobicContact CD2-CD2 3.64Å; F1113-Y1115 AromaticContact CD2-CE2 3.42Å; F1113-Y1115 HydrophobicContact CD2-CE2 3.42Å; F1113-Y1115 VanDerWaalsContact CD2-CE2 3.42Å; F1113-Y1115 AromaticContact CE2-CD2 3.57Å; F1113-Y1115 HydrophobicContact CE2-CD2 3.57Å; F1113-Y1115 AromaticContact CE2-CE2 3.23Å; F1113-Y1115 HydrophobicContact CE2-CE2 3.23Å; F1113-Y1115 HydrophobicContact CZ-CE2 4.28Å; Y1115-N1122 HydrophobicContact CD1-CB 3.51Å; Y1115-N1122 HydrophobicContact CE1-CB 3.67Å; Y1115-N1122 HydrophobicContact CG-CB 4.39Å
1116	F	86.7	Confident	88.9	Confident	35 Å²	35	47.9 Å²	47.9	15%	0.154	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	88.7	179	-59.5	-74.5	0	0	0	109.5	A1114 H1118 D1119 H1120 T1121 K1123 A1181 K1182	A1114-F1116 HydrophobicContact CB-CE1 4.3Å; A1114-F1116 HydrophobicContact CB-CE2 3.78Å; A1114-F1116 HydrophobicContact CB-CZ 3.61Å; F1116-H1118 VanDerWaalsContact C-N 3.26Å; F1116-H1118 PolarHBondContact O-N 3.48Å; F1116-H1118 VanDerWaalsContact O-N 3.15Å; F1116-D1119 PolarHBondContact O-N 2.97Å; F1116-D1119 VanDerWaalsContact O-N 3.09Å; F1116-H1120 PolarHBondContact O-N 3.49Å; F1116-H1120 VanDerWaalsContact O-N 3.12Å; F1116-T1121 PolarHBondContact N-O 3.45Å; F1116-T1121 PolarHBondContact O-N 3.32Å; F1116-K1123 HydrophobicContact CD2-CG 4.3Å; F1116-K1123 HydrophobicContact CE2-CB 4.04Å; F1116-K1123 HydrophobicContact CE2-CD 3.93Å; F1116-K1123 HydrophobicContact CE2-CG 3.73Å; F1116-A1181 HydrophobicContact CZ-CB 4.23Å; F1116-K1182 HydrophobicContact CD1-CB 4.03Å; F1116-K1182 HydrophobicContact CD1-CD 4.16Å; F1116-K1182 HydrophobicContact CD1-CG 3.98Å; F1116-K1182 HydrophobicContact CE1-CB 3.52Å; F1116-K1182 HydrophobicContact CE1-CG 3.96Å; F1116-K1182 HydrophobicContact CG-CG 4.33Å; F1116-K1182 HydrophobicContact CZ-CB 3.86Å; F1116-K1182 HydrophobicContact CZ-CG 4.29Å
1117	L	78.4	Confident	89.2	Confident	144 Å²	144	46.4 Å²	46.4	75%	0.754	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-38.1	-172.2	-70.6	170.3	0	0	0	114.3	D1119 H1120	L1117-D1119 VanDerWaalsContact C-N 3.31Å; L1117-D1119 PolarHBondContact O-N 3.04Å; L1117-H1120 PolarHBondContact O-N 2.97Å
1118	H	76.7	Confident	89.4	Confident	185 Å²	185	45.6 Å²	45.6	86%	0.856	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-28.1	-177.6	-69	-61.4	0	0	0	114	F1116	F1116-H1118 VanDerWaalsContact C-N 3.26Å; F1116-H1118 PolarHBondContact O-N 3.48Å; F1116-H1118 VanDerWaalsContact O-N 3.15Å
1119	D	73.8	Confident	89.3	Confident	79 Å²	79	47.9 Å²	47.9	42%	0.422	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-5.1	-176.8	-63.5	20.7	0	0	0	111.3	F1116 L1117 T1121 K1182	F1116-D1119 PolarHBondContact O-N 2.97Å; F1116-D1119 VanDerWaalsContact O-N 3.09Å; L1117-D1119 VanDerWaalsContact C-N 3.31Å; L1117-D1119 PolarHBondContact O-N 3.04Å; D1119-T1121 HydrophobicContact CB-CG2 4.07Å; D1119-T1121 PolarHBondContact O-N 3.27Å; D1119-T1121 VanDerWaalsContact O-N 3.14Å; D1119-K1182 IonicContact OD1-NZ 3.94Å; D1119-K1182 PolarHBondContact OD1-NZ 3.31Å; D1119-K1182 WeakPolarHBondContact OD2-CE 3.44Å; D1119-K1182 IonicContact OD2-NZ 3.48Å; D1119-K1182 PolarHBondContact OD2-NZ 3.1Å
1120	H	79.1	Confident	89	Confident	175 Å²	175	48.8 Å²	48.8	81%	0.81	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	27.3	-168.4	-58.9	-68.9	0	0	0	113.7	F1116 L1117	F1116-H1120 PolarHBondContact O-N 3.49Å; F1116-H1120 VanDerWaalsContact O-N 3.12Å; L1117-H1120 PolarHBondContact O-N 2.97Å
1121	T	83.4	Confident	88.6	Confident	38 Å²	38	47.9 Å²	47.9	23%	0.233	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	155	177.9	57.7	0	0	0	0	111.1	F1116 D1119 N1138	F1116-T1121 PolarHBondContact N-O 3.45Å; F1116-T1121 PolarHBondContact O-N 3.32Å; D1119-T1121 HydrophobicContact CB-CG2 4.07Å; D1119-T1121 PolarHBondContact O-N 3.27Å; D1119-T1121 VanDerWaalsContact O-N 3.14Å; T1121-N1138 WeakPolarHBondContact CA-OD1 3.44Å; T1121-N1138 VanDerWaalsContact CB-OD1 3.3Å; T1121-N1138 WeakPolarHBondContact CB-OD1 3.27Å; T1121-N1138 WeakPolarHBondContact CG2-OD1 3.34Å
1122	N	89.2	Confident	88.5	Confident	20 Å²	20	48.5 Å²	48.5	11%	0.107	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	154	170.5	70.2	69.8	0	0	0	109.8	F1074 A1114 Y1115 E1137 N1138 I1139	F1074-N1122 HydrophobicContact CE2-CB 4.29Å; F1074-N1122 HydrophobicContact CZ-CB 4.19Å; A1114-N1122 CarbonylContact O-C 3.58Å; A1114-N1122 VanDerWaalsContact O-CA 3.31Å; A1114-N1122 WeakPolarHBondContact O-CA 3.4Å; Y1115-N1122 HydrophobicContact CD1-CB 3.51Å; Y1115-N1122 HydrophobicContact CE1-CB 3.67Å; Y1115-N1122 HydrophobicContact CG-CB 4.39Å; N1122-E1137 WeakPolarHBondContact O-CA 3.36Å; N1122-N1138 PolarHBondContact N-OD1 2.85Å; N1122-N1138 PolarHBondContact O-N 3.4Å; N1122-N1138 WeakPolarHBondContact OD1-CA 3.46Å; N1122-N1138 PolarHBondContact OD1-N 3.39Å; N1122-I1139 PolarHBondContact ND2-O 2.93Å; N1122-I1139 PolarHBondContact OD1-N 3.22Å
1123	K	91.6	Very high	88.6	Confident	24 Å²	24	47.2 Å²	47.2	10%	0.104	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.8	173.5	-62.2	-166	-174.2	-159.7	0	109.7	F1113 A1114 F1116 Y1125 V1135 I1136 E1137 K1182	F1113-K1123 CarbonylContact C-O 3.56Å; F1113-K1123 WeakPolarHBondContact CA-O 3.13Å; A1114-K1123 PolarHBondContact N-O 2.94Å; A1114-K1123 PolarHBondContact O-N 2.82Å; F1116-K1123 HydrophobicContact CD2-CG 4.3Å; F1116-K1123 HydrophobicContact CE2-CB 4.04Å; F1116-K1123 HydrophobicContact CE2-CD 3.93Å; F1116-K1123 HydrophobicContact CE2-CG 3.73Å; K1123-Y1125 HydrophobicContact CB-CE1 4.08Å; K1123-Y1125 HydrophobicContact CB-CE2 3.99Å; K1123-Y1125 WeakPolarHBondContact CB-OH 3.45Å; K1123-Y1125 HydrophobicContact CD-CE1 4.44Å; K1123-V1135 HydrophobicContact CB-CG1 4.49Å; K1123-V1135 HydrophobicContact CD-CG1 4.16Å; K1123-I1136 CarbonylContact C-O 3.52Å; K1123-I1136 WeakPolarHBondContact CA-O 3.23Å; K1123-E1137 HydrophobicContact CD-CG 4.15Å; K1123-E1137 WeakPolarHBondContact CE-OE1 3.25Å; K1123-E1137 HydrophobicContact CG-CG 4.05Å; K1123-E1137 IonicContact NZ-OE1 3.17Å; K1123-E1137 PolarHBondContact NZ-OE1 3.15Å; K1123-K1182 WeakPolarHBondContact CE-O 3.18Å; K1123-K1182 PolarHBondContact NZ-O 3.13Å
1124	V	94	Very high	88.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.5	170.9	175.9	0	0	0	0	108.6	F1074 L1080 I1111 F1113 V1135 I1136 I1139	F1074-V1124 HydrophobicContact CD2-CG2 4.05Å; F1074-V1124 HydrophobicContact CE2-CG2 3.97Å; L1080-V1124 HydrophobicContact CD1-CG1 3.88Å; L1080-V1124 HydrophobicContact CD1-CG2 3.91Å; I1111-V1124 HydrophobicContact CG2-CG1 3.78Å; F1113-V1124 HydrophobicContact CB-CG2 3.87Å; V1124-V1135 CarbonylContact O-C 3.51Å; V1124-V1135 WeakPolarHBondContact O-CA 3.24Å; V1124-I1136 HydrophobicContact CB-CB 4.41Å; V1124-I1136 PolarHBondContact N-O 2.95Å; V1124-I1136 PolarHBondContact O-N 3.43Å; V1124-I1139 HydrophobicContact CB-CD1 3.68Å; V1124-I1139 HydrophobicContact CB-CG1 4.35Å; V1124-I1139 HydrophobicContact CG1-CD1 4.21Å; V1124-I1139 HydrophobicContact CG2-CB 4.12Å; V1124-I1139 HydrophobicContact CG2-CD1 3.51Å; V1124-I1139 HydrophobicContact CG2-CG1 3.92Å
1125	Y	96.2	Very high	88.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	118	-178.8	-49.7	-82.2	0	0	0	108.1	I1111 T1112 A1114 K1123 V1134 V1135 L1168 A1181 M1184	I1111-Y1125 WeakPolarHBondContact CA-O 3.43Å; T1112-Y1125 HydrophobicContact CG2-CD2 4.02Å; T1112-Y1125 HydrophobicContact CG2-CG 4.48Å; T1112-Y1125 PolarHBondContact N-O 2.84Å; T1112-Y1125 PolarHBondContact O-N 3.34Å; A1114-Y1125 HydrophobicContact CB-CE2 3.8Å; K1123-Y1125 HydrophobicContact CB-CE1 4.08Å; K1123-Y1125 HydrophobicContact CB-CE2 3.99Å; K1123-Y1125 WeakPolarHBondContact CB-OH 3.45Å; K1123-Y1125 HydrophobicContact CD-CE1 4.44Å; Y1125-V1134 CarbonylContact C-O 3.52Å; Y1125-V1134 VanDerWaalsContact CA-O 3.3Å; Y1125-V1134 WeakPolarHBondContact CA-O 3.45Å; Y1125-V1135 HydrophobicContact CD1-CB 4.49Å; Y1125-V1135 HydrophobicContact CD1-CG1 4.06Å; Y1125-V1135 HydrophobicContact CD1-CG2 4.01Å; Y1125-V1135 HydrophobicContact CE1-CG1 3.89Å; Y1125-V1135 HydrophobicContact CE1-CG2 4.38Å; Y1125-L1168 HydrophobicContact CD1-CD1 4.31Å; Y1125-L1168 HydrophobicContact CD1-CD2 3.51Å; Y1125-L1168 HydrophobicContact CD2-CD1 3.84Å; Y1125-L1168 HydrophobicContact CE1-CD2 3.95Å; Y1125-L1168 HydrophobicContact CE2-CD1 4.31Å; Y1125-L1168 HydrophobicContact CG-CD1 3.83Å; Y1125-L1168 HydrophobicContact CG-CD2 3.83Å; Y1125-A1181 PolarHBondContact OH-O 3.03Å; Y1125-M1184 HydrophobicContact CD1-CE 4.49Å; Y1125-M1184 HydrophobicContact CD1-SD 4.2Å; Y1125-M1184 HydrophobicContact CE1-CE 4.39Å; Y1125-M1184 HydrophobicContact CE1-SD 3.53Å; Y1125-M1184 VanDerWaalsContact CE1-SD 3.53Å
1126	A	95.8	Very high	88.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	115.8	-178.6	0	0	0	0	0	109.7	V1108 D1110 I1111 L1133 V1134	V1108-A1126 HydrophobicContact CG1-CB 3.8Å; D1110-A1126 CarbonylContact O-C 3.6Å; D1110-A1126 WeakPolarHBondContact O-CA 3.29Å; I1111-A1126 HydrophobicContact CG1-CB 4.04Å; A1126-L1133 CarbonylContact O-C 3.49Å; A1126-L1133 WeakPolarHBondContact O-CA 3.35Å; A1126-V1134 HydrophobicContact CB-CB 4.21Å; A1126-V1134 PolarHBondContact N-O 2.72Å; A1126-V1134 PolarHBondContact O-N 2.9Å
1127	G	95.4	Very high	88.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	140	173.4	0	0	0	0	0	110.5	V1108 S1109 D1110	V1108-G1127 CarbonylContact C-O 3.56Å; S1109-G1127 PolarHBondContact N-O 3.19Å; S1109-G1127 VanDerWaalsContact OG-C 3.24Å; S1109-G1127 PolarHBondContact OG-O 3.49Å; D1110-G1127 PolarHBondContact O-N 2.94Å
1128	L	95.5	Very high	89.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	159.3	-179.5	-54.1	-168.8	0	0	0	112.6	I1104 H1105 D1106 S1107 V1108 N1130 G1131 E1132 V1134 Y1150 I1158	I1104-L1128 HydrophobicContact CG2-CD1 3.5Å; I1104-L1128 VanDerWaalsContact CG2-CD1 3.5Å; I1104-L1128 HydrophobicContact CG2-CD2 3.62Å; I1104-L1128 HydrophobicContact CG2-CG 4.21Å; H1105-L1128 HydrophobicContact CB-CD1 4.13Å; D1106-L1128 HydrophobicContact CB-CB 4.46Å; D1106-L1128 HydrophobicContact CB-CD1 4.48Å; S1107-L1128 WeakPolarHBondContact O-CA 3.31Å; V1108-L1128 HydrophobicContact CB-CD2 4.26Å; V1108-L1128 HydrophobicContact CG1-CD2 4.4Å; V1108-L1128 HydrophobicContact CG2-CD2 3.85Å; L1128-N1130 VanDerWaalsContact C-N 3.27Å; L1128-N1130 WeakPolarHBondContact CB-OD1 3.34Å; L1128-N1130 PolarHBondContact O-N 2.78Å; L1128-G1131 PolarHBondContact O-N 2.67Å; L1128-E1132 VanDerWaalsContact CB-O 3.23Å; L1128-E1132 WeakPolarHBondContact CB-O 3.44Å; L1128-E1132 HydrophobicContact CD1-CB 4.15Å; L1128-E1132 HydrophobicContact CG-CB 4.49Å; L1128-E1132 WeakPolarHBondContact CG-O 3.23Å; L1128-E1132 PolarHBondContact N-O 3.4Å; L1128-V1134 HydrophobicContact CD1-CG2 3.58Å; L1128-V1134 HydrophobicContact CD2-CG2 3.81Å; L1128-V1134 HydrophobicContact CG-CG2 3.72Å; L1128-Y1150 HydrophobicContact CD1-CE1 4.37Å; L1128-I1158 PolarHBondContact O-N 2.93Å
1129	T	89.6	Confident	89.6	Confident	49 Å²	49	28.8 Å²	28.8	30%	0.301	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.3	178.5	49.2	0	0	0	0	114.8	D1106 S1107 G1131 P1157	D1106-T1129 PolarHBondContact OD1-OG1 3.45Å; D1106-T1129 PolarHBondContact OD2-OG1 3.12Å; S1107-T1129 WeakPolarHBondContact CB-OG1 3.49Å; S1107-T1129 PolarHBondContact N-OG1 3.38Å; S1107-T1129 PolarHBondContact O-N 2.76Å; S1107-T1129 PolarHBondContact O-OG1 3.13Å; T1129-G1131 VanDerWaalsContact C-N 3.3Å; T1129-P1157 VanDerWaalsContact O-CA 3.32Å; T1129-P1157 WeakPolarHBondContact O-CA 3.42Å; T1129-P1157 WeakPolarHBondContact O-CB 3.29Å; T1129-P1157 WeakPolarHBondContact O-CG 3.4Å
1130	N	86.8	Confident	90.1	Very high	50 Å²	50	26 Å²	26	27%	0.267	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-2.4	173.4	65.5	-7.6	0	0	0	113.3	D1106 L1128 E1132	D1106-N1130 HydrophobicContact CB-CB 4.01Å; D1106-N1130 WeakPolarHBondContact OD2-CB 3.5Å; D1106-N1130 PolarHBondContact OD2-N 3.35Å; L1128-N1130 VanDerWaalsContact C-N 3.27Å; L1128-N1130 WeakPolarHBondContact CB-OD1 3.34Å; L1128-N1130 PolarHBondContact O-N 2.78Å; N1130-E1132 VanDerWaalsContact ND2-CD 3.33Å; N1130-E1132 PolarHBondContact ND2-OE2 3.37Å; N1130-E1132 WeakPolarHBondContact OD1-CB 3.25Å; N1130-E1132 WeakPolarHBondContact OD1-CG 3.45Å; N1130-E1132 PolarHBondContact OD1-N 2.96Å; N1130-E1132 VanDerWaalsContact OD1-N 3.12Å
1131	G	86.5	Confident	90.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	91.3	9.8	-179.1	0	0	0	0	0	115.2	L1128 T1129 I1153 S1154 I1156	L1128-G1131 PolarHBondContact O-N 2.67Å; T1129-G1131 VanDerWaalsContact C-N 3.3Å; G1131-I1153 PolarHBondContact O-N 3.36Å; G1131-S1154 CarbonylContact C-O 3.48Å; G1131-S1154 VanDerWaalsContact CA-O 3.28Å; G1131-S1154 WeakPolarHBondContact CA-O 3.45Å; G1131-S1154 PolarHBondContact O-N 2.95Å; G1131-S1154 VanDerWaalsContact O-N 3.16Å; G1131-I1156 WeakPolarHBondContact CA-O 3.33Å
1132	E	93.9	Very high	90.2	Very high	26 Å²	26	27.7 Å²	27.7	12%	0.121	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	145	172.4	-57.9	-177.2	137.1	0	0	112.2	H1105 L1128 N1130 I1151 T1152 I1158	H1105-E1132 WeakPolarHBondContact CB-OE2 3.45Å; H1105-E1132 IonicContact CG-OE2 3.61Å; H1105-E1132 IonicContact ND1-OE1 3.04Å; H1105-E1132 IonicContact ND1-OE2 2.68Å; H1105-E1132 PolarHBondContact ND1-OE2 3.38Å; L1128-E1132 VanDerWaalsContact CB-O 3.23Å; L1128-E1132 WeakPolarHBondContact CB-O 3.44Å; L1128-E1132 HydrophobicContact CD1-CB 4.15Å; L1128-E1132 HydrophobicContact CG-CB 4.49Å; L1128-E1132 WeakPolarHBondContact CG-O 3.23Å; L1128-E1132 PolarHBondContact N-O 3.4Å; N1130-E1132 VanDerWaalsContact ND2-CD 3.33Å; N1130-E1132 PolarHBondContact ND2-OE2 3.37Å; N1130-E1132 WeakPolarHBondContact OD1-CB 3.25Å; N1130-E1132 WeakPolarHBondContact OD1-CG 3.45Å; N1130-E1132 PolarHBondContact OD1-N 2.96Å; N1130-E1132 VanDerWaalsContact OD1-N 3.12Å; E1132-I1151 CarbonylContact C-O 3.53Å; E1132-I1151 WeakPolarHBondContact CA-O 3.36Å; E1132-T1152 HydrophobicContact CG-CG2 4.15Å; E1132-T1152 PolarHBondContact OE1-OG1 3.23Å; E1132-I1158 VanDerWaalsContact C-CD1 3.43Å; E1132-I1158 VanDerWaalsContact O-CD1 3.25Å; E1132-I1158 WeakPolarHBondContact O-CD1 3.38Å
1133	L	95.1	Very high	89.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.1	170.6	175.7	76.9	0	0	0	108.4	A1126 V1135 I1151 I1153 I1158 V1161 L1168 M1184	A1126-L1133 CarbonylContact O-C 3.49Å; A1126-L1133 WeakPolarHBondContact O-CA 3.35Å; L1133-V1135 HydrophobicContact CD2-CG2 4.35Å; L1133-V1135 HydrophobicContact CG-CG2 4.48Å; L1133-I1151 HydrophobicContact CB-CB 4.12Å; L1133-I1151 HydrophobicContact CB-CG2 4.46Å; L1133-I1151 HydrophobicContact CD2-CD1 4.39Å; L1133-I1151 PolarHBondContact N-O 3.37Å; L1133-I1151 WeakPolarHBondContact O-CA 3.26Å; L1133-I1151 WeakPolarHBondContact O-CB 3.38Å; L1133-I1151 PolarHBondContact O-N 3.3Å; L1133-I1153 HydrophobicContact CB-CD1 3.6Å; L1133-I1153 HydrophobicContact CB-CG1 4.14Å; L1133-I1153 HydrophobicContact CD2-CD1 4.04Å; L1133-I1153 HydrophobicContact CG-CD1 4.35Å; L1133-I1158 HydrophobicContact CB-CD1 3.83Å; L1133-V1161 HydrophobicContact CD1-CG1 4.27Å; L1133-V1161 HydrophobicContact CD1-CG2 4.16Å; L1133-L1168 HydrophobicContact CD2-CD2 3.64Å; L1133-M1184 HydrophobicContact CD2-CE 3.62Å
1134	V	93.8	Very high	89.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.8	173.3	-170	0	0	0	0	108.9	I1104 Y1125 A1126 L1128 I1136 I1148 Y1149 Y1150	I1104-V1134 HydrophobicContact CD1-CG1 4.47Å; I1104-V1134 HydrophobicContact CD1-CG2 4.47Å; I1104-V1134 HydrophobicContact CG2-CG2 3.78Å; Y1125-V1134 CarbonylContact C-O 3.52Å; Y1125-V1134 VanDerWaalsContact CA-O 3.3Å; Y1125-V1134 WeakPolarHBondContact CA-O 3.45Å; A1126-V1134 HydrophobicContact CB-CB 4.21Å; A1126-V1134 PolarHBondContact N-O 2.72Å; A1126-V1134 PolarHBondContact O-N 2.9Å; L1128-V1134 HydrophobicContact CD1-CG2 3.58Å; L1128-V1134 HydrophobicContact CD2-CG2 3.81Å; L1128-V1134 HydrophobicContact CG-CG2 3.72Å; V1134-I1136 HydrophobicContact CG1-CD1 4.22Å; V1134-I1136 HydrophobicContact CG1-CG1 3.82Å; V1134-I1148 HydrophobicContact CG1-CG2 3.53Å; V1134-Y1149 CarbonylContact C-O 3.59Å; V1134-Y1149 WeakPolarHBondContact CA-O 3.34Å; V1134-Y1150 HydrophobicContact CB-CE1 4.5Å; V1134-Y1150 HydrophobicContact CG1-CE1 4.23Å; V1134-Y1150 HydrophobicContact CG2-CD1 3.72Å; V1134-Y1150 HydrophobicContact CG2-CE1 3.55Å
1135	V	93.1	Very high	87.9	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.018	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121	172.7	-172.7	0	0	0	0	107.6	K1123 V1124 Y1125 L1133 I1148 Y1149 I1151 M1184	K1123-V1135 HydrophobicContact CB-CG1 4.49Å; K1123-V1135 HydrophobicContact CD-CG1 4.16Å; V1124-V1135 CarbonylContact O-C 3.51Å; V1124-V1135 WeakPolarHBondContact O-CA 3.24Å; Y1125-V1135 HydrophobicContact CD1-CB 4.49Å; Y1125-V1135 HydrophobicContact CD1-CG1 4.06Å; Y1125-V1135 HydrophobicContact CD1-CG2 4.01Å; Y1125-V1135 HydrophobicContact CE1-CG1 3.89Å; Y1125-V1135 HydrophobicContact CE1-CG2 4.38Å; L1133-V1135 HydrophobicContact CD2-CG2 4.35Å; L1133-V1135 HydrophobicContact CG-CG2 4.48Å; V1135-I1148 CarbonylContact O-C 3.54Å; V1135-Y1149 PolarHBondContact N-O 3.16Å; V1135-Y1149 PolarHBondContact O-N 2.86Å; V1135-I1151 HydrophobicContact CG2-CD1 3.53Å; V1135-I1151 HydrophobicContact CG2-CG1 4.29Å; V1135-M1184 HydrophobicContact CG2-CE 3.9Å; V1135-M1184 HydrophobicContact CG2-CG 4.48Å; V1135-M1184 HydrophobicContact CG2-SD 4.38Å
1136	I	91.2	Very high	86.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	120.5	178.7	-49.4	179.9	0	0	0	108.3	L1088 I1102 K1123 V1124 V1134 I1139 P1144 S1147 I1148	L1088-I1136 HydrophobicContact CD2-CD1 3.38Å; I1102-I1136 HydrophobicContact CD1-CD1 3.86Å; K1123-I1136 CarbonylContact C-O 3.52Å; K1123-I1136 WeakPolarHBondContact CA-O 3.23Å; V1124-I1136 HydrophobicContact CB-CB 4.41Å; V1124-I1136 PolarHBondContact N-O 2.95Å; V1124-I1136 PolarHBondContact O-N 3.43Å; V1134-I1136 HydrophobicContact CG1-CD1 4.22Å; V1134-I1136 HydrophobicContact CG1-CG1 3.82Å; I1136-I1139 HydrophobicContact CB-CD1 3.79Å; I1136-I1139 HydrophobicContact CB-CG1 4Å; I1136-I1139 HydrophobicContact CD1-CD1 4.14Å; I1136-I1139 HydrophobicContact CG2-CD1 3.59Å; I1136-I1139 HydrophobicContact CG2-CG1 3.47Å; I1136-I1139 VanDerWaalsContact CG2-CG1 3.47Å; I1136-P1144 HydrophobicContact CG2-CB 3.52Å; I1136-P1144 HydrophobicContact CG2-CG 3.73Å; I1136-S1147 CarbonylContact C-O 3.56Å; I1136-S1147 VanDerWaalsContact CA-O 3.31Å; I1136-S1147 WeakPolarHBondContact CA-O 3.23Å; I1136-I1148 HydrophobicContact CD1-CG1 4.41Å; I1136-I1148 HydrophobicContact CG1-CG1 4.13Å; I1136-I1148 HydrophobicContact CG1-CG2 4.24Å; I1136-I1148 HydrophobicContact CG2-CG1 4.06Å
1137	E	88.2	Confident	85.6	Confident	44 Å²	44	47.3 Å²	47.3	21%	0.206	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	143.9	-178.2	-53.4	-173.5	150.6	0	0	111.1	N1122 K1123 I1139 S1147 Y1149	N1122-E1137 WeakPolarHBondContact O-CA 3.36Å; K1123-E1137 HydrophobicContact CD-CG 4.15Å; K1123-E1137 WeakPolarHBondContact CE-OE1 3.25Å; K1123-E1137 HydrophobicContact CG-CG 4.05Å; K1123-E1137 IonicContact NZ-OE1 3.17Å; K1123-E1137 PolarHBondContact NZ-OE1 3.15Å; E1137-I1139 PolarHBondContact O-N 3.26Å; E1137-S1147 PolarHBondContact N-O 3.34Å; E1137-S1147 WeakPolarHBondContact O-CB 3.48Å; E1137-S1147 PolarHBondContact O-OG 2.81Å; E1137-Y1149 HydrophobicContact CG-CD2 4.22Å; E1137-Y1149 HydrophobicContact CG-CE2 3.74Å
1138	N	84.8	Confident	85.2	Confident	90 Å²	90	49.3 Å²	49.3	48%	0.481	24%	0.244	S	C	.	.	S	Bend	trans	56.8	47.1	173.7	-57.1	-37.3	0	0	0	114.1	T1121 N1122	T1121-N1138 WeakPolarHBondContact CA-OD1 3.44Å; T1121-N1138 VanDerWaalsContact CB-OD1 3.3Å; T1121-N1138 WeakPolarHBondContact CB-OD1 3.27Å; T1121-N1138 WeakPolarHBondContact CG2-OD1 3.34Å; N1122-N1138 PolarHBondContact N-OD1 2.85Å; N1122-N1138 PolarHBondContact O-N 3.4Å; N1122-N1138 WeakPolarHBondContact OD1-CA 3.46Å; N1122-N1138 PolarHBondContact OD1-N 3.39Å
1139	I	85	Confident	84.7	Confident	6 Å²	6	54.9 Å²	54.9	3%	0.031	27%	0.266	C	S	.	.			trans	-62.7	139.8	171.4	-69.8	-155.1	0	0	0	110.9	F1074 L1080 W1100 N1122 V1124 I1136 E1137	F1074-I1139 HydrophobicContact CD1-CG2 4.36Å; F1074-I1139 HydrophobicContact CE1-CG2 4.08Å; F1074-I1139 HydrophobicContact CE2-CB 4.32Å; F1074-I1139 HydrophobicContact CE2-CG2 4.3Å; F1074-I1139 HydrophobicContact CZ-CB 4.12Å; F1074-I1139 HydrophobicContact CZ-CG2 4.04Å; F1074-I1139 WeakPolarHBondContact CZ-O 3.48Å; L1080-I1139 HydrophobicContact CD1-CD1 4.43Å; L1080-I1139 HydrophobicContact CD2-CG2 4.44Å; W1100-I1139 HydrophobicContact CH2-CD1 4.03Å; W1100-I1139 HydrophobicContact CZ2-CD1 4.26Å; W1100-I1139 HydrophobicContact CZ2-CG2 3.87Å; N1122-I1139 PolarHBondContact ND2-O 2.93Å; N1122-I1139 PolarHBondContact OD1-N 3.22Å; V1124-I1139 HydrophobicContact CB-CD1 3.68Å; V1124-I1139 HydrophobicContact CB-CG1 4.35Å; V1124-I1139 HydrophobicContact CG1-CD1 4.21Å; V1124-I1139 HydrophobicContact CG2-CB 4.12Å; V1124-I1139 HydrophobicContact CG2-CD1 3.51Å; V1124-I1139 HydrophobicContact CG2-CG1 3.92Å; I1136-I1139 HydrophobicContact CB-CD1 3.79Å; I1136-I1139 HydrophobicContact CB-CG1 4Å; I1136-I1139 HydrophobicContact CD1-CD1 4.14Å; I1136-I1139 HydrophobicContact CG2-CD1 3.59Å; I1136-I1139 HydrophobicContact CG2-CG1 3.47Å; I1136-I1139 VanDerWaalsContact CG2-CG1 3.47Å; E1137-I1139 PolarHBondContact O-N 3.26Å
1140	G	83.8	Confident	84.6	Confident	20 Å²	20	55 Å²	55	21%	0.206	26%	0.261	C	S	.	.	S	Bend	trans	-163.4	-145.3	173	0	0	0	0	0	111.5	W1100 E1142	W1100-G1140 PolarHBondContact NE1-O 2.99Å; G1140-E1142 VanDerWaalsContact C-N 3.27Å
1141	F	83.7	Confident	84.5	Confident	84 Å²	84	53.3 Å²	53.3	37%	0.368	25%	0.252	S	S	.	.	S	Bend	trans	-72.9	-21.4	174.6	-69.7	-82.3	0	0	0	113.4	E1077 I1078 I1099	E1077-F1141 HydrophobicContact CG-CE1 4.27Å; E1077-F1141 HydrophobicContact CG-CZ 4.06Å; E1077-F1141 WeakPolarHBondContact OE1-CE1 3.34Å; E1077-F1141 WeakPolarHBondContact OE1-CZ 3.3Å; E1077-F1141 WeakPolarHBondContact OE2-CZ 3.48Å; I1078-F1141 HydrophobicContact CD1-CD1 4.35Å; I1078-F1141 HydrophobicContact CD1-CD2 4.19Å; I1078-F1141 HydrophobicContact CD1-CE1 4.19Å; I1078-F1141 HydrophobicContact CD1-CE2 4.03Å; I1078-F1141 HydrophobicContact CD1-CG 4.34Å; I1078-F1141 HydrophobicContact CD1-CZ 4.02Å; I1078-F1141 HydrophobicContact CG1-CE1 4.18Å; I1078-F1141 HydrophobicContact CG1-CZ 4.14Å; I1099-F1141 HydrophobicContact CD1-CD1 4.05Å; I1099-F1141 HydrophobicContact CD1-CE1 4.27Å; I1099-F1141 HydrophobicContact CG2-CB 4.42Å; I1099-F1141 HydrophobicContact CG2-CD1 4.36Å; I1099-F1141 WeakPolarHBondContact CG2-O 3.18Å
1142	E	81.9	Confident	84.6	Confident	166 Å²	166	54.1 Å²	54.1	78%	0.776	26%	0.257	S	S	*	.	S	Bend	trans	-86.5	146.2	177.3	-63.8	-175.7	-179.4	0	0	110.4	W1100 G1140	W1100-E1142 PolarHBondContact NE1-O 3.1Å; G1140-E1142 VanDerWaalsContact C-N 3.27Å
1143	E	81.9	Confident	84.1	Confident	78 Å²	78	53.9 Å²	53.9	36%	0.364	26%	0.256	S	S	.	.			trans	-68.2	128.4	177.6	-177.2	-171.7	-170.6	0	0	110.2	W1100 I1102 R1145	W1100-E1143 HydrophobicContact CB-CB 4.05Å; W1100-E1143 HydrophobicContact CB-CG 4.26Å; W1100-E1143 HydrophobicContact CG-CB 4.26Å; I1102-E1143 HydrophobicContact CG2-CG 3.78Å; E1143-R1145 HydrophobicContact CG-CG 4.23Å; E1143-R1145 PolarHBondContact O-N 2.9Å; E1143-R1145 IonicContact OE2-CZ 2.61Å; E1143-R1145 IonicContact OE2-NE 3.18Å; E1143-R1145 PolarHBondContact OE2-NE 3.31Å; E1143-R1145 IonicContact OE2-NH2 2.94Å; E1143-R1145 PolarHBondContact OE2-NH2 3.5Å; E1143-R1145 VanDerWaalsContact OE2-NH2 3.12Å
1144	P	79.2	Confident	83.3	Confident	9 Å²	9	54.8 Å²	54.8	6%	0.058	26%	0.263	C	S	.	.			trans	-76.8	91.7	179.1	30.4	-33	0	0	0	110.1	W1100 I1102 I1136 S1147 I1148	W1100-P1144 HydrophobicContact CH2-CG 4.5Å; I1102-P1144 HydrophobicContact CD1-CG 4.1Å; I1136-P1144 HydrophobicContact CG2-CB 3.52Å; I1136-P1144 HydrophobicContact CG2-CG 3.73Å; P1144-S1147 WeakPolarHBondContact CB-OG 3.34Å; P1144-I1148 HydrophobicContact CB-CG1 4.41Å; P1144-I1148 WeakPolarHBondContact O-CD1 3.45Å
1145	R	64.9	Low	82.5	Confident	188 Å²	188	60.8 Å²	60.8	71%	0.709	29%	0.289	S	S	*	.	S	Bend	trans	-81.5	-41.4	-176.4	-68.7	-176	179.5	171.8	2.2	114.1	E1143	E1143-R1145 HydrophobicContact CG-CG 4.23Å; E1143-R1145 PolarHBondContact O-N 2.9Å; E1143-R1145 IonicContact OE2-CZ 2.61Å; E1143-R1145 IonicContact OE2-NE 3.18Å; E1143-R1145 PolarHBondContact OE2-NE 3.31Å; E1143-R1145 IonicContact OE2-NH2 2.94Å; E1143-R1145 PolarHBondContact OE2-NH2 3.5Å; E1143-R1145 VanDerWaalsContact OE2-NH2 3.12Å
1146	D	65.8	Low	82	Confident	157 Å²	157	63.3 Å²	63.3	84%	0.84	30%	0.302	S	S	*	.	S	Bend	trans	-120	12.6	-172.2	-61.5	-43.2	0	0	0	113.6
1147	S	78	Confident	81.7	Confident	23 Å²	23	66.2 Å²	66.2	16%	0.161	32%	0.321	C	S	.	.			trans	-116.5	21.3	-174.1	60.3	0	0	0	0	113.9	I1136 E1137 P1144	I1136-S1147 CarbonylContact C-O 3.56Å; I1136-S1147 VanDerWaalsContact CA-O 3.31Å; I1136-S1147 WeakPolarHBondContact CA-O 3.23Å; E1137-S1147 PolarHBondContact N-O 3.34Å; E1137-S1147 WeakPolarHBondContact O-CB 3.48Å; E1137-S1147 PolarHBondContact O-OG 2.81Å; P1144-S1147 WeakPolarHBondContact CB-OG 3.34Å
1148	I	86.4	Confident	82	Confident	43 Å²	43	64.1 Å²	64.1	22%	0.221	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.9	-179.2	-54.8	167.8	0	0	0	109.9	I1102 V1134 V1135 I1136 P1144 Y1150	I1102-I1148 HydrophobicContact CD1-CD1 3.59Å; I1102-I1148 HydrophobicContact CD1-CG1 4.45Å; V1134-I1148 HydrophobicContact CG1-CG2 3.53Å; V1135-I1148 CarbonylContact O-C 3.54Å; I1136-I1148 HydrophobicContact CD1-CG1 4.41Å; I1136-I1148 HydrophobicContact CG1-CG1 4.13Å; I1136-I1148 HydrophobicContact CG1-CG2 4.24Å; I1136-I1148 HydrophobicContact CG2-CG1 4.06Å; P1144-I1148 HydrophobicContact CB-CG1 4.41Å; P1144-I1148 WeakPolarHBondContact O-CD1 3.45Å; I1148-Y1150 HydrophobicContact CG2-CD2 4.26Å; I1148-Y1150 HydrophobicContact CG2-CE2 3.57Å
1149	Y	85.2	Confident	82.4	Confident	116 Å²	116	61.2 Å²	61.2	46%	0.455	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.3	178.9	-50.8	-87.3	0	0	0	110.5	V1134 V1135 E1137	V1134-Y1149 CarbonylContact C-O 3.59Å; V1134-Y1149 WeakPolarHBondContact CA-O 3.34Å; V1135-Y1149 PolarHBondContact N-O 3.16Å; V1135-Y1149 PolarHBondContact O-N 2.86Å; E1137-Y1149 HydrophobicContact CG-CD2 4.22Å; E1137-Y1149 HydrophobicContact CG-CE2 3.74Å
1150	Y	87.5	Confident	82.9	Confident	52 Å²	52	60.9 Å²	60.9	20%	0.204	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.7	178.6	-67.8	-95.4	0	0	0	110.6	R761 I1104 H1105 L1128 V1134 I1148	R761-Y1150 PolarHBondContact NH1-O 3.03Å; I1104-Y1150 HydrophobicContact CG2-CE1 3.98Å; H1105-Y1150 HydrophobicContact CB-CD1 4.35Å; H1105-Y1150 HydrophobicContact CB-CE1 3.95Å; H1105-Y1150 AromaticContact CD2-CE1 3.48Å; H1105-Y1150 VanDerWaalsContact CD2-CE1 3.48Å; H1105-Y1150 WeakPolarHBondContact CD2-CE1 3.43Å; H1105-Y1150 AromaticContact CD2-CZ 3.51Å; H1105-Y1150 AromaticContact CE1-CD1 3.53Å; H1105-Y1150 AromaticContact CE1-CD2 3.78Å; H1105-Y1150 AromaticContact CE1-CE1 3.78Å; H1105-Y1150 AromaticContact CE1-CG 3.53Å; H1105-Y1150 AromaticContact CG-CD1 3.68Å; H1105-Y1150 AromaticContact CG-CE1 3.39Å; H1105-Y1150 AromaticContact CG-CZ 3.94Å; H1105-Y1150 AromaticContact ND1-CD1 3.35Å; H1105-Y1150 VanDerWaalsContact ND1-CD1 3.35Å; H1105-Y1150 WeakPolarHBondContact ND1-CD1 3.46Å; H1105-Y1150 AromaticContact ND1-CE1 3.59Å; H1105-Y1150 AromaticContact ND1-CG 3.81Å; H1105-Y1150 AromaticContact NE2-CD1 3.96Å; H1105-Y1150 AromaticContact NE2-CD2 3.87Å; H1105-Y1150 AromaticContact NE2-CE1 3.75Å; H1105-Y1150 AromaticContact NE2-CE2 3.65Å; H1105-Y1150 AromaticContact NE2-CZ 3.59Å; L1128-Y1150 HydrophobicContact CD1-CE1 4.37Å; V1134-Y1150 HydrophobicContact CB-CE1 4.5Å; V1134-Y1150 HydrophobicContact CG1-CE1 4.23Å; V1134-Y1150 HydrophobicContact CG2-CD1 3.72Å; V1134-Y1150 HydrophobicContact CG2-CE1 3.55Å; I1148-Y1150 HydrophobicContact CG2-CD2 4.26Å; I1148-Y1150 HydrophobicContact CG2-CE2 3.57Å
1151	I	85.2	Confident	83.5	Confident	14 Å²	14	60.3 Å²	60.3	7%	0.072	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	95.1	-179.3	-60.4	174.6	0	0	0	110.3	E1132 L1133 V1135 I1153 M1184	E1132-I1151 CarbonylContact C-O 3.53Å; E1132-I1151 WeakPolarHBondContact CA-O 3.36Å; L1133-I1151 HydrophobicContact CB-CB 4.12Å; L1133-I1151 HydrophobicContact CB-CG2 4.46Å; L1133-I1151 HydrophobicContact CD2-CD1 4.39Å; L1133-I1151 PolarHBondContact N-O 3.37Å; L1133-I1151 WeakPolarHBondContact O-CA 3.26Å; L1133-I1151 WeakPolarHBondContact O-CB 3.38Å; L1133-I1151 PolarHBondContact O-N 3.3Å; V1135-I1151 HydrophobicContact CG2-CD1 3.53Å; V1135-I1151 HydrophobicContact CG2-CG1 4.29Å; I1151-I1153 HydrophobicContact CG2-CG1 3.93Å; I1151-I1153 PolarHBondContact O-N 2.82Å; I1151-I1153 VanDerWaalsContact O-N 3.11Å; I1151-M1184 HydrophobicContact CD1-CB 4.39Å; I1151-M1184 HydrophobicContact CD1-CE 3.39Å; I1151-M1184 HydrophobicContact CD1-CG 4.35Å
1152	T	87.1	Confident	84	Confident	17 Å²	17	57.4 Å²	57.4	10%	0.104	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	113.4	170.7	-38.2	0	0	0	0	109.6	L765 E1132	L765-T1152 HydrophobicContact CD1-CG2 4.07Å; E1132-T1152 HydrophobicContact CG-CG2 4.15Å; E1132-T1152 PolarHBondContact OE1-OG1 3.23Å
1153	I	83.4	Confident	84.6	Confident	21 Å²	21	51.6 Å²	51.6	11%	0.108	25%	0.251	C	S	.	.			trans	-97	-38.4	178.3	-64.8	-178.1	0	0	0	109.9	G1131 L1133 I1151 I1158 C1170 F1177 F1179	G1131-I1153 PolarHBondContact O-N 3.36Å; L1133-I1153 HydrophobicContact CB-CD1 3.6Å; L1133-I1153 HydrophobicContact CB-CG1 4.14Å; L1133-I1153 HydrophobicContact CD2-CD1 4.04Å; L1133-I1153 HydrophobicContact CG-CD1 4.35Å; I1151-I1153 HydrophobicContact CG2-CG1 3.93Å; I1151-I1153 PolarHBondContact O-N 2.82Å; I1151-I1153 VanDerWaalsContact O-N 3.11Å; I1153-I1158 HydrophobicContact CB-CD1 4.43Å; I1153-I1158 HydrophobicContact CD1-CD1 3.82Å; I1153-I1158 HydrophobicContact CG1-CD1 4.38Å; I1153-C1170 HydrophobicContact CD1-CB 3.54Å; I1153-F1177 HydrophobicContact CG2-CB 3.67Å; I1153-F1177 HydrophobicContact CG2-CD1 3.79Å; I1153-F1177 HydrophobicContact CG2-CD2 3.16Å; I1153-F1177 HydrophobicContact CG2-CE1 4.19Å; I1153-F1177 HydrophobicContact CG2-CE2 3.64Å; I1153-F1177 HydrophobicContact CG2-CG 3.25Å; I1153-F1177 HydrophobicContact CG2-CZ 4.12Å; I1153-F1179 HydrophobicContact CD1-CE2 3.66Å; I1153-F1179 HydrophobicContact CD1-CZ 4.08Å; I1153-F1179 HydrophobicContact CG1-CE2 4.17Å; I1153-F1179 HydrophobicContact CG1-CZ 4.06Å
1154	S	78.5	Confident	85	Confident	20 Å²	20	48 Å²	48	14%	0.14	23%	0.234	C	C	.	.			trans	-161.2	-176.9	-177.9	68.6	0	0	0	0	110.6	G1131 I1156 S1172	G1131-S1154 CarbonylContact C-O 3.48Å; G1131-S1154 VanDerWaalsContact CA-O 3.28Å; G1131-S1154 WeakPolarHBondContact CA-O 3.45Å; G1131-S1154 PolarHBondContact O-N 2.95Å; G1131-S1154 VanDerWaalsContact O-N 3.16Å; S1154-I1156 PolarHBondContact OG-N 3.42Å; S1154-I1156 PolarHBondContact OG-O 3.13Å; S1154-S1172 VanDerWaalsContact OG-CB 3.29Å; S1154-S1172 WeakPolarHBondContact OG-CB 3.39Å; S1154-S1172 PolarHBondContact OG-OG 3.42Å
1155	F	77.8	Confident	85.3	Confident	125 Å²	125	54.2 Å²	54.2	55%	0.548	26%	0.26	S	S	.	.	S	Bend	trans	-101.4	3.6	169.9	-58.7	-78.3	0	0	0	113.3
1156	I	81.5	Confident	86.4	Confident	56 Å²	56	48.1 Å²	48.1	29%	0.287	25%	0.247	S	C	.	.	S	Bend	trans	-101.8	142.5	178.1	-60.4	172.1	0	0	0	107	I212 G1131 S1154 I1158 S1172	I212-I1156 HydrophobicContact CD1-CG1 4.46Å; G1131-I1156 WeakPolarHBondContact CA-O 3.33Å; S1154-I1156 PolarHBondContact OG-N 3.42Å; S1154-I1156 PolarHBondContact OG-O 3.13Å; I1156-I1158 PolarHBondContact O-N 3.47Å; I1156-S1172 WeakPolarHBondContact CB-OG 3.27Å; I1156-S1172 PolarHBondContact O-OG 3.43Å
1157	P	86.6	Confident	87.7	Confident	62 Å²	62	41.9 Å²	41.9	40%	0.403	21%	0.212	S	C	.	.			trans	-48.6	131.1	177.2	-27.2	28.9	0	0	0	112.8	T1129 S1159	T1129-P1157 VanDerWaalsContact O-CA 3.32Å; T1129-P1157 WeakPolarHBondContact O-CA 3.42Å; T1129-P1157 WeakPolarHBondContact O-CB 3.29Å; T1129-P1157 WeakPolarHBondContact O-CG 3.4Å; P1157-S1159 PolarHBondContact O-N 3.39Å; P1157-S1159 VanDerWaalsContact O-N 3.13Å
1158	I	93.8	Very high	88.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	112.8	168	-61.2	-176.1	0	0	0	106.6	S1109 L1128 E1132 L1133 I1153 I1156 V1161 A1171	S1109-I1158 WeakPolarHBondContact CB-O 3.38Å; S1109-I1158 PolarHBondContact OG-O 3.16Å; L1128-I1158 PolarHBondContact O-N 2.93Å; E1132-I1158 VanDerWaalsContact C-CD1 3.43Å; E1132-I1158 VanDerWaalsContact O-CD1 3.25Å; E1132-I1158 WeakPolarHBondContact O-CD1 3.38Å; L1133-I1158 HydrophobicContact CB-CD1 3.83Å; I1153-I1158 HydrophobicContact CB-CD1 4.43Å; I1153-I1158 HydrophobicContact CD1-CD1 3.82Å; I1153-I1158 HydrophobicContact CG1-CD1 4.38Å; I1156-I1158 PolarHBondContact O-N 3.47Å; I1158-V1161 HydrophobicContact CG2-CG2 3.61Å; I1158-A1171 CarbonylContact C-O 3.48Å; I1158-A1171 WeakPolarHBondContact CA-O 3.26Å; I1158-A1171 WeakPolarHBondContact CG2-O 3.39Å
1159	S	93	Very high	89.1	Confident	28 Å²	28	38.8 Å²	38.8	20%	0.196	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-28.2	-174.1	59.4	0	0	0	0	113.1	P1157 A1171 I1200	P1157-S1159 PolarHBondContact O-N 3.39Å; P1157-S1159 VanDerWaalsContact O-N 3.13Å; S1159-A1171 PolarHBondContact N-O 2.94Å; S1159-A1171 WeakPolarHBondContact OG-CB 3.43Å; S1159-I1200 WeakPolarHBondContact CB-O 3.21Å; S1159-I1200 PolarHBondContact OG-O 3.36Å
1160	S	95.1	Very high	89.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	141.5	-179.8	-168	0	0	0	0	111.4	D1110 A1171 K1202 I1203	D1110-S1160 VanDerWaalsContact OD2-CA 3.24Å; D1110-S1160 WeakPolarHBondContact OD2-CA 3.41Å; D1110-S1160 PolarHBondContact OD2-OG 2.84Å; S1160-A1171 PolarHBondContact O-N 3.38Å; S1160-K1202 WeakPolarHBondContact OG-CD 3.43Å; S1160-I1203 PolarHBondContact OG-N 3.25Å
1161	V	96.2	Very high	90.1	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.042	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.6	174.2	-172.1	0	0	0	0	108.9	D1110 T1112 L1133 I1158 L1168 W1169	D1110-V1161 HydrophobicContact CB-CG2 4.44Å; D1110-V1161 PolarHBondContact OD2-N 3.12Å; T1112-V1161 HydrophobicContact CG2-CB 4.27Å; T1112-V1161 HydrophobicContact CG2-CG1 3.62Å; L1133-V1161 HydrophobicContact CD1-CG1 4.27Å; L1133-V1161 HydrophobicContact CD1-CG2 4.16Å; I1158-V1161 HydrophobicContact CG2-CG2 3.61Å; V1161-L1168 HydrophobicContact CG1-CD1 3.65Å; V1161-L1168 HydrophobicContact CG1-CG 4.21Å; V1161-W1169 CarbonylContact C-O 3.58Å; V1161-W1169 WeakPolarHBondContact CA-O 3.43Å
1162	L	95.8	Very high	90.4	Very high	23 Å²	23	30.3 Å²	30.3	12%	0.12	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.9	-178	174.7	69.5	0	0	0	110.8	W1169 I1203 L1205 V1210	L1162-W1169 HydrophobicContact CB-CB 4.28Å; L1162-W1169 PolarHBondContact N-O 2.96Å; L1162-W1169 PolarHBondContact O-N 3.23Å; L1162-I1203 HydrophobicContact CB-CB 4.35Å; L1162-I1203 HydrophobicContact CB-CG2 4.24Å; L1162-I1203 HydrophobicContact CD2-CB 4.31Å; L1162-I1203 HydrophobicContact CD2-CG2 3.48Å; L1162-I1203 VanDerWaalsContact CD2-CG2 3.48Å; L1162-L1205 HydrophobicContact CD1-CB 4.06Å; L1162-L1205 HydrophobicContact CD2-CB 4.1Å; L1162-V1210 HydrophobicContact CD2-CG1 4.01Å; L1162-V1210 HydrophobicContact CD2-CG2 4.39Å
1163	L	94.1	Very high	90.6	Very high	45 Å²	45	29.6 Å²	29.6	24%	0.236	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	114.1	166.5	-175.9	70.6	0	0	0	109.6	F1113 A1114 A1181	F1113-L1163 WeakPolarHBondContact O-CD2 3.19Å; A1114-L1163 HydrophobicContact CB-CD1 4.41Å; A1114-L1163 HydrophobicContact CB-CD2 3.63Å; L1163-A1181 HydrophobicContact CD1-CB 3.43Å; L1163-A1181 VanDerWaalsContact CD1-CB 3.43Å
1164	A	89.9	Confident	90.9	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.008	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	108.2	176.1	0	0	0	0	0	110.1	S1166 Q1167 L1205	A1164-S1166 PolarHBondContact O-N 2.73Å; A1164-S1166 VanDerWaalsContact O-N 3.15Å; A1164-Q1167 PolarHBondContact N-O 3Å; A1164-Q1167 WeakPolarHBondContact O-CB 3.37Å; A1164-Q1167 PolarHBondContact O-N 3.18Å; A1164-L1205 HydrophobicContact CB-CD1 4.18Å; A1164-L1205 HydrophobicContact CB-CD2 4.28Å
1165	K	85.9	Confident	91.6	Very high	140 Å²	140	29.3 Å²	29.3	61%	0.609	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	-114.2	-172.4	-53	176.9	-175.7	176	0	110.4	D1226	K1165-D1226 IonicContact NZ-OD1 2.93Å; K1165-D1226 PolarHBondContact NZ-OD1 2.93Å; K1165-D1226 IonicContact NZ-OD2 2.74Å; K1165-D1226 PolarHBondContact NZ-OD2 3.31Å
1166	S	88.3	Confident	92.4	Very high	61 Å²	61	23.4 Å²	23.4	43%	0.427	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	7	175.2	54.7	0	0	0	0	113.5	A1164 A1181	A1164-S1166 PolarHBondContact O-N 2.73Å; A1164-S1166 VanDerWaalsContact O-N 3.15Å; S1166-A1181 PolarHBondContact O-N 3.07Å
1167	Q	93.4	Very high	93.1	Very high	26 Å²	26	22 Å²	22	12%	0.121	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	133.2	-178.5	-60.3	176.9	7.4	0	0	110.9	A1164 I1178 F1179 P1225	A1164-Q1167 PolarHBondContact N-O 3Å; A1164-Q1167 WeakPolarHBondContact O-CB 3.37Å; A1164-Q1167 PolarHBondContact O-N 3.18Å; Q1167-I1178 HydrophobicContact CB-CG2 3.95Å; Q1167-I1178 HydrophobicContact CG-CG2 4.28Å; Q1167-F1179 CarbonylContact C-O 3.48Å; Q1167-F1179 WeakPolarHBondContact CA-O 3.36Å; Q1167-P1225 PolarHBondContact NE2-O 3.04Å; Q1167-P1225 PolarHBondContact OE1-O 3.16Å
1168	L	96.5	Very high	93.5	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	116.4	170.6	-174.3	74.5	0	0	0	109.1	T1112 Y1125 L1133 V1161 I1178 F1179 A1181 M1184	T1112-L1168 HydrophobicContact CG2-CD1 3.97Å; Y1125-L1168 HydrophobicContact CD1-CD1 4.31Å; Y1125-L1168 HydrophobicContact CD1-CD2 3.51Å; Y1125-L1168 HydrophobicContact CD2-CD1 3.84Å; Y1125-L1168 HydrophobicContact CE1-CD2 3.95Å; Y1125-L1168 HydrophobicContact CE2-CD1 4.31Å; Y1125-L1168 HydrophobicContact CG-CD1 3.83Å; Y1125-L1168 HydrophobicContact CG-CD2 3.83Å; L1133-L1168 HydrophobicContact CD2-CD2 3.64Å; V1161-L1168 HydrophobicContact CG1-CD1 3.65Å; V1161-L1168 HydrophobicContact CG1-CG 4.21Å; L1168-I1178 CarbonylContact O-C 3.5Å; L1168-I1178 VanDerWaalsContact O-CA 3.31Å; L1168-I1178 WeakPolarHBondContact O-CA 3.41Å; L1168-F1179 HydrophobicContact CB-CB 4.42Å; L1168-F1179 PolarHBondContact N-O 3.16Å; L1168-F1179 PolarHBondContact O-N 2.92Å; L1168-A1181 HydrophobicContact CB-CB 4.42Å; L1168-M1184 HydrophobicContact CD2-CE 3.81Å; L1168-M1184 HydrophobicContact CD2-SD 4.18Å
1169	W	97.3	Very high	93.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	118.5	-178.9	-69.1	50.5	0	0	0	109.2	V1161 L1162 I1176 I1178 I1190 V1210 P1225 L1228	V1161-W1169 CarbonylContact C-O 3.58Å; V1161-W1169 WeakPolarHBondContact CA-O 3.43Å; L1162-W1169 HydrophobicContact CB-CB 4.28Å; L1162-W1169 PolarHBondContact N-O 2.96Å; L1162-W1169 PolarHBondContact O-N 3.23Å; W1169-I1176 HydrophobicContact CB-CG2 4.17Å; W1169-I1176 HydrophobicContact CD2-CG2 4.28Å; W1169-I1176 HydrophobicContact CE3-CD1 4.39Å; W1169-I1176 HydrophobicContact CE3-CG2 3.7Å; W1169-I1176 HydrophobicContact CZ3-CG2 4.44Å; W1169-I1178 HydrophobicContact CD2-CD1 3.92Å; W1169-I1178 HydrophobicContact CD2-CG1 3.99Å; W1169-I1178 HydrophobicContact CE3-CD1 4.18Å; W1169-I1178 HydrophobicContact CE3-CG1 4.44Å; W1169-I1178 HydrophobicContact CG-CG1 4.15Å; W1169-I1178 HydrophobicContact CH2-CD1 3.95Å; W1169-I1178 HydrophobicContact CZ2-CD1 3.69Å; W1169-I1178 HydrophobicContact CZ3-CD1 4.18Å; W1169-I1190 HydrophobicContact CH2-CD1 4.35Å; W1169-I1190 HydrophobicContact CZ3-CD1 4.41Å; W1169-V1210 HydrophobicContact CE3-CG1 4.12Å; W1169-V1210 HydrophobicContact CH2-CG2 4.36Å; W1169-V1210 HydrophobicContact CZ2-CG2 4.38Å; W1169-V1210 HydrophobicContact CZ3-CB 4.42Å; W1169-V1210 HydrophobicContact CZ3-CG1 4.06Å; W1169-P1225 HydrophobicContact CZ2-CB 4.22Å; W1169-L1228 HydrophobicContact CH2-CD2 3.48Å; W1169-L1228 VanDerWaalsContact CH2-CD2 3.48Å; W1169-L1228 HydrophobicContact CZ2-CD2 3.29Å
1170	C	96.9	Very high	93.4	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	110	-179.8	-60	0	0	0	0	109.8	I1153 I1176 F1177	I1153-C1170 HydrophobicContact CD1-CB 3.54Å; C1170-I1176 WeakPolarHBondContact O-CA 3.44Å; C1170-F1177 PolarHBondContact N-O 3.35Å; C1170-F1177 PolarHBondContact O-N 3.41Å
1171	A	96.3	Very high	93.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	128.4	173.9	0	0	0	0	0	111	I1158 S1159 S1160 S1175 I1200 I1203	I1158-A1171 CarbonylContact C-O 3.48Å; I1158-A1171 WeakPolarHBondContact CA-O 3.26Å; I1158-A1171 WeakPolarHBondContact CG2-O 3.39Å; S1159-A1171 PolarHBondContact N-O 2.94Å; S1159-A1171 WeakPolarHBondContact OG-CB 3.43Å; S1160-A1171 PolarHBondContact O-N 3.38Å; A1171-S1175 WeakPolarHBondContact CA-O 3.38Å; A1171-I1200 HydrophobicContact CB-CB 3.88Å; A1171-I1200 HydrophobicContact CB-CD1 3.88Å; A1171-I1200 HydrophobicContact CB-CG2 3.67Å; A1171-I1203 HydrophobicContact CB-CD1 3.61Å; A1171-I1203 HydrophobicContact CB-CG1 4.17Å
1172	S	92.2	Very high	92.7	Very high	4 Å²	4	25.2 Å²	25.2	3%	0.028	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	121.2	167.6	177.5	0	0	0	0	110.7	S1154 I1156 S1174 S1175	S1154-S1172 VanDerWaalsContact OG-CB 3.29Å; S1154-S1172 WeakPolarHBondContact OG-CB 3.39Å; S1154-S1172 PolarHBondContact OG-OG 3.42Å; I1156-S1172 WeakPolarHBondContact CB-OG 3.27Å; I1156-S1172 PolarHBondContact O-OG 3.43Å; S1172-S1174 PolarHBondContact O-N 3.44Å; S1172-S1175 PolarHBondContact N-O 2.95Å; S1172-S1175 PolarHBondContact O-N 3.03Å; S1172-S1175 VanDerWaalsContact O-O 3.07Å
1173	G	90.2	Very high	92.2	Very high	2 Å²	2	27.6 Å²	27.6	2%	0.021	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	-127.7	-170.6	0	0	0	0	0	111.2	D1198 V1199 I1200	G1173-D1198 CarbonylContact C-O 3.58Å; G1173-V1199 WeakPolarHBondContact O-CA 3.46Å; G1173-I1200 WeakPolarHBondContact O-CG1 3.5Å; G1173-I1200 PolarHBondContact O-N 3.22Å
1174	S	88.7	Confident	91.9	Very high	16 Å²	16	27 Å²	27	11%	0.112	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	3	175.5	59.1	0	0	0	0	113.7	S1172 I1192 D1198	S1172-S1174 PolarHBondContact O-N 3.44Å; S1174-I1192 VanDerWaalsContact O-CG1 3.28Å; S1174-I1192 WeakPolarHBondContact O-CG1 3.31Å; S1174-I1192 PolarHBondContact O-N 2.9Å; S1174-D1198 WeakPolarHBondContact CA-O 3.45Å; S1174-D1198 WeakPolarHBondContact CB-O 3.3Å; S1174-D1198 PolarHBondContact N-O 3.16Å
1175	S	93.8	Very high	91.4	Very high	19 Å²	19	31.8 Å²	31.8	13%	0.133	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	151.1	-176.4	-71.6	0	0	0	0	112.6	A1171 S1172 Q1189 I1190 I1200	A1171-S1175 WeakPolarHBondContact CA-O 3.38Å; S1172-S1175 PolarHBondContact N-O 2.95Å; S1172-S1175 PolarHBondContact O-N 3.03Å; S1172-S1175 VanDerWaalsContact O-O 3.07Å; S1175-Q1189 PolarHBondContact OG-NE2 3.5Å; S1175-Q1189 VanDerWaalsContact OG-NE2 3.12Å; S1175-I1190 CarbonylContact C-O 3.56Å; S1175-I1190 WeakPolarHBondContact CA-O 3.32Å; S1175-I1200 WeakPolarHBondContact O-CD1 3.36Å
1176	I	95.1	Very high	91.4	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	124.8	173.8	-58.9	176.7	0	0	0	108	W1169 C1170 I1178 Q1189 I1190 I1192 I1200 I1203 I1212	W1169-I1176 HydrophobicContact CB-CG2 4.17Å; W1169-I1176 HydrophobicContact CD2-CG2 4.28Å; W1169-I1176 HydrophobicContact CE3-CD1 4.39Å; W1169-I1176 HydrophobicContact CE3-CG2 3.7Å; W1169-I1176 HydrophobicContact CZ3-CG2 4.44Å; C1170-I1176 WeakPolarHBondContact O-CA 3.44Å; I1176-I1178 HydrophobicContact CG2-CG1 4.09Å; I1176-Q1189 CarbonylContact O-C 3.56Å; I1176-Q1189 VanDerWaalsContact O-CA 3.27Å; I1176-Q1189 WeakPolarHBondContact O-CA 3.32Å; I1176-I1190 PolarHBondContact N-O 3.01Å; I1176-I1190 PolarHBondContact O-N 3.1Å; I1176-I1192 HydrophobicContact CD1-CG2 4.04Å; I1176-I1200 HydrophobicContact CD1-CD1 3.97Å; I1176-I1200 HydrophobicContact CG1-CD1 3.44Å; I1176-I1200 VanDerWaalsContact CG1-CD1 3.44Å; I1176-I1203 HydrophobicContact CD1-CD1 3.63Å; I1176-I1203 HydrophobicContact CD1-CG1 4.42Å; I1176-I1203 HydrophobicContact CG1-CD1 3.92Å; I1176-I1203 HydrophobicContact CG2-CD1 4.18Å; I1176-I1212 HydrophobicContact CD1-CD1 3.52Å
1177	F	96	Very high	91.2	Very high	26 Å²	26	34.8 Å²	34.8	11%	0.114	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	125.7	177	-60.3	-96.8	0	0	0	108.7	I1153 C1170 F1179 Y1186 Q1189	I1153-F1177 HydrophobicContact CG2-CB 3.67Å; I1153-F1177 HydrophobicContact CG2-CD1 3.79Å; I1153-F1177 HydrophobicContact CG2-CD2 3.16Å; I1153-F1177 HydrophobicContact CG2-CE1 4.19Å; I1153-F1177 HydrophobicContact CG2-CE2 3.64Å; I1153-F1177 HydrophobicContact CG2-CG 3.25Å; I1153-F1177 HydrophobicContact CG2-CZ 4.12Å; C1170-F1177 PolarHBondContact N-O 3.35Å; C1170-F1177 PolarHBondContact O-N 3.41Å; F1177-F1179 HydrophobicContact CB-CE2 3.7Å; F1177-F1179 HydrophobicContact CB-CZ 4.11Å; F1177-Y1186 HydrophobicContact CD1-CE2 4.38Å; F1177-Q1189 HydrophobicContact CD1-CB 4.18Å; F1177-Q1189 HydrophobicContact CD1-CG 4.02Å; F1177-Q1189 HydrophobicContact CE1-CB 4.32Å; F1177-Q1189 VanDerWaalsContact CE1-CD 3.42Å; F1177-Q1189 HydrophobicContact CE1-CG 3.83Å; F1177-Q1189 HydrophobicContact CZ-CG 4.21Å
1178	I	94.9	Very high	91	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.8	-174.5	-55.4	174.1	0	0	0	108.9	Q1167 L1168 W1169 I1176 Y1187 K1188 I1190 L1228	Q1167-I1178 HydrophobicContact CB-CG2 3.95Å; Q1167-I1178 HydrophobicContact CG-CG2 4.28Å; L1168-I1178 CarbonylContact O-C 3.5Å; L1168-I1178 VanDerWaalsContact O-CA 3.31Å; L1168-I1178 WeakPolarHBondContact O-CA 3.41Å; W1169-I1178 HydrophobicContact CD2-CD1 3.92Å; W1169-I1178 HydrophobicContact CD2-CG1 3.99Å; W1169-I1178 HydrophobicContact CE3-CD1 4.18Å; W1169-I1178 HydrophobicContact CE3-CG1 4.44Å; W1169-I1178 HydrophobicContact CG-CG1 4.15Å; W1169-I1178 HydrophobicContact CH2-CD1 3.95Å; W1169-I1178 HydrophobicContact CZ2-CD1 3.69Å; W1169-I1178 HydrophobicContact CZ3-CD1 4.18Å; I1176-I1178 HydrophobicContact CG2-CG1 4.09Å; I1178-Y1187 HydrophobicContact CB-CD1 4.44Å; I1178-Y1187 HydrophobicContact CG2-CD1 4.04Å; I1178-Y1187 WeakPolarHBondContact O-CA 3.27Å; I1178-Y1187 WeakPolarHBondContact O-CB 3.43Å; I1178-Y1187 PolarHBondContact O-N 3.49Å; I1178-K1188 WeakPolarHBondContact CB-O 3.3Å; I1178-K1188 PolarHBondContact N-O 2.95Å; I1178-K1188 PolarHBondContact O-N 3.21Å; I1178-I1190 HydrophobicContact CD1-CD1 3.65Å; I1178-I1190 HydrophobicContact CD1-CG1 4.28Å; I1178-L1228 HydrophobicContact CD1-CD1 3.77Å; I1178-L1228 HydrophobicContact CD1-CD2 3.57Å; I1178-L1228 HydrophobicContact CD1-CG 4.32Å
1179	F	94.3	Very high	90.7	Very high	18 Å²	18	42.7 Å²	42.7	8%	0.079	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	155.8	177.1	-56.1	-92.4	0	0	0	110.3	I1153 Q1167 L1168 F1177 A1181 M1184 D1185 Y1186	I1153-F1179 HydrophobicContact CD1-CE2 3.66Å; I1153-F1179 HydrophobicContact CD1-CZ 4.08Å; I1153-F1179 HydrophobicContact CG1-CE2 4.17Å; I1153-F1179 HydrophobicContact CG1-CZ 4.06Å; Q1167-F1179 CarbonylContact C-O 3.48Å; Q1167-F1179 WeakPolarHBondContact CA-O 3.36Å; L1168-F1179 HydrophobicContact CB-CB 4.42Å; L1168-F1179 PolarHBondContact N-O 3.16Å; L1168-F1179 PolarHBondContact O-N 2.92Å; F1177-F1179 HydrophobicContact CB-CE2 3.7Å; F1177-F1179 HydrophobicContact CB-CZ 4.11Å; F1179-A1181 PolarHBondContact O-N 3.44Å; F1179-M1184 HydrophobicContact CB-CE 4.23Å; F1179-M1184 HydrophobicContact CG-CE 4.3Å; F1179-D1185 CarbonylContact C-O 3.58Å; F1179-D1185 VanDerWaalsContact CA-O 3.23Å; F1179-D1185 WeakPolarHBondContact CA-O 3.38Å; F1179-Y1186 HydrophobicContact CD1-CD2 4.29Å; F1179-Y1186 AromaticContact CE1-CD2 3.8Å; F1179-Y1186 HydrophobicContact CE1-CD2 3.8Å; F1179-Y1186 HydrophobicContact CE1-CG 4.41Å; F1179-Y1186 HydrophobicContact CZ-CD2 4.16Å
1180	H	90.6	Very high	90.3	Very high	74 Å²	74	43.4 Å²	43.4	34%	0.343	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	121.4	165.4	-174	-87.1	0	0	0	109.1	K1182 T1183 M1184 D1185	H1180-K1182 VanDerWaalsContact C-N 3.33Å; H1180-K1182 PolarHBondContact ND1-N 3.08Å; H1180-K1182 PolarHBondContact O-N 2.95Å; H1180-T1183 WeakPolarHBondContact CB-OG1 3.25Å; H1180-T1183 PolarHBondContact ND1-N 3.34Å; H1180-T1183 PolarHBondContact ND1-OG1 3.47Å; H1180-M1184 WeakPolarHBondContact O-CA 3.5Å; H1180-M1184 PolarHBondContact O-N 3.09Å; H1180-D1185 HydrophobicContact CB-CB 4.35Å; H1180-D1185 PolarHBondContact N-O 2.97Å
1181	A	91.1	Very high	89.9	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.008	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-40.7	-168.5	0	0	0	0	0	113.2	F1116 Y1125 L1163 S1166 L1168 F1179	F1116-A1181 HydrophobicContact CZ-CB 4.23Å; Y1125-A1181 PolarHBondContact OH-O 3.03Å; L1163-A1181 HydrophobicContact CD1-CB 3.43Å; L1163-A1181 VanDerWaalsContact CD1-CB 3.43Å; S1166-A1181 PolarHBondContact O-N 3.07Å; L1168-A1181 HydrophobicContact CB-CB 4.42Å; F1179-A1181 PolarHBondContact O-N 3.44Å
1182	K	85.6	Confident	89.5	Confident	72 Å²	72	47.1 Å²	47.1	31%	0.313	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-55.5	-177	-169.3	178	177.3	176.6	0	112.5	F1116 D1119 K1123 H1180	F1116-K1182 HydrophobicContact CD1-CB 4.03Å; F1116-K1182 HydrophobicContact CD1-CD 4.16Å; F1116-K1182 HydrophobicContact CD1-CG 3.98Å; F1116-K1182 HydrophobicContact CE1-CB 3.52Å; F1116-K1182 HydrophobicContact CE1-CG 3.96Å; F1116-K1182 HydrophobicContact CG-CG 4.33Å; F1116-K1182 HydrophobicContact CZ-CB 3.86Å; F1116-K1182 HydrophobicContact CZ-CG 4.29Å; D1119-K1182 IonicContact OD1-NZ 3.94Å; D1119-K1182 PolarHBondContact OD1-NZ 3.31Å; D1119-K1182 WeakPolarHBondContact OD2-CE 3.44Å; D1119-K1182 IonicContact OD2-NZ 3.48Å; D1119-K1182 PolarHBondContact OD2-NZ 3.1Å; K1123-K1182 WeakPolarHBondContact CE-O 3.18Å; K1123-K1182 PolarHBondContact NZ-O 3.13Å; H1180-K1182 VanDerWaalsContact C-N 3.33Å; H1180-K1182 PolarHBondContact ND1-N 3.08Å; H1180-K1182 PolarHBondContact O-N 2.95Å
1183	T	84.5	Confident	88.9	Confident	74 Å²	74	47.6 Å²	47.6	45%	0.454	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-15.1	-172.4	53.6	0	0	0	0	113	H1180 D1185	H1180-T1183 WeakPolarHBondContact CB-OG1 3.25Å; H1180-T1183 PolarHBondContact ND1-N 3.34Å; H1180-T1183 PolarHBondContact ND1-OG1 3.47Å; T1183-D1185 WeakPolarHBondContact CB-OD2 3.29Å; T1183-D1185 PolarHBondContact O-N 2.89Å; T1183-D1185 VanDerWaalsContact OG1-CG 3.22Å; T1183-D1185 PolarHBondContact OG1-OD2 3.43Å
1184	M	88.7	Confident	88.1	Confident	33 Å²	33	55.4 Å²	55.4	16%	0.163	27%	0.273	C	S	.	.			trans	59.6	19.7	-171	-64	-54.8	-65.7	0	0	114.3	Y1125 L1133 V1135 I1151 L1168 F1179 H1180 Y1186	Y1125-M1184 HydrophobicContact CD1-CE 4.49Å; Y1125-M1184 HydrophobicContact CD1-SD 4.2Å; Y1125-M1184 HydrophobicContact CE1-CE 4.39Å; Y1125-M1184 HydrophobicContact CE1-SD 3.53Å; Y1125-M1184 VanDerWaalsContact CE1-SD 3.53Å; L1133-M1184 HydrophobicContact CD2-CE 3.62Å; V1135-M1184 HydrophobicContact CG2-CE 3.9Å; V1135-M1184 HydrophobicContact CG2-CG 4.48Å; V1135-M1184 HydrophobicContact CG2-SD 4.38Å; I1151-M1184 HydrophobicContact CD1-CB 4.39Å; I1151-M1184 HydrophobicContact CD1-CE 3.39Å; I1151-M1184 HydrophobicContact CD1-CG 4.35Å; L1168-M1184 HydrophobicContact CD2-CE 3.81Å; L1168-M1184 HydrophobicContact CD2-SD 4.18Å; F1179-M1184 HydrophobicContact CB-CE 4.23Å; F1179-M1184 HydrophobicContact CG-CE 4.3Å; H1180-M1184 WeakPolarHBondContact O-CA 3.5Å; H1180-M1184 PolarHBondContact O-N 3.09Å; M1184-Y1186 PolarHBondContact O-N 3.14Å
1185	D	78.4	Confident	87.2	Confident	100 Å²	100	57.5 Å²	57.5	54%	0.535	28%	0.283	S	S	.	.			trans	-65.3	130.2	174.3	-61.6	-39.1	0	0	0	110	F1179 H1180 T1183 Y1187	F1179-D1185 CarbonylContact C-O 3.58Å; F1179-D1185 VanDerWaalsContact CA-O 3.23Å; F1179-D1185 WeakPolarHBondContact CA-O 3.38Å; H1180-D1185 HydrophobicContact CB-CB 4.35Å; H1180-D1185 PolarHBondContact N-O 2.97Å; T1183-D1185 WeakPolarHBondContact CB-OD2 3.29Å; T1183-D1185 PolarHBondContact O-N 2.89Å; T1183-D1185 VanDerWaalsContact OG1-CG 3.22Å; T1183-D1185 PolarHBondContact OG1-OD2 3.43Å; D1185-Y1187 PolarHBondContact O-N 3.06Å
1186	Y	86.4	Confident	85.9	Confident	129 Å²	129	59.8 Å²	59.8	51%	0.506	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	131.3	175.4	172.8	-100.7	0	0	0	110.6	F1177 F1179 M1184 Q1189	F1177-Y1186 HydrophobicContact CD1-CE2 4.38Å; F1179-Y1186 HydrophobicContact CD1-CD2 4.29Å; F1179-Y1186 AromaticContact CE1-CD2 3.8Å; F1179-Y1186 HydrophobicContact CE1-CD2 3.8Å; F1179-Y1186 HydrophobicContact CE1-CG 4.41Å; F1179-Y1186 HydrophobicContact CZ-CD2 4.16Å; M1184-Y1186 PolarHBondContact O-N 3.14Å; Y1186-Q1189 VanDerWaalsContact OH-CB 3.26Å; Y1186-Q1189 WeakPolarHBondContact OH-CB 3.36Å; Y1186-Q1189 PolarHBondContact OH-N 3.41Å
1187	Y	84.1	Confident	84.8	Confident	136 Å²	136	65.4 Å²	65.4	53%	0.533	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-60	-179.9	-174.7	-114.7	0	0	0	112	I1178 D1185 L1228	I1178-Y1187 HydrophobicContact CB-CD1 4.44Å; I1178-Y1187 HydrophobicContact CG2-CD1 4.04Å; I1178-Y1187 WeakPolarHBondContact O-CA 3.27Å; I1178-Y1187 WeakPolarHBondContact O-CB 3.43Å; I1178-Y1187 PolarHBondContact O-N 3.49Å; D1185-Y1187 PolarHBondContact O-N 3.06Å; Y1187-L1228 HydrophobicContact CD1-CD1 3.85Å; Y1187-L1228 HydrophobicContact CE1-CD1 3.46Å; Y1187-L1228 VanDerWaalsContact CE1-CD1 3.46Å; Y1187-L1228 HydrophobicContact CE1-CG 4.32Å
1188	K	88.6	Confident	84.1	Confident	103 Å²	103	65.6 Å²	65.6	45%	0.448	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	155.7	-175.3	-163.3	170.1	-178.5	-178.5	0	112.5	I1178 L1228	I1178-K1188 WeakPolarHBondContact CB-O 3.3Å; I1178-K1188 PolarHBondContact N-O 2.95Å; I1178-K1188 PolarHBondContact O-N 3.21Å; K1188-L1228 HydrophobicContact CB-CD1 4Å; K1188-L1228 HydrophobicContact CD-CD1 3.67Å; K1188-L1228 HydrophobicContact CG-CD1 4.35Å
1189	Q	90.6	Very high	83.7	Confident	89 Å²	89	68 Å²	68	42%	0.416	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137.9	166.1	-179.2	-176.1	-6.2	0	0	110.1	S1175 I1176 F1177 Y1186	S1175-Q1189 PolarHBondContact OG-NE2 3.5Å; S1175-Q1189 VanDerWaalsContact OG-NE2 3.12Å; I1176-Q1189 CarbonylContact O-C 3.56Å; I1176-Q1189 VanDerWaalsContact O-CA 3.27Å; I1176-Q1189 WeakPolarHBondContact O-CA 3.32Å; F1177-Q1189 HydrophobicContact CD1-CB 4.18Å; F1177-Q1189 HydrophobicContact CD1-CG 4.02Å; F1177-Q1189 HydrophobicContact CE1-CB 4.32Å; F1177-Q1189 VanDerWaalsContact CE1-CD 3.42Å; F1177-Q1189 HydrophobicContact CE1-CG 3.83Å; F1177-Q1189 HydrophobicContact CZ-CG 4.21Å; Y1186-Q1189 VanDerWaalsContact OH-CB 3.26Å; Y1186-Q1189 WeakPolarHBondContact OH-CB 3.36Å; Y1186-Q1189 PolarHBondContact OH-N 3.41Å
1190	I	89.6	Confident	83.7	Confident	15 Å²	15	67.1 Å²	67.1	8%	0.077	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.1	176.6	-52.7	174	0	0	0	108	W1169 S1175 I1176 I1178 W1223 L1228	W1169-I1190 HydrophobicContact CH2-CD1 4.35Å; W1169-I1190 HydrophobicContact CZ3-CD1 4.41Å; S1175-I1190 CarbonylContact C-O 3.56Å; S1175-I1190 WeakPolarHBondContact CA-O 3.32Å; I1176-I1190 PolarHBondContact N-O 3.01Å; I1176-I1190 PolarHBondContact O-N 3.1Å; I1178-I1190 HydrophobicContact CD1-CD1 3.65Å; I1178-I1190 HydrophobicContact CD1-CG1 4.28Å; I1190-W1223 HydrophobicContact CD1-CE3 4.48Å; I1190-W1223 HydrophobicContact CD1-CZ3 4.31Å; I1190-W1223 HydrophobicContact CG2-CE3 4.35Å; I1190-W1223 HydrophobicContact CG2-CH2 3.4Å; I1190-W1223 VanDerWaalsContact CG2-CH2 3.4Å; I1190-W1223 HydrophobicContact CG2-CZ2 4.29Å; I1190-W1223 HydrophobicContact CG2-CZ3 3.45Å; I1190-W1223 VanDerWaalsContact CG2-CZ3 3.45Å; I1190-L1228 HydrophobicContact CD1-CB 3.81Å; I1190-L1228 HydrophobicContact CD1-CD1 4.12Å; I1190-L1228 HydrophobicContact CD1-CD2 4.02Å; I1190-L1228 HydrophobicContact CD1-CG 4.2Å
1191	S	89	Confident	83.7	Confident	64 Å²	64	65.5 Å²	65.5	45%	0.448	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	128.6	166.9	-168.4	0	0	0	0	109.8	S1193	S1191-S1193 PolarHBondContact OG-O 3.43Å
1192	I	86.3	Confident	83.8	Confident	14 Å²	14	68.6 Å²	68.6	7%	0.072	35%	0.347	C	S	.	.	S	Bend	trans	-92.4	-13.3	178.9	63.1	150.2	0	0	0	112.9	S1174 I1176 I1200 I1212 V1214 W1223 R1245	S1174-I1192 VanDerWaalsContact O-CG1 3.28Å; S1174-I1192 WeakPolarHBondContact O-CG1 3.31Å; S1174-I1192 PolarHBondContact O-N 2.9Å; I1176-I1192 HydrophobicContact CD1-CG2 4.04Å; I1192-I1200 HydrophobicContact CD1-CD1 4.09Å; I1192-I1200 HydrophobicContact CD1-CG1 3.43Å; I1192-I1200 VanDerWaalsContact CD1-CG1 3.43Å; I1192-I1200 HydrophobicContact CG1-CD1 4.1Å; I1192-I1200 HydrophobicContact CG1-CG1 3.94Å; I1192-I1212 HydrophobicContact CD1-CG2 4.03Å; I1192-I1212 HydrophobicContact CG2-CD1 4.14Å; I1192-V1214 HydrophobicContact CD1-CG2 3.3Å; I1192-W1223 HydrophobicContact CB-CZ2 4.49Å; I1192-W1223 HydrophobicContact CG2-CZ2 3.85Å; I1192-R1245 PolarHBondContact O-NH1 2.92Å
1193	S	81.2	Confident	84.2	Confident	14 Å²	14	65.2 Å²	65.2	10%	0.098	33%	0.332	C	S	.	.			trans	-144.6	147.5	-179.5	-170.2	0	0	0	0	111.3	S1191 N1195 D1198	S1191-S1193 PolarHBondContact OG-O 3.43Å; S1193-N1195 VanDerWaalsContact C-N 3.31Å; S1193-N1195 PolarHBondContact OG-N 3.35Å; S1193-N1195 VanDerWaalsContact OG-N 3.17Å; S1193-D1198 WeakPolarHBondContact CB-OD2 3.41Å; S1193-D1198 PolarHBondContact OG-OD2 2.96Å
1194	N	72	Confident	84.6	Confident	166 Å²	166	62.6 Å²	62.6	89%	0.888	32%	0.317	S	S	*	.	S	Bend	trans	-83.4	-13.7	171.2	-66	-9.6	0	0	0	111.7	P1196	N1194-P1196 WeakPolarHBondContact O-CD 3.34Å
1195	N	71.2	Confident	84.9	Confident	60 Å²	60	64.7 Å²	64.7	32%	0.321	33%	0.328	S	S	.	.			trans	-81.7	116.5	176.1	-174.8	-2.8	0	0	0	109.7	S1193 L1197 D1198	S1193-N1195 VanDerWaalsContact C-N 3.31Å; S1193-N1195 PolarHBondContact OG-N 3.35Å; S1193-N1195 VanDerWaalsContact OG-N 3.17Å; N1195-L1197 PolarHBondContact O-N 2.97Å; N1195-L1197 WeakPolarHBondContact OD1-CB 3.44Å; N1195-L1197 PolarHBondContact OD1-N 3.18Å; N1195-D1198 PolarHBondContact ND2-OD1 3.5Å; N1195-D1198 PolarHBondContact O-N 3.07Å
1196	P	65.8	Low	85.4	Confident	67 Å²	67	60.4 Å²	60.4	44%	0.435	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-13.3	-179.8	29.5	-36.2	0	0	0	113.5	N1194	N1194-P1196 WeakPolarHBondContact O-CD 3.34Å
1197	L	73	Confident	85.5	Confident	118 Å²	118	60.1 Å²	60.1	62%	0.618	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-13.7	177.2	-59.7	176.9	0	0	0	113.1	N1195 V1199 Y1250	N1195-L1197 PolarHBondContact O-N 2.97Å; N1195-L1197 WeakPolarHBondContact OD1-CB 3.44Å; N1195-L1197 PolarHBondContact OD1-N 3.18Å; L1197-V1199 PolarHBondContact O-N 3.09Å; L1197-Y1250 HydrophobicContact CD1-CE1 4.18Å
1198	D	81.1	Confident	85.6	Confident	31 Å²	31	54.9 Å²	54.9	17%	0.166	30%	0.296	C	S	.	.			trans	-70.5	129.3	178.1	-73.6	-5	0	0	0	109.9	G1173 S1174 S1193 N1195 V1214	G1173-D1198 CarbonylContact C-O 3.58Å; S1174-D1198 WeakPolarHBondContact CA-O 3.45Å; S1174-D1198 WeakPolarHBondContact CB-O 3.3Å; S1174-D1198 PolarHBondContact N-O 3.16Å; S1193-D1198 WeakPolarHBondContact CB-OD2 3.41Å; S1193-D1198 PolarHBondContact OG-OD2 2.96Å; N1195-D1198 PolarHBondContact ND2-OD1 3.5Å; N1195-D1198 PolarHBondContact O-N 3.07Å; D1198-V1214 HydrophobicContact CB-CG1 4.02Å
1199	V	86	Confident	85.7	Confident	49 Å²	49	50.2 Å²	50.2	30%	0.297	28%	0.277	S	S	.	.			trans	-117.1	121.2	176.4	-178	0	0	0	0	108.7	G1173 L1197 L1201 R1215	G1173-V1199 WeakPolarHBondContact O-CA 3.46Å; L1197-V1199 PolarHBondContact O-N 3.09Å; V1199-L1201 PolarHBondContact O-N 3.19Å; V1199-R1215 VanDerWaalsContact O-CB 3.27Å; V1199-R1215 WeakPolarHBondContact O-CB 3.26Å; V1199-R1215 PolarHBondContact O-N 3.17Å
1200	I	93.2	Very high	85.9	Confident	1 Å²	1	46 Å²	46	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	126.9	172.6	-66.5	158.2	0	0	0	108.2	S1159 A1171 G1173 S1175 I1176 I1192 I1203 I1212	S1159-I1200 WeakPolarHBondContact CB-O 3.21Å; S1159-I1200 PolarHBondContact OG-O 3.36Å; A1171-I1200 HydrophobicContact CB-CB 3.88Å; A1171-I1200 HydrophobicContact CB-CD1 3.88Å; A1171-I1200 HydrophobicContact CB-CG2 3.67Å; G1173-I1200 WeakPolarHBondContact O-CG1 3.5Å; G1173-I1200 PolarHBondContact O-N 3.22Å; S1175-I1200 WeakPolarHBondContact O-CD1 3.36Å; I1176-I1200 HydrophobicContact CD1-CD1 3.97Å; I1176-I1200 HydrophobicContact CG1-CD1 3.44Å; I1176-I1200 VanDerWaalsContact CG1-CD1 3.44Å; I1192-I1200 HydrophobicContact CD1-CD1 4.09Å; I1192-I1200 HydrophobicContact CD1-CG1 3.43Å; I1192-I1200 VanDerWaalsContact CD1-CG1 3.43Å; I1192-I1200 HydrophobicContact CG1-CD1 4.1Å; I1192-I1200 HydrophobicContact CG1-CG1 3.94Å; I1200-I1203 HydrophobicContact CG2-CD1 4.43Å; I1200-I1203 HydrophobicContact CG2-CG1 3.84Å; I1200-I1212 HydrophobicContact CG1-CG2 4.48Å; I1200-I1212 HydrophobicContact CG2-CG2 4.01Å
1201	L	91.6	Very high	86.2	Confident	40 Å²	40	45.4 Å²	45.4	21%	0.209	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-52.2	179.8	174.9	64.9	0	0	0	111.4	V1199 A1213 R1215 V1257	V1199-L1201 PolarHBondContact O-N 3.19Å; L1201-A1213 HydrophobicContact CB-CB 4.44Å; L1201-A1213 WeakPolarHBondContact CB-O 3.41Å; L1201-A1213 HydrophobicContact CD2-CB 4.4Å; L1201-A1213 PolarHBondContact N-O 2.87Å; L1201-R1215 HydrophobicContact CB-CB 4.2Å; L1201-R1215 HydrophobicContact CD1-CB 4.45Å; L1201-R1215 HydrophobicContact CD1-CG 4.47Å; L1201-V1257 HydrophobicContact CD2-CG1 4.38Å; L1201-V1257 VanDerWaalsContact CD2-O 3.3Å; L1201-V1257 WeakPolarHBondContact CD2-O 3.2Å
1202	K	92.2	Very high	86.6	Confident	65 Å²	65	42.3 Å²	42.3	28%	0.283	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	145.7	-177.2	-163.9	71	-174.2	173.9	0	110.2	D1110 S1160 A1213 I1260	D1110-K1202 IonicContact OD1-NZ 3.84Å; D1110-K1202 PolarHBondContact OD1-NZ 3.16Å; D1110-K1202 IonicContact OD2-NZ 2.94Å; D1110-K1202 PolarHBondContact OD2-NZ 3.25Å; S1160-K1202 WeakPolarHBondContact OG-CD 3.43Å; K1202-A1213 PolarHBondContact O-N 2.89Å; K1202-A1213 VanDerWaalsContact O-N 3.15Å; K1202-I1260 HydrophobicContact CB-CG1 4.41Å
1203	I	95.2	Very high	86.9	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.7	169.1	-51.6	176.8	0	0	0	107.6	S1160 L1162 A1171 I1176 I1200 V1210 W1211 I1212	S1160-I1203 PolarHBondContact OG-N 3.25Å; L1162-I1203 HydrophobicContact CB-CB 4.35Å; L1162-I1203 HydrophobicContact CB-CG2 4.24Å; L1162-I1203 HydrophobicContact CD2-CB 4.31Å; L1162-I1203 HydrophobicContact CD2-CG2 3.48Å; L1162-I1203 VanDerWaalsContact CD2-CG2 3.48Å; A1171-I1203 HydrophobicContact CB-CD1 3.61Å; A1171-I1203 HydrophobicContact CB-CG1 4.17Å; I1176-I1203 HydrophobicContact CD1-CD1 3.63Å; I1176-I1203 HydrophobicContact CD1-CG1 4.42Å; I1176-I1203 HydrophobicContact CG1-CD1 3.92Å; I1176-I1203 HydrophobicContact CG2-CD1 4.18Å; I1200-I1203 HydrophobicContact CG2-CD1 4.43Å; I1200-I1203 HydrophobicContact CG2-CG1 3.84Å; I1203-V1210 HydrophobicContact CG2-CG1 3.22Å; I1203-W1211 WeakPolarHBondContact CA-O 3.43Å; I1203-I1212 HydrophobicContact CG2-CG1 4.26Å
1204	C	93.4	Very high	87.4	Confident	19 Å²	19	41.1 Å²	41.1	13%	0.128	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	134.9	179.5	-65	0	0	0	0	110.7	W1211 I1260 P1262	C1204-W1211 PolarHBondContact N-O 3.44Å; C1204-W1211 PolarHBondContact O-N 2.95Å; C1204-I1260 HydrophobicContact CB-CD1 4.39Å; C1204-I1260 HydrophobicContact CB-CG1 4.49Å; C1204-I1260 PolarHBondContact SG-O 2.67Å; C1204-I1260 VanDerWaalsContact SG-O 3.41Å; C1204-P1262 HydrophobicContact CB-CG 3.87Å
1205	L	93.3	Very high	87.9	Confident	76 Å²	76	41.6 Å²	41.6	40%	0.398	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	130.8	172.4	-176.5	65.5	0	0	0	110	L1162 A1164 V1210 P1262	L1162-L1205 HydrophobicContact CD1-CB 4.06Å; L1162-L1205 HydrophobicContact CD2-CB 4.1Å; A1164-L1205 HydrophobicContact CB-CD1 4.18Å; A1164-L1205 HydrophobicContact CB-CD2 4.28Å; L1205-V1210 HydrophobicContact CD1-CG2 3.93Å; L1205-P1262 WeakPolarHBondContact O-CG 3.33Å
1206	G	90.6	Very high	88.5	Confident	11 Å²	11	40 Å²	40	11%	0.113	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	176.5	167	0	0	0	0	0	111.6	N1208 G1209	G1206-N1208 PolarHBondContact O-N 3.08Å; G1206-G1209 CarbonylContact C-O 3.51Å; G1206-G1209 PolarHBondContact N-O 3.19Å; G1206-G1209 PolarHBondContact O-N 2.79Å; G1206-G1209 VanDerWaalsContact O-N 3.09Å; G1206-G1209 VanDerWaalsContact O-O 3.06Å
1207	D	87.2	Confident	89.6	Confident	123 Å²	123	37 Å²	37	66%	0.658	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-28.7	-175.6	-65.3	-3.4	0	0	0	113.2	D1264	D1207-D1264 WeakPolarHBondContact OD2-CA 3.43Å
1208	N	87	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	-91.5	-5.5	-178.9	-65	-61.1	0	0	0	113.6	G1206 L1222 T1283 Y1367	G1206-N1208 PolarHBondContact O-N 3.08Å; N1208-L1222 HydrophobicContact CB-CD2 4.25Å; N1208-T1283 PolarHBondContact OD1-OG1 3.48Å; N1208-Y1367 HydrophobicContact CB-CD1 4.3Å; N1208-Y1367 HydrophobicContact CB-CE1 3.77Å; N1208-Y1367 WeakPolarHBondContact OD1-CE1 3.12Å
1209	G	90.9	Very high	90.9	Very high	5 Å²	5	30.1 Å²	30.1	5%	0.052	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.8	-161.9	-176.8	0	0	0	0	0	113.6	G1206 W1223	G1206-G1209 CarbonylContact C-O 3.51Å; G1206-G1209 PolarHBondContact N-O 3.19Å; G1206-G1209 PolarHBondContact O-N 2.79Å; G1206-G1209 VanDerWaalsContact O-N 3.09Å; G1206-G1209 VanDerWaalsContact O-O 3.06Å; G1209-W1223 CarbonylContact C-O 3.6Å; G1209-W1223 WeakPolarHBondContact CA-O 3.36Å
1210	V	94.4	Very high	91.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	117.9	-176.7	177.1	0	0	0	0	110	L1162 W1169 I1203 L1205 I1212 L1222 W1223 P1225	L1162-V1210 HydrophobicContact CD2-CG1 4.01Å; L1162-V1210 HydrophobicContact CD2-CG2 4.39Å; W1169-V1210 HydrophobicContact CE3-CG1 4.12Å; W1169-V1210 HydrophobicContact CH2-CG2 4.36Å; W1169-V1210 HydrophobicContact CZ2-CG2 4.38Å; W1169-V1210 HydrophobicContact CZ3-CB 4.42Å; W1169-V1210 HydrophobicContact CZ3-CG1 4.06Å; I1203-V1210 HydrophobicContact CG2-CG1 3.22Å; L1205-V1210 HydrophobicContact CD1-CG2 3.93Å; V1210-I1212 HydrophobicContact CG1-CG1 4.23Å; V1210-L1222 CarbonylContact O-C 3.59Å; V1210-L1222 WeakPolarHBondContact O-CA 3.22Å; V1210-W1223 HydrophobicContact CB-CB 4.37Å; V1210-W1223 PolarHBondContact N-O 2.97Å; V1210-W1223 PolarHBondContact O-N 3.36Å; V1210-P1225 HydrophobicContact CG2-CB 3.92Å; V1210-P1225 HydrophobicContact CG2-CG 4.47Å
1211	W	96.2	Very high	91.2	Very high	3 Å²	3	27.9 Å²	27.9	1%	0.011	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	137.8	175.7	-70.3	91.8	0	0	0	111.2	I1203 C1204 I1220 E1221 L1222 L1232 I1260 P1262 L1267 I1281 L1369	I1203-W1211 WeakPolarHBondContact CA-O 3.43Å; C1204-W1211 PolarHBondContact N-O 3.44Å; C1204-W1211 PolarHBondContact O-N 2.95Å; W1211-I1220 HydrophobicContact CE3-CD1 4.29Å; W1211-I1220 HydrophobicContact CZ3-CD1 3.84Å; W1211-I1220 HydrophobicContact CZ3-CG1 4.45Å; W1211-E1221 CarbonylContact C-O 3.54Å; W1211-E1221 VanDerWaalsContact CA-O 3.31Å; W1211-E1221 WeakPolarHBondContact CA-O 3.41Å; W1211-L1222 HydrophobicContact CD2-CB 4.27Å; W1211-L1222 HydrophobicContact CD2-CD1 3.94Å; W1211-L1222 HydrophobicContact CE3-CB 4.02Å; W1211-L1222 HydrophobicContact CG-CD1 4.15Å; W1211-L1222 HydrophobicContact CH2-CB 4.04Å; W1211-L1222 HydrophobicContact CH2-CD2 4.2Å; W1211-L1222 HydrophobicContact CZ2-CB 4.29Å; W1211-L1222 HydrophobicContact CZ2-CD1 4.09Å; W1211-L1222 HydrophobicContact CZ2-CD2 3.95Å; W1211-L1222 HydrophobicContact CZ2-CG 4.32Å; W1211-L1222 HydrophobicContact CZ3-CB 3.9Å; W1211-L1232 HydrophobicContact CH2-CD1 4.27Å; W1211-L1232 HydrophobicContact CZ3-CD1 4.04Å; W1211-I1260 HydrophobicContact CB-CD1 3.99Å; W1211-P1262 HydrophobicContact CG-CB 4.36Å; W1211-P1262 HydrophobicContact CG-CG 4.49Å; W1211-L1267 HydrophobicContact CD2-CD1 4.07Å; W1211-L1267 HydrophobicContact CD2-CD2 4.1Å; W1211-L1267 HydrophobicContact CE3-CD1 4.46Å; W1211-L1267 HydrophobicContact CE3-CD2 3.76Å; W1211-L1267 HydrophobicContact CG-CD1 4.23Å; W1211-L1267 HydrophobicContact CH2-CD2 3.85Å; W1211-L1267 HydrophobicContact CZ2-CD2 4.16Å; W1211-L1267 HydrophobicContact CZ3-CD2 3.63Å; W1211-I1281 HydrophobicContact CZ2-CD1 3.79Å; W1211-I1281 HydrophobicContact CZ2-CG1 4.39Å; W1211-L1369 HydrophobicContact CH2-CD1 4.19Å; W1211-L1369 HydrophobicContact CH2-CD2 4.06Å
1212	I	96.1	Very high	91.3	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.5	-177.3	-52.4	176.4	0	0	0	109.5	I1176 I1192 I1200 I1203 V1210 E1221 W1223	I1176-I1212 HydrophobicContact CD1-CD1 3.52Å; I1192-I1212 HydrophobicContact CD1-CG2 4.03Å; I1192-I1212 HydrophobicContact CG2-CD1 4.14Å; I1200-I1212 HydrophobicContact CG1-CG2 4.48Å; I1200-I1212 HydrophobicContact CG2-CG2 4.01Å; I1203-I1212 HydrophobicContact CG2-CG1 4.26Å; V1210-I1212 HydrophobicContact CG1-CG1 4.23Å; I1212-E1221 HydrophobicContact CB-CB 4.38Å; I1212-E1221 PolarHBondContact N-O 3.39Å; I1212-E1221 PolarHBondContact O-N 3.36Å; I1212-W1223 VanDerWaalsContact CD1-CD1 3.41Å; I1212-W1223 HydrophobicContact CD1-CD2 4.39Å; I1212-W1223 HydrophobicContact CD1-CG 3.9Å
1213	A	93.9	Very high	91.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	146.8	170.3	0	0	0	0	0	110.4	L1201 K1202 V1257 I1260	L1201-A1213 HydrophobicContact CB-CB 4.44Å; L1201-A1213 WeakPolarHBondContact CB-O 3.41Å; L1201-A1213 HydrophobicContact CD2-CB 4.4Å; L1201-A1213 PolarHBondContact N-O 2.87Å; K1202-A1213 PolarHBondContact O-N 2.89Å; K1202-A1213 VanDerWaalsContact O-N 3.15Å; A1213-V1257 HydrophobicContact CB-CB 4.41Å; A1213-V1257 HydrophobicContact CB-CG1 3.77Å; A1213-I1260 HydrophobicContact CB-CD1 4.05Å; A1213-I1260 HydrophobicContact CB-CG1 4.44Å; A1213-I1260 HydrophobicContact CB-CG2 4.13Å
1214	V	90.3	Very high	91.1	Very high	3 Å²	3	25.2 Å²	25.2	2%	0.018	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	139.6	175.6	171.2	0	0	0	0	110.1	I1192 D1198 G1216 S1217	I1192-V1214 HydrophobicContact CD1-CG2 3.3Å; D1198-V1214 HydrophobicContact CB-CG1 4.02Å; V1214-G1216 PolarHBondContact O-N 3.19Å; V1214-S1217 PolarHBondContact O-N 3.19Å
1215	R	84.5	Confident	90.9	Very high	175 Å²	175	25 Å²	25	66%	0.66	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	126.8	-177.7	-173.7	178.7	-177	127.5	-1.9	109.7	V1199 L1201 S1217	V1199-R1215 VanDerWaalsContact O-CB 3.27Å; V1199-R1215 WeakPolarHBondContact O-CB 3.26Å; V1199-R1215 PolarHBondContact O-N 3.17Å; L1201-R1215 HydrophobicContact CB-CB 4.2Å; L1201-R1215 HydrophobicContact CD1-CB 4.45Å; L1201-R1215 HydrophobicContact CD1-CG 4.47Å; R1215-S1217 VanDerWaalsContact C-N 3.3Å
1216	G	83.8	Confident	90.6	Very high	28 Å²	28	25.7 Å²	25.7	29%	0.289	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	-17	179.8	0	0	0	0	0	114.4	V1214 R1256	V1214-G1216 PolarHBondContact O-N 3.19Å; G1216-R1256 VanDerWaalsContact O-CB 3.31Å; G1216-R1256 WeakPolarHBondContact O-CB 3.28Å
1217	S	88.4	Confident	90.3	Very high	4 Å²	4	31.6 Å²	31.6	3%	0.028	15%	0.153	C	C	.	.			trans	-93.5	153.6	-176.2	-177	0	0	0	0	112.5	V1214 R1215 V1219 E1248 R1256 V1257	V1214-S1217 PolarHBondContact O-N 3.19Å; R1215-S1217 VanDerWaalsContact C-N 3.3Å; S1217-V1219 VanDerWaalsContact C-N 3.33Å; S1217-V1219 WeakPolarHBondContact OG-CB 3.42Å; S1217-V1219 PolarHBondContact OG-N 2.65Å; S1217-E1248 WeakPolarHBondContact CB-OE1 3.46Å; S1217-E1248 PolarHBondContact OG-OE1 2.97Å; S1217-R1256 WeakPolarHBondContact O-CA 3.3Å; S1217-V1257 PolarHBondContact O-N 3.05Å
1218	S	89.3	Confident	90.3	Very high	4 Å²	4	26.3 Å²	26.3	3%	0.028	13%	0.125	C	C	.	.	S	Bend	trans	-92.6	6.7	167	62	0	0	0	0	113.1	N1235 I1236 V1237 N1253	S1218-N1235 PolarHBondContact OG-OD1 2.91Å; S1218-I1236 WeakPolarHBondContact O-CG1 3.28Å; S1218-I1236 PolarHBondContact O-N 3.39Å; S1218-V1237 VanDerWaalsContact CB-CG2 3.44Å; S1218-N1253 WeakPolarHBondContact CB-ND2 3.06Å; S1218-N1253 PolarHBondContact OG-ND2 3.31Å
1219	V	90.7	Very high	90.2	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.9	-175.9	-176.7	0	0	0	0	110.7	S1217 L1233 F1234 N1235 L1242 P1246	S1217-V1219 VanDerWaalsContact C-N 3.33Å; S1217-V1219 WeakPolarHBondContact OG-CB 3.42Å; S1217-V1219 PolarHBondContact OG-N 2.65Å; V1219-L1233 HydrophobicContact CG1-CD1 3.29Å; V1219-L1233 HydrophobicContact CG1-CG 3.76Å; V1219-F1234 WeakPolarHBondContact CA-O 3.24Å; V1219-N1235 HydrophobicContact CG2-CB 4.22Å; V1219-L1242 HydrophobicContact CG1-CD1 4.09Å; V1219-L1242 HydrophobicContact CG2-CD1 3.95Å; V1219-P1246 HydrophobicContact CG2-CG 4.31Å
1220	I	93.6	Very high	90.1	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	152	175.1	57.5	168.7	0	0	0	111	W1211 F1234 I1236 V1257 I1260 L1267 I1269	W1211-I1220 HydrophobicContact CE3-CD1 4.29Å; W1211-I1220 HydrophobicContact CZ3-CD1 3.84Å; W1211-I1220 HydrophobicContact CZ3-CG1 4.45Å; I1220-F1234 HydrophobicContact CD1-CD1 4.12Å; I1220-F1234 HydrophobicContact CG1-CB 4.05Å; I1220-F1234 HydrophobicContact CG1-CD1 4.22Å; I1220-F1234 WeakPolarHBondContact CG1-O 3.31Å; I1220-F1234 PolarHBondContact N-O 3.06Å; I1220-F1234 PolarHBondContact O-N 2.98Å; I1220-I1236 HydrophobicContact CD1-CG2 4.2Å; I1220-I1236 HydrophobicContact CG1-CG2 4.24Å; I1220-I1236 HydrophobicContact CG2-CG2 4.47Å; I1220-V1257 HydrophobicContact CG2-CG2 3.88Å; I1220-I1260 HydrophobicContact CG2-CG2 4.35Å; I1220-L1267 HydrophobicContact CD1-CD2 3.4Å; I1220-L1267 VanDerWaalsContact CD1-CD2 3.4Å; I1220-I1269 HydrophobicContact CD1-CD1 3.87Å; I1220-I1269 HydrophobicContact CG2-CD1 4.47Å
1221	E	93.5	Very high	89.8	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	148.9	179.3	-38.9	-165.8	-162.7	0	0	111.4	W1211 I1212 W1223 R1230 L1232 L1233 R1245	W1211-E1221 CarbonylContact C-O 3.54Å; W1211-E1221 VanDerWaalsContact CA-O 3.31Å; W1211-E1221 WeakPolarHBondContact CA-O 3.41Å; I1212-E1221 HydrophobicContact CB-CB 4.38Å; I1212-E1221 PolarHBondContact N-O 3.39Å; I1212-E1221 PolarHBondContact O-N 3.36Å; E1221-W1223 PolarHBondContact OE2-NE1 3.46Å; E1221-R1230 WeakPolarHBondContact OE2-CD 3.5Å; E1221-L1232 WeakPolarHBondContact CA-O 3.37Å; E1221-L1233 HydrophobicContact CB-CD1 4.45Å; E1221-L1233 HydrophobicContact CG-CD1 3.55Å; E1221-R1245 IonicContact OE1-CZ 2.79Å; E1221-R1245 IonicContact OE1-NH1 3.99Å; E1221-R1245 PolarHBondContact OE1-NH1 3.04Å; E1221-R1245 IonicContact OE1-NH2 3.25Å; E1221-R1245 PolarHBondContact OE1-NH2 3.05Å
1222	L	93.5	Very high	89.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.1	169.4	176.3	62.1	0	0	0	109	N1208 V1210 W1211 I1231 L1232 Y1367	N1208-L1222 HydrophobicContact CB-CD2 4.25Å; V1210-L1222 CarbonylContact O-C 3.59Å; V1210-L1222 WeakPolarHBondContact O-CA 3.22Å; W1211-L1222 HydrophobicContact CD2-CB 4.27Å; W1211-L1222 HydrophobicContact CD2-CD1 3.94Å; W1211-L1222 HydrophobicContact CE3-CB 4.02Å; W1211-L1222 HydrophobicContact CG-CD1 4.15Å; W1211-L1222 HydrophobicContact CH2-CB 4.04Å; W1211-L1222 HydrophobicContact CH2-CD2 4.2Å; W1211-L1222 HydrophobicContact CZ2-CB 4.29Å; W1211-L1222 HydrophobicContact CZ2-CD1 4.09Å; W1211-L1222 HydrophobicContact CZ2-CD2 3.95Å; W1211-L1222 HydrophobicContact CZ2-CG 4.32Å; W1211-L1222 HydrophobicContact CZ3-CB 3.9Å; L1222-I1231 HydrophobicContact CB-CB 4.45Å; L1222-I1231 HydrophobicContact CD2-CB 4.34Å; L1222-I1231 HydrophobicContact CD2-CD1 4.28Å; L1222-I1231 HydrophobicContact CD2-CG2 4.16Å; L1222-I1231 HydrophobicContact CG-CB 4.18Å; L1222-I1231 HydrophobicContact CG-CD1 4.09Å; L1222-I1231 WeakPolarHBondContact O-CB 3.36Å; L1222-I1231 PolarHBondContact O-N 3.39Å; L1222-L1232 HydrophobicContact CB-CD1 3.92Å; L1222-L1232 HydrophobicContact CB-CG 3.85Å; L1222-L1232 HydrophobicContact CD2-CD2 4.29Å; L1222-L1232 HydrophobicContact CD2-CG 4.39Å; L1222-L1232 PolarHBondContact N-O 3.45Å; L1222-L1232 PolarHBondContact O-N 3.3Å; L1222-Y1367 HydrophobicContact CD2-CD1 4.43Å; L1222-Y1367 HydrophobicContact CD2-CG 4.45Å
1223	W	93.2	Very high	89.2	Confident	21 Å²	21	34 Å²	34	8%	0.08	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.3	-176.3	-74.4	71.1	0	0	0	111.2	I1190 I1192 G1209 V1210 I1212 E1221 P1225 I1229 R1230	I1190-W1223 HydrophobicContact CD1-CE3 4.48Å; I1190-W1223 HydrophobicContact CD1-CZ3 4.31Å; I1190-W1223 HydrophobicContact CG2-CE3 4.35Å; I1190-W1223 HydrophobicContact CG2-CH2 3.4Å; I1190-W1223 VanDerWaalsContact CG2-CH2 3.4Å; I1190-W1223 HydrophobicContact CG2-CZ2 4.29Å; I1190-W1223 HydrophobicContact CG2-CZ3 3.45Å; I1190-W1223 VanDerWaalsContact CG2-CZ3 3.45Å; I1192-W1223 HydrophobicContact CB-CZ2 4.49Å; I1192-W1223 HydrophobicContact CG2-CZ2 3.85Å; G1209-W1223 CarbonylContact C-O 3.6Å; G1209-W1223 WeakPolarHBondContact CA-O 3.36Å; V1210-W1223 HydrophobicContact CB-CB 4.37Å; V1210-W1223 PolarHBondContact N-O 2.97Å; V1210-W1223 PolarHBondContact O-N 3.36Å; I1212-W1223 VanDerWaalsContact CD1-CD1 3.41Å; I1212-W1223 HydrophobicContact CD1-CD2 4.39Å; I1212-W1223 HydrophobicContact CD1-CG 3.9Å; E1221-W1223 PolarHBondContact OE2-NE1 3.46Å; W1223-P1225 WeakPolarHBondContact O-CD 3.41Å; W1223-I1229 WeakPolarHBondContact CA-O 3.22Å; W1223-I1229 VanDerWaalsContact CE3-C 3.43Å; W1223-R1230 HydrophobicContact CD2-CB 4.03Å; W1223-R1230 HydrophobicContact CE3-CB 4.35Å; W1223-R1230 HydrophobicContact CH2-CB 4.13Å; W1223-R1230 HydrophobicContact CZ2-CB 3.78Å; W1223-R1230 HydrophobicContact CZ2-CG 4.23Å; W1223-R1230 HydrophobicContact CZ3-CB 4.39Å
1224	D	89	Confident	89.2	Confident	31 Å²	31	34 Å²	34	17%	0.166	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	116.7	170.7	-174.8	-31.9	0	0	0	108.8	D1226 R1227 L1228 I1229 I1231	D1224-D1226 VanDerWaalsContact C-N 3.29Å; D1224-D1226 PolarHBondContact O-N 2.97Å; D1224-D1226 PolarHBondContact OD1-N 3.28Å; D1224-R1227 HydrophobicContact CB-CB 4.17Å; D1224-R1227 PolarHBondContact OD1-N 3.02Å; D1224-R1227 VanDerWaalsContact OD1-N 3.08Å; D1224-R1227 WeakPolarHBondContact OD2-CD 3.46Å; D1224-R1227 WeakPolarHBondContact OD2-CG 3.41Å; D1224-L1228 VanDerWaalsContact O-CA 3.23Å; D1224-L1228 WeakPolarHBondContact O-CA 3.39Å; D1224-L1228 PolarHBondContact O-N 3.02Å; D1224-I1229 HydrophobicContact CB-CG1 4.01Å; D1224-I1229 PolarHBondContact N-O 3.35Å; D1224-I1231 HydrophobicContact CB-CD1 3.93Å; D1224-I1231 HydrophobicContact CB-CG1 4.11Å
1225	P	89.4	Confident	89.3	Confident	14 Å²	14	34.7 Å²	34.7	9%	0.091	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-23.7	-178.6	27	-33.3	0	0	0	113.9	Q1167 W1169 V1210 W1223 L1228	Q1167-P1225 PolarHBondContact NE2-O 3.04Å; Q1167-P1225 PolarHBondContact OE1-O 3.16Å; W1169-P1225 HydrophobicContact CZ2-CB 4.22Å; V1210-P1225 HydrophobicContact CG2-CB 3.92Å; V1210-P1225 HydrophobicContact CG2-CG 4.47Å; W1223-P1225 WeakPolarHBondContact O-CD 3.41Å; P1225-L1228 WeakPolarHBondContact O-CD2 3.43Å
1226	D	86.5	Confident	89.6	Confident	91 Å²	91	26.8 Å²	26.8	49%	0.487	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-40.9	-177.8	-62.8	-35.3	0	0	0	110.5	K1165 D1224	K1165-D1226 IonicContact NZ-OD1 2.93Å; K1165-D1226 PolarHBondContact NZ-OD1 2.93Å; K1165-D1226 IonicContact NZ-OD2 2.74Å; K1165-D1226 PolarHBondContact NZ-OD2 3.31Å; D1224-D1226 VanDerWaalsContact C-N 3.29Å; D1224-D1226 PolarHBondContact O-N 2.97Å; D1224-D1226 PolarHBondContact OD1-N 3.28Å
1227	R	84.3	Confident	89.7	Confident	134 Å²	134	27.8 Å²	27.8	51%	0.506	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-14.3	-178.7	-63.3	-177.4	179.5	-169.3	0.8	114.1	D1224 I1229 N1362	D1224-R1227 HydrophobicContact CB-CB 4.17Å; D1224-R1227 PolarHBondContact OD1-N 3.02Å; D1224-R1227 VanDerWaalsContact OD1-N 3.08Å; D1224-R1227 WeakPolarHBondContact OD2-CD 3.46Å; D1224-R1227 WeakPolarHBondContact OD2-CG 3.41Å; R1227-I1229 VanDerWaalsContact C-N 3.27Å; R1227-I1229 HydrophobicContact CB-CD1 4.05Å; R1227-I1229 HydrophobicContact CB-CG1 3.84Å; R1227-I1229 PolarHBondContact O-N 3.25Å; R1227-N1362 PolarHBondContact NH1-O 3.31Å
1228	L	87.6	Confident	89.5	Confident	12 Å²	12	32.9 Å²	32.9	6%	0.063	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	42.6	-176.2	-57.1	-172.1	0	0	0	112.9	W1169 I1178 Y1187 K1188 I1190 D1224 P1225	W1169-L1228 HydrophobicContact CH2-CD2 3.48Å; W1169-L1228 VanDerWaalsContact CH2-CD2 3.48Å; W1169-L1228 HydrophobicContact CZ2-CD2 3.29Å; I1178-L1228 HydrophobicContact CD1-CD1 3.77Å; I1178-L1228 HydrophobicContact CD1-CD2 3.57Å; I1178-L1228 HydrophobicContact CD1-CG 4.32Å; Y1187-L1228 HydrophobicContact CD1-CD1 3.85Å; Y1187-L1228 HydrophobicContact CE1-CD1 3.46Å; Y1187-L1228 VanDerWaalsContact CE1-CD1 3.46Å; Y1187-L1228 HydrophobicContact CE1-CG 4.32Å; K1188-L1228 HydrophobicContact CB-CD1 4Å; K1188-L1228 HydrophobicContact CD-CD1 3.67Å; K1188-L1228 HydrophobicContact CG-CD1 4.35Å; I1190-L1228 HydrophobicContact CD1-CB 3.81Å; I1190-L1228 HydrophobicContact CD1-CD1 4.12Å; I1190-L1228 HydrophobicContact CD1-CD2 4.02Å; I1190-L1228 HydrophobicContact CD1-CG 4.2Å; D1224-L1228 VanDerWaalsContact O-CA 3.23Å; D1224-L1228 WeakPolarHBondContact O-CA 3.39Å; D1224-L1228 PolarHBondContact O-N 3.02Å; P1225-L1228 WeakPolarHBondContact O-CD2 3.43Å
1229	I	85.9	Confident	89.4	Confident	61 Å²	61	36.8 Å²	36.8	31%	0.313	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.8	177.6	60.5	178	0	0	0	110.7	W1223 D1224 R1227 I1231 N1362	W1223-I1229 WeakPolarHBondContact CA-O 3.22Å; W1223-I1229 VanDerWaalsContact CE3-C 3.43Å; D1224-I1229 HydrophobicContact CB-CG1 4.01Å; D1224-I1229 PolarHBondContact N-O 3.35Å; R1227-I1229 VanDerWaalsContact C-N 3.27Å; R1227-I1229 HydrophobicContact CB-CD1 4.05Å; R1227-I1229 HydrophobicContact CB-CG1 3.84Å; R1227-I1229 PolarHBondContact O-N 3.25Å; I1229-I1231 PolarHBondContact O-N 2.99Å; I1229-N1362 HydrophobicContact CD1-CB 4.31Å
1230	R	88.8	Confident	89.2	Confident	95 Å²	95	39.6 Å²	39.6	36%	0.358	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	123.3	173.6	-168.7	-177.8	67.5	-166.1	2.1	110	E1221 W1223 S1243	E1221-R1230 WeakPolarHBondContact OE2-CD 3.5Å; W1223-R1230 HydrophobicContact CD2-CB 4.03Å; W1223-R1230 HydrophobicContact CE3-CB 4.35Å; W1223-R1230 HydrophobicContact CH2-CB 4.13Å; W1223-R1230 HydrophobicContact CZ2-CB 3.78Å; W1223-R1230 HydrophobicContact CZ2-CG 4.23Å; W1223-R1230 HydrophobicContact CZ3-CB 4.39Å; R1230-S1243 PolarHBondContact NH2-O 2.87Å
1231	I	87.3	Confident	88.9	Confident	22 Å²	22	42.5 Å²	42.5	11%	0.113	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-50.2	177.6	-64.4	174	0	0	0	110.2	L1222 D1224 I1229 Y1367	L1222-I1231 HydrophobicContact CB-CB 4.45Å; L1222-I1231 HydrophobicContact CD2-CB 4.34Å; L1222-I1231 HydrophobicContact CD2-CD1 4.28Å; L1222-I1231 HydrophobicContact CD2-CG2 4.16Å; L1222-I1231 HydrophobicContact CG-CB 4.18Å; L1222-I1231 HydrophobicContact CG-CD1 4.09Å; L1222-I1231 WeakPolarHBondContact O-CB 3.36Å; L1222-I1231 PolarHBondContact O-N 3.39Å; D1224-I1231 HydrophobicContact CB-CD1 3.93Å; D1224-I1231 HydrophobicContact CB-CG1 4.11Å; I1229-I1231 PolarHBondContact O-N 2.99Å; I1231-Y1367 HydrophobicContact CD1-CE2 4.35Å; I1231-Y1367 HydrophobicContact CG2-CD2 3.37Å; I1231-Y1367 HydrophobicContact CG2-CE2 3.46Å; I1231-Y1367 VanDerWaalsContact CG2-CE2 3.46Å; I1231-Y1367 HydrophobicContact CG2-CG 4.37Å
1232	L	89.3	Confident	88.5	Confident	15 Å²	15	44.1 Å²	44.1	8%	0.079	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	164.1	178.8	63.4	75.5	0	0	0	112.5	W1211 E1221 L1222 F1234 Y1241 L1369	W1211-L1232 HydrophobicContact CH2-CD1 4.27Å; W1211-L1232 HydrophobicContact CZ3-CD1 4.04Å; E1221-L1232 WeakPolarHBondContact CA-O 3.37Å; L1222-L1232 HydrophobicContact CB-CD1 3.92Å; L1222-L1232 HydrophobicContact CB-CG 3.85Å; L1222-L1232 HydrophobicContact CD2-CD2 4.29Å; L1222-L1232 HydrophobicContact CD2-CG 4.39Å; L1222-L1232 PolarHBondContact N-O 3.45Å; L1222-L1232 PolarHBondContact O-N 3.3Å; L1232-F1234 HydrophobicContact CD1-CB 4.19Å; L1232-Y1241 HydrophobicContact CD2-CE1 4.28Å; L1232-L1369 HydrophobicContact CD1-CD1 4.34Å; L1232-L1369 HydrophobicContact CD2-CD1 4.43Å
1233	L	91.5	Very high	87.6	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	123.1	174.6	-175.7	69.2	0	0	0	107.5	V1219 E1221 Y1241 L1242 R1245	V1219-L1233 HydrophobicContact CG1-CD1 3.29Å; V1219-L1233 HydrophobicContact CG1-CG 3.76Å; E1221-L1233 HydrophobicContact CB-CD1 4.45Å; E1221-L1233 HydrophobicContact CG-CD1 3.55Å; L1233-Y1241 WeakPolarHBondContact O-CA 3.48Å; L1233-L1242 HydrophobicContact CB-CB 4.29Å; L1233-L1242 WeakPolarHBondContact CB-O 3.08Å; L1233-L1242 HydrophobicContact CD2-CB 3.66Å; L1233-L1242 HydrophobicContact CD2-CD1 4.37Å; L1233-L1242 HydrophobicContact CG-CB 3.88Å; L1233-L1242 HydrophobicContact CG-CD1 4.33Å; L1233-L1242 PolarHBondContact O-N 2.97Å; L1233-R1245 HydrophobicContact CD2-CB 4.4Å
1234	F	92.8	Very high	86.7	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.7	-170.5	-176.2	-99.4	0	0	0	111.4	V1219 I1220 L1232 I1236 E1239 Y1241 Y1279 L1369	V1219-F1234 WeakPolarHBondContact CA-O 3.24Å; I1220-F1234 HydrophobicContact CD1-CD1 4.12Å; I1220-F1234 HydrophobicContact CG1-CB 4.05Å; I1220-F1234 HydrophobicContact CG1-CD1 4.22Å; I1220-F1234 WeakPolarHBondContact CG1-O 3.31Å; I1220-F1234 PolarHBondContact N-O 3.06Å; I1220-F1234 PolarHBondContact O-N 2.98Å; L1232-F1234 HydrophobicContact CD1-CB 4.19Å; F1234-I1236 HydrophobicContact CD1-CG2 4.21Å; F1234-I1236 HydrophobicContact CE1-CG2 4.35Å; F1234-E1239 HydrophobicContact CZ-CB 4.1Å; F1234-E1239 HydrophobicContact CZ-CG 4.44Å; F1234-Y1241 HydrophobicContact CB-CD1 4.47Å; F1234-Y1241 AromaticContact CD2-CD1 3.79Å; F1234-Y1241 HydrophobicContact CD2-CD1 3.79Å; F1234-Y1241 HydrophobicContact CD2-CD2 4.21Å; F1234-Y1241 AromaticContact CD2-CE1 3.74Å; F1234-Y1241 HydrophobicContact CD2-CE1 3.74Å; F1234-Y1241 HydrophobicContact CD2-CE2 4.15Å; F1234-Y1241 HydrophobicContact CD2-CG 4.01Å; F1234-Y1241 AromaticContact CD2-CZ 3.9Å; F1234-Y1241 HydrophobicContact CE2-CD2 4.36Å; F1234-Y1241 HydrophobicContact CE2-CE1 4.39Å; F1234-Y1241 HydrophobicContact CE2-CE2 4.08Å; F1234-Y1279 HydrophobicContact CE1-CD1 4.36Å; F1234-Y1279 AromaticContact CE1-CE1 3.66Å; F1234-Y1279 HydrophobicContact CE1-CE1 3.66Å; F1234-Y1279 AromaticContact CE1-CZ 3.89Å; F1234-Y1279 AromaticContact CZ-CE1 3.88Å; F1234-Y1279 HydrophobicContact CZ-CE1 3.88Å; F1234-L1369 HydrophobicContact CB-CD1 3.88Å; F1234-L1369 HydrophobicContact CD1-CD1 3.8Å; F1234-L1369 HydrophobicContact CD2-CD1 3.97Å; F1234-L1369 HydrophobicContact CE1-CD1 4.29Å; F1234-L1369 HydrophobicContact CE2-CB 4.36Å; F1234-L1369 HydrophobicContact CE2-CD1 4.44Å; F1234-L1369 HydrophobicContact CG-CD1 3.6Å; F1234-L1369 HydrophobicContact CZ-CB 4.31Å
1235	N	91.5	Very high	86.1	Confident	17 Å²	17	57 Å²	57	9%	0.091	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	117.3	176	-173.1	-21.3	0	0	0	110.1	S1218 V1219 V1237 E1239 T1240 L1242	S1218-N1235 PolarHBondContact OG-OD1 2.91Å; V1219-N1235 HydrophobicContact CG2-CB 4.22Å; N1235-V1237 VanDerWaalsContact C-N 3.29Å; N1235-V1237 PolarHBondContact O-N 3.37Å; N1235-V1237 PolarHBondContact OD1-N 2.97Å; N1235-E1239 WeakPolarHBondContact O-CA 3.42Å; N1235-E1239 PolarHBondContact O-N 3.07Å; N1235-T1240 PolarHBondContact N-O 2.95Å; N1235-T1240 PolarHBondContact O-N 3.5Å; N1235-L1242 HydrophobicContact CB-CD1 3.93Å; N1235-L1242 HydrophobicContact CB-CG 4.4Å
1236	I	90.8	Very high	85.1	Confident	8 Å²	8	59 Å²	59	4%	0.041	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-20.1	-175.8	72.9	-178.5	0	0	0	113.8	S1218 I1220 F1234 V1257 I1269 T1271 L1277 Y1279	S1218-I1236 WeakPolarHBondContact O-CG1 3.28Å; S1218-I1236 PolarHBondContact O-N 3.39Å; I1220-I1236 HydrophobicContact CD1-CG2 4.2Å; I1220-I1236 HydrophobicContact CG1-CG2 4.24Å; I1220-I1236 HydrophobicContact CG2-CG2 4.47Å; F1234-I1236 HydrophobicContact CD1-CG2 4.21Å; F1234-I1236 HydrophobicContact CE1-CG2 4.35Å; I1236-V1257 HydrophobicContact CD1-CG2 3.53Å; I1236-I1269 HydrophobicContact CD1-CG2 4.1Å; I1236-I1269 HydrophobicContact CG2-CD1 3.71Å; I1236-T1271 HydrophobicContact CD1-CG2 4.32Å; I1236-L1277 HydrophobicContact CB-CD1 4.36Å; I1236-L1277 HydrophobicContact CD1-CD1 4.15Å; I1236-L1277 HydrophobicContact CG1-CD1 4.49Å; I1236-Y1279 PolarHBondContact O-OH 3.04Å
1237	V	87	Confident	84	Confident	50 Å²	50	64.1 Å²	64.1	30%	0.303	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-48.6	-176.7	171.4	0	0	0	0	110.2	S1218 N1235 Q1255	S1218-V1237 VanDerWaalsContact CB-CG2 3.44Å; N1235-V1237 VanDerWaalsContact C-N 3.29Å; N1235-V1237 PolarHBondContact O-N 3.37Å; N1235-V1237 PolarHBondContact OD1-N 2.97Å; V1237-Q1255 HydrophobicContact CG2-CB 3.71Å
1238	N	84	Confident	82.6	Confident	110 Å²	110	61.4 Å²	61.4	59%	0.588	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-5.8	-179.7	-63.4	-11.4	0	0	0	112.6	T1240	N1238-T1240 HydrophobicContact CB-CG2 4.05Å; N1238-T1240 WeakPolarHBondContact O-CG2 3.1Å; N1238-T1240 PolarHBondContact O-N 3.49Å
1239	E	87.9	Confident	80.8	Confident	87 Å²	87	68.4 Å²	68.4	41%	0.407	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	38	-174.5	-65.1	170.5	-121.7	0	0	112.7	F1234 N1235 K1371	F1234-E1239 HydrophobicContact CZ-CB 4.1Å; F1234-E1239 HydrophobicContact CZ-CG 4.44Å; N1235-E1239 WeakPolarHBondContact O-CA 3.42Å; N1235-E1239 PolarHBondContact O-N 3.07Å; E1239-K1371 VanDerWaalsContact CD-NZ 3.26Å; E1239-K1371 VanDerWaalsContact OE1-CE 3.28Å; E1239-K1371 WeakPolarHBondContact OE1-CE 3.4Å; E1239-K1371 IonicContact OE1-NZ 3.18Å; E1239-K1371 PolarHBondContact OE1-NZ 2.83Å; E1239-K1371 WeakPolarHBondContact OE2-CE 3.48Å; E1239-K1371 IonicContact OE2-NZ 3.5Å
1240	T	86.6	Confident	79.2	Confident	59 Å²	59	75.8 Å²	75.8	36%	0.362	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	144	-176.8	54.4	0	0	0	0	112	N1235 N1238	N1235-T1240 PolarHBondContact N-O 2.95Å; N1235-T1240 PolarHBondContact O-N 3.5Å; N1238-T1240 HydrophobicContact CB-CG2 4.05Å; N1238-T1240 WeakPolarHBondContact O-CG2 3.1Å; N1238-T1240 PolarHBondContact O-N 3.49Å
1241	Y	87	Confident	77.5	Confident	62 Å²	62	76.4 Å²	76.4	24%	0.243	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	140.9	167.2	-62.5	-90.1	0	0	0	111.2	L1232 L1233 F1234 L1357 E1368 L1369	L1232-Y1241 HydrophobicContact CD2-CE1 4.28Å; L1233-Y1241 WeakPolarHBondContact O-CA 3.48Å; F1234-Y1241 HydrophobicContact CB-CD1 4.47Å; F1234-Y1241 AromaticContact CD2-CD1 3.79Å; F1234-Y1241 HydrophobicContact CD2-CD1 3.79Å; F1234-Y1241 HydrophobicContact CD2-CD2 4.21Å; F1234-Y1241 AromaticContact CD2-CE1 3.74Å; F1234-Y1241 HydrophobicContact CD2-CE1 3.74Å; F1234-Y1241 HydrophobicContact CD2-CE2 4.15Å; F1234-Y1241 HydrophobicContact CD2-CG 4.01Å; F1234-Y1241 AromaticContact CD2-CZ 3.9Å; F1234-Y1241 HydrophobicContact CE2-CD2 4.36Å; F1234-Y1241 HydrophobicContact CE2-CE1 4.39Å; F1234-Y1241 HydrophobicContact CE2-CE2 4.08Å; Y1241-L1357 HydrophobicContact CD1-CD1 4.45Å; Y1241-L1357 HydrophobicContact CG-CD1 3.94Å; Y1241-E1368 VanDerWaalsContact OH-CA 3.25Å; Y1241-E1368 WeakPolarHBondContact OH-CA 3.5Å; Y1241-L1369 HydrophobicContact CE1-CD1 4.43Å; Y1241-L1369 PolarHBondContact OH-N 3.4Å
1242	L	85.2	Confident	76.2	Confident	35 Å²	35	82.4 Å²	82.4	18%	0.183	40%	0.396	C	S	.	.			trans	-118.2	144.1	-173.2	-58.5	172.6	0	0	0	110.2	V1219 L1233 N1235 P1246	V1219-L1242 HydrophobicContact CG1-CD1 4.09Å; V1219-L1242 HydrophobicContact CG2-CD1 3.95Å; L1233-L1242 HydrophobicContact CB-CB 4.29Å; L1233-L1242 WeakPolarHBondContact CB-O 3.08Å; L1233-L1242 HydrophobicContact CD2-CB 3.66Å; L1233-L1242 HydrophobicContact CD2-CD1 4.37Å; L1233-L1242 HydrophobicContact CG-CB 3.88Å; L1233-L1242 HydrophobicContact CG-CD1 4.33Å; L1233-L1242 PolarHBondContact O-N 2.97Å; N1235-L1242 HydrophobicContact CB-CD1 3.93Å; N1235-L1242 HydrophobicContact CB-CG 4.4Å; L1242-P1246 HydrophobicContact CD1-CG 4.39Å
1243	S	73.1	Confident	75.4	Confident	75 Å²	75	83.4 Å²	83.4	52%	0.524	40%	0.401	S	S	.	.	S	Bend	trans	-84.8	-32.3	171.4	56.3	0	0	0	0	111.8	R1230	R1230-S1243 PolarHBondContact NH2-O 2.87Å
1244	R	75.5	Confident	74.6	Confident	207 Å²	207	86.3 Å²	86.3	78%	0.781	42%	0.42	S	S	*	.	S	Bend	trans	-138.2	153.1	178.3	-66.6	-175.9	179.5	-179.3	-0.7	109.8
1245	R	76	Confident	74	Confident	40 Å²	40	89.1 Å²	89.1	15%	0.151	43%	0.434	C	S	.	.			trans	-65.9	130.4	175.3	-170.1	176.5	-116.3	119.5	12.4	108.2	I1192 E1221 L1233	I1192-R1245 PolarHBondContact O-NH1 2.92Å; E1221-R1245 IonicContact OE1-CZ 2.79Å; E1221-R1245 IonicContact OE1-NH1 3.99Å; E1221-R1245 PolarHBondContact OE1-NH1 3.04Å; E1221-R1245 IonicContact OE1-NH2 3.25Å; E1221-R1245 PolarHBondContact OE1-NH2 3.05Å; L1233-R1245 HydrophobicContact CD2-CB 4.4Å
1246	P	68.9	Low	74	Confident	56 Å²	56	90.4 Å²	90.4	36%	0.364	44%	0.437	S	S	.	.			trans	-65.3	142.7	174.6	26.4	-33.2	0	0	0	109.5	V1219 L1242 E1248	V1219-P1246 HydrophobicContact CG2-CG 4.31Å; L1242-P1246 HydrophobicContact CD1-CG 4.39Å; P1246-E1248 VanDerWaalsContact C-N 3.29Å; P1246-E1248 HydrophobicContact CG-CG 4.25Å; P1246-E1248 PolarHBondContact O-N 3.04Å
1247	E	63.1	Low	74.1	Confident	199 Å²	199	90.1 Å²	90.1	93%	0.93	44%	0.436	S	S	*	.			trans	-72.4	91.9	165.4	-66.7	-171.8	-180	0	0	106.8	E1249	E1247-E1249 PolarHBondContact O-N 3.25Å
1248	E	55.2	Low	74.3	Confident	76 Å²	76	89 Å²	89	36%	0.355	43%	0.429	S	S	.	.			trans	-66	124.3	178.7	-67.8	-179.2	-167.4	0	0	108.9	S1217 P1246	S1217-E1248 WeakPolarHBondContact CB-OE1 3.46Å; S1217-E1248 PolarHBondContact OG-OE1 2.97Å; P1246-E1248 VanDerWaalsContact C-N 3.29Å; P1246-E1248 HydrophobicContact CG-CG 4.25Å; P1246-E1248 PolarHBondContact O-N 3.04Å
1249	E	50.2	Low	74.7	Confident	160 Å²	160	84.6 Å²	84.6	75%	0.748	41%	0.406	S	S	*	.			trans	-57.6	143.4	170.1	-68.6	-178.1	169.3	0	0	109.2	E1247 T1251	E1247-E1249 PolarHBondContact O-N 3.25Å; E1249-T1251 PolarHBondContact O-N 2.91Å
1250	Y	51.1	Low	75.1	Confident	215 Å²	215	80.7 Å²	80.7	84%	0.843	39%	0.388	S	S	*	.	S	Bend	trans	-60	19.8	-173.3	-60.5	-85.3	0	0	0	116.5	L1197	L1197-Y1250 HydrophobicContact CD1-CE1 4.18Å
1251	T	52.4	Low	75.4	Confident	108 Å²	108	79 Å²	79	66%	0.663	38%	0.377	S	S	*	.	S	Bend	trans	-80.9	140.7	174	64.5	0	0	0	0	111.1	E1249 N1253	E1249-T1251 PolarHBondContact O-N 2.91Å; T1251-N1253 PolarHBondContact O-N 3.47Å; T1251-N1253 VanDerWaalsContact O-N 3.16Å
1252	F	60.7	Low	75.7	Confident	149 Å²	149	76.7 Å²	76.7	65%	0.654	37%	0.369	S	S	*	.			trans	-69	111.6	178.2	177.9	-98.6	0	0	0	110.1	P1254	F1252-P1254 WeakPolarHBondContact O-CD 3.37Å
1253	N	72.9	Confident	75.7	Confident	35 Å²	35	76.6 Å²	76.6	19%	0.187	37%	0.367	C	S	.	.			trans	-73.9	111.5	176.2	-173.2	-14.7	0	0	0	110.4	S1218 T1251 Q1255 R1256	S1218-N1253 WeakPolarHBondContact CB-ND2 3.06Å; S1218-N1253 PolarHBondContact OG-ND2 3.31Å; T1251-N1253 PolarHBondContact O-N 3.47Å; T1251-N1253 VanDerWaalsContact O-N 3.16Å; N1253-Q1255 VanDerWaalsContact C-N 3.26Å; N1253-Q1255 PolarHBondContact O-N 3.3Å; N1253-Q1255 WeakPolarHBondContact OD1-CA 3.33Å; N1253-Q1255 PolarHBondContact OD1-N 2.88Å; N1253-R1256 HydrophobicContact CB-CB 4.35Å; N1253-R1256 WeakPolarHBondContact O-CB 3.38Å; N1253-R1256 WeakPolarHBondContact O-CG 3.33Å; N1253-R1256 PolarHBondContact O-N 3.5Å; N1253-R1256 PolarHBondContact O-NH1 3.39Å; N1253-R1256 PolarHBondContact OD1-N 2.83Å
1254	P	74	Confident	76.1	Confident	62 Å²	62	76.3 Å²	76.3	40%	0.403	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-32.7	178.9	27	-33.1	0	0	0	111.6	F1252 R1256 G1272 M1273	F1252-P1254 WeakPolarHBondContact O-CD 3.37Å; P1254-R1256 VanDerWaalsContact C-N 3.25Å; P1254-R1256 PolarHBondContact O-N 2.84Å; P1254-G1272 CarbonylContact O-C 3.57Å; P1254-G1272 VanDerWaalsContact O-C 3.25Å; P1254-G1272 VanDerWaalsContact O-CA 3.3Å; P1254-G1272 WeakPolarHBondContact O-CA 3.42Å; P1254-M1273 HydrophobicContact CB-CG 4.07Å; P1254-M1273 HydrophobicContact CB-SD 3.62Å; P1254-M1273 WeakPolarHBondContact O-CG 3.27Å; P1254-M1273 PolarHBondContact O-N 2.92Å
1255	Q	81.6	Confident	76.6	Confident	62 Å²	62	69.3 Å²	69.3	29%	0.29	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	14	180	-65.9	178.1	-29.9	0	0	113.4	V1237 N1253 M1273	V1237-Q1255 HydrophobicContact CG2-CB 3.71Å; N1253-Q1255 VanDerWaalsContact C-N 3.26Å; N1253-Q1255 PolarHBondContact O-N 3.3Å; N1253-Q1255 WeakPolarHBondContact OD1-CA 3.33Å; N1253-Q1255 PolarHBondContact OD1-N 2.88Å; Q1255-M1273 HydrophobicContact CG-CG 4.09Å
1256	R	90.9	Very high	77.2	Confident	43 Å²	43	68 Å²	68	16%	0.162	33%	0.334	C	S	.	.			trans	-53.9	150.6	174.9	72	-169.6	-178.6	-67.1	-4.7	112.1	G1216 S1217 N1253 P1254 T1258 T1271 G1272	G1216-R1256 VanDerWaalsContact O-CB 3.31Å; G1216-R1256 WeakPolarHBondContact O-CB 3.28Å; S1217-R1256 WeakPolarHBondContact O-CA 3.3Å; N1253-R1256 HydrophobicContact CB-CB 4.35Å; N1253-R1256 WeakPolarHBondContact O-CB 3.38Å; N1253-R1256 WeakPolarHBondContact O-CG 3.33Å; N1253-R1256 PolarHBondContact O-N 3.5Å; N1253-R1256 PolarHBondContact O-NH1 3.39Å; N1253-R1256 PolarHBondContact OD1-N 2.83Å; P1254-R1256 VanDerWaalsContact C-N 3.25Å; P1254-R1256 PolarHBondContact O-N 2.84Å; R1256-T1258 HydrophobicContact CG-CG2 4.28Å; R1256-T1271 CarbonylContact O-C 3.59Å; R1256-T1271 WeakPolarHBondContact O-CA 3.35Å; R1256-G1272 PolarHBondContact O-N 3.36Å
1257	V	92.7	Very high	78.4	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.012	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	133.6	169.1	177.3	0	0	0	0	109.3	L1201 A1213 S1217 I1220 I1236 I1260 I1269	L1201-V1257 HydrophobicContact CD2-CG1 4.38Å; L1201-V1257 VanDerWaalsContact CD2-O 3.3Å; L1201-V1257 WeakPolarHBondContact CD2-O 3.2Å; A1213-V1257 HydrophobicContact CB-CB 4.41Å; A1213-V1257 HydrophobicContact CB-CG1 3.77Å; S1217-V1257 PolarHBondContact O-N 3.05Å; I1220-V1257 HydrophobicContact CG2-CG2 3.88Å; I1236-V1257 HydrophobicContact CD1-CG2 3.53Å; V1257-I1260 HydrophobicContact CG1-CG2 3.59Å; V1257-I1269 HydrophobicContact CG1-CG2 4.07Å; V1257-I1269 HydrophobicContact CG2-CG2 3.99Å
1258	T	90.9	Very high	79.9	Confident	27 Å²	27	55.9 Å²	55.9	17%	0.166	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-25.6	175.3	50.8	0	0	0	0	113.1	R1256 G1270 T1271 P1381 I1382	R1256-T1258 HydrophobicContact CG-CG2 4.28Å; T1258-G1270 PolarHBondContact N-O 2.94Å; T1258-G1270 VanDerWaalsContact OG1-C 3.24Å; T1258-G1270 PolarHBondContact OG1-O 2.99Å; T1258-T1271 PolarHBondContact OG1-O 3.24Å; T1258-P1381 HydrophobicContact CG2-CB 4.3Å; T1258-I1382 VanDerWaalsContact CB-O 3.26Å; T1258-I1382 WeakPolarHBondContact CB-O 3.39Å; T1258-I1382 PolarHBondContact OG1-O 2.88Å
1259	V	93.4	Very high	81.8	Confident	18 Å²	18	52.3 Å²	52.3	11%	0.109	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	147.3	174.2	57.9	0	0	0	0	109.8	I1269 G1270 I1382 L1385	V1259-I1269 WeakPolarHBondContact O-CA 3.48Å; V1259-G1270 PolarHBondContact N-O 3.46Å; V1259-G1270 PolarHBondContact O-N 3.47Å; V1259-I1382 HydrophobicContact CG1-CG2 3.95Å; V1259-L1385 HydrophobicContact CG1-CB 4.32Å; V1259-L1385 HydrophobicContact CG1-CD1 3.79Å; V1259-L1385 HydrophobicContact CG1-CG 3.78Å; V1259-L1385 HydrophobicContact CG2-CB 4.1Å; V1259-L1385 HydrophobicContact CG2-CG 4.47Å
1260	I	95	Very high	83.9	Confident	5 Å²	5	44.7 Å²	44.7	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.2	175.1	53.4	169.5	0	0	0	109.7	K1202 C1204 W1211 A1213 I1220 V1257 W1268 I1269	K1202-I1260 HydrophobicContact CB-CG1 4.41Å; C1204-I1260 HydrophobicContact CB-CD1 4.39Å; C1204-I1260 HydrophobicContact CB-CG1 4.49Å; C1204-I1260 PolarHBondContact SG-O 2.67Å; C1204-I1260 VanDerWaalsContact SG-O 3.41Å; W1211-I1260 HydrophobicContact CB-CD1 3.99Å; A1213-I1260 HydrophobicContact CB-CD1 4.05Å; A1213-I1260 HydrophobicContact CB-CG1 4.44Å; A1213-I1260 HydrophobicContact CB-CG2 4.13Å; I1220-I1260 HydrophobicContact CG2-CG2 4.35Å; V1257-I1260 HydrophobicContact CG1-CG2 3.59Å; I1260-W1268 CarbonylContact C-O 3.57Å; I1260-W1268 WeakPolarHBondContact CA-O 3.43Å; I1260-I1269 HydrophobicContact CG2-CG1 4.41Å
1261	L	94.5	Very high	85.9	Confident	24 Å²	24	34.5 Å²	34.5	13%	0.126	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	97.5	176.7	-179	70.7	0	0	0	109.9	W1268 L1385 M1387 I1397	L1261-W1268 HydrophobicContact CB-CB 4.16Å; L1261-W1268 PolarHBondContact N-O 3.41Å; L1261-W1268 WeakPolarHBondContact O-CB 3.32Å; L1261-W1268 PolarHBondContact O-N 3.48Å; L1261-L1385 HydrophobicContact CB-CB 3.9Å; L1261-L1385 HydrophobicContact CB-CD1 4.41Å; L1261-L1385 HydrophobicContact CD2-CB 3.97Å; L1261-M1387 HydrophobicContact CD1-CG 4Å; L1261-M1387 HydrophobicContact CD1-SD 4.48Å; L1261-M1387 HydrophobicContact CD2-CB 3.98Å; L1261-M1387 HydrophobicContact CD2-CG 4.02Å; L1261-M1387 HydrophobicContact CG-CG 4.39Å; L1261-I1397 HydrophobicContact CD2-CG2 4.4Å
1262	P	92.5	Very high	87.5	Confident	12 Å²	12	29.8 Å²	29.8	8%	0.078	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	138.2	170.9	31.8	-33.5	0	0	0	110.3	C1204 L1205 W1211 L1267	C1204-P1262 HydrophobicContact CB-CG 3.87Å; L1205-P1262 WeakPolarHBondContact O-CG 3.33Å; W1211-P1262 HydrophobicContact CG-CB 4.36Å; W1211-P1262 HydrophobicContact CG-CG 4.49Å; P1262-L1267 HydrophobicContact CB-CD1 4.02Å
1263	Y	84.8	Confident	88.8	Confident	33 Å²	33	26.4 Å²	26.4	13%	0.129	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	126.3	175.2	172.5	-102.1	0	0	0	110.6	N1265 T1266 M1387 I1395	Y1263-N1265 PolarHBondContact O-N 2.99Å; Y1263-T1266 PolarHBondContact N-O 3.3Å; Y1263-T1266 CarbonylContact O-C 3.56Å; Y1263-T1266 WeakPolarHBondContact O-CA 3.38Å; Y1263-T1266 WeakPolarHBondContact O-CB 3.38Å; Y1263-T1266 PolarHBondContact O-N 3.46Å; Y1263-T1266 PolarHBondContact O-OG1 2.98Å; Y1263-M1387 HydrophobicContact CD2-CE 3.24Å; Y1263-M1387 HydrophobicContact CD2-SD 3.36Å; Y1263-M1387 WeakPolarHBondContact CD2-SD 3.32Å; Y1263-M1387 HydrophobicContact CE2-CE 3.52Å; Y1263-M1387 HydrophobicContact CE2-SD 4.26Å; Y1263-M1387 HydrophobicContact CG-CE 4.17Å; Y1263-M1387 HydrophobicContact CG-SD 3.86Å; Y1263-I1395 HydrophobicContact CE1-CD1 3.41Å; Y1263-I1395 VanDerWaalsContact CE1-CD1 3.41Å; Y1263-I1395 HydrophobicContact CE1-CG1 3.82Å; Y1263-I1395 HydrophobicContact CE1-CG2 4.29Å; Y1263-I1395 HydrophobicContact CE2-CG1 4.33Å; Y1263-I1395 VanDerWaalsContact CZ-CD1 3.48Å; Y1263-I1395 WeakPolarHBondContact OH-CD1 3.48Å; Y1263-I1395 WeakPolarHBondContact OH-CG1 2.94Å
1264	D	81.2	Confident	89.4	Confident	69 Å²	69	24.7 Å²	24.7	37%	0.369	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	-138	-176	-168.5	-13.4	0	0	0	108.7	D1207 T1266	D1207-D1264 WeakPolarHBondContact OD2-CA 3.43Å; D1264-T1266 PolarHBondContact O-N 3.34Å
1265	N	85.8	Confident	90.3	Very high	60 Å²	60	22.8 Å²	22.8	32%	0.321	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	31.6	171.3	-65.5	-64.7	0	0	0	112.5	Y1263 Q1280 I1281	Y1263-N1265 PolarHBondContact O-N 2.99Å; N1265-Q1280 CarbonylContact O-C 3.49Å; N1265-Q1280 WeakPolarHBondContact O-CA 3.4Å; N1265-Q1280 PolarHBondContact O-NE2 3.36Å; N1265-Q1280 VanDerWaalsContact O-NE2 3.11Å; N1265-I1281 PolarHBondContact O-N 3.02Å
1266	T	89.2	Confident	90.8	Very high	13 Å²	13	19.9 Å²	19.9	8%	0.08	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.2	175.3	68.3	0	0	0	0	112.5	Y1263 D1264 W1268 Y1279	Y1263-T1266 PolarHBondContact N-O 3.3Å; Y1263-T1266 CarbonylContact O-C 3.56Å; Y1263-T1266 WeakPolarHBondContact O-CA 3.38Å; Y1263-T1266 WeakPolarHBondContact O-CB 3.38Å; Y1263-T1266 PolarHBondContact O-N 3.46Å; Y1263-T1266 PolarHBondContact O-OG1 2.98Å; D1264-T1266 PolarHBondContact O-N 3.34Å; T1266-W1268 PolarHBondContact OG1-NE1 2.85Å; T1266-Y1279 CarbonylContact C-O 3.55Å; T1266-Y1279 WeakPolarHBondContact CA-O 3.43Å
1267	L	93.8	Very high	90.9	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	116.7	172.4	179.2	67.5	0	0	0	109.4	W1211 I1220 P1262 I1269 V1278 Y1279 I1281 L1369	W1211-L1267 HydrophobicContact CD2-CD1 4.07Å; W1211-L1267 HydrophobicContact CD2-CD2 4.1Å; W1211-L1267 HydrophobicContact CE3-CD1 4.46Å; W1211-L1267 HydrophobicContact CE3-CD2 3.76Å; W1211-L1267 HydrophobicContact CG-CD1 4.23Å; W1211-L1267 HydrophobicContact CH2-CD2 3.85Å; W1211-L1267 HydrophobicContact CZ2-CD2 4.16Å; W1211-L1267 HydrophobicContact CZ3-CD2 3.63Å; I1220-L1267 HydrophobicContact CD1-CD2 3.4Å; I1220-L1267 VanDerWaalsContact CD1-CD2 3.4Å; P1262-L1267 HydrophobicContact CB-CD1 4.02Å; L1267-I1269 HydrophobicContact CD2-CD1 3.99Å; L1267-I1269 HydrophobicContact CD2-CG1 4.29Å; L1267-I1269 HydrophobicContact CG-CD1 4.27Å; L1267-I1269 HydrophobicContact CG-CG1 4.04Å; L1267-V1278 WeakPolarHBondContact O-CA 3.44Å; L1267-Y1279 PolarHBondContact N-O 3.36Å; L1267-Y1279 PolarHBondContact O-N 3.06Å; L1267-I1281 HydrophobicContact CB-CD1 4.23Å; L1267-I1281 HydrophobicContact CB-CG1 4.47Å; L1267-L1369 HydrophobicContact CD2-CD2 4.42Å
1268	W	94.6	Very high	90.9	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	135.5	176.5	-66.6	67.4	0	0	0	110.2	I1260 L1261 T1266 V1276 L1277 V1278 L1385 I1397 W1413 W1423	I1260-W1268 CarbonylContact C-O 3.57Å; I1260-W1268 WeakPolarHBondContact CA-O 3.43Å; L1261-W1268 HydrophobicContact CB-CB 4.16Å; L1261-W1268 PolarHBondContact N-O 3.41Å; L1261-W1268 WeakPolarHBondContact O-CB 3.32Å; L1261-W1268 PolarHBondContact O-N 3.48Å; T1266-W1268 PolarHBondContact OG1-NE1 2.85Å; W1268-V1276 HydrophobicContact CE3-CG1 3.64Å; W1268-V1276 HydrophobicContact CZ3-CG1 3.9Å; W1268-L1277 CarbonylContact C-O 3.51Å; W1268-L1277 WeakPolarHBondContact CA-O 3.32Å; W1268-V1278 HydrophobicContact CD2-CB 4.42Å; W1268-V1278 HydrophobicContact CD2-CG1 4.13Å; W1268-V1278 HydrophobicContact CD2-CG2 3.51Å; W1268-V1278 HydrophobicContact CE3-CG2 3.43Å; W1268-V1278 VanDerWaalsContact CE3-CG2 3.43Å; W1268-V1278 HydrophobicContact CG-CG1 4.33Å; W1268-V1278 HydrophobicContact CG-CG2 4.21Å; W1268-V1278 HydrophobicContact CH2-CG2 3.74Å; W1268-V1278 HydrophobicContact CZ2-CG1 4.11Å; W1268-V1278 HydrophobicContact CZ2-CG2 3.81Å; W1268-V1278 HydrophobicContact CZ3-CG2 3.55Å; W1268-L1385 HydrophobicContact CB-CD1 3.99Å; W1268-I1397 HydrophobicContact CD2-CD1 4.01Å; W1268-I1397 HydrophobicContact CE3-CG2 4.27Å; W1268-I1397 HydrophobicContact CH2-CD1 4.06Å; W1268-I1397 HydrophobicContact CZ2-CD1 3.44Å; W1268-I1397 VanDerWaalsContact CZ2-CD1 3.44Å; W1268-I1397 HydrophobicContact CZ3-CG2 4.34Å; W1268-W1413 HydrophobicContact CH2-CB 4.25Å; W1268-W1413 HydrophobicContact CH2-CD2 4.15Å; W1268-W1413 HydrophobicContact CH2-CE3 4.01Å; W1268-W1413 HydrophobicContact CH2-CG 4.28Å; W1268-W1413 HydrophobicContact CZ3-CB 4.46Å; W1268-W1413 AromaticContact CZ3-CD2 3.77Å; W1268-W1413 HydrophobicContact CZ3-CD2 3.77Å; W1268-W1413 AromaticContact CZ3-CE3 3.88Å; W1268-W1413 HydrophobicContact CZ3-CE3 3.88Å; W1268-W1413 HydrophobicContact CZ3-CG 4.04Å; W1268-W1413 HydrophobicContact CZ3-CZ3 4.41Å; W1268-W1423 HydrophobicContact CH2-CB 4.24Å; W1268-W1423 AromaticContact CH2-CD2 3.6Å; W1268-W1423 HydrophobicContact CH2-CD2 3.6Å; W1268-W1423 AromaticContact CH2-CE3 3.69Å; W1268-W1423 HydrophobicContact CH2-CE3 3.69Å; W1268-W1423 AromaticContact CH2-CG 3.83Å; W1268-W1423 HydrophobicContact CH2-CG 3.83Å; W1268-W1423 HydrophobicContact CH2-CZ3 4.24Å; W1268-W1423 AromaticContact CZ2-CD2 3.5Å; W1268-W1423 HydrophobicContact CZ2-CD2 3.5Å; W1268-W1423 VanDerWaalsContact CZ2-CD2 3.5Å; W1268-W1423 AromaticContact CZ2-CE2 3.49Å; W1268-W1423 VanDerWaalsContact CZ2-CE2 3.49Å; W1268-W1423 AromaticContact CZ2-CE3 3.79Å; W1268-W1423 HydrophobicContact CZ2-CE3 3.79Å; W1268-W1423 AromaticContact CZ2-CG 3.96Å; W1268-W1423 HydrophobicContact CZ2-CG 3.96Å; W1268-W1423 HydrophobicContact CZ2-CH2 4.03Å; W1268-W1423 AromaticContact CZ2-CZ2 3.78Å; W1268-W1423 HydrophobicContact CZ2-CZ2 3.78Å; W1268-W1423 HydrophobicContact CZ2-CZ3 4.04Å; W1268-W1423 AromaticContact CZ2-NE1 3.89Å
1269	I	95.5	Very high	90.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	124.6	-175.7	-53.4	-178.6	0	0	0	108.7	I1220 I1236 V1257 V1259 I1260 L1267 V1276 L1277 Y1279	I1220-I1269 HydrophobicContact CD1-CD1 3.87Å; I1220-I1269 HydrophobicContact CG2-CD1 4.47Å; I1236-I1269 HydrophobicContact CD1-CG2 4.1Å; I1236-I1269 HydrophobicContact CG2-CD1 3.71Å; V1257-I1269 HydrophobicContact CG1-CG2 4.07Å; V1257-I1269 HydrophobicContact CG2-CG2 3.99Å; V1259-I1269 WeakPolarHBondContact O-CA 3.48Å; I1260-I1269 HydrophobicContact CG2-CG1 4.41Å; L1267-I1269 HydrophobicContact CD2-CD1 3.99Å; L1267-I1269 HydrophobicContact CD2-CG1 4.29Å; L1267-I1269 HydrophobicContact CG-CD1 4.27Å; L1267-I1269 HydrophobicContact CG-CG1 4.04Å; I1269-V1276 CarbonylContact O-C 3.57Å; I1269-V1276 WeakPolarHBondContact O-CA 3.46Å; I1269-L1277 HydrophobicContact CB-CB 4.27Å; I1269-L1277 PolarHBondContact N-O 3.06Å; I1269-L1277 PolarHBondContact O-N 3.09Å; I1269-Y1279 HydrophobicContact CD1-CD2 3.98Å; I1269-Y1279 HydrophobicContact CD1-CE2 3.91Å
1270	G	94	Very high	90.8	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	139.5	166.5	0	0	0	0	0	110.2	T1258 V1259 E1275	T1258-G1270 PolarHBondContact N-O 2.94Å; T1258-G1270 VanDerWaalsContact OG1-C 3.24Å; T1258-G1270 PolarHBondContact OG1-O 2.99Å; V1259-G1270 PolarHBondContact N-O 3.46Å; V1259-G1270 PolarHBondContact O-N 3.47Å; G1270-E1275 WeakPolarHBondContact CA-O 3.35Å
1271	T	93.6	Very high	90.6	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.006	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	160.8	179.1	77	0	0	0	0	112.7	I1236 R1256 T1258 M1273 G1274 E1275 L1277 I1382	I1236-T1271 HydrophobicContact CD1-CG2 4.32Å; R1256-T1271 CarbonylContact O-C 3.59Å; R1256-T1271 WeakPolarHBondContact O-CA 3.35Å; T1258-T1271 PolarHBondContact OG1-O 3.24Å; T1271-M1273 PolarHBondContact O-N 3.49Å; T1271-M1273 PolarHBondContact OG1-N 3.19Å; T1271-G1274 PolarHBondContact O-N 3.34Å; T1271-E1275 HydrophobicContact CG2-CB 4.26Å; T1271-E1275 PolarHBondContact N-O 3.43Å; T1271-E1275 WeakPolarHBondContact OG1-CB 3.45Å; T1271-E1275 PolarHBondContact OG1-N 3.37Å; T1271-E1275 VanDerWaalsContact OG1-N 3.17Å; T1271-L1277 HydrophobicContact CG2-CD1 4.01Å; T1271-L1277 HydrophobicContact CG2-CG 4.16Å; T1271-I1382 PolarHBondContact O-N 3.44Å
1272	G	86.9	Confident	90.3	Very high	9 Å²	9	20.1 Å²	20.1	9%	0.093	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.1	172	0	0	0	0	0	114.4	P1254 R1256 G1274 P1381	P1254-G1272 CarbonylContact O-C 3.57Å; P1254-G1272 VanDerWaalsContact O-C 3.25Å; P1254-G1272 VanDerWaalsContact O-CA 3.3Å; P1254-G1272 WeakPolarHBondContact O-CA 3.42Å; R1256-G1272 PolarHBondContact O-N 3.36Å; G1272-G1274 VanDerWaalsContact C-N 3.35Å; G1272-P1381 WeakPolarHBondContact O-CG 3.38Å
1273	M	86	Confident	89.8	Confident	78 Å²	78	22 Å²	22	38%	0.384	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	5.4	174.4	-71.4	-58.4	-76.5	0	0	113	P1254 Q1255 T1271 E1275 K1376	P1254-M1273 HydrophobicContact CB-CG 4.07Å; P1254-M1273 HydrophobicContact CB-SD 3.62Å; P1254-M1273 WeakPolarHBondContact O-CG 3.27Å; P1254-M1273 PolarHBondContact O-N 2.92Å; Q1255-M1273 HydrophobicContact CG-CG 4.09Å; T1271-M1273 PolarHBondContact O-N 3.49Å; T1271-M1273 PolarHBondContact OG1-N 3.19Å; M1273-E1275 VanDerWaalsContact C-N 3.31Å; M1273-E1275 HydrophobicContact CB-CG 4.36Å; M1273-E1275 PolarHBondContact O-N 3.01Å; M1273-K1376 WeakPolarHBondContact O-CD 3.45Å; M1273-K1376 WeakPolarHBondContact O-CE 3.21Å; M1273-K1376 PolarHBondContact O-NZ 3.4Å
1274	G	86.4	Confident	89.5	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	73.3	24.9	-177.7	0	0	0	0	0	113.7	T1271 G1272 V1377 A1378 T1380	T1271-G1274 PolarHBondContact O-N 3.34Å; G1272-G1274 VanDerWaalsContact C-N 3.35Å; G1274-V1377 PolarHBondContact O-N 3.23Å; G1274-A1378 WeakPolarHBondContact CA-O 3.42Å; G1274-A1378 PolarHBondContact O-N 2.82Å; G1274-A1378 VanDerWaalsContact O-N 3.09Å; G1274-T1380 WeakPolarHBondContact CA-O 3.34Å
1275	E	92.3	Very high	89.1	Confident	22 Å²	22	24.3 Å²	24.3	10%	0.103	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	143.4	171.3	-55.7	177.9	116.6	0	0	110.4	G1270 T1271 M1273 L1277 R1374 S1375 K1376	G1270-E1275 WeakPolarHBondContact CA-O 3.35Å; T1271-E1275 HydrophobicContact CG2-CB 4.26Å; T1271-E1275 PolarHBondContact N-O 3.43Å; T1271-E1275 WeakPolarHBondContact OG1-CB 3.45Å; T1271-E1275 PolarHBondContact OG1-N 3.37Å; T1271-E1275 VanDerWaalsContact OG1-N 3.17Å; M1273-E1275 VanDerWaalsContact C-N 3.31Å; M1273-E1275 HydrophobicContact CB-CG 4.36Å; M1273-E1275 PolarHBondContact O-N 3.01Å; E1275-L1277 HydrophobicContact CB-CD2 4.42Å; E1275-R1374 IonicContact OE1-CZ 3.88Å; E1275-R1374 VanDerWaalsContact OE1-CZ 3.29Å; E1275-R1374 IonicContact OE1-NE 2.52Å; E1275-R1374 PolarHBondContact OE1-NE 2.82Å; E1275-R1374 IonicContact OE1-NH2 3.54Å; E1275-R1374 PolarHBondContact OE1-NH2 3.05Å; E1275-R1374 IonicContact OE2-CZ 3.68Å; E1275-R1374 IonicContact OE2-NE 2.75Å; E1275-R1374 IonicContact OE2-NH2 3.28Å; E1275-R1374 PolarHBondContact OE2-NH2 3.36Å; E1275-R1374 VanDerWaalsContact OE2-NH2 3.17Å; E1275-S1375 CarbonylContact C-O 3.42Å; E1275-S1375 VanDerWaalsContact CA-O 3.28Å; E1275-S1375 WeakPolarHBondContact CA-O 3.47Å; E1275-K1376 HydrophobicContact CG-CB 4.22Å; E1275-K1376 HydrophobicContact CG-CD 3.99Å
1276	V	92.7	Very high	88.2	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.6	164.6	177.2	0	0	0	0	107.9	W1268 I1269 V1278 S1375 V1377 I1382 W1413	W1268-V1276 HydrophobicContact CE3-CG1 3.64Å; W1268-V1276 HydrophobicContact CZ3-CG1 3.9Å; I1269-V1276 CarbonylContact O-C 3.57Å; I1269-V1276 WeakPolarHBondContact O-CA 3.46Å; V1276-V1278 HydrophobicContact CG1-CG2 4.44Å; V1276-S1375 PolarHBondContact N-O 2.99Å; V1276-S1375 PolarHBondContact O-N 3.08Å; V1276-V1377 HydrophobicContact CG2-CG2 3.77Å; V1276-I1382 HydrophobicContact CG2-CD1 4.24Å; V1276-I1382 HydrophobicContact CG2-CG1 3.98Å; V1276-I1382 HydrophobicContact CG2-CG2 4.4Å; V1276-W1413 HydrophobicContact CB-CH2 4.14Å; V1276-W1413 HydrophobicContact CB-CZ2 3.89Å; V1276-W1413 HydrophobicContact CG1-CH2 4.25Å; V1276-W1413 HydrophobicContact CG1-CZ2 4.01Å; V1276-W1413 HydrophobicContact CG2-CZ2 3.9Å
1277	L	92.9	Very high	86.6	Confident	8 Å²	8	29 Å²	29	4%	0.042	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	137.9	174.5	-48.8	178.5	0	0	0	109	I1236 W1268 I1269 T1271 E1275 Y1279 V1373 R1374	I1236-L1277 HydrophobicContact CB-CD1 4.36Å; I1236-L1277 HydrophobicContact CD1-CD1 4.15Å; I1236-L1277 HydrophobicContact CG1-CD1 4.49Å; W1268-L1277 CarbonylContact C-O 3.51Å; W1268-L1277 WeakPolarHBondContact CA-O 3.32Å; I1269-L1277 HydrophobicContact CB-CB 4.27Å; I1269-L1277 PolarHBondContact N-O 3.06Å; I1269-L1277 PolarHBondContact O-N 3.09Å; T1271-L1277 HydrophobicContact CG2-CD1 4.01Å; T1271-L1277 HydrophobicContact CG2-CG 4.16Å; E1275-L1277 HydrophobicContact CB-CD2 4.42Å; L1277-Y1279 HydrophobicContact CB-CD2 4.43Å; L1277-Y1279 HydrophobicContact CB-CE2 3.89Å; L1277-Y1279 HydrophobicContact CD1-CE2 4.22Å; L1277-V1373 WeakPolarHBondContact CA-O 3.42Å; L1277-R1374 HydrophobicContact CD2-CB 3.84Å; L1277-R1374 HydrophobicContact CD2-CG 3.56Å
1278	V	91.9	Very high	84.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	123.9	173.4	-169.7	0	0	0	0	108.6	L1267 W1268 V1276 I1372 V1373	L1267-V1278 WeakPolarHBondContact O-CA 3.44Å; W1268-V1278 HydrophobicContact CD2-CB 4.42Å; W1268-V1278 HydrophobicContact CD2-CG1 4.13Å; W1268-V1278 HydrophobicContact CD2-CG2 3.51Å; W1268-V1278 HydrophobicContact CE3-CG2 3.43Å; W1268-V1278 VanDerWaalsContact CE3-CG2 3.43Å; W1268-V1278 HydrophobicContact CG-CG1 4.33Å; W1268-V1278 HydrophobicContact CG-CG2 4.21Å; W1268-V1278 HydrophobicContact CH2-CG2 3.74Å; W1268-V1278 HydrophobicContact CZ2-CG1 4.11Å; W1268-V1278 HydrophobicContact CZ2-CG2 3.81Å; W1268-V1278 HydrophobicContact CZ3-CG2 3.55Å; V1276-V1278 HydrophobicContact CG1-CG2 4.44Å; V1278-I1372 HydrophobicContact CB-CD1 4.42Å; V1278-I1372 HydrophobicContact CB-CG1 4.02Å; V1278-I1372 HydrophobicContact CG1-CD1 3.84Å; V1278-I1372 HydrophobicContact CG1-CG1 3.92Å; V1278-I1372 VanDerWaalsContact O-CG1 3.23Å; V1278-I1372 WeakPolarHBondContact O-CG1 3.34Å; V1278-I1372 PolarHBondContact O-N 2.96Å; V1278-V1373 HydrophobicContact CB-CB 3.81Å; V1278-V1373 HydrophobicContact CB-CG2 4.15Å; V1278-V1373 HydrophobicContact CG2-CB 3.81Å; V1278-V1373 HydrophobicContact CG2-CG1 4.36Å; V1278-V1373 HydrophobicContact CG2-CG2 4.26Å; V1278-V1373 PolarHBondContact N-O 3.34Å; V1278-V1373 PolarHBondContact O-N 3.37Å
1279	Y	92.6	Very high	81.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.6	174.9	-69.9	-96.3	0	0	0	109.8	F1234 I1236 T1266 L1267 I1269 L1277 L1369 Q1370 K1371	F1234-Y1279 HydrophobicContact CE1-CD1 4.36Å; F1234-Y1279 AromaticContact CE1-CE1 3.66Å; F1234-Y1279 HydrophobicContact CE1-CE1 3.66Å; F1234-Y1279 AromaticContact CE1-CZ 3.89Å; F1234-Y1279 AromaticContact CZ-CE1 3.88Å; F1234-Y1279 HydrophobicContact CZ-CE1 3.88Å; I1236-Y1279 PolarHBondContact O-OH 3.04Å; T1266-Y1279 CarbonylContact C-O 3.55Å; T1266-Y1279 WeakPolarHBondContact CA-O 3.43Å; L1267-Y1279 PolarHBondContact N-O 3.36Å; L1267-Y1279 PolarHBondContact O-N 3.06Å; I1269-Y1279 HydrophobicContact CD1-CD2 3.98Å; I1269-Y1279 HydrophobicContact CD1-CE2 3.91Å; L1277-Y1279 HydrophobicContact CB-CD2 4.43Å; L1277-Y1279 HydrophobicContact CB-CE2 3.89Å; L1277-Y1279 HydrophobicContact CD1-CE2 4.22Å; Y1279-L1369 HydrophobicContact CD1-CB 4.04Å; Y1279-L1369 HydrophobicContact CG-CD2 4.33Å; Y1279-Q1370 CarbonylContact C-O 3.49Å; Y1279-Q1370 WeakPolarHBondContact CA-O 3.43Å; Y1279-K1371 HydrophobicContact CD1-CB 3.83Å; Y1279-K1371 HydrophobicContact CD1-CG 4.48Å; Y1279-K1371 HydrophobicContact CE1-CB 3.56Å; Y1279-K1371 HydrophobicContact CE1-CD 4.42Å; Y1279-K1371 HydrophobicContact CE1-CG 4.11Å
1280	Q	90.4	Very high	79.3	Confident	55 Å²	55	46.8 Å²	46.8	26%	0.257	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	127.8	164.5	-172.7	69.8	34.4	0	0	108.7	N1265 H1282 Q1370 I1372	N1265-Q1280 CarbonylContact O-C 3.49Å; N1265-Q1280 WeakPolarHBondContact O-CA 3.4Å; N1265-Q1280 PolarHBondContact O-NE2 3.36Å; N1265-Q1280 VanDerWaalsContact O-NE2 3.11Å; Q1280-H1282 VanDerWaalsContact CG-CE1 3.46Å; Q1280-H1282 WeakPolarHBondContact CG-CE1 3.47Å; Q1280-Q1370 PolarHBondContact N-O 2.99Å; Q1280-Q1370 PolarHBondContact O-N 3.39Å; Q1280-I1372 HydrophobicContact CB-CD1 4.45Å; Q1280-I1372 HydrophobicContact CB-CG2 3.87Å
1281	I	91	Very high	76.8	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.026	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	118	177.2	-51.7	163.3	0	0	0	107.7	W1211 N1265 L1267 Y1367 E1368 L1369	W1211-I1281 HydrophobicContact CZ2-CD1 3.79Å; W1211-I1281 HydrophobicContact CZ2-CG1 4.39Å; N1265-I1281 PolarHBondContact O-N 3.02Å; L1267-I1281 HydrophobicContact CB-CD1 4.23Å; L1267-I1281 HydrophobicContact CB-CG1 4.47Å; I1281-Y1367 HydrophobicContact CG2-CD1 4.21Å; I1281-E1368 CarbonylContact C-O 3.54Å; I1281-E1368 WeakPolarHBondContact CA-O 3.41Å; I1281-L1369 HydrophobicContact CG1-CD2 3.9Å
1282	H	87.3	Confident	74.1	Confident	57 Å²	57	58 Å²	58	26%	0.264	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.7	172.5	-58.5	86.2	0	0	0	109.1	Q1280 Y1284 Y1367 E1368 Q1370	Q1280-H1282 VanDerWaalsContact CG-CE1 3.46Å; Q1280-H1282 WeakPolarHBondContact CG-CE1 3.47Å; H1282-Y1284 HydrophobicContact CB-CE2 3.81Å; H1282-Y1367 CarbonylContact O-C 3.58Å; H1282-Y1367 WeakPolarHBondContact O-CA 3.24Å; H1282-E1368 HydrophobicContact CB-CB 4.23Å; H1282-E1368 PolarHBondContact N-O 3.13Å; H1282-E1368 PolarHBondContact O-N 3.46Å; H1282-Q1370 PolarHBondContact CE1-OE1 3.47Å
1283	T	83.4	Confident	71.8	Confident	50 Å²	50	63.6 Å²	63.6	31%	0.307	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	119.8	-178.8	-56.1	0	0	0	0	109	N1208 Y1365 I1366 Y1367	N1208-T1283 PolarHBondContact OD1-OG1 3.48Å; T1283-Y1365 HydrophobicContact CG2-CD1 3.84Å; T1283-Y1365 HydrophobicContact CG2-CG 4.04Å; T1283-I1366 CarbonylContact C-O 3.58Å; T1283-I1366 WeakPolarHBondContact CA-O 3.27Å; T1283-Y1367 HydrophobicContact CG2-CD1 3.94Å; T1283-Y1367 HydrophobicContact CG2-CE1 3.53Å; T1283-Y1367 VanDerWaalsContact OG1-CD1 3.32Å; T1283-Y1367 WeakPolarHBondContact OG1-CD1 3.47Å; T1283-Y1367 WeakPolarHBondContact OG1-CE1 3.46Å
1284	Y	78.3	Confident	69.5	Low	77 Å²	77	66.8 Å²	66.8	30%	0.302	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.7	-179.6	-53.3	-83.5	0	0	0	110.8	H1282 Y1365 I1366 E1368	H1282-Y1284 HydrophobicContact CB-CE2 3.81Å; Y1284-Y1365 CarbonylContact O-C 3.33Å; Y1284-Y1365 VanDerWaalsContact O-CA 3.23Å; Y1284-Y1365 WeakPolarHBondContact O-CA 3.5Å; Y1284-I1366 PolarHBondContact N-O 3.49Å; Y1284-I1366 PolarHBondContact O-N 3.05Å; Y1284-E1368 HydrophobicContact CE2-CB 3.89Å; Y1284-E1368 VanDerWaalsContact CE2-OE2 3.24Å; Y1284-E1368 WeakPolarHBondContact CE2-OE2 3.39Å; Y1284-E1368 PolarHBondContact OH-OE2 2.87Å
1285	Q	73.3	Confident	67	Low	74 Å²	74	69.3 Å²	69.3	35%	0.346	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	131.9	171.8	-156.5	175.4	8.1	0	0	109.9	T1287 E1288 Y1365	Q1285-T1287 PolarHBondContact O-N 2.84Å; Q1285-E1288 HydrophobicContact CB-CG 4.36Å; Q1285-E1288 PolarHBondContact O-N 3.06Å; Q1285-Y1365 HydrophobicContact CB-CD1 4.12Å; Q1285-Y1365 HydrophobicContact CB-CE1 3.98Å; Q1285-Y1365 HydrophobicContact CG-CD1 4.18Å; Q1285-Y1365 HydrophobicContact CG-CE1 3.78Å
1286	K	66.7	Low	64.3	Low	79 Å²	79	72.6 Å²	72.6	34%	0.343	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-27.5	-177.6	-81	-179.9	175.7	167	0	113.5	A1360 S1363 N1364 I1366	K1286-A1360 PolarHBondContact NZ-O 2.88Å; K1286-S1363 WeakPolarHBondContact CD-O 3.22Å; K1286-S1363 WeakPolarHBondContact CE-O 3.5Å; K1286-S1363 PolarHBondContact NZ-O 3.01Å; K1286-N1364 PolarHBondContact N-O 3.44Å; K1286-I1366 HydrophobicContact CG-CD1 4.25Å; K1286-I1366 HydrophobicContact CG-CG1 4.14Å
1287	T	54.1	Low	61.5	Low	93 Å²	93	78.6 Å²	78.6	57%	0.571	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-27.8	178	44.5	0	0	0	0	114.1	Q1285	Q1285-T1287 PolarHBondContact O-N 2.84Å
1288	E	49.4	Very low	58.6	Low	120 Å²	120	86.6 Å²	86.6	56%	0.561	44%	0.438	S	S	*	.	H	α-helix	trans	-81.1	-28.4	-173	-70.7	-173	146.4	0	0	113.4	Q1285 K1290 K1291 S1292	Q1285-E1288 HydrophobicContact CB-CG 4.36Å; Q1285-E1288 PolarHBondContact O-N 3.06Å; E1288-K1290 PolarHBondContact O-N 3.15Å; E1288-K1291 PolarHBondContact O-N 2.96Å; E1288-S1292 PolarHBondContact O-N 2.93Å; E1288-S1292 VanDerWaalsContact O-N 3.11Å
1289	K	41.4	Very low	55.6	Low	83 Å²	83	94.8 Å²	94.8	36%	0.361	48%	0.478	S	S	.	.	H	α-helix	trans	-65.7	-24.4	176.2	-103.6	-174.4	178.5	177.2	0	113.7	K1291 L1293	K1289-K1291 VanDerWaalsContact C-N 3.35Å; K1289-L1293 WeakPolarHBondContact O-CB 3.22Å; K1289-L1293 PolarHBondContact O-N 3.25Å
1290	K	41.7	Very low	52.5	Low	171 Å²	171	100 Å²	100	74%	0.743	51%	0.511	S	S	*	.	H	α-helix	trans	-68	-33.7	172	-85.3	-173.7	175	179.3	0	112.3	E1288 E1294	E1288-K1290 PolarHBondContact O-N 3.15Å; K1290-E1294 PolarHBondContact O-N 2.75Å
1291	K	40.8	Very low	49.5	Very low	170 Å²	170	108.8 Å²	108.8	74%	0.739	54%	0.541	S	S	*	.	H	α-helix	trans	-81.1	-35.2	178.4	-74	-174.8	175.8	-179.8	0	113.3	E1288 K1289 E1294 G1295	E1288-K1291 PolarHBondContact O-N 2.96Å; K1289-K1291 VanDerWaalsContact C-N 3.35Å; K1291-E1294 PolarHBondContact O-N 3.19Å; K1291-G1295 PolarHBondContact O-N 3.31Å; K1291-G1295 VanDerWaalsContact O-N 3.08Å
1292	S	37.5	Very low	46.5	Very low	67 Å²	67	117.2 Å²	117.2	47%	0.469	58%	0.58	S	S	.	*	H	α-helix	trans	-74.1	-29.2	177.8	63.4	0	0	0	0	113.3	E1288 T1296	E1288-S1292 PolarHBondContact O-N 2.93Å; E1288-S1292 VanDerWaalsContact O-N 3.11Å; S1292-T1296 PolarHBondContact O-N 2.84Å; S1292-T1296 PolarHBondContact O-OG1 3.43Å
1293	L	37.6	Very low	43.7	Very low	126 Å²	126	123.9 Å²	123.9	66%	0.66	61%	0.609	S	S	*	*	H	α-helix	trans	-72	-31.8	172.4	-146.5	78	0	0	0	112.4	K1289 I1297	K1289-L1293 WeakPolarHBondContact O-CB 3.22Å; K1289-L1293 PolarHBondContact O-N 3.25Å; L1293-I1297 WeakPolarHBondContact O-CD1 3.42Å; L1293-I1297 WeakPolarHBondContact O-CG1 3.42Å
1294	E	37.6	Very low	40.9	Very low	145 Å²	145	133.6 Å²	133.6	68%	0.678	64%	0.64	S	S	*	*	H	α-helix	trans	-73.7	-35.1	173.6	-76.3	-179.1	170.1	0	0	112.8	K1290 K1291 T1296	K1290-E1294 PolarHBondContact O-N 2.75Å; K1291-E1294 PolarHBondContact O-N 3.19Å; E1294-T1296 PolarHBondContact O-N 3.46Å
1295	G	34.7	Very low	38.4	Very low	53 Å²	53	134.7 Å²	134.7	55%	0.546	66%	0.659	S	S	.	*	H	α-helix	trans	-69.2	-28.7	176.8	0	0	0	0	0	114.5	K1291	K1291-G1295 PolarHBondContact O-N 3.31Å; K1291-G1295 VanDerWaalsContact O-N 3.08Å
1296	T	35.6	Very low	36.2	Very low	92 Å²	92	137.6 Å²	137.6	56%	0.564	68%	0.681	S	S	*	*	H	α-helix	trans	-80.8	-17.8	-177.4	-50.1	0	0	0	0	112.7	S1292 E1294 Q1298 T1300	S1292-T1296 PolarHBondContact O-N 2.84Å; S1292-T1296 PolarHBondContact O-OG1 3.43Å; E1294-T1296 PolarHBondContact O-N 3.46Å; T1296-Q1298 VanDerWaalsContact C-N 3.31Å; T1296-Q1298 PolarHBondContact O-N 3.42Å; T1296-T1300 PolarHBondContact O-OG1 2.67Å
1297	I	32.8	Very low	34.3	Very low	125 Å²	125	139.2 Å²	139.2	64%	0.641	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-16.7	-179.1	-66.7	169.2	0	0	0	112.6	L1293	L1293-I1297 WeakPolarHBondContact O-CD1 3.42Å; L1293-I1297 WeakPolarHBondContact O-CG1 3.42Å
1298	Q	32.4	Very low	33	Very low	177 Å²	177	142 Å²	142	83%	0.827	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-12.1	179.1	-78	-170.3	-6.4	0	0	115.9	T1296	T1296-Q1298 VanDerWaalsContact C-N 3.31Å; T1296-Q1298 PolarHBondContact O-N 3.42Å
1299	M	28.3	Very low	32.2	Very low	171 Å²	171	145.2 Å²	145.2	84%	0.842	73%	0.726	S	S	*	*	S	Bend	trans	-107.7	2.4	-173.5	-78.9	-77.6	-81.7	0	0	116.1
1300	T	28	Very low	31.8	Very low	111 Å²	111	148.7 Å²	148.7	68%	0.681	75%	0.748	S	S	*	*			trans	-122.7	21.5	-177.5	43.4	0	0	0	0	115	T1296 H1302	T1296-T1300 PolarHBondContact O-OG1 2.67Å; T1300-H1302 VanDerWaalsContact C-N 3.33Å
1301	R	28.2	Very low	31.2	Very low	238 Å²	238	149 Å²	149	90%	0.898	75%	0.752	S	S	*	*	S	Bend	trans	-84.7	1.6	171.6	-125.1	178.8	-173.1	169.6	2.5	115.3
1302	H	27.6	Very low	30.5	Very low	183 Å²	183	148.7 Å²	148.7	85%	0.847	76%	0.758	S	S	*	*	S	Bend	trans	-121.8	93.3	171.5	-79.9	-56.6	0	0	0	110.8	T1300	T1300-H1302 VanDerWaalsContact C-N 3.33Å
1303	K	27.7	Very low	30.1	Very low	197 Å²	197	153.7 Å²	153.7	86%	0.857	77%	0.774	S	S	*	*	S	Bend	trans	142.2	94.3	151.3	-80.9	168.6	-179.4	-178.7	0	110.2
1304	R	26.3	Very low	29.7	Very low	253 Å²	253	155.7 Å²	155.7	96%	0.955	78%	0.784	S	S	*	*			trans	169.6	74.2	137.3	-91.7	167.3	-174.8	-171.2	2.4	107.7
1305	S	24.5	Very low	29.3	Very low	101 Å²	101	157.1 Å²	157.1	71%	0.706	80%	0.795	S	S	*	*			trans	-65	153.3	153.4	51.5	0	0	0	0	109.3
1306	T	26.6	Very low	29	Very low	134 Å²	134	157.4 Å²	157.4	82%	0.822	80%	0.798	S	S	*	*	S	Bend	trans	71.8	95.7	163.6	65.8	0	0	0	0	117.8
1307	S	28.2	Very low	28.6	Very low	114 Å²	114	162.1 Å²	162.1	80%	0.797	81%	0.813	S	S	*	*	S	Bend	trans	150.9	70.7	131	178.8	0	0	0	0	111.3
1308	L	26.8	Very low	28.4	Very low	150 Å²	150	162.6 Å²	162.6	79%	0.785	82%	0.822	S	S	*	*			trans	-169.1	41.6	162.2	-108.9	146.9	0	0	0	109.8
1309	K	32.1	Very low	28.2	Very low	189 Å²	189	161.4 Å²	161.4	82%	0.822	83%	0.827	S	S	*	*			trans	-98.3	-0.5	-175.4	-113	-172.3	178.4	-172.4	0	115.3
1310	D	32.9	Very low	28.1	Very low	155 Å²	155	165.1 Å²	165.1	83%	0.829	83%	0.832	S	S	*	*	S	Bend	trans	-116	7.1	-173.4	-65.7	-24.1	0	0	0	116
1311	E	29.3	Very low	28.1	Very low	179 Å²	179	169.5 Å²	169.5	84%	0.836	84%	0.841	S	S	*	*	S	Bend	trans	-122.4	11.8	177.1	-96.4	-174.9	167.1	0	0	116
1312	L	26.8	Very low	28	Very low	163 Å²	163	164.7 Å²	164.7	85%	0.853	84%	0.838	S	S	*	*	S	Bend	trans	-123.1	29.3	176.5	-89.3	162	0	0	0	113.9
1313	Q	27.7	Very low	27.9	Very low	172 Å²	172	164.5 Å²	164.5	80%	0.804	84%	0.843	S	S	*	*	S	Bend	trans	-108.3	23.9	-179.8	-129.6	-180	28.9	0	0	115.3
1314	L	29	Very low	27.8	Very low	168 Å²	168	163.3 Å²	163.3	88%	0.88	85%	0.845	S	S	*	*	S	Bend	trans	-144.8	44.8	175	-135.4	102.6	0	0	0	115.7
1315	I	30.4	Very low	27.8	Very low	174 Å²	174	161.1 Å²	161.1	89%	0.892	84%	0.842	S	S	*	*	S	Bend	trans	-136.5	84.9	151.8	-57	-178.9	0	0	0	107.3
1316	G	27.3	Very low	27.8	Very low	59 Å²	59	161.7 Å²	161.7	61%	0.608	85%	0.846	S	S	*	*			trans	-67.1	134.8	176.2	0	0	0	0	0	112.4
1317	E	28	Very low	27.8	Very low	192 Å²	192	161.9 Å²	161.9	90%	0.897	85%	0.848	S	S	*	*				39.1	87.3	126.9	-60.8	-173.7	147.2	0	0	118.1
1318	T	28.4	Very low	27.7	Very low	134 Å²	134	168 Å²	168	82%	0.822	85%	0.853	S	S	*	*	S	Bend	trans	-152.3	14.1	149.9	-16.2	0	0	0	0	118
1319	T	27.8	Very low	27.5	Very low	152 Å²	152	166.9 Å²	166.9	93%	0.933	86%	0.856	S	S	*	*	S	Bend	trans	-135.7	25	-178.5	21.9	0	0	0	0	116.1
1320	R	26.2	Very low	27.2	Very low	249 Å²	249	163.8 Å²	163.8	94%	0.94	86%	0.856	S	S	*	*	S	Bend	trans	-110.2	28.2	-178.7	-138.2	179.2	-169.2	164.3	3.9	116.6
1321	K	27.7	Very low	26.8	Very low	203 Å²	203	161.5 Å²	161.5	88%	0.883	85%	0.852	S	S	*	*	S	Bend	trans	-128.7	15.1	-176.4	-95.5	-171.5	-179.7	177.7	0	119.6
1322	T	26.9	Very low	26.9	Very low	137 Å²	137	160.4 Å²	160.4	84%	0.84	85%	0.852	S	S	*	*	S	Bend	trans	-139.4	27.5	-177.4	-12.3	0	0	0	0	117.9
1323	L	25.4	Very low	27.6	Very low	179 Å²	179	157.1 Å²	157.1	94%	0.937	84%	0.841	S	S	*	*			trans	-136.1	60.7	167.9	-100	119.8	0	0	0	112.3
1324	L	25.1	Very low	27.7	Very low	173 Å²	173	157 Å²	157	91%	0.906	85%	0.845	S	S	*	*			trans	-140.5	78.8	165.8	-91.1	163.1	0	0	0	108.5
1325	K	27.4	Very low	27.6	Very low	206 Å²	206	155.5 Å²	155.5	90%	0.896	84%	0.843	S	S	*	*			trans	-135.6	88.3	154.9	-82.8	-167.9	177.3	177.9	0	108.8
1326	S	24.4	Very low	27.3	Very low	113 Å²	113	151.9 Å²	151.9	79%	0.79	83%	0.833	S	S	*	*			trans	-50.8	129	163.1	54.9	0	0	0	0	111.5
1327	T	26.9	Very low	27.5	Very low	139 Å²	139	157.5 Å²	157.5	85%	0.853	84%	0.843	S	S	*	*			trans	-122.1	128.1	153.4	36.6	0	0	0	0	108
1328	R	26.2	Very low	27.4	Very low	242 Å²	242	156.4 Å²	156.4	91%	0.913	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-70.3	134.7	-168.7	-74	169.1	167.1	170.8	-6.2	111
1329	C	20.9	Very low	27.4	Very low	126 Å²	126	155.1 Å²	155.1	85%	0.851	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-69.7	132.4	164.1	-57.1	0	0	0	0	110.5
1330	P	27.6	Very low	27.4	Very low	124 Å²	124	155.8 Å²	155.8	81%	0.805	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-94.4	133.9	162.1	29.9	-18.7	0	0	0	110.8
1331	S	24.3	Very low	27.4	Very low	108 Å²	108	153.2 Å²	153.2	76%	0.755	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-63.4	132.7	167.8	46.8	0	0	0	0	113
1332	N	30.3	Very low	27.4	Very low	155 Å²	155	150.9 Å²	150.9	83%	0.829	83%	0.826	S	S	*	*				-179.4	158.5	113.6	-115.6	2	0	0	0	112.5
1333	P	41.6	Very low	27.5	Very low	95 Å²	95	150.1 Å²	150.1	62%	0.617	82%	0.824	S	S	*	*			trans	-92	153.8	-168	38.1	-33.2	0	0	0	112
1334	D	30.2	Very low	27.5	Very low	168 Å²	168	150.1 Å²	150.1	90%	0.898	82%	0.819	S	S	*	*			trans	-164.5	138.6	130.2	-99.3	-28.9	0	0	0	110.9
1335	V	26.6	Very low	27.5	Very low	137 Å²	137	146.7 Å²	146.7	83%	0.83	81%	0.807	S	S	*	*			trans	-86.4	127.3	-173.4	170.5	0	0	0	0	109
1336	S	25.2	Very low	27.4	Very low	98 Å²	98	144 Å²	144	69%	0.685	80%	0.802	S	S	*	*			trans	166	148.3	139.4	49.4	0	0	0	0	110.6
1337	H	30	Very low	27.3	Very low	177 Å²	177	147.8 Å²	147.8	82%	0.819	80%	0.804	S	S	*	*			trans	79.5	86.3	-177.3	-64.3	-69.3	0	0	0	116.7	P1339	H1337-P1339 VanDerWaalsContact O-CD 3.31Å; H1337-P1339 WeakPolarHBondContact O-CD 3.41Å
1338	I	27.1	Very low	27.1	Very low	169 Å²	169	150.4 Å²	150.4	87%	0.867	80%	0.8	S	S	*	*			trans	-86.8	111	155.7	-59.4	164.6	0	0	0	106.5
1339	P	26.9	Very low	27.1	Very low	107 Å²	107	144.9 Å²	144.9	70%	0.695	80%	0.795	S	S	*	*			trans	-99.5	129.8	161.1	31.7	-20.8	0	0	0	109.5	H1337 K1341	H1337-P1339 VanDerWaalsContact O-CD 3.31Å; H1337-P1339 WeakPolarHBondContact O-CD 3.41Å; P1339-K1341 PolarHBondContact O-N 2.69Å; P1339-K1341 VanDerWaalsContact O-N 3.08Å
1340	D	28	Very low	27.3	Very low	166 Å²	166	147.3 Å²	147.3	89%	0.888	80%	0.799	S	S	*	*			trans	-44.6	110.2	172.2	-72.1	-45.9	0	0	0	111.4
1341	K	27.8	Very low	27.2	Very low	195 Å²	195	153 Å²	153	85%	0.848	80%	0.804	S	S	*	*			trans	-128.7	113.6	161.3	-87.7	-169.9	173	-174.4	0	107.5	P1339	P1339-K1341 PolarHBondContact O-N 2.69Å; P1339-K1341 VanDerWaalsContact O-N 3.08Å
1342	D	26.2	Very low	27.3	Very low	154 Å²	154	156.4 Å²	156.4	82%	0.824	81%	0.808	S	S	*	*			trans	-47.8	134.4	173.7	-66.1	-54.1	0	0	0	111	E1344	D1342-E1344 PolarHBondContact O-N 3.23Å
1343	P	29.6	Very low	27.1	Very low	122 Å²	122	156.7 Å²	156.7	79%	0.792	81%	0.81	S	S	*	*			trans	-77.6	116	-173.7	30.3	-31.1	0	0	0	110.2
1344	E	24.5	Very low	26.4	Very low	179 Å²	179	156.7 Å²	156.7	84%	0.836	81%	0.812	S	S	*	*			trans	-63.1	135	168.5	-79.8	-176.4	152.7	0	0	111	D1342 L1346	D1342-E1344 PolarHBondContact O-N 3.23Å; E1344-L1346 PolarHBondContact O-N 3.06Å
1345	P	25.7	Very low	26.5	Very low	101 Å²	101	156.5 Å²	156.5	66%	0.656	81%	0.81	S	S	*	*			trans	-78	114.9	-174.2	29.3	-32.5	0	0	0	111.8	F1347	P1345-F1347 HydrophobicContact CB-CE2 4.32Å; P1345-F1347 HydrophobicContact CG-CE2 4.08Å; P1345-F1347 WeakPolarHBondContact O-CD2 3.34Å; P1345-F1347 PolarHBondContact O-N 3.01Å
1346	L	24.5	Very low	26.9	Very low	149 Å²	149	153.2 Å²	153.2	78%	0.78	79%	0.787	S	S	*	*			trans	-73.6	104.9	170.8	-77.6	158.5	0	0	0	110.3	E1344 Y1348	E1344-L1346 PolarHBondContact O-N 3.06Å; L1346-Y1348 HydrophobicContact CB-CE2 4.42Å
1347	F	23.7	Very low	27.4	Very low	192 Å²	192	151.3 Å²	151.3	84%	0.842	77%	0.769	S	S	*	*			trans	-78.9	117.2	172.9	-77.1	-90.8	0	0	0	111	P1345	P1345-F1347 HydrophobicContact CB-CE2 4.32Å; P1345-F1347 HydrophobicContact CG-CE2 4.08Å; P1345-F1347 WeakPolarHBondContact O-CD2 3.34Å; P1345-F1347 PolarHBondContact O-N 3.01Å
1348	Y	23.2	Very low	27.4	Very low	194 Å²	194	150.5 Å²	150.5	76%	0.761	77%	0.766	S	S	*	*			trans	-112.6	141.7	166.2	-79.6	-81.2	0	0	0	110.8	L1346	L1346-Y1348 HydrophobicContact CB-CE2 4.42Å
1349	P	25.1	Very low	27.7	Very low	127 Å²	127	149.5 Å²	149.5	83%	0.825	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-76.8	137.1	-174.4	-7.7	25.3	0	0	0	112.7
1350	L	25.8	Very low	28.2	Very low	176 Å²	176	145.3 Å²	145.3	92%	0.921	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-68.4	128.8	-173.4	-71.6	148.1	0	0	0	113.3
1351	R	25.1	Very low	29	Very low	245 Å²	245	143.7 Å²	143.7	93%	0.925	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-90.8	125	157.5	-81.2	-172.3	177.1	-170.4	-1.2	109
1352	Q	26.2	Very low	30	Very low	178 Å²	178	139.5 Å²	139.5	83%	0.832	71%	0.708	S	S	*	*	S	Bend	trans	-62.6	150.1	171.2	-72.8	170.5	-21.1	0	0	110.7
1353	N	26	Very low	31.2	Very low	161 Å²	161	133 Å²	133	86%	0.861	67%	0.674	S	S	*	*	S	Bend	trans	97.6	68.8	177.5	-53.5	-19.6	0	0	0	115.8
1354	S	26.9	Very low	32.9	Very low	96 Å²	96	131.8 Å²	131.8	67%	0.671	66%	0.662	S	S	*	*			trans	163.6	86.1	148.8	162	0	0	0	0	108.2	I1356	S1354-I1356 VanDerWaalsContact C-N 3.3Å; S1354-I1356 PolarHBondContact O-N 2.96Å
1355	L	32.4	Very low	35	Very low	164 Å²	164	127.9 Å²	127.9	86%	0.859	64%	0.64	S	S	*	*			trans	-69.7	78.9	-179.4	-81	153.6	0	0	0	111.5
1356	I	34.4	Very low	37.4	Very low	67 Å²	67	124.7 Å²	124.7	34%	0.344	62%	0.617	S	S	.	*			trans	-107	112.2	158.9	-60.8	177.9	0	0	0	104.9	S1354 E1358 I1366	S1354-I1356 VanDerWaalsContact C-N 3.3Å; S1354-I1356 PolarHBondContact O-N 2.96Å; I1356-E1358 PolarHBondContact O-N 2.92Å; I1356-I1366 HydrophobicContact CG2-CD1 4.34Å; I1356-I1366 HydrophobicContact CG2-CG2 3.6Å
1357	L	35.8	Very low	40.2	Very low	59 Å²	59	119.3 Å²	119.3	31%	0.309	59%	0.587	S	S	.	*			trans	-60.7	104	-178.6	-86.4	96.3	0	0	0	110.6	Y1241 H1359	Y1241-L1357 HydrophobicContact CD1-CD1 4.45Å; Y1241-L1357 HydrophobicContact CG-CD1 3.94Å; L1357-H1359 HydrophobicContact CD2-CB 4.17Å; L1357-H1359 PolarHBondContact O-N 3.27Å
1358	E	30.8	Very low	43.2	Very low	159 Å²	159	114.1 Å²	114.1	74%	0.743	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	6.5	162.4	-78.3	-170.9	151	0	0	113	I1356 A1360 I1361	I1356-E1358 PolarHBondContact O-N 2.92Å; E1358-A1360 PolarHBondContact O-N 3.47Å; E1358-I1361 WeakPolarHBondContact O-CG1 3.36Å
1359	H	33.6	Very low	46.4	Very low	149 Å²	149	105.6 Å²	105.6	69%	0.69	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-6.6	174.8	-83	70.7	0	0	0	114.2	L1357 I1361	L1357-H1359 HydrophobicContact CD2-CB 4.17Å; L1357-H1359 PolarHBondContact O-N 3.27Å; H1359-I1361 PolarHBondContact O-N 3.41Å
1360	A	37.6	Very low	49.4	Very low	19 Å²	19	104.6 Å²	104.6	16%	0.157	52%	0.517	C	S	.	.			trans	-78.5	59	161.1	0	0	0	0	0	109.5	K1286 E1358 N1362 S1363	K1286-A1360 PolarHBondContact NZ-O 2.88Å; E1358-A1360 PolarHBondContact O-N 3.47Å; A1360-N1362 PolarHBondContact O-N 2.9Å; A1360-S1363 WeakPolarHBondContact CB-OG 3.48Å; A1360-S1363 PolarHBondContact O-N 3.43Å
1361	I	44	Very low	52.5	Low	131 Å²	131	98.9 Å²	98.9	67%	0.672	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-27	-176.2	-66.4	174.8	0	0	0	110.6	E1358 H1359	E1358-I1361 WeakPolarHBondContact O-CG1 3.36Å; H1359-I1361 PolarHBondContact O-N 3.41Å
1362	N	49.4	Very low	55.5	Low	108 Å²	108	90.5 Å²	90.5	58%	0.578	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-6.3	-178.3	-71.7	-11.1	0	0	0	116.3	R1227 I1229 A1360	R1227-N1362 PolarHBondContact NH1-O 3.31Å; I1229-N1362 HydrophobicContact CD1-CB 4.31Å; A1360-N1362 PolarHBondContact O-N 2.9Å
1363	S	52	Low	58.3	Low	16 Å²	16	83 Å²	83	11%	0.112	42%	0.424	C	S	.	.			trans	-84.4	137.8	173.9	72.9	0	0	0	0	110.4	K1286 A1360 Y1365	K1286-S1363 WeakPolarHBondContact CD-O 3.22Å; K1286-S1363 WeakPolarHBondContact CE-O 3.5Å; K1286-S1363 PolarHBondContact NZ-O 3.01Å; A1360-S1363 WeakPolarHBondContact CB-OG 3.48Å; A1360-S1363 PolarHBondContact O-N 3.43Å; S1363-Y1365 PolarHBondContact O-N 3.1Å; S1363-Y1365 PolarHBondContact OG-O 3.14Å
1364	N	64.2	Low	61.3	Low	98 Å²	98	81.6 Å²	81.6	52%	0.524	41%	0.406	S	S	.	.	S	Bend	trans	-74.5	-8	170.7	-75	-15.3	0	0	0	112.4	K1286	K1286-N1364 PolarHBondContact N-O 3.44Å
1365	Y	69.6	Low	64.2	Low	97 Å²	97	78.6 Å²	78.6	38%	0.38	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	140.2	-171.1	-59.3	-78.5	0	0	0	111.8	T1283 Y1284 Q1285 S1363	T1283-Y1365 HydrophobicContact CG2-CD1 3.84Å; T1283-Y1365 HydrophobicContact CG2-CG 4.04Å; Y1284-Y1365 CarbonylContact O-C 3.33Å; Y1284-Y1365 VanDerWaalsContact O-CA 3.23Å; Y1284-Y1365 WeakPolarHBondContact O-CA 3.5Å; Q1285-Y1365 HydrophobicContact CB-CD1 4.12Å; Q1285-Y1365 HydrophobicContact CB-CE1 3.98Å; Q1285-Y1365 HydrophobicContact CG-CD1 4.18Å; Q1285-Y1365 HydrophobicContact CG-CE1 3.78Å; S1363-Y1365 PolarHBondContact O-N 3.1Å; S1363-Y1365 PolarHBondContact OG-O 3.14Å
1366	I	75.6	Confident	66.8	Low	34 Å²	34	74.8 Å²	74.8	17%	0.174	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131.1	171.5	-60.9	172.9	0	0	0	107	T1283 Y1284 K1286 I1356	T1283-I1366 CarbonylContact C-O 3.58Å; T1283-I1366 WeakPolarHBondContact CA-O 3.27Å; Y1284-I1366 PolarHBondContact N-O 3.49Å; Y1284-I1366 PolarHBondContact O-N 3.05Å; K1286-I1366 HydrophobicContact CG-CD1 4.25Å; K1286-I1366 HydrophobicContact CG-CG1 4.14Å; I1356-I1366 HydrophobicContact CG2-CD1 4.34Å; I1356-I1366 HydrophobicContact CG2-CG2 3.6Å
1367	Y	82.9	Confident	69.2	Low	36 Å²	36	72.4 Å²	72.4	14%	0.141	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.9	-178.9	-60.8	-92	0	0	0	110.1	N1208 L1222 I1231 I1281 H1282 T1283	N1208-Y1367 HydrophobicContact CB-CD1 4.3Å; N1208-Y1367 HydrophobicContact CB-CE1 3.77Å; N1208-Y1367 WeakPolarHBondContact OD1-CE1 3.12Å; L1222-Y1367 HydrophobicContact CD2-CD1 4.43Å; L1222-Y1367 HydrophobicContact CD2-CG 4.45Å; I1231-Y1367 HydrophobicContact CD1-CE2 4.35Å; I1231-Y1367 HydrophobicContact CG2-CD2 3.37Å; I1231-Y1367 HydrophobicContact CG2-CE2 3.46Å; I1231-Y1367 VanDerWaalsContact CG2-CE2 3.46Å; I1231-Y1367 HydrophobicContact CG2-CG 4.37Å; I1281-Y1367 HydrophobicContact CG2-CD1 4.21Å; H1282-Y1367 CarbonylContact O-C 3.58Å; H1282-Y1367 WeakPolarHBondContact O-CA 3.24Å; T1283-Y1367 HydrophobicContact CG2-CD1 3.94Å; T1283-Y1367 HydrophobicContact CG2-CE1 3.53Å; T1283-Y1367 VanDerWaalsContact OG1-CD1 3.32Å; T1283-Y1367 WeakPolarHBondContact OG1-CD1 3.47Å; T1283-Y1367 WeakPolarHBondContact OG1-CE1 3.46Å
1368	E	86.3	Confident	71.5	Confident	83 Å²	83	70.1 Å²	70.1	39%	0.388	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.2	178.1	-178.2	176.5	-159.7	0	0	110.1	Y1241 I1281 H1282 Y1284	Y1241-E1368 VanDerWaalsContact OH-CA 3.25Å; Y1241-E1368 WeakPolarHBondContact OH-CA 3.5Å; I1281-E1368 CarbonylContact C-O 3.54Å; I1281-E1368 WeakPolarHBondContact CA-O 3.41Å; H1282-E1368 HydrophobicContact CB-CB 4.23Å; H1282-E1368 PolarHBondContact N-O 3.13Å; H1282-E1368 PolarHBondContact O-N 3.46Å; Y1284-E1368 HydrophobicContact CE2-CB 3.89Å; Y1284-E1368 VanDerWaalsContact CE2-OE2 3.24Å; Y1284-E1368 WeakPolarHBondContact CE2-OE2 3.39Å; Y1284-E1368 PolarHBondContact OH-OE2 2.87Å
1369	L	90.9	Very high	73.8	Confident	15 Å²	15	70.1 Å²	70.1	8%	0.079	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	107.8	-177.8	-78.6	160.1	0	0	0	107.4	W1211 L1232 F1234 Y1241 L1267 Y1279 I1281	W1211-L1369 HydrophobicContact CH2-CD1 4.19Å; W1211-L1369 HydrophobicContact CH2-CD2 4.06Å; L1232-L1369 HydrophobicContact CD1-CD1 4.34Å; L1232-L1369 HydrophobicContact CD2-CD1 4.43Å; F1234-L1369 HydrophobicContact CB-CD1 3.88Å; F1234-L1369 HydrophobicContact CD1-CD1 3.8Å; F1234-L1369 HydrophobicContact CD2-CD1 3.97Å; F1234-L1369 HydrophobicContact CE1-CD1 4.29Å; F1234-L1369 HydrophobicContact CE2-CB 4.36Å; F1234-L1369 HydrophobicContact CE2-CD1 4.44Å; F1234-L1369 HydrophobicContact CG-CD1 3.6Å; F1234-L1369 HydrophobicContact CZ-CB 4.31Å; Y1241-L1369 HydrophobicContact CE1-CD1 4.43Å; Y1241-L1369 PolarHBondContact OH-N 3.4Å; L1267-L1369 HydrophobicContact CD2-CD2 4.42Å; Y1279-L1369 HydrophobicContact CD1-CB 4.04Å; Y1279-L1369 HydrophobicContact CG-CD2 4.33Å; I1281-L1369 HydrophobicContact CG1-CD2 3.9Å
1370	Q	88.9	Confident	76.3	Confident	105 Å²	105	64 Å²	64	49%	0.491	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	115.7	175.7	-177.2	-178.8	-1.2	0	0	109.2	Y1279 Q1280 H1282 I1372	Y1279-Q1370 CarbonylContact C-O 3.49Å; Y1279-Q1370 WeakPolarHBondContact CA-O 3.43Å; Q1280-Q1370 PolarHBondContact N-O 2.99Å; Q1280-Q1370 PolarHBondContact O-N 3.39Å; H1282-Q1370 PolarHBondContact CE1-OE1 3.47Å; Q1370-I1372 PolarHBondContact O-N 3.35Å
1371	K	90.8	Very high	78.7	Confident	56 Å²	56	64.8 Å²	64.8	24%	0.243	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	122.6	174.5	-170.6	173.9	54	179.8	0	110.2	E1239 Y1279 R1374	E1239-K1371 VanDerWaalsContact CD-NZ 3.26Å; E1239-K1371 VanDerWaalsContact OE1-CE 3.28Å; E1239-K1371 WeakPolarHBondContact OE1-CE 3.4Å; E1239-K1371 IonicContact OE1-NZ 3.18Å; E1239-K1371 PolarHBondContact OE1-NZ 2.83Å; E1239-K1371 WeakPolarHBondContact OE2-CE 3.48Å; E1239-K1371 IonicContact OE2-NZ 3.5Å; Y1279-K1371 HydrophobicContact CD1-CB 3.83Å; Y1279-K1371 HydrophobicContact CD1-CG 4.48Å; Y1279-K1371 HydrophobicContact CE1-CB 3.56Å; Y1279-K1371 HydrophobicContact CE1-CD 4.42Å; Y1279-K1371 HydrophobicContact CE1-CG 4.11Å; K1371-R1374 HydrophobicContact CD-CB 4.39Å
1372	I	87.1	Confident	81	Confident	69 Å²	69	58.6 Å²	58.6	35%	0.354	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-28.9	179.7	54.6	165.8	0	0	0	112.7	V1278 Q1280 Q1370	V1278-I1372 HydrophobicContact CB-CD1 4.42Å; V1278-I1372 HydrophobicContact CB-CG1 4.02Å; V1278-I1372 HydrophobicContact CG1-CD1 3.84Å; V1278-I1372 HydrophobicContact CG1-CG1 3.92Å; V1278-I1372 VanDerWaalsContact O-CG1 3.23Å; V1278-I1372 WeakPolarHBondContact O-CG1 3.34Å; V1278-I1372 PolarHBondContact O-N 2.96Å; Q1280-I1372 HydrophobicContact CB-CD1 4.45Å; Q1280-I1372 HydrophobicContact CB-CG2 3.87Å; Q1370-I1372 PolarHBondContact O-N 3.35Å
1373	V	84.8	Confident	82.9	Confident	22 Å²	22	58 Å²	58	13%	0.133	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	136.5	178.3	-177.9	0	0	0	0	109.4	L1277 V1278 W1423	L1277-V1373 WeakPolarHBondContact CA-O 3.42Å; V1278-V1373 HydrophobicContact CB-CB 3.81Å; V1278-V1373 HydrophobicContact CB-CG2 4.15Å; V1278-V1373 HydrophobicContact CG2-CB 3.81Å; V1278-V1373 HydrophobicContact CG2-CG1 4.36Å; V1278-V1373 HydrophobicContact CG2-CG2 4.26Å; V1278-V1373 PolarHBondContact N-O 3.34Å; V1278-V1373 PolarHBondContact O-N 3.37Å; V1373-W1423 HydrophobicContact CG2-CB 4.37Å
1374	R	89.5	Confident	84.9	Confident	130 Å²	130	59.1 Å²	59.1	49%	0.491	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	111.9	163.1	173.1	172.7	-171.6	166	13.6	107	E1275 L1277 K1371	E1275-R1374 IonicContact OE1-CZ 3.88Å; E1275-R1374 VanDerWaalsContact OE1-CZ 3.29Å; E1275-R1374 IonicContact OE1-NE 2.52Å; E1275-R1374 PolarHBondContact OE1-NE 2.82Å; E1275-R1374 IonicContact OE1-NH2 3.54Å; E1275-R1374 PolarHBondContact OE1-NH2 3.05Å; E1275-R1374 IonicContact OE2-CZ 3.68Å; E1275-R1374 IonicContact OE2-NE 2.75Å; E1275-R1374 IonicContact OE2-NH2 3.28Å; E1275-R1374 PolarHBondContact OE2-NH2 3.36Å; E1275-R1374 VanDerWaalsContact OE2-NH2 3.17Å; L1277-R1374 HydrophobicContact CD2-CB 3.84Å; L1277-R1374 HydrophobicContact CD2-CG 3.56Å; K1371-R1374 HydrophobicContact CD-CB 4.39Å
1375	S	87.1	Confident	86.3	Confident	33 Å²	33	55 Å²	55	23%	0.231	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	119.7	-177.9	-170.4	0	0	0	0	109.6	E1275 V1276 V1377	E1275-S1375 CarbonylContact C-O 3.42Å; E1275-S1375 VanDerWaalsContact CA-O 3.28Å; E1275-S1375 WeakPolarHBondContact CA-O 3.47Å; V1276-S1375 PolarHBondContact N-O 2.99Å; V1276-S1375 PolarHBondContact O-N 3.08Å; S1375-V1377 PolarHBondContact O-N 2.95Å; S1375-V1377 VanDerWaalsContact OG-CG1 3.26Å; S1375-V1377 WeakPolarHBondContact OG-CG1 3.45Å
1376	K	87.1	Confident	87.3	Confident	85 Å²	85	51.6 Å²	51.6	37%	0.37	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	106.6	169.3	173.3	70.6	175.3	-179.4	0	106.8	M1273 E1275 A1378 E1379	M1273-K1376 WeakPolarHBondContact O-CD 3.45Å; M1273-K1376 WeakPolarHBondContact O-CE 3.21Å; M1273-K1376 PolarHBondContact O-NZ 3.4Å; E1275-K1376 HydrophobicContact CG-CB 4.22Å; E1275-K1376 HydrophobicContact CG-CD 3.99Å; K1376-A1378 WeakPolarHBondContact CD-O 3.49Å; K1376-A1378 WeakPolarHBondContact CE-O 3.36Å; K1376-A1378 PolarHBondContact NZ-O 3.43Å; K1376-E1379 WeakPolarHBondContact CE-OE1 3.38Å; K1376-E1379 VanDerWaalsContact CE-OE2 3.29Å; K1376-E1379 WeakPolarHBondContact CE-OE2 3.25Å; K1376-E1379 IonicContact NZ-OE1 3.87Å; K1376-E1379 IonicContact NZ-OE2 3.38Å; K1376-E1379 PolarHBondContact NZ-OE2 3.02Å
1377	V	84.4	Confident	88	Confident	17 Å²	17	52.6 Å²	52.6	10%	0.103	25%	0.249	C	C	.	.			trans	-113.4	-15	-172	-62.1	0	0	0	0	113.5	G1274 V1276 S1375 I1382 L1411 W1413	G1274-V1377 PolarHBondContact O-N 3.23Å; V1276-V1377 HydrophobicContact CG2-CG2 3.77Å; S1375-V1377 PolarHBondContact O-N 2.95Å; S1375-V1377 VanDerWaalsContact OG-CG1 3.26Å; S1375-V1377 WeakPolarHBondContact OG-CG1 3.45Å; V1377-I1382 HydrophobicContact CG2-CD1 3.57Å; V1377-L1411 HydrophobicContact CB-CD1 3.56Å; V1377-L1411 HydrophobicContact CG1-CD1 3.99Å; V1377-L1411 HydrophobicContact CG2-CD1 4.08Å; V1377-W1413 HydrophobicContact CG1-CH2 3.77Å; V1377-W1413 HydrophobicContact CG1-CZ2 3.74Å
1378	A	84.6	Confident	88.1	Confident	11 Å²	11	53.3 Å²	53.3	9%	0.091	25%	0.253	C	S	.	.			trans	-143.9	154.7	175.3	0	0	0	0	0	110.6	G1274 K1376 T1380 I1382	G1274-A1378 WeakPolarHBondContact CA-O 3.42Å; G1274-A1378 PolarHBondContact O-N 2.82Å; G1274-A1378 VanDerWaalsContact O-N 3.09Å; K1376-A1378 WeakPolarHBondContact CD-O 3.49Å; K1376-A1378 WeakPolarHBondContact CE-O 3.36Å; K1376-A1378 PolarHBondContact NZ-O 3.43Å; A1378-T1380 VanDerWaalsContact C-N 3.27Å; A1378-T1380 WeakPolarHBondContact CB-O 3.3Å; A1378-I1382 HydrophobicContact CB-CD1 4.04Å
1379	E	80	Confident	87.9	Confident	159 Å²	159	53.9 Å²	53.9	74%	0.743	25%	0.254	S	S	*	.	S	Bend	trans	-80.4	-15.5	167.3	-66.4	-53.8	152	0	0	112.8	K1376	K1376-E1379 WeakPolarHBondContact CE-OE1 3.38Å; K1376-E1379 VanDerWaalsContact CE-OE2 3.29Å; K1376-E1379 WeakPolarHBondContact CE-OE2 3.25Å; K1376-E1379 IonicContact NZ-OE1 3.87Å; K1376-E1379 IonicContact NZ-OE2 3.38Å; K1376-E1379 PolarHBondContact NZ-OE2 3.02Å
1380	T	85.3	Confident	87.2	Confident	21 Å²	21	55.9 Å²	55.9	13%	0.129	26%	0.264	C	S	.	.	S	Bend	trans	-106.1	156.5	179	67.2	0	0	0	0	110.9	G1274 A1378 I1382 S1401 T1402 Y1403 D1406	G1274-T1380 WeakPolarHBondContact CA-O 3.34Å; A1378-T1380 VanDerWaalsContact C-N 3.27Å; A1378-T1380 WeakPolarHBondContact CB-O 3.3Å; T1380-I1382 PolarHBondContact O-N 2.85Å; T1380-S1401 WeakPolarHBondContact OG1-CB 3.25Å; T1380-T1402 PolarHBondContact OG1-N 3.04Å; T1380-T1402 VanDerWaalsContact OG1-N 3.16Å; T1380-Y1403 HydrophobicContact CG2-CD2 3.71Å; T1380-Y1403 HydrophobicContact CG2-CE2 3.76Å; T1380-D1406 PolarHBondContact OG1-OD2 3.44Å
1381	P	88.3	Confident	86.4	Confident	35 Å²	35	54.1 Å²	54.1	23%	0.227	26%	0.261	C	S	.	.			trans	-51.5	139	179.3	-26.8	31.5	0	0	0	112.9	T1258 G1272 R1383 S1401 T1402	T1258-P1381 HydrophobicContact CG2-CB 4.3Å; G1272-P1381 WeakPolarHBondContact O-CG 3.38Å; P1381-R1383 PolarHBondContact O-N 2.98Å; P1381-S1401 CarbonylContact O-C 3.51Å; P1381-T1402 WeakPolarHBondContact CD-OG1 3.38Å; P1381-T1402 PolarHBondContact O-N 3.37Å; P1381-T1402 PolarHBondContact O-OG1 2.84Å
1382	I	91.8	Very high	85.3	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	29%	0.285	C	S	.	.			trans	-70.8	113.9	168.8	-54	-52.2	0	0	0	107.7	T1258 V1259 T1271 V1276 V1377 A1378 T1380 L1385 C1400	T1258-I1382 VanDerWaalsContact CB-O 3.26Å; T1258-I1382 WeakPolarHBondContact CB-O 3.39Å; T1258-I1382 PolarHBondContact OG1-O 2.88Å; V1259-I1382 HydrophobicContact CG1-CG2 3.95Å; T1271-I1382 PolarHBondContact O-N 3.44Å; V1276-I1382 HydrophobicContact CG2-CD1 4.24Å; V1276-I1382 HydrophobicContact CG2-CG1 3.98Å; V1276-I1382 HydrophobicContact CG2-CG2 4.4Å; V1377-I1382 HydrophobicContact CG2-CD1 3.57Å; A1378-I1382 HydrophobicContact CB-CD1 4.04Å; T1380-I1382 PolarHBondContact O-N 2.85Å; I1382-L1385 HydrophobicContact CG2-CD2 4.44Å; I1382-L1385 HydrophobicContact CG2-CG 4.3Å; I1382-C1400 CarbonylContact C-O 3.52Å
1383	R	89.7	Confident	84.3	Confident	94 Å²	94	60 Å²	60	36%	0.355	30%	0.304	S	S	.	.			trans	-88.9	-37.1	-177.8	-75.1	-168.1	69	96.1	4.5	113	I1024 P1381 C1400	I1024-R1383 WeakPolarHBondContact O-CD 3.36Å; I1024-R1383 PolarHBondContact O-NE 3.2Å; I1024-R1383 VanDerWaalsContact O-NE 3.16Å; P1381-R1383 PolarHBondContact O-N 2.98Å; R1383-C1400 PolarHBondContact N-O 3.44Å
1384	F	93.5	Very high	83.7	Confident	41 Å²	41	63.1 Å²	63.1	18%	0.18	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	141.8	-173.9	-54.7	-78	0	0	0	111.6	I1024 Q1025 I1027 S1399 C1400	I1024-F1384 HydrophobicContact CB-CE2 4.32Å; I1024-F1384 HydrophobicContact CG2-CD2 3.8Å; I1024-F1384 HydrophobicContact CG2-CE2 3.71Å; I1024-F1384 WeakPolarHBondContact O-CE2 3.35Å; Q1025-F1384 VanDerWaalsContact C-CZ 3.49Å; Q1025-F1384 WeakPolarHBondContact O-CZ 3.35Å; I1027-F1384 HydrophobicContact CG2-CB 3.4Å; I1027-F1384 VanDerWaalsContact CG2-CB 3.4Å; I1027-F1384 HydrophobicContact CG2-CD1 3.82Å; I1027-F1384 HydrophobicContact CG2-CD2 4.08Å; I1027-F1384 HydrophobicContact CG2-CG 3.48Å; I1027-F1384 VanDerWaalsContact CG2-CG 3.48Å; F1384-S1399 WeakPolarHBondContact O-CA 3.26Å; F1384-C1400 HydrophobicContact CB-CB 4.12Å; F1384-C1400 HydrophobicContact CD2-CB 4.11Å; F1384-C1400 PolarHBondContact N-O 3.44Å; F1384-C1400 PolarHBondContact O-N 3.44Å
1385	L	93.5	Very high	83.2	Confident	11 Å²	11	57.8 Å²	57.8	6%	0.058	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	118.3	165.1	-72.8	170.8	0	0	0	106	V1259 L1261 W1268 I1382 I1398	V1259-L1385 HydrophobicContact CG1-CB 4.32Å; V1259-L1385 HydrophobicContact CG1-CD1 3.79Å; V1259-L1385 HydrophobicContact CG1-CG 3.78Å; V1259-L1385 HydrophobicContact CG2-CB 4.1Å; V1259-L1385 HydrophobicContact CG2-CG 4.47Å; L1261-L1385 HydrophobicContact CB-CB 3.9Å; L1261-L1385 HydrophobicContact CB-CD1 4.41Å; L1261-L1385 HydrophobicContact CD2-CB 3.97Å; W1268-L1385 HydrophobicContact CB-CD1 3.99Å; I1382-L1385 HydrophobicContact CG2-CD2 4.44Å; I1382-L1385 HydrophobicContact CG2-CG 4.3Å; L1385-I1398 WeakPolarHBondContact CA-O 3.23Å
1386	V	91.8	Very high	83	Confident	26 Å²	26	56.4 Å²	56.4	16%	0.158	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	149.4	176.7	-68.3	0	0	0	0	109.7	I1027 F1029 I1397 I1398	I1027-V1386 HydrophobicContact CD1-CG2 3.67Å; I1027-V1386 HydrophobicContact CG1-CG2 3.98Å; I1027-V1386 HydrophobicContact CG2-CG1 3.75Å; I1027-V1386 HydrophobicContact CG2-CG2 4.4Å; F1029-V1386 HydrophobicContact CD2-CB 4.23Å; F1029-V1386 HydrophobicContact CD2-CG2 4.12Å; F1029-V1386 HydrophobicContact CE2-CB 4.09Å; F1029-V1386 HydrophobicContact CE2-CG2 3.67Å; V1386-I1397 WeakPolarHBondContact O-CA 3.49Å; V1386-I1398 HydrophobicContact CG2-CB 3.88Å; V1386-I1398 PolarHBondContact N-O 3.45Å; V1386-I1398 PolarHBondContact O-N 2.96Å
1387	M	89.8	Confident	83.1	Confident	54 Å²	54	52.3 Å²	52.3	27%	0.266	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	153.7	178.3	57.5	160.1	-69.2	0	0	112	L1261 Y1263 L1396 I1397	L1261-M1387 HydrophobicContact CD1-CG 4Å; L1261-M1387 HydrophobicContact CD1-SD 4.48Å; L1261-M1387 HydrophobicContact CD2-CB 3.98Å; L1261-M1387 HydrophobicContact CD2-CG 4.02Å; L1261-M1387 HydrophobicContact CG-CG 4.39Å; Y1263-M1387 HydrophobicContact CD2-CE 3.24Å; Y1263-M1387 HydrophobicContact CD2-SD 3.36Å; Y1263-M1387 WeakPolarHBondContact CD2-SD 3.32Å; Y1263-M1387 HydrophobicContact CE2-CE 3.52Å; Y1263-M1387 HydrophobicContact CE2-SD 4.26Å; Y1263-M1387 HydrophobicContact CG-CE 4.17Å; Y1263-M1387 HydrophobicContact CG-SD 3.86Å; M1387-L1396 CarbonylContact C-O 3.6Å; M1387-L1396 VanDerWaalsContact CA-O 3.23Å; M1387-L1396 WeakPolarHBondContact CA-O 3.13Å; M1387-I1397 HydrophobicContact CB-CG1 4.09Å
1388	K	85.2	Confident	83.5	Confident	51 Å²	51	51.5 Å²	51.5	22%	0.222	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	128.7	166.6	-166.3	72.5	173.9	-159.2	0	109	F1029 D1031 N1032 L1396	F1029-K1388 HydrophobicContact CB-CD 3.96Å; F1029-K1388 HydrophobicContact CD1-CB 3.86Å; F1029-K1388 HydrophobicContact CD1-CG 4.2Å; F1029-K1388 HydrophobicContact CD2-CB 3.92Å; F1029-K1388 HydrophobicContact CE1-CB 3.92Å; F1029-K1388 HydrophobicContact CE2-CB 3.97Å; F1029-K1388 HydrophobicContact CG-CB 3.86Å; F1029-K1388 HydrophobicContact CG-CD 4.2Å; F1029-K1388 HydrophobicContact CG-CG 4.28Å; F1029-K1388 HydrophobicContact CZ-CB 3.98Å; D1031-K1388 WeakPolarHBondContact O-CE 3.41Å; D1031-K1388 PolarHBondContact O-NZ 3.44Å; N1032-K1388 WeakPolarHBondContact OD1-CE 3.37Å; K1388-L1396 PolarHBondContact N-O 2.96Å; K1388-L1396 PolarHBondContact O-N 2.78Å
1389	K	81.2	Confident	83.9	Confident	96 Å²	96	51.1 Å²	51.1	42%	0.417	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	112.1	172.7	-172.2	177.7	176.2	-172.5	0	107.9	T1391 D1392	K1389-T1391 WeakPolarHBondContact CG-O 3.33Å; K1389-D1392 WeakPolarHBondContact CE-OD1 3.46Å; K1389-D1392 IonicContact NZ-OD1 2.68Å; K1389-D1392 PolarHBondContact NZ-OD1 3.36Å
1390	I	77.6	Confident	84.4	Confident	56 Å²	56	43.5 Å²	43.5	29%	0.287	23%	0.227	S	C	.	.			trans	-89.1	-46.6	-177.9	-60.7	172.6	0	0	0	109.6	H1394 L1396	I1390-H1394 PolarHBondContact N-O 3.29Å; I1390-L1396 HydrophobicContact CD1-CB 3.91Å; I1390-L1396 HydrophobicContact CD1-CD2 4.42Å; I1390-L1396 HydrophobicContact CG1-CB 4.47Å
1391	T	70.7	Confident	84.6	Confident	68 Å²	68	42.6 Å²	42.6	42%	0.417	22%	0.221	S	C	.	.	S	Bend	trans	-136.2	172.5	171.1	59.4	0	0	0	0	109.3	K1389 S1393 H1394	K1389-T1391 WeakPolarHBondContact CG-O 3.33Å; T1391-S1393 PolarHBondContact O-N 3.45Å; T1391-S1393 PolarHBondContact OG1-OG 3.23Å; T1391-H1394 PolarHBondContact N-O 2.85Å; T1391-H1394 VanDerWaalsContact N-O 3.1Å; T1391-H1394 PolarHBondContact O-N 2.89Å; T1391-H1394 WeakPolarHBondContact OG1-CB 3.34Å; T1391-H1394 PolarHBondContact OG1-N 3.27Å
1392	D	67.8	Low	84.4	Confident	140 Å²	140	41.6 Å²	41.6	75%	0.749	21%	0.214	S	C	*	.	S	Bend	trans	-57.9	-27.3	174	-72.6	-35.6	0	0	0	113.3	K1389	K1389-D1392 WeakPolarHBondContact CE-OD1 3.46Å; K1389-D1392 IonicContact NZ-OD1 2.68Å; K1389-D1392 PolarHBondContact NZ-OD1 3.36Å
1393	S	66.9	Low	83.9	Confident	108 Å²	108	45 Å²	45	76%	0.755	23%	0.228	S	C	*	.	S	Bend	trans	-100	-23.4	178.4	52.7	0	0	0	0	114.8	T1391	T1391-S1393 PolarHBondContact O-N 3.45Å; T1391-S1393 PolarHBondContact OG1-OG 3.23Å
1394	H	72.1	Confident	83.5	Confident	89 Å²	89	41.3 Å²	41.3	41%	0.412	21%	0.214	S	C	.	.			trans	-113.8	113.6	-172.4	-162.2	61.1	0	0	0	111.1	I1390 T1391	I1390-H1394 PolarHBondContact N-O 3.29Å; T1391-H1394 PolarHBondContact N-O 2.85Å; T1391-H1394 VanDerWaalsContact N-O 3.1Å; T1391-H1394 PolarHBondContact O-N 2.89Å; T1391-H1394 WeakPolarHBondContact OG1-CB 3.34Å; T1391-H1394 PolarHBondContact OG1-N 3.27Å
1395	I	78.3	Confident	82.5	Confident	18 Å²	18	42.4 Å²	42.4	9%	0.092	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.3	177.4	-55.5	119.7	0	0	0	108.3	Y1263 I1397	Y1263-I1395 HydrophobicContact CE1-CD1 3.41Å; Y1263-I1395 VanDerWaalsContact CE1-CD1 3.41Å; Y1263-I1395 HydrophobicContact CE1-CG1 3.82Å; Y1263-I1395 HydrophobicContact CE1-CG2 4.29Å; Y1263-I1395 HydrophobicContact CE2-CG1 4.33Å; Y1263-I1395 VanDerWaalsContact CZ-CD1 3.48Å; Y1263-I1395 WeakPolarHBondContact OH-CD1 3.48Å; Y1263-I1395 WeakPolarHBondContact OH-CG1 2.94Å; I1395-I1397 HydrophobicContact CG2-CG1 4.1Å
1396	L	83.4	Confident	81.6	Confident	3 Å²	3	44 Å²	44	2%	0.016	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.3	174.8	-177.5	73.5	0	0	0	108.8	F1029 V1052 M1387 K1388 I1390 I1398 K1412	F1029-L1396 HydrophobicContact CE1-CD2 3.47Å; F1029-L1396 VanDerWaalsContact CE1-CD2 3.47Å; F1029-L1396 HydrophobicContact CZ-CD2 3.46Å; F1029-L1396 VanDerWaalsContact CZ-CD2 3.46Å; F1029-L1396 HydrophobicContact CZ-CG 4.16Å; V1052-L1396 HydrophobicContact CB-CD2 3.86Å; V1052-L1396 HydrophobicContact CG1-CD1 3.37Å; V1052-L1396 HydrophobicContact CG1-CD2 3.24Å; V1052-L1396 HydrophobicContact CG1-CG 3.88Å; V1052-L1396 HydrophobicContact CG2-CD2 3.76Å; M1387-L1396 CarbonylContact C-O 3.6Å; M1387-L1396 VanDerWaalsContact CA-O 3.23Å; M1387-L1396 WeakPolarHBondContact CA-O 3.13Å; K1388-L1396 PolarHBondContact N-O 2.96Å; K1388-L1396 PolarHBondContact O-N 2.78Å; I1390-L1396 HydrophobicContact CD1-CB 3.91Å; I1390-L1396 HydrophobicContact CD1-CD2 4.42Å; I1390-L1396 HydrophobicContact CG1-CB 4.47Å; L1396-I1398 HydrophobicContact CD1-CD1 4.29Å; L1396-I1398 HydrophobicContact CG-CD1 4.27Å; L1396-K1412 HydrophobicContact CD1-CD 3.97Å; L1396-K1412 VanDerWaalsContact CD1-CE 3.48Å; L1396-K1412 HydrophobicContact CD1-CG 3.69Å
1397	I	89.5	Confident	80.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.2	173.5	-61.5	174.2	0	0	0	107.8	L1261 W1268 V1386 M1387 I1395 W1413 W1423	L1261-I1397 HydrophobicContact CD2-CG2 4.4Å; W1268-I1397 HydrophobicContact CD2-CD1 4.01Å; W1268-I1397 HydrophobicContact CE3-CG2 4.27Å; W1268-I1397 HydrophobicContact CH2-CD1 4.06Å; W1268-I1397 HydrophobicContact CZ2-CD1 3.44Å; W1268-I1397 VanDerWaalsContact CZ2-CD1 3.44Å; W1268-I1397 HydrophobicContact CZ3-CG2 4.34Å; V1386-I1397 WeakPolarHBondContact O-CA 3.49Å; M1387-I1397 HydrophobicContact CB-CG1 4.09Å; I1395-I1397 HydrophobicContact CG2-CG1 4.1Å; I1397-W1413 HydrophobicContact CB-CB 4.06Å; I1397-W1413 HydrophobicContact CG2-CB 4.45Å; I1397-W1413 WeakPolarHBondContact O-CB 3.21Å; I1397-W1413 PolarHBondContact O-N 2.82Å; I1397-W1423 HydrophobicContact CD1-CH2 3.89Å; I1397-W1423 HydrophobicContact CD1-CZ3 4.1Å
1398	I	92.3	Very high	79.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131.9	176	-55.4	-60.8	0	0	0	108.7	I1027 F1029 L1035 L1385 V1386 L1396 V1410 L1411 K1412 I1428	I1027-I1398 HydrophobicContact CD1-CG2 4.08Å; F1029-I1398 HydrophobicContact CE2-CG1 4.32Å; F1029-I1398 HydrophobicContact CZ-CG1 3.79Å; L1035-I1398 HydrophobicContact CD2-CB 4.47Å; L1035-I1398 HydrophobicContact CD2-CD1 4.4Å; L1035-I1398 HydrophobicContact CD2-CG1 3.68Å; L1385-I1398 WeakPolarHBondContact CA-O 3.23Å; V1386-I1398 HydrophobicContact CG2-CB 3.88Å; V1386-I1398 PolarHBondContact N-O 3.45Å; V1386-I1398 PolarHBondContact O-N 2.96Å; L1396-I1398 HydrophobicContact CD1-CD1 4.29Å; L1396-I1398 HydrophobicContact CG-CD1 4.27Å; I1398-V1410 HydrophobicContact CG2-CG1 3.59Å; I1398-L1411 VanDerWaalsContact CA-O 3.31Å; I1398-L1411 WeakPolarHBondContact CA-O 3.49Å; I1398-K1412 HydrophobicContact CD1-CB 3.8Å; I1398-K1412 HydrophobicContact CD1-CG 4.04Å; I1398-I1428 HydrophobicContact CD1-CD1 3.91Å
1399	S	92.7	Very high	79.4	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.014	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	139.4	170.5	66.5	0	0	0	0	110.9	F1384 V1410 L1411 W1413	F1384-S1399 WeakPolarHBondContact O-CA 3.26Å; S1399-V1410 WeakPolarHBondContact O-CA 3.44Å; S1399-L1411 PolarHBondContact N-O 2.92Å; S1399-L1411 PolarHBondContact O-N 3.19Å; S1399-W1413 PolarHBondContact OG-NE1 3.43Å
1400	C	91.5	Very high	79.7	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	133.6	176.2	-58	0	0	0	0	112.1	I1024 I1027 I1382 R1383 F1384 A1409	I1024-C1400 HydrophobicContact CD1-CB 3.92Å; I1024-C1400 HydrophobicContact CG2-CB 4.34Å; I1027-C1400 VanDerWaalsContact CD1-SG 3.58Å; I1382-C1400 CarbonylContact C-O 3.52Å; R1383-C1400 PolarHBondContact N-O 3.44Å; F1384-C1400 HydrophobicContact CB-CB 4.12Å; F1384-C1400 HydrophobicContact CD2-CB 4.11Å; F1384-C1400 PolarHBondContact N-O 3.44Å; F1384-C1400 PolarHBondContact O-N 3.44Å; C1400-A1409 CarbonylContact C-O 3.49Å; C1400-A1409 WeakPolarHBondContact CA-O 3.48Å
1401	S	88.8	Confident	80.3	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.007	20%	0.199	C	C	.	.			trans	-77.7	-170.4	169.7	85	0	0	0	0	111.1	T1380 P1381 D1406 A1409	T1380-S1401 WeakPolarHBondContact OG1-CB 3.25Å; P1381-S1401 CarbonylContact O-C 3.51Å; S1401-D1406 PolarHBondContact OG-OD2 3.49Å; S1401-A1409 PolarHBondContact N-O 2.86Å; S1401-A1409 WeakPolarHBondContact OG-CA 3.39Å
1402	T	83.5	Confident	81.2	Confident	15 Å²	15	34.6 Å²	34.6	9%	0.092	19%	0.185	C	C	.	.	S	Bend	trans	-77.7	-43	-176.7	-64.2	0	0	0	0	113.2	V1023 I1024 T1380 P1381	V1023-T1402 WeakPolarHBondContact CA-O 3.47Å; V1023-T1402 HydrophobicContact CG1-CG2 4.37Å; I1024-T1402 PolarHBondContact N-O 3.48Å; T1380-T1402 PolarHBondContact OG1-N 3.04Å; T1380-T1402 VanDerWaalsContact OG1-N 3.16Å; P1381-T1402 WeakPolarHBondContact CD-OG1 3.38Å; P1381-T1402 PolarHBondContact O-N 3.37Å; P1381-T1402 PolarHBondContact O-OG1 2.84Å
1403	Y	83.1	Confident	82.2	Confident	72 Å²	72	28 Å²	28	28%	0.282	15%	0.15	S	C	.	.	B	Isolated β-bridge	trans	-108.5	132.9	-173.2	-55	-66.4	0	0	0	111.1	Q1021 V1023 T1380 N1405 D1406 A1409	Q1021-Y1403 HydrophobicContact CB-CD1 3.6Å; Q1021-Y1403 HydrophobicContact CB-CE1 4.05Å; Q1021-Y1403 HydrophobicContact CB-CG 3.99Å; V1023-Y1403 HydrophobicContact CG2-CD1 3.86Å; V1023-Y1403 HydrophobicContact CG2-CE1 3.84Å; T1380-Y1403 HydrophobicContact CG2-CD2 3.71Å; T1380-Y1403 HydrophobicContact CG2-CE2 3.76Å; Y1403-N1405 PolarHBondContact O-N 3.05Å; Y1403-D1406 WeakPolarHBondContact O-CB 3.43Å; Y1403-D1406 PolarHBondContact O-N 3.17Å; Y1403-D1406 VanDerWaalsContact O-N 3.09Å; Y1403-A1409 VanDerWaalsContact O-CB 3.24Å; Y1403-A1409 WeakPolarHBondContact O-CB 3.34Å
1404	F	79.9	Confident	82.7	Confident	16 Å²	16	26.6 Å²	26.6	7%	0.07	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-29.1	179.3	-178.7	-94.1	0	0	0	113.1	A1022 I1024 Y1039 M1057 A1409	A1022-F1404 HydrophobicContact CB-CB 4.22Å; A1022-F1404 VanDerWaalsContact O-CB 3.29Å; A1022-F1404 WeakPolarHBondContact O-CB 3.34Å; A1022-F1404 PolarHBondContact O-N 3.43Å; I1024-F1404 HydrophobicContact CG1-CB 4.11Å; I1024-F1404 HydrophobicContact CG1-CD2 4.46Å; Y1039-F1404 AromaticContact CD1-CD2 3.61Å; Y1039-F1404 HydrophobicContact CD1-CD2 3.61Å; Y1039-F1404 AromaticContact CD1-CE2 3.44Å; Y1039-F1404 HydrophobicContact CD1-CE2 3.44Å; Y1039-F1404 VanDerWaalsContact CD1-CE2 3.44Å; Y1039-F1404 HydrophobicContact CD1-CG 4.4Å; Y1039-F1404 HydrophobicContact CD1-CZ 4.15Å; Y1039-F1404 HydrophobicContact CD2-CB 4.1Å; Y1039-F1404 AromaticContact CD2-CD1 3.83Å; Y1039-F1404 HydrophobicContact CD2-CD1 3.83Å; Y1039-F1404 AromaticContact CD2-CD2 3.65Å; Y1039-F1404 HydrophobicContact CD2-CD2 3.65Å; Y1039-F1404 HydrophobicContact CD2-CE1 4.11Å; Y1039-F1404 AromaticContact CD2-CE2 3.91Å; Y1039-F1404 HydrophobicContact CD2-CE2 3.91Å; Y1039-F1404 AromaticContact CD2-CG 3.58Å; Y1039-F1404 HydrophobicContact CD2-CG 3.58Å; Y1039-F1404 HydrophobicContact CD2-CZ 4.14Å; Y1039-F1404 HydrophobicContact CE1-CD2 4.16Å; Y1039-F1404 AromaticContact CE1-CE2 3.55Å; Y1039-F1404 HydrophobicContact CE1-CE2 3.55Å; Y1039-F1404 AromaticContact CE1-CZ 3.83Å; Y1039-F1404 HydrophobicContact CE1-CZ 3.83Å; Y1039-F1404 AromaticContact CE2-CD1 3.95Å; Y1039-F1404 HydrophobicContact CE2-CD1 3.95Å; Y1039-F1404 HydrophobicContact CE2-CD2 4.18Å; Y1039-F1404 AromaticContact CE2-CE1 3.79Å; Y1039-F1404 HydrophobicContact CE2-CE1 3.79Å; Y1039-F1404 AromaticContact CE2-CE2 3.99Å; Y1039-F1404 HydrophobicContact CE2-CE2 3.99Å; Y1039-F1404 HydrophobicContact CE2-CG 4.13Å; Y1039-F1404 AromaticContact CE2-CZ 3.8Å; Y1039-F1404 HydrophobicContact CE2-CZ 3.8Å; Y1039-F1404 HydrophobicContact CG-CB 4.22Å; Y1039-F1404 HydrophobicContact CG-CD1 4.4Å; Y1039-F1404 AromaticContact CG-CD2 3.35Å; Y1039-F1404 HydrophobicContact CG-CD2 3.35Å; Y1039-F1404 AromaticContact CG-CE2 3.65Å; Y1039-F1404 HydrophobicContact CG-CE2 3.65Å; Y1039-F1404 AromaticContact CG-CG 3.75Å; Y1039-F1404 HydrophobicContact CG-CG 3.75Å; Y1039-F1404 HydrophobicContact CG-CZ 4.31Å; Y1039-F1404 AromaticContact CZ-CE2 3.82Å; Y1039-F1404 AromaticContact CZ-CZ 3.63Å; M1057-F1404 HydrophobicContact CE-CD2 4.09Å; M1057-F1404 HydrophobicContact CE-CE1 4.35Å; M1057-F1404 HydrophobicContact CE-CE2 3.2Å; M1057-F1404 HydrophobicContact CE-CZ 3.36Å; M1057-F1404 HydrophobicContact SD-CE2 3.57Å; M1057-F1404 VanDerWaalsContact SD-CE2 3.57Å; M1057-F1404 HydrophobicContact SD-CZ 4.09Å; F1404-A1409 WeakPolarHBondContact O-CB 3.4Å
1405	N	73.5	Confident	82.9	Confident	65 Å²	65	28.7 Å²	28.7	35%	0.348	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	1.7	-179.8	-69.6	-31.7	0	0	0	113.6	Y1403 R1439	Y1403-N1405 PolarHBondContact O-N 3.05Å; N1405-R1439 PolarHBondContact OD1-NH1 2.81Å
1406	D	74.5	Confident	82.4	Confident	44 Å²	44	30 Å²	30	24%	0.235	14%	0.142	C	C	.	.	S	Bend	trans	-63.7	142.5	172.9	-72.1	-13.4	0	0	0	109.4	T1380 S1401 Y1403 D1408 A1409	T1380-D1406 PolarHBondContact OG1-OD2 3.44Å; S1401-D1406 PolarHBondContact OG-OD2 3.49Å; Y1403-D1406 WeakPolarHBondContact O-CB 3.43Å; Y1403-D1406 PolarHBondContact O-N 3.17Å; Y1403-D1406 VanDerWaalsContact O-N 3.09Å; D1406-D1408 PolarHBondContact O-N 3.43Å; D1406-D1408 VanDerWaalsContact O-N 3.14Å; D1406-A1409 HydrophobicContact CB-CB 4.02Å; D1406-A1409 VanDerWaalsContact O-CB 3.25Å; D1406-A1409 WeakPolarHBondContact O-CB 3.28Å; D1406-A1409 PolarHBondContact O-N 3.39Å
1407	D	67.9	Low	81.5	Confident	64 Å²	64	36.9 Å²	36.9	34%	0.342	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-32.3	-178.1	-90.4	-5.7	0	0	0	113.3	P1441 A1442 Y1443	D1407-P1441 HydrophobicContact CB-CB 3.89Å; D1407-P1441 WeakPolarHBondContact O-CG 3.49Å; D1407-A1442 PolarHBondContact OD1-N 2.85Å; D1407-A1442 WeakPolarHBondContact OD2-CA 3.24Å; D1407-A1442 WeakPolarHBondContact OD2-CB 3.45Å; D1407-A1442 PolarHBondContact OD2-N 3.26Å; D1407-Y1443 HydrophobicContact CB-CD1 4.05Å; D1407-Y1443 HydrophobicContact CB-CE1 4.11Å; D1407-Y1443 PolarHBondContact OD2-N 3.48Å
1408	D	71.7	Confident	80	Confident	46 Å²	46	43.8 Å²	43.8	25%	0.246	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	39.3	177.9	-62.8	-51.7	0	0	0	110.5	D1406 V1410 L1411 Y1443	D1406-D1408 PolarHBondContact O-N 3.43Å; D1406-D1408 VanDerWaalsContact O-N 3.14Å; D1408-V1410 PolarHBondContact O-N 3.2Å; D1408-L1411 HydrophobicContact CB-CD1 4.38Å; D1408-L1411 HydrophobicContact CB-CD2 3.92Å; D1408-L1411 HydrophobicContact CB-CG 4.3Å; D1408-Y1443 WeakPolarHBondContact OD1-CE1 3.29Å; D1408-Y1443 PolarHBondContact OD1-OH 2.86Å
1409	A	80.2	Confident	78.1	Confident	7 Å²	7	48.6 Å²	48.6	6%	0.058	24%	0.241	C	C	.	.	S	Bend	trans	-58	-35.3	-177	0	0	0	0	0	113.3	I1024 C1400 S1401 Y1403 F1404 D1406	I1024-A1409 HydrophobicContact CD1-CB 4.33Å; C1400-A1409 CarbonylContact C-O 3.49Å; C1400-A1409 WeakPolarHBondContact CA-O 3.48Å; S1401-A1409 PolarHBondContact N-O 2.86Å; S1401-A1409 WeakPolarHBondContact OG-CA 3.39Å; Y1403-A1409 VanDerWaalsContact O-CB 3.24Å; Y1403-A1409 WeakPolarHBondContact O-CB 3.34Å; F1404-A1409 WeakPolarHBondContact O-CB 3.4Å; D1406-A1409 HydrophobicContact CB-CB 4.02Å; D1406-A1409 VanDerWaalsContact O-CB 3.25Å; D1406-A1409 WeakPolarHBondContact O-CB 3.28Å; D1406-A1409 PolarHBondContact O-N 3.39Å
1410	V	88.2	Confident	76.2	Confident	5 Å²	5	50 Å²	50	3%	0.03	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	115.5	-178	-172.6	0	0	0	0	108.9	I1024 I1037 I1398 S1399 D1408 I1428	I1024-V1410 HydrophobicContact CD1-CG2 4.13Å; I1037-V1410 HydrophobicContact CD1-CG1 4.03Å; I1037-V1410 HydrophobicContact CD1-CG2 3.69Å; I1398-V1410 HydrophobicContact CG2-CG1 3.59Å; S1399-V1410 WeakPolarHBondContact O-CA 3.44Å; D1408-V1410 PolarHBondContact O-N 3.2Å; V1410-I1428 HydrophobicContact CB-CB 4.28Å; V1410-I1428 HydrophobicContact CG1-CB 4.15Å; V1410-I1428 HydrophobicContact CG1-CD1 3.83Å; V1410-I1428 HydrophobicContact CG1-CG1 4.17Å; V1410-I1428 PolarHBondContact O-N 2.97Å
1411	L	89.7	Confident	74.6	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.016	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132	-179.1	-63.3	177.8	0	0	0	110.9	V1377 I1398 S1399 D1408 N1425 P1427	V1377-L1411 HydrophobicContact CB-CD1 3.56Å; V1377-L1411 HydrophobicContact CG1-CD1 3.99Å; V1377-L1411 HydrophobicContact CG2-CD1 4.08Å; I1398-L1411 VanDerWaalsContact CA-O 3.31Å; I1398-L1411 WeakPolarHBondContact CA-O 3.49Å; S1399-L1411 PolarHBondContact N-O 2.92Å; S1399-L1411 PolarHBondContact O-N 3.19Å; D1408-L1411 HydrophobicContact CB-CD1 4.38Å; D1408-L1411 HydrophobicContact CB-CD2 3.92Å; D1408-L1411 HydrophobicContact CB-CG 4.3Å; L1411-N1425 HydrophobicContact CB-CB 4.3Å; L1411-N1425 HydrophobicContact CD1-CB 4.43Å; L1411-P1427 HydrophobicContact CD2-CB 4.05Å
1412	K	89.1	Confident	73.6	Confident	29 Å²	29	58.1 Å²	58.1	13%	0.126	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	122.2	170.7	175.8	179.1	-180	-179.9	0	110	V1052 N1055 L1396 I1398 N1425 E1426 I1428	V1052-K1412 HydrophobicContact CG1-CD 3.83Å; V1052-K1412 HydrophobicContact CG1-CG 4.49Å; V1052-K1412 PolarHBondContact O-NZ 3.05Å; N1055-K1412 WeakPolarHBondContact OD1-CD 3.46Å; N1055-K1412 PolarHBondContact OD1-NZ 2.9Å; L1396-K1412 HydrophobicContact CD1-CD 3.97Å; L1396-K1412 VanDerWaalsContact CD1-CE 3.48Å; L1396-K1412 HydrophobicContact CD1-CG 3.69Å; I1398-K1412 HydrophobicContact CD1-CB 3.8Å; I1398-K1412 HydrophobicContact CD1-CG 4.04Å; K1412-N1425 CarbonylContact O-C 3.59Å; K1412-N1425 WeakPolarHBondContact O-CA 3.33Å; K1412-E1426 PolarHBondContact N-O 3.16Å; K1412-E1426 PolarHBondContact O-N 3.41Å; K1412-I1428 HydrophobicContact CB-CD1 4.27Å; K1412-I1428 HydrophobicContact CB-CG1 4.16Å
1413	W	88.7	Confident	73.3	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.008	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.3	176.8	-62.9	79.4	0	0	0	110.4	W1268 V1276 V1377 I1397 S1399 W1423 T1424 N1425	W1268-W1413 HydrophobicContact CH2-CB 4.25Å; W1268-W1413 HydrophobicContact CH2-CD2 4.15Å; W1268-W1413 HydrophobicContact CH2-CE3 4.01Å; W1268-W1413 HydrophobicContact CH2-CG 4.28Å; W1268-W1413 HydrophobicContact CZ3-CB 4.46Å; W1268-W1413 AromaticContact CZ3-CD2 3.77Å; W1268-W1413 HydrophobicContact CZ3-CD2 3.77Å; W1268-W1413 AromaticContact CZ3-CE3 3.88Å; W1268-W1413 HydrophobicContact CZ3-CE3 3.88Å; W1268-W1413 HydrophobicContact CZ3-CG 4.04Å; W1268-W1413 HydrophobicContact CZ3-CZ3 4.41Å; V1276-W1413 HydrophobicContact CB-CH2 4.14Å; V1276-W1413 HydrophobicContact CB-CZ2 3.89Å; V1276-W1413 HydrophobicContact CG1-CH2 4.25Å; V1276-W1413 HydrophobicContact CG1-CZ2 4.01Å; V1276-W1413 HydrophobicContact CG2-CZ2 3.9Å; V1377-W1413 HydrophobicContact CG1-CH2 3.77Å; V1377-W1413 HydrophobicContact CG1-CZ2 3.74Å; I1397-W1413 HydrophobicContact CB-CB 4.06Å; I1397-W1413 HydrophobicContact CG2-CB 4.45Å; I1397-W1413 WeakPolarHBondContact O-CB 3.21Å; I1397-W1413 PolarHBondContact O-N 2.82Å; S1399-W1413 PolarHBondContact OG-NE1 3.43Å; W1413-W1423 HydrophobicContact CB-CE3 4.19Å; W1413-W1423 HydrophobicContact CB-CZ3 4.49Å; W1413-W1423 HydrophobicContact CE3-CB 4.22Å; W1413-T1424 WeakPolarHBondContact CA-O 3.19Å; W1413-N1425 HydrophobicContact CD2-CB 3.88Å; W1413-N1425 HydrophobicContact CE3-CB 3.95Å; W1413-N1425 HydrophobicContact CG-CB 4.4Å; W1413-N1425 HydrophobicContact CH2-CB 4.34Å; W1413-N1425 WeakPolarHBondContact CH2-ND2 3.22Å; W1413-N1425 HydrophobicContact CZ2-CB 4.26Å; W1413-N1425 HydrophobicContact CZ3-CB 4.19Å
1414	K	79	Confident	73.1	Confident	77 Å²	77	57.6 Å²	57.6	34%	0.335	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	145	175.7	68.2	-177.6	-174.3	176.4	0	110.2	T1424 E1426	K1414-T1424 WeakPolarHBondContact CE-OG1 3.35Å; K1414-T1424 VanDerWaalsContact CG-OG1 3.24Å; K1414-T1424 WeakPolarHBondContact CG-OG1 3.38Å; K1414-T1424 PolarHBondContact N-O 2.97Å; K1414-T1424 PolarHBondContact O-N 3.36Å; K1414-T1424 PolarHBondContact O-OG1 3.42Å; K1414-E1426 VanDerWaalsContact CE-OE1 3.28Å; K1414-E1426 WeakPolarHBondContact CE-OE1 3.49Å; K1414-E1426 IonicContact NZ-OE1 2.6Å; K1414-E1426 PolarHBondContact NZ-OE1 3.21Å
1415	R	75.2	Confident	73.3	Confident	133 Å²	133	59.7 Å²	59.7	50%	0.502	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	128.1	173.4	-166.5	173.2	177.1	177.1	-0.7	108.7	N1417 G1420 W1423	R1415-N1417 PolarHBondContact O-N 3.19Å; R1415-G1420 PolarHBondContact NE-O 3.24Å; R1415-G1420 PolarHBondContact NH2-O 3.4Å; R1415-W1423 HydrophobicContact CB-CD2 4.42Å; R1415-W1423 HydrophobicContact CB-CE3 4.27Å; R1415-W1423 HydrophobicContact CB-CH2 4.29Å; R1415-W1423 HydrophobicContact CB-CZ2 4.41Å; R1415-W1423 HydrophobicContact CB-CZ3 4.21Å
1416	D	68.3	Low	73.8	Confident	46 Å²	46	59.4 Å²	59.4	25%	0.246	32%	0.315	C	S	.	.			trans	-70.9	115.2	175.5	-179	8.6	0	0	0	109.8	N1418 N1419 G1420 I1422	D1416-N1418 PolarHBondContact O-N 2.78Å; D1416-N1418 PolarHBondContact OD1-N 3.21Å; D1416-N1418 VanDerWaalsContact OD1-N 3.07Å; D1416-N1419 PolarHBondContact O-N 2.84Å; D1416-G1420 PolarHBondContact O-N 3.34Å; D1416-G1420 VanDerWaalsContact O-N 3.07Å; D1416-I1422 PolarHBondContact N-O 3.46Å
1417	N	64	Low	74.3	Confident	148 Å²	148	58 Å²	58	79%	0.791	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.3	-178.9	-72.2	-14	0	0	0	112.6	R1415	R1415-N1417 PolarHBondContact O-N 3.19Å
1418	N	58.4	Low	75.1	Confident	145 Å²	145	55.6 Å²	55.6	78%	0.775	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-31.5	-175	-68.2	-20.3	0	0	0	113.1	D1416	D1416-N1418 PolarHBondContact O-N 2.78Å; D1416-N1418 PolarHBondContact OD1-N 3.21Å; D1416-N1418 VanDerWaalsContact OD1-N 3.07Å
1419	N	53.2	Low	75.6	Confident	101 Å²	101	56.3 Å²	56.3	54%	0.54	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-3.5	-176.6	-78.1	-29.5	0	0	0	114.1	D1416 S1421 I1422	D1416-N1419 PolarHBondContact O-N 2.84Å; N1419-S1421 PolarHBondContact O-N 2.96Å; N1419-I1422 HydrophobicContact CB-CD1 3.88Å; N1419-I1422 HydrophobicContact CB-CG1 4.16Å
1420	G	52.5	Low	75.5	Confident	30 Å²	30	57.7 Å²	57.7	31%	0.309	30%	0.302	S	S	.	.	S	Bend	trans	66.3	-26.6	169.3	0	0	0	0	0	116.3	R1415 D1416	R1415-G1420 PolarHBondContact NE-O 3.24Å; R1415-G1420 PolarHBondContact NH2-O 3.4Å; D1416-G1420 PolarHBondContact O-N 3.34Å; D1416-G1420 VanDerWaalsContact O-N 3.07Å
1421	S	57.4	Low	75.1	Confident	87 Å²	87	60.2 Å²	60.2	61%	0.608	31%	0.313	S	S	*	.	S	Bend	trans	-123.6	-8.6	-170.7	-52.4	0	0	0	0	113.3	N1419	N1419-S1421 PolarHBondContact O-N 2.96Å
1422	I	66.8	Low	74.3	Confident	86 Å²	86	63.2 Å²	63.2	44%	0.441	33%	0.329	S	S	.	.			trans	-98.5	119.3	-173.4	-55.5	178	0	0	0	109.2	D1416 N1419 T1424	D1416-I1422 PolarHBondContact N-O 3.46Å; N1419-I1422 HydrophobicContact CB-CD1 3.88Å; N1419-I1422 HydrophobicContact CB-CG1 4.16Å; I1422-T1424 HydrophobicContact CG2-CG2 4.43Å
1423	W	77.5	Confident	73.2	Confident	26 Å²	26	68 Å²	68	10%	0.098	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	132.5	169	-71.5	91.2	0	0	0	109.4	W1268 V1373 I1397 W1413 R1415	W1268-W1423 HydrophobicContact CH2-CB 4.24Å; W1268-W1423 AromaticContact CH2-CD2 3.6Å; W1268-W1423 HydrophobicContact CH2-CD2 3.6Å; W1268-W1423 AromaticContact CH2-CE3 3.69Å; W1268-W1423 HydrophobicContact CH2-CE3 3.69Å; W1268-W1423 AromaticContact CH2-CG 3.83Å; W1268-W1423 HydrophobicContact CH2-CG 3.83Å; W1268-W1423 HydrophobicContact CH2-CZ3 4.24Å; W1268-W1423 AromaticContact CZ2-CD2 3.5Å; W1268-W1423 HydrophobicContact CZ2-CD2 3.5Å; W1268-W1423 VanDerWaalsContact CZ2-CD2 3.5Å; W1268-W1423 AromaticContact CZ2-CE2 3.49Å; W1268-W1423 VanDerWaalsContact CZ2-CE2 3.49Å; W1268-W1423 AromaticContact CZ2-CE3 3.79Å; W1268-W1423 HydrophobicContact CZ2-CE3 3.79Å; W1268-W1423 AromaticContact CZ2-CG 3.96Å; W1268-W1423 HydrophobicContact CZ2-CG 3.96Å; W1268-W1423 HydrophobicContact CZ2-CH2 4.03Å; W1268-W1423 AromaticContact CZ2-CZ2 3.78Å; W1268-W1423 HydrophobicContact CZ2-CZ2 3.78Å; W1268-W1423 HydrophobicContact CZ2-CZ3 4.04Å; W1268-W1423 AromaticContact CZ2-NE1 3.89Å; V1373-W1423 HydrophobicContact CG2-CB 4.37Å; I1397-W1423 HydrophobicContact CD1-CH2 3.89Å; I1397-W1423 HydrophobicContact CD1-CZ3 4.1Å; W1413-W1423 HydrophobicContact CB-CE3 4.19Å; W1413-W1423 HydrophobicContact CB-CZ3 4.49Å; W1413-W1423 HydrophobicContact CE3-CB 4.22Å; R1415-W1423 HydrophobicContact CB-CD2 4.42Å; R1415-W1423 HydrophobicContact CB-CE3 4.27Å; R1415-W1423 HydrophobicContact CB-CH2 4.29Å; R1415-W1423 HydrophobicContact CB-CZ2 4.41Å; R1415-W1423 HydrophobicContact CB-CZ3 4.21Å
1424	T	78.6	Confident	72.2	Confident	50 Å²	50	76.6 Å²	76.6	31%	0.307	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	155.2	173.3	56.7	0	0	0	0	108.8	W1413 K1414 I1422	W1413-T1424 WeakPolarHBondContact CA-O 3.19Å; K1414-T1424 WeakPolarHBondContact CE-OG1 3.35Å; K1414-T1424 VanDerWaalsContact CG-OG1 3.24Å; K1414-T1424 WeakPolarHBondContact CG-OG1 3.38Å; K1414-T1424 PolarHBondContact N-O 2.97Å; K1414-T1424 PolarHBondContact O-N 3.36Å; K1414-T1424 PolarHBondContact O-OG1 3.42Å; I1422-T1424 HydrophobicContact CG2-CG2 4.43Å
1425	N	85	Confident	71.8	Confident	60 Å²	60	75.8 Å²	75.8	32%	0.321	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	151.9	175.7	59.4	61.6	0	0	0	111.4	L1411 K1412 W1413	L1411-N1425 HydrophobicContact CB-CB 4.3Å; L1411-N1425 HydrophobicContact CD1-CB 4.43Å; K1412-N1425 CarbonylContact O-C 3.59Å; K1412-N1425 WeakPolarHBondContact O-CA 3.33Å; W1413-N1425 HydrophobicContact CD2-CB 3.88Å; W1413-N1425 HydrophobicContact CE3-CB 3.95Å; W1413-N1425 HydrophobicContact CG-CB 4.4Å; W1413-N1425 HydrophobicContact CH2-CB 4.34Å; W1413-N1425 WeakPolarHBondContact CH2-ND2 3.22Å; W1413-N1425 HydrophobicContact CZ2-CB 4.26Å; W1413-N1425 HydrophobicContact CZ3-CB 4.19Å
1426	E	84.4	Confident	71.5	Confident	59 Å²	59	76.8 Å²	76.8	28%	0.276	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.1	174.2	-65.1	-177.7	165.6	0	0	108.9	N1055 K1412 K1414	N1055-E1426 PolarHBondContact ND2-OE2 3.36Å; K1412-E1426 PolarHBondContact N-O 3.16Å; K1412-E1426 PolarHBondContact O-N 3.41Å; K1414-E1426 VanDerWaalsContact CE-OE1 3.28Å; K1414-E1426 WeakPolarHBondContact CE-OE1 3.49Å; K1414-E1426 IonicContact NZ-OE1 2.6Å; K1414-E1426 PolarHBondContact NZ-OE1 3.21Å
1427	P	85	Confident	71.7	Confident	15 Å²	15	77.3 Å²	77.3	10%	0.097	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	142.4	175.7	29.7	-34.2	0	0	0	111.4	L1411 Y1429 M1444	L1411-P1427 HydrophobicContact CD2-CB 4.05Å; P1427-Y1429 HydrophobicContact CG-CE1 4.03Å; P1427-M1444 HydrophobicContact CG-CE 3.85Å
1428	I	84.1	Confident	72	Confident	13 Å²	13	74.7 Å²	74.7	7%	0.067	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-90.2	122.4	170.2	-60.2	-167.7	0	0	0	108.5	V1050 M1057 I1398 V1410 K1412	V1050-I1428 HydrophobicContact CG1-CD1 3.53Å; V1050-I1428 HydrophobicContact CG1-CG2 3.8Å; V1050-I1428 HydrophobicContact CG2-CG2 4.46Å; M1057-I1428 HydrophobicContact CB-CG2 4.07Å; I1398-I1428 HydrophobicContact CD1-CD1 3.91Å; V1410-I1428 HydrophobicContact CB-CB 4.28Å; V1410-I1428 HydrophobicContact CG1-CB 4.15Å; V1410-I1428 HydrophobicContact CG1-CD1 3.83Å; V1410-I1428 HydrophobicContact CG1-CG1 4.17Å; V1410-I1428 PolarHBondContact O-N 2.97Å; K1412-I1428 HydrophobicContact CB-CD1 4.27Å; K1412-I1428 HydrophobicContact CB-CG1 4.16Å
1429	Y	82	Confident	72.5	Confident	61 Å²	61	74 Å²	74	24%	0.239	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	140.6	-173.3	-58.6	-69.9	0	0	0	112	N1055 C1056 M1057 P1427 F1431 L1440 P1441 M1444	N1055-Y1429 PolarHBondContact O-N 2.72Å; C1056-Y1429 CarbonylContact C-O 3.57Å; C1056-Y1429 VanDerWaalsContact CA-O 3.32Å; C1056-Y1429 WeakPolarHBondContact CA-O 3.43Å; M1057-Y1429 PolarHBondContact N-O 2.88Å; P1427-Y1429 HydrophobicContact CG-CE1 4.03Å; Y1429-F1431 PolarHBondContact O-N 3.06Å; Y1429-L1440 HydrophobicContact CD1-CD2 4.13Å; Y1429-L1440 HydrophobicContact CE1-CD2 3.91Å; Y1429-P1441 HydrophobicContact CE1-CG 4.42Å; Y1429-M1444 HydrophobicContact CE1-CE 4.45Å; Y1429-M1444 HydrophobicContact CE1-SD 3.92Å; Y1429-M1444 WeakPolarHBondContact OH-CE 3.48Å
1430	V	79.1	Confident	73.1	Confident	35 Å²	35	71.7 Å²	71.7	21%	0.212	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	119.9	173	-168.4	0	0	0	0	109.2	M1057 R1439	M1057-V1430 HydrophobicContact CE-CG2 3.56Å; V1430-R1439 HydrophobicContact CB-CB 4.18Å; V1430-R1439 PolarHBondContact O-N 3.46Å
1431	F	78.6	Confident	73.7	Confident	59 Å²	59	70.8 Å²	70.8	26%	0.259	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	114.4	172.2	-178.1	-97.7	0	0	0	109.5	M1057 Q1058 Y1429 R1433 L1438	M1057-F1431 PolarHBondContact O-N 3.13Å; Q1058-F1431 HydrophobicContact CG-CD1 4.48Å; Y1429-F1431 PolarHBondContact O-N 3.06Å; F1431-R1433 HydrophobicContact CE1-CG 4.42Å; F1431-L1438 HydrophobicContact CB-CD2 4.4Å; F1431-L1438 HydrophobicContact CD2-CD2 4.32Å; F1431-L1438 HydrophobicContact CD2-CG 4.36Å
1432	D	72.8	Confident	73.9	Confident	66 Å²	66	68 Å²	68	35%	0.353	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	118.7	174.7	176.2	17.1	0	0	0	109.9	E1434 S1435 H1436 S1437	D1432-E1434 VanDerWaalsContact C-N 3.32Å; D1432-E1434 PolarHBondContact O-N 3.44Å; D1432-E1434 PolarHBondContact OD1-N 3.34Å; D1432-S1435 WeakPolarHBondContact CB-OG 3.47Å; D1432-S1435 VanDerWaalsContact CG-OG 3.22Å; D1432-S1435 VanDerWaalsContact OD2-CB 3.3Å; D1432-S1435 WeakPolarHBondContact OD2-CB 3.45Å; D1432-S1435 PolarHBondContact OD2-N 3.11Å; D1432-S1435 PolarHBondContact OD2-OG 2.68Å; D1432-H1436 WeakPolarHBondContact O-CA 3.38Å; D1432-H1436 PolarHBondContact O-N 2.92Å; D1432-H1436 VanDerWaalsContact O-N 3.09Å; D1432-S1437 PolarHBondContact N-O 2.87Å; D1432-S1437 PolarHBondContact O-N 2.97Å
1433	R	67.5	Low	73.7	Confident	129 Å²	129	68.5 Å²	68.5	49%	0.487	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-35.7	179.8	-81.7	-173.5	176.4	167.2	7.7	112	Q1058 F1431	Q1058-R1433 VanDerWaalsContact CD-NH2 3.3Å; Q1058-R1433 HydrophobicContact CG-CG 4.1Å; F1431-R1433 HydrophobicContact CE1-CG 4.42Å
1434	E	66.4	Low	73.2	Confident	182 Å²	182	69.5 Å²	69.5	85%	0.85	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-44	-173	-65.9	-173.7	172.6	0	0	111.7	D1432 H1436	D1432-E1434 VanDerWaalsContact C-N 3.32Å; D1432-E1434 PolarHBondContact O-N 3.44Å; D1432-E1434 PolarHBondContact OD1-N 3.34Å; E1434-H1436 VanDerWaalsContact C-N 3.34Å
1435	S	70.2	Confident	72.5	Confident	61 Å²	61	72.9 Å²	72.9	43%	0.427	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-5.6	177.8	63.1	0	0	0	0	114	D1432 S1437	D1432-S1435 WeakPolarHBondContact CB-OG 3.47Å; D1432-S1435 VanDerWaalsContact CG-OG 3.22Å; D1432-S1435 VanDerWaalsContact OD2-CB 3.3Å; D1432-S1435 WeakPolarHBondContact OD2-CB 3.45Å; D1432-S1435 PolarHBondContact OD2-N 3.11Å; D1432-S1435 PolarHBondContact OD2-OG 2.68Å; S1435-S1437 PolarHBondContact O-N 3.34Å; S1435-S1437 VanDerWaalsContact O-N 3.14Å; S1435-S1437 PolarHBondContact OG-OG 3.44Å
1436	H	68.9	Low	71.5	Confident	153 Å²	153	75 Å²	75	71%	0.708	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	36.9	-169.1	-72.3	-68.7	0	0	0	112.6	D1432 E1434	D1432-H1436 WeakPolarHBondContact O-CA 3.38Å; D1432-H1436 PolarHBondContact O-N 2.92Å; D1432-H1436 VanDerWaalsContact O-N 3.09Å; E1434-H1436 VanDerWaalsContact C-N 3.34Å
1437	S	72.9	Confident	70.5	Confident	57 Å²	57	75 Å²	75	40%	0.399	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	150.1	-172.9	80.7	0	0	0	0	112.5	D1432 S1435	D1432-S1437 PolarHBondContact N-O 2.87Å; D1432-S1437 PolarHBondContact O-N 2.97Å; S1435-S1437 PolarHBondContact O-N 3.34Å; S1435-S1437 VanDerWaalsContact O-N 3.14Å; S1435-S1437 PolarHBondContact OG-OG 3.44Å
1438	L	70.9	Confident	69.4	Low	94 Å²	94	78 Å²	78	49%	0.492	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121.7	173.3	-75.3	156.1	0	0	0	109.1	F1431 L1440	F1431-L1438 HydrophobicContact CB-CD2 4.4Å; F1431-L1438 HydrophobicContact CD2-CD2 4.32Å; F1431-L1438 HydrophobicContact CD2-CG 4.36Å; L1438-L1440 PolarHBondContact O-N 3.38Å; L1438-L1440 VanDerWaalsContact O-N 3.15Å
1439	R	69.1	Low	68.2	Low	130 Å²	130	81 Å²	81	49%	0.491	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	102.9	172.9	-168.2	179	-177.6	-172.3	-1.3	109	N1405 V1430	N1405-R1439 PolarHBondContact OD1-NH1 2.81Å; V1430-R1439 HydrophobicContact CB-CB 4.18Å; V1430-R1439 PolarHBondContact O-N 3.46Å
1440	L	65.9	Low	67.2	Low	53 Å²	53	83.4 Å²	83.4	28%	0.277	42%	0.419	S	S	.	.			trans	-76.8	143	176.7	-67.8	173	0	0	0	111.6	Y1429 L1438 M1444 R1445 L1448	Y1429-L1440 HydrophobicContact CD1-CD2 4.13Å; Y1429-L1440 HydrophobicContact CE1-CD2 3.91Å; L1438-L1440 PolarHBondContact O-N 3.38Å; L1438-L1440 VanDerWaalsContact O-N 3.15Å; L1440-M1444 HydrophobicContact CB-CB 4.39Å; L1440-M1444 HydrophobicContact CD2-SD 4.38Å; L1440-R1445 HydrophobicContact CB-CG 3.83Å; L1440-R1445 PolarHBondContact O-NE 3.38Å; L1440-L1448 HydrophobicContact CD1-CD1 4.1Å
1441	P	64.5	Low	66.3	Low	10 Å²	10	87.2 Å²	87.2	7%	0.065	44%	0.435	C	S	.	.			trans	-52.3	147.6	169.1	-26.1	34.6	0	0	0	112	D1407 Y1429 Y1443 M1444 R1445	D1407-P1441 HydrophobicContact CB-CB 3.89Å; D1407-P1441 WeakPolarHBondContact O-CG 3.49Å; Y1429-P1441 HydrophobicContact CE1-CG 4.42Å; P1441-Y1443 VanDerWaalsContact C-N 3.29Å; P1441-Y1443 HydrophobicContact CB-CD1 3.58Å; P1441-Y1443 HydrophobicContact CB-CE1 3.26Å; P1441-Y1443 HydrophobicContact CB-CG 4.41Å; P1441-Y1443 HydrophobicContact CG-CE1 3.96Å; P1441-Y1443 PolarHBondContact O-N 2.88Å; P1441-M1444 HydrophobicContact CB-CG 4.44Å; P1441-M1444 HydrophobicContact CG-CG 4.47Å; P1441-M1444 HydrophobicContact CG-SD 4.47Å; P1441-M1444 PolarHBondContact O-N 3.49Å; P1441-R1445 PolarHBondContact O-N 3.34Å
1442	A	61.2	Low	65.4	Low	30 Å²	30	89.9 Å²	89.9	25%	0.248	45%	0.45	C	S	.	.	H	α-helix	trans	-59	-37.7	-176.9	0	0	0	0	0	112.4	D1407 M1444 R1445 N1446	D1407-A1442 PolarHBondContact OD1-N 2.85Å; D1407-A1442 WeakPolarHBondContact OD2-CA 3.24Å; D1407-A1442 WeakPolarHBondContact OD2-CB 3.45Å; D1407-A1442 PolarHBondContact OD2-N 3.26Å; A1442-M1444 VanDerWaalsContact C-N 3.35Å; A1442-M1444 PolarHBondContact O-N 3.31Å; A1442-R1445 PolarHBondContact O-N 3.04Å; A1442-N1446 WeakPolarHBondContact O-CB 3.32Å; A1442-N1446 VanDerWaalsContact O-CG 3.27Å; A1442-N1446 PolarHBondContact O-N 3.48Å; A1442-N1446 PolarHBondContact O-ND2 2.98Å
1443	Y	64	Low	64.6	Low	95 Å²	95	93.1 Å²	93.1	37%	0.373	46%	0.462	S	S	.	.	H	α-helix	trans	-62.9	-38.1	174.5	69.5	-93	0	0	0	113	D1407 D1408 P1441 N1446 S1447	D1407-Y1443 HydrophobicContact CB-CD1 4.05Å; D1407-Y1443 HydrophobicContact CB-CE1 4.11Å; D1407-Y1443 PolarHBondContact OD2-N 3.48Å; D1408-Y1443 WeakPolarHBondContact OD1-CE1 3.29Å; D1408-Y1443 PolarHBondContact OD1-OH 2.86Å; P1441-Y1443 VanDerWaalsContact C-N 3.29Å; P1441-Y1443 HydrophobicContact CB-CD1 3.58Å; P1441-Y1443 HydrophobicContact CB-CE1 3.26Å; P1441-Y1443 HydrophobicContact CB-CG 4.41Å; P1441-Y1443 HydrophobicContact CG-CE1 3.96Å; P1441-Y1443 PolarHBondContact O-N 2.88Å; Y1443-N1446 PolarHBondContact O-N 3.43Å; Y1443-S1447 PolarHBondContact O-N 3.5Å
1444	M	66.8	Low	64	Low	47 Å²	47	91.6 Å²	91.6	23%	0.232	46%	0.464	C	S	.	.	H	α-helix	trans	-69.6	-41.6	174.5	-69.1	-163.3	178.9	0	0	111.2	P1427 Y1429 L1440 P1441 A1442 N1446 S1447 L1448	P1427-M1444 HydrophobicContact CG-CE 3.85Å; Y1429-M1444 HydrophobicContact CE1-CE 4.45Å; Y1429-M1444 HydrophobicContact CE1-SD 3.92Å; Y1429-M1444 WeakPolarHBondContact OH-CE 3.48Å; L1440-M1444 HydrophobicContact CB-CB 4.39Å; L1440-M1444 HydrophobicContact CD2-SD 4.38Å; P1441-M1444 HydrophobicContact CB-CG 4.44Å; P1441-M1444 HydrophobicContact CG-CG 4.47Å; P1441-M1444 HydrophobicContact CG-SD 4.47Å; P1441-M1444 PolarHBondContact O-N 3.49Å; A1442-M1444 VanDerWaalsContact C-N 3.35Å; A1442-M1444 PolarHBondContact O-N 3.31Å; M1444-N1446 VanDerWaalsContact C-N 3.31Å; M1444-N1446 PolarHBondContact O-N 2.9Å; M1444-S1447 PolarHBondContact O-N 2.86Å; M1444-L1448 WeakPolarHBondContact O-CB 3.31Å; M1444-L1448 PolarHBondContact O-N 3.49Å
1445	R	64.5	Low	63.4	Low	121 Å²	121	89.8 Å²	89.8	46%	0.457	45%	0.453	S	S	.	.	H	α-helix	trans	-58.3	-43	174.7	-74.1	-173.8	-84	156	1.8	111.5	L1440 P1441 A1442 L1448 C1449	L1440-R1445 HydrophobicContact CB-CG 3.83Å; L1440-R1445 PolarHBondContact O-NE 3.38Å; P1441-R1445 PolarHBondContact O-N 3.34Å; A1442-R1445 PolarHBondContact O-N 3.04Å; R1445-L1448 PolarHBondContact O-N 2.99Å; R1445-C1449 VanDerWaalsContact O-CB 3.3Å; R1445-C1449 WeakPolarHBondContact O-CB 3.36Å; R1445-C1449 PolarHBondContact O-N 3.17Å
1446	N	62.8	Low	62.6	Low	104 Å²	104	93.8 Å²	93.8	56%	0.556	46%	0.463	S	S	*	.	H	α-helix	trans	-65	-44.2	177.1	-71.7	-20.4	0	0	0	111.9	A1442 Y1443 M1444 C1449 L1450	A1442-N1446 WeakPolarHBondContact O-CB 3.32Å; A1442-N1446 VanDerWaalsContact O-CG 3.27Å; A1442-N1446 PolarHBondContact O-N 3.48Å; A1442-N1446 PolarHBondContact O-ND2 2.98Å; Y1443-N1446 PolarHBondContact O-N 3.43Å; M1444-N1446 VanDerWaalsContact C-N 3.31Å; M1444-N1446 PolarHBondContact O-N 2.9Å; N1446-C1449 PolarHBondContact O-N 3.05Å; N1446-L1450 WeakPolarHBondContact O-CB 3.45Å; N1446-L1450 WeakPolarHBondContact O-CD1 3.48Å; N1446-L1450 WeakPolarHBondContact O-CG 3.45Å; N1446-L1450 PolarHBondContact O-N 3.36Å
1447	S	63.1	Low	61.6	Low	61 Å²	61	89.1 Å²	89.1	43%	0.427	45%	0.448	S	S	.	.	H	α-helix	trans	-63.7	-42.6	176	-173.3	0	0	0	0	112.3	Y1443 M1444 L1450 Q1451	Y1443-S1447 PolarHBondContact O-N 3.5Å; M1444-S1447 PolarHBondContact O-N 2.86Å; S1447-L1450 WeakPolarHBondContact O-CB 3.32Å; S1447-L1450 PolarHBondContact O-N 2.95Å; S1447-Q1451 WeakPolarHBondContact O-CG 3.35Å; S1447-Q1451 PolarHBondContact O-N 3.41Å
1448	L	61.4	Low	60.5	Low	78 Å²	78	91.1 Å²	91.1	41%	0.408	45%	0.453	S	S	.	.	H	α-helix	trans	-66.1	-40.3	175.7	-119.5	122.2	0	0	0	111.7	L1440 M1444 R1445 Q1451 M1452	L1440-L1448 HydrophobicContact CD1-CD1 4.1Å; M1444-L1448 WeakPolarHBondContact O-CB 3.31Å; M1444-L1448 PolarHBondContact O-N 3.49Å; R1445-L1448 PolarHBondContact O-N 2.99Å; L1448-Q1451 PolarHBondContact O-N 2.91Å; L1448-M1452 HydrophobicContact CD2-CE 4.16Å; L1448-M1452 VanDerWaalsContact O-CB 3.24Å; L1448-M1452 WeakPolarHBondContact O-CB 3.32Å; L1448-M1452 WeakPolarHBondContact O-CG 3.34Å; L1448-M1452 PolarHBondContact O-N 2.92Å
1449	C	59.4	Low	59.5	Low	75 Å²	75	92.4 Å²	92.4	51%	0.507	46%	0.459	S	S	.	.	H	α-helix	trans	-62.1	-42.1	172.8	-88	0	0	0	0	111.7	R1445 N1446 M1452 H1453	R1445-C1449 VanDerWaalsContact O-CB 3.3Å; R1445-C1449 WeakPolarHBondContact O-CB 3.36Å; R1445-C1449 PolarHBondContact O-N 3.17Å; N1446-C1449 PolarHBondContact O-N 3.05Å; C1449-M1452 PolarHBondContact O-N 2.89Å; C1449-H1453 WeakPolarHBondContact O-CB 3.42Å; C1449-H1453 PolarHBondContact O-N 3.42Å
1450	L	60.7	Low	58.5	Low	111 Å²	111	94.2 Å²	94.2	58%	0.581	48%	0.475	S	S	*	.	H	α-helix	trans	-63.4	-43.6	173.9	-84.7	153.8	0	0	0	111.7	N1446 S1447 H1453 N1454	N1446-L1450 WeakPolarHBondContact O-CB 3.45Å; N1446-L1450 WeakPolarHBondContact O-CD1 3.48Å; N1446-L1450 WeakPolarHBondContact O-CG 3.45Å; N1446-L1450 PolarHBondContact O-N 3.36Å; S1447-L1450 WeakPolarHBondContact O-CB 3.32Å; S1447-L1450 PolarHBondContact O-N 2.95Å; L1450-H1453 PolarHBondContact O-N 3.32Å; L1450-N1454 WeakPolarHBondContact O-CB 3.48Å; L1450-N1454 VanDerWaalsContact O-CG 3.28Å; L1450-N1454 PolarHBondContact O-N 3.46Å
1451	Q	61.5	Low	57.6	Low	116 Å²	116	98.2 Å²	98.2	54%	0.542	50%	0.497	S	S	.	.	H	α-helix	trans	-67.1	-37.9	175.3	-74.8	-174.5	-1.8	0	0	112.7	S1447 L1448 N1454 K1455	S1447-Q1451 WeakPolarHBondContact O-CG 3.35Å; S1447-Q1451 PolarHBondContact O-N 3.41Å; L1448-Q1451 PolarHBondContact O-N 2.91Å; Q1451-N1454 PolarHBondContact O-N 3.19Å; Q1451-K1455 WeakPolarHBondContact O-CB 3.47Å; Q1451-K1455 WeakPolarHBondContact O-CG 3.07Å; Q1451-K1455 PolarHBondContact O-N 2.83Å
1452	M	59	Low	56.1	Low	114 Å²	114	106.4 Å²	106.4	56%	0.562	54%	0.54	S	S	*	.	H	α-helix	trans	-67.4	-40.1	174.3	-75.4	-104.7	-167.3	0	0	111.2	L1448 C1449 K1455 K1456	L1448-M1452 HydrophobicContact CD2-CE 4.16Å; L1448-M1452 VanDerWaalsContact O-CB 3.24Å; L1448-M1452 WeakPolarHBondContact O-CB 3.32Å; L1448-M1452 WeakPolarHBondContact O-CG 3.34Å; L1448-M1452 PolarHBondContact O-N 2.92Å; C1449-M1452 PolarHBondContact O-N 2.89Å; M1452-K1455 PolarHBondContact O-N 3.29Å; M1452-K1456 WeakPolarHBondContact O-CB 3.3Å; M1452-K1456 PolarHBondContact O-N 3.09Å
1453	H	57	Low	55.9	Low	135 Å²	135	110.3 Å²	110.3	63%	0.625	56%	0.555	S	S	*	*	H	α-helix	trans	-65.7	-41.9	172.8	-101.5	-71.1	0	0	0	111.6	C1449 L1450 K1456 S1457	C1449-H1453 WeakPolarHBondContact O-CB 3.42Å; C1449-H1453 PolarHBondContact O-N 3.42Å; L1450-H1453 PolarHBondContact O-N 3.32Å; H1453-K1456 PolarHBondContact O-N 3.08Å; H1453-S1457 VanDerWaalsContact O-CB 3.29Å; H1453-S1457 WeakPolarHBondContact O-CB 3.5Å; H1453-S1457 PolarHBondContact O-N 2.9Å
1454	N	54.8	Low	55.5	Low	97 Å²	97	111.1 Å²	111.1	52%	0.519	56%	0.564	S	S	.	*	H	α-helix	trans	-64.7	-42.1	174.1	-76.4	-14.6	0	0	0	111.3	L1450 Q1451 S1457 I1458	L1450-N1454 WeakPolarHBondContact O-CB 3.48Å; L1450-N1454 VanDerWaalsContact O-CG 3.28Å; L1450-N1454 PolarHBondContact O-N 3.46Å; Q1451-N1454 PolarHBondContact O-N 3.19Å; N1454-S1457 PolarHBondContact O-N 3.39Å; N1454-I1458 WeakPolarHBondContact O-CB 3.45Å; N1454-I1458 WeakPolarHBondContact O-CD1 3.31Å; N1454-I1458 WeakPolarHBondContact O-CG1 3.36Å; N1454-I1458 PolarHBondContact O-N 2.96Å
1455	K	53.6	Low	54.8	Low	143 Å²	143	114.6 Å²	114.6	62%	0.622	58%	0.583	S	S	*	*	H	α-helix	trans	-64.3	-42.8	173.5	-83.4	-176.7	175.2	179	0	112.2	Q1451 M1452 S1457 I1458 I1459	Q1451-K1455 WeakPolarHBondContact O-CB 3.47Å; Q1451-K1455 WeakPolarHBondContact O-CG 3.07Å; Q1451-K1455 PolarHBondContact O-N 2.83Å; M1452-K1455 PolarHBondContact O-N 3.29Å; K1455-S1457 VanDerWaalsContact C-N 3.34Å; K1455-I1458 PolarHBondContact O-N 3.44Å; K1455-I1459 WeakPolarHBondContact O-CB 3.27Å; K1455-I1459 WeakPolarHBondContact O-CD1 3.42Å; K1455-I1459 WeakPolarHBondContact O-CG1 3.44Å; K1455-I1459 PolarHBondContact O-N 3.39Å
1456	K	51.9	Low	54.3	Low	145 Å²	145	114.2 Å²	114.2	63%	0.63	59%	0.59	S	S	*	*	H	α-helix	trans	-64.1	-37.6	174	-83.9	-174.8	175	-179.5	0	112	M1452 H1453 I1459 M1460	M1452-K1456 WeakPolarHBondContact O-CB 3.3Å; M1452-K1456 PolarHBondContact O-N 3.09Å; H1453-K1456 PolarHBondContact O-N 3.08Å; K1456-I1459 PolarHBondContact O-N 3.12Å; K1456-M1460 WeakPolarHBondContact O-CB 3.46Å; K1456-M1460 WeakPolarHBondContact O-CG 3.26Å; K1456-M1460 PolarHBondContact O-N 3.01Å
1457	S	49.8	Very low	53.7	Low	56 Å²	56	114.9 Å²	114.9	39%	0.392	59%	0.592	S	S	.	*	H	α-helix	trans	-65.9	-40.6	173.3	166.9	0	0	0	0	111.7	H1453 N1454 K1455 I1459 M1460 N1461	H1453-S1457 VanDerWaalsContact O-CB 3.29Å; H1453-S1457 WeakPolarHBondContact O-CB 3.5Å; H1453-S1457 PolarHBondContact O-N 2.9Å; N1454-S1457 PolarHBondContact O-N 3.39Å; K1455-S1457 VanDerWaalsContact C-N 3.34Å; S1457-I1459 VanDerWaalsContact C-N 3.33Å; S1457-M1460 PolarHBondContact O-N 3.39Å; S1457-N1461 VanDerWaalsContact O-CB 3.3Å; S1457-N1461 WeakPolarHBondContact O-CB 3.45Å; S1457-N1461 PolarHBondContact O-N 3.5Å
1458	I	49.2	Very low	53.1	Low	98 Å²	98	118.5 Å²	118.5	50%	0.503	60%	0.603	S	S	.	*	H	α-helix	trans	-67.4	-35.4	175.3	-67.5	161.4	0	0	0	110.9	N1454 K1455 N1462	N1454-I1458 WeakPolarHBondContact O-CB 3.45Å; N1454-I1458 WeakPolarHBondContact O-CD1 3.31Å; N1454-I1458 WeakPolarHBondContact O-CG1 3.36Å; N1454-I1458 PolarHBondContact O-N 2.96Å; K1455-I1458 PolarHBondContact O-N 3.44Å; I1458-N1462 WeakPolarHBondContact O-CB 3.43Å; I1458-N1462 PolarHBondContact O-N 2.88Å; I1458-N1462 VanDerWaalsContact O-N 3.16Å; I1458-N1462 PolarHBondContact O-ND2 3.02Å
1459	I	50.1	Low	52.5	Low	122 Å²	122	121.4 Å²	121.4	63%	0.626	62%	0.617	S	S	*	*	H	α-helix	trans	-76.9	-26.8	176.5	-65.9	164.2	0	0	0	112.3	K1455 K1456 S1457	K1455-I1459 WeakPolarHBondContact O-CB 3.27Å; K1455-I1459 WeakPolarHBondContact O-CD1 3.42Å; K1455-I1459 WeakPolarHBondContact O-CG1 3.44Å; K1455-I1459 PolarHBondContact O-N 3.39Å; K1456-I1459 PolarHBondContact O-N 3.12Å; S1457-I1459 VanDerWaalsContact C-N 3.33Å
1460	M	47.4	Very low	52	Low	167 Å²	167	124.9 Å²	124.9	82%	0.823	63%	0.626	S	S	*	*	H	α-helix	trans	-85.8	-20.5	174.3	-77.7	-109.5	-82.2	0	0	113.3	K1456 S1457	K1456-M1460 WeakPolarHBondContact O-CB 3.46Å; K1456-M1460 WeakPolarHBondContact O-CG 3.26Å; K1456-M1460 PolarHBondContact O-N 3.01Å; S1457-M1460 PolarHBondContact O-N 3.39Å
1461	N	46.5	Very low	51.3	Low	138 Å²	138	126.1 Å²	126.1	74%	0.738	63%	0.629	S	S	*	*	H	α-helix	trans	-92.1	-11.4	174.2	-79.5	-12.5	0	0	0	113.6	S1457	S1457-N1461 VanDerWaalsContact O-CB 3.3Å; S1457-N1461 WeakPolarHBondContact O-CB 3.45Å; S1457-N1461 PolarHBondContact O-N 3.5Å
1462	N	34.5	Very low	50.3	Low	182 Å²	182	127 Å²	127	97%	0.973	64%	0.637	S	S	*	*			trans	-97	0	166.6	-76.3	-21.9	0	0	0	109.4	I1458	I1458-N1462 WeakPolarHBondContact O-CB 3.43Å; I1458-N1462 PolarHBondContact O-N 2.88Å; I1458-N1462 VanDerWaalsContact O-N 3.16Å; I1458-N1462 PolarHBondContact O-ND2 3.02Å

Retrieved 1,462 of 1,462 residues in 1677.3 ms (Link to these results)

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