A0A087X9A6_POEFO Loading...

GDNF inducible zinc finger protein 1

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A087X9A6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 817 aa.

						>A0A087X9A6_POEFO|A0A087X9A6
MGIKVIQLTSKSHHENLLASLHQMRMQGQLCDVTIQVNYQEEVEEFQAHQLILAASSGYFQKILLSQDANRAKLQLSNMHSSDFSKYLEFVYTGKIEVARNKIGDVQEVARLLDCEGLSVVCSDALSAGVLERPKSKTCDSKVKDGGGELPGAEKVDAKKQPLKRQLSSQSPKKQDRKKKLKAKTFQRKTTNQVKKLKLKLAGRKVLQRRLRYSLKDDPKDKNQANESEDRTGEDSEPENEEDLSEEQENIEGRASDNLDFEEDAQSNDPQDSLYVDEEEEEDDEDEEGQSEEEVKRISKAQFSCNKCQRTFHYEKSYLKHISTYHGVKAHVIHRCETCMQTFANSSNLKIHEKHVHSNERLFACDSCSKTFKRKKDVVRHKRQVHERNMRHVCAECGKSLSSRAALLLHERTHTGLKPYECTVCGAKFTQNSALKMHHRTHTGEKPYACDLCDSRFSQRHMLAYHKRSHTGEKPFMCESCGKSFASKEYLRHHSNIHTGSKPYKCEHCGRGFAQRNSLNQHLKIHTGERPYSCKSCDKHFTQLNALQRHQRIHTGEKPYMCGLCKRTFTDKSTLRRHTMIHGSDVPWKTYLVVLEGNVEEKKPKSPTKEKGGSEEKRSTASKSSSSPVPTVHAVDDADKSSTETVVVPTEPVTLPADWARHGAITLVSHGGVGAIAVIHTEVPPGTQIQPIGTSAITLDGSAIAVPFSIPVSVAQTLSSEAPSGSLSVPTLSVPVSETLLASDISTTSLLEAAAAQAVLAPPSENNPTSESDKMHPDIETVIVGEGLHGKEQEQLLDDGQNKTADEAETTKDQSSV
					

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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	27.3	Very low	33.7	Very low	236 Å²	236	104.4 Å²	104.4	100%	1.163	56%	0.558	S	S	*	*				0	120.3	0	-69.8	-58.1	-143.1	0	0	108.2	I3	M1-I3 PolarHBondContact O-N 3.08Å
2	G	31.3	Very low	33.8	Very low	77 Å²	77	101.4 Å²	101.4	79%	0.794	55%	0.552	S	S	*	*			trans	-77.1	116.5	-170	0	0	0	0	0	113.4	K4	G2-K4 VanDerWaalsContact C-N 3.35Å; G2-K4 PolarHBondContact O-N 3Å
3	I	30.6	Very low	34.3	Very low	142 Å²	142	106.7 Å²	106.7	73%	0.728	57%	0.57	S	S	*	*			trans	-69.9	94.8	164.5	-56.6	174.7	0	0	0	106.8	M1 V5	M1-I3 PolarHBondContact O-N 3.08Å; I3-V5 VanDerWaalsContact C-N 3.28Å; I3-V5 HydrophobicContact CG2-CG2 4.11Å; I3-V5 PolarHBondContact O-N 2.63Å
4	K	31.2	Very low	35.4	Very low	142 Å²	142	102.1 Å²	102.1	62%	0.617	54%	0.543	S	S	*	.			trans	-74	86.8	171.3	-75.1	-167.9	175.8	-175.8	0	108.8	G2 R100	G2-K4 VanDerWaalsContact C-N 3.35Å; G2-K4 PolarHBondContact O-N 3Å; K4-R100 VanDerWaalsContact CB-NE 3.34Å; K4-R100 WeakPolarHBondContact O-CD 3.49Å; K4-R100 VanDerWaalsContact O-CG 3.3Å; K4-R100 WeakPolarHBondContact O-CG 3.42Å; K4-R100 PolarHBondContact O-NE 2.84Å
5	V	35.4	Very low	35.8	Very low	67 Å²	67	107.1 Å²	107.1	41%	0.406	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-53.1	149.1	170	-177.2	0	0	0	0	110.4	I3 E97	I3-V5 VanDerWaalsContact C-N 3.28Å; I3-V5 HydrophobicContact CG2-CG2 4.11Å; I3-V5 PolarHBondContact O-N 2.63Å; V5-E97 HydrophobicContact CG1-CB 3.6Å; V5-E97 HydrophobicContact CG1-CG 3.96Å; V5-E97 WeakPolarHBondContact CG1-OE2 3.2Å
6	I	36.4	Very low	36.3	Very low	32 Å²	32	108.1 Å²	108.1	16%	0.164	57%	0.568	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.1	127.6	163.9	-66.3	-175.6	0	0	0	107.8	L8 V98 R100 I103	I6-L8 HydrophobicContact CG2-CD2 4.06Å; I6-V98 PolarHBondContact O-N 3.16Å; I6-R100 HydrophobicContact CD1-CG 3.66Å; I6-R100 HydrophobicContact CG1-CG 3.78Å; I6-I103 HydrophobicContact CB-CD1 4.39Å; I6-I103 HydrophobicContact CD1-CD1 4.06Å
7	Q	34.7	Very low	37	Very low	99 Å²	99	103.5 Å²	103.5	46%	0.463	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	113.3	179.9	179.8	162.8	110.1	0	0	109.2	T9 K95 E97	Q7-T9 HydrophobicContact CG-CG2 4.22Å; Q7-K95 HydrophobicContact CG-CD 4.19Å; Q7-E97 PolarHBondContact NE2-OE1 2.95Å; Q7-E97 VanDerWaalsContact NE2-OE1 3.12Å
8	L	35.9	Very low	37.7	Very low	21 Å²	21	99.9 Å²	99.9	11%	0.11	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.3	176.7	-56	178	0	0	0	109.6	I6 I96 V98 V121 A125	I6-L8 HydrophobicContact CG2-CD2 4.06Å; L8-I96 WeakPolarHBondContact CB-O 3.3Å; L8-I96 PolarHBondContact N-O 3.39Å; L8-V98 HydrophobicContact CD1-CB 4.36Å; L8-V98 HydrophobicContact CD1-CG2 3.78Å; L8-V121 HydrophobicContact CB-CG1 4.23Å; L8-V121 HydrophobicContact CD2-CG1 4.47Å; L8-A125 HydrophobicContact CD2-CB 3.4Å
9	T	34.4	Very low	38.2	Very low	92 Å²	92	97.6 Å²	97.6	56%	0.564	52%	0.522	S	S	*	.			trans	-121.3	90.1	176.8	57.5	0	0	0	0	110.2	Q7	Q7-T9 HydrophobicContact CG-CG2 4.22Å
10	S	35.7	Very low	38.7	Very low	33 Å²	33	93.3 Å²	93.3	23%	0.231	50%	0.5	C	S	.	.			trans	-70.2	148.3	167.8	-173.7	0	0	0	0	110.5	S12	S10-S12 PolarHBondContact OG-N 3.22Å; S10-S12 VanDerWaalsContact OG-N 3.15Å; S10-S12 PolarHBondContact OG-O 3.34Å
11	K	37.7	Very low	39.3	Very low	207 Å²	207	90.3 Å²	90.3	90%	0.9	48%	0.484	S	S	*	.			trans	-116.9	11	168.2	-70.6	-172.6	176.4	-178.9	0	112.7
12	S	34.9	Very low	40.3	Very low	69 Å²	69	83.4 Å²	83.4	48%	0.483	45%	0.448	S	S	.	.	S	Bend	trans	-135.1	124.8	-173	39.7	0	0	0	0	112.5	S10	S10-S12 PolarHBondContact OG-N 3.22Å; S10-S12 VanDerWaalsContact OG-N 3.15Å; S10-S12 PolarHBondContact OG-O 3.34Å
13	H	40.2	Very low	41	Very low	170 Å²	170	84.3 Å²	84.3	79%	0.787	43%	0.432	S	S	*	.			trans	38.3	106.9	163.8	-58.1	-68.1	0	0	0	118.8
14	H	49.8	Very low	41.8	Very low	42 Å²	42	77.7 Å²	77.7	19%	0.194	40%	0.398	C	S	.	.			trans	-96.8	-10.8	-166.1	-75.1	66.2	0	0	0	116.5	L17 Y92	H14-L17 PolarHBondContact O-N 2.78Å; H14-Y92 PolarHBondContact CD2-O 3.5Å
15	E	41.8	Very low	42.4	Very low	177 Å²	177	77 Å²	77	83%	0.827	39%	0.391	S	S	*	.	H	α-helix	trans	-64	-49.7	-174.2	-63	-169.8	139.6	0	0	113	L17 A19	E15-L17 VanDerWaalsContact C-N 3.29Å; E15-L17 PolarHBondContact O-N 3.33Å; E15-A19 PolarHBondContact O-N 3.05Å
16	N	43.7	Very low	42.8	Very low	123 Å²	123	80.6 Å²	80.6	66%	0.658	41%	0.406	S	S	*	.	H	α-helix	trans	-67.5	-28.8	-179.4	-70.9	-18.2	0	0	0	112.7	A19 S20	N16-A19 PolarHBondContact O-N 2.94Å; N16-S20 WeakPolarHBondContact O-CB 3.24Å; N16-S20 PolarHBondContact O-N 2.95Å; N16-S20 PolarHBondContact O-OG 3.37Å; N16-S20 VanDerWaalsContact O-OG 3.07Å
17	L	47.6	Very low	43.2	Very low	30 Å²	30	84.1 Å²	84.1	16%	0.157	42%	0.421	C	S	.	.	H	α-helix	trans	-65.3	-46.8	-174.9	-161.6	74.2	0	0	0	111.6	H14 E15 L21 I96 L118	H14-L17 PolarHBondContact O-N 2.78Å; E15-L17 VanDerWaalsContact C-N 3.29Å; E15-L17 PolarHBondContact O-N 3.33Å; L17-L21 HydrophobicContact CG-CD1 4.44Å; L17-L21 WeakPolarHBondContact O-CB 3.4Å; L17-L21 VanDerWaalsContact O-CG 3.25Å; L17-L21 WeakPolarHBondContact O-CG 3.5Å; L17-L21 PolarHBondContact O-N 2.64Å; L17-I96 HydrophobicContact CD2-CD1 3.59Å; L17-I96 HydrophobicContact CG-CD1 4.49Å; L17-L118 HydrophobicContact CD1-CB 4.1Å; L17-L118 HydrophobicContact CD1-CD1 3.88Å; L17-L118 HydrophobicContact CD1-CG 4.45Å
18	L	49.6	Very low	43.5	Very low	39 Å²	39	82.3 Å²	82.3	20%	0.204	43%	0.429	C	S	.	.	H	α-helix	trans	-69.3	-37.8	177.7	-78.9	152.6	0	0	0	112.1	H22 I35 I52 Y92	L18-H22 WeakPolarHBondContact O-CB 3.32Å; L18-H22 PolarHBondContact O-N 3.37Å; L18-I35 HydrophobicContact CD2-CD1 4.47Å; L18-I52 HydrophobicContact CD2-CD1 4.13Å; L18-Y92 HydrophobicContact CD1-CD1 3.63Å; L18-Y92 HydrophobicContact CD1-CE1 3.78Å; L18-Y92 HydrophobicContact CD1-CG 4.01Å; L18-Y92 HydrophobicContact CD2-CD1 4.4Å; L18-Y92 HydrophobicContact CD2-CE1 4.03Å
19	A	47.7	Very low	44	Very low	56 Å²	56	86.8 Å²	86.8	46%	0.463	45%	0.45	S	S	.	.	H	α-helix	trans	-62.1	-47.1	175.2	0	0	0	0	0	111.8	E15 N16 H22 Q23	E15-A19 PolarHBondContact O-N 3.05Å; N16-A19 PolarHBondContact O-N 2.94Å; A19-H22 WeakPolarHBondContact O-CB 3.46Å; A19-H22 PolarHBondContact O-N 3.05Å; A19-Q23 PolarHBondContact O-N 2.65Å
20	S	49.1	Very low	44.3	Very low	12 Å²	12	83.4 Å²	83.4	8%	0.084	43%	0.428	C	S	.	.	H	α-helix	trans	-69.9	-39.8	-179.4	-60.4	0	0	0	0	112.5	N16 H22 Q23 M24 C115	N16-S20 WeakPolarHBondContact O-CB 3.24Å; N16-S20 PolarHBondContact O-N 2.95Å; N16-S20 PolarHBondContact O-OG 3.37Å; N16-S20 VanDerWaalsContact O-OG 3.07Å; S20-H22 VanDerWaalsContact C-N 3.28Å; S20-H22 PolarHBondContact O-N 3.4Å; S20-Q23 PolarHBondContact O-N 3.05Å; S20-M24 WeakPolarHBondContact O-CB 3.47Å; S20-M24 VanDerWaalsContact O-CG 3.28Å; S20-M24 WeakPolarHBondContact O-CG 3.24Å; S20-M24 PolarHBondContact O-N 2.89Å; S20-C115 PolarHBondContact OG-SG 2.85Å
21	L	49.6	Very low	44.5	Very low	31 Å²	31	85.7 Å²	85.7	16%	0.162	44%	0.443	C	S	.	.	H	α-helix	trans	-60.9	-37.3	172.1	-73	170.5	0	0	0	112.1	L17 R25 L30 I96	L17-L21 HydrophobicContact CG-CD1 4.44Å; L17-L21 WeakPolarHBondContact O-CB 3.4Å; L17-L21 VanDerWaalsContact O-CG 3.25Å; L17-L21 WeakPolarHBondContact O-CG 3.5Å; L17-L21 PolarHBondContact O-N 2.64Å; L21-R25 WeakPolarHBondContact O-CB 3.47Å; L21-R25 PolarHBondContact O-N 3.38Å; L21-R25 VanDerWaalsContact O-N 3.16Å; L21-L30 HydrophobicContact CD2-CD1 3.76Å; L21-I96 HydrophobicContact CD1-CD1 4.25Å
22	H	48.5	Very low	44.4	Very low	91 Å²	91	83.3 Å²	83.3	42%	0.421	44%	0.44	S	S	.	.	H	α-helix	trans	-65.5	-45.2	172.8	-175	70.4	0	0	0	111.7	L18 A19 S20 R25 M26	L18-H22 WeakPolarHBondContact O-CB 3.32Å; L18-H22 PolarHBondContact O-N 3.37Å; A19-H22 WeakPolarHBondContact O-CB 3.46Å; A19-H22 PolarHBondContact O-N 3.05Å; S20-H22 VanDerWaalsContact C-N 3.28Å; S20-H22 PolarHBondContact O-N 3.4Å; H22-R25 PolarHBondContact O-N 3.16Å; H22-M26 WeakPolarHBondContact O-CG 3.37Å; H22-M26 PolarHBondContact O-N 2.99Å
23	Q	47.3	Very low	44.7	Very low	96 Å²	96	82.1 Å²	82.1	45%	0.449	43%	0.43	S	S	.	.	H	α-helix	trans	-63.3	-44.1	178.8	-175.6	163.4	-35.1	0	0	112.6	A19 S20 R25 M26 Q27	A19-Q23 PolarHBondContact O-N 2.65Å; S20-Q23 PolarHBondContact O-N 3.05Å; Q23-R25 VanDerWaalsContact C-N 3.31Å; Q23-R25 PolarHBondContact O-N 3.03Å; Q23-M26 PolarHBondContact O-N 3.43Å; Q23-Q27 WeakPolarHBondContact O-CG 3.38Å; Q23-Q27 PolarHBondContact O-N 2.87Å
24	M	45.9	Very low	44.5	Very low	3 Å²	3	77.1 Å²	77.1	2%	0.015	41%	0.412	C	S	.	.	H	α-helix	trans	-62.8	-35.4	175.3	-69.2	173.1	75.3	0	0	112.5	S20 Q27 G28 Q29 L30 V106 V109 L113	S20-M24 WeakPolarHBondContact O-CB 3.47Å; S20-M24 VanDerWaalsContact O-CG 3.28Å; S20-M24 WeakPolarHBondContact O-CG 3.24Å; S20-M24 PolarHBondContact O-N 2.89Å; M24-Q27 PolarHBondContact O-N 2.91Å; M24-G28 PolarHBondContact O-N 3.12Å; M24-Q29 PolarHBondContact O-N 3.07Å; M24-L30 HydrophobicContact CB-CD1 3.73Å; M24-L30 HydrophobicContact CB-CG 4.07Å; M24-L30 HydrophobicContact CE-CD1 3.9Å; M24-L30 HydrophobicContact CE-CD2 4.36Å; M24-L30 HydrophobicContact CE-CG 4.12Å; M24-L30 HydrophobicContact SD-CD1 4.08Å; M24-V106 HydrophobicContact CE-CB 4.47Å; M24-V106 HydrophobicContact CE-CG1 4.4Å; M24-V106 HydrophobicContact CE-CG2 4.16Å; M24-V109 HydrophobicContact CE-CB 3.92Å; M24-V109 HydrophobicContact CE-CG1 3.61Å; M24-V109 HydrophobicContact CG-CG1 3.78Å; M24-V109 HydrophobicContact SD-CG1 4.03Å; M24-L113 HydrophobicContact CG-CD1 3.82Å; M24-L113 HydrophobicContact SD-CD1 4.46Å
25	R	44.6	Very low	44.1	Very low	126 Å²	126	75.9 Å²	75.9	48%	0.475	41%	0.406	S	S	.	.	H	α-helix	trans	-71.6	-36.9	173.2	-170.8	174.3	178.2	-142.2	-6.5	112.1	L21 H22 Q23 Q27 G28 H49	L21-R25 WeakPolarHBondContact O-CB 3.47Å; L21-R25 PolarHBondContact O-N 3.38Å; L21-R25 VanDerWaalsContact O-N 3.16Å; H22-R25 PolarHBondContact O-N 3.16Å; Q23-R25 VanDerWaalsContact C-N 3.31Å; Q23-R25 PolarHBondContact O-N 3.03Å; R25-Q27 PolarHBondContact O-N 3.46Å; R25-G28 PolarHBondContact O-N 3.47Å; R25-H49 VanDerWaalsContact NH1-CG 3.3Å; R25-H49 PolarHBondContact NH1-ND1 3.08Å
26	M	43.5	Very low	43.7	Very low	144 Å²	144	70.4 Å²	70.4	71%	0.709	38%	0.38	S	S	*	.	H	α-helix	trans	-66.2	-24.6	172.9	-73.1	-62.6	-65.2	0	0	113.1	H22 Q23 G28	H22-M26 WeakPolarHBondContact O-CG 3.37Å; H22-M26 PolarHBondContact O-N 2.99Å; Q23-M26 PolarHBondContact O-N 3.43Å; M26-G28 VanDerWaalsContact C-N 3.31Å
27	Q	45.4	Very low	43.5	Very low	105 Å²	105	65.9 Å²	65.9	49%	0.491	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-0.2	170	-69.1	172.6	-19.3	0	0	113.5	Q23 M24 R25 Q29	Q23-Q27 WeakPolarHBondContact O-CG 3.38Å; Q23-Q27 PolarHBondContact O-N 2.87Å; M24-Q27 PolarHBondContact O-N 2.91Å; R25-Q27 PolarHBondContact O-N 3.46Å; Q27-Q29 VanDerWaalsContact C-N 3.33Å; Q27-Q29 PolarHBondContact O-N 3.43Å
28	G	40.5	Very low	42.9	Very low	61 Å²	61	70.2 Å²	70.2	63%	0.629	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	6.4	174.2	0	0	0	0	0	115.8	M24 R25 M26	M24-G28 PolarHBondContact O-N 3.12Å; R25-G28 PolarHBondContact O-N 3.47Å; M26-G28 VanDerWaalsContact C-N 3.31Å
29	Q	45.7	Very low	42.2	Very low	115 Å²	115	74.3 Å²	74.3	54%	0.537	39%	0.394	S	S	.	.			trans	-90.9	-16.2	-171.7	-67.8	-179.2	-17.5	0	0	114.3	M24 Q27	M24-Q29 PolarHBondContact O-N 3.07Å; Q27-Q29 VanDerWaalsContact C-N 3.33Å; Q27-Q29 PolarHBondContact O-N 3.43Å
30	L	42.7	Very low	41.4	Very low	22 Å²	22	79.1 Å²	79.1	12%	0.115	41%	0.407	C	S	.	.			trans	-113	116.4	176.5	-69.4	-178.9	0	0	0	112.6	L21 M24 V106	L21-L30 HydrophobicContact CD2-CD1 3.76Å; M24-L30 HydrophobicContact CB-CD1 3.73Å; M24-L30 HydrophobicContact CB-CG 4.07Å; M24-L30 HydrophobicContact CE-CD1 3.9Å; M24-L30 HydrophobicContact CE-CD2 4.36Å; M24-L30 HydrophobicContact CE-CG 4.12Å; M24-L30 HydrophobicContact SD-CD1 4.08Å; L30-V106 HydrophobicContact CD2-CG2 4.14Å
31	C	38.6	Very low	40.8	Very low	80 Å²	80	87.6 Å²	87.6	54%	0.541	45%	0.445	S	S	.	.			trans	-104.5	133.5	158.2	-58.5	0	0	0	0	109	K102	C31-K102 PolarHBondContact O-NZ 2.84Å
32	D	37	Very low	39.8	Very low	157 Å²	157	93.4 Å²	93.4	84%	0.84	47%	0.472	S	S	*	.			trans	61	94.8	169.3	-47.7	-38	0	0	0	116.2
33	V	39.3	Very low	39.2	Very low	44 Å²	44	93 Å²	93	27%	0.267	48%	0.476	S	S	.	.			trans	-116.3	109.9	162.1	179.4	0	0	0	0	107.1	I35 I96	V33-I35 HydrophobicContact CG1-CG1 4.41Å; V33-I96 HydrophobicContact CG1-CG2 4.14Å
34	T	37.4	Very low	38.8	Very low	66 Å²	66	94 Å²	94	41%	0.405	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	140.7	167.4	37.8	0	0	0	0	109.5
35	I	39.9	Very low	38.4	Very low	15 Å²	15	100.1 Å²	100.1	8%	0.077	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	110.2	171.4	-56	-177.8	0	0	0	106.8	L18 V33 V37 A48	L18-I35 HydrophobicContact CD2-CD1 4.47Å; V33-I35 HydrophobicContact CG1-CG1 4.41Å; I35-V37 HydrophobicContact CG2-CG2 4.02Å; I35-A48 HydrophobicContact CD1-CB 3.62Å; I35-A48 HydrophobicContact CG1-CB 4.04Å
36	Q	35.3	Very low	38.1	Very low	62 Å²	62	98.1 Å²	98.1	29%	0.29	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	119.5	169.6	-72.8	-179.4	-5.2	0	0	108.4	V43 E45 G94 K95	Q36-V43 HydrophobicContact CB-CG1 4.39Å; Q36-V43 HydrophobicContact CG-CG1 4.14Å; Q36-E45 HydrophobicContact CG-CG 4.34Å; Q36-E45 PolarHBondContact NE2-OE1 3.27Å; Q36-G94 WeakPolarHBondContact O-CA 3.18Å; Q36-K95 PolarHBondContact O-N 3.05Å
37	V	38.1	Very low	37.9	Very low	29 Å²	29	98.4 Å²	98.4	18%	0.176	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	124	173.8	-179.3	0	0	0	0	107.2	I35 V91	I35-V37 HydrophobicContact CG2-CG2 4.02Å; V37-V91 HydrophobicContact CG1-CG1 4.44Å; V37-V91 VanDerWaalsContact CG1-O 3.29Å; V37-V91 WeakPolarHBondContact CG1-O 3.24Å; V37-V91 WeakPolarHBondContact CG2-O 3.46Å
38	N	35.9	Very low	37.9	Very low	121 Å²	121	94.3 Å²	94.3	65%	0.647	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	106.5	-173.2	-143.7	26.5	0	0	0	109.3
39	Y	34.8	Very low	37.9	Very low	124 Å²	124	95.4 Å²	95.4	49%	0.486	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	113.5	179.7	-172.2	-89.9	0	0	0	110.5	E41 F90	Y39-E41 PolarHBondContact O-N 3.32Å; Y39-F90 HydrophobicContact CD2-CE1 4.32Å; Y39-F90 HydrophobicContact CE2-CE1 4.38Å
40	Q	31.3	Very low	37.6	Very low	157 Å²	157	97.1 Å²	97.1	73%	0.734	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	47.4	176	-61.1	-175.5	-22.5	0	0	114.1	E42	Q40-E42 PolarHBondContact O-N 3.12Å; Q40-E42 VanDerWaalsContact O-N 3.1Å
41	E	35.4	Very low	37.5	Very low	190 Å²	190	99.8 Å²	99.8	89%	0.888	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	-5.7	174.4	-55.4	-167.7	153	0	0	117.2	Y39	Y39-E41 PolarHBondContact O-N 3.32Å
42	E	29.4	Very low	37.8	Very low	154 Å²	154	98.1 Å²	98.1	72%	0.72	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	128.6	165.2	-66.4	-168.1	134.9	0	0	111.1	Q40	Q40-E42 PolarHBondContact O-N 3.12Å; Q40-E42 VanDerWaalsContact O-N 3.1Å
43	V	36.3	Very low	37.8	Very low	82 Å²	82	95.1 Å²	95.1	50%	0.497	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	95	177.6	-176.9	0	0	0	0	108.8	Q36	Q36-V43 HydrophobicContact CB-CG1 4.39Å; Q36-V43 HydrophobicContact CG-CG1 4.14Å
44	E	38.6	Very low	37.7	Very low	118 Å²	118	94.9 Å²	94.9	55%	0.551	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	124.6	172.9	-71.7	-158.9	119.8	0	0	111.6	F46	E44-F46 HydrophobicContact CB-CD2 4.12Å; E44-F46 HydrophobicContact CB-CE2 3.49Å; E44-F46 VanDerWaalsContact CB-CE2 3.49Å; E44-F46 HydrophobicContact CB-CZ 3.9Å; E44-F46 PolarHBondContact O-N 2.78Å; E44-F46 VanDerWaalsContact OE2-CZ 3.27Å; E44-F46 WeakPolarHBondContact OE2-CZ 3.39Å
45	E	35.8	Very low	37.9	Very low	131 Å²	131	96 Å²	96	61%	0.612	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	92.3	178.4	-62.4	-154.9	129.8	0	0	111.6	Q36 Q47	Q36-E45 HydrophobicContact CG-CG 4.34Å; Q36-E45 PolarHBondContact NE2-OE1 3.27Å; E45-Q47 PolarHBondContact O-N 3.35Å
46	F	39.3	Very low	37.7	Very low	84 Å²	84	99.2 Å²	99.2	37%	0.368	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	120.3	177.6	-70.7	-75.4	0	0	0	112.2	E44 A48	E44-F46 HydrophobicContact CB-CD2 4.12Å; E44-F46 HydrophobicContact CB-CE2 3.49Å; E44-F46 VanDerWaalsContact CB-CE2 3.49Å; E44-F46 HydrophobicContact CB-CZ 3.9Å; E44-F46 PolarHBondContact O-N 2.78Å; E44-F46 VanDerWaalsContact OE2-CZ 3.27Å; E44-F46 WeakPolarHBondContact OE2-CZ 3.39Å; F46-A48 PolarHBondContact O-N 3.5Å
47	Q	39.4	Very low	37.6	Very low	150 Å²	150	98.2 Å²	98.2	70%	0.701	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	100.9	159.3	-68.5	-171.1	1.9	0	0	108.6	E45 H49 Q50	E45-Q47 PolarHBondContact O-N 3.35Å; Q47-H49 PolarHBondContact O-N 2.68Å; Q47-Q50 PolarHBondContact O-N 3.48Å
48	A	46	Very low	37.5	Very low	19 Å²	19	99.1 Å²	99.1	16%	0.157	52%	0.524	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-24.4	-176.1	0	0	0	0	0	114.5	I35 F46 Q50 L51 I52	I35-A48 HydrophobicContact CD1-CB 3.62Å; I35-A48 HydrophobicContact CG1-CB 4.04Å; F46-A48 PolarHBondContact O-N 3.5Å; A48-Q50 VanDerWaalsContact C-N 3.29Å; A48-Q50 PolarHBondContact O-N 2.89Å; A48-L51 PolarHBondContact O-N 3.13Å; A48-I52 HydrophobicContact CB-CD1 4.34Å; A48-I52 VanDerWaalsContact O-CG1 3.3Å; A48-I52 WeakPolarHBondContact O-CG1 3.38Å; A48-I52 PolarHBondContact O-N 2.81Å
49	H	40.6	Very low	37.5	Very low	84 Å²	84	101.3 Å²	101.3	39%	0.389	52%	0.524	S	S	.	.	H	α-helix	trans	-49	-42.1	172.2	-161.1	15.3	0	0	0	114.2	R25 Q47 L53	R25-H49 VanDerWaalsContact NH1-CG 3.3Å; R25-H49 PolarHBondContact NH1-ND1 3.08Å; Q47-H49 PolarHBondContact O-N 2.68Å; H49-L53 VanDerWaalsContact CE1-CD1 3.49Å; H49-L53 WeakPolarHBondContact CE1-CD1 3.44Å; H49-L53 WeakPolarHBondContact ND1-CD1 3.33Å; H49-L53 VanDerWaalsContact O-CB 3.25Å; H49-L53 WeakPolarHBondContact O-CB 3.46Å; H49-L53 WeakPolarHBondContact O-CD1 3.28Å; H49-L53 WeakPolarHBondContact O-CG 3.37Å; H49-L53 PolarHBondContact O-N 2.97Å; H49-L53 VanDerWaalsContact O-N 3.12Å
50	Q	37.7	Very low	37.6	Very low	150 Å²	150	100.2 Å²	100.2	70%	0.701	52%	0.522	S	S	*	.	H	α-helix	trans	-74.7	-45	-176.4	-76.8	-168.8	-7.6	0	0	113.1	Q47 A48 L53 A54	Q47-Q50 PolarHBondContact O-N 3.48Å; A48-Q50 VanDerWaalsContact C-N 3.29Å; A48-Q50 PolarHBondContact O-N 2.89Å; Q50-L53 PolarHBondContact O-N 3.03Å; Q50-A54 WeakPolarHBondContact O-CB 3.44Å; Q50-A54 PolarHBondContact O-N 2.95Å
51	L	42	Very low	38	Very low	79 Å²	79	99.3 Å²	99.3	41%	0.414	52%	0.518	S	S	.	.	H	α-helix	trans	-64.4	-43.2	179.7	-117.9	84.2	0	0	0	111.5	A48 A54 A55	A48-L51 PolarHBondContact O-N 3.13Å; L51-A54 PolarHBondContact O-N 2.94Å; L51-A55 PolarHBondContact O-N 3.09Å
52	I	44.3	Very low	38.1	Very low	45 Å²	45	98.1 Å²	98.1	23%	0.231	51%	0.51	C	S	.	.	H	α-helix	trans	-66.5	-42.2	179.1	-61.7	172.2	0	0	0	110.5	L18 A48 A54 A55 S56	L18-I52 HydrophobicContact CD2-CD1 4.13Å; A48-I52 HydrophobicContact CB-CD1 4.34Å; A48-I52 VanDerWaalsContact O-CG1 3.3Å; A48-I52 WeakPolarHBondContact O-CG1 3.38Å; A48-I52 PolarHBondContact O-N 2.81Å; I52-A54 VanDerWaalsContact C-N 3.33Å; I52-A54 PolarHBondContact O-N 3.48Å; I52-A55 PolarHBondContact O-N 3Å; I52-S56 VanDerWaalsContact O-CB 3.3Å; I52-S56 WeakPolarHBondContact O-CB 3.49Å; I52-S56 PolarHBondContact O-N 3.42Å; I52-S56 PolarHBondContact O-OG 3.42Å
53	L	37.3	Very low	38.5	Very low	93 Å²	93	94.8 Å²	94.8	49%	0.487	50%	0.496	S	S	.	.	H	α-helix	trans	-64.5	-34.2	174.8	-80	175	0	0	0	113.2	H49 Q50 S57	H49-L53 VanDerWaalsContact CE1-CD1 3.49Å; H49-L53 WeakPolarHBondContact CE1-CD1 3.44Å; H49-L53 WeakPolarHBondContact ND1-CD1 3.33Å; H49-L53 VanDerWaalsContact O-CB 3.25Å; H49-L53 WeakPolarHBondContact O-CB 3.46Å; H49-L53 WeakPolarHBondContact O-CD1 3.28Å; H49-L53 WeakPolarHBondContact O-CG 3.37Å; H49-L53 PolarHBondContact O-N 2.97Å; H49-L53 VanDerWaalsContact O-N 3.12Å; Q50-L53 PolarHBondContact O-N 3.03Å; L53-S57 WeakPolarHBondContact O-CB 3.32Å; L53-S57 PolarHBondContact O-N 2.98Å; L53-S57 PolarHBondContact O-OG 3.2Å
54	A	37.5	Very low	38.5	Very low	39 Å²	39	97.5 Å²	97.5	32%	0.322	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-51.8	174.1	0	0	0	0	0	110.3	Q50 L51 I52 S56 S57 F60	Q50-A54 WeakPolarHBondContact O-CB 3.44Å; Q50-A54 PolarHBondContact O-N 2.95Å; L51-A54 PolarHBondContact O-N 2.94Å; I52-A54 VanDerWaalsContact C-N 3.33Å; I52-A54 PolarHBondContact O-N 3.48Å; A54-S56 PolarHBondContact O-N 2.96Å; A54-S57 PolarHBondContact O-N 3.24Å; A54-S57 PolarHBondContact O-OG 3.1Å; A54-S57 VanDerWaalsContact O-OG 3.11Å; A54-F60 HydrophobicContact CB-CE2 3.93Å; A54-F60 HydrophobicContact CB-CZ 4.36Å; A54-F60 VanDerWaalsContact O-CD2 3.27Å; A54-F60 WeakPolarHBondContact O-CD2 3.39Å
55	A	41.6	Very low	38.8	Very low	90 Å²	90	98.9 Å²	98.9	74%	0.744	52%	0.518	S	S	*	.	H	α-helix	trans	-63.1	-37.6	179.5	0	0	0	0	0	113.6	L51 I52 S57	L51-A55 PolarHBondContact O-N 3.09Å; I52-A55 PolarHBondContact O-N 3Å; A55-S57 VanDerWaalsContact C-N 3.29Å; A55-S57 PolarHBondContact O-N 3.15Å
56	S	35.5	Very low	38.7	Very low	83 Å²	83	96.6 Å²	96.6	58%	0.58	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	1.7	-176.6	79.4	0	0	0	0	114.5	I52 A54	I52-S56 VanDerWaalsContact O-CB 3.3Å; I52-S56 WeakPolarHBondContact O-CB 3.49Å; I52-S56 PolarHBondContact O-N 3.42Å; I52-S56 PolarHBondContact O-OG 3.42Å; A54-S56 PolarHBondContact O-N 2.96Å
57	S	33.1	Very low	38.9	Very low	41 Å²	41	99.2 Å²	99.2	29%	0.287	53%	0.529	S	S	.	.			trans	-106.7	118.8	-174.9	70.8	0	0	0	0	112.8	L53 A54 A55 Y59 F60	L53-S57 WeakPolarHBondContact O-CB 3.32Å; L53-S57 PolarHBondContact O-N 2.98Å; L53-S57 PolarHBondContact O-OG 3.2Å; A54-S57 PolarHBondContact O-N 3.24Å; A54-S57 PolarHBondContact O-OG 3.1Å; A54-S57 VanDerWaalsContact O-OG 3.11Å; A55-S57 VanDerWaalsContact C-N 3.29Å; A55-S57 PolarHBondContact O-N 3.15Å; S57-Y59 PolarHBondContact O-N 3.47Å; S57-F60 PolarHBondContact O-N 2.96Å; S57-F60 WeakPolarHBondContact OG-CD2 3.38Å
58	G	36.7	Very low	38.4	Very low	47 Å²	47	99.6 Å²	99.6	49%	0.485	54%	0.536	S	S	.	.	H	α-helix	trans	-62	2.1	174.1	0	0	0	0	0	115.1	K62	G58-K62 PolarHBondContact O-N 3.11Å
59	Y	35.8	Very low	37.6	Very low	168 Å²	168	102 Å²	102	66%	0.659	56%	0.556	S	S	*	*	H	α-helix	trans	-65	-46.1	170.1	-171.3	-117.3	0	0	0	111.4	S57 Q61 K62 I63	S57-Y59 PolarHBondContact O-N 3.47Å; Y59-Q61 PolarHBondContact O-N 2.8Å; Y59-K62 PolarHBondContact O-N 2.82Å; Y59-I63 HydrophobicContact CD1-CD1 3.68Å; Y59-I63 HydrophobicContact CE1-CD1 3.44Å; Y59-I63 VanDerWaalsContact CE1-CD1 3.44Å; Y59-I63 HydrophobicContact CE2-CD1 4.31Å; Y59-I63 HydrophobicContact CG-CD1 4.22Å; Y59-I63 WeakPolarHBondContact O-CG1 3.27Å; Y59-I63 PolarHBondContact O-N 3.38Å; Y59-I63 VanDerWaalsContact O-N 3.13Å
60	F	36.8	Very low	37.3	Very low	100 Å²	100	106.4 Å²	106.4	44%	0.439	58%	0.583	S	S	.	*	H	α-helix	trans	-66.4	-37.3	176.6	-74.3	-83.5	0	0	0	112.2	A54 S57 K62 I63 L64	A54-F60 HydrophobicContact CB-CE2 3.93Å; A54-F60 HydrophobicContact CB-CZ 4.36Å; A54-F60 VanDerWaalsContact O-CD2 3.27Å; A54-F60 WeakPolarHBondContact O-CD2 3.39Å; S57-F60 PolarHBondContact O-N 2.96Å; S57-F60 WeakPolarHBondContact OG-CD2 3.38Å; F60-K62 PolarHBondContact O-N 3.24Å; F60-I63 PolarHBondContact O-N 3.47Å; F60-I63 VanDerWaalsContact O-N 3.16Å; F60-L64 WeakPolarHBondContact O-CB 3.3Å; F60-L64 VanDerWaalsContact O-CG 3.31Å; F60-L64 WeakPolarHBondContact O-CG 3.5Å; F60-L64 PolarHBondContact O-N 2.98Å
61	Q	39.3	Very low	37.4	Very low	139 Å²	139	106.8 Å²	106.8	65%	0.65	58%	0.578	S	S	*	*	H	α-helix	trans	-58.9	-34.1	176.2	-165.8	-179.3	23.8	0	0	112.6	Y59 L65	Y59-Q61 PolarHBondContact O-N 2.8Å; Q61-L65 WeakPolarHBondContact O-CD1 3.42Å; Q61-L65 WeakPolarHBondContact O-CG 3.39Å
62	K	38.2	Very low	37	Very low	164 Å²	164	107.8 Å²	107.8	71%	0.713	60%	0.597	S	S	*	*	H	α-helix	trans	-79.2	-37.3	173.9	-79.5	-175.5	173.5	178.2	0	113.4	G58 Y59 F60 L64 L65	G58-K62 PolarHBondContact O-N 3.11Å; Y59-K62 PolarHBondContact O-N 2.82Å; F60-K62 PolarHBondContact O-N 3.24Å; K62-L64 VanDerWaalsContact C-N 3.28Å; K62-L64 PolarHBondContact O-N 3.43Å; K62-L65 PolarHBondContact O-N 3.37Å; K62-L65 VanDerWaalsContact O-N 3.15Å
63	I	36.5	Very low	36.4	Very low	84 Å²	84	115 Å²	115	43%	0.431	63%	0.627	S	S	.	*	H	α-helix	trans	-63.8	-35	176.7	-71.8	165.8	0	0	0	111.5	Y59 F60 L65	Y59-I63 HydrophobicContact CD1-CD1 3.68Å; Y59-I63 HydrophobicContact CE1-CD1 3.44Å; Y59-I63 VanDerWaalsContact CE1-CD1 3.44Å; Y59-I63 HydrophobicContact CE2-CD1 4.31Å; Y59-I63 HydrophobicContact CG-CD1 4.22Å; Y59-I63 WeakPolarHBondContact O-CG1 3.27Å; Y59-I63 PolarHBondContact O-N 3.38Å; Y59-I63 VanDerWaalsContact O-N 3.13Å; F60-I63 PolarHBondContact O-N 3.47Å; F60-I63 VanDerWaalsContact O-N 3.16Å; I63-L65 PolarHBondContact O-N 3.01Å
64	L	37.7	Very low	36.2	Very low	140 Å²	140	118.7 Å²	118.7	73%	0.733	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-14.6	176.2	-70	168	0	0	0	114	F60 K62	F60-L64 WeakPolarHBondContact O-CB 3.3Å; F60-L64 VanDerWaalsContact O-CG 3.31Å; F60-L64 WeakPolarHBondContact O-CG 3.5Å; F60-L64 PolarHBondContact O-N 2.98Å; K62-L64 VanDerWaalsContact C-N 3.28Å; K62-L64 PolarHBondContact O-N 3.43Å
65	L	43.5	Very low	35.7	Very low	147 Å²	147	122.4 Å²	122.4	77%	0.77	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	8	-179.3	-70.3	171.7	0	0	0	113.7	Q61 K62 I63	Q61-L65 WeakPolarHBondContact O-CD1 3.42Å; Q61-L65 WeakPolarHBondContact O-CG 3.39Å; K62-L65 PolarHBondContact O-N 3.37Å; K62-L65 VanDerWaalsContact O-N 3.15Å; I63-L65 PolarHBondContact O-N 3.01Å
66	S	34.5	Very low	35.6	Very low	82 Å²	82	123.7 Å²	123.7	57%	0.573	65%	0.65	S	S	*	*			trans	-140	104	177.1	62.8	0	0	0	0	112.9
67	Q	42.4	Very low	35.7	Very low	140 Å²	140	123.2 Å²	123.2	65%	0.654	65%	0.647	S	S	*	*			trans	-104.9	146.8	150.5	-69.5	172.1	41.1	0	0	105.3
68	D	28.8	Very low	35.9	Very low	157 Å²	157	128.7 Å²	128.7	84%	0.84	67%	0.673	S	S	*	*			cis	-133.8	168.8	48.8	-71.3	-45.7	0	0	0	114.1
69	A	30.2	Very low	35.8	Very low	71 Å²	71	129.8 Å²	129.8	59%	0.587	67%	0.667	S	S	*	*			cis	-163.3	135.4	-28	0	0	0	0	0	108.8
70	N	33.6	Very low	35.9	Very low	175 Å²	175	127.9 Å²	127.9	94%	0.936	66%	0.664	S	S	*	*			trans	174.5	117.6	150.6	-98.1	-53	0	0	0	108.1
71	R	39.5	Very low	35.9	Very low	159 Å²	159	127.6 Å²	127.6	60%	0.6	67%	0.674	S	S	*	*			trans	-100.4	139.9	-169.6	-72.6	-177.9	178	167	-0.2	113.2
72	A	33.5	Very low	35.9	Very low	99 Å²	99	123.4 Å²	123.4	82%	0.818	66%	0.66	S	S	*	*			trans	-153.3	47.3	164.9	0	0	0	0	0	113.2
73	K	32.7	Very low	35.9	Very low	196 Å²	196	118.3 Å²	118.3	85%	0.852	64%	0.64	S	S	*	*	S	Bend	trans	-167.3	169	161.4	-108.1	158.6	-173.3	-173.4	0	110.9
74	L	31.9	Very low	36.2	Very low	172 Å²	172	118.9 Å²	118.9	90%	0.901	64%	0.64	S	S	*	*			trans	-57	150	-159.1	-74.7	100.9	0	0	0	116.2
75	Q	28.2	Very low	36.4	Very low	117 Å²	117	115.8 Å²	115.8	55%	0.547	63%	0.63	S	S	.	*			trans	-89.4	126.1	167.7	-78.7	-177.1	-121.9	0	0	111.7	S77	Q75-S77 PolarHBondContact NE2-OG 2.96Å
76	L	39.5	Very low	36.1	Very low	116 Å²	116	114.2 Å²	114.2	61%	0.607	62%	0.617	S	S	*	*			trans	-87.8	17.6	164	-72.7	163.6	0	0	0	112.5	N78 M79	L76-N78 VanDerWaalsContact C-N 3.28Å; L76-N78 PolarHBondContact O-N 3.03Å; L76-N78 VanDerWaalsContact O-N 3.09Å; L76-M79 HydrophobicContact CD2-CE 4.07Å; L76-M79 PolarHBondContact O-N 3.15Å
77	S	36.8	Very low	36.4	Very low	74 Å²	74	115.7 Å²	115.7	52%	0.517	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70	-12.8	-158	56.2	0	0	0	0	116.7	Q75	Q75-S77 PolarHBondContact NE2-OG 2.96Å
78	N	36.9	Very low	36.3	Very low	155 Å²	155	112.4 Å²	112.4	83%	0.829	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.8	9.5	-174.5	-65.5	45.7	0	0	0	112.4	L76	L76-N78 VanDerWaalsContact C-N 3.28Å; L76-N78 PolarHBondContact O-N 3.03Å; L76-N78 VanDerWaalsContact O-N 3.09Å
79	M	35.5	Very low	36.7	Very low	71 Å²	71	110.5 Å²	110.5	35%	0.35	58%	0.583	S	S	.	*			trans	-91.7	111.8	180	-146.6	153.4	83.7	0	0	109.3	L76 D83 F84 Y87	L76-M79 HydrophobicContact CD2-CE 4.07Å; L76-M79 PolarHBondContact O-N 3.15Å; M79-D83 HydrophobicContact CG-CB 3.83Å; M79-F84 HydrophobicContact CE-CB 4.47Å; M79-F84 HydrophobicContact CE-CD2 4.13Å; M79-Y87 HydrophobicContact CE-CD1 4.26Å; M79-Y87 HydrophobicContact CE-CD2 4.15Å; M79-Y87 HydrophobicContact CE-CG 3.73Å
80	H	37.6	Very low	36.9	Very low	128 Å²	128	113.6 Å²	113.6	59%	0.593	58%	0.584	S	S	*	*			trans	-65.6	157.1	-178.9	-169.7	-111.6	0	0	0	110.6	S82 D83 F84	H80-S82 PolarHBondContact ND1-OG 3.2Å; H80-S82 PolarHBondContact O-N 2.9Å; H80-S82 VanDerWaalsContact O-N 3.09Å; H80-D83 WeakPolarHBondContact O-CA 3.4Å; H80-D83 PolarHBondContact O-N 3.25Å; H80-F84 PolarHBondContact O-N 3.17Å
81	S	36.9	Very low	37.1	Very low	93 Å²	93	106.5 Å²	106.5	65%	0.65	55%	0.547	S	S	*	.	H	α-helix	trans	-55.4	-35.1	-175.3	-51.9	0	0	0	0	112.9	D83 S85	S81-D83 VanDerWaalsContact C-N 3.3Å; S81-D83 PolarHBondContact O-N 3.32Å; S81-S85 PolarHBondContact O-N 3.05Å; S81-S85 PolarHBondContact O-OG 2.55Å
82	S	40.1	Very low	37.1	Very low	51 Å²	51	101.1 Å²	101.1	36%	0.357	53%	0.527	S	S	.	.	H	α-helix	trans	-61	-34.2	172.9	49.5	0	0	0	0	113.9	H80 K86	H80-S82 PolarHBondContact ND1-OG 3.2Å; H80-S82 PolarHBondContact O-N 2.9Å; H80-S82 VanDerWaalsContact O-N 3.09Å; S82-K86 VanDerWaalsContact O-CG 3.32Å; S82-K86 WeakPolarHBondContact O-CG 3.43Å; S82-K86 PolarHBondContact O-N 2.69Å; S82-K86 VanDerWaalsContact O-N 3.07Å
83	D	37.6	Very low	37.3	Very low	57 Å²	57	100.9 Å²	100.9	31%	0.305	52%	0.515	S	S	.	.	H	α-helix	trans	-92.9	-23.4	-175	-51	-44.6	0	0	0	111.2	M79 H80 S81 K86 Y87	M79-D83 HydrophobicContact CG-CB 3.83Å; H80-D83 WeakPolarHBondContact O-CA 3.4Å; H80-D83 PolarHBondContact O-N 3.25Å; S81-D83 VanDerWaalsContact C-N 3.3Å; S81-D83 PolarHBondContact O-N 3.32Å; D83-K86 IonicContact OD1-NZ 2.55Å; D83-K86 PolarHBondContact OD1-NZ 3.29Å; D83-Y87 VanDerWaalsContact O-CB 3.23Å; D83-Y87 WeakPolarHBondContact O-CB 3.46Å; D83-Y87 PolarHBondContact O-N 3.27Å
84	F	43.5	Very low	37.7	Very low	97 Å²	97	92.1 Å²	92.1	43%	0.425	48%	0.481	S	S	.	.	H	α-helix	trans	-65.1	-41.4	161.1	-172.3	-103.8	0	0	0	111.7	M79 H80 Y87 L88	M79-F84 HydrophobicContact CE-CB 4.47Å; M79-F84 HydrophobicContact CE-CD2 4.13Å; H80-F84 PolarHBondContact O-N 3.17Å; F84-Y87 PolarHBondContact O-N 3.21Å; F84-L88 HydrophobicContact CD1-CD1 3.98Å; F84-L88 HydrophobicContact CE1-CD1 3.61Å; F84-L88 HydrophobicContact CE1-CG 4.36Å; F84-L88 HydrophobicContact CZ-CD1 4.18Å; F84-L88 WeakPolarHBondContact O-CG 3.33Å; F84-L88 PolarHBondContact O-N 3Å
85	S	40.5	Very low	37.8	Very low	74 Å²	74	88.4 Å²	88.4	52%	0.517	46%	0.457	S	S	.	.	H	α-helix	trans	-61.1	-47.1	170.8	-65.7	0	0	0	0	112.2	S81 Y87 L88 E89	S81-S85 PolarHBondContact O-N 3.05Å; S81-S85 PolarHBondContact O-OG 2.55Å; S85-Y87 VanDerWaalsContact C-N 3.32Å; S85-Y87 PolarHBondContact O-N 2.84Å; S85-L88 PolarHBondContact O-N 3.36Å; S85-E89 WeakPolarHBondContact O-CB 3.47Å; S85-E89 PolarHBondContact O-N 3.32Å
86	K	38.7	Very low	38.4	Very low	115 Å²	115	84.1 Å²	84.1	50%	0.5	44%	0.438	S	S	.	.	H	α-helix	trans	-63.2	-34.7	174.5	-68.6	167.2	-161	160.6	0	113.2	S82 D83 E89 F90	S82-K86 VanDerWaalsContact O-CG 3.32Å; S82-K86 WeakPolarHBondContact O-CG 3.43Å; S82-K86 PolarHBondContact O-N 2.69Å; S82-K86 VanDerWaalsContact O-N 3.07Å; D83-K86 IonicContact OD1-NZ 2.55Å; D83-K86 PolarHBondContact OD1-NZ 3.29Å; K86-E89 PolarHBondContact O-N 3.08Å; K86-F90 WeakPolarHBondContact O-CB 3.38Å; K86-F90 PolarHBondContact O-N 3.48Å
87	Y	40.3	Very low	38.3	Very low	112 Å²	112	81 Å²	81	44%	0.439	42%	0.42	S	S	.	.	H	α-helix	trans	-66.2	-41.6	175.5	177.3	-93.3	0	0	0	111	M79 D83 F84 S85 F90 V91	M79-Y87 HydrophobicContact CE-CD1 4.26Å; M79-Y87 HydrophobicContact CE-CD2 4.15Å; M79-Y87 HydrophobicContact CE-CG 3.73Å; D83-Y87 VanDerWaalsContact O-CB 3.23Å; D83-Y87 WeakPolarHBondContact O-CB 3.46Å; D83-Y87 PolarHBondContact O-N 3.27Å; F84-Y87 PolarHBondContact O-N 3.21Å; S85-Y87 VanDerWaalsContact C-N 3.32Å; S85-Y87 PolarHBondContact O-N 2.84Å; Y87-F90 PolarHBondContact O-N 2.9Å; Y87-V91 HydrophobicContact CD1-CG2 4.28Å; Y87-V91 HydrophobicContact CE1-CG2 3.9Å; Y87-V91 HydrophobicContact CE2-CG2 4.19Å; Y87-V91 WeakPolarHBondContact O-CB 3.38Å; Y87-V91 VanDerWaalsContact O-CG2 3.25Å; Y87-V91 WeakPolarHBondContact O-CG2 3.32Å; Y87-V91 PolarHBondContact O-N 3.17Å
88	L	39.7	Very low	38.5	Very low	71 Å²	71	78.8 Å²	78.8	37%	0.372	40%	0.403	S	S	.	.	H	α-helix	trans	-63.4	-43.8	170.8	-72.8	168.9	0	0	0	111.5	F84 S85 F90 V91 Y92	F84-L88 HydrophobicContact CD1-CD1 3.98Å; F84-L88 HydrophobicContact CE1-CD1 3.61Å; F84-L88 HydrophobicContact CE1-CG 4.36Å; F84-L88 HydrophobicContact CZ-CD1 4.18Å; F84-L88 WeakPolarHBondContact O-CG 3.33Å; F84-L88 PolarHBondContact O-N 3Å; S85-L88 PolarHBondContact O-N 3.36Å; L88-F90 PolarHBondContact O-N 3.48Å; L88-V91 PolarHBondContact O-N 3.39Å; L88-Y92 HydrophobicContact CD2-CD2 4.36Å; L88-Y92 HydrophobicContact CD2-CE2 4.09Å; L88-Y92 VanDerWaalsContact O-CB 3.29Å; L88-Y92 WeakPolarHBondContact O-CB 3.3Å; L88-Y92 WeakPolarHBondContact O-CD2 3.49Å; L88-Y92 PolarHBondContact O-N 3.27Å
89	E	36.8	Very low	38.7	Very low	118 Å²	118	73.4 Å²	73.4	55%	0.551	38%	0.38	S	S	*	.	H	α-helix	trans	-59.5	-43.4	176.6	-168.3	169.6	-140.3	0	0	111.9	S85 K86 Y92 T93	S85-E89 WeakPolarHBondContact O-CB 3.47Å; S85-E89 PolarHBondContact O-N 3.32Å; K86-E89 PolarHBondContact O-N 3.08Å; E89-Y92 PolarHBondContact O-N 3.49Å; E89-T93 PolarHBondContact O-N 2.97Å; E89-T93 VanDerWaalsContact O-N 3.15Å
90	F	36.1	Very low	38.9	Very low	135 Å²	135	73.3 Å²	73.3	59%	0.592	38%	0.376	S	S	*	.	H	α-helix	trans	-68.8	-39.5	176.5	-177.4	-95.7	0	0	0	113.2	Y39 K86 Y87 L88 T93	Y39-F90 HydrophobicContact CD2-CE1 4.32Å; Y39-F90 HydrophobicContact CE2-CE1 4.38Å; K86-F90 WeakPolarHBondContact O-CB 3.38Å; K86-F90 PolarHBondContact O-N 3.48Å; Y87-F90 PolarHBondContact O-N 2.9Å; L88-F90 PolarHBondContact O-N 3.48Å; F90-T93 PolarHBondContact O-OG1 3Å
91	V	37.7	Very low	39.2	Very low	26 Å²	26	74.4 Å²	74.4	16%	0.158	39%	0.386	C	S	.	.	H	α-helix	trans	-72.7	-29.5	175.5	168.8	0	0	0	0	111.6	V37 Y87 L88	V37-V91 HydrophobicContact CG1-CG1 4.44Å; V37-V91 VanDerWaalsContact CG1-O 3.29Å; V37-V91 WeakPolarHBondContact CG1-O 3.24Å; V37-V91 WeakPolarHBondContact CG2-O 3.46Å; Y87-V91 HydrophobicContact CD1-CG2 4.28Å; Y87-V91 HydrophobicContact CE1-CG2 3.9Å; Y87-V91 HydrophobicContact CE2-CG2 4.19Å; Y87-V91 WeakPolarHBondContact O-CB 3.38Å; Y87-V91 VanDerWaalsContact O-CG2 3.25Å; Y87-V91 WeakPolarHBondContact O-CG2 3.32Å; Y87-V91 PolarHBondContact O-N 3.17Å; L88-V91 PolarHBondContact O-N 3.39Å
92	Y	39.5	Very low	39.8	Very low	47 Å²	47	73.7 Å²	73.7	18%	0.184	37%	0.372	C	S	.	.	S	Bend	trans	-95.7	8.3	-179.9	-78.8	-71.1	0	0	0	115.5	H14 L18 L88 E89 G94	H14-Y92 PolarHBondContact CD2-O 3.5Å; L18-Y92 HydrophobicContact CD1-CD1 3.63Å; L18-Y92 HydrophobicContact CD1-CE1 3.78Å; L18-Y92 HydrophobicContact CD1-CG 4.01Å; L18-Y92 HydrophobicContact CD2-CD1 4.4Å; L18-Y92 HydrophobicContact CD2-CE1 4.03Å; L88-Y92 HydrophobicContact CD2-CD2 4.36Å; L88-Y92 HydrophobicContact CD2-CE2 4.09Å; L88-Y92 VanDerWaalsContact O-CB 3.29Å; L88-Y92 WeakPolarHBondContact O-CB 3.3Å; L88-Y92 WeakPolarHBondContact O-CD2 3.49Å; L88-Y92 PolarHBondContact O-N 3.27Å; E89-Y92 PolarHBondContact O-N 3.49Å; Y92-G94 PolarHBondContact O-N 3.37Å
93	T	36.3	Very low	40.3	Very low	94 Å²	94	71.9 Å²	71.9	58%	0.577	36%	0.358	S	S	*	.			trans	-71	44	155.1	52.7	0	0	0	0	112.1	E89 F90	E89-T93 PolarHBondContact O-N 2.97Å; E89-T93 VanDerWaalsContact O-N 3.15Å; F90-T93 PolarHBondContact O-OG1 3Å
94	G	40.5	Very low	40.8	Very low	12 Å²	12	71.3 Å²	71.3	12%	0.124	37%	0.365	C	S	.	.			trans	-77.4	137.2	174.5	0	0	0	0	0	110.5	Q36 Y92	Q36-G94 WeakPolarHBondContact O-CA 3.18Å; Y92-G94 PolarHBondContact O-N 3.37Å
95	K	35.9	Very low	41.2	Very low	93 Å²	93	71.7 Å²	71.7	40%	0.404	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	131.6	175.4	-66.7	-175.4	176.4	-171.1	0	109	Q7 Q36	Q7-K95 HydrophobicContact CG-CD 4.19Å; Q36-K95 PolarHBondContact O-N 3.05Å
96	I	39.9	Very low	41.7	Very low	28 Å²	28	68.8 Å²	68.8	14%	0.144	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.2	178.3	-65	169.8	0	0	0	108	L8 L17 L21 V33 V98	L8-I96 WeakPolarHBondContact CB-O 3.3Å; L8-I96 PolarHBondContact N-O 3.39Å; L17-I96 HydrophobicContact CD2-CD1 3.59Å; L17-I96 HydrophobicContact CG-CD1 4.49Å; L21-I96 HydrophobicContact CD1-CD1 4.25Å; V33-I96 HydrophobicContact CG1-CG2 4.14Å; I96-V98 HydrophobicContact CG2-CG2 4.02Å
97	E	37.8	Very low	42.1	Very low	50 Å²	50	66 Å²	66	23%	0.234	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.9	-176.2	-67	-155.3	149.3	0	0	109.8	V5 Q7	V5-E97 HydrophobicContact CG1-CB 3.6Å; V5-E97 HydrophobicContact CG1-CG 3.96Å; V5-E97 WeakPolarHBondContact CG1-OE2 3.2Å; Q7-E97 PolarHBondContact NE2-OE1 2.95Å; Q7-E97 VanDerWaalsContact NE2-OE1 3.12Å
98	V	40.8	Very low	42.5	Very low	27 Å²	27	65.7 Å²	65.7	16%	0.164	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134	-173.6	-175.7	0	0	0	0	110.1	I6 L8 I96 R100 I103	I6-V98 PolarHBondContact O-N 3.16Å; L8-V98 HydrophobicContact CD1-CB 4.36Å; L8-V98 HydrophobicContact CD1-CG2 3.78Å; I96-V98 HydrophobicContact CG2-CG2 4.02Å; V98-R100 PolarHBondContact O-N 3.27Å; V98-I103 HydrophobicContact CB-CG1 4.46Å; V98-I103 HydrophobicContact CG1-CG1 3.97Å
99	A	40.1	Very low	42.8	Very low	42 Å²	42	63.2 Å²	63.2	35%	0.347	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	122.1	175	0	0	0	0	0	110.7	N101 K102	A99-N101 PolarHBondContact O-N 2.93Å; A99-K102 PolarHBondContact O-N 3.02Å
100	R	41.3	Very low	43.4	Very low	70 Å²	70	57.6 Å²	57.6	26%	0.264	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-40.2	-44	-176.3	-74.9	177.3	-171.8	-119.4	-7.4	114.6	K4 I6 V98 K102 I103 V130	K4-R100 VanDerWaalsContact CB-NE 3.34Å; K4-R100 WeakPolarHBondContact O-CD 3.49Å; K4-R100 VanDerWaalsContact O-CG 3.3Å; K4-R100 WeakPolarHBondContact O-CG 3.42Å; K4-R100 PolarHBondContact O-NE 2.84Å; I6-R100 HydrophobicContact CD1-CG 3.66Å; I6-R100 HydrophobicContact CG1-CG 3.78Å; V98-R100 PolarHBondContact O-N 3.27Å; R100-K102 PolarHBondContact O-N 3.42Å; R100-I103 PolarHBondContact O-N 3.43Å; R100-I103 VanDerWaalsContact O-N 3.16Å; R100-V130 PolarHBondContact NH1-O 3.41Å
101	N	44.2	Very low	44.1	Very low	150 Å²	150	59.5 Å²	59.5	80%	0.802	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-53.2	-27.9	-175.6	-48.3	26.6	0	0	0	113.3	A99	A99-N101 PolarHBondContact O-N 2.93Å
102	K	49	Very low	44.4	Very low	79 Å²	79	64.4 Å²	64.4	34%	0.343	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-106.4	-1.4	-173.3	-56	-174.9	-176	-179.8	0	114.1	C31 A99 R100 G104 D105 V106	C31-K102 PolarHBondContact O-NZ 2.84Å; A99-K102 PolarHBondContact O-N 3.02Å; R100-K102 PolarHBondContact O-N 3.42Å; K102-G104 VanDerWaalsContact C-N 3.31Å; K102-G104 PolarHBondContact O-N 3.19Å; K102-D105 PolarHBondContact O-N 3.41Å; K102-V106 WeakPolarHBondContact O-CG2 3.39Å; K102-V106 PolarHBondContact O-N 2.81Å
103	I	50.8	Low	44.5	Very low	12 Å²	12	64.1 Å²	64.1	6%	0.062	33%	0.333	C	S	.	.	H	α-helix	trans	-65.9	-34.7	-173.7	-65.4	178.2	0	0	0	111.5	I6 V98 R100 V106 Q107 L126	I6-I103 HydrophobicContact CB-CD1 4.39Å; I6-I103 HydrophobicContact CD1-CD1 4.06Å; V98-I103 HydrophobicContact CB-CG1 4.46Å; V98-I103 HydrophobicContact CG1-CG1 3.97Å; R100-I103 PolarHBondContact O-N 3.43Å; R100-I103 VanDerWaalsContact O-N 3.16Å; I103-V106 PolarHBondContact O-N 3.19Å; I103-Q107 WeakPolarHBondContact O-CB 3.45Å; I103-Q107 PolarHBondContact O-N 3.48Å; I103-L126 HydrophobicContact CG2-CD2 4.37Å; I103-L126 HydrophobicContact CG2-CG 4.39Å
104	G	48	Very low	44.7	Very low	45 Å²	45	67 Å²	67	46%	0.464	35%	0.345	S	S	.	.	H	α-helix	trans	-64.2	-45.7	173.2	0	0	0	0	0	112.5	K102 V106 Q107 E108	K102-G104 VanDerWaalsContact C-N 3.31Å; K102-G104 PolarHBondContact O-N 3.19Å; G104-V106 VanDerWaalsContact C-N 3.31Å; G104-V106 PolarHBondContact O-N 3.41Å; G104-Q107 PolarHBondContact O-N 3.28Å; G104-Q107 VanDerWaalsContact O-N 3.15Å; G104-E108 PolarHBondContact O-N 3.16Å
105	D	52	Low	45.1	Very low	106 Å²	106	67.4 Å²	67.4	57%	0.567	35%	0.346	S	S	*	.	H	α-helix	trans	-60.8	-42.2	176.9	-46	-38.2	0	0	0	111	K102 V109	K102-D105 PolarHBondContact O-N 3.41Å; D105-V109 WeakPolarHBondContact O-CB 3.4Å; D105-V109 VanDerWaalsContact O-CG2 3.28Å; D105-V109 WeakPolarHBondContact O-CG2 3.48Å; D105-V109 PolarHBondContact O-N 3.34Å
106	V	49.6	Very low	45.5	Very low	12 Å²	12	70.6 Å²	70.6	7%	0.073	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-38.3	175.4	172.8	0	0	0	0	111.6	M24 L30 K102 I103 G104 A110 L118	M24-V106 HydrophobicContact CE-CB 4.47Å; M24-V106 HydrophobicContact CE-CG1 4.4Å; M24-V106 HydrophobicContact CE-CG2 4.16Å; L30-V106 HydrophobicContact CD2-CG2 4.14Å; K102-V106 WeakPolarHBondContact O-CG2 3.39Å; K102-V106 PolarHBondContact O-N 2.81Å; I103-V106 PolarHBondContact O-N 3.19Å; G104-V106 VanDerWaalsContact C-N 3.31Å; G104-V106 PolarHBondContact O-N 3.41Å; V106-A110 WeakPolarHBondContact O-CB 3.19Å; V106-A110 PolarHBondContact O-N 3.2Å; V106-L118 HydrophobicContact CG1-CD1 4.34Å; V106-L118 HydrophobicContact CG1-CD2 4.36Å
107	Q	47.7	Very low	45.8	Very low	57 Å²	57	71.5 Å²	71.5	27%	0.266	38%	0.378	S	S	.	.	H	α-helix	trans	-68.6	-43.3	178.3	-169.6	178.5	25.8	0	0	112.1	I103 G104 A110 R111 C122 S123 L126	I103-Q107 WeakPolarHBondContact O-CB 3.45Å; I103-Q107 PolarHBondContact O-N 3.48Å; G104-Q107 PolarHBondContact O-N 3.28Å; G104-Q107 VanDerWaalsContact O-N 3.15Å; Q107-A110 PolarHBondContact O-N 3.28Å; Q107-R111 WeakPolarHBondContact O-CB 3.29Å; Q107-R111 PolarHBondContact O-N 2.99Å; Q107-C122 HydrophobicContact CB-CB 4.33Å; Q107-C122 HydrophobicContact CG-CB 4.36Å; Q107-S123 PolarHBondContact NE2-OG 3.23Å; Q107-S123 VanDerWaalsContact NE2-OG 3.08Å; Q107-L126 VanDerWaalsContact OE1-CD1 3.25Å
108	E	48.1	Very low	46.5	Very low	106 Å²	106	70 Å²	70	50%	0.495	37%	0.372	S	S	.	.	H	α-helix	trans	-68	-39.3	177.8	-167.1	61.9	-161.6	0	0	111.2	G104 R111 L112	G104-E108 PolarHBondContact O-N 3.16Å; E108-R111 WeakPolarHBondContact O-CB 3.48Å; E108-R111 PolarHBondContact O-N 3.03Å; E108-L112 WeakPolarHBondContact O-CG 3.42Å; E108-L112 PolarHBondContact O-N 2.99Å
109	V	47.8	Very low	46.9	Very low	18 Å²	18	70.3 Å²	70.3	11%	0.109	38%	0.375	C	S	.	.	H	α-helix	trans	-69.8	-34.9	174.3	174.8	0	0	0	0	112	M24 D105 R111 L112 L113	M24-V109 HydrophobicContact CE-CB 3.92Å; M24-V109 HydrophobicContact CE-CG1 3.61Å; M24-V109 HydrophobicContact CG-CG1 3.78Å; M24-V109 HydrophobicContact SD-CG1 4.03Å; D105-V109 WeakPolarHBondContact O-CB 3.4Å; D105-V109 VanDerWaalsContact O-CG2 3.28Å; D105-V109 WeakPolarHBondContact O-CG2 3.48Å; D105-V109 PolarHBondContact O-N 3.34Å; V109-R111 VanDerWaalsContact C-N 3.28Å; V109-R111 PolarHBondContact O-N 2.68Å; V109-L112 CarbonylContact O-C 3.54Å; V109-L112 PolarHBondContact O-N 2.9Å; V109-L113 HydrophobicContact CG1-CD1 3.81Å; V109-L113 HydrophobicContact CG1-CG 4.3Å; V109-L113 WeakPolarHBondContact O-CB 3.35Å; V109-L113 VanDerWaalsContact O-CG 3.27Å; V109-L113 WeakPolarHBondContact O-CG 3.33Å; V109-L113 PolarHBondContact O-N 3.02Å
110	A	47.9	Very low	47.5	Very low	1 Å²	1	71.7 Å²	71.7	1%	0.008	38%	0.379	C	S	.	.	H	α-helix	trans	-62.8	-35.9	171.9	0	0	0	0	0	112.2	V106 Q107 L113 D114 C115 L118	V106-A110 WeakPolarHBondContact O-CB 3.19Å; V106-A110 PolarHBondContact O-N 3.2Å; Q107-A110 PolarHBondContact O-N 3.28Å; A110-L113 PolarHBondContact O-N 2.83Å; A110-D114 PolarHBondContact O-N 3.18Å; A110-C115 PolarHBondContact O-N 3.21Å; A110-L118 HydrophobicContact CB-CB 4.17Å; A110-L118 HydrophobicContact CB-CD2 3.74Å; A110-L118 HydrophobicContact CB-CG 3.77Å
111	R	51.5	Low	48.1	Very low	175 Å²	175	69.3 Å²	69.3	66%	0.66	37%	0.373	S	S	*	.	H	α-helix	trans	-70.3	-32.6	172.8	178.5	-178.3	172.3	76.7	7.3	112.8	Q107 E108 V109 L113	Q107-R111 WeakPolarHBondContact O-CB 3.29Å; Q107-R111 PolarHBondContact O-N 2.99Å; E108-R111 WeakPolarHBondContact O-CB 3.48Å; E108-R111 PolarHBondContact O-N 3.03Å; V109-R111 VanDerWaalsContact C-N 3.28Å; V109-R111 PolarHBondContact O-N 2.68Å; R111-L113 VanDerWaalsContact C-N 3.3Å
112	L	43.3	Very low	48.4	Very low	128 Å²	128	62.3 Å²	62.3	67%	0.67	34%	0.335	S	S	*	.	H	α-helix	trans	-78.4	-11.2	173.6	-70.1	167.4	0	0	0	113.9	E108 V109	E108-L112 WeakPolarHBondContact O-CG 3.42Å; E108-L112 PolarHBondContact O-N 2.99Å; V109-L112 CarbonylContact O-C 3.54Å; V109-L112 PolarHBondContact O-N 2.9Å
113	L	41.2	Very low	48.6	Very low	41 Å²	41	60.7 Å²	60.7	22%	0.215	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	11.3	178.5	-66.5	175.6	0	0	0	112.9	M24 V109 A110 R111 C115	M24-L113 HydrophobicContact CG-CD1 3.82Å; M24-L113 HydrophobicContact SD-CD1 4.46Å; V109-L113 HydrophobicContact CG1-CD1 3.81Å; V109-L113 HydrophobicContact CG1-CG 4.3Å; V109-L113 WeakPolarHBondContact O-CB 3.35Å; V109-L113 VanDerWaalsContact O-CG 3.27Å; V109-L113 WeakPolarHBondContact O-CG 3.33Å; V109-L113 PolarHBondContact O-N 3.02Å; A110-L113 PolarHBondContact O-N 2.83Å; R111-L113 VanDerWaalsContact C-N 3.3Å; L113-C115 PolarHBondContact O-N 3.22Å; L113-C115 PolarHBondContact O-SG 3.46Å
114	D	42.3	Very low	48.7	Very low	154 Å²	154	64.6 Å²	64.6	82%	0.824	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	30.3	-176.4	-67.3	-36.6	0	0	0	114.4	A110 E116	A110-D114 PolarHBondContact O-N 3.18Å; D114-E116 PolarHBondContact O-N 3.11Å; D114-E116 VanDerWaalsContact O-N 3.11Å
115	C	48.8	Very low	48.9	Very low	21 Å²	21	63.5 Å²	63.5	14%	0.142	34%	0.341	C	S	.	.			trans	-90.5	72.7	-173.7	-75.6	0	0	0	0	112	S20 A110 L113 G117 L118 S119	S20-C115 PolarHBondContact OG-SG 2.85Å; A110-C115 PolarHBondContact O-N 3.21Å; L113-C115 PolarHBondContact O-N 3.22Å; L113-C115 PolarHBondContact O-SG 3.46Å; C115-G117 VanDerWaalsContact C-N 3.33Å; C115-G117 PolarHBondContact O-N 3.17Å; C115-L118 HydrophobicContact CB-CB 4.25Å; C115-L118 PolarHBondContact O-N 3.27Å; C115-S119 PolarHBondContact O-N 3.06Å
116	E	42.8	Very low	49	Very low	160 Å²	160	62.6 Å²	62.6	75%	0.748	34%	0.336	S	S	*	.	H	α-helix	trans	-50.8	-44.7	-172.9	-161.3	166.7	-132.5	0	0	113.6	D114 L118 S119 V120	D114-E116 PolarHBondContact O-N 3.11Å; D114-E116 VanDerWaalsContact O-N 3.11Å; E116-L118 PolarHBondContact O-N 3.49Å; E116-S119 WeakPolarHBondContact O-CB 3.28Å; E116-S119 PolarHBondContact O-N 3.17Å; E116-V120 WeakPolarHBondContact O-CG2 3.48Å; E116-V120 PolarHBondContact O-N 3.34Å
117	G	46.3	Very low	49.2	Very low	47 Å²	47	66.6 Å²	66.6	49%	0.485	36%	0.364	S	S	.	.	H	α-helix	trans	-64.2	-34.7	178.1	0	0	0	0	0	115	C115 V121	C115-G117 VanDerWaalsContact C-N 3.33Å; C115-G117 PolarHBondContact O-N 3.17Å; G117-V121 WeakPolarHBondContact O-CG2 3.5Å; G117-V121 PolarHBondContact O-N 2.9Å; G117-V121 VanDerWaalsContact O-N 3.17Å
118	L	52.8	Low	49.3	Very low	18 Å²	18	67.6 Å²	67.6	9%	0.094	38%	0.382	C	S	.	.	H	α-helix	trans	-73.1	-39.8	174.4	176.9	58.9	0	0	0	110.5	L17 V106 A110 C115 E116 V120 V121 C122	L17-L118 HydrophobicContact CD1-CB 4.1Å; L17-L118 HydrophobicContact CD1-CD1 3.88Å; L17-L118 HydrophobicContact CD1-CG 4.45Å; V106-L118 HydrophobicContact CG1-CD1 4.34Å; V106-L118 HydrophobicContact CG1-CD2 4.36Å; A110-L118 HydrophobicContact CB-CB 4.17Å; A110-L118 HydrophobicContact CB-CD2 3.74Å; A110-L118 HydrophobicContact CB-CG 3.77Å; C115-L118 HydrophobicContact CB-CB 4.25Å; C115-L118 PolarHBondContact O-N 3.27Å; E116-L118 PolarHBondContact O-N 3.49Å; L118-V120 PolarHBondContact O-N 2.95Å; L118-V121 PolarHBondContact O-N 3.06Å; L118-C122 WeakPolarHBondContact O-CB 3.3Å; L118-C122 PolarHBondContact O-N 2.88Å; L118-C122 PolarHBondContact O-SG 3.43Å; L118-C122 VanDerWaalsContact O-SG 3.42Å
119	S	49.4	Very low	49.4	Very low	35 Å²	35	65.4 Å²	65.4	25%	0.245	39%	0.389	C	S	.	.	H	α-helix	trans	-59.9	-43	174.8	-173.5	0	0	0	0	112.2	C115 E116 S123	C115-S119 PolarHBondContact O-N 3.06Å; E116-S119 WeakPolarHBondContact O-CB 3.28Å; E116-S119 PolarHBondContact O-N 3.17Å; S119-S123 WeakPolarHBondContact O-CB 3.47Å; S119-S123 PolarHBondContact O-N 2.89Å; S119-S123 PolarHBondContact O-OG 3.42Å
120	V	52.5	Low	49.3	Very low	70 Å²	70	68.2 Å²	68.2	42%	0.424	41%	0.406	S	S	.	.	H	α-helix	trans	-62.7	-52.3	174.9	170.9	0	0	0	0	110.9	E116 L118 C122 S123 D124	E116-V120 WeakPolarHBondContact O-CG2 3.48Å; E116-V120 PolarHBondContact O-N 3.34Å; L118-V120 PolarHBondContact O-N 2.95Å; V120-C122 VanDerWaalsContact C-N 3.3Å; V120-C122 PolarHBondContact O-N 3.25Å; V120-S123 CarbonylContact O-C 3.49Å; V120-S123 WeakPolarHBondContact O-CA 3.49Å; V120-S123 WeakPolarHBondContact O-CB 3.45Å; V120-S123 PolarHBondContact O-N 3.45Å; V120-D124 PolarHBondContact O-N 3.15Å
121	V	53.7	Low	48.7	Very low	21 Å²	21	75.1 Å²	75.1	13%	0.127	44%	0.442	C	S	.	.	H	α-helix	trans	-60.9	-36.7	-179.3	172.4	0	0	0	0	112.4	L8 G117 L118 A125	L8-V121 HydrophobicContact CB-CG1 4.23Å; L8-V121 HydrophobicContact CD2-CG1 4.47Å; G117-V121 WeakPolarHBondContact O-CG2 3.5Å; G117-V121 PolarHBondContact O-N 2.9Å; G117-V121 VanDerWaalsContact O-N 3.17Å; L118-V121 PolarHBondContact O-N 3.06Å; V121-A125 WeakPolarHBondContact O-CB 3.28Å; V121-A125 PolarHBondContact O-N 3.11Å; V121-A125 VanDerWaalsContact O-N 3.09Å
122	C	51.6	Low	47.7	Very low	3 Å²	3	73.8 Å²	73.8	2%	0.02	44%	0.443	C	S	.	.	H	α-helix	trans	-67.3	-37.9	171.8	-71.8	0	0	0	0	112.5	Q107 L118 V120 A125 L126	Q107-C122 HydrophobicContact CB-CB 4.33Å; Q107-C122 HydrophobicContact CG-CB 4.36Å; L118-C122 WeakPolarHBondContact O-CB 3.3Å; L118-C122 PolarHBondContact O-N 2.88Å; L118-C122 PolarHBondContact O-SG 3.43Å; L118-C122 VanDerWaalsContact O-SG 3.42Å; V120-C122 VanDerWaalsContact C-N 3.3Å; V120-C122 PolarHBondContact O-N 3.25Å; C122-A125 PolarHBondContact O-N 3.03Å; C122-L126 WeakPolarHBondContact O-CB 3.05Å; C122-L126 WeakPolarHBondContact O-CD1 3.2Å; C122-L126 VanDerWaalsContact O-CG 3.24Å; C122-L126 WeakPolarHBondContact O-CG 3.48Å; C122-L126 PolarHBondContact O-N 3.21Å
123	S	52.4	Low	47.1	Very low	44 Å²	44	78.4 Å²	78.4	31%	0.308	45%	0.451	S	S	.	.	H	α-helix	trans	-70.6	-37.3	178.2	-56.5	0	0	0	0	112.5	Q107 S119 V120 L126 S127	Q107-S123 PolarHBondContact NE2-OG 3.23Å; Q107-S123 VanDerWaalsContact NE2-OG 3.08Å; S119-S123 WeakPolarHBondContact O-CB 3.47Å; S119-S123 PolarHBondContact O-N 2.89Å; S119-S123 PolarHBondContact O-OG 3.42Å; V120-S123 CarbonylContact O-C 3.49Å; V120-S123 WeakPolarHBondContact O-CA 3.49Å; V120-S123 WeakPolarHBondContact O-CB 3.45Å; V120-S123 PolarHBondContact O-N 3.45Å; S123-L126 PolarHBondContact O-N 3.04Å; S123-S127 WeakPolarHBondContact O-CB 3.47Å; S123-S127 PolarHBondContact O-N 3.2Å; S123-S127 PolarHBondContact O-OG 3.48Å
124	D	52.3	Low	46.5	Very low	95 Å²	95	82.7 Å²	82.7	51%	0.508	48%	0.481	S	S	.	.	H	α-helix	trans	-65	-43.4	173.4	-68.7	-14.3	0	0	0	110.6	V120 L126 S127 A128	V120-D124 PolarHBondContact O-N 3.15Å; D124-L126 VanDerWaalsContact C-N 3.31Å; D124-L126 PolarHBondContact O-N 3Å; D124-S127 WeakPolarHBondContact CA-OG 3.44Å; D124-S127 PolarHBondContact O-N 3.45Å; D124-S127 PolarHBondContact O-OG 3.44Å; D124-S127 VanDerWaalsContact O-OG 3.13Å; D124-A128 WeakPolarHBondContact O-CB 3.28Å; D124-A128 PolarHBondContact O-N 3.15Å
125	A	53.3	Low	45.8	Very low	21 Å²	21	82.8 Å²	82.8	17%	0.174	47%	0.474	C	S	.	.	H	α-helix	trans	-66.3	-29.9	176	0	0	0	0	0	113.8	L8 V121 C122	L8-A125 HydrophobicContact CD2-CB 3.4Å; V121-A125 WeakPolarHBondContact O-CB 3.28Å; V121-A125 PolarHBondContact O-N 3.11Å; V121-A125 VanDerWaalsContact O-N 3.09Å; C122-A125 PolarHBondContact O-N 3.03Å
126	L	54.3	Low	44.8	Very low	88 Å²	88	86.3 Å²	86.3	46%	0.461	50%	0.499	S	S	.	.	H	α-helix	trans	-77.7	-40	174.2	-72.8	166.4	0	0	0	112	I103 Q107 C122 S123 D124 A128 G129	I103-L126 HydrophobicContact CG2-CD2 4.37Å; I103-L126 HydrophobicContact CG2-CG 4.39Å; Q107-L126 VanDerWaalsContact OE1-CD1 3.25Å; C122-L126 WeakPolarHBondContact O-CB 3.05Å; C122-L126 WeakPolarHBondContact O-CD1 3.2Å; C122-L126 VanDerWaalsContact O-CG 3.24Å; C122-L126 WeakPolarHBondContact O-CG 3.48Å; C122-L126 PolarHBondContact O-N 3.21Å; S123-L126 PolarHBondContact O-N 3.04Å; D124-L126 VanDerWaalsContact C-N 3.31Å; D124-L126 PolarHBondContact O-N 3Å; L126-A128 VanDerWaalsContact C-N 3.33Å; L126-G129 PolarHBondContact O-N 3.34Å
127	S	54	Low	44	Very low	95 Å²	95	89 Å²	89	66%	0.664	51%	0.509	S	S	*	.	H	α-helix	trans	-73.9	-21.2	177.2	57.3	0	0	0	0	113.6	S123 D124 G129	S123-S127 WeakPolarHBondContact O-CB 3.47Å; S123-S127 PolarHBondContact O-N 3.2Å; S123-S127 PolarHBondContact O-OG 3.48Å; D124-S127 WeakPolarHBondContact CA-OG 3.44Å; D124-S127 PolarHBondContact O-N 3.45Å; D124-S127 PolarHBondContact O-OG 3.44Å; D124-S127 VanDerWaalsContact O-OG 3.13Å; S127-G129 PolarHBondContact O-N 2.82Å
128	A	49	Very low	43.3	Very low	78 Å²	78	91.8 Å²	91.8	65%	0.645	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	1	168.5	0	0	0	0	0	114.8	D124 L126	D124-A128 WeakPolarHBondContact O-CB 3.28Å; D124-A128 PolarHBondContact O-N 3.15Å; L126-A128 VanDerWaalsContact C-N 3.33Å
129	G	49.9	Very low	41.9	Very low	61 Å²	61	96.6 Å²	96.6	63%	0.629	55%	0.55	S	S	*	.			trans	88.2	35.9	149.8	0	0	0	0	0	117.6	L126 S127	L126-G129 PolarHBondContact O-N 3.34Å; S127-G129 PolarHBondContact O-N 2.82Å
130	V	46.2	Very low	40.7	Very low	77 Å²	77	101.3 Å²	101.3	47%	0.467	57%	0.572	S	S	.	*			trans	-125.2	73.4	177.1	-156.2	0	0	0	0	114.8	R100	R100-V130 PolarHBondContact NH1-O 3.41Å
131	L	34.3	Very low	39.6	Very low	146 Å²	146	102 Å²	102	76%	0.764	58%	0.58	S	S	*	*			trans	101.4	157.7	160.4	-60	170.3	0	0	0	119
132	E	32	Very low	38.2	Very low	146 Å²	146	110.4 Å²	110.4	68%	0.682	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-71.1	163.1	-163.6	-61.6	-171.1	127.9	0	0	115.8	K135	E132-K135 IonicContact OE1-NZ 3.27Å; E132-K135 PolarHBondContact OE1-NZ 3.03Å; E132-K135 VanDerWaalsContact OE1-NZ 3.08Å; E132-K135 IonicContact OE2-NZ 3.08Å; E132-K135 PolarHBondContact OE2-NZ 3Å
133	R	29.7	Very low	37.1	Very low	226 Å²	226	116 Å²	116	85%	0.853	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-55.6	141.3	163.3	-67.5	179.6	172.6	-171.8	-3.8	111.4	K135	R133-K135 PolarHBondContact O-N 3.17Å
134	P	28.7	Very low	35.8	Very low	130 Å²	130	121.9 Å²	121.9	84%	0.844	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-63.1	120.2	168.2	27.5	-33.2	0	0	0	109.9	S136	P134-S136 PolarHBondContact O-N 3.18Å
135	K	28.4	Very low	34.5	Very low	156 Å²	156	123.6 Å²	123.6	68%	0.678	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-75.5	122.7	177.8	-72.9	160.4	180	154.5	0	109.1	E132 R133	E132-K135 IonicContact OE1-NZ 3.27Å; E132-K135 PolarHBondContact OE1-NZ 3.03Å; E132-K135 VanDerWaalsContact OE1-NZ 3.08Å; E132-K135 IonicContact OE2-NZ 3.08Å; E132-K135 PolarHBondContact OE2-NZ 3Å; R133-K135 PolarHBondContact O-N 3.17Å
136	S	28.3	Very low	33.2	Very low	95 Å²	95	126.4 Å²	126.4	66%	0.664	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-61.7	133.2	174.6	46.8	0	0	0	0	110.7	P134 T138	P134-S136 PolarHBondContact O-N 3.18Å; S136-T138 PolarHBondContact O-N 3.07Å
137	K	25.6	Very low	31.7	Very low	218 Å²	218	126.2 Å²	126.2	95%	0.948	73%	0.729	S	S	*	*			trans	-77.4	71.8	166.6	-78.3	-169.2	174.1	-174.7	0	110.6
138	T	31	Very low	30.2	Very low	104 Å²	104	125.4 Å²	125.4	64%	0.638	74%	0.735	S	S	*	*			trans	-81	146.8	149.1	45.9	0	0	0	0	108.5	S136	S136-T138 PolarHBondContact O-N 3.07Å
139	C	23.2	Very low	28.9	Very low	119 Å²	119	131.2 Å²	131.2	80%	0.804	75%	0.749	S	S	*	*			trans	-118.9	130	148.7	42.5	0	0	0	0	106.4
140	D	24.5	Very low	27.7	Very low	134 Å²	134	135.9 Å²	135.9	72%	0.717	76%	0.759	S	S	*	*			cis	79	134.8	49.3	-77.4	-52.3	0	0	0	113.6
141	S	28.8	Very low	26.9	Very low	85 Å²	85	138.3 Å²	138.3	59%	0.594	78%	0.776	S	S	*	*			cis	-174.2	151.6	-16.2	-119.5	0	0	0	0	111
142	K	25	Very low	26.4	Very low	198 Å²	198	134.3 Å²	134.3	86%	0.861	77%	0.77	S	S	*	*			trans	174.6	132.5	144.3	-98.8	157	-174.8	175	0	109.7
143	V	27.6	Very low	26.1	Very low	121 Å²	121	132.1 Å²	132.1	73%	0.733	78%	0.777	S	S	*	*			cis	79.8	122	16.8	-168	0	0	0	0	115.9
144	K	26.8	Very low	25.7	Very low	166 Å²	166	129.8 Å²	129.8	72%	0.722	78%	0.776	S	S	*	*			trans	145.3	145.2	152.6	-83.9	-168.8	148.1	-69.1	0	109.9
145	D	24.4	Very low	25.4	Very low	131 Å²	131	132.1 Å²	132.1	70%	0.701	77%	0.773	S	S	*	*			cis	-151.4	166.3	-9.2	-87.5	-39.3	0	0	0	107.1
146	G	25.4	Very low	25.1	Very low	80 Å²	80	130.7 Å²	130.7	83%	0.825	78%	0.776	S	S	*	*			cis	156.8	42.3	-4.8	0	0	0	0	0	116.9
147	G	23.5	Very low	24.9	Very low	85 Å²	85	133.1 Å²	133.1	88%	0.876	78%	0.782	S	S	*	*			trans	-173.4	165.1	179	0	0	0	0	0	115.8
148	G	22	Very low	24.9	Very low	77 Å²	77	126.6 Å²	126.6	79%	0.794	77%	0.769	S	S	*	*			trans	177.3	169.6	177	0	0	0	0	0	113.6
149	E	21.2	Very low	24.7	Very low	201 Å²	201	130.5 Å²	130.5	94%	0.939	78%	0.777	S	S	*	*			trans	-154	166	174.8	-118.1	179.2	125.7	0	0	111.9
150	L	25.4	Very low	24.8	Very low	159 Å²	159	134.4 Å²	134.4	83%	0.832	78%	0.78	S	S	*	*			trans	-90.4	148.7	-179.8	-76	165.4	0	0	0	111.4
151	P	29.7	Very low	24.8	Very low	127 Å²	127	136.8 Å²	136.8	83%	0.825	79%	0.787	S	S	*	*				-132	167.4	84.5	38.1	-28.3	0	0	0	113.1
152	G	23.6	Very low	25.2	Very low	62 Å²	62	137.6 Å²	137.6	64%	0.639	79%	0.791	S	S	*	*			cis	135.6	119.8	-2.3	0	0	0	0	0	111.9
153	A	24.4	Very low	25.1	Very low	100 Å²	100	135.1 Å²	135.1	83%	0.826	79%	0.786	S	S	*	*			trans	56.4	145	170.6	0	0	0	0	0	118
154	E	22.3	Very low	24.9	Very low	177 Å²	177	137.9 Å²	137.9	83%	0.827	79%	0.788	S	S	*	*			cis	-158.2	-159.1	-22.9	-132.3	-165.3	126	0	0	108
155	K	23.2	Very low	24.8	Very low	180 Å²	180	140.2 Å²	140.2	78%	0.783	79%	0.792	S	S	*	*			trans	-83.1	156.9	179.5	-58.6	154.8	-173.8	157.2	0	112.4
156	V	21.6	Very low	24.8	Very low	125 Å²	125	141.5 Å²	141.5	76%	0.758	79%	0.794	S	S	*	*				159.4	143.8	118.7	160.1	0	0	0	0	110.7
157	D	23.1	Very low	24.7	Very low	146 Å²	146	145.3 Å²	145.3	78%	0.781	80%	0.795	S	S	*	*			trans	3.5	150.1	163.2	-63.1	-50.9	0	0	0	121
158	A	25.5	Very low	24.7	Very low	81 Å²	81	146.2 Å²	146.2	67%	0.669	79%	0.787	S	S	*	*			cis	-165.4	146.1	37.8	0	0	0	0	0	116.3
159	K	26.5	Very low	24.8	Very low	187 Å²	187	146.8 Å²	146.8	81%	0.813	78%	0.78	S	S	*	*			trans	52.8	137.3	131.9	-75.2	169.4	179	158.9	0	122.7
160	K	25.7	Very low	24.9	Very low	200 Å²	200	146 Å²	146	87%	0.87	78%	0.776	S	S	*	*			trans	90	109.8	151.2	-72.7	173	178.5	-178.3	0	119.8
161	Q	25.4	Very low	24.8	Very low	184 Å²	184	143.1 Å²	143.1	86%	0.86	77%	0.769	S	S	*	*			trans	-49.1	162	140.8	-72.3	-174.7	-0.1	0	0	111.7
162	P	36.2	Very low	24.9	Very low	103 Å²	103	142.2 Å²	142.2	67%	0.669	76%	0.763	S	S	*	*			cis	-151.3	173.6	34	44.1	-23.9	0	0	0	120.2
163	L	23.8	Very low	24.9	Very low	146 Å²	146	148.3 Å²	148.3	76%	0.764	77%	0.772	S	S	*	*			trans	65.8	129	143	-79.2	161.9	0	0	0	122.9
164	K	23.8	Very low	25	Very low	179 Å²	179	152.5 Å²	152.5	78%	0.778	77%	0.772	S	S	*	*			trans	84.4	141.2	143.1	-72.4	171.5	179.3	174.3	0	121.5
165	R	23.1	Very low	25.1	Very low	214 Å²	214	153.4 Å²	153.4	81%	0.808	78%	0.776	S	S	*	*			trans	69.3	129.2	155.7	-76.8	-169.2	152	153	-4.6	117.2
166	Q	25.6	Very low	25.3	Very low	158 Å²	158	150.7 Å²	150.7	74%	0.738	77%	0.77	S	S	*	*				72.6	109.7	59.6	-72.2	-169.3	-53.2	0	0	114.5
167	L	24.1	Very low	25.6	Very low	161 Å²	161	156.6 Å²	156.6	84%	0.843	78%	0.778	S	S	*	*			trans	-168.5	120.3	136.5	-96.7	143.1	0	0	0	104.9
168	S	22.7	Very low	25.8	Very low	103 Å²	103	158.5 Å²	158.5	72%	0.72	78%	0.78	S	S	*	*				55.8	121.8	57.1	140.2	0	0	0	0	111
169	S	23.1	Very low	25.9	Very low	90 Å²	90	164.8 Å²	164.8	63%	0.629	79%	0.792	S	S	*	*			cis	-155.6	-169.9	43.4	61.2	0	0	0	0	110.6
170	Q	24.9	Very low	25.9	Very low	184 Å²	184	164.9 Å²	164.9	86%	0.86	79%	0.793	S	S	*	*			cis	-154.6	-178.3	17.8	-144.4	160.5	114.5	0	0	111.2
171	S	22.3	Very low	25.9	Very low	99 Å²	99	162 Å²	162	69%	0.692	79%	0.786	S	S	*	*			trans	-129.3	174.2	-177.9	67.3	0	0	0	0	112
172	P	31	Very low	25.8	Very low	108 Å²	108	162 Å²	162	70%	0.701	78%	0.783	S	S	*	*				-143.2	139.7	120.1	34	-19.1	0	0	0	117
173	K	23.6	Very low	25.4	Very low	190 Å²	190	161.7 Å²	161.7	83%	0.826	79%	0.79	S	S	*	*			trans	51.3	106	137.3	-54.5	165.9	-171.6	172.6	0	117.8
174	K	26.9	Very low	25.5	Very low	187 Å²	187	165 Å²	165	81%	0.813	80%	0.798	S	S	*	*				61.6	124	67.2	-70	-166.7	172.9	-172.8	0	116.9
175	Q	25.7	Very low	25.6	Very low	196 Å²	196	162.4 Å²	162.4	92%	0.916	80%	0.797	S	S	*	*				-158.1	148.8	107.2	-106	-175.5	29	0	0	113.1
176	D	27.2	Very low	25.6	Very low	123 Å²	123	161.4 Å²	161.4	66%	0.658	80%	0.799	S	S	*	*			trans	-91.6	158	-179.8	-76.2	-101.3	0	0	0	113.1
177	R	26.5	Very low	25.7	Very low	249 Å²	249	160.9 Å²	160.9	94%	0.94	80%	0.796	S	S	*	*				-159.2	116.9	127.5	-114.9	166.7	-174.9	-165.6	1.7	115.3
178	K	28.7	Very low	25.8	Very low	186 Å²	186	163.6 Å²	163.6	81%	0.809	80%	0.795	S	S	*	*			trans	-84.8	152.2	162.9	-64.4	170.7	-179.8	169.2	0	110.5
179	K	26.5	Very low	26	Very low	213 Å²	213	167.6 Å²	167.6	93%	0.926	80%	0.8	S	S	*	*			trans	-154.4	158.4	147.5	-111.7	169.9	-173.9	-175.9	0	111.3
180	K	26.6	Very low	26.2	Very low	190 Å²	190	169.7 Å²	169.7	83%	0.826	81%	0.809	S	S	*	*			trans	-114.6	169.9	-175.1	-62.9	176.6	173.5	-180	0	110.7
181	L	25.5	Very low	26.3	Very low	139 Å²	139	167.6 Å²	167.6	73%	0.728	81%	0.809	S	S	*	*			trans	126.8	121.2	132.5	-71.8	140.4	0	0	0	117.7
182	K	23.1	Very low	26.3	Very low	183 Å²	183	169.3 Å²	169.3	80%	0.796	81%	0.81	S	S	*	*			trans	57.6	105.5	135.6	-66.2	-179.9	178.5	-175.4	0	121
183	A	27.7	Very low	26	Very low	98 Å²	98	171.9 Å²	171.9	81%	0.81	81%	0.813	S	S	*	*				23.6	136	115.5	0	0	0	0	0	120.9
184	K	26.3	Very low	26	Very low	215 Å²	215	167.9 Å²	167.9	94%	0.935	80%	0.804	S	S	*	*			trans	-146.3	150.3	151.4	-106.3	179.8	179.8	179.6	0	110.6
185	T	26	Very low	26	Very low	124 Å²	124	168.1 Å²	168.1	76%	0.761	81%	0.805	S	S	*	*			trans	-127.7	130.9	-177	-48.7	0	0	0	0	110.1
186	F	23.5	Very low	25.9	Very low	193 Å²	193	168 Å²	168	85%	0.846	80%	0.802	S	S	*	*			trans	-160.8	118.5	161.3	-122.6	-92.3	0	0	0	106.8
187	Q	27.6	Very low	25.9	Very low	148 Å²	148	170 Å²	170	69%	0.692	81%	0.812	S	S	*	*			cis	92.8	133.8	45.6	-89.3	-133.8	30.3	0	0	115.4
188	R	26.3	Very low	25.8	Very low	217 Å²	217	166.2 Å²	166.2	82%	0.819	80%	0.802	S	S	*	*			trans	77.2	153.6	169.2	-64.9	-177.5	171.6	-166.9	-4.8	118.3
189	K	27	Very low	25.8	Very low	187 Å²	187	163.9 Å²	163.9	81%	0.813	80%	0.798	S	S	*	*			cis	163.2	122.1	-39.1	-107.6	-172.5	176	-173	0	108.7
190	T	27.4	Very low	25.8	Very low	135 Å²	135	162.9 Å²	162.9	83%	0.828	79%	0.793	S	S	*	*			trans	175.1	147	157.3	30.9	0	0	0	0	108.9
191	T	26.6	Very low	25.8	Very low	139 Å²	139	162.5 Å²	162.5	85%	0.853	80%	0.799	S	S	*	*			cis	-150.6	-179.1	-13.5	-1.7	0	0	0	0	109.4
192	N	23.1	Very low	25.8	Very low	135 Å²	135	160.6 Å²	160.6	72%	0.722	80%	0.804	S	S	*	*			trans	-121.7	144.1	-162.1	-141.4	-2.1	0	0	0	113.8
193	Q	23.5	Very low	25.9	Very low	162 Å²	162	155.6 Å²	155.6	76%	0.757	80%	0.804	S	S	*	*			trans	60.2	152.1	156.6	-59.5	174	15.3	0	0	121.1
194	V	25.3	Very low	26	Very low	107 Å²	107	161.9 Å²	161.9	65%	0.648	81%	0.807	S	S	*	*				159	131	108.4	163.8	0	0	0	0	112.5
195	K	25.8	Very low	26	Very low	191 Å²	191	160.1 Å²	160.1	83%	0.83	80%	0.799	S	S	*	*			trans	63.4	132.7	168.5	-66.9	154.6	-162.1	168.7	0	117.5
196	K	24.6	Very low	26	Very low	194 Å²	194	160.1 Å²	160.1	84%	0.843	80%	0.799	S	S	*	*			cis	92.7	91.4	17.4	-167.8	-173.7	-177.6	175.6	0	116
197	L	26	Very low	26.2	Very low	165 Å²	165	157.6 Å²	157.6	86%	0.864	79%	0.794	S	S	*	*			trans	-172.1	155	149	-88.9	174	0	0	0	106.7
198	K	25.4	Very low	26	Very low	170 Å²	170	157 Å²	157	74%	0.739	79%	0.791	S	S	*	*			cis	174.8	133.2	-40.9	-125.1	-165.8	172.2	-172.6	0	104.5
199	L	27.3	Very low	26.1	Very low	136 Å²	136	156.3 Å²	156.3	71%	0.712	79%	0.788	S	S	*	*			trans	64	117.3	163.2	-81.2	75.7	0	0	0	117.3
200	K	26.6	Very low	26.2	Very low	193 Å²	193	155.9 Å²	155.9	84%	0.839	78%	0.781	S	S	*	*				76.6	110.4	78.1	-77.6	-170.2	-178.8	-177	0	113.7
201	L	27.9	Very low	26.2	Very low	181 Å²	181	155.4 Å²	155.4	95%	0.948	77%	0.773	S	S	*	*			trans	-144.2	152.8	142.4	-111	160.8	0	0	0	108.3
202	A	24.6	Very low	26.4	Very low	100 Å²	100	156.1 Å²	156.1	83%	0.826	76%	0.76	S	S	*	*			trans	-115.7	162.9	-176.5	0	0	0	0	0	109.9
203	G	25.9	Very low	26.5	Very low	78 Å²	78	158 Å²	158	80%	0.804	76%	0.758	S	S	*	*			trans	149.7	99.1	168.7	0	0	0	0	0	115.9
204	R	28.7	Very low	26.7	Very low	230 Å²	230	155 Å²	155	87%	0.868	76%	0.755	S	S	*	*			trans	-34.2	145.9	160.7	-86.7	171.4	162.3	162.9	-4.1	116.7
205	K	26.4	Very low	26.9	Very low	178 Å²	178	155.9 Å²	155.9	77%	0.774	76%	0.756	S	S	*	*			trans	86.4	112.9	132.9	-81.7	-177.8	174.1	-168.5	0	121.7
206	V	27.3	Very low	26.8	Very low	123 Å²	123	156 Å²	156	75%	0.745	76%	0.756	S	S	*	*				82.6	141.5	114.9	171.2	0	0	0	0	120.9
207	L	26.3	Very low	26.9	Very low	141 Å²	141	153 Å²	153	74%	0.738	75%	0.749	S	S	*	*			trans	77.1	107.1	163.8	-80.6	167.3	0	0	0	120.8
208	Q	24.7	Very low	26.7	Very low	135 Å²	135	153 Å²	153	63%	0.631	75%	0.75	S	S	*	*				62	112.2	113.4	-160.8	-154.6	93.4	0	0	120
209	R	27.2	Very low	27.5	Very low	202 Å²	202	150.1 Å²	150.1	76%	0.762	75%	0.749	S	S	*	*				174.6	152.4	117	-92.6	163.6	-168.9	-166.2	2	108.5
210	R	30.7	Very low	27.6	Very low	179 Å²	179	153.5 Å²	153.5	68%	0.675	76%	0.758	S	S	*	*			cis	136.4	141.2	8.7	-178	-158.5	-155.7	-176.1	9.6	104.8
211	L	27	Very low	27.8	Very low	124 Å²	124	152 Å²	152	65%	0.649	76%	0.759	S	S	*	*			trans	123.8	140.6	148.4	-66.2	174.1	0	0	0	114.4
212	R	30.1	Very low	27.8	Very low	155 Å²	155	153.1 Å²	153.1	59%	0.585	76%	0.756	S	S	*	*			cis	-177.7	-176.7	-21.9	-146	-160.4	-139.4	155.8	-1.9	110.4
213	Y	26.3	Very low	27.8	Very low	174 Å²	174	155.6 Å²	155.6	68%	0.682	76%	0.756	S	S	*	*			trans	82.9	143.4	158.8	-59.3	-59.1	0	0	0	115.9
214	S	27.5	Very low	27.8	Very low	98 Å²	98	160.4 Å²	160.4	69%	0.685	76%	0.757	S	S	*	*			cis	-167.7	165.6	-2.8	-106.5	0	0	0	0	108.1
215	L	28.6	Very low	27.6	Very low	127 Å²	127	153.6 Å²	153.6	67%	0.665	75%	0.75	S	S	*	*			cis	174.3	131.6	-24.5	-124.4	173.5	0	0	0	104.5
216	K	23.8	Very low	27.4	Very low	193 Å²	193	151.1 Å²	151.1	84%	0.839	75%	0.745	S	S	*	*			trans	145.5	132.2	160.2	-87.7	177.6	178.8	-170.1	0	109.7
217	D	26.1	Very low	27.4	Very low	130 Å²	130	153.2 Å²	153.2	70%	0.695	75%	0.747	S	S	*	*			cis	129	111.1	-8.1	-74	-32.8	0	0	0	108.8
218	D	22.6	Very low	27.4	Very low	166 Å²	166	151.1 Å²	151.1	89%	0.888	74%	0.744	S	S	*	*			trans	-139	148.7	172.1	-99.6	-51.2	0	0	0	110.1
219	P	41.3	Very low	27.7	Very low	110 Å²	110	153.3 Å²	153.3	71%	0.714	75%	0.754	S	S	*	*			trans	-128.1	146.2	-160.6	38.3	-21.5	0	0	0	118.8
220	K	29.1	Very low	27.6	Very low	206 Å²	206	149.1 Å²	149.1	90%	0.896	75%	0.747	S	S	*	*			trans	79.6	142.3	145	-81	-174	171.9	-174.6	0	122.7
221	D	31.3	Very low	27.5	Very low	163 Å²	163	149.9 Å²	149.9	87%	0.872	75%	0.75	S	S	*	*			trans	-66.2	158.5	163.1	-74.1	-69.9	0	0	0	114.7
222	K	28.3	Very low	27.5	Very low	204 Å²	204	150.6 Å²	150.6	89%	0.887	76%	0.76	S	S	*	*			trans	-80.7	165.2	171.4	-69.9	-172.7	175.6	-173.2	0	112.7
223	N	23.9	Very low	27.3	Very low	152 Å²	152	146.2 Å²	146.2	81%	0.813	76%	0.763	S	S	*	*			trans	-143.2	143.3	145.9	-150	-12.3	0	0	0	110.3
224	Q	25.7	Very low	27.3	Very low	178 Å²	178	146.9 Å²	146.9	83%	0.832	77%	0.772	S	S	*	*			trans	70.3	139.8	174.7	-60.6	-174.3	-13.9	0	0	121.3
225	A	24.9	Very low	27.2	Very low	87 Å²	87	149.1 Å²	149.1	72%	0.719	78%	0.777	S	S	*	*			trans	73.1	125.6	144.3	0	0	0	0	0	123.4
226	N	23.7	Very low	27.2	Very low	127 Å²	127	148.3 Å²	148.3	68%	0.679	78%	0.781	S	S	*	*			trans	69.6	129.1	136.8	-76.1	36	0	0	0	124.9
227	E	25.8	Very low	27.5	Very low	167 Å²	167	148 Å²	148	78%	0.78	78%	0.783	S	S	*	*			trans	83.1	129.6	130.5	-71.6	164	149.4	0	0	123.7
228	S	27.7	Very low	28.1	Very low	97 Å²	97	147 Å²	147	68%	0.678	78%	0.784	S	S	*	*			trans	64.7	111.1	143.2	62.2	0	0	0	0	123.7
229	E	29.9	Very low	28.4	Very low	180 Å²	180	147.2 Å²	147.2	84%	0.841	78%	0.779	S	S	*	*				76.7	140.1	120.1	-64.5	179.4	169.1	0	0	123.3
230	D	26.1	Very low	27.6	Very low	115 Å²	115	147.7 Å²	147.7	62%	0.615	78%	0.776	S	S	*	*			trans	59.8	152.4	144.8	-92.3	18.3	0	0	0	121.9
231	R	28.8	Very low	27.5	Very low	194 Å²	194	145.1 Å²	145.1	73%	0.732	77%	0.767	S	S	*	*			cis	-165.8	163.2	-21.4	-133.4	178.8	-162.9	121.6	-0.7	108.3
232	T	25.2	Very low	27.4	Very low	140 Å²	140	145.8 Å²	145.8	86%	0.859	77%	0.765	S	S	*	*			trans	59.9	154.6	163.5	51.1	0	0	0	0	117.8
233	G	26.2	Very low	27.1	Very low	63 Å²	63	142.6 Å²	142.6	65%	0.649	76%	0.758	S	S	*	*			cis	151	142.9	-7.1	0	0	0	0	0	111.4
234	E	27.4	Very low	27.3	Very low	187 Å²	187	142.2 Å²	142.2	87%	0.874	76%	0.755	S	S	*	*			trans	65.2	154.2	160.8	-71.4	158.3	-160.7	0	0	116.4
235	D	24.2	Very low	27.3	Very low	146 Å²	146	138.3 Å²	138.3	78%	0.781	75%	0.747	S	S	*	*			cis	-160	-173.9	-15	-133.6	-25.2	0	0	0	112.1
236	S	28.4	Very low	27.5	Very low	109 Å²	109	142.3 Å²	142.3	76%	0.762	75%	0.751	S	S	*	*			trans	85.5	116.3	150.3	71.1	0	0	0	0	122.4
237	E	30.9	Very low	27.6	Very low	186 Å²	186	142.6 Å²	142.6	87%	0.869	75%	0.748	S	S	*	*			trans	-84.1	169.3	137.2	-52.1	-179	125.3	0	0	108.4
238	P	39.1	Very low	27.7	Very low	110 Å²	110	141.9 Å²	141.9	71%	0.714	75%	0.745	S	S	*	*				-158.7	154.3	84.9	42.3	-22	0	0	0	119.2
239	E	28.3	Very low	27.7	Very low	170 Å²	170	144.4 Å²	144.4	79%	0.794	75%	0.746	S	S	*	*				64.2	147.8	128.2	-66.7	-179.5	169.6	0	0	127
240	N	24.2	Very low	27.4	Very low	121 Å²	121	141.6 Å²	141.6	65%	0.647	74%	0.737	S	S	*	*			trans	70.9	152.4	147.7	-65.8	8.7	0	0	0	121.5
241	E	27.5	Very low	27.4	Very low	151 Å²	151	142.7 Å²	142.7	71%	0.706	74%	0.741	S	S	*	*			cis	-153.6	137	-5.7	-112.3	156.5	-134.8	0	0	106.5
242	E	28.3	Very low	27.2	Very low	177 Å²	177	142.5 Å²	142.5	83%	0.827	75%	0.748	S	S	*	*				80.3	153.4	79.7	-62.7	-139.8	130.9	0	0	117.9
243	D	23.7	Very low	27.2	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	75%	0.745	S	S	*	*			trans	64.9	153.1	165.4	-85.7	17.8	0	0	0	124.2
244	L	26.7	Very low	27.2	Very low	143 Å²	143	148.9 Å²	148.9	75%	0.749	76%	0.761	S	S	*	*			cis	-169.3	-177.2	-47.4	-119.7	-173.6	0	0	0	110.4
245	S	26.7	Very low	27.1	Very low	96 Å²	96	143.9 Å²	143.9	67%	0.671	75%	0.752	S	S	*	*			trans	69.4	159.9	160.9	86.6	0	0	0	0	118
246	E	28.2	Very low	27.4	Very low	171 Å²	171	142.5 Å²	142.5	80%	0.799	75%	0.753	S	S	*	*			cis	-172.2	169	-27.5	-102.3	160	179.9	0	0	105
247	E	26.5	Very low	27.3	Very low	133 Å²	133	143.8 Å²	143.8	62%	0.621	75%	0.752	S	S	*	*			cis	-158.5	156.1	5.7	-133.4	-177.9	166.2	0	0	109.2
248	Q	27.3	Very low	27.2	Very low	152 Å²	152	142.3 Å²	142.3	71%	0.71	75%	0.75	S	S	*	*			trans	46	151	143.5	-74	163.2	32.2	0	0	122.2
249	E	27.4	Very low	26.8	Very low	151 Å²	151	144.6 Å²	144.6	71%	0.706	76%	0.756	S	S	*	*			cis	-160.5	170	6.8	-98.4	-102.2	117	0	0	106.3
250	N	24.8	Very low	26.7	Very low	121 Å²	121	144.1 Å²	144.1	65%	0.647	76%	0.758	S	S	*	*			cis	178.4	-163.7	-19.1	-176.6	12	0	0	0	108.1
251	I	26.3	Very low	26.8	Very low	137 Å²	137	147.2 Å²	147.2	70%	0.703	77%	0.766	S	S	*	*			trans	83.9	95.9	167.5	-51.2	-177.2	0	0	0	117.6
252	E	23.6	Very low	27	Very low	190 Å²	190	148.8 Å²	148.8	89%	0.888	77%	0.774	S	S	*	*			trans	41.6	130.4	135.4	-52	-166.9	142.4	0	0	122.4
253	G	25.6	Very low	27.1	Very low	77 Å²	77	148.6 Å²	148.6	79%	0.794	77%	0.773	S	S	*	*			trans	-166.6	28.2	178.7	0	0	0	0	0	120	A255	G253-A255 PolarHBondContact O-N 3.03Å
254	R	25.2	Very low	27.2	Very low	260 Å²	260	148.9 Å²	148.9	98%	0.981	77%	0.774	S	S	*	*			trans	-30.8	111.1	177.1	177.6	-168.8	-176.1	172.2	2.5	117
255	A	27.1	Very low	27.4	Very low	82 Å²	82	146.8 Å²	146.8	68%	0.678	78%	0.778	S	S	*	*			trans	-152.9	164.4	161.7	0	0	0	0	0	112.7	G253	G253-A255 PolarHBondContact O-N 3.03Å
256	S	29.5	Very low	27.6	Very low	117 Å²	117	150.5 Å²	150.5	82%	0.818	79%	0.785	S	S	*	*			trans	-121.6	98.4	-175.4	-60	0	0	0	0	112.2
257	D	26	Very low	27.6	Very low	136 Å²	136	148 Å²	148	73%	0.727	79%	0.786	S	S	*	*			trans	-83.4	120.4	-177.2	-70.9	-40.3	0	0	0	113.8	L259	D257-L259 HydrophobicContact CB-CD2 4.47Å; D257-L259 HydrophobicContact CB-CG 4.35Å
258	N	28.6	Very low	27.5	Very low	156 Å²	156	149 Å²	149	83%	0.834	80%	0.795	S	S	*	*			trans	-97.3	106.5	154.2	-66.7	-78.5	0	0	0	107.3	D260	N258-D260 PolarHBondContact O-N 3.36Å
259	L	31.5	Very low	27.6	Very low	158 Å²	158	149.2 Å²	149.2	83%	0.827	80%	0.801	S	S	*	*			trans	-92.1	91.3	172.6	-61.9	178.9	0	0	0	109.8	D257	D257-L259 HydrophobicContact CB-CD2 4.47Å; D257-L259 HydrophobicContact CB-CG 4.35Å
260	D	26	Very low	28.6	Very low	160 Å²	160	147.2 Å²	147.2	86%	0.856	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-83.7	128.3	153.1	-89.9	-44.1	0	0	0	107.5	N258	N258-D260 PolarHBondContact O-N 3.36Å
261	F	26.2	Very low	28.8	Very low	185 Å²	185	149.7 Å²	149.7	81%	0.811	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-82.4	127.5	-170	-163	-97.1	0	0	0	111.3
262	E	32.2	Very low	28.8	Very low	184 Å²	184	149.2 Å²	149.2	86%	0.86	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-76.7	145.6	169.3	-62.8	-170.2	130.8	0	0	110.6
263	E	29.5	Very low	28.9	Very low	174 Å²	174	144.7 Å²	144.7	81%	0.813	80%	0.798	S	S	*	*			trans	-153.7	148.7	157.3	-138.8	172.3	-139.6	0	0	110.2
264	D	25.9	Very low	29.1	Very low	143 Å²	143	148 Å²	148	77%	0.765	80%	0.796	S	S	*	*			trans	-76.7	160.3	-151	-76.2	-81.3	0	0	0	117.9
265	A	31.4	Very low	29.2	Very low	100 Å²	100	145.8 Å²	145.8	83%	0.826	79%	0.79	S	S	*	*			trans	-111.1	108.3	164.8	0	0	0	0	0	110.5
266	Q	30.5	Very low	29.3	Very low	174 Å²	174	147.1 Å²	147.1	81%	0.813	79%	0.789	S	S	*	*			trans	-135.2	95.1	173	-68.4	-172	7.3	0	0	112
267	S	28	Very low	29.2	Very low	118 Å²	118	148.5 Å²	148.5	83%	0.825	79%	0.787	S	S	*	*			trans	-171.1	100.2	147.8	47.5	0	0	0	0	111.7
268	N	26.2	Very low	29.5	Very low	153 Å²	153	150.4 Å²	150.4	82%	0.818	79%	0.792	S	S	*	*			trans	-90.6	137.6	149.4	-69.6	-21.6	0	0	0	107.3
269	D	29.3	Very low	30	Very low	157 Å²	157	151.2 Å²	151.2	84%	0.84	79%	0.791	S	S	*	*				-174.8	164.8	110.9	-99.3	-13.1	0	0	0	111.1
270	P	46.7	Very low	30	Very low	110 Å²	110	152.5 Å²	152.5	71%	0.714	79%	0.792	S	S	*	*			trans	-113	-178.6	-148.8	42.5	-36.5	0	0	0	113.9
271	Q	29.3	Very low	30.5	Very low	172 Å²	172	153.7 Å²	153.7	80%	0.804	79%	0.793	S	S	*	*			trans	-162.3	143.7	138.1	-107.7	-175.5	-74	0	0	112.9
272	D	26.2	Very low	30.9	Very low	128 Å²	128	153.1 Å²	153.1	68%	0.684	79%	0.793	S	S	*	*			trans	39.5	124.8	150	-61.5	-51.8	0	0	0	120.8
273	S	26.8	Very low	30.8	Very low	95 Å²	95	152.2 Å²	152.2	66%	0.664	79%	0.793	S	S	*	*				74	134.1	63.9	-157.1	0	0	0	0	111.5
274	L	29.5	Very low	31	Very low	146 Å²	146	151.5 Å²	151.5	76%	0.764	80%	0.795	S	S	*	*			cis	-144.7	164.6	35.1	-63.9	142.7	0	0	0	112
275	Y	26.9	Very low	31.5	Very low	214 Å²	214	154.2 Å²	154.2	84%	0.839	80%	0.803	S	S	*	*				-173.6	109.6	114.9	-120.1	-90.7	0	0	0	113.6
276	V	28.3	Very low	31.5	Very low	110 Å²	110	157 Å²	157	67%	0.667	80%	0.804	S	S	*	*			trans	36.2	137.3	146	-163.1	0	0	0	0	121.9
277	D	29.3	Very low	31.8	Very low	146 Å²	146	157.7 Å²	157.7	78%	0.781	81%	0.808	S	S	*	*			trans	-94.9	177.6	-178.2	-40.6	-99.3	0	0	0	114
278	E	31.1	Very low	32	Very low	176 Å²	176	160.1 Å²	160.1	82%	0.822	81%	0.806	S	S	*	*			trans	170.1	105.4	155.3	-95.7	159.6	-148.2	0	0	105.1
279	E	38.5	Very low	32	Very low	173 Å²	173	156.5 Å²	156.5	81%	0.808	81%	0.805	S	S	*	*				72.9	142.8	79.1	-66.8	178.8	-174	0	0	111.9
280	E	31.8	Very low	32	Very low	185 Å²	185	157.3 Å²	157.3	86%	0.864	80%	0.804	S	S	*	*			cis	-134.8	-146.5	18.6	-64.2	176.6	125.7	0	0	113.5
281	E	36.2	Very low	31.2	Very low	185 Å²	185	156.8 Å²	156.8	86%	0.864	80%	0.803	S	S	*	*			trans	-110.6	-177.9	-150.6	-61.1	-176.2	143.3	0	0	118.1
282	E	35.9	Very low	31.2	Very low	173 Å²	173	157.5 Å²	157.5	81%	0.808	81%	0.806	S	S	*	*			trans	-47.9	156.7	175.6	-54	178.5	151.3	0	0	118.7
283	D	28.7	Very low	31.4	Very low	164 Å²	164	160.4 Å²	160.4	88%	0.877	82%	0.816	S	S	*	*				179	161.4	122.1	-102	-23.2	0	0	0	113.1
284	D	35.3	Very low	32.1	Very low	159 Å²	159	164.4 Å²	164.4	85%	0.85	82%	0.824	S	S	*	*			trans	-104.1	164.2	-170.8	-68.2	-54.1	0	0	0	115
285	E	35.7	Very low	32.7	Very low	200 Å²	200	162.6 Å²	162.6	94%	0.935	82%	0.818	S	S	*	*			trans	-165.7	145.6	144.7	-115.4	174.8	-154	0	0	112.8
286	D	30.6	Very low	33.3	Very low	159 Å²	159	161.7 Å²	161.7	85%	0.85	82%	0.819	S	S	*	*			trans	-117.2	143.4	-175.9	-84.2	-56.4	0	0	0	112.4
287	E	37.2	Very low	33.9	Very low	188 Å²	188	168.6 Å²	168.6	88%	0.879	83%	0.833	S	S	*	*				177	172.2	117.2	-102.9	-160.3	166.6	0	0	116.6
288	E	31.9	Very low	34.5	Very low	169 Å²	169	168.3 Å²	168.3	79%	0.79	83%	0.83	S	S	*	*			trans	-38.1	149.7	-164.3	-53.6	-158.8	132.3	0	0	123.4
289	G	27.9	Very low	35.3	Very low	78 Å²	78	165.4 Å²	165.4	80%	0.804	83%	0.829	S	S	*	*			trans	-161.5	130.4	161.6	0	0	0	0	0	111.7
290	Q	28.6	Very low	35.8	Very low	173 Å²	173	165.7 Å²	165.7	81%	0.808	83%	0.828	S	S	*	*			trans	-89	129.5	-158	-65.3	177.3	-7.6	0	0	116.9
291	S	29.5	Very low	36.9	Very low	99 Å²	99	158.3 Å²	158.3	69%	0.692	80%	0.798	S	S	*	*			trans	60	163	140.2	61.7	0	0	0	0	122.5
292	E	29.4	Very low	38.2	Very low	187 Å²	187	156.6 Å²	156.6	87%	0.874	79%	0.79	S	S	*	*			trans	70.7	131.7	179.3	-56.2	-178.9	-178.5	0	0	114.7
293	E	31.4	Very low	39.4	Very low	190 Å²	190	150.5 Å²	150.5	89%	0.888	76%	0.761	S	S	*	*			cis	-139	166.3	1.1	-148	-177.2	-179.1	0	0	111.8
294	E	41	Very low	41	Very low	179 Å²	179	145.3 Å²	145.3	84%	0.836	74%	0.738	S	S	*	*			trans	-62.1	130.9	-172.8	-179.5	-176.6	164.8	0	0	114.6
295	V	41.4	Very low	42.5	Very low	107 Å²	107	138 Å²	138	65%	0.648	70%	0.699	S	S	*	*			trans	174.6	144.9	138.9	143.6	0	0	0	0	113
296	K	40.1	Very low	43.9	Very low	195 Å²	195	135.5 Å²	135.5	85%	0.848	69%	0.692	S	S	*	*			trans	73	37.7	166.4	-74.4	157.3	-161.7	163.1	0	120.8	I298	K296-I298 VanDerWaalsContact C-N 3.35Å; K296-I298 PolarHBondContact O-N 3.41Å
297	R	41.3	Very low	45.4	Very low	256 Å²	256	134.9 Å²	134.9	97%	0.966	68%	0.682	S	S	*	*			trans	-90.9	61.8	150.2	-82.8	-168	177.7	-179.4	1.8	112.9
298	I	41.9	Very low	47	Very low	140 Å²	140	128.4 Å²	128.4	72%	0.718	66%	0.656	S	S	*	*			trans	-134.5	89.1	163.4	-51.3	178	0	0	0	109.4	K296 K300	K296-I298 VanDerWaalsContact C-N 3.35Å; K296-I298 PolarHBondContact O-N 3.41Å; I298-K300 HydrophobicContact CG2-CG 4.01Å; I298-K300 PolarHBondContact O-N 2.94Å
299	S	46.9	Very low	48.6	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	66%	0.657	S	S	*	*			trans	-72.8	72.4	169.7	40.6	0	0	0	0	110.5	A301	S299-A301 PolarHBondContact O-N 3.42Å
300	K	49.7	Very low	50.6	Low	178 Å²	178	132 Å²	132	77%	0.774	65%	0.646	S	S	*	*			trans	-46.6	126.1	177.4	-79.1	-177.6	173.7	175.5	0	110.7	I298 Q302	I298-K300 HydrophobicContact CG2-CG 4.01Å; I298-K300 PolarHBondContact O-N 2.94Å; K300-Q302 PolarHBondContact O-N 3.34Å; K300-Q302 VanDerWaalsContact O-N 3.08Å
301	A	53.9	Low	52.4	Low	30 Å²	30	128 Å²	128	25%	0.248	63%	0.633	C	S	.	*			trans	-58.4	115.9	171.5	0	0	0	0	0	109.4	S299 F303 T311	S299-A301 PolarHBondContact O-N 3.42Å; A301-F303 VanDerWaalsContact C-N 3.28Å; A301-F303 PolarHBondContact O-N 2.83Å; A301-T311 HydrophobicContact CB-CG2 4.07Å
302	Q	62.8	Low	54.6	Low	149 Å²	149	125.2 Å²	125.2	70%	0.696	61%	0.609	S	S	*	*	S	Bend	trans	-73.1	-18.1	-158.2	-170.4	172.6	1.4	0	0	114.1	K300	K300-Q302 PolarHBondContact O-N 3.34Å; K300-Q302 VanDerWaalsContact O-N 3.08Å
303	F	61.9	Low	56.4	Low	46 Å²	46	122.2 Å²	122.2	20%	0.202	60%	0.595	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-131.1	123.5	-179.3	-52.9	-86.5	0	0	0	110.3	A301 T311 F312 E315 Y318	A301-F303 VanDerWaalsContact C-N 3.28Å; A301-F303 PolarHBondContact O-N 2.83Å; F303-T311 CarbonylContact O-C 3.43Å; F303-T311 WeakPolarHBondContact O-CA 3.43Å; F303-F312 HydrophobicContact CB-CB 4.43Å; F303-F312 PolarHBondContact N-O 2.92Å; F303-F312 VanDerWaalsContact N-O 3.16Å; F303-F312 PolarHBondContact O-N 2.9Å; F303-E315 HydrophobicContact CD1-CB 4.45Å; F303-E315 HydrophobicContact CD1-CG 4.32Å; F303-E315 HydrophobicContact CD2-CB 4.39Å; F303-E315 HydrophobicContact CE1-CB 3.9Å; F303-E315 HydrophobicContact CE1-CG 3.77Å; F303-E315 HydrophobicContact CE2-CB 3.85Å; F303-E315 HydrophobicContact CZ-CB 3.58Å; F303-E315 HydrophobicContact CZ-CG 3.95Å; F303-Y318 HydrophobicContact CB-CD1 3.83Å; F303-Y318 HydrophobicContact CB-CD2 3.94Å; F303-Y318 HydrophobicContact CB-CE1 4.37Å; F303-Y318 HydrophobicContact CB-CE2 4.47Å; F303-Y318 HydrophobicContact CB-CG 3.58Å; F303-Y318 AromaticContact CD1-CD1 3.93Å; F303-Y318 HydrophobicContact CD1-CD1 3.93Å; F303-Y318 HydrophobicContact CD1-CE1 4.32Å; F303-Y318 HydrophobicContact CG-CD1 4.17Å; F303-Y318 HydrophobicContact CG-CG 4.3Å
304	S	63.1	Low	58	Low	55 Å²	55	121.5 Å²	121.5	39%	0.385	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.9	139.4	177.3	61.4	0	0	0	0	111.2	N306 R310 Y318	S304-N306 PolarHBondContact O-N 3.39Å; S304-R310 WeakPolarHBondContact CA-O 3.48Å; S304-Y318 WeakPolarHBondContact O-CE2 3.23Å; S304-Y318 PolarHBondContact O-OH 3.28Å
305	C	67.3	Low	59.1	Low	4 Å²	4	117.5 Å²	117.5	3%	0.027	57%	0.567	C	S	.	*			trans	-88.3	106.3	-177.6	-171.6	0	0	0	0	111.8	K307 C308 Q309 R310 Y318 H321 H326	C305-K307 PolarHBondContact O-N 3.28Å; C305-C308 PolarHBondContact O-N 3.02Å; C305-Q309 VanDerWaalsContact O-CA 3.31Å; C305-Q309 WeakPolarHBondContact O-CA 3.46Å; C305-Q309 PolarHBondContact O-N 2.98Å; C305-R310 PolarHBondContact N-O 3.18Å; C305-Y318 HydrophobicContact CB-CE2 4.14Å; C305-H321 WeakPolarHBondContact CB-NE2 3.45Å; C305-H321 PolarHBondContact SG-NE2 3.29Å; C305-H321 VanDerWaalsContact SG-NE2 3.41Å; C305-H326 PolarHBondContact SG-CD2 3.49Å; C305-H326 PolarHBondContact SG-NE2 3.19Å
306	N	63.7	Low	60.4	Low	149 Å²	149	121 Å²	121	80%	0.797	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-15.8	178.6	-63.6	-14.7	0	0	0	114.7	S304	S304-N306 PolarHBondContact O-N 3.39Å
307	K	61.7	Low	61.7	Low	146 Å²	146	114.4 Å²	114.4	64%	0.635	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-18.2	176.2	-74	-173.7	174.8	-175.1	0	115.3	C305 H326	C305-K307 PolarHBondContact O-N 3.28Å; K307-H326 HydrophobicContact CD-CB 4.07Å
308	C	72	Confident	63.3	Low	51 Å²	51	104.7 Å²	104.7	35%	0.345	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.4	7.6	179.8	74.9	0	0	0	0	115.2	C305 R310 H321	C305-C308 PolarHBondContact O-N 3.02Å; C308-R310 PolarHBondContact O-N 3.18Å; C308-H321 PolarHBondContact SG-CE1 2.86Å; C308-H321 PolarHBondContact SG-NE2 2.93Å
309	Q	64.3	Low	64.5	Low	173 Å²	173	99.8 Å²	99.8	81%	0.808	49%	0.49	S	S	*	.			trans	56.1	7.7	178.5	-57.9	-176.6	5	0	0	116.5	C305 T311	C305-Q309 VanDerWaalsContact O-CA 3.31Å; C305-Q309 WeakPolarHBondContact O-CA 3.46Å; C305-Q309 PolarHBondContact O-N 2.98Å; Q309-T311 PolarHBondContact O-N 3.39Å
310	R	70.4	Confident	65.6	Low	149 Å²	149	101.7 Å²	101.7	56%	0.562	48%	0.484	S	S	*	.			trans	-65.9	131.3	172.7	-74.3	-178.1	165.6	166.4	-3.6	111.6	S304 C305 C308 F312	S304-R310 WeakPolarHBondContact CA-O 3.48Å; C305-R310 PolarHBondContact N-O 3.18Å; C308-R310 PolarHBondContact O-N 3.18Å; R310-F312 HydrophobicContact CB-CE2 3.72Å; R310-F312 HydrophobicContact CB-CZ 3.94Å; R310-F312 WeakPolarHBondContact O-CE2 3.42Å
311	T	67.2	Low	66.8	Low	89 Å²	89	93.8 Å²	93.8	55%	0.546	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	147.2	175.4	44.6	0	0	0	0	111.4	A301 F303 Q309	A301-T311 HydrophobicContact CB-CG2 4.07Å; F303-T311 CarbonylContact O-C 3.43Å; F303-T311 WeakPolarHBondContact O-CA 3.43Å; Q309-T311 PolarHBondContact O-N 3.39Å
312	F	75.7	Confident	67.5	Low	41 Å²	41	93.4 Å²	93.4	18%	0.18	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	136.5	-179.5	-58.8	-91.5	0	0	0	109.4	F303 R310 Y318 H321	F303-F312 HydrophobicContact CB-CB 4.43Å; F303-F312 PolarHBondContact N-O 2.92Å; F303-F312 VanDerWaalsContact N-O 3.16Å; F303-F312 PolarHBondContact O-N 2.9Å; R310-F312 HydrophobicContact CB-CE2 3.72Å; R310-F312 HydrophobicContact CB-CZ 3.94Å; R310-F312 WeakPolarHBondContact O-CE2 3.42Å; F312-Y318 AromaticContact CD2-CD2 3.91Å; F312-Y318 HydrophobicContact CD2-CD2 3.91Å; F312-Y318 HydrophobicContact CE2-CD2 4.36Å; F312-H321 HydrophobicContact CE1-CB 4.06Å; F312-H321 HydrophobicContact CE2-CB 4.25Å; F312-H321 AromaticContact CE2-CD2 3.35Å; F312-H321 WeakPolarHBondContact CE2-CD2 3.42Å; F312-H321 AromaticContact CE2-CG 3.85Å; F312-H321 HydrophobicContact CZ-CB 3.63Å; F312-H321 AromaticContact CZ-CD2 3.42Å; F312-H321 VanDerWaalsContact CZ-CD2 3.42Å; F312-H321 WeakPolarHBondContact CZ-CD2 3.41Å; F312-H321 AromaticContact CZ-CG 3.4Å; F312-H321 VanDerWaalsContact CZ-CG 3.4Å
313	H	66.4	Low	67.7	Low	125 Å²	125	89.3 Å²	89.3	58%	0.579	43%	0.431	S	S	*	.	S	Bend	trans	-83.3	-12.4	176.2	-64.5	-90.5	0	0	0	113.1
314	Y	66.2	Low	67.8	Low	175 Å²	175	91.5 Å²	91.5	69%	0.686	45%	0.448	S	S	*	.	S	Bend	trans	-130.8	129.4	-176.4	-56.8	-70.8	0	0	0	112.2	K316 S317 Y318	Y314-K316 VanDerWaalsContact C-N 3.33Å; Y314-K316 PolarHBondContact O-N 3.31Å; Y314-S317 WeakPolarHBondContact O-CB 3.49Å; Y314-S317 PolarHBondContact O-N 3.42Å; Y314-S317 VanDerWaalsContact O-N 3.08Å; Y314-Y318 PolarHBondContact O-N 3.12Å
315	E	64.3	Low	67.8	Low	95 Å²	95	96.3 Å²	96.3	44%	0.444	46%	0.459	S	S	.	.	H	α-helix	trans	-54.9	-44.2	-179.2	-167.4	-171.4	180	0	0	112.7	F303 S317 Y318 L319	F303-E315 HydrophobicContact CD1-CB 4.45Å; F303-E315 HydrophobicContact CD1-CG 4.32Å; F303-E315 HydrophobicContact CD2-CB 4.39Å; F303-E315 HydrophobicContact CE1-CB 3.9Å; F303-E315 HydrophobicContact CE1-CG 3.77Å; F303-E315 HydrophobicContact CE2-CB 3.85Å; F303-E315 HydrophobicContact CZ-CB 3.58Å; F303-E315 HydrophobicContact CZ-CG 3.95Å; E315-S317 PolarHBondContact O-N 3.03Å; E315-Y318 WeakPolarHBondContact O-CB 3.39Å; E315-Y318 PolarHBondContact O-N 2.95Å; E315-Y318 VanDerWaalsContact O-N 3.13Å; E315-L319 HydrophobicContact CG-CD1 3.85Å; E315-L319 HydrophobicContact CG-CG 4.22Å; E315-L319 WeakPolarHBondContact O-CB 3.16Å; E315-L319 WeakPolarHBondContact O-CG 3.41Å; E315-L319 PolarHBondContact O-N 3.28Å
316	K	66.8	Low	67.9	Low	180 Å²	180	98.6 Å²	98.6	78%	0.783	47%	0.469	S	S	*	.	H	α-helix	trans	-58.5	-36.2	178.9	-66.4	177.7	-179	173.3	0	112.4	Y314 K320	Y314-K316 VanDerWaalsContact C-N 3.33Å; Y314-K316 PolarHBondContact O-N 3.31Å; K316-K320 VanDerWaalsContact O-CB 3.28Å; K316-K320 WeakPolarHBondContact O-CB 3.21Å; K316-K320 PolarHBondContact O-N 2.8Å
317	S	67.9	Low	67.5	Low	57 Å²	57	94.5 Å²	94.5	40%	0.399	46%	0.463	S	S	.	.	H	α-helix	trans	-73.8	-39.5	177.7	-58.3	0	0	0	0	111.6	Y314 E315 H321	Y314-S317 WeakPolarHBondContact O-CB 3.49Å; Y314-S317 PolarHBondContact O-N 3.42Å; Y314-S317 VanDerWaalsContact O-N 3.08Å; E315-S317 PolarHBondContact O-N 3.03Å; S317-H321 WeakPolarHBondContact O-CB 3.27Å; S317-H321 PolarHBondContact O-N 3Å
318	Y	74.3	Confident	67.3	Low	51 Å²	51	91.1 Å²	91.1	20%	0.2	45%	0.454	C	S	.	.	H	α-helix	trans	-63.4	-48.4	174.3	171.3	-115.6	0	0	0	112.5	F303 S304 C305 F312 Y314 E315 H321 I322	F303-Y318 HydrophobicContact CB-CD1 3.83Å; F303-Y318 HydrophobicContact CB-CD2 3.94Å; F303-Y318 HydrophobicContact CB-CE1 4.37Å; F303-Y318 HydrophobicContact CB-CE2 4.47Å; F303-Y318 HydrophobicContact CB-CG 3.58Å; F303-Y318 AromaticContact CD1-CD1 3.93Å; F303-Y318 HydrophobicContact CD1-CD1 3.93Å; F303-Y318 HydrophobicContact CD1-CE1 4.32Å; F303-Y318 HydrophobicContact CG-CD1 4.17Å; F303-Y318 HydrophobicContact CG-CG 4.3Å; S304-Y318 WeakPolarHBondContact O-CE2 3.23Å; S304-Y318 PolarHBondContact O-OH 3.28Å; C305-Y318 HydrophobicContact CB-CE2 4.14Å; F312-Y318 AromaticContact CD2-CD2 3.91Å; F312-Y318 HydrophobicContact CD2-CD2 3.91Å; F312-Y318 HydrophobicContact CE2-CD2 4.36Å; Y314-Y318 PolarHBondContact O-N 3.12Å; E315-Y318 WeakPolarHBondContact O-CB 3.39Å; E315-Y318 PolarHBondContact O-N 2.95Å; E315-Y318 VanDerWaalsContact O-N 3.13Å; Y318-H321 PolarHBondContact O-N 3.3Å; Y318-I322 HydrophobicContact CD1-CD1 4.32Å; Y318-I322 HydrophobicContact CD2-CD1 4.05Å; Y318-I322 HydrophobicContact CE1-CD1 3.76Å; Y318-I322 HydrophobicContact CE2-CD1 3.45Å; Y318-I322 VanDerWaalsContact CE2-CD1 3.45Å; Y318-I322 HydrophobicContact CE2-CG1 4.23Å; Y318-I322 HydrophobicContact CG-CD1 4.45Å; Y318-I322 PolarHBondContact O-N 3.24Å; Y318-I322 WeakPolarHBondContact OH-CD1 3.25Å
319	L	68.8	Low	66.2	Low	38 Å²	38	96.8 Å²	96.8	20%	0.199	47%	0.473	C	S	.	.	H	α-helix	trans	-62.8	-42.9	176.5	-69.6	171.1	0	0	0	111.8	E315 H321 I322 S323 A330 V332	E315-L319 HydrophobicContact CG-CD1 3.85Å; E315-L319 HydrophobicContact CG-CG 4.22Å; E315-L319 WeakPolarHBondContact O-CB 3.16Å; E315-L319 WeakPolarHBondContact O-CG 3.41Å; E315-L319 PolarHBondContact O-N 3.28Å; L319-H321 VanDerWaalsContact C-N 3.35Å; L319-H321 PolarHBondContact O-N 3.41Å; L319-I322 PolarHBondContact O-N 3.01Å; L319-S323 VanDerWaalsContact O-CB 3.32Å; L319-S323 WeakPolarHBondContact O-CB 3.42Å; L319-S323 PolarHBondContact O-N 3.25Å; L319-A330 HydrophobicContact CD2-CB 3.72Å; L319-V332 HydrophobicContact CD1-CG2 3.57Å
320	K	68.9	Low	65.6	Low	154 Å²	154	90.7 Å²	90.7	67%	0.67	45%	0.452	S	S	*	.	H	α-helix	trans	-59.6	-46.1	173.6	-174	174.1	-177.2	177.2	0	111	K316 S323 T324	K316-K320 VanDerWaalsContact O-CB 3.28Å; K316-K320 WeakPolarHBondContact O-CB 3.21Å; K316-K320 PolarHBondContact O-N 2.8Å; K320-S323 PolarHBondContact O-N 3.08Å; K320-T324 WeakPolarHBondContact O-CG2 3.29Å; K320-T324 PolarHBondContact O-N 2.81Å; K320-T324 PolarHBondContact O-OG1 3.06Å
321	H	74.5	Confident	64.7	Low	12 Å²	12	90.5 Å²	90.5	6%	0.056	46%	0.457	C	S	.	.	H	α-helix	trans	-61.3	-46	177.3	159	61.3	0	0	0	112.8	C305 C308 F312 S317 Y318 L319 S323 T324 Y325 H326	C305-H321 WeakPolarHBondContact CB-NE2 3.45Å; C305-H321 PolarHBondContact SG-NE2 3.29Å; C305-H321 VanDerWaalsContact SG-NE2 3.41Å; C308-H321 PolarHBondContact SG-CE1 2.86Å; C308-H321 PolarHBondContact SG-NE2 2.93Å; F312-H321 HydrophobicContact CE1-CB 4.06Å; F312-H321 HydrophobicContact CE2-CB 4.25Å; F312-H321 AromaticContact CE2-CD2 3.35Å; F312-H321 WeakPolarHBondContact CE2-CD2 3.42Å; F312-H321 AromaticContact CE2-CG 3.85Å; F312-H321 HydrophobicContact CZ-CB 3.63Å; F312-H321 AromaticContact CZ-CD2 3.42Å; F312-H321 VanDerWaalsContact CZ-CD2 3.42Å; F312-H321 WeakPolarHBondContact CZ-CD2 3.41Å; F312-H321 AromaticContact CZ-CG 3.4Å; F312-H321 VanDerWaalsContact CZ-CG 3.4Å; S317-H321 WeakPolarHBondContact O-CB 3.27Å; S317-H321 PolarHBondContact O-N 3Å; Y318-H321 PolarHBondContact O-N 3.3Å; L319-H321 VanDerWaalsContact C-N 3.35Å; L319-H321 PolarHBondContact O-N 3.41Å; H321-S323 VanDerWaalsContact C-N 3.35Å; H321-S323 PolarHBondContact O-N 3.09Å; H321-T324 PolarHBondContact O-N 3.43Å; H321-Y325 AromaticContact ND1-CD2 3.34Å; H321-Y325 VanDerWaalsContact ND1-CD2 3.34Å; H321-Y325 WeakPolarHBondContact ND1-CD2 3.25Å; H321-Y325 AromaticContact ND1-CG 3.83Å; H321-Y325 WeakPolarHBondContact O-CB 3.33Å; H321-Y325 WeakPolarHBondContact O-CD2 3.35Å; H321-Y325 PolarHBondContact O-N 2.82Å; H321-H326 AromaticContact CE1-NE2 3.75Å; H321-H326 AromaticContact NE2-CD2 3.99Å; H321-H326 AromaticContact NE2-NE2 3.76Å
322	I	70.2	Confident	64.3	Low	23 Å²	23	89.1 Å²	89.1	12%	0.118	45%	0.448	C	S	.	.	H	α-helix	trans	-62	-43.5	176.7	-78.1	175.5	0	0	0	111.3	Y318 L319 H326 G327 V328	Y318-I322 HydrophobicContact CD1-CD1 4.32Å; Y318-I322 HydrophobicContact CD2-CD1 4.05Å; Y318-I322 HydrophobicContact CE1-CD1 3.76Å; Y318-I322 HydrophobicContact CE2-CD1 3.45Å; Y318-I322 VanDerWaalsContact CE2-CD1 3.45Å; Y318-I322 HydrophobicContact CE2-CG1 4.23Å; Y318-I322 HydrophobicContact CG-CD1 4.45Å; Y318-I322 PolarHBondContact O-N 3.24Å; Y318-I322 WeakPolarHBondContact OH-CD1 3.25Å; L319-I322 PolarHBondContact O-N 3.01Å; I322-H326 CarbonylContact O-C 3.58Å; I322-H326 WeakPolarHBondContact O-CA 3.44Å; I322-H326 WeakPolarHBondContact O-CB 3.37Å; I322-H326 PolarHBondContact O-N 2.9Å; I322-G327 PolarHBondContact O-N 3.15Å; I322-V328 HydrophobicContact CG2-CB 3.78Å; I322-V328 HydrophobicContact CG2-CG1 4.49Å; I322-V328 HydrophobicContact CG2-CG2 4.43Å
323	S	65.7	Low	63.7	Low	62 Å²	62	92.5 Å²	92.5	43%	0.434	47%	0.467	S	S	.	.	H	α-helix	trans	-61.4	-48.5	177.9	-173	0	0	0	0	111.7	L319 K320 H321 G327	L319-S323 VanDerWaalsContact O-CB 3.32Å; L319-S323 WeakPolarHBondContact O-CB 3.42Å; L319-S323 PolarHBondContact O-N 3.25Å; K320-S323 PolarHBondContact O-N 3.08Å; H321-S323 VanDerWaalsContact C-N 3.35Å; H321-S323 PolarHBondContact O-N 3.09Å; S323-G327 PolarHBondContact O-N 3.25Å
324	T	65	Low	63.9	Low	92 Å²	92	89.4 Å²	89.4	56%	0.564	45%	0.453	S	S	*	.	H	α-helix	trans	-82	-29.4	-175.3	63.7	0	0	0	0	115.2	K320 H321	K320-T324 WeakPolarHBondContact O-CG2 3.29Å; K320-T324 PolarHBondContact O-N 2.81Å; K320-T324 PolarHBondContact O-OG1 3.06Å; H321-T324 PolarHBondContact O-N 3.43Å
325	Y	62	Low	64	Low	157 Å²	157	87.9 Å²	87.9	62%	0.616	45%	0.446	S	S	*	.	H	α-helix	trans	-106	-16.6	-175.9	-68.9	-85.9	0	0	0	114.4	H321	H321-Y325 AromaticContact ND1-CD2 3.34Å; H321-Y325 VanDerWaalsContact ND1-CD2 3.34Å; H321-Y325 WeakPolarHBondContact ND1-CD2 3.25Å; H321-Y325 AromaticContact ND1-CG 3.83Å; H321-Y325 WeakPolarHBondContact O-CB 3.33Å; H321-Y325 WeakPolarHBondContact O-CD2 3.35Å; H321-Y325 PolarHBondContact O-N 2.82Å
326	H	70.5	Confident	64.5	Low	51 Å²	51	83.4 Å²	83.4	24%	0.236	43%	0.425	C	S	.	.	H	α-helix	trans	-129	2.8	-176.3	-60.9	-42.5	0	0	0	114.2	C305 K307 H321 I322 V328	C305-H326 PolarHBondContact SG-CD2 3.49Å; C305-H326 PolarHBondContact SG-NE2 3.19Å; K307-H326 HydrophobicContact CD-CB 4.07Å; H321-H326 AromaticContact CE1-NE2 3.75Å; H321-H326 AromaticContact NE2-CD2 3.99Å; H321-H326 AromaticContact NE2-NE2 3.76Å; I322-H326 CarbonylContact O-C 3.58Å; I322-H326 WeakPolarHBondContact O-CA 3.44Å; I322-H326 WeakPolarHBondContact O-CB 3.37Å; I322-H326 PolarHBondContact O-N 2.9Å; H326-V328 PolarHBondContact O-N 2.78Å; H326-V328 VanDerWaalsContact O-N 3.08Å
327	G	55.1	Low	64.6	Low	64 Å²	64	82.9 Å²	82.9	66%	0.66	43%	0.425	S	S	*	.			trans	69.1	2.9	170.2	0	0	0	0	0	115.7	I322 S323 K329	I322-G327 PolarHBondContact O-N 3.15Å; S323-G327 PolarHBondContact O-N 3.25Å; G327-K329 PolarHBondContact O-N 3.14Å
328	V	57.4	Low	64.5	Low	74 Å²	74	84.8 Å²	84.8	45%	0.448	44%	0.435	S	S	.	.			trans	-82.5	112.5	-178.4	-176.5	0	0	0	0	109.1	I322 H326 A330	I322-V328 HydrophobicContact CG2-CB 3.78Å; I322-V328 HydrophobicContact CG2-CG1 4.49Å; I322-V328 HydrophobicContact CG2-CG2 4.43Å; H326-V328 PolarHBondContact O-N 2.78Å; H326-V328 VanDerWaalsContact O-N 3.08Å; V328-A330 PolarHBondContact O-N 3.07Å
329	K	49.4	Very low	64.3	Low	171 Å²	171	84.3 Å²	84.3	74%	0.743	44%	0.438	S	S	*	.			trans	-69.5	77.5	172.2	-68.8	-175.5	179.2	179.1	0	110.8	G327 H331	G327-K329 PolarHBondContact O-N 3.14Å; K329-H331 PolarHBondContact O-CD2 2.84Å; K329-H331 PolarHBondContact O-N 2.84Å
330	A	50.8	Low	64.4	Low	45 Å²	45	87 Å²	87	37%	0.372	45%	0.451	S	S	.	.			trans	-74.3	87.3	175.4	0	0	0	0	0	110.7	L319 V328	L319-A330 HydrophobicContact CD2-CB 3.72Å; V328-A330 PolarHBondContact O-N 3.07Å
331	H	52.2	Low	64.5	Low	145 Å²	145	84.4 Å²	84.4	67%	0.671	44%	0.441	S	S	*	.			trans	-74.4	125.8	169.3	-68.6	-91.1	0	0	0	109.7	K329 I333	K329-H331 PolarHBondContact O-CD2 2.84Å; K329-H331 PolarHBondContact O-N 2.84Å; H331-I333 PolarHBondContact O-N 2.78Å; H331-I333 VanDerWaalsContact O-N 3.15Å
332	V	57.3	Low	64.2	Low	59 Å²	59	88 Å²	88	36%	0.358	46%	0.464	S	S	.	.			trans	-76.6	101.7	176.9	-177.4	0	0	0	0	108.7	L319 H334	L319-V332 HydrophobicContact CD1-CG2 3.57Å; V332-H334 PolarHBondContact O-CD2 2.73Å; V332-H334 PolarHBondContact O-N 2.86Å
333	I	64.3	Low	64.4	Low	113 Å²	113	88.9 Å²	88.9	58%	0.579	47%	0.467	S	S	*	.			trans	-85.3	106.9	-179.1	-60.7	175	0	0	0	109.3	H331 T342	H331-I333 PolarHBondContact O-N 2.78Å; H331-I333 VanDerWaalsContact O-N 3.15Å; I333-T342 VanDerWaalsContact CG2-CB 3.48Å; I333-T342 HydrophobicContact CG2-CG2 3.55Å
334	H	70.9	Confident	64.7	Low	59 Å²	59	89.3 Å²	89.3	27%	0.273	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	116	177.1	-66.1	-79.3	0	0	0	110.3	V332 F343 N345 S346 L349	V332-H334 PolarHBondContact O-CD2 2.73Å; V332-H334 PolarHBondContact O-N 2.86Å; H334-F343 PolarHBondContact N-O 2.74Å; H334-F343 PolarHBondContact O-N 2.59Å; H334-N345 VanDerWaalsContact CD2-C 3.47Å; H334-S346 PolarHBondContact CD2-N 3.04Å; H334-S346 PolarHBondContact NE2-N 2.89Å; H334-L349 HydrophobicContact CB-CB 4.13Å; H334-L349 HydrophobicContact CB-CD2 3.92Å
335	R	67.5	Low	65.3	Low	144 Å²	144	89.2 Å²	89.2	54%	0.543	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135	-176.1	-175.7	174.9	176.5	139.1	-8.2	110.8	M340 Q341 T342	R335-M340 PolarHBondContact NE-SD 3.05Å; R335-M340 PolarHBondContact NH2-SD 3.08Å; R335-Q341 CarbonylContact C-O 3.51Å; R335-Q341 WeakPolarHBondContact CA-O 3.18Å; R335-T342 HydrophobicContact CB-CG2 4.42Å; R335-T342 HydrophobicContact CG-CG2 4.35Å
336	C	74.6	Confident	65.6	Low	0 Å²	0	84.4 Å²	84.4	0%	0	46%	0.46	C	S	.	.			trans	-77.4	125.3	174.9	-174.7	0	0	0	0	111.3	T338 M340 Q341 F343 L349 H352	C336-T338 VanDerWaalsContact C-N 3.28Å; C336-T338 PolarHBondContact O-N 3.19Å; C336-M340 WeakPolarHBondContact O-CA 3.38Å; C336-M340 PolarHBondContact O-N 3.02Å; C336-Q341 PolarHBondContact N-O 3.03Å; C336-F343 HydrophobicContact CB-CE2 4.18Å; C336-L349 VanDerWaalsContact CA-CD1 3.43Å; C336-L349 HydrophobicContact CB-CD1 3.38Å; C336-H352 VanDerWaalsContact SG-CD2 3.6Å; C336-H352 PolarHBondContact SG-NE2 3.42Å
337	E	69.8	Low	65.6	Low	169 Å²	169	85.4 Å²	85.4	79%	0.79	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-25.4	-178.7	-62.4	-179.5	173.8	0	0	112.5	M340	E337-M340 WeakPolarHBondContact O-CE 3.47Å
338	T	66	Low	66.5	Low	97 Å²	97	85.8 Å²	85.8	60%	0.595	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-16	-177.9	-32.7	0	0	0	0	114.4	C336 H357	C336-T338 VanDerWaalsContact C-N 3.28Å; C336-T338 PolarHBondContact O-N 3.19Å; T338-H357 WeakPolarHBondContact CG2-ND1 3.43Å
339	C	70.4	Confident	67.4	Low	41 Å²	41	83.2 Å²	83.2	28%	0.277	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.3	3.2	179.5	75.5	0	0	0	0	115.9	Q341 H352	C339-Q341 PolarHBondContact O-N 2.92Å; C339-Q341 VanDerWaalsContact SG-CG 3.6Å; C339-H352 PolarHBondContact SG-CE1 3.26Å; C339-H352 PolarHBondContact SG-NE2 2.83Å
340	M	69	Low	68.5	Low	95 Å²	95	82.3 Å²	82.3	47%	0.468	44%	0.439	S	S	.	.			trans	61	7	179.8	-58.2	-68	118.6	0	0	116.1	R335 C336 E337	R335-M340 PolarHBondContact NE-SD 3.05Å; R335-M340 PolarHBondContact NH2-SD 3.08Å; C336-M340 WeakPolarHBondContact O-CA 3.38Å; C336-M340 PolarHBondContact O-N 3.02Å; E337-M340 WeakPolarHBondContact O-CE 3.47Å
341	Q	71.2	Confident	69.4	Low	100 Å²	100	84.3 Å²	84.3	47%	0.467	44%	0.443	S	S	.	.			trans	-69	143.7	175.7	-68.9	-178.1	20	0	0	111.8	R335 C336 C339 F343 H352	R335-Q341 CarbonylContact C-O 3.51Å; R335-Q341 WeakPolarHBondContact CA-O 3.18Å; C336-Q341 PolarHBondContact N-O 3.03Å; C339-Q341 PolarHBondContact O-N 2.92Å; C339-Q341 VanDerWaalsContact SG-CG 3.6Å; Q341-F343 HydrophobicContact CB-CE2 3.68Å; Q341-F343 HydrophobicContact CB-CZ 3.73Å; Q341-F343 WeakPolarHBondContact O-CE2 3.25Å; Q341-H352 PolarHBondContact OE1-CE1 2.92Å
342	T	68.1	Low	70.5	Confident	87 Å²	87	78.3 Å²	78.3	53%	0.534	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	132.1	-175.6	43.8	0	0	0	0	111.6	I333 R335	I333-T342 VanDerWaalsContact CG2-CB 3.48Å; I333-T342 HydrophobicContact CG2-CG2 3.55Å; R335-T342 HydrophobicContact CB-CG2 4.42Å; R335-T342 HydrophobicContact CG-CG2 4.35Å
343	F	74.6	Confident	71.2	Confident	41 Å²	41	78.4 Å²	78.4	18%	0.18	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	141.8	-177.5	-58.5	-82.5	0	0	0	110.2	H334 C336 Q341 N345 N348 L349 H352	H334-F343 PolarHBondContact N-O 2.74Å; H334-F343 PolarHBondContact O-N 2.59Å; C336-F343 HydrophobicContact CB-CE2 4.18Å; Q341-F343 HydrophobicContact CB-CE2 3.68Å; Q341-F343 HydrophobicContact CB-CZ 3.73Å; Q341-F343 WeakPolarHBondContact O-CE2 3.25Å; F343-N345 VanDerWaalsContact C-N 3.28Å; F343-N345 PolarHBondContact O-N 2.4Å; F343-N348 HydrophobicContact CB-CB 4.2Å; F343-N348 HydrophobicContact CD1-CB 4.32Å; F343-L349 HydrophobicContact CB-CB 4.4Å; F343-L349 HydrophobicContact CD2-CB 4.13Å; F343-L349 HydrophobicContact CD2-CD1 3.82Å; F343-L349 HydrophobicContact CE2-CD1 4.05Å; F343-L349 HydrophobicContact CG-CB 4.46Å; F343-H352 HydrophobicContact CE1-CB 3.87Å; F343-H352 HydrophobicContact CE2-CB 3.86Å; F343-H352 AromaticContact CE2-CD2 3.89Å; F343-H352 AromaticContact CE2-CG 3.67Å; F343-H352 HydrophobicContact CZ-CB 3.47Å; F343-H352 VanDerWaalsContact CZ-CB 3.47Å; F343-H352 AromaticContact CZ-CD2 3.93Å; F343-H352 AromaticContact CZ-CG 3.28Å; F343-H352 AromaticContact CZ-ND1 3.45Å; F343-H352 WeakPolarHBondContact CZ-ND1 3.48Å
344	A	73.3	Confident	71.5	Confident	72 Å²	72	78.3 Å²	78.3	60%	0.595	41%	0.407	S	S	*	.	S	Bend	trans	-67.3	-27	179.2	0	0	0	0	0	113.5
345	N	76.6	Confident	71.3	Confident	89 Å²	89	77.7 Å²	77.7	48%	0.476	40%	0.404	S	S	.	.	S	Bend	trans	-131.1	140.6	-172.8	-61.4	2.9	0	0	0	110.5	H334 F343 S347 N348 L349	H334-N345 VanDerWaalsContact CD2-C 3.47Å; F343-N345 VanDerWaalsContact C-N 3.28Å; F343-N345 PolarHBondContact O-N 2.4Å; N345-S347 PolarHBondContact O-N 2.85Å; N345-N348 HydrophobicContact CB-CB 4.36Å; N345-N348 WeakPolarHBondContact O-CB 3.3Å; N345-N348 PolarHBondContact O-N 3.44Å; N345-L349 PolarHBondContact O-N 3.22Å; N345-L349 VanDerWaalsContact O-N 3.09Å
346	S	68.1	Low	71.2	Confident	56 Å²	56	74.4 Å²	74.4	39%	0.392	40%	0.4	S	S	.	.	H	α-helix	trans	-59.9	-32.4	175	57.1	0	0	0	0	113.1	H334 N348 L349 K350	H334-S346 PolarHBondContact CD2-N 3.04Å; H334-S346 PolarHBondContact NE2-N 2.89Å; S346-N348 VanDerWaalsContact C-N 3.32Å; S346-N348 PolarHBondContact O-N 3.05Å; S346-L349 WeakPolarHBondContact O-CB 3.42Å; S346-L349 PolarHBondContact O-N 2.84Å; S346-K350 PolarHBondContact O-N 3.22Å
347	S	71.7	Confident	70.9	Confident	73 Å²	73	77.4 Å²	77.4	51%	0.51	41%	0.414	S	S	.	.	H	α-helix	trans	-61.6	-39.5	171.9	-50.5	0	0	0	0	112.1	N345 K350 I351	N345-S347 PolarHBondContact O-N 2.85Å; S347-K350 PolarHBondContact O-N 3.08Å; S347-I351 VanDerWaalsContact O-CB 3.29Å; S347-I351 WeakPolarHBondContact O-CB 3.44Å; S347-I351 WeakPolarHBondContact O-CD1 3.39Å; S347-I351 WeakPolarHBondContact O-CG1 3.48Å; S347-I351 PolarHBondContact O-N 3.07Å
348	N	72.9	Confident	70.8	Confident	72 Å²	72	70.6 Å²	70.6	39%	0.385	39%	0.385	S	S	.	.	H	α-helix	trans	-71.5	-33.2	177.5	-69.8	-7.3	0	0	0	111.3	F343 N345 S346 H352	F343-N348 HydrophobicContact CB-CB 4.2Å; F343-N348 HydrophobicContact CD1-CB 4.32Å; N345-N348 HydrophobicContact CB-CB 4.36Å; N345-N348 WeakPolarHBondContact O-CB 3.3Å; N345-N348 PolarHBondContact O-N 3.44Å; S346-N348 VanDerWaalsContact C-N 3.32Å; S346-N348 PolarHBondContact O-N 3.05Å; N348-H352 WeakPolarHBondContact O-CB 3.49Å; N348-H352 PolarHBondContact O-N 2.86Å
349	L	77.2	Confident	70.4	Confident	20 Å²	20	71.8 Å²	71.8	11%	0.105	39%	0.388	C	S	.	.	H	α-helix	trans	-63.6	-51.9	170.1	174.2	57.6	0	0	0	111.8	H334 C336 F343 N345 S346 I351 H352 E353	H334-L349 HydrophobicContact CB-CB 4.13Å; H334-L349 HydrophobicContact CB-CD2 3.92Å; C336-L349 VanDerWaalsContact CA-CD1 3.43Å; C336-L349 HydrophobicContact CB-CD1 3.38Å; F343-L349 HydrophobicContact CB-CB 4.4Å; F343-L349 HydrophobicContact CD2-CB 4.13Å; F343-L349 HydrophobicContact CD2-CD1 3.82Å; F343-L349 HydrophobicContact CE2-CD1 4.05Å; F343-L349 HydrophobicContact CG-CB 4.46Å; N345-L349 PolarHBondContact O-N 3.22Å; N345-L349 VanDerWaalsContact O-N 3.09Å; S346-L349 WeakPolarHBondContact O-CB 3.42Å; S346-L349 PolarHBondContact O-N 2.84Å; L349-I351 VanDerWaalsContact C-N 3.26Å; L349-I351 PolarHBondContact O-N 3.35Å; L349-H352 CarbonylContact O-C 3.33Å; L349-H352 WeakPolarHBondContact O-CA 3.26Å; L349-H352 WeakPolarHBondContact O-CB 3.36Å; L349-H352 PolarHBondContact O-N 3.44Å; L349-E353 HydrophobicContact CD1-CG 4.02Å; L349-E353 VanDerWaalsContact CD1-OE1 3.29Å; L349-E353 WeakPolarHBondContact CD1-OE1 3.34Å; L349-E353 HydrophobicContact CG-CG 4.5Å; L349-E353 WeakPolarHBondContact CG-OE1 3.36Å; L349-E353 WeakPolarHBondContact O-CG 3.15Å; L349-E353 PolarHBondContact O-N 2.95Å
350	K	72	Confident	70.1	Confident	151 Å²	151	75 Å²	75	66%	0.657	40%	0.399	S	S	*	.	H	α-helix	trans	-60.6	-35.5	176.9	-71.2	-175.1	176.2	-171.9	0	112.6	S346 S347 K354	S346-K350 PolarHBondContact O-N 3.22Å; S347-K350 PolarHBondContact O-N 3.08Å; K350-K354 VanDerWaalsContact O-CB 3.3Å; K350-K354 WeakPolarHBondContact O-CB 3.39Å; K350-K354 PolarHBondContact O-N 3.36Å
351	I	70.7	Confident	69.9	Low	88 Å²	88	77.4 Å²	77.4	45%	0.451	40%	0.402	S	S	.	.	H	α-helix	trans	-64.8	-44.3	171	-76.2	167.6	0	0	0	110.6	S347 L349 H355	S347-I351 VanDerWaalsContact O-CB 3.29Å; S347-I351 WeakPolarHBondContact O-CB 3.44Å; S347-I351 WeakPolarHBondContact O-CD1 3.39Å; S347-I351 WeakPolarHBondContact O-CG1 3.48Å; S347-I351 PolarHBondContact O-N 3.07Å; L349-I351 VanDerWaalsContact C-N 3.26Å; L349-I351 PolarHBondContact O-N 3.35Å; I351-H355 WeakPolarHBondContact O-CB 3.42Å; I351-H355 PolarHBondContact O-N 3.45Å; I351-H355 VanDerWaalsContact O-N 3.1Å; I351-H355 PolarHBondContact O-ND1 2.86Å
352	H	75.1	Confident	69.7	Low	19 Å²	19	77.3 Å²	77.3	9%	0.088	41%	0.405	C	S	.	.	H	α-helix	trans	-60.7	-50.8	175.4	166.8	83.4	0	0	0	111.2	C336 C339 Q341 F343 N348 L349 K354 H355 V356 H357	C336-H352 VanDerWaalsContact SG-CD2 3.6Å; C336-H352 PolarHBondContact SG-NE2 3.42Å; C339-H352 PolarHBondContact SG-CE1 3.26Å; C339-H352 PolarHBondContact SG-NE2 2.83Å; Q341-H352 PolarHBondContact OE1-CE1 2.92Å; F343-H352 HydrophobicContact CE1-CB 3.87Å; F343-H352 HydrophobicContact CE2-CB 3.86Å; F343-H352 AromaticContact CE2-CD2 3.89Å; F343-H352 AromaticContact CE2-CG 3.67Å; F343-H352 HydrophobicContact CZ-CB 3.47Å; F343-H352 VanDerWaalsContact CZ-CB 3.47Å; F343-H352 AromaticContact CZ-CD2 3.93Å; F343-H352 AromaticContact CZ-CG 3.28Å; F343-H352 AromaticContact CZ-ND1 3.45Å; F343-H352 WeakPolarHBondContact CZ-ND1 3.48Å; N348-H352 WeakPolarHBondContact O-CB 3.49Å; N348-H352 PolarHBondContact O-N 2.86Å; L349-H352 CarbonylContact O-C 3.33Å; L349-H352 WeakPolarHBondContact O-CA 3.26Å; L349-H352 WeakPolarHBondContact O-CB 3.36Å; L349-H352 PolarHBondContact O-N 3.44Å; H352-K354 PolarHBondContact O-N 3.25Å; H352-H355 PolarHBondContact O-N 2.97Å; H352-H355 VanDerWaalsContact O-N 3.11Å; H352-V356 WeakPolarHBondContact CE1-CG1 3.45Å; H352-V356 VanDerWaalsContact CE1-CG2 3.42Å; H352-V356 WeakPolarHBondContact CE1-CG2 3Å; H352-V356 WeakPolarHBondContact ND1-CG2 3.45Å; H352-V356 WeakPolarHBondContact O-CB 3.32Å; H352-V356 PolarHBondContact O-N 3.41Å; H352-H357 AromaticContact CD2-CD2 3.89Å; H352-H357 AromaticContact NE2-CD2 2.71Å; H352-H357 PolarHBondContact NE2-CD2 3.32Å; H352-H357 AromaticContact NE2-CE1 3.47Å; H352-H357 PolarHBondContact NE2-CE1 2.84Å; H352-H357 AromaticContact NE2-NE2 2.2Å; H352-H357 PolarHBondContact NE2-NE2 2.86Å
353	E	71.8	Confident	70	Confident	60 Å²	60	76.8 Å²	76.8	28%	0.28	40%	0.395	S	S	.	.	I	π-helix	trans	-56	-48.6	178.3	-70.7	161.9	165.2	0	0	111.3	L349 H355 H357 S358	L349-E353 HydrophobicContact CD1-CG 4.02Å; L349-E353 VanDerWaalsContact CD1-OE1 3.29Å; L349-E353 WeakPolarHBondContact CD1-OE1 3.34Å; L349-E353 HydrophobicContact CG-CG 4.5Å; L349-E353 WeakPolarHBondContact CG-OE1 3.36Å; L349-E353 WeakPolarHBondContact O-CG 3.15Å; L349-E353 PolarHBondContact O-N 2.95Å; E353-H355 VanDerWaalsContact C-N 3.29Å; E353-H355 PolarHBondContact O-N 3.45Å; E353-H357 CarbonylContact O-C 3.51Å; E353-H357 WeakPolarHBondContact O-CA 3.22Å; E353-H357 PolarHBondContact O-N 3.5Å; E353-S358 PolarHBondContact O-N 3.45Å
354	K	69.6	Low	70.1	Confident	112 Å²	112	77.5 Å²	77.5	49%	0.487	41%	0.408	S	S	.	.	I	π-helix	trans	-70.3	-15.9	179.3	-168.2	153.7	-173.2	156.7	0	114.9	K350 H352 S358	K350-K354 VanDerWaalsContact O-CB 3.3Å; K350-K354 WeakPolarHBondContact O-CB 3.39Å; K350-K354 PolarHBondContact O-N 3.36Å; H352-K354 PolarHBondContact O-N 3.25Å; K354-S358 WeakPolarHBondContact O-CB 3.37Å
355	H	68.2	Low	70.4	Confident	45 Å²	45	74.3 Å²	74.3	21%	0.208	38%	0.382	C	S	.	.	I	π-helix	trans	-106.4	-26.9	176.4	-65.5	107	0	0	0	114.4	I351 H352 E353 K373 R374	I351-H355 WeakPolarHBondContact O-CB 3.42Å; I351-H355 PolarHBondContact O-N 3.45Å; I351-H355 VanDerWaalsContact O-N 3.1Å; I351-H355 PolarHBondContact O-ND1 2.86Å; H352-H355 PolarHBondContact O-N 2.97Å; H352-H355 VanDerWaalsContact O-N 3.11Å; E353-H355 VanDerWaalsContact C-N 3.29Å; E353-H355 PolarHBondContact O-N 3.45Å; H355-K373 PolarHBondContact CD2-O 3.11Å; H355-K373 PolarHBondContact NE2-O 3.24Å; H355-K373 WeakPolarHBondContact O-CD 3.3Å; H355-K373 WeakPolarHBondContact O-CE 3.3Å; H355-K373 PolarHBondContact O-NZ 3.24Å; H355-R374 WeakPolarHBondContact NE2-CG 3.47Å
356	V	65	Low	70.5	Confident	75 Å²	75	76.7 Å²	76.7	46%	0.455	39%	0.394	S	S	.	.	I	π-helix	trans	-103.2	-42.6	-175.5	-179.2	0	0	0	0	111.4	H352	H352-V356 WeakPolarHBondContact CE1-CG1 3.45Å; H352-V356 VanDerWaalsContact CE1-CG2 3.42Å; H352-V356 WeakPolarHBondContact CE1-CG2 3Å; H352-V356 WeakPolarHBondContact ND1-CG2 3.45Å; H352-V356 WeakPolarHBondContact O-CB 3.32Å; H352-V356 PolarHBondContact O-N 3.41Å
357	H	66.8	Low	70.9	Confident	64 Å²	64	77 Å²	77	30%	0.296	40%	0.396	S	S	.	.	I	π-helix	trans	-99.3	-36.2	-174.9	-62.7	-64.3	0	0	0	113.1	T338 H352 E353	T338-H357 WeakPolarHBondContact CG2-ND1 3.43Å; H352-H357 AromaticContact CD2-CD2 3.89Å; H352-H357 AromaticContact NE2-CD2 2.71Å; H352-H357 PolarHBondContact NE2-CD2 3.32Å; H352-H357 AromaticContact NE2-CE1 3.47Å; H352-H357 PolarHBondContact NE2-CE1 2.84Å; H352-H357 AromaticContact NE2-NE2 2.2Å; H352-H357 PolarHBondContact NE2-NE2 2.86Å; E353-H357 CarbonylContact O-C 3.51Å; E353-H357 WeakPolarHBondContact O-CA 3.22Å; E353-H357 PolarHBondContact O-N 3.5Å
358	S	67.8	Low	71.3	Confident	25 Å²	25	75.1 Å²	75.1	18%	0.175	38%	0.383	C	S	.	.			trans	-69	131.8	163.3	168.5	0	0	0	0	110.5	E353 K354 E360 K373	E353-S358 PolarHBondContact O-N 3.45Å; K354-S358 WeakPolarHBondContact O-CB 3.37Å; S358-E360 VanDerWaalsContact OG-CB 3.3Å; S358-E360 WeakPolarHBondContact OG-CB 3.39Å; S358-E360 VanDerWaalsContact OG-CG 3.25Å; S358-E360 WeakPolarHBondContact OG-CG 3.4Å; S358-E360 PolarHBondContact OG-N 3.24Å; S358-E360 VanDerWaalsContact OG-N 3.12Å; S358-E360 PolarHBondContact OG-OE2 2.84Å; S358-E360 VanDerWaalsContact OG-OE2 3.12Å; S358-K373 PolarHBondContact O-NZ 3.16Å
359	N	58.5	Low	71.3	Confident	123 Å²	123	77.7 Å²	77.7	66%	0.658	41%	0.407	S	S	*	.			trans	-95.8	4.5	171.4	-80.7	-41.4	0	0	0	113.3	R361	N359-R361 PolarHBondContact O-N 3.35Å; N359-R361 VanDerWaalsContact O-N 3.08Å
360	E	64.3	Low	71.3	Confident	108 Å²	108	82.2 Å²	82.2	51%	0.505	43%	0.426	S	S	.	.			trans	-65.6	107.4	179	-57.2	166.4	156.4	0	0	110.4	S358 L362	S358-E360 VanDerWaalsContact OG-CB 3.3Å; S358-E360 WeakPolarHBondContact OG-CB 3.39Å; S358-E360 VanDerWaalsContact OG-CG 3.25Å; S358-E360 WeakPolarHBondContact OG-CG 3.4Å; S358-E360 PolarHBondContact OG-N 3.24Å; S358-E360 VanDerWaalsContact OG-N 3.12Å; S358-E360 PolarHBondContact OG-OE2 2.84Å; S358-E360 VanDerWaalsContact OG-OE2 3.12Å; E360-L362 HydrophobicContact CB-CD1 4.4Å; E360-L362 HydrophobicContact CB-CD2 3.83Å; E360-L362 HydrophobicContact CB-CG 3.76Å; E360-L362 PolarHBondContact O-N 2.85Å
361	R	63.9	Low	71.5	Confident	145 Å²	145	78.2 Å²	78.2	55%	0.547	41%	0.414	S	S	.	.			trans	-84.7	61.7	173.6	-63.5	-175.6	176.9	97	-5.4	109.8	N359 F363 T371 F372 K373	N359-R361 PolarHBondContact O-N 3.35Å; N359-R361 VanDerWaalsContact O-N 3.08Å; R361-F363 PolarHBondContact O-N 3.3Å; R361-T371 WeakPolarHBondContact CB-OG1 3.39Å; R361-T371 WeakPolarHBondContact CD-O 3.15Å; R361-T371 VanDerWaalsContact CD-OG1 3.29Å; R361-T371 WeakPolarHBondContact CD-OG1 3.34Å; R361-T371 WeakPolarHBondContact O-CB 3.36Å; R361-F372 CarbonylContact C-O 3.38Å; R361-F372 VanDerWaalsContact C-O 3.29Å; R361-F372 WeakPolarHBondContact CA-O 3.43Å; R361-K373 HydrophobicContact CG-CG 4.34Å
362	L	67.9	Low	71.9	Confident	98 Å²	98	76.2 Å²	76.2	51%	0.513	40%	0.402	S	S	.	.			trans	-57.1	-18.5	-169.3	-64.1	173.3	0	0	0	115.3	E360	E360-L362 HydrophobicContact CB-CD1 4.4Å; E360-L362 HydrophobicContact CB-CD2 3.83Å; E360-L362 HydrophobicContact CB-CG 3.76Å; E360-L362 PolarHBondContact O-N 2.85Å
363	F	73.1	Confident	71.7	Confident	77 Å²	77	77.9 Å²	77.9	34%	0.338	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	96.4	-177.5	-53.2	-80	0	0	0	110.4	R361 F372 R374 K375 V378	R361-F363 PolarHBondContact O-N 3.3Å; F363-F372 PolarHBondContact N-O 2.87Å; F363-F372 VanDerWaalsContact N-O 3.15Å; F363-F372 PolarHBondContact O-N 3.1Å; F363-R374 VanDerWaalsContact CD2-C 3.47Å; F363-K375 HydrophobicContact CD1-CB 3.81Å; F363-K375 HydrophobicContact CD1-CG 4.22Å; F363-K375 HydrophobicContact CE1-CB 3.87Å; F363-K375 HydrophobicContact CE1-CD 4.42Å; F363-K375 HydrophobicContact CE1-CG 4.45Å; F363-K375 HydrophobicContact CG-CB 4.24Å; F363-K375 HydrophobicContact CZ-CB 4.35Å; F363-V378 HydrophobicContact CB-CG2 3.46Å; F363-V378 VanDerWaalsContact CB-CG2 3.46Å; F363-V378 VanDerWaalsContact O-CG2 3.28Å; F363-V378 WeakPolarHBondContact O-CG2 3.46Å
364	A	76.9	Confident	71.7	Confident	55 Å²	55	80.9 Å²	80.9	46%	0.455	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	164.8	167.8	0	0	0	0	0	111.6	T371 V378	A364-T371 HydrophobicContact CB-CG2 4.21Å; A364-V378 WeakPolarHBondContact O-CG1 3.45Å
365	C	80.4	Confident	72	Confident	6 Å²	6	82.7 Å²	82.7	4%	0.041	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	115.4	166.6	-179.8	0	0	0	0	109.3	S367 C368 K370 F372 V378 H381 K382 H386	C365-S367 PolarHBondContact O-N 3.28Å; C365-C368 WeakPolarHBondContact CB-O 3.31Å; C365-C368 CarbonylContact O-C 3.36Å; C365-C368 PolarHBondContact O-N 3.02Å; C365-K370 PolarHBondContact N-O 3.11Å; C365-K370 VanDerWaalsContact N-O 3.09Å; C365-F372 HydrophobicContact CB-CE2 4.33Å; C365-V378 HydrophobicContact CB-CG1 4.19Å; C365-H381 PolarHBondContact SG-CD2 3.09Å; C365-H381 PolarHBondContact SG-NE2 3.02Å; C365-H381 VanDerWaalsContact SG-NE2 3.37Å; C365-K382 VanDerWaalsContact SG-CG 3.51Å; C365-H386 PolarHBondContact SG-NE2 3.13Å; C365-H386 VanDerWaalsContact SG-NE2 3.37Å
366	D	78.7	Confident	72.4	Confident	138 Å²	138	89.3 Å²	89.3	74%	0.738	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	5.3	-178.7	-14.5	-32.8	0	0	0	114	K382	D366-K382 VanDerWaalsContact CG-NZ 3.26Å; D366-K382 IonicContact OD1-NZ 3.89Å; D366-K382 IonicContact OD2-NZ 3.46Å; D366-K382 PolarHBondContact OD2-NZ 2.87Å
367	S	76.4	Confident	73	Confident	62 Å²	62	87.1 Å²	87.1	43%	0.434	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-6.4	177.3	-46.7	0	0	0	0	113.6	C365 H386	C365-S367 PolarHBondContact O-N 3.28Å; S367-H386 PolarHBondContact O-CE1 3.03Å
368	C	79.7	Confident	73.6	Confident	34 Å²	34	84.5 Å²	84.5	23%	0.23	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	157.7	163.1	69.4	0	0	0	0	111.8	C365 K370 H381 H386	C365-C368 WeakPolarHBondContact CB-O 3.31Å; C365-C368 CarbonylContact O-C 3.36Å; C365-C368 PolarHBondContact O-N 3.02Å; C368-K370 PolarHBondContact O-N 3.11Å; C368-H381 PolarHBondContact SG-NE2 3.27Å; C368-H386 WeakPolarHBondContact CB-CE1 3.39Å; C368-H386 WeakPolarHBondContact CB-NE2 3.44Å; C368-H386 PolarHBondContact SG-NE2 2.99Å
369	S	73.9	Confident	74	Confident	126 Å²	126	86.3 Å²	86.3	88%	0.881	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	15.3	-175.8	-29.7	0	0	0	0	117.4
370	K	76.4	Confident	74.7	Confident	116 Å²	116	86.8 Å²	86.8	50%	0.504	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	122.1	175.1	-67.2	175.9	-176.8	168.8	0	110.1	C365 C368 F372	C365-K370 PolarHBondContact N-O 3.11Å; C365-K370 VanDerWaalsContact N-O 3.09Å; C368-K370 PolarHBondContact O-N 3.11Å; K370-F372 HydrophobicContact CB-CE2 3.57Å; K370-F372 HydrophobicContact CB-CZ 3.88Å; K370-F372 WeakPolarHBondContact O-CD2 3.32Å; K370-F372 VanDerWaalsContact O-CE2 3.27Å; K370-F372 WeakPolarHBondContact O-CE2 3.49Å
371	T	77.1	Confident	75.4	Confident	66 Å²	66	82.2 Å²	82.2	41%	0.405	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	148.2	176.7	56.6	0	0	0	0	111.1	R361 A364	R361-T371 WeakPolarHBondContact CB-OG1 3.39Å; R361-T371 WeakPolarHBondContact CD-O 3.15Å; R361-T371 VanDerWaalsContact CD-OG1 3.29Å; R361-T371 WeakPolarHBondContact CD-OG1 3.34Å; R361-T371 WeakPolarHBondContact O-CB 3.36Å; A364-T371 HydrophobicContact CB-CG2 4.21Å
372	F	77.9	Confident	75.9	Confident	46 Å²	46	77.4 Å²	77.4	20%	0.202	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	152.9	-171.4	-63	-96.1	0	0	0	111.4	R361 F363 C365 K370 R374 D377 V378 H381	R361-F372 CarbonylContact C-O 3.38Å; R361-F372 VanDerWaalsContact C-O 3.29Å; R361-F372 WeakPolarHBondContact CA-O 3.43Å; F363-F372 PolarHBondContact N-O 2.87Å; F363-F372 VanDerWaalsContact N-O 3.15Å; F363-F372 PolarHBondContact O-N 3.1Å; C365-F372 HydrophobicContact CB-CE2 4.33Å; K370-F372 HydrophobicContact CB-CE2 3.57Å; K370-F372 HydrophobicContact CB-CZ 3.88Å; K370-F372 WeakPolarHBondContact O-CD2 3.32Å; K370-F372 VanDerWaalsContact O-CE2 3.27Å; K370-F372 WeakPolarHBondContact O-CE2 3.49Å; F372-R374 VanDerWaalsContact C-N 3.34Å; F372-D377 HydrophobicContact CB-CB 4.25Å; F372-D377 HydrophobicContact CD1-CB 4.04Å; F372-D377 HydrophobicContact CG-CB 4.46Å; F372-V378 HydrophobicContact CB-CG2 3.77Å; F372-V378 HydrophobicContact CD2-CG2 3.76Å; F372-V378 HydrophobicContact CG-CG2 4.01Å; F372-H381 HydrophobicContact CE1-CB 3.91Å; F372-H381 HydrophobicContact CE2-CB 4.07Å; F372-H381 AromaticContact CE2-CD2 3.25Å; F372-H381 WeakPolarHBondContact CE2-CD2 3.23Å; F372-H381 AromaticContact CE2-CG 3.73Å; F372-H381 HydrophobicContact CZ-CB 3.52Å; F372-H381 AromaticContact CZ-CD2 3.33Å; F372-H381 WeakPolarHBondContact CZ-CD2 3.44Å; F372-H381 AromaticContact CZ-CG 3.29Å
373	K	71.2	Confident	76.1	Confident	54 Å²	54	79.9 Å²	79.9	24%	0.235	40%	0.395	C	S	.	.	S	Bend	trans	-77.4	-13.1	177.9	-63.2	-157.2	-179.5	-165.2	0	114	H355 S358 R361	H355-K373 PolarHBondContact CD2-O 3.11Å; H355-K373 PolarHBondContact NE2-O 3.24Å; H355-K373 WeakPolarHBondContact O-CD 3.3Å; H355-K373 WeakPolarHBondContact O-CE 3.3Å; H355-K373 PolarHBondContact O-NZ 3.24Å; S358-K373 PolarHBondContact O-NZ 3.16Å; R361-K373 HydrophobicContact CG-CG 4.34Å
374	R	72.2	Confident	75.9	Confident	124 Å²	124	81.2 Å²	81.2	47%	0.468	40%	0.402	S	S	.	.			trans	-139.3	141	179.9	-53.7	178.8	176.1	159.8	-1.8	112.4	H355 F363 F372 K376 D377 V378	H355-R374 WeakPolarHBondContact NE2-CG 3.47Å; F363-R374 VanDerWaalsContact CD2-C 3.47Å; F372-R374 VanDerWaalsContact C-N 3.34Å; R374-K376 VanDerWaalsContact C-N 3.26Å; R374-K376 PolarHBondContact O-N 3.2Å; R374-D377 HydrophobicContact CB-CB 4.27Å; R374-D377 VanDerWaalsContact CB-OD2 3.31Å; R374-D377 WeakPolarHBondContact CB-OD2 3.36Å; R374-D377 WeakPolarHBondContact CD-OD2 3.37Å; R374-D377 WeakPolarHBondContact CG-OD2 3.46Å; R374-D377 WeakPolarHBondContact O-CB 3.46Å; R374-D377 PolarHBondContact O-N 2.78Å; R374-V378 PolarHBondContact O-N 2.86Å; R374-V378 VanDerWaalsContact O-N 3.13Å
375	K	75.1	Confident	75.5	Confident	150 Å²	150	82.3 Å²	82.3	65%	0.652	40%	0.403	S	S	*	.	H	α-helix	trans	-57	-36.2	169.7	-159.7	169.5	-176.1	174.1	0	112.6	F363 D377 V378 V379	F363-K375 HydrophobicContact CD1-CB 3.81Å; F363-K375 HydrophobicContact CD1-CG 4.22Å; F363-K375 HydrophobicContact CE1-CB 3.87Å; F363-K375 HydrophobicContact CE1-CD 4.42Å; F363-K375 HydrophobicContact CE1-CG 4.45Å; F363-K375 HydrophobicContact CG-CB 4.24Å; F363-K375 HydrophobicContact CZ-CB 4.35Å; K375-D377 VanDerWaalsContact C-N 3.31Å; K375-D377 PolarHBondContact O-N 3.35Å; K375-V378 PolarHBondContact O-N 3.43Å; K375-V379 WeakPolarHBondContact O-CG2 3.47Å; K375-V379 PolarHBondContact O-N 2.8Å
376	K	76.4	Confident	75.1	Confident	183 Å²	183	86 Å²	86	80%	0.796	42%	0.419	S	S	*	.	H	α-helix	trans	-61.9	-33.7	172.6	-73	-171.8	177.4	-177.9	0	112.8	R374 R380	R374-K376 VanDerWaalsContact C-N 3.26Å; R374-K376 PolarHBondContact O-N 3.2Å; K376-R380 PolarHBondContact O-N 3.07Å
377	D	78.6	Confident	74.5	Confident	29 Å²	29	84.1 Å²	84.1	16%	0.155	41%	0.406	C	S	.	.	H	α-helix	trans	-76	-36.1	177.1	-66.3	-46.8	0	0	0	111.7	F372 R374 K375 R380 H381	F372-D377 HydrophobicContact CB-CB 4.25Å; F372-D377 HydrophobicContact CD1-CB 4.04Å; F372-D377 HydrophobicContact CG-CB 4.46Å; R374-D377 HydrophobicContact CB-CB 4.27Å; R374-D377 VanDerWaalsContact CB-OD2 3.31Å; R374-D377 WeakPolarHBondContact CB-OD2 3.36Å; R374-D377 WeakPolarHBondContact CD-OD2 3.37Å; R374-D377 WeakPolarHBondContact CG-OD2 3.46Å; R374-D377 WeakPolarHBondContact O-CB 3.46Å; R374-D377 PolarHBondContact O-N 2.78Å; K375-D377 VanDerWaalsContact C-N 3.31Å; K375-D377 PolarHBondContact O-N 3.35Å; D377-R380 PolarHBondContact O-N 3.42Å; D377-R380 IonicContact OD1-CZ 2.76Å; D377-R380 IonicContact OD1-NH1 3.82Å; D377-R380 PolarHBondContact OD1-NH1 3.41Å; D377-R380 IonicContact OD1-NH2 2.62Å; D377-R380 PolarHBondContact OD1-NH2 2.91Å; D377-H381 VanDerWaalsContact O-CB 3.31Å; D377-H381 WeakPolarHBondContact O-CB 3.27Å; D377-H381 PolarHBondContact O-N 2.95Å
378	V	79.4	Confident	73.6	Confident	10 Å²	10	92.8 Å²	92.8	6%	0.061	43%	0.429	C	S	.	.	H	α-helix	trans	-59.7	-47.1	169	-179.2	0	0	0	0	111	F363 A364 C365 F372 R374 K375 R380 H381 K382	F363-V378 HydrophobicContact CB-CG2 3.46Å; F363-V378 VanDerWaalsContact CB-CG2 3.46Å; F363-V378 VanDerWaalsContact O-CG2 3.28Å; F363-V378 WeakPolarHBondContact O-CG2 3.46Å; A364-V378 WeakPolarHBondContact O-CG1 3.45Å; C365-V378 HydrophobicContact CB-CG1 4.19Å; F372-V378 HydrophobicContact CB-CG2 3.77Å; F372-V378 HydrophobicContact CD2-CG2 3.76Å; F372-V378 HydrophobicContact CG-CG2 4.01Å; R374-V378 PolarHBondContact O-N 2.86Å; R374-V378 VanDerWaalsContact O-N 3.13Å; K375-V378 PolarHBondContact O-N 3.43Å; V378-R380 PolarHBondContact O-N 3.04Å; V378-H381 PolarHBondContact O-N 3.24Å; V378-H381 VanDerWaalsContact O-N 3.15Å; V378-K382 HydrophobicContact CG1-CD 4.36Å; V378-K382 HydrophobicContact CG1-CG 4.32Å; V378-K382 PolarHBondContact O-N 3.4Å
379	V	75.7	Confident	72.6	Confident	62 Å²	62	96 Å²	96	38%	0.376	44%	0.444	S	S	.	.	H	α-helix	trans	-62.6	-41.6	179.1	172.2	0	0	0	0	111.2	K375 H381 R383	K375-V379 WeakPolarHBondContact O-CG2 3.47Å; K375-V379 PolarHBondContact O-N 2.8Å; V379-H381 VanDerWaalsContact C-N 3.35Å; V379-R383 WeakPolarHBondContact O-CB 3.38Å; V379-R383 VanDerWaalsContact O-CG 3.29Å; V379-R383 WeakPolarHBondContact O-CG 3.37Å; V379-R383 PolarHBondContact O-N 3.05Å
380	R	74	Confident	71.8	Confident	133 Å²	133	91.9 Å²	91.9	50%	0.502	41%	0.411	S	S	.	.	H	α-helix	trans	-62.3	-42.2	172.7	-173.5	176.7	67.3	-112	-10.1	111.7	K376 D377 V378 R383 Q384	K376-R380 PolarHBondContact O-N 3.07Å; D377-R380 PolarHBondContact O-N 3.42Å; D377-R380 IonicContact OD1-CZ 2.76Å; D377-R380 IonicContact OD1-NH1 3.82Å; D377-R380 PolarHBondContact OD1-NH1 3.41Å; D377-R380 IonicContact OD1-NH2 2.62Å; D377-R380 PolarHBondContact OD1-NH2 2.91Å; V378-R380 PolarHBondContact O-N 3.04Å; R380-R383 PolarHBondContact O-N 3.29Å; R380-Q384 VanDerWaalsContact O-CB 3.26Å; R380-Q384 WeakPolarHBondContact O-CB 3.42Å; R380-Q384 PolarHBondContact O-N 3.45Å; R380-Q384 VanDerWaalsContact O-N 3.12Å
381	H	78.3	Confident	71	Confident	13 Å²	13	95.6 Å²	95.6	6%	0.06	42%	0.422	C	S	.	.	H	α-helix	trans	-65.5	-45.9	178.4	162.3	50.5	0	0	0	112.5	C365 C368 F372 D377 V378 V379 R383 Q384 V385 H386	C365-H381 PolarHBondContact SG-CD2 3.09Å; C365-H381 PolarHBondContact SG-NE2 3.02Å; C365-H381 VanDerWaalsContact SG-NE2 3.37Å; C368-H381 PolarHBondContact SG-NE2 3.27Å; F372-H381 HydrophobicContact CE1-CB 3.91Å; F372-H381 HydrophobicContact CE2-CB 4.07Å; F372-H381 AromaticContact CE2-CD2 3.25Å; F372-H381 WeakPolarHBondContact CE2-CD2 3.23Å; F372-H381 AromaticContact CE2-CG 3.73Å; F372-H381 HydrophobicContact CZ-CB 3.52Å; F372-H381 AromaticContact CZ-CD2 3.33Å; F372-H381 WeakPolarHBondContact CZ-CD2 3.44Å; F372-H381 AromaticContact CZ-CG 3.29Å; D377-H381 VanDerWaalsContact O-CB 3.31Å; D377-H381 WeakPolarHBondContact O-CB 3.27Å; D377-H381 PolarHBondContact O-N 2.95Å; V378-H381 PolarHBondContact O-N 3.24Å; V378-H381 VanDerWaalsContact O-N 3.15Å; V379-H381 VanDerWaalsContact C-N 3.35Å; H381-R383 VanDerWaalsContact C-N 3.34Å; H381-R383 PolarHBondContact O-N 3.07Å; H381-Q384 PolarHBondContact O-N 3.24Å; H381-Q384 VanDerWaalsContact O-N 3.08Å; H381-V385 VanDerWaalsContact ND1-CG2 3.34Å; H381-V385 WeakPolarHBondContact ND1-CG2 3.14Å; H381-V385 WeakPolarHBondContact O-CB 3.24Å; H381-V385 PolarHBondContact O-N 3.47Å; H381-H386 AromaticContact CD2-NE2 3.94Å; H381-H386 AromaticContact CE1-CD2 3.88Å; H381-H386 AromaticContact CE1-NE2 3.11Å; H381-H386 PolarHBondContact CE1-NE2 3.03Å; H381-H386 AromaticContact NE2-CD2 3.75Å; H381-H386 AromaticContact NE2-NE2 2.75Å; H381-H386 PolarHBondContact NE2-NE2 3.19Å
382	K	74.3	Confident	70.7	Confident	43 Å²	43	94.9 Å²	94.9	19%	0.187	41%	0.414	C	S	.	.	H	α-helix	trans	-56.3	-48.1	173.3	-76.1	-171.5	175.8	-169.3	0	111.1	C365 D366 V378 Q384 H386 E387	C365-K382 VanDerWaalsContact SG-CG 3.51Å; D366-K382 VanDerWaalsContact CG-NZ 3.26Å; D366-K382 IonicContact OD1-NZ 3.89Å; D366-K382 IonicContact OD2-NZ 3.46Å; D366-K382 PolarHBondContact OD2-NZ 2.87Å; V378-K382 HydrophobicContact CG1-CD 4.36Å; V378-K382 HydrophobicContact CG1-CG 4.32Å; V378-K382 PolarHBondContact O-N 3.4Å; K382-Q384 PolarHBondContact O-N 3.36Å; K382-Q384 VanDerWaalsContact O-N 3.16Å; K382-H386 PolarHBondContact O-N 3.06Å; K382-E387 PolarHBondContact O-N 3.4Å
383	R	71.7	Confident	70.6	Confident	151 Å²	151	96.5 Å²	96.5	57%	0.57	43%	0.428	S	S	*	.	H	α-helix	trans	-64.1	-10.9	175.1	-73.8	178.1	-179.2	-174	3.7	116.1	V379 R380 H381 E387	V379-R383 WeakPolarHBondContact O-CB 3.38Å; V379-R383 VanDerWaalsContact O-CG 3.29Å; V379-R383 WeakPolarHBondContact O-CG 3.37Å; V379-R383 PolarHBondContact O-N 3.05Å; R380-R383 PolarHBondContact O-N 3.29Å; H381-R383 VanDerWaalsContact C-N 3.34Å; H381-R383 PolarHBondContact O-N 3.07Å; R383-E387 CarbonylContact C-O 3.29Å; R383-E387 WeakPolarHBondContact CG-OE2 3.33Å
384	Q	69.9	Low	71.1	Confident	104 Å²	104	93.9 Å²	93.9	49%	0.486	42%	0.416	S	S	.	.	H	α-helix	trans	-115.6	-21.8	-176.2	-171.6	173.2	15.4	0	0	113.1	R380 H381 K382 M390	R380-Q384 VanDerWaalsContact O-CB 3.26Å; R380-Q384 WeakPolarHBondContact O-CB 3.42Å; R380-Q384 PolarHBondContact O-N 3.45Å; R380-Q384 VanDerWaalsContact O-N 3.12Å; H381-Q384 PolarHBondContact O-N 3.24Å; H381-Q384 VanDerWaalsContact O-N 3.08Å; K382-Q384 PolarHBondContact O-N 3.36Å; K382-Q384 VanDerWaalsContact O-N 3.16Å; Q384-M390 HydrophobicContact CG-CE 4.28Å; Q384-M390 HydrophobicContact CG-SD 4.42Å
385	V	68.7	Low	71.4	Confident	79 Å²	79	92.8 Å²	92.8	48%	0.479	43%	0.434	S	S	.	.	H	α-helix	trans	-123	-32.4	-172.5	-179	0	0	0	0	113.1	H381	H381-V385 VanDerWaalsContact ND1-CG2 3.34Å; H381-V385 WeakPolarHBondContact ND1-CG2 3.14Å; H381-V385 WeakPolarHBondContact O-CB 3.24Å; H381-V385 PolarHBondContact O-N 3.47Å
386	H	71.8	Confident	71.5	Confident	82 Å²	82	91.4 Å²	91.4	38%	0.38	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-52.3	-172.6	-64.6	-67	0	0	0	111.4	C365 S367 C368 H381 K382 R388	C365-H386 PolarHBondContact SG-NE2 3.13Å; C365-H386 VanDerWaalsContact SG-NE2 3.37Å; S367-H386 PolarHBondContact O-CE1 3.03Å; C368-H386 WeakPolarHBondContact CB-CE1 3.39Å; C368-H386 WeakPolarHBondContact CB-NE2 3.44Å; C368-H386 PolarHBondContact SG-NE2 2.99Å; H381-H386 AromaticContact CD2-NE2 3.94Å; H381-H386 AromaticContact CE1-CD2 3.88Å; H381-H386 AromaticContact CE1-NE2 3.11Å; H381-H386 PolarHBondContact CE1-NE2 3.03Å; H381-H386 AromaticContact NE2-CD2 3.75Å; H381-H386 AromaticContact NE2-NE2 2.75Å; H381-H386 PolarHBondContact NE2-NE2 3.19Å; K382-H386 PolarHBondContact O-N 3.06Å; H386-R388 PolarHBondContact O-N 3.28Å
387	E	65.3	Low	71.7	Confident	99 Å²	99	84.9 Å²	84.9	46%	0.463	41%	0.407	S	S	.	.			trans	-77.5	102.7	162.9	-62.3	169.2	-161.9	0	0	108	K382 R383 N389	K382-E387 PolarHBondContact O-N 3.4Å; R383-E387 CarbonylContact C-O 3.29Å; R383-E387 WeakPolarHBondContact CG-OE2 3.33Å; E387-N389 PolarHBondContact O-N 2.78Å
388	R	57.6	Low	71.8	Confident	244 Å²	244	86 Å²	86	92%	0.921	43%	0.425	S	S	*	.			trans	-67.7	12	171.2	-161.5	-178.5	-80.9	155.9	-6	112.9	H386 M390	H386-R388 PolarHBondContact O-N 3.28Å; R388-M390 PolarHBondContact O-N 2.87Å
389	N	59.3	Low	71.7	Confident	103 Å²	103	91 Å²	91	55%	0.551	45%	0.446	S	S	*	.			trans	-84.6	60.2	-177.8	-162	-15.5	0	0	0	111.5	E387 R391	E387-N389 PolarHBondContact O-N 2.78Å; N389-R391 VanDerWaalsContact C-N 3.29Å; N389-R391 PolarHBondContact O-N 2.78Å; N389-R391 WeakPolarHBondContact OD1-CG 3.46Å
390	M	56.4	Low	71.6	Confident	38 Å²	38	91.2 Å²	91.2	19%	0.187	45%	0.45	C	S	.	.			trans	-71.5	84.9	169.3	-70.2	-85	-100.6	0	0	108.5	Q384 R388 H392	Q384-M390 HydrophobicContact CG-CE 4.28Å; Q384-M390 HydrophobicContact CG-SD 4.42Å; R388-M390 PolarHBondContact O-N 2.87Å; M390-H392 PolarHBondContact O-N 3.26Å
391	R	60.7	Low	71.9	Confident	194 Å²	194	87 Å²	87	73%	0.732	44%	0.437	S	S	*	.	S	Bend	trans	-59.4	4.7	-172.2	-60	-175.9	-172	-169.2	1.9	116.4	N389	N389-R391 VanDerWaalsContact C-N 3.29Å; N389-R391 PolarHBondContact O-N 2.78Å; N389-R391 WeakPolarHBondContact OD1-CG 3.46Å
392	H	69.8	Low	71.6	Confident	51 Å²	51	90.4 Å²	90.4	24%	0.236	46%	0.463	C	S	.	.			trans	-131.3	69.3	-175	-55.1	-47.6	0	0	0	108.8	M390 L401 R404 L407	M390-H392 PolarHBondContact O-N 3.26Å; H392-L401 PolarHBondContact O-N 2.88Å; H392-R404 PolarHBondContact CD2-N 3.37Å; H392-R404 PolarHBondContact NE2-N 2.85Å; H392-L407 HydrophobicContact CB-CB 4.05Å; H392-L407 HydrophobicContact CB-CD2 3.82Å
393	V	76.5	Confident	71.8	Confident	80 Å²	80	90.6 Å²	90.6	49%	0.485	47%	0.469	S	S	.	.	B	Isolated β-bridge	trans	-87.4	132	169.1	-177.8	0	0	0	0	108.1	K399	V393-K399 WeakPolarHBondContact CA-O 3.44Å
394	C	81.9	Confident	72.1	Confident	0 Å²	0	91 Å²	91	0%	0	47%	0.471	C	S	.	.			trans	-75.2	123.1	173	-173.9	0	0	0	0	110.3	E396 C397 G398 K399 L407 H414	C394-E396 VanDerWaalsContact C-N 3.31Å; C394-E396 PolarHBondContact O-N 3.02Å; C394-C397 PolarHBondContact O-N 2.8Å; C394-G398 WeakPolarHBondContact O-CA 3.48Å; C394-G398 PolarHBondContact O-N 3.41Å; C394-K399 PolarHBondContact N-O 2.71Å; C394-L407 HydrophobicContact CB-CD1 3.58Å; C394-H414 VanDerWaalsContact SG-CD2 3.54Å; C394-H414 PolarHBondContact SG-NE2 3.35Å
395	A	78.3	Confident	72.6	Confident	101 Å²	101	89.5 Å²	89.5	84%	0.835	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-40.3	-175.7	0	0	0	0	0	112.6	C397	A395-C397 VanDerWaalsContact C-N 3.34Å; A395-C397 PolarHBondContact O-N 3.21Å
396	E	76.9	Confident	73.2	Confident	121 Å²	121	87.2 Å²	87.2	57%	0.565	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-15.8	-172.9	-61.7	163.1	124.5	0	0	113.9	C394 H414	C394-E396 VanDerWaalsContact C-N 3.31Å; C394-E396 PolarHBondContact O-N 3.02Å; E396-H414 WeakPolarHBondContact OE2-CB 3.29Å; E396-H414 IonicContact OE2-CD2 3.81Å; E396-H414 PolarHBondContact OE2-CD2 2.95Å; E396-H414 IonicContact OE2-CG 2.58Å
397	C	81.4	Confident	73.7	Confident	46 Å²	46	83.8 Å²	83.8	31%	0.311	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.8	6	-173.9	78.2	0	0	0	0	116.1	C394 A395 K399 H410 H414	C394-C397 PolarHBondContact O-N 2.8Å; A395-C397 VanDerWaalsContact C-N 3.34Å; A395-C397 PolarHBondContact O-N 3.21Å; C397-K399 PolarHBondContact O-N 3.38Å; C397-H410 PolarHBondContact SG-NE2 3.08Å; C397-H414 PolarHBondContact SG-NE2 3.09Å; C397-H414 VanDerWaalsContact SG-NE2 3.39Å
398	G	79	Confident	74.5	Confident	52 Å²	52	83.1 Å²	83.1	54%	0.536	45%	0.449	S	S	.	.			trans	66.5	1.6	176.9	0	0	0	0	0	116.3	C394 S400	C394-G398 WeakPolarHBondContact O-CA 3.48Å; C394-G398 PolarHBondContact O-N 3.41Å; G398-S400 PolarHBondContact O-N 3.09Å
399	K	77.5	Confident	75.7	Confident	116 Å²	116	74 Å²	74	50%	0.504	42%	0.418	S	S	.	.			trans	-71.1	122.7	-176.9	-69.7	172.9	-164.2	152.6	0	110.9	V393 C394 C397	V393-K399 WeakPolarHBondContact CA-O 3.44Å; C394-K399 PolarHBondContact N-O 2.71Å; C397-K399 PolarHBondContact O-N 3.38Å
400	S	75.1	Confident	76.8	Confident	66 Å²	66	70.4 Å²	70.4	46%	0.462	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-85.9	127.9	176.4	51.5	0	0	0	0	111.3	G398	G398-S400 PolarHBondContact O-N 3.09Å
401	L	78.7	Confident	78.1	Confident	44 Å²	44	71.2 Å²	71.2	23%	0.23	40%	0.401	C	S	.	.			trans	-123.3	153	-173.4	-68	169.4	0	0	0	111.8	H392 S403 A406 L407 H410	H392-L401 PolarHBondContact O-N 2.88Å; L401-S403 VanDerWaalsContact C-N 3.33Å; L401-S403 PolarHBondContact O-N 3.26Å; L401-A406 HydrophobicContact CB-CB 4.45Å; L401-L407 HydrophobicContact CD1-CB 4.21Å; L401-L407 HydrophobicContact CD1-CD1 4.14Å; L401-H410 HydrophobicContact CD1-CB 3.53Å
402	S	73.4	Confident	79.2	Confident	85 Å²	85	65.8 Å²	65.8	59%	0.594	38%	0.38	S	S	*	.	S	Bend	trans	-79.4	-9.3	-170	54.4	0	0	0	0	114.9
403	S	77.6	Confident	79.8	Confident	46 Å²	46	67.2 Å²	67.2	32%	0.322	39%	0.393	S	S	.	.	S	Bend	trans	-158.9	155	178.6	70.7	0	0	0	0	112.4	L401 A405 A406 L407	L401-S403 VanDerWaalsContact C-N 3.33Å; L401-S403 PolarHBondContact O-N 3.26Å; S403-A405 VanDerWaalsContact C-N 3.26Å; S403-A405 PolarHBondContact O-N 3.48Å; S403-A406 PolarHBondContact O-N 2.94Å; S403-A406 WeakPolarHBondContact OG-CB 3.4Å; S403-A406 PolarHBondContact OG-N 3.16Å; S403-A406 VanDerWaalsContact OG-N 3.14Å; S403-L407 PolarHBondContact O-N 3.17Å
404	R	77.9	Confident	80	Confident	161 Å²	161	66.9 Å²	66.9	61%	0.608	39%	0.386	S	S	*	.	H	α-helix	trans	-59.6	-35.6	174.8	-172.6	172.8	174.3	80.4	-1.9	112.4	H392 L407 L408	H392-R404 PolarHBondContact CD2-N 3.37Å; H392-R404 PolarHBondContact NE2-N 2.85Å; R404-L407 PolarHBondContact O-N 3.22Å; R404-L408 HydrophobicContact CG-CD1 4.2Å; R404-L408 WeakPolarHBondContact O-CG 3.23Å; R404-L408 PolarHBondContact O-N 3.02Å
405	A	79.8	Confident	79.9	Confident	71 Å²	71	70.5 Å²	70.5	59%	0.587	41%	0.408	S	S	*	.	H	α-helix	trans	-66.6	-38.7	176.2	0	0	0	0	0	112.4	S403 L407 L409	S403-A405 VanDerWaalsContact C-N 3.26Å; S403-A405 PolarHBondContact O-N 3.48Å; A405-L407 VanDerWaalsContact C-N 3.32Å; A405-L409 VanDerWaalsContact O-CB 3.28Å; A405-L409 WeakPolarHBondContact O-CB 3.18Å; A405-L409 PolarHBondContact O-N 3.26Å; A405-L409 VanDerWaalsContact O-N 3.12Å
406	A	81.6	Confident	80	Confident	31 Å²	31	67.7 Å²	67.7	26%	0.256	39%	0.389	S	S	.	.	H	α-helix	trans	-67.7	-33.9	173	0	0	0	0	0	112	L401 S403 H410	L401-A406 HydrophobicContact CB-CB 4.45Å; S403-A406 PolarHBondContact O-N 2.94Å; S403-A406 WeakPolarHBondContact OG-CB 3.4Å; S403-A406 PolarHBondContact OG-N 3.16Å; S403-A406 VanDerWaalsContact OG-N 3.14Å; A406-H410 WeakPolarHBondContact O-CB 3.46Å; A406-H410 PolarHBondContact O-N 3.33Å
407	L	82.6	Confident	80.1	Confident	11 Å²	11	67 Å²	67	6%	0.058	39%	0.389	C	S	.	.	H	α-helix	trans	-67.3	-51.5	174.5	175	60.7	0	0	0	112.5	H392 C394 L401 S403 R404 A405 L409 H410 E411	H392-L407 HydrophobicContact CB-CB 4.05Å; H392-L407 HydrophobicContact CB-CD2 3.82Å; C394-L407 HydrophobicContact CB-CD1 3.58Å; L401-L407 HydrophobicContact CD1-CB 4.21Å; L401-L407 HydrophobicContact CD1-CD1 4.14Å; S403-L407 PolarHBondContact O-N 3.17Å; R404-L407 PolarHBondContact O-N 3.22Å; A405-L407 VanDerWaalsContact C-N 3.32Å; L407-L409 PolarHBondContact O-N 3.04Å; L407-H410 CarbonylContact O-C 3.57Å; L407-H410 WeakPolarHBondContact O-CA 3.41Å; L407-H410 WeakPolarHBondContact O-CB 3.49Å; L407-H410 PolarHBondContact O-N 2.82Å; L407-E411 HydrophobicContact CD1-CG 4.02Å; L407-E411 WeakPolarHBondContact CD1-OE1 3.34Å; L407-E411 HydrophobicContact CG-CG 4.4Å; L407-E411 VanDerWaalsContact CG-OE1 3.27Å; L407-E411 WeakPolarHBondContact CG-OE1 3.48Å; L407-E411 WeakPolarHBondContact O-CG 3.32Å; L407-E411 PolarHBondContact O-N 2.82Å
408	L	81.9	Confident	80.2	Confident	84 Å²	84	70.5 Å²	70.5	44%	0.44	40%	0.399	S	S	.	.	H	α-helix	trans	-57.1	-35.4	175.6	-70.5	164.9	0	0	0	112.3	R404 H410 E411 R412	R404-L408 HydrophobicContact CG-CD1 4.2Å; R404-L408 WeakPolarHBondContact O-CG 3.23Å; R404-L408 PolarHBondContact O-N 3.02Å; L408-H410 VanDerWaalsContact C-N 3.35Å; L408-E411 WeakPolarHBondContact CA-OE2 3.33Å; L408-R412 WeakPolarHBondContact O-CG 3.47Å; L408-R412 PolarHBondContact O-N 3.13Å
409	L	83.6	Confident	80.4	Confident	52 Å²	52	72 Å²	72	27%	0.272	40%	0.399	S	S	.	.	H	α-helix	trans	-71.8	-26.9	173.7	175.7	58.5	0	0	0	113.2	A405 L407 Q431	A405-L409 VanDerWaalsContact O-CB 3.28Å; A405-L409 WeakPolarHBondContact O-CB 3.18Å; A405-L409 PolarHBondContact O-N 3.26Å; A405-L409 VanDerWaalsContact O-N 3.12Å; L407-L409 PolarHBondContact O-N 3.04Å; L409-Q431 HydrophobicContact CD1-CG 3.43Å; L409-Q431 VanDerWaalsContact CD1-CG 3.43Å; L409-Q431 HydrophobicContact CD2-CG 4.23Å; L409-Q431 HydrophobicContact CG-CG 4.47Å
410	H	83.3	Confident	80.8	Confident	28 Å²	28	70.4 Å²	70.4	13%	0.13	39%	0.39	C	S	.	.	H	α-helix	trans	-81.5	-36.2	174.5	-177.6	28.5	0	0	0	112.3	C397 L401 A406 L407 L408 R412 T413 H414	C397-H410 PolarHBondContact SG-NE2 3.08Å; L401-H410 HydrophobicContact CD1-CB 3.53Å; A406-H410 WeakPolarHBondContact O-CB 3.46Å; A406-H410 PolarHBondContact O-N 3.33Å; L407-H410 CarbonylContact O-C 3.57Å; L407-H410 WeakPolarHBondContact O-CA 3.41Å; L407-H410 WeakPolarHBondContact O-CB 3.49Å; L407-H410 PolarHBondContact O-N 2.82Å; L408-H410 VanDerWaalsContact C-N 3.35Å; H410-R412 PolarHBondContact O-N 3.43Å; H410-T413 PolarHBondContact CE1-OG1 3.33Å; H410-T413 VanDerWaalsContact CE1-OG1 3.29Å; H410-T413 PolarHBondContact ND1-OG1 2.86Å; H410-T413 WeakPolarHBondContact O-CA 3.47Å; H410-T413 WeakPolarHBondContact O-CB 3.31Å; H410-T413 PolarHBondContact O-N 3.06Å; H410-T413 PolarHBondContact O-OG1 3.2Å; H410-H414 AromaticContact CE1-CE1 3.68Å; H410-H414 AromaticContact CE1-NE2 3.41Å; H410-H414 PolarHBondContact CE1-NE2 3.44Å; H410-H414 AromaticContact NE2-CE1 3.94Å; H410-H414 AromaticContact NE2-NE2 3.4Å; H410-H414 PolarHBondContact NE2-NE2 3.16Å
411	E	82.5	Confident	81.4	Confident	56 Å²	56	71.5 Å²	71.5	26%	0.262	39%	0.388	S	S	.	.	H	α-helix	trans	-61	-30.4	175.1	-70.4	160.4	168.3	0	0	111.3	L407 L408 T413 H414 T415	L407-E411 HydrophobicContact CD1-CG 4.02Å; L407-E411 WeakPolarHBondContact CD1-OE1 3.34Å; L407-E411 HydrophobicContact CG-CG 4.4Å; L407-E411 VanDerWaalsContact CG-OE1 3.27Å; L407-E411 WeakPolarHBondContact CG-OE1 3.48Å; L407-E411 WeakPolarHBondContact O-CG 3.32Å; L407-E411 PolarHBondContact O-N 2.82Å; L408-E411 WeakPolarHBondContact CA-OE2 3.33Å; E411-T413 PolarHBondContact O-N 3.15Å; E411-T413 VanDerWaalsContact O-N 3.16Å; E411-H414 PolarHBondContact O-N 2.97Å; E411-H414 VanDerWaalsContact O-N 3.14Å; E411-T415 PolarHBondContact O-N 2.81Å; E411-T415 PolarHBondContact O-OG1 3.26Å
412	R	83.8	Confident	82	Confident	79 Å²	79	69.4 Å²	69.4	30%	0.298	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-15.8	166.8	-69.8	179.2	-167.5	171.5	3.4	115.3	L408 H410 T415 G416 L417 T430	L408-R412 WeakPolarHBondContact O-CG 3.47Å; L408-R412 PolarHBondContact O-N 3.13Å; H410-R412 PolarHBondContact O-N 3.43Å; R412-T415 WeakPolarHBondContact CA-OG1 3.47Å; R412-G416 CarbonylContact O-C 3.54Å; R412-G416 PolarHBondContact O-N 3.29Å; R412-L417 HydrophobicContact CG-CB 4.24Å; R412-L417 PolarHBondContact O-N 2.82Å; R412-T430 HydrophobicContact CB-CG2 4.34Å; R412-T430 PolarHBondContact NH1-O 3.19Å; R412-T430 VanDerWaalsContact NH1-O 3.09Å
413	T	81.7	Confident	82.5	Confident	82 Å²	82	71.7 Å²	71.7	50%	0.503	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-15.9	176.5	69.2	0	0	0	0	113.4	H410 E411	H410-T413 PolarHBondContact CE1-OG1 3.33Å; H410-T413 VanDerWaalsContact CE1-OG1 3.29Å; H410-T413 PolarHBondContact ND1-OG1 2.86Å; H410-T413 WeakPolarHBondContact O-CA 3.47Å; H410-T413 WeakPolarHBondContact O-CB 3.31Å; H410-T413 PolarHBondContact O-N 3.06Å; H410-T413 PolarHBondContact O-OG1 3.2Å; E411-T413 PolarHBondContact O-N 3.15Å; E411-T413 VanDerWaalsContact O-N 3.16Å
414	H	81.4	Confident	82.9	Confident	72 Å²	72	74 Å²	74	33%	0.333	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-52.5	172.2	-55.2	-56.5	0	0	0	110.3	C394 E396 C397 H410 E411 G416	C394-H414 VanDerWaalsContact SG-CD2 3.54Å; C394-H414 PolarHBondContact SG-NE2 3.35Å; E396-H414 WeakPolarHBondContact OE2-CB 3.29Å; E396-H414 IonicContact OE2-CD2 3.81Å; E396-H414 PolarHBondContact OE2-CD2 2.95Å; E396-H414 IonicContact OE2-CG 2.58Å; C397-H414 PolarHBondContact SG-NE2 3.09Å; C397-H414 VanDerWaalsContact SG-NE2 3.39Å; H410-H414 AromaticContact CE1-CE1 3.68Å; H410-H414 AromaticContact CE1-NE2 3.41Å; H410-H414 PolarHBondContact CE1-NE2 3.44Å; H410-H414 AromaticContact NE2-CE1 3.94Å; H410-H414 AromaticContact NE2-NE2 3.4Å; H410-H414 PolarHBondContact NE2-NE2 3.16Å; E411-H414 PolarHBondContact O-N 2.97Å; E411-H414 VanDerWaalsContact O-N 3.14Å; H414-G416 PolarHBondContact O-N 2.84Å
415	T	79.3	Confident	83.3	Confident	77 Å²	77	69.5 Å²	69.5	47%	0.472	39%	0.393	S	S	.	.	S	Bend	trans	-65.9	-3.9	174.9	57.4	0	0	0	0	114.7	E411 R412 L417	E411-T415 PolarHBondContact O-N 2.81Å; E411-T415 PolarHBondContact O-OG1 3.26Å; R412-T415 WeakPolarHBondContact CA-OG1 3.47Å; T415-L417 PolarHBondContact O-N 3.43Å
416	G	80.8	Confident	83.5	Confident	42 Å²	42	67.9 Å²	67.9	43%	0.433	38%	0.383	S	S	.	.			trans	66.6	-4.4	-179.3	0	0	0	0	0	116	R412 H414 K418	R412-G416 CarbonylContact O-C 3.54Å; R412-G416 PolarHBondContact O-N 3.29Å; H414-G416 PolarHBondContact O-N 2.84Å; G416-K418 WeakPolarHBondContact O-CG 3.26Å; G416-K418 PolarHBondContact O-N 3.04Å; G416-K418 VanDerWaalsContact O-N 3.16Å
417	L	79.4	Confident	83.8	Confident	107 Å²	107	68 Å²	68	56%	0.56	38%	0.383	S	S	*	.			trans	-60	113.6	-170.5	-69.4	175.5	0	0	0	112.5	R412 T415 P419	R412-L417 HydrophobicContact CG-CB 4.24Å; R412-L417 PolarHBondContact O-N 2.82Å; T415-L417 PolarHBondContact O-N 3.43Å; L417-P419 WeakPolarHBondContact O-CD 3.44Å
418	K	84.6	Confident	84.1	Confident	119 Å²	119	72.6 Å²	72.6	52%	0.517	40%	0.403	S	S	.	.			trans	-121.3	79	-178.5	-73.7	155.7	175.6	177.4	0	110.6	G416 Y420 K428 F429 T430	G416-K418 WeakPolarHBondContact O-CG 3.26Å; G416-K418 PolarHBondContact O-N 3.04Å; G416-K418 VanDerWaalsContact O-N 3.16Å; K418-Y420 PolarHBondContact O-N 3.4Å; K418-Y420 VanDerWaalsContact O-N 3.11Å; K418-K428 HydrophobicContact CB-CB 3.65Å; K418-K428 HydrophobicContact CD-CB 4.17Å; K418-K428 WeakPolarHBondContact CD-O 3.45Å; K418-K428 HydrophobicContact CG-CB 4.47Å; K418-F429 CarbonylContact C-O 3.19Å; K418-F429 VanDerWaalsContact CA-O 3.24Å; K418-F429 WeakPolarHBondContact CA-O 3.35Å; K418-T430 HydrophobicContact CG-CG2 3.83Å
419	P	82.4	Confident	84.3	Confident	84 Å²	84	71 Å²	71	55%	0.545	39%	0.393	S	S	.	.			trans	-72.7	-3.2	-170.5	-17.8	33	0	0	0	115.5	L417	L417-P419 WeakPolarHBondContact O-CD 3.44Å
420	Y	84.9	Confident	84.4	Confident	81 Å²	81	70.1 Å²	70.1	32%	0.318	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	98.2	-171.9	-60.1	-77	0	0	0	110	K418 F429 N432	K418-Y420 PolarHBondContact O-N 3.4Å; K418-Y420 VanDerWaalsContact O-N 3.11Å; Y420-F429 PolarHBondContact N-O 3.32Å; Y420-F429 VanDerWaalsContact N-O 3.13Å; Y420-F429 PolarHBondContact O-N 3.39Å; Y420-N432 HydrophobicContact CD1-CB 3.8Å; Y420-N432 HydrophobicContact CE1-CB 3.66Å; Y420-N432 HydrophobicContact CG-CB 4.31Å
421	E	88.9	Confident	84.5	Confident	89 Å²	89	72.3 Å²	72.3	42%	0.416	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	143.6	-176.5	-175.7	154.5	-166.1	0	0	112.4	K428	E421-K428 HydrophobicContact CB-CG 4.3Å; E421-K428 HydrophobicContact CG-CD 4.41Å; E421-K428 HydrophobicContact CG-CG 4.03Å; E421-K428 WeakPolarHBondContact OE1-CE 3.44Å; E421-K428 IonicContact OE1-NZ 2.94Å; E421-K428 PolarHBondContact OE1-NZ 3.41Å; E421-K428 WeakPolarHBondContact OE2-CD 3.47Å; E421-K428 VanDerWaalsContact OE2-CE 3.28Å; E421-K428 WeakPolarHBondContact OE2-CE 3.36Å; E421-K428 IonicContact OE2-NZ 2.67Å; E421-K428 PolarHBondContact OE2-NZ 3.14Å
422	C	90.6	Very high	84.6	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.007	41%	0.405	C	S	.	.			trans	-89.2	114	176.9	-172.6	0	0	0	0	111.2	V424 C425 G426 A427 F429 L435 H439 H442	C422-V424 PolarHBondContact O-N 3.29Å; C422-C425 PolarHBondContact O-N 2.63Å; C422-G426 WeakPolarHBondContact O-CA 3.25Å; C422-G426 PolarHBondContact O-N 3.25Å; C422-A427 HydrophobicContact CB-CB 4.26Å; C422-A427 WeakPolarHBondContact CB-O 3.48Å; C422-A427 PolarHBondContact N-O 3.27Å; C422-F429 HydrophobicContact CB-CE2 4.41Å; C422-L435 HydrophobicContact CB-CD1 3.72Å; C422-H439 VanDerWaalsContact SG-CD2 3.52Å; C422-H439 PolarHBondContact SG-NE2 3.3Å; C422-H442 VanDerWaalsContact SG-CD2 3.54Å; C422-H442 PolarHBondContact SG-NE2 3.18Å; C422-H442 VanDerWaalsContact SG-NE2 3.41Å
423	T	84.9	Confident	84.7	Confident	133 Å²	133	72.5 Å²	72.5	82%	0.816	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-13.9	179.2	52.6	0	0	0	0	114.8
424	V	85.5	Confident	84.9	Confident	93 Å²	93	69.7 Å²	69.7	56%	0.564	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-19.4	-178.3	-174.9	0	0	0	0	112.6	C422 H442	C422-V424 PolarHBondContact O-N 3.29Å; V424-H442 HydrophobicContact CG1-CB 4.12Å
425	C	86.2	Confident	85.3	Confident	68 Å²	68	67.2 Å²	67.2	46%	0.459	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.6	11.9	-174.4	67.1	0	0	0	0	116.2	C422 A427 H438 H442	C422-C425 PolarHBondContact O-N 2.63Å; C425-A427 PolarHBondContact O-N 3.13Å; C425-A427 VanDerWaalsContact SG-CB 3.56Å; C425-H438 PolarHBondContact SG-NE2 2.89Å; C425-H442 PolarHBondContact SG-NE2 2.85Å
426	G	84.8	Confident	85.5	Confident	37 Å²	37	70.1 Å²	70.1	38%	0.381	39%	0.394	S	S	.	.			trans	66.6	2.4	-179.7	0	0	0	0	0	115.6	C422 K428	C422-G426 WeakPolarHBondContact O-CA 3.25Å; C422-G426 PolarHBondContact O-N 3.25Å; G426-K428 WeakPolarHBondContact O-CG 3.31Å; G426-K428 PolarHBondContact O-N 3.28Å
427	A	86.9	Confident	85.8	Confident	32 Å²	32	72 Å²	72	26%	0.264	39%	0.393	S	S	.	.			trans	-66.4	120	-177.5	0	0	0	0	0	111.2	C422 C425 F429	C422-A427 HydrophobicContact CB-CB 4.26Å; C422-A427 WeakPolarHBondContact CB-O 3.48Å; C422-A427 PolarHBondContact N-O 3.27Å; C425-A427 PolarHBondContact O-N 3.13Å; C425-A427 VanDerWaalsContact SG-CB 3.56Å; A427-F429 HydrophobicContact CB-CE2 3.67Å; A427-F429 HydrophobicContact CB-CZ 3.93Å; A427-F429 VanDerWaalsContact O-CD2 3.26Å; A427-F429 WeakPolarHBondContact O-CD2 3.35Å; A427-F429 WeakPolarHBondContact O-CE2 3.33Å
428	K	87.9	Confident	86.2	Confident	109 Å²	109	68.7 Å²	68.7	47%	0.474	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.7	-175.1	-40.7	-162.7	-168.3	-138.5	0	112.2	K418 E421 G426	K418-K428 HydrophobicContact CB-CB 3.65Å; K418-K428 HydrophobicContact CD-CB 4.17Å; K418-K428 WeakPolarHBondContact CD-O 3.45Å; K418-K428 HydrophobicContact CG-CB 4.47Å; E421-K428 HydrophobicContact CB-CG 4.3Å; E421-K428 HydrophobicContact CG-CD 4.41Å; E421-K428 HydrophobicContact CG-CG 4.03Å; E421-K428 WeakPolarHBondContact OE1-CE 3.44Å; E421-K428 IonicContact OE1-NZ 2.94Å; E421-K428 PolarHBondContact OE1-NZ 3.41Å; E421-K428 WeakPolarHBondContact OE2-CD 3.47Å; E421-K428 VanDerWaalsContact OE2-CE 3.28Å; E421-K428 WeakPolarHBondContact OE2-CE 3.36Å; E421-K428 IonicContact OE2-NZ 2.67Å; E421-K428 PolarHBondContact OE2-NZ 3.14Å; G426-K428 WeakPolarHBondContact O-CG 3.31Å; G426-K428 PolarHBondContact O-N 3.28Å
429	F	87	Confident	86.2	Confident	50 Å²	50	65.8 Å²	65.8	22%	0.219	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	150.8	-174.1	-60.4	-89.6	0	0	0	112.6	K418 Y420 C422 A427 Q431 A434 L435 H438	K418-F429 CarbonylContact C-O 3.19Å; K418-F429 VanDerWaalsContact CA-O 3.24Å; K418-F429 WeakPolarHBondContact CA-O 3.35Å; Y420-F429 PolarHBondContact N-O 3.32Å; Y420-F429 VanDerWaalsContact N-O 3.13Å; Y420-F429 PolarHBondContact O-N 3.39Å; C422-F429 HydrophobicContact CB-CE2 4.41Å; A427-F429 HydrophobicContact CB-CE2 3.67Å; A427-F429 HydrophobicContact CB-CZ 3.93Å; A427-F429 VanDerWaalsContact O-CD2 3.26Å; A427-F429 WeakPolarHBondContact O-CD2 3.35Å; A427-F429 WeakPolarHBondContact O-CE2 3.33Å; F429-Q431 VanDerWaalsContact C-N 3.31Å; F429-A434 HydrophobicContact CB-CB 4.23Å; F429-A434 HydrophobicContact CD1-CB 3.9Å; F429-A434 HydrophobicContact CG-CB 4.33Å; F429-L435 HydrophobicContact CD2-CB 4.23Å; F429-L435 HydrophobicContact CD2-CD1 3.71Å; F429-L435 HydrophobicContact CE2-CD1 4.02Å; F429-H438 HydrophobicContact CE1-CB 4.09Å; F429-H438 HydrophobicContact CE2-CB 3.97Å; F429-H438 AromaticContact CE2-CD2 3.34Å; F429-H438 WeakPolarHBondContact CE2-CD2 3.4Å; F429-H438 AromaticContact CE2-CG 3.8Å; F429-H438 HydrophobicContact CZ-CB 3.54Å; F429-H438 AromaticContact CZ-CD2 3.36Å; F429-H438 WeakPolarHBondContact CZ-CD2 3.36Å; F429-H438 AromaticContact CZ-CG 3.37Å
430	T	85.2	Confident	86.4	Confident	34 Å²	34	65.3 Å²	65.3	21%	0.209	35%	0.35	C	S	.	.	S	Bend	trans	-79.8	-11	177.9	58.8	0	0	0	0	113.9	R412 K418	R412-T430 HydrophobicContact CB-CG2 4.34Å; R412-T430 PolarHBondContact NH1-O 3.19Å; R412-T430 VanDerWaalsContact NH1-O 3.09Å; K418-T430 HydrophobicContact CG-CG2 3.83Å
431	Q	85.6	Confident	86.4	Confident	74 Å²	74	66 Å²	66	35%	0.346	36%	0.363	S	S	.	.			trans	-142.9	141.1	-177.8	-58.5	176.5	50.4	0	0	112.6	L409 F429 S433 A434 L435	L409-Q431 HydrophobicContact CD1-CG 3.43Å; L409-Q431 VanDerWaalsContact CD1-CG 3.43Å; L409-Q431 HydrophobicContact CD2-CG 4.23Å; L409-Q431 HydrophobicContact CG-CG 4.47Å; F429-Q431 VanDerWaalsContact C-N 3.31Å; Q431-S433 VanDerWaalsContact CB-OG 3.25Å; Q431-S433 WeakPolarHBondContact CB-OG 3.36Å; Q431-S433 PolarHBondContact O-N 2.83Å; Q431-S433 PolarHBondContact OE1-OG 3.37Å; Q431-A434 HydrophobicContact CB-CB 4.35Å; Q431-A434 PolarHBondContact O-N 2.9Å; Q431-A434 VanDerWaalsContact O-N 3.15Å; Q431-L435 PolarHBondContact O-N 3.09Å; Q431-L435 VanDerWaalsContact O-N 3.11Å
432	N	85.6	Confident	86.2	Confident	68 Å²	68	65.3 Å²	65.3	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-59.7	-33.5	170.4	-163.8	-11.9	0	0	0	112.4	Y420 A434 L435 K436	Y420-N432 HydrophobicContact CD1-CB 3.8Å; Y420-N432 HydrophobicContact CE1-CB 3.66Å; Y420-N432 HydrophobicContact CG-CB 4.31Å; N432-A434 VanDerWaalsContact C-N 3.33Å; N432-A434 PolarHBondContact O-N 3.22Å; N432-L435 PolarHBondContact O-N 3.18Å; N432-K436 WeakPolarHBondContact O-CB 3.42Å; N432-K436 WeakPolarHBondContact O-CG 3.38Å; N432-K436 PolarHBondContact O-N 3.4Å; N432-K436 WeakPolarHBondContact OD1-CE 3.46Å
433	S	85.6	Confident	85.8	Confident	71 Å²	71	69.2 Å²	69.2	50%	0.497	38%	0.384	S	S	.	.	H	α-helix	trans	-59.3	-41.4	174.4	56	0	0	0	0	112.5	Q431 M437	Q431-S433 VanDerWaalsContact CB-OG 3.25Å; Q431-S433 WeakPolarHBondContact CB-OG 3.36Å; Q431-S433 PolarHBondContact O-N 2.83Å; Q431-S433 PolarHBondContact OE1-OG 3.37Å; S433-M437 VanDerWaalsContact O-CB 3.31Å; S433-M437 WeakPolarHBondContact O-CB 3.14Å; S433-M437 PolarHBondContact O-N 3.36Å; S433-M437 VanDerWaalsContact O-N 3.1Å
434	A	85.8	Confident	85.7	Confident	23 Å²	23	65 Å²	65	19%	0.19	37%	0.366	C	S	.	.	H	α-helix	trans	-71.8	-40.9	176.2	0	0	0	0	0	111.4	F429 Q431 N432 M437 H438	F429-A434 HydrophobicContact CB-CB 4.23Å; F429-A434 HydrophobicContact CD1-CB 3.9Å; F429-A434 HydrophobicContact CG-CB 4.33Å; Q431-A434 HydrophobicContact CB-CB 4.35Å; Q431-A434 PolarHBondContact O-N 2.9Å; Q431-A434 VanDerWaalsContact O-N 3.15Å; N432-A434 VanDerWaalsContact C-N 3.33Å; N432-A434 PolarHBondContact O-N 3.22Å; A434-M437 PolarHBondContact O-N 3.15Å; A434-H438 WeakPolarHBondContact O-CB 3.32Å; A434-H438 PolarHBondContact O-N 3.43Å
435	L	88.8	Confident	85.6	Confident	20 Å²	20	65.2 Å²	65.2	11%	0.105	36%	0.361	C	S	.	.	H	α-helix	trans	-59.5	-51.4	174.1	-179.1	66.6	0	0	0	111.8	C422 F429 Q431 N432 M437 H438 H439	C422-L435 HydrophobicContact CB-CD1 3.72Å; F429-L435 HydrophobicContact CD2-CB 4.23Å; F429-L435 HydrophobicContact CD2-CD1 3.71Å; F429-L435 HydrophobicContact CE2-CD1 4.02Å; Q431-L435 PolarHBondContact O-N 3.09Å; Q431-L435 VanDerWaalsContact O-N 3.11Å; N432-L435 PolarHBondContact O-N 3.18Å; L435-M437 VanDerWaalsContact C-N 3.25Å; L435-M437 PolarHBondContact O-N 3.42Å; L435-H438 CarbonylContact O-C 3.57Å; L435-H438 WeakPolarHBondContact O-CA 3.24Å; L435-H438 WeakPolarHBondContact O-CB 3.46Å; L435-H438 PolarHBondContact O-N 3.28Å; L435-H439 WeakPolarHBondContact CD1-NE2 3.48Å; L435-H439 PolarHBondContact O-CD2 3.15Å; L435-H439 VanDerWaalsContact O-CD2 3.24Å; L435-H439 PolarHBondContact O-N 3Å
436	K	85.2	Confident	85.5	Confident	138 Å²	138	67.4 Å²	67.4	60%	0.6	36%	0.362	S	S	*	.	H	α-helix	trans	-60.7	-33.5	176.6	-72.2	-176.8	179.8	-172.5	0	112.7	N432	N432-K436 WeakPolarHBondContact O-CB 3.42Å; N432-K436 WeakPolarHBondContact O-CG 3.38Å; N432-K436 PolarHBondContact O-N 3.4Å; N432-K436 WeakPolarHBondContact OD1-CE 3.46Å
437	M	85.8	Confident	85.6	Confident	82 Å²	82	68.6 Å²	68.6	40%	0.404	36%	0.363	S	S	.	.	H	α-helix	trans	-71.5	-33.2	173.9	-175.1	175.8	69.7	0	0	112.4	S433 A434 L435 Q459	S433-M437 VanDerWaalsContact O-CB 3.31Å; S433-M437 WeakPolarHBondContact O-CB 3.14Å; S433-M437 PolarHBondContact O-N 3.36Å; S433-M437 VanDerWaalsContact O-N 3.1Å; A434-M437 PolarHBondContact O-N 3.15Å; L435-M437 VanDerWaalsContact C-N 3.25Å; L435-M437 PolarHBondContact O-N 3.42Å; M437-Q459 HydrophobicContact CG-CG 4.41Å; M437-Q459 HydrophobicContact SD-CG 4.15Å; M437-Q459 PolarHBondContact SD-NE2 2.93Å
438	H	87.5	Confident	85.5	Confident	37 Å²	37	70.1 Å²	70.1	17%	0.171	36%	0.363	C	S	.	.	H	α-helix	trans	-75.3	-37	174.8	174.5	53.8	0	0	0	112.9	C425 F429 A434 L435 R440 T441 H442	C425-H438 PolarHBondContact SG-NE2 2.89Å; F429-H438 HydrophobicContact CE1-CB 4.09Å; F429-H438 HydrophobicContact CE2-CB 3.97Å; F429-H438 AromaticContact CE2-CD2 3.34Å; F429-H438 WeakPolarHBondContact CE2-CD2 3.4Å; F429-H438 AromaticContact CE2-CG 3.8Å; F429-H438 HydrophobicContact CZ-CB 3.54Å; F429-H438 AromaticContact CZ-CD2 3.36Å; F429-H438 WeakPolarHBondContact CZ-CD2 3.36Å; F429-H438 AromaticContact CZ-CG 3.37Å; A434-H438 WeakPolarHBondContact O-CB 3.32Å; A434-H438 PolarHBondContact O-N 3.43Å; L435-H438 CarbonylContact O-C 3.57Å; L435-H438 WeakPolarHBondContact O-CA 3.24Å; L435-H438 WeakPolarHBondContact O-CB 3.46Å; L435-H438 PolarHBondContact O-N 3.28Å; H438-R440 PolarHBondContact O-N 3.37Å; H438-T441 PolarHBondContact CE1-OG1 3.28Å; H438-T441 PolarHBondContact ND1-OG1 3.3Å; H438-T441 PolarHBondContact O-N 3.37Å; H438-T441 PolarHBondContact O-OG1 3.4Å; H438-H442 AromaticContact CD2-NE2 3.9Å; H438-H442 AromaticContact CE1-CE1 3.82Å; H438-H442 AromaticContact CE1-NE2 3.43Å; H438-H442 PolarHBondContact CE1-NE2 3.02Å; H438-H442 AromaticContact NE2-CD2 3.98Å; H438-H442 AromaticContact NE2-CE1 3.85Å; H438-H442 AromaticContact NE2-NE2 3.09Å; H438-H442 PolarHBondContact NE2-NE2 3.42Å
439	H	85.2	Confident	85.5	Confident	58 Å²	58	66.8 Å²	66.8	27%	0.269	36%	0.356	S	S	.	.	H	α-helix	trans	-55.6	-30.3	175.8	-82.3	-136.5	0	0	0	112.5	C422 L435 T441 H442 T443	C422-H439 VanDerWaalsContact SG-CD2 3.52Å; C422-H439 PolarHBondContact SG-NE2 3.3Å; L435-H439 WeakPolarHBondContact CD1-NE2 3.48Å; L435-H439 PolarHBondContact O-CD2 3.15Å; L435-H439 VanDerWaalsContact O-CD2 3.24Å; L435-H439 PolarHBondContact O-N 3Å; H439-T441 PolarHBondContact O-N 3.42Å; H439-H442 PolarHBondContact O-N 3.43Å; H439-T443 PolarHBondContact O-N 3.4Å
440	R	86.5	Confident	85.6	Confident	73 Å²	73	64.9 Å²	64.9	28%	0.275	35%	0.349	S	S	.	.	H	α-helix	trans	-65.7	-15.1	172.7	-63.4	-175.9	179.6	155.8	7.3	115.1	H438 G444 E445 S458	H438-R440 PolarHBondContact O-N 3.37Å; R440-G444 CarbonylContact O-C 3.44Å; R440-G444 WeakPolarHBondContact O-CA 3.41Å; R440-G444 PolarHBondContact O-N 2.63Å; R440-E445 HydrophobicContact CB-CB 4.25Å; R440-E445 HydrophobicContact CG-CB 4.03Å; R440-E445 PolarHBondContact O-N 2.88Å; R440-S458 PolarHBondContact NH1-O 3.49Å
441	T	85.3	Confident	85.6	Confident	96 Å²	96	69.3 Å²	69.3	59%	0.589	37%	0.371	S	S	*	.	H	α-helix	trans	-78.6	-24.9	170	65.1	0	0	0	0	112	H438 H439	H438-T441 PolarHBondContact CE1-OG1 3.28Å; H438-T441 PolarHBondContact ND1-OG1 3.3Å; H438-T441 PolarHBondContact O-N 3.37Å; H438-T441 PolarHBondContact O-OG1 3.4Å; H439-T441 PolarHBondContact O-N 3.42Å
442	H	84.3	Confident	85.5	Confident	74 Å²	74	71 Å²	71	34%	0.343	38%	0.382	S	S	.	.	H	α-helix	trans	-86.7	-46.7	175.9	-58.3	-48.6	0	0	0	111.9	C422 V424 C425 H438 H439 G444	C422-H442 VanDerWaalsContact SG-CD2 3.54Å; C422-H442 PolarHBondContact SG-NE2 3.18Å; C422-H442 VanDerWaalsContact SG-NE2 3.41Å; V424-H442 HydrophobicContact CG1-CB 4.12Å; C425-H442 PolarHBondContact SG-NE2 2.85Å; H438-H442 AromaticContact CD2-NE2 3.9Å; H438-H442 AromaticContact CE1-CE1 3.82Å; H438-H442 AromaticContact CE1-NE2 3.43Å; H438-H442 PolarHBondContact CE1-NE2 3.02Å; H438-H442 AromaticContact NE2-CD2 3.98Å; H438-H442 AromaticContact NE2-CE1 3.85Å; H438-H442 AromaticContact NE2-NE2 3.09Å; H438-H442 PolarHBondContact NE2-NE2 3.42Å; H439-H442 PolarHBondContact O-N 3.43Å; H442-G444 PolarHBondContact O-N 2.94Å
443	T	82.3	Confident	85.6	Confident	84 Å²	84	69.7 Å²	69.7	52%	0.515	38%	0.378	S	S	.	.	S	Bend	trans	-74.7	-7.2	176.9	66	0	0	0	0	113.5	H439 E445	H439-T443 PolarHBondContact O-N 3.4Å; T443-E445 WeakPolarHBondContact CB-OE1 3.28Å; T443-E445 PolarHBondContact O-N 2.86Å; T443-E445 VanDerWaalsContact O-N 3.08Å; T443-E445 WeakPolarHBondContact OG1-CB 3.23Å; T443-E445 VanDerWaalsContact OG1-CD 3.31Å; T443-E445 VanDerWaalsContact OG1-CG 3.3Å; T443-E445 WeakPolarHBondContact OG1-CG 3.36Å; T443-E445 PolarHBondContact OG1-OE1 3.21Å
444	G	82.8	Confident	85.6	Confident	43 Å²	43	74 Å²	74	44%	0.443	40%	0.395	S	S	.	.			trans	66.9	2.4	-174.9	0	0	0	0	0	114.7	R440 H442 K446	R440-G444 CarbonylContact O-C 3.44Å; R440-G444 WeakPolarHBondContact O-CA 3.41Å; R440-G444 PolarHBondContact O-N 2.63Å; H442-G444 PolarHBondContact O-N 2.94Å; G444-K446 PolarHBondContact O-N 3.34Å
445	E	82.9	Confident	85.5	Confident	99 Å²	99	75.3 Å²	75.3	46%	0.463	40%	0.403	S	S	.	.			trans	-56.5	120.7	-172.4	-88.7	171.7	-116.2	0	0	113.2	R440 T443 P447	R440-E445 HydrophobicContact CB-CB 4.25Å; R440-E445 HydrophobicContact CG-CB 4.03Å; R440-E445 PolarHBondContact O-N 2.88Å; T443-E445 WeakPolarHBondContact CB-OE1 3.28Å; T443-E445 PolarHBondContact O-N 2.86Å; T443-E445 VanDerWaalsContact O-N 3.08Å; T443-E445 WeakPolarHBondContact OG1-CB 3.23Å; T443-E445 VanDerWaalsContact OG1-CD 3.31Å; T443-E445 VanDerWaalsContact OG1-CG 3.3Å; T443-E445 WeakPolarHBondContact OG1-CG 3.36Å; T443-E445 PolarHBondContact OG1-OE1 3.21Å; E445-P447 WeakPolarHBondContact O-CD 3.4Å
446	K	85.3	Confident	85.4	Confident	113 Å²	113	81 Å²	81	49%	0.491	42%	0.423	S	S	.	.			trans	-123.7	82.3	174.8	-70.8	155.7	174.5	177.8	0	109.5	G444 Y448 R456 F457	G444-K446 PolarHBondContact O-N 3.34Å; K446-Y448 PolarHBondContact O-N 3.12Å; K446-R456 HydrophobicContact CB-CB 3.47Å; K446-R456 VanDerWaalsContact CB-CB 3.47Å; K446-R456 HydrophobicContact CD-CB 4.25Å; K446-R456 WeakPolarHBondContact CD-O 3.4Å; K446-R456 HydrophobicContact CG-CB 4.38Å; K446-R456 PolarHBondContact O-NE 2.94Å; K446-R456 PolarHBondContact O-NH2 3.06Å; K446-R456 VanDerWaalsContact O-NH2 3.17Å; K446-F457 CarbonylContact C-O 3.5Å; K446-F457 WeakPolarHBondContact CA-O 3.27Å
447	P	85.5	Confident	85.5	Confident	62 Å²	62	76.7 Å²	76.7	40%	0.403	40%	0.404	S	S	.	.			trans	-67.5	-22.7	-176.3	-21.7	34.7	0	0	0	113.8	E445	E445-P447 WeakPolarHBondContact O-CD 3.4Å
448	Y	86.1	Confident	85.4	Confident	64 Å²	64	74.5 Å²	74.5	25%	0.251	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	87.1	-173.4	-52.9	-75.7	0	0	0	110.3	K446 F457 S458 Q459 R460	K446-Y448 PolarHBondContact O-N 3.12Å; Y448-F457 WeakPolarHBondContact CB-O 3.49Å; Y448-F457 WeakPolarHBondContact CD2-O 3.47Å; Y448-F457 PolarHBondContact N-O 2.96Å; Y448-F457 PolarHBondContact O-N 3.23Å; Y448-S458 WeakPolarHBondContact CE2-O 3.42Å; Y448-Q459 VanDerWaalsContact CD2-C 3.41Å; Y448-R460 HydrophobicContact CD1-CB 3.99Å; Y448-R460 HydrophobicContact CD1-CG 4.48Å; Y448-R460 HydrophobicContact CE1-CB 3.81Å; Y448-R460 HydrophobicContact CE1-CG 4.47Å; Y448-R460 HydrophobicContact CE2-CB 4.44Å; Y448-R460 HydrophobicContact CG-CB 4.39Å
449	A	86.9	Confident	85.3	Confident	39 Å²	39	75.2 Å²	75.2	32%	0.322	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	158.9	171.6	0	0	0	0	0	112	R456 L463	A449-R456 HydrophobicContact CB-CG 4.1Å; A449-L463 WeakPolarHBondContact O-CD1 3.41Å; A449-L463 WeakPolarHBondContact O-CD2 3.44Å
450	C	88.9	Confident	85.3	Confident	11 Å²	11	81.2 Å²	81.2	7%	0.074	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	137.4	167.8	-165	0	0	0	0	110.2	L452 C453 S455 L463	C450-L452 PolarHBondContact O-N 2.92Å; C450-C453 WeakPolarHBondContact CB-O 3.36Å; C450-S455 WeakPolarHBondContact CB-O 3.45Å; C450-S455 PolarHBondContact N-O 3.14Å; C450-S455 VanDerWaalsContact N-O 3.08Å; C450-L463 HydrophobicContact CB-CD1 3.71Å
451	D	86.8	Confident	85	Confident	126 Å²	126	83.2 Å²	83.2	67%	0.674	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-0.5	-179.2	-27	-65.5	0	0	0	112.5	K467	D451-K467 WeakPolarHBondContact OD2-CE 3.49Å; D451-K467 IonicContact OD2-NZ 3.04Å; D451-K467 PolarHBondContact OD2-NZ 3.37Å
452	L	83.3	Confident	85	Confident	110 Å²	110	82.9 Å²	82.9	58%	0.576	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	-10.8	-176.2	-59.2	177.1	0	0	0	113.6	C450 H470	C450-L452 PolarHBondContact O-N 2.92Å; L452-H470 HydrophobicContact CD1-CB 3.57Å
453	C	87.8	Confident	85.1	Confident	41 Å²	41	80.3 Å²	80.3	28%	0.277	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.4	167.1	169.6	69	0	0	0	0	111.2	C450 S455 H466 H470	C450-C453 WeakPolarHBondContact CB-O 3.36Å; C453-S455 PolarHBondContact O-N 3.22Å; C453-S455 PolarHBondContact SG-OG 2.84Å; C453-S455 VanDerWaalsContact SG-OG 3.4Å; C453-H466 PolarHBondContact SG-NE2 3.01Å; C453-H466 VanDerWaalsContact SG-NE2 3.37Å; C453-H470 VanDerWaalsContact SG-CE1 3.51Å; C453-H470 PolarHBondContact SG-NE2 3.2Å; C453-H470 VanDerWaalsContact SG-NE2 3.37Å
454	D	84.6	Confident	85.1	Confident	162 Å²	162	78.7 Å²	78.7	87%	0.866	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	8.6	-175	-43.3	-74.5	0	0	0	115.2	R456	D454-R456 PolarHBondContact O-N 2.67Å
455	S	83.5	Confident	85.1	Confident	49 Å²	49	80.7 Å²	80.7	34%	0.343	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	110.9	177.7	-67.7	0	0	0	0	111.3	C450 C453 F457	C450-S455 WeakPolarHBondContact CB-O 3.45Å; C450-S455 PolarHBondContact N-O 3.14Å; C450-S455 VanDerWaalsContact N-O 3.08Å; C453-S455 PolarHBondContact O-N 3.22Å; C453-S455 PolarHBondContact SG-OG 2.84Å; C453-S455 VanDerWaalsContact SG-OG 3.4Å; S455-F457 VanDerWaalsContact O-CE2 3.26Å; S455-F457 WeakPolarHBondContact O-CE2 3.34Å
456	R	87.2	Confident	85.2	Confident	141 Å²	141	77.5 Å²	77.5	53%	0.532	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	141.6	176.6	-50.8	-178.1	64.6	126.9	-0.5	111.8	K446 A449 D454	K446-R456 HydrophobicContact CB-CB 3.47Å; K446-R456 VanDerWaalsContact CB-CB 3.47Å; K446-R456 HydrophobicContact CD-CB 4.25Å; K446-R456 WeakPolarHBondContact CD-O 3.4Å; K446-R456 HydrophobicContact CG-CB 4.38Å; K446-R456 PolarHBondContact O-NE 2.94Å; K446-R456 PolarHBondContact O-NH2 3.06Å; K446-R456 VanDerWaalsContact O-NH2 3.17Å; A449-R456 HydrophobicContact CB-CG 4.1Å; D454-R456 PolarHBondContact O-N 2.67Å
457	F	86.4	Confident	85.1	Confident	47 Å²	47	75.7 Å²	75.7	21%	0.206	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	149.6	-175.7	-57.9	-88.4	0	0	0	112	K446 Y448 S455 Q459 M462 L463 H466	K446-F457 CarbonylContact C-O 3.5Å; K446-F457 WeakPolarHBondContact CA-O 3.27Å; Y448-F457 WeakPolarHBondContact CB-O 3.49Å; Y448-F457 WeakPolarHBondContact CD2-O 3.47Å; Y448-F457 PolarHBondContact N-O 2.96Å; Y448-F457 PolarHBondContact O-N 3.23Å; S455-F457 VanDerWaalsContact O-CE2 3.26Å; S455-F457 WeakPolarHBondContact O-CE2 3.34Å; F457-Q459 VanDerWaalsContact C-N 3.33Å; F457-M462 HydrophobicContact CB-CB 4.35Å; F457-M462 HydrophobicContact CD1-CB 4.02Å; F457-M462 HydrophobicContact CG-CB 4.41Å; F457-L463 HydrophobicContact CB-CB 4.35Å; F457-L463 HydrophobicContact CD2-CB 3.96Å; F457-L463 HydrophobicContact CD2-CD1 3.99Å; F457-L463 HydrophobicContact CE2-CD1 4.24Å; F457-L463 HydrophobicContact CG-CB 4.33Å; F457-H466 HydrophobicContact CE1-CB 4.06Å; F457-H466 HydrophobicContact CE2-CB 3.77Å; F457-H466 AromaticContact CE2-CD2 3.36Å; F457-H466 WeakPolarHBondContact CE2-CD2 3.32Å; F457-H466 AromaticContact CE2-CG 3.58Å; F457-H466 HydrophobicContact CZ-CB 3.43Å; F457-H466 VanDerWaalsContact CZ-CB 3.43Å; F457-H466 AromaticContact CZ-CD2 3.55Å; F457-H466 AromaticContact CZ-CG 3.29Å; F457-H466 AromaticContact CZ-ND1 3.81Å
458	S	85.5	Confident	85.1	Confident	36 Å²	36	76.4 Å²	76.4	25%	0.252	38%	0.376	S	S	.	.	S	Bend	trans	-81	-11.9	176.4	54.7	0	0	0	0	113.7	R440 Y448	R440-S458 PolarHBondContact NH1-O 3.49Å; Y448-S458 WeakPolarHBondContact CE2-O 3.42Å
459	Q	85.1	Confident	84.8	Confident	52 Å²	52	77.3 Å²	77.3	24%	0.243	39%	0.392	C	S	.	.	S	Bend	trans	-140.2	135.1	-175	-56.4	-179.3	38.2	0	0	112.5	M437 Y448 F457 H461 M462 L463	M437-Q459 HydrophobicContact CG-CG 4.41Å; M437-Q459 HydrophobicContact SD-CG 4.15Å; M437-Q459 PolarHBondContact SD-NE2 2.93Å; Y448-Q459 VanDerWaalsContact CD2-C 3.41Å; F457-Q459 VanDerWaalsContact C-N 3.33Å; Q459-H461 VanDerWaalsContact C-N 3.33Å; Q459-H461 PolarHBondContact O-N 3.41Å; Q459-H461 PolarHBondContact OE1-CE1 3.05Å; Q459-M462 HydrophobicContact CB-CG 4.35Å; Q459-M462 PolarHBondContact O-N 3.45Å; Q459-M462 VanDerWaalsContact O-N 3.15Å; Q459-L463 PolarHBondContact O-N 3.3Å
460	R	83.8	Confident	84.6	Confident	184 Å²	184	79.1 Å²	79.1	69%	0.694	39%	0.394	S	S	*	.	H	α-helix	trans	-58.6	-37	-176.4	-177.1	179.8	-81.7	174.2	-5.3	113.9	Y448 M462 L463 A464	Y448-R460 HydrophobicContact CD1-CB 3.99Å; Y448-R460 HydrophobicContact CD1-CG 4.48Å; Y448-R460 HydrophobicContact CE1-CB 3.81Å; Y448-R460 HydrophobicContact CE1-CG 4.47Å; Y448-R460 HydrophobicContact CE2-CB 4.44Å; Y448-R460 HydrophobicContact CG-CB 4.39Å; R460-M462 VanDerWaalsContact C-N 3.34Å; R460-L463 PolarHBondContact O-N 3.42Å; R460-A464 PolarHBondContact O-N 3.37Å
461	H	81.1	Confident	84.1	Confident	115 Å²	115	82.4 Å²	82.4	53%	0.532	41%	0.413	S	S	.	.	H	α-helix	trans	-73.6	-26.1	-178.9	73.3	-108.2	0	0	0	112.9	Q459 A464 Y465	Q459-H461 VanDerWaalsContact C-N 3.33Å; Q459-H461 PolarHBondContact O-N 3.41Å; Q459-H461 PolarHBondContact OE1-CE1 3.05Å; H461-A464 PolarHBondContact O-N 2.93Å; H461-Y465 PolarHBondContact O-N 2.87Å
462	M	84.6	Confident	83.8	Confident	88 Å²	88	78.4 Å²	78.4	43%	0.433	40%	0.402	S	S	.	.	H	α-helix	trans	-72	-39.7	173.1	-70.1	-66.3	169.2	0	0	111.1	F457 Q459 R460 A464 Y465 H466	F457-M462 HydrophobicContact CB-CB 4.35Å; F457-M462 HydrophobicContact CD1-CB 4.02Å; F457-M462 HydrophobicContact CG-CB 4.41Å; Q459-M462 HydrophobicContact CB-CG 4.35Å; Q459-M462 PolarHBondContact O-N 3.45Å; Q459-M462 VanDerWaalsContact O-N 3.15Å; R460-M462 VanDerWaalsContact C-N 3.34Å; M462-A464 VanDerWaalsContact C-N 3.34Å; M462-A464 PolarHBondContact O-N 3.22Å; M462-Y465 PolarHBondContact O-N 3.42Å; M462-H466 WeakPolarHBondContact O-CB 3.3Å; M462-H466 PolarHBondContact O-N 3.01Å
463	L	86.6	Confident	83.5	Confident	21 Å²	21	78 Å²	78	11%	0.11	40%	0.397	C	S	.	.	H	α-helix	trans	-58.4	-45.4	167.3	171	62.9	0	0	0	111.5	A449 C450 F457 Q459 R460 Y465 H466 K467	A449-L463 WeakPolarHBondContact O-CD1 3.41Å; A449-L463 WeakPolarHBondContact O-CD2 3.44Å; C450-L463 HydrophobicContact CB-CD1 3.71Å; F457-L463 HydrophobicContact CB-CB 4.35Å; F457-L463 HydrophobicContact CD2-CB 3.96Å; F457-L463 HydrophobicContact CD2-CD1 3.99Å; F457-L463 HydrophobicContact CE2-CD1 4.24Å; F457-L463 HydrophobicContact CG-CB 4.33Å; Q459-L463 PolarHBondContact O-N 3.3Å; R460-L463 PolarHBondContact O-N 3.42Å; L463-Y465 VanDerWaalsContact C-N 3.34Å; L463-Y465 PolarHBondContact O-N 3.01Å; L463-H466 PolarHBondContact O-N 3.27Å; L463-K467 HydrophobicContact CD1-CG 4.17Å; L463-K467 PolarHBondContact O-N 3.15Å
464	A	83.6	Confident	83.2	Confident	50 Å²	50	82 Å²	82	41%	0.413	41%	0.41	S	S	.	.	H	α-helix	trans	-63.1	-38	178.9	0	0	0	0	0	112.7	R460 H461 M462	R460-A464 PolarHBondContact O-N 3.37Å; H461-A464 PolarHBondContact O-N 2.93Å; M462-A464 VanDerWaalsContact C-N 3.34Å; M462-A464 PolarHBondContact O-N 3.22Å
465	Y	82.1	Confident	83	Confident	85 Å²	85	77.9 Å²	77.9	33%	0.333	39%	0.392	S	S	.	.	H	α-helix	trans	-66.7	-40.7	172.1	-179.2	-100.3	0	0	0	112	H461 M462 L463 R468 A486 Y490	H461-Y465 PolarHBondContact O-N 2.87Å; M462-Y465 PolarHBondContact O-N 3.42Å; L463-Y465 VanDerWaalsContact C-N 3.34Å; L463-Y465 PolarHBondContact O-N 3.01Å; Y465-R468 WeakPolarHBondContact O-CB 3.36Å; Y465-R468 PolarHBondContact O-N 3.25Å; Y465-A486 HydrophobicContact CD2-CB 4.3Å; Y465-A486 HydrophobicContact CE2-CB 3.56Å; Y465-Y490 AromaticContact CZ-CE2 3.9Å; Y465-Y490 WeakPolarHBondContact OH-CD2 3.46Å; Y465-Y490 VanDerWaalsContact OH-CE2 3.23Å; Y465-Y490 WeakPolarHBondContact OH-CE2 3.43Å
466	H	85.2	Confident	83	Confident	31 Å²	31	78.6 Å²	78.6	14%	0.144	39%	0.389	C	S	.	.	H	α-helix	trans	-65.8	-38.3	176.2	171.8	68	0	0	0	112.8	C453 F457 M462 L463 R468 S469 H470	C453-H466 PolarHBondContact SG-NE2 3.01Å; C453-H466 VanDerWaalsContact SG-NE2 3.37Å; F457-H466 HydrophobicContact CE1-CB 4.06Å; F457-H466 HydrophobicContact CE2-CB 3.77Å; F457-H466 AromaticContact CE2-CD2 3.36Å; F457-H466 WeakPolarHBondContact CE2-CD2 3.32Å; F457-H466 AromaticContact CE2-CG 3.58Å; F457-H466 HydrophobicContact CZ-CB 3.43Å; F457-H466 VanDerWaalsContact CZ-CB 3.43Å; F457-H466 AromaticContact CZ-CD2 3.55Å; F457-H466 AromaticContact CZ-CG 3.29Å; F457-H466 AromaticContact CZ-ND1 3.81Å; M462-H466 WeakPolarHBondContact O-CB 3.3Å; M462-H466 PolarHBondContact O-N 3.01Å; L463-H466 PolarHBondContact O-N 3.27Å; H466-R468 PolarHBondContact O-N 3.49Å; H466-S469 PolarHBondContact ND1-OG 3.48Å; H466-S469 WeakPolarHBondContact O-CA 3.29Å; H466-S469 WeakPolarHBondContact O-CB 3.47Å; H466-S469 PolarHBondContact O-N 3.01Å; H466-S469 PolarHBondContact O-OG 3.3Å; H466-H470 AromaticContact CD2-NE2 3.89Å; H466-H470 AromaticContact CE1-NE2 3.42Å; H466-H470 PolarHBondContact CE1-NE2 3.33Å; H466-H470 AromaticContact NE2-CD2 3.69Å; H466-H470 AromaticContact NE2-NE2 3.02Å; H466-H470 PolarHBondContact NE2-NE2 3Å
467	K	83.9	Confident	83	Confident	75 Å²	75	77.4 Å²	77.4	33%	0.326	39%	0.391	S	S	.	.	H	α-helix	trans	-56.7	-34.3	175.4	-78.6	-170.9	172.2	-167.9	0	112.9	D451 L463 S469 H470 T471	D451-K467 WeakPolarHBondContact OD2-CE 3.49Å; D451-K467 IonicContact OD2-NZ 3.04Å; D451-K467 PolarHBondContact OD2-NZ 3.37Å; L463-K467 HydrophobicContact CD1-CG 4.17Å; L463-K467 PolarHBondContact O-N 3.15Å; K467-S469 PolarHBondContact O-N 3.37Å; K467-H470 WeakPolarHBondContact O-CB 3.19Å; K467-H470 PolarHBondContact O-N 2.58Å; K467-T471 PolarHBondContact O-N 3.5Å; K467-T471 VanDerWaalsContact O-N 3.13Å
468	R	83.5	Confident	83.1	Confident	77 Å²	77	75.4 Å²	75.4	29%	0.291	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-21.7	172.5	-64.9	-177.2	-179.5	145.8	8.9	114.3	Y465 H466 H470 G472 E473 A486	Y465-R468 WeakPolarHBondContact O-CB 3.36Å; Y465-R468 PolarHBondContact O-N 3.25Å; H466-R468 PolarHBondContact O-N 3.49Å; R468-H470 VanDerWaalsContact C-N 3.32Å; R468-G472 CarbonylContact O-C 3.55Å; R468-G472 WeakPolarHBondContact O-CA 3.44Å; R468-G472 PolarHBondContact O-N 3.13Å; R468-E473 HydrophobicContact CB-CB 4.26Å; R468-E473 HydrophobicContact CG-CB 4.1Å; R468-E473 PolarHBondContact O-N 3.04Å; R468-A486 HydrophobicContact CB-CB 4.24Å; R468-A486 PolarHBondContact NH1-O 2.83Å
469	S	81.6	Confident	82.9	Confident	84 Å²	84	83 Å²	83	59%	0.587	41%	0.414	S	S	*	.	H	α-helix	trans	-75.3	-21.4	173.3	71.3	0	0	0	0	113.1	H466 K467	H466-S469 PolarHBondContact ND1-OG 3.48Å; H466-S469 WeakPolarHBondContact O-CA 3.29Å; H466-S469 WeakPolarHBondContact O-CB 3.47Å; H466-S469 PolarHBondContact O-N 3.01Å; H466-S469 PolarHBondContact O-OG 3.3Å; K467-S469 PolarHBondContact O-N 3.37Å
470	H	81.6	Confident	82.8	Confident	77 Å²	77	84.1 Å²	84.1	36%	0.356	43%	0.428	S	S	.	.	H	α-helix	trans	-86.4	-45.4	172.1	-65.6	-74	0	0	0	112.1	L452 C453 H466 K467 R468 G472	L452-H470 HydrophobicContact CD1-CB 3.57Å; C453-H470 VanDerWaalsContact SG-CE1 3.51Å; C453-H470 PolarHBondContact SG-NE2 3.2Å; C453-H470 VanDerWaalsContact SG-NE2 3.37Å; H466-H470 AromaticContact CD2-NE2 3.89Å; H466-H470 AromaticContact CE1-NE2 3.42Å; H466-H470 PolarHBondContact CE1-NE2 3.33Å; H466-H470 AromaticContact NE2-CD2 3.69Å; H466-H470 AromaticContact NE2-NE2 3.02Å; H466-H470 PolarHBondContact NE2-NE2 3Å; K467-H470 WeakPolarHBondContact O-CB 3.19Å; K467-H470 PolarHBondContact O-N 2.58Å; R468-H470 VanDerWaalsContact C-N 3.32Å; H470-G472 VanDerWaalsContact C-N 3.25Å; H470-G472 PolarHBondContact O-N 3.4Å
471	T	78.9	Confident	82.8	Confident	79 Å²	79	77.5 Å²	77.5	49%	0.485	41%	0.409	S	S	.	.	H	α-helix	trans	-76.7	-11.3	178.6	61.8	0	0	0	0	113.6	K467 E473	K467-T471 PolarHBondContact O-N 3.5Å; K467-T471 VanDerWaalsContact O-N 3.13Å; T471-E473 VanDerWaalsContact CB-OE1 3.31Å; T471-E473 WeakPolarHBondContact CB-OE1 3.48Å; T471-E473 PolarHBondContact O-N 3.35Å; T471-E473 WeakPolarHBondContact OG1-CB 3.39Å; T471-E473 VanDerWaalsContact OG1-CD 3.22Å; T471-E473 VanDerWaalsContact OG1-CG 3.31Å; T471-E473 WeakPolarHBondContact OG1-CG 3.29Å; T471-E473 PolarHBondContact OG1-OE1 3.14Å
472	G	79.4	Confident	82.9	Confident	43 Å²	43	74.2 Å²	74.2	44%	0.443	41%	0.407	S	S	.	.			trans	72.2	-1.4	-174.7	0	0	0	0	0	114.3	R468 H470 K474	R468-G472 CarbonylContact O-C 3.55Å; R468-G472 WeakPolarHBondContact O-CA 3.44Å; R468-G472 PolarHBondContact O-N 3.13Å; H470-G472 VanDerWaalsContact C-N 3.25Å; H470-G472 PolarHBondContact O-N 3.4Å; G472-K474 WeakPolarHBondContact O-CD 3.34Å; G472-K474 WeakPolarHBondContact O-CG 3.49Å; G472-K474 PolarHBondContact O-N 3.35Å
473	E	77.6	Confident	82.9	Confident	101 Å²	101	75.9 Å²	75.9	47%	0.472	41%	0.411	S	S	.	.			trans	-54.5	121.6	-177.3	-82.8	168	-120.3	0	0	112.6	R468 T471	R468-E473 HydrophobicContact CB-CB 4.26Å; R468-E473 HydrophobicContact CG-CB 4.1Å; R468-E473 PolarHBondContact O-N 3.04Å; T471-E473 VanDerWaalsContact CB-OE1 3.31Å; T471-E473 WeakPolarHBondContact CB-OE1 3.48Å; T471-E473 PolarHBondContact O-N 3.35Å; T471-E473 WeakPolarHBondContact OG1-CB 3.39Å; T471-E473 VanDerWaalsContact OG1-CD 3.22Å; T471-E473 VanDerWaalsContact OG1-CG 3.31Å; T471-E473 WeakPolarHBondContact OG1-CG 3.29Å; T471-E473 PolarHBondContact OG1-OE1 3.14Å
474	K	81.3	Confident	82.8	Confident	125 Å²	125	76.6 Å²	76.6	54%	0.543	42%	0.418	S	S	.	.			trans	-128.9	77.7	178.8	-74.1	154.4	172.7	177.9	0	110	G472 F476 S484 F485	G472-K474 WeakPolarHBondContact O-CD 3.34Å; G472-K474 WeakPolarHBondContact O-CG 3.49Å; G472-K474 PolarHBondContact O-N 3.35Å; K474-F476 PolarHBondContact O-N 3.18Å; K474-S484 VanDerWaalsContact CB-CB 3.46Å; K474-S484 WeakPolarHBondContact CD-O 3.34Å; K474-S484 WeakPolarHBondContact O-CB 3.48Å; K474-F485 CarbonylContact C-O 3.16Å; K474-F485 VanDerWaalsContact C-O 3.23Å; K474-F485 VanDerWaalsContact CA-O 3.29Å; K474-F485 WeakPolarHBondContact CA-O 3.37Å
475	P	81.8	Confident	82.8	Confident	76 Å²	76	76.5 Å²	76.5	49%	0.494	41%	0.409	S	S	.	.			trans	-68.1	-8	-172.2	-21.1	34.4	0	0	0	115.1
476	F	82.7	Confident	82.7	Confident	63 Å²	63	73.2 Å²	73.2	28%	0.276	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	86.7	-173	-56.2	-78.2	0	0	0	110.1	K474 S484 F485 S487 K488 L491	K474-F476 PolarHBondContact O-N 3.18Å; F476-S484 WeakPolarHBondContact O-CA 3.46Å; F476-F485 WeakPolarHBondContact CB-O 3.4Å; F476-F485 PolarHBondContact N-O 3.19Å; F476-F485 VanDerWaalsContact N-O 3.13Å; F476-F485 PolarHBondContact O-N 3.36Å; F476-S487 VanDerWaalsContact CD2-C 3.46Å; F476-S487 VanDerWaalsContact CD2-CA 3.48Å; F476-K488 HydrophobicContact CD1-CB 3.87Å; F476-K488 HydrophobicContact CD1-CG 4.44Å; F476-K488 HydrophobicContact CE1-CB 3.85Å; F476-K488 HydrophobicContact CG-CB 4.35Å; F476-K488 HydrophobicContact CZ-CB 4.3Å; F476-L491 HydrophobicContact CB-CB 4.19Å; F476-L491 HydrophobicContact CB-CD2 3.87Å
477	M	86.4	Confident	82.5	Confident	116 Å²	116	73.4 Å²	73.4	57%	0.571	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	144.7	175.5	-168.2	177.3	-71.1	0	0	111.5	L491	M477-L491 WeakPolarHBondContact O-CD2 3.45Å
478	C	88.3	Confident	82.5	Confident	5 Å²	5	77 Å²	77	3%	0.034	42%	0.42	C	S	.	.			trans	-94.3	107.2	169.5	-176	0	0	0	0	110.1	S480 C481 G482 K483 F485 L491 H494	C478-S480 VanDerWaalsContact C-N 3.26Å; C478-S480 PolarHBondContact O-N 3.35Å; C478-S480 PolarHBondContact SG-OG 3.13Å; C478-S480 VanDerWaalsContact SG-OG 3.39Å; C478-C481 PolarHBondContact O-N 2.84Å; C478-C481 VanDerWaalsContact O-N 3.09Å; C478-C481 VanDerWaalsContact SG-SG 3.67Å; C478-G482 WeakPolarHBondContact O-CA 3.42Å; C478-G482 PolarHBondContact O-N 3.19Å; C478-K483 VanDerWaalsContact CB-O 3.25Å; C478-K483 WeakPolarHBondContact CB-O 3.45Å; C478-K483 PolarHBondContact N-O 3.22Å; C478-F485 HydrophobicContact CB-CE2 4.2Å; C478-L491 HydrophobicContact CB-CD1 3.5Å; C478-H494 VanDerWaalsContact SG-CD2 3.58Å
479	E	82.6	Confident	82.4	Confident	195 Å²	195	77.4 Å²	77.4	91%	0.911	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-40.1	-177	-68.3	157.7	-168.2	0	0	112.8	C481	E479-C481 VanDerWaalsContact C-N 3.27Å; E479-C481 PolarHBondContact O-N 3.27Å
480	S	81.9	Confident	82.5	Confident	77 Å²	77	79.5 Å²	79.5	54%	0.538	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-2.7	-178.2	64.3	0	0	0	0	115.6	C478 H498	C478-S480 VanDerWaalsContact C-N 3.26Å; C478-S480 PolarHBondContact O-N 3.35Å; C478-S480 PolarHBondContact SG-OG 3.13Å; C478-S480 VanDerWaalsContact SG-OG 3.39Å; S480-H498 PolarHBondContact OG-CD2 3.41Å; S480-H498 PolarHBondContact OG-ND1 3.36Å; S480-H498 PolarHBondContact OG-NE2 2.84Å
481	C	85.1	Confident	82.7	Confident	45 Å²	45	77.4 Å²	77.4	30%	0.304	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.4	11.7	177.5	66.8	0	0	0	0	116.5	C478 E479 K483 H494 H498	C478-C481 PolarHBondContact O-N 2.84Å; C478-C481 VanDerWaalsContact O-N 3.09Å; C478-C481 VanDerWaalsContact SG-SG 3.67Å; E479-C481 VanDerWaalsContact C-N 3.27Å; E479-C481 PolarHBondContact O-N 3.27Å; C481-K483 PolarHBondContact O-N 3.03Å; C481-H494 PolarHBondContact SG-NE2 3.08Å; C481-H498 VanDerWaalsContact SG-CE1 3.52Å; C481-H498 PolarHBondContact SG-NE2 3.42Å
482	G	82.4	Confident	82.9	Confident	46 Å²	46	78.5 Å²	78.5	47%	0.474	41%	0.407	S	S	.	.			trans	65.8	-2.7	-178.9	0	0	0	0	0	116.3	C478 S484	C478-G482 WeakPolarHBondContact O-CA 3.42Å; C478-G482 PolarHBondContact O-N 3.19Å; G482-S484 PolarHBondContact O-N 2.86Å
483	K	83.7	Confident	83.1	Confident	122 Å²	122	78.1 Å²	78.1	53%	0.53	39%	0.394	S	S	.	.			trans	-74	121.6	-174.7	-69.9	172.2	-172.3	161.8	0	111	C478 C481 F485	C478-K483 VanDerWaalsContact CB-O 3.25Å; C478-K483 WeakPolarHBondContact CB-O 3.45Å; C478-K483 PolarHBondContact N-O 3.22Å; C481-K483 PolarHBondContact O-N 3.03Å; K483-F485 HydrophobicContact CB-CE2 3.92Å; K483-F485 HydrophobicContact CB-CZ 4.12Å; K483-F485 WeakPolarHBondContact O-CD2 3.35Å; K483-F485 WeakPolarHBondContact O-CE2 3.42Å
484	S	85.5	Confident	83.5	Confident	37 Å²	37	74.4 Å²	74.4	26%	0.259	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	140.8	-177.6	-52	0	0	0	0	113.5	K474 F476 G482	K474-S484 VanDerWaalsContact CB-CB 3.46Å; K474-S484 WeakPolarHBondContact CD-O 3.34Å; K474-S484 WeakPolarHBondContact O-CB 3.48Å; F476-S484 WeakPolarHBondContact O-CA 3.46Å; G482-S484 PolarHBondContact O-N 2.86Å
485	F	83.1	Confident	83.6	Confident	48 Å²	48	70.5 Å²	70.5	21%	0.211	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	152.7	-175.8	-60.2	-88.9	0	0	0	112.2	K474 F476 C478 K483 S487 L491 H494	K474-F485 CarbonylContact C-O 3.16Å; K474-F485 VanDerWaalsContact C-O 3.23Å; K474-F485 VanDerWaalsContact CA-O 3.29Å; K474-F485 WeakPolarHBondContact CA-O 3.37Å; F476-F485 WeakPolarHBondContact CB-O 3.4Å; F476-F485 PolarHBondContact N-O 3.19Å; F476-F485 VanDerWaalsContact N-O 3.13Å; F476-F485 PolarHBondContact O-N 3.36Å; C478-F485 HydrophobicContact CB-CE2 4.2Å; K483-F485 HydrophobicContact CB-CE2 3.92Å; K483-F485 HydrophobicContact CB-CZ 4.12Å; K483-F485 WeakPolarHBondContact O-CD2 3.35Å; K483-F485 WeakPolarHBondContact O-CE2 3.42Å; F485-S487 VanDerWaalsContact C-N 3.34Å; F485-L491 HydrophobicContact CB-CB 4.47Å; F485-L491 HydrophobicContact CD2-CB 4.24Å; F485-L491 HydrophobicContact CD2-CD1 4.05Å; F485-L491 HydrophobicContact CE2-CD1 4.34Å; F485-H494 HydrophobicContact CE1-CB 4.19Å; F485-H494 HydrophobicContact CE2-CB 3.89Å; F485-H494 AromaticContact CE2-CD2 3.37Å; F485-H494 WeakPolarHBondContact CE2-CD2 3.42Å; F485-H494 AromaticContact CE2-CG 3.66Å; F485-H494 HydrophobicContact CZ-CB 3.62Å; F485-H494 AromaticContact CZ-CD2 3.42Å; F485-H494 VanDerWaalsContact CZ-CD2 3.42Å; F485-H494 WeakPolarHBondContact CZ-CD2 3.45Å; F485-H494 AromaticContact CZ-CG 3.3Å; F485-H494 AromaticContact CZ-ND1 3.84Å; F485-H494 AromaticContact CZ-NE2 3.99Å
486	A	80.9	Confident	83.8	Confident	16 Å²	16	67.7 Å²	67.7	13%	0.132	35%	0.345	C	S	.	.	S	Bend	trans	-81.2	-9.2	-179.5	0	0	0	0	0	114.3	Y465 R468	Y465-A486 HydrophobicContact CD2-CB 4.3Å; Y465-A486 HydrophobicContact CE2-CB 3.56Å; R468-A486 HydrophobicContact CB-CB 4.24Å; R468-A486 PolarHBondContact NH1-O 2.83Å
487	S	81.1	Confident	83.8	Confident	35 Å²	35	70.1 Å²	70.1	25%	0.245	36%	0.36	C	S	.	.	S	Bend	trans	-147.3	144.2	175.7	173.1	0	0	0	0	111.7	F476 F485 E489 Y490 L491	F476-S487 VanDerWaalsContact CD2-C 3.46Å; F476-S487 VanDerWaalsContact CD2-CA 3.48Å; F485-S487 VanDerWaalsContact C-N 3.34Å; S487-E489 PolarHBondContact O-N 3.29Å; S487-E489 PolarHBondContact OG-N 2.86Å; S487-Y490 PolarHBondContact O-N 3.04Å; S487-L491 PolarHBondContact O-N 2.95Å
488	K	83.5	Confident	83.6	Confident	151 Å²	151	68.5 Å²	68.5	66%	0.657	35%	0.351	S	S	*	.	H	α-helix	trans	-57	-29.3	175.8	-171	172.5	-178.6	174.7	0	113.2	F476 L491 R492	F476-K488 HydrophobicContact CD1-CB 3.87Å; F476-K488 HydrophobicContact CD1-CG 4.44Å; F476-K488 HydrophobicContact CE1-CB 3.85Å; F476-K488 HydrophobicContact CG-CB 4.35Å; F476-K488 HydrophobicContact CZ-CB 4.3Å; K488-L491 WeakPolarHBondContact O-CB 3.31Å; K488-L491 PolarHBondContact O-N 3.33Å; K488-R492 WeakPolarHBondContact O-CB 3.31Å; K488-R492 PolarHBondContact O-N 2.81Å
489	E	81.9	Confident	83.2	Confident	85 Å²	85	73 Å²	73	40%	0.397	38%	0.379	S	S	.	.	H	α-helix	trans	-73.8	-36.5	-179.3	-168.6	61.6	-173.9	0	0	112.2	S487 R492 H493	S487-E489 PolarHBondContact O-N 3.29Å; S487-E489 PolarHBondContact OG-N 2.86Å; E489-R492 VanDerWaalsContact CD-NE 3.33Å; E489-R492 WeakPolarHBondContact O-CB 3.46Å; E489-R492 PolarHBondContact O-N 3.29Å; E489-R492 IonicContact OE1-CZ 2.9Å; E489-R492 VanDerWaalsContact OE1-CZ 3.27Å; E489-R492 IonicContact OE1-NE 2.71Å; E489-R492 PolarHBondContact OE1-NE 3.05Å; E489-R492 IonicContact OE1-NH2 3.6Å; E489-R492 PolarHBondContact OE1-NH2 3.14Å; E489-R492 IonicContact OE2-CZ 2.68Å; E489-R492 IonicContact OE2-NE 2.73Å; E489-R492 PolarHBondContact OE2-NE 3.22Å; E489-R492 IonicContact OE2-NH2 3.69Å; E489-H493 PolarHBondContact O-CD2 3.18Å; E489-H493 VanDerWaalsContact O-CD2 3.23Å; E489-H493 PolarHBondContact O-N 3Å; E489-H493 IonicContact OE1-CE1 2.72Å; E489-H493 IonicContact OE1-NE2 3.15Å
490	Y	82.6	Confident	83.2	Confident	128 Å²	128	65.9 Å²	65.9	50%	0.502	36%	0.357	S	S	.	.	H	α-helix	trans	-68.8	-35.4	170.1	-74.4	-66.5	0	0	0	111.9	Y465 S487 H493 H494	Y465-Y490 AromaticContact CZ-CE2 3.9Å; Y465-Y490 WeakPolarHBondContact OH-CD2 3.46Å; Y465-Y490 VanDerWaalsContact OH-CE2 3.23Å; Y465-Y490 WeakPolarHBondContact OH-CE2 3.43Å; S487-Y490 PolarHBondContact O-N 3.04Å; Y490-H493 PolarHBondContact O-N 3.44Å; Y490-H494 VanDerWaalsContact O-CB 3.32Å; Y490-H494 WeakPolarHBondContact O-CB 3.49Å; Y490-H494 PolarHBondContact O-N 2.97Å
491	L	86.1	Confident	83.1	Confident	33 Å²	33	64.5 Å²	64.5	17%	0.173	35%	0.348	C	S	.	.	H	α-helix	trans	-61	-44.4	170.1	174.9	60.1	0	0	0	111.2	F476 M477 C478 F485 S487 K488 H493 H494 S495	F476-L491 HydrophobicContact CB-CB 4.19Å; F476-L491 HydrophobicContact CB-CD2 3.87Å; M477-L491 WeakPolarHBondContact O-CD2 3.45Å; C478-L491 HydrophobicContact CB-CD1 3.5Å; F485-L491 HydrophobicContact CB-CB 4.47Å; F485-L491 HydrophobicContact CD2-CB 4.24Å; F485-L491 HydrophobicContact CD2-CD1 4.05Å; F485-L491 HydrophobicContact CE2-CD1 4.34Å; S487-L491 PolarHBondContact O-N 2.95Å; K488-L491 WeakPolarHBondContact O-CB 3.31Å; K488-L491 PolarHBondContact O-N 3.33Å; L491-H493 PolarHBondContact O-N 3.38Å; L491-H494 CarbonylContact O-C 3.51Å; L491-H494 WeakPolarHBondContact O-CA 3.25Å; L491-H494 WeakPolarHBondContact O-CB 3.15Å; L491-H494 PolarHBondContact O-N 2.9Å; L491-S495 PolarHBondContact O-N 3.31Å; L491-S495 PolarHBondContact O-OG 2.85Å
492	R	84.3	Confident	83.1	Confident	102 Å²	102	68.4 Å²	68.4	39%	0.385	36%	0.359	S	S	.	.	H	α-helix	trans	-60.7	-44.1	176.6	-168.8	-178.9	78.1	87.5	-2.2	112.4	K488 E489 H494 S495 N496	K488-R492 WeakPolarHBondContact O-CB 3.31Å; K488-R492 PolarHBondContact O-N 2.81Å; E489-R492 VanDerWaalsContact CD-NE 3.33Å; E489-R492 WeakPolarHBondContact O-CB 3.46Å; E489-R492 PolarHBondContact O-N 3.29Å; E489-R492 IonicContact OE1-CZ 2.9Å; E489-R492 VanDerWaalsContact OE1-CZ 3.27Å; E489-R492 IonicContact OE1-NE 2.71Å; E489-R492 PolarHBondContact OE1-NE 3.05Å; E489-R492 IonicContact OE1-NH2 3.6Å; E489-R492 PolarHBondContact OE1-NH2 3.14Å; E489-R492 IonicContact OE2-CZ 2.68Å; E489-R492 IonicContact OE2-NE 2.73Å; E489-R492 PolarHBondContact OE2-NE 3.22Å; E489-R492 IonicContact OE2-NH2 3.69Å; R492-H494 VanDerWaalsContact C-N 3.25Å; R492-H494 PolarHBondContact O-N 3.44Å; R492-S495 WeakPolarHBondContact CA-OG 3.49Å; R492-S495 PolarHBondContact O-OG 3.01Å; R492-N496 PolarHBondContact O-N 3.44Å; R492-N496 PolarHBondContact O-OD1 2.74Å
493	H	82.9	Confident	83.2	Confident	35 Å²	35	69.6 Å²	69.6	16%	0.162	36%	0.359	C	S	.	.	H	α-helix	trans	-69	-22.7	173.8	-69	-46	0	0	0	113.4	E489 Y490 L491 Q515	E489-H493 PolarHBondContact O-CD2 3.18Å; E489-H493 VanDerWaalsContact O-CD2 3.23Å; E489-H493 PolarHBondContact O-N 3Å; E489-H493 IonicContact OE1-CE1 2.72Å; E489-H493 IonicContact OE1-NE2 3.15Å; Y490-H493 PolarHBondContact O-N 3.44Å; L491-H493 PolarHBondContact O-N 3.38Å; H493-Q515 HydrophobicContact CB-CG 4.27Å
494	H	85.8	Confident	83.3	Confident	23 Å²	23	66 Å²	66	11%	0.106	34%	0.343	C	S	.	.	H	α-helix	trans	-82.5	-39	174.2	-175.7	59.2	0	0	0	112.8	C478 C481 F485 Y490 L491 R492 N496 I497 H498	C478-H494 VanDerWaalsContact SG-CD2 3.58Å; C481-H494 PolarHBondContact SG-NE2 3.08Å; F485-H494 HydrophobicContact CE1-CB 4.19Å; F485-H494 HydrophobicContact CE2-CB 3.89Å; F485-H494 AromaticContact CE2-CD2 3.37Å; F485-H494 WeakPolarHBondContact CE2-CD2 3.42Å; F485-H494 AromaticContact CE2-CG 3.66Å; F485-H494 HydrophobicContact CZ-CB 3.62Å; F485-H494 AromaticContact CZ-CD2 3.42Å; F485-H494 VanDerWaalsContact CZ-CD2 3.42Å; F485-H494 WeakPolarHBondContact CZ-CD2 3.45Å; F485-H494 AromaticContact CZ-CG 3.3Å; F485-H494 AromaticContact CZ-ND1 3.84Å; F485-H494 AromaticContact CZ-NE2 3.99Å; Y490-H494 VanDerWaalsContact O-CB 3.32Å; Y490-H494 WeakPolarHBondContact O-CB 3.49Å; Y490-H494 PolarHBondContact O-N 2.97Å; L491-H494 CarbonylContact O-C 3.51Å; L491-H494 WeakPolarHBondContact O-CA 3.25Å; L491-H494 WeakPolarHBondContact O-CB 3.15Å; L491-H494 PolarHBondContact O-N 2.9Å; R492-H494 VanDerWaalsContact C-N 3.25Å; R492-H494 PolarHBondContact O-N 3.44Å; H494-N496 PolarHBondContact O-N 3.34Å; H494-I497 VanDerWaalsContact O-CB 3.3Å; H494-I497 WeakPolarHBondContact O-CB 3.34Å; H494-I497 WeakPolarHBondContact O-CG1 3.45Å; H494-I497 PolarHBondContact O-N 3.19Å; H494-H498 AromaticContact CD2-NE2 3.66Å; H494-H498 AromaticContact CE1-NE2 3.62Å; H494-H498 AromaticContact NE2-CD2 3.92Å; H494-H498 AromaticContact NE2-NE2 3.04Å; H494-H498 PolarHBondContact NE2-NE2 3.41Å
495	S	83.9	Confident	83.4	Confident	42 Å²	42	71.5 Å²	71.5	29%	0.294	36%	0.361	S	S	.	.	H	α-helix	trans	-59.4	-30.1	175.3	50.3	0	0	0	0	112.5	L491 R492 I497 H498 T499	L491-S495 PolarHBondContact O-N 3.31Å; L491-S495 PolarHBondContact O-OG 2.85Å; R492-S495 WeakPolarHBondContact CA-OG 3.49Å; R492-S495 PolarHBondContact O-OG 3.01Å; S495-I497 PolarHBondContact O-N 3.27Å; S495-I497 VanDerWaalsContact O-N 3.15Å; S495-H498 PolarHBondContact O-N 3.07Å; S495-T499 PolarHBondContact O-N 3.24Å; S495-T499 PolarHBondContact O-OG1 2.84Å; S495-T499 VanDerWaalsContact O-OG1 3.14Å
496	N	85.4	Confident	83.7	Confident	17 Å²	17	69.3 Å²	69.3	9%	0.091	35%	0.352	C	S	.	.	H	α-helix	trans	-58.4	-21.1	171.7	-72.8	3.3	0	0	0	114.1	R492 H494 G500 S501 A514	R492-N496 PolarHBondContact O-N 3.44Å; R492-N496 PolarHBondContact O-OD1 2.74Å; H494-N496 PolarHBondContact O-N 3.34Å; N496-G500 CarbonylContact O-C 3.55Å; N496-G500 WeakPolarHBondContact O-CA 3.37Å; N496-G500 PolarHBondContact O-N 2.78Å; N496-S501 WeakPolarHBondContact CB-O 3.36Å; N496-S501 PolarHBondContact O-N 3.39Å; N496-A514 HydrophobicContact CB-CB 3.92Å; N496-A514 PolarHBondContact ND2-O 2.91Å
497	I	82.7	Confident	84	Confident	115 Å²	115	77.5 Å²	77.5	59%	0.59	39%	0.388	S	S	*	.	H	α-helix	trans	-75	-41.5	174.4	-55.7	-178.9	0	0	0	110.2	H494 S495	H494-I497 VanDerWaalsContact O-CB 3.3Å; H494-I497 WeakPolarHBondContact O-CB 3.34Å; H494-I497 WeakPolarHBondContact O-CG1 3.45Å; H494-I497 PolarHBondContact O-N 3.19Å; S495-I497 PolarHBondContact O-N 3.27Å; S495-I497 VanDerWaalsContact O-N 3.15Å
498	H	82.3	Confident	84.2	Confident	81 Å²	81	82 Å²	82	38%	0.375	41%	0.405	S	S	.	.	H	α-helix	trans	-75.9	-38.1	-178.4	-59	-75.7	0	0	0	112.6	S480 C481 H494 S495 G500	S480-H498 PolarHBondContact OG-CD2 3.41Å; S480-H498 PolarHBondContact OG-ND1 3.36Å; S480-H498 PolarHBondContact OG-NE2 2.84Å; C481-H498 VanDerWaalsContact SG-CE1 3.52Å; C481-H498 PolarHBondContact SG-NE2 3.42Å; H494-H498 AromaticContact CD2-NE2 3.66Å; H494-H498 AromaticContact CE1-NE2 3.62Å; H494-H498 AromaticContact NE2-CD2 3.92Å; H494-H498 AromaticContact NE2-NE2 3.04Å; H494-H498 PolarHBondContact NE2-NE2 3.41Å; S495-H498 PolarHBondContact O-N 3.07Å; H498-G500 VanDerWaalsContact C-N 3.27Å; H498-G500 PolarHBondContact O-N 2.96Å
499	T	80.7	Confident	84.3	Confident	101 Å²	101	77.7 Å²	77.7	62%	0.62	39%	0.393	S	S	*	.	S	Bend	trans	-83.4	-1.1	175.9	59.6	0	0	0	0	113.5	S495 S501	S495-T499 PolarHBondContact O-N 3.24Å; S495-T499 PolarHBondContact O-OG1 2.84Å; S495-T499 VanDerWaalsContact O-OG1 3.14Å; T499-S501 PolarHBondContact O-N 2.99Å; T499-S501 VanDerWaalsContact OG1-CB 3.29Å; T499-S501 WeakPolarHBondContact OG1-CB 3.42Å; T499-S501 PolarHBondContact OG1-N 2.8Å
500	G	81	Confident	84.4	Confident	44 Å²	44	76.2 Å²	76.2	45%	0.454	40%	0.401	S	S	.	.			trans	61.9	5.5	-171.3	0	0	0	0	0	114.9	N496 H498 K502	N496-G500 CarbonylContact O-C 3.55Å; N496-G500 WeakPolarHBondContact O-CA 3.37Å; N496-G500 PolarHBondContact O-N 2.78Å; H498-G500 VanDerWaalsContact C-N 3.27Å; H498-G500 PolarHBondContact O-N 2.96Å; G500-K502 WeakPolarHBondContact O-CG 3.35Å; G500-K502 PolarHBondContact O-N 3.09Å
501	S	81.1	Confident	84.6	Confident	49 Å²	49	77.9 Å²	77.9	34%	0.343	41%	0.406	S	S	.	.			trans	-65	116.9	-168.4	-173.9	0	0	0	0	112.3	N496 T499 P503	N496-S501 WeakPolarHBondContact CB-O 3.36Å; N496-S501 PolarHBondContact O-N 3.39Å; T499-S501 PolarHBondContact O-N 2.99Å; T499-S501 VanDerWaalsContact OG1-CB 3.29Å; T499-S501 WeakPolarHBondContact OG1-CB 3.42Å; T499-S501 PolarHBondContact OG1-N 2.8Å; S501-P503 VanDerWaalsContact O-CD 3.24Å; S501-P503 WeakPolarHBondContact O-CD 3.46Å
502	K	84.5	Confident	84.6	Confident	126 Å²	126	77.2 Å²	77.2	55%	0.548	41%	0.408	S	S	.	.			trans	-119.1	69.2	-178.1	-74.1	159.4	179.1	169.3	0	110.3	G500 Y504 G512 F513	G500-K502 WeakPolarHBondContact O-CG 3.35Å; G500-K502 PolarHBondContact O-N 3.09Å; K502-Y504 PolarHBondContact O-N 3.21Å; K502-G512 WeakPolarHBondContact CD-O 3.37Å; K502-F513 CarbonylContact C-O 3.53Å; K502-F513 WeakPolarHBondContact CA-O 3.44Å
503	P	83.4	Confident	84.6	Confident	72 Å²	72	74 Å²	74	47%	0.468	40%	0.397	S	S	.	.			trans	-69.8	-9.9	-173.6	29.2	-36.3	0	0	0	114.2	S501	S501-P503 VanDerWaalsContact O-CD 3.24Å; S501-P503 WeakPolarHBondContact O-CD 3.46Å
504	Y	85.7	Confident	84.6	Confident	47 Å²	47	73.7 Å²	73.7	18%	0.184	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	96	177.6	-53.4	-71.8	0	0	0	109.3	K502 F513 R516	K502-Y504 PolarHBondContact O-N 3.21Å; Y504-F513 PolarHBondContact N-O 3.01Å; Y504-F513 PolarHBondContact O-N 3.35Å; Y504-R516 HydrophobicContact CD1-CB 3.99Å; Y504-R516 HydrophobicContact CD2-CB 4.41Å; Y504-R516 VanDerWaalsContact CD2-N 3.28Å; Y504-R516 HydrophobicContact CE1-CB 3.92Å; Y504-R516 HydrophobicContact CE2-CB 4.33Å; Y504-R516 HydrophobicContact CG-CB 4.23Å
505	K	87.7	Confident	84.5	Confident	151 Å²	151	76.1 Å²	76.1	66%	0.657	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	148	175.1	-63	-177.8	-177.6	179.2	0	110.7	L519	K505-L519 VanDerWaalsContact O-CD2 3.32Å; K505-L519 WeakPolarHBondContact O-CD2 3.34Å
506	C	90.9	Very high	84.6	Confident	3 Å²	3	81.4 Å²	81.4	2%	0.02	43%	0.425	C	S	.	.			trans	-85.7	129.4	166	-173.9	0	0	0	0	109.5	G510 R511 F513 L519 H526	C506-G510 CarbonylContact O-C 3.6Å; C506-G510 WeakPolarHBondContact O-CA 3.46Å; C506-G510 PolarHBondContact O-N 3.45Å; C506-R511 HydrophobicContact CB-CB 4.5Å; C506-R511 PolarHBondContact N-O 3.22Å; C506-F513 HydrophobicContact CB-CE2 4.34Å; C506-L519 HydrophobicContact CB-CD1 3.63Å; C506-H526 PolarHBondContact SG-NE2 3.15Å
507	E	87.6	Confident	84.6	Confident	188 Å²	188	86.6 Å²	86.6	88%	0.879	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-71.7	-44.8	-179.8	-73.4	153.8	-166.5	0	0	111.1	C509	E507-C509 PolarHBondContact O-N 3.22Å
508	H	84.3	Confident	84.7	Confident	130 Å²	130	83.1 Å²	83.1	60%	0.602	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-62.1	-14.9	179.6	-53.4	-63.2	0	0	0	116.4	H526	H508-H526 AromaticContact CD2-CD2 3.97Å; H508-H526 AromaticContact CD2-CG 4Å
509	C	86.3	Confident	85	Confident	59 Å²	59	80.3 Å²	80.3	40%	0.399	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-153.9	17.5	-178.6	72	0	0	0	0	115.3	E507 R511 H522 H526	E507-C509 PolarHBondContact O-N 3.22Å; C509-R511 PolarHBondContact O-N 2.94Å; C509-H522 PolarHBondContact SG-NE2 3.49Å; C509-H526 WeakPolarHBondContact CB-CE1 3.36Å; C509-H526 PolarHBondContact SG-CE1 2.84Å; C509-H526 PolarHBondContact SG-NE2 3.38Å
510	G	83.4	Confident	85.3	Confident	55 Å²	55	79.5 Å²	79.5	57%	0.567	42%	0.418	S	S	*	.			trans	63.4	-9.8	-179.1	0	0	0	0	0	116.9	C506 G512	C506-G510 CarbonylContact O-C 3.6Å; C506-G510 WeakPolarHBondContact O-CA 3.46Å; C506-G510 PolarHBondContact O-N 3.45Å; G510-G512 PolarHBondContact O-N 2.72Å
511	R	85.9	Confident	85.5	Confident	162 Å²	162	81.7 Å²	81.7	61%	0.611	42%	0.416	S	S	*	.			trans	-65.7	120.9	-165.7	-169.4	170.2	-174.8	147.3	3.9	112.2	C506 C509 F513	C506-R511 HydrophobicContact CB-CB 4.5Å; C506-R511 PolarHBondContact N-O 3.22Å; C509-R511 PolarHBondContact O-N 2.94Å; R511-F513 HydrophobicContact CB-CE2 4.01Å; R511-F513 HydrophobicContact CB-CZ 4.36Å; R511-F513 HydrophobicContact CG-CE2 3.89Å; R511-F513 HydrophobicContact CG-CZ 3.86Å; R511-F513 VanDerWaalsContact O-CD2 3.23Å; R511-F513 WeakPolarHBondContact O-CD2 3.18Å; R511-F513 WeakPolarHBondContact O-CE2 3.32Å
512	G	86.3	Confident	85.8	Confident	20 Å²	20	80.4 Å²	80.4	21%	0.206	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	137.8	-179.7	0	0	0	0	0	114.7	K502 G510	K502-G512 WeakPolarHBondContact CD-O 3.37Å; G510-G512 PolarHBondContact O-N 2.72Å
513	F	84.6	Confident	86	Confident	35 Å²	35	77 Å²	77	15%	0.154	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	146.8	178.7	-61.3	-91.1	0	0	0	112.1	K502 Y504 C506 R511 Q515 L519 H522	K502-F513 CarbonylContact C-O 3.53Å; K502-F513 WeakPolarHBondContact CA-O 3.44Å; Y504-F513 PolarHBondContact N-O 3.01Å; Y504-F513 PolarHBondContact O-N 3.35Å; C506-F513 HydrophobicContact CB-CE2 4.34Å; R511-F513 HydrophobicContact CB-CE2 4.01Å; R511-F513 HydrophobicContact CB-CZ 4.36Å; R511-F513 HydrophobicContact CG-CE2 3.89Å; R511-F513 HydrophobicContact CG-CZ 3.86Å; R511-F513 VanDerWaalsContact O-CD2 3.23Å; R511-F513 WeakPolarHBondContact O-CD2 3.18Å; R511-F513 WeakPolarHBondContact O-CE2 3.32Å; F513-Q515 VanDerWaalsContact C-N 3.34Å; F513-L519 HydrophobicContact CB-CB 4.41Å; F513-L519 HydrophobicContact CD2-CB 4.12Å; F513-L519 HydrophobicContact CD2-CD1 3.98Å; F513-L519 HydrophobicContact CE2-CD1 4.15Å; F513-L519 HydrophobicContact CG-CB 4.38Å; F513-H522 HydrophobicContact CE1-CB 4.04Å; F513-H522 HydrophobicContact CE2-CB 4.04Å; F513-H522 AromaticContact CE2-CD2 3.31Å; F513-H522 WeakPolarHBondContact CE2-CD2 3.31Å; F513-H522 AromaticContact CE2-CG 3.79Å; F513-H522 HydrophobicContact CZ-CB 3.52Å; F513-H522 AromaticContact CZ-CD2 3.36Å; F513-H522 WeakPolarHBondContact CZ-CD2 3.41Å; F513-H522 AromaticContact CZ-CG 3.35Å
514	A	83.8	Confident	86.2	Confident	28 Å²	28	76.6 Å²	76.6	23%	0.231	38%	0.383	C	S	.	.	S	Bend	trans	-78.8	-13.4	178.9	0	0	0	0	0	114.2	N496	N496-A514 HydrophobicContact CB-CB 3.92Å; N496-A514 PolarHBondContact ND2-O 2.91Å
515	Q	83.9	Confident	86.1	Confident	73 Å²	73	79.8 Å²	79.8	34%	0.341	40%	0.402	S	S	.	.	S	Bend	trans	-141.7	140.8	-177.5	-61.2	-179.2	11.5	0	0	111.1	H493 F513 N517 S518 L519	H493-Q515 HydrophobicContact CB-CG 4.27Å; F513-Q515 VanDerWaalsContact C-N 3.34Å; Q515-N517 VanDerWaalsContact C-N 3.33Å; Q515-N517 PolarHBondContact O-N 3.48Å; Q515-S518 WeakPolarHBondContact O-CB 3.45Å; Q515-S518 PolarHBondContact O-N 2.9Å; Q515-L519 PolarHBondContact O-N 3.41Å
516	R	84.9	Confident	85.9	Confident	153 Å²	153	76.8 Å²	76.8	58%	0.577	39%	0.391	S	S	*	.	H	α-helix	trans	-61.3	-38.4	177.7	-177.4	172.6	-77.5	156.9	-7.8	112.5	Y504 S518 L519 N520	Y504-R516 HydrophobicContact CD1-CB 3.99Å; Y504-R516 HydrophobicContact CD2-CB 4.41Å; Y504-R516 VanDerWaalsContact CD2-N 3.28Å; Y504-R516 HydrophobicContact CE1-CB 3.92Å; Y504-R516 HydrophobicContact CE2-CB 4.33Å; Y504-R516 HydrophobicContact CG-CB 4.23Å; R516-S518 PolarHBondContact O-N 3.4Å; R516-L519 WeakPolarHBondContact O-CB 3.45Å; R516-L519 PolarHBondContact O-N 3.42Å; R516-N520 PolarHBondContact O-N 3.17Å; R516-N520 PolarHBondContact O-OD1 3.44Å; R516-N520 VanDerWaalsContact O-OD1 3.05Å
517	N	85.1	Confident	85.6	Confident	126 Å²	126	80.4 Å²	80.4	67%	0.674	41%	0.412	S	S	*	.	H	α-helix	trans	-61.6	-33.5	178.3	-64.5	12.7	0	0	0	112.3	Q515 Q521	Q515-N517 VanDerWaalsContact C-N 3.33Å; Q515-N517 PolarHBondContact O-N 3.48Å; N517-Q521 VanDerWaalsContact O-CB 3.3Å; N517-Q521 WeakPolarHBondContact O-CB 3.26Å; N517-Q521 PolarHBondContact O-N 2.94Å
518	S	86.3	Confident	85.3	Confident	43 Å²	43	73.7 Å²	73.7	30%	0.301	39%	0.394	S	S	.	.	H	α-helix	trans	-70.9	-37.1	174.2	-52	0	0	0	0	112.2	Q515 R516 H522	Q515-S518 WeakPolarHBondContact O-CB 3.45Å; Q515-S518 PolarHBondContact O-N 2.9Å; R516-S518 PolarHBondContact O-N 3.4Å; S518-H522 WeakPolarHBondContact O-CB 3.32Å; S518-H522 PolarHBondContact O-N 3.25Å
519	L	88.4	Confident	85.2	Confident	21 Å²	21	71.5 Å²	71.5	11%	0.11	38%	0.384	C	S	.	.	H	α-helix	trans	-63.6	-51.4	171.8	173.2	59.8	0	0	0	110.8	K505 C506 F513 Q515 R516 Q521 H522 L523	K505-L519 VanDerWaalsContact O-CD2 3.32Å; K505-L519 WeakPolarHBondContact O-CD2 3.34Å; C506-L519 HydrophobicContact CB-CD1 3.63Å; F513-L519 HydrophobicContact CB-CB 4.41Å; F513-L519 HydrophobicContact CD2-CB 4.12Å; F513-L519 HydrophobicContact CD2-CD1 3.98Å; F513-L519 HydrophobicContact CE2-CD1 4.15Å; F513-L519 HydrophobicContact CG-CB 4.38Å; Q515-L519 PolarHBondContact O-N 3.41Å; R516-L519 WeakPolarHBondContact O-CB 3.45Å; R516-L519 PolarHBondContact O-N 3.42Å; L519-Q521 VanDerWaalsContact C-N 3.26Å; L519-Q521 PolarHBondContact O-N 2.95Å; L519-H522 CarbonylContact O-C 3.3Å; L519-H522 WeakPolarHBondContact O-CA 3.42Å; L519-H522 WeakPolarHBondContact O-CB 3.29Å; L519-H522 PolarHBondContact O-N 3.43Å; L519-L523 HydrophobicContact CD1-CD1 4.36Å; L519-L523 HydrophobicContact CD1-CD2 4.34Å; L519-L523 HydrophobicContact CD1-CG 4.06Å; L519-L523 HydrophobicContact CG-CD1 4.19Å; L519-L523 HydrophobicContact CG-CG 4.36Å; L519-L523 WeakPolarHBondContact O-CG 3.32Å; L519-L523 PolarHBondContact O-N 3.37Å
520	N	86.3	Confident	85.1	Confident	84 Å²	84	75.9 Å²	75.9	45%	0.449	39%	0.392	S	S	.	.	H	α-helix	trans	-59.7	-36	178.7	-69.2	37.6	0	0	0	112.4	R516 H522	R516-N520 PolarHBondContact O-N 3.17Å; R516-N520 PolarHBondContact O-OD1 3.44Å; R516-N520 VanDerWaalsContact O-OD1 3.05Å; N520-H522 VanDerWaalsContact C-N 3.33Å
521	Q	85.3	Confident	85.1	Confident	90 Å²	90	76.9 Å²	76.9	42%	0.421	39%	0.389	S	S	.	.	H	α-helix	trans	-69	-30	173.3	-179.8	173.6	92.4	0	0	112.8	N517 L519 Q543	N517-Q521 VanDerWaalsContact O-CB 3.3Å; N517-Q521 WeakPolarHBondContact O-CB 3.26Å; N517-Q521 PolarHBondContact O-N 2.94Å; L519-Q521 VanDerWaalsContact C-N 3.26Å; L519-Q521 PolarHBondContact O-N 2.95Å; Q521-Q543 HydrophobicContact CG-CG 4.41Å; Q521-Q543 VanDerWaalsContact NE2-CD 3.31Å; Q521-Q543 VanDerWaalsContact OE1-NE2 3.13Å
522	H	87.5	Confident	85.1	Confident	23 Å²	23	73.5 Å²	73.5	11%	0.106	38%	0.377	C	S	.	.	H	α-helix	trans	-78.4	-35.3	174.8	168.1	57.2	0	0	0	112.8	C509 F513 S518 L519 N520 K524 I525 H526	C509-H522 PolarHBondContact SG-NE2 3.49Å; F513-H522 HydrophobicContact CE1-CB 4.04Å; F513-H522 HydrophobicContact CE2-CB 4.04Å; F513-H522 AromaticContact CE2-CD2 3.31Å; F513-H522 WeakPolarHBondContact CE2-CD2 3.31Å; F513-H522 AromaticContact CE2-CG 3.79Å; F513-H522 HydrophobicContact CZ-CB 3.52Å; F513-H522 AromaticContact CZ-CD2 3.36Å; F513-H522 WeakPolarHBondContact CZ-CD2 3.41Å; F513-H522 AromaticContact CZ-CG 3.35Å; S518-H522 WeakPolarHBondContact O-CB 3.32Å; S518-H522 PolarHBondContact O-N 3.25Å; L519-H522 CarbonylContact O-C 3.3Å; L519-H522 WeakPolarHBondContact O-CA 3.42Å; L519-H522 WeakPolarHBondContact O-CB 3.29Å; L519-H522 PolarHBondContact O-N 3.43Å; N520-H522 VanDerWaalsContact C-N 3.33Å; H522-K524 PolarHBondContact O-N 3.35Å; H522-I525 VanDerWaalsContact O-CB 3.23Å; H522-I525 WeakPolarHBondContact O-CB 3.34Å; H522-I525 WeakPolarHBondContact O-CG1 3.28Å; H522-I525 PolarHBondContact O-N 3.38Å; H522-H526 AromaticContact CD2-NE2 3.44Å; H522-H526 PolarHBondContact CD2-NE2 2.79Å; H522-H526 AromaticContact CE1-CD2 3.96Å; H522-H526 AromaticContact CE1-NE2 2.85Å; H522-H526 PolarHBondContact CE1-NE2 2.85Å; H522-H526 AromaticContact ND1-NE2 3.97Å; H522-H526 AromaticContact NE2-CD2 3.8Å; H522-H526 AromaticContact NE2-NE2 2.4Å; H522-H526 PolarHBondContact NE2-NE2 3.22Å
523	L	87.6	Confident	85.2	Confident	54 Å²	54	75.5 Å²	75.5	28%	0.283	39%	0.387	S	S	.	.	H	α-helix	trans	-58.5	-33.2	176.1	-71.1	172.1	0	0	0	112	L519 I525 H526 T527	L519-L523 HydrophobicContact CD1-CD1 4.36Å; L519-L523 HydrophobicContact CD1-CD2 4.34Å; L519-L523 HydrophobicContact CD1-CG 4.06Å; L519-L523 HydrophobicContact CG-CD1 4.19Å; L519-L523 HydrophobicContact CG-CG 4.36Å; L519-L523 WeakPolarHBondContact O-CG 3.32Å; L519-L523 PolarHBondContact O-N 3.37Å; L523-I525 PolarHBondContact O-N 2.94Å; L523-H526 WeakPolarHBondContact O-CA 3.41Å; L523-H526 PolarHBondContact O-N 3.15Å; L523-T527 PolarHBondContact O-N 3.33Å; L523-T527 PolarHBondContact O-OG1 3.04Å
524	K	87.4	Confident	85.4	Confident	63 Å²	63	74.3 Å²	74.3	27%	0.274	38%	0.384	S	S	.	.	H	α-helix	trans	-61.7	-9.7	170.9	-66.9	-176.3	-179.7	-70.6	0	115.3	H522 T527 E529	H522-K524 PolarHBondContact O-N 3.35Å; K524-T527 WeakPolarHBondContact CA-OG1 3.47Å; K524-E529 HydrophobicContact CB-CB 4.21Å; K524-E529 HydrophobicContact CG-CB 4.13Å; K524-E529 IonicContact NZ-OE2 3.99Å; K524-E529 PolarHBondContact NZ-OE2 3.12Å; K524-E529 PolarHBondContact O-N 3.45Å
525	I	84.2	Confident	85.5	Confident	114 Å²	114	82.7 Å²	82.7	59%	0.585	42%	0.415	S	S	*	.	H	α-helix	trans	-83.4	-36	170.4	-53	179.6	0	0	0	109.9	H522 L523	H522-I525 VanDerWaalsContact O-CB 3.23Å; H522-I525 WeakPolarHBondContact O-CB 3.34Å; H522-I525 WeakPolarHBondContact O-CG1 3.28Å; H522-I525 PolarHBondContact O-N 3.38Å; L523-I525 PolarHBondContact O-N 2.94Å
526	H	84.4	Confident	85.5	Confident	89 Å²	89	82.9 Å²	82.9	41%	0.412	42%	0.424	S	S	.	.	H	α-helix	trans	-77.9	-40.4	177.1	-63.9	-65	0	0	0	112.3	C506 H508 C509 H522 L523 G528	C506-H526 PolarHBondContact SG-NE2 3.15Å; H508-H526 AromaticContact CD2-CD2 3.97Å; H508-H526 AromaticContact CD2-CG 4Å; C509-H526 WeakPolarHBondContact CB-CE1 3.36Å; C509-H526 PolarHBondContact SG-CE1 2.84Å; C509-H526 PolarHBondContact SG-NE2 3.38Å; H522-H526 AromaticContact CD2-NE2 3.44Å; H522-H526 PolarHBondContact CD2-NE2 2.79Å; H522-H526 AromaticContact CE1-CD2 3.96Å; H522-H526 AromaticContact CE1-NE2 2.85Å; H522-H526 PolarHBondContact CE1-NE2 2.85Å; H522-H526 AromaticContact ND1-NE2 3.97Å; H522-H526 AromaticContact NE2-CD2 3.8Å; H522-H526 AromaticContact NE2-NE2 2.4Å; H522-H526 PolarHBondContact NE2-NE2 3.22Å; L523-H526 WeakPolarHBondContact O-CA 3.41Å; L523-H526 PolarHBondContact O-N 3.15Å; H526-G528 PolarHBondContact O-N 2.59Å
527	T	83.3	Confident	85.7	Confident	78 Å²	78	77.1 Å²	77.1	48%	0.479	41%	0.407	S	S	.	.	S	Bend	trans	-77.1	-2.8	175.3	63.3	0	0	0	0	113.7	L523 K524 E529	L523-T527 PolarHBondContact O-N 3.33Å; L523-T527 PolarHBondContact O-OG1 3.04Å; K524-T527 WeakPolarHBondContact CA-OG1 3.47Å; T527-E529 WeakPolarHBondContact CB-OE1 3.44Å; T527-E529 PolarHBondContact O-N 2.72Å; T527-E529 WeakPolarHBondContact OG1-CG 3.41Å; T527-E529 PolarHBondContact OG1-OE1 2.76Å
528	G	82.6	Confident	85.7	Confident	48 Å²	48	78.5 Å²	78.5	50%	0.495	41%	0.414	S	S	.	.			trans	67.2	-4.7	-175.7	0	0	0	0	0	115.5	H526 R530	H526-G528 PolarHBondContact O-N 2.59Å; G528-R530 WeakPolarHBondContact O-CG 3.46Å; G528-R530 PolarHBondContact O-N 3.16Å; G528-R530 VanDerWaalsContact O-N 3.08Å
529	E	82.3	Confident	85.6	Confident	84 Å²	84	82.2 Å²	82.2	39%	0.393	43%	0.425	S	S	.	.			trans	-54.3	110.6	-174.9	-80.1	173.1	-107.9	0	0	113.4	K524 T527 P531	K524-E529 HydrophobicContact CB-CB 4.21Å; K524-E529 HydrophobicContact CG-CB 4.13Å; K524-E529 IonicContact NZ-OE2 3.99Å; K524-E529 PolarHBondContact NZ-OE2 3.12Å; K524-E529 PolarHBondContact O-N 3.45Å; T527-E529 WeakPolarHBondContact CB-OE1 3.44Å; T527-E529 PolarHBondContact O-N 2.72Å; T527-E529 WeakPolarHBondContact OG1-CG 3.41Å; T527-E529 PolarHBondContact OG1-OE1 2.76Å; E529-P531 WeakPolarHBondContact O-CD 3Å
530	R	83.3	Confident	85.5	Confident	150 Å²	150	85.4 Å²	85.4	57%	0.566	44%	0.439	S	S	*	.			trans	-122.7	75.9	173.7	-68.6	168.6	164.2	-157.4	2.4	111.4	G528 Y532 H540 F541 T542	G528-R530 WeakPolarHBondContact O-CG 3.46Å; G528-R530 PolarHBondContact O-N 3.16Å; G528-R530 VanDerWaalsContact O-N 3.08Å; R530-Y532 PolarHBondContact O-N 3.08Å; R530-H540 HydrophobicContact CB-CB 3.59Å; R530-H540 WeakPolarHBondContact CD-O 3.29Å; R530-H540 HydrophobicContact CG-CB 4.42Å; R530-H540 PolarHBondContact NH1-O 2.83Å; R530-F541 CarbonylContact C-O 3.54Å; R530-F541 VanDerWaalsContact C-O 3.3Å; R530-F541 VanDerWaalsContact CA-O 3.3Å; R530-F541 WeakPolarHBondContact CA-O 3.42Å; R530-T542 HydrophobicContact CG-CG2 3.83Å
531	P	84.3	Confident	85.5	Confident	77 Å²	77	83.7 Å²	83.7	50%	0.5	43%	0.428	S	S	.	.			trans	-66	-10.9	-173.5	-21	34	0	0	0	115	E529	E529-P531 WeakPolarHBondContact O-CD 3Å
532	Y	85.6	Confident	85.5	Confident	90 Å²	90	81.1 Å²	81.1	35%	0.353	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	86.5	-172.7	-55.8	-78	0	0	0	110.3	R530 F541 L544	R530-Y532 PolarHBondContact O-N 3.08Å; Y532-F541 WeakPolarHBondContact CB-O 3.38Å; Y532-F541 WeakPolarHBondContact CD2-O 3.17Å; Y532-F541 PolarHBondContact N-O 3.44Å; Y532-F541 PolarHBondContact O-N 2.98Å; Y532-L544 HydrophobicContact CD1-CB 3.97Å; Y532-L544 HydrophobicContact CD1-CD1 3.9Å; Y532-L544 HydrophobicContact CE1-CB 3.74Å; Y532-L544 HydrophobicContact CE1-CD1 4.15Å; Y532-L544 HydrophobicContact CE1-CG 4.41Å; Y532-L544 HydrophobicContact CG-CB 4.49Å
533	S	87.8	Confident	85.4	Confident	62 Å²	62	83.1 Å²	83.1	43%	0.434	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	149.7	171.8	54.5	0	0	0	0	111.9	L547	S533-L547 VanDerWaalsContact O-CD2 3.24Å; S533-L547 WeakPolarHBondContact O-CD2 3.29Å
534	C	90.2	Very high	85.3	Confident	11 Å²	11	84.2 Å²	84.2	7%	0.074	43%	0.434	C	S	.	.			trans	-87.7	138.3	167.6	-165.6	0	0	0	0	110.4	S536 C537 K539 L547	C534-S536 PolarHBondContact O-N 2.9Å; C534-C537 WeakPolarHBondContact CB-O 3.43Å; C534-K539 PolarHBondContact N-O 3.05Å; C534-K539 VanDerWaalsContact N-O 3.07Å; C534-L547 HydrophobicContact CB-CD1 3.66Å
535	K	85.1	Confident	85.2	Confident	203 Å²	203	86.8 Å²	86.8	88%	0.883	45%	0.45	S	S	*	.	S	Bend	trans	-78.3	-6.7	176.6	-64.7	-168.2	175.9	-169.6	0	114
536	S	83.6	Confident	85.2	Confident	78 Å²	78	82.1 Å²	82.1	55%	0.545	43%	0.429	S	S	.	.	S	Bend	trans	-117.1	-3	-172.7	-51.6	0	0	0	0	113.5	C534	C534-S536 PolarHBondContact O-N 2.9Å
537	C	88.8	Confident	85.4	Confident	32 Å²	32	78.5 Å²	78.5	22%	0.216	41%	0.413	C	S	.	.	S	Bend	trans	-172.9	165.4	166.9	63.9	0	0	0	0	109.9	C534 K539 H550 H554	C534-C537 WeakPolarHBondContact CB-O 3.43Å; C537-K539 PolarHBondContact O-N 2.76Å; C537-H550 PolarHBondContact SG-NE2 2.85Å; C537-H554 PolarHBondContact SG-CE1 3.46Å; C537-H554 PolarHBondContact SG-NE2 2.91Å
538	D	84.7	Confident	85.5	Confident	154 Å²	154	79.3 Å²	79.3	82%	0.824	41%	0.411	S	S	*	.	S	Bend	trans	-77.1	35.9	-170.6	-39.7	-76.3	0	0	0	113.8	H540	D538-H540 PolarHBondContact O-CD2 3.13Å
539	K	85.1	Confident	85.6	Confident	122 Å²	122	83 Å²	83	53%	0.53	41%	0.41	S	S	.	.			trans	-99.3	110	-178.9	-67.7	-178.1	-177.5	174.5	0	109.8	C534 C537 F541	C534-K539 PolarHBondContact N-O 3.05Å; C534-K539 VanDerWaalsContact N-O 3.07Å; C537-K539 PolarHBondContact O-N 2.76Å; K539-F541 HydrophobicContact CB-CE2 3.82Å; K539-F541 HydrophobicContact CB-CZ 4.01Å; K539-F541 WeakPolarHBondContact O-CD2 3.47Å; K539-F541 WeakPolarHBondContact O-CE2 3.35Å
540	H	87.2	Confident	85.7	Confident	87 Å²	87	79.9 Å²	79.9	40%	0.403	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	142.2	177.8	-63.6	-117.1	0	0	0	111.3	R530 D538	R530-H540 HydrophobicContact CB-CB 3.59Å; R530-H540 WeakPolarHBondContact CD-O 3.29Å; R530-H540 HydrophobicContact CG-CB 4.42Å; R530-H540 PolarHBondContact NH1-O 2.83Å; D538-H540 PolarHBondContact O-CD2 3.13Å
541	F	85.4	Confident	85.9	Confident	48 Å²	48	76.1 Å²	76.1	21%	0.211	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	150.4	-175.9	-61.3	-89.6	0	0	0	112.3	R530 Y532 K539 Q543 A546 L547 H550	R530-F541 CarbonylContact C-O 3.54Å; R530-F541 VanDerWaalsContact C-O 3.3Å; R530-F541 VanDerWaalsContact CA-O 3.3Å; R530-F541 WeakPolarHBondContact CA-O 3.42Å; Y532-F541 WeakPolarHBondContact CB-O 3.38Å; Y532-F541 WeakPolarHBondContact CD2-O 3.17Å; Y532-F541 PolarHBondContact N-O 3.44Å; Y532-F541 PolarHBondContact O-N 2.98Å; K539-F541 HydrophobicContact CB-CE2 3.82Å; K539-F541 HydrophobicContact CB-CZ 4.01Å; K539-F541 WeakPolarHBondContact O-CD2 3.47Å; K539-F541 WeakPolarHBondContact O-CE2 3.35Å; F541-Q543 VanDerWaalsContact C-N 3.3Å; F541-A546 HydrophobicContact CB-CB 4.31Å; F541-A546 HydrophobicContact CD1-CB 3.92Å; F541-A546 HydrophobicContact CG-CB 4.37Å; F541-L547 HydrophobicContact CB-CB 4.38Å; F541-L547 HydrophobicContact CD2-CB 4.01Å; F541-L547 HydrophobicContact CD2-CD1 4.07Å; F541-L547 HydrophobicContact CE2-CD1 4.27Å; F541-L547 HydrophobicContact CG-CB 4.34Å; F541-H550 HydrophobicContact CE1-CB 4.13Å; F541-H550 HydrophobicContact CE2-CB 3.93Å; F541-H550 AromaticContact CE2-CD2 3.33Å; F541-H550 WeakPolarHBondContact CE2-CD2 3.5Å; F541-H550 AromaticContact CE2-CG 3.72Å; F541-H550 HydrophobicContact CZ-CB 3.51Å; F541-H550 AromaticContact CZ-CD2 3.47Å; F541-H550 VanDerWaalsContact CZ-CD2 3.47Å; F541-H550 WeakPolarHBondContact CZ-CD2 3.39Å; F541-H550 AromaticContact CZ-CG 3.38Å
542	T	85	Confident	85.9	Confident	37 Å²	37	75.4 Å²	75.4	23%	0.227	37%	0.372	C	S	.	.	S	Bend	trans	-80.1	-9.1	174.8	58.9	0	0	0	0	113.3	R530	R530-T542 HydrophobicContact CG-CG2 3.83Å
543	Q	85.4	Confident	85.8	Confident	65 Å²	65	76.7 Å²	76.7	30%	0.304	38%	0.383	S	S	.	.	S	Bend	trans	-143.3	135.5	-174.8	-53.7	-177.7	28.2	0	0	112.2	Q521 F541 N545 A546 L547	Q521-Q543 HydrophobicContact CG-CG 4.41Å; Q521-Q543 VanDerWaalsContact NE2-CD 3.31Å; Q521-Q543 VanDerWaalsContact OE1-NE2 3.13Å; F541-Q543 VanDerWaalsContact C-N 3.3Å; Q543-N545 VanDerWaalsContact C-N 3.32Å; Q543-N545 PolarHBondContact O-N 3.1Å; Q543-A546 HydrophobicContact CB-CB 4.15Å; Q543-A546 WeakPolarHBondContact O-CB 3.33Å; Q543-A546 PolarHBondContact O-N 3.09Å; Q543-L547 PolarHBondContact O-N 2.97Å; Q543-L547 VanDerWaalsContact O-N 3.17Å
544	L	85.6	Confident	85.6	Confident	77 Å²	77	77.6 Å²	77.6	40%	0.403	38%	0.381	S	S	.	.	H	α-helix	trans	-56.7	-42.4	175.6	-176.1	59.9	0	0	0	112.7	Y532 A546 L547 Q548	Y532-L544 HydrophobicContact CD1-CB 3.97Å; Y532-L544 HydrophobicContact CD1-CD1 3.9Å; Y532-L544 HydrophobicContact CE1-CB 3.74Å; Y532-L544 HydrophobicContact CE1-CD1 4.15Å; Y532-L544 HydrophobicContact CE1-CG 4.41Å; Y532-L544 HydrophobicContact CG-CB 4.49Å; L544-A546 PolarHBondContact O-N 3.17Å; L544-L547 HydrophobicContact CD1-CD2 4.42Å; L544-L547 WeakPolarHBondContact O-CB 3.42Å; L544-L547 PolarHBondContact O-N 3.25Å; L544-L547 VanDerWaalsContact O-N 3.17Å; L544-Q548 HydrophobicContact CD1-CG 4.48Å; L544-Q548 HydrophobicContact CG-CG 4.46Å; L544-Q548 WeakPolarHBondContact O-CG 3.38Å; L544-Q548 PolarHBondContact O-N 3.48Å
545	N	85.4	Confident	85.2	Confident	116 Å²	116	81.1 Å²	81.1	62%	0.62	40%	0.402	S	S	*	.	H	α-helix	trans	-63.3	-29.6	178.7	-62.9	-0.5	0	0	0	112.5	Q543 R549	Q543-N545 VanDerWaalsContact C-N 3.32Å; Q543-N545 PolarHBondContact O-N 3.1Å; N545-R549 WeakPolarHBondContact O-CB 3.46Å; N545-R549 PolarHBondContact O-N 2.91Å; N545-R549 VanDerWaalsContact O-N 3.11Å
546	A	84.5	Confident	84.9	Confident	17 Å²	17	73.6 Å²	73.6	14%	0.14	38%	0.382	C	S	.	.	H	α-helix	trans	-74.1	-41.3	175.6	0	0	0	0	0	111.1	F541 Q543 L544 R549 H550	F541-A546 HydrophobicContact CB-CB 4.31Å; F541-A546 HydrophobicContact CD1-CB 3.92Å; F541-A546 HydrophobicContact CG-CB 4.37Å; Q543-A546 HydrophobicContact CB-CB 4.15Å; Q543-A546 WeakPolarHBondContact O-CB 3.33Å; Q543-A546 PolarHBondContact O-N 3.09Å; L544-A546 PolarHBondContact O-N 3.17Å; A546-R549 PolarHBondContact O-N 3.29Å; A546-H550 WeakPolarHBondContact O-CB 3.09Å; A546-H550 PolarHBondContact O-N 3.27Å
547	L	88.3	Confident	84.8	Confident	13 Å²	13	74.7 Å²	74.7	7%	0.068	38%	0.378	C	S	.	.	H	α-helix	trans	-59.9	-49.3	170.9	170.5	60.7	0	0	0	111.6	S533 C534 F541 Q543 L544 R549 H550 Q551	S533-L547 VanDerWaalsContact O-CD2 3.24Å; S533-L547 WeakPolarHBondContact O-CD2 3.29Å; C534-L547 HydrophobicContact CB-CD1 3.66Å; F541-L547 HydrophobicContact CB-CB 4.38Å; F541-L547 HydrophobicContact CD2-CB 4.01Å; F541-L547 HydrophobicContact CD2-CD1 4.07Å; F541-L547 HydrophobicContact CE2-CD1 4.27Å; F541-L547 HydrophobicContact CG-CB 4.34Å; Q543-L547 PolarHBondContact O-N 2.97Å; Q543-L547 VanDerWaalsContact O-N 3.17Å; L544-L547 HydrophobicContact CD1-CD2 4.42Å; L544-L547 WeakPolarHBondContact O-CB 3.42Å; L544-L547 PolarHBondContact O-N 3.25Å; L544-L547 VanDerWaalsContact O-N 3.17Å; L547-R549 VanDerWaalsContact C-N 3.33Å; L547-R549 PolarHBondContact O-N 3.28Å; L547-H550 CarbonylContact O-C 3.55Å; L547-H550 WeakPolarHBondContact O-CA 3.48Å; L547-H550 WeakPolarHBondContact O-CB 3.34Å; L547-H550 PolarHBondContact O-N 2.8Å; L547-Q551 HydrophobicContact CD1-CG 3.97Å; L547-Q551 HydrophobicContact CG-CG 4.41Å; L547-Q551 WeakPolarHBondContact O-CG 3.31Å; L547-Q551 PolarHBondContact O-N 3.46Å
548	Q	85.3	Confident	84.4	Confident	95 Å²	95	78.5 Å²	78.5	44%	0.444	39%	0.391	S	S	.	.	H	α-helix	trans	-58.9	-42.3	178.4	-73.7	177.6	-14.5	0	0	112.4	L544 H550 Q551	L544-Q548 HydrophobicContact CD1-CG 4.48Å; L544-Q548 HydrophobicContact CG-CG 4.46Å; L544-Q548 WeakPolarHBondContact O-CG 3.38Å; L544-Q548 PolarHBondContact O-N 3.48Å; Q548-H550 VanDerWaalsContact C-N 3.32Å; Q548-H550 PolarHBondContact O-N 3.39Å; Q548-Q551 PolarHBondContact O-N 2.9Å
549	R	83.9	Confident	84.3	Confident	125 Å²	125	74.7 Å²	74.7	47%	0.472	38%	0.375	S	S	.	.	H	α-helix	trans	-65.5	-35.1	173.5	179.2	176.4	58.5	-172.7	-3.6	112.2	N545 A546 L547 D571	N545-R549 WeakPolarHBondContact O-CB 3.46Å; N545-R549 PolarHBondContact O-N 2.91Å; N545-R549 VanDerWaalsContact O-N 3.11Å; A546-R549 PolarHBondContact O-N 3.29Å; L547-R549 VanDerWaalsContact C-N 3.33Å; L547-R549 PolarHBondContact O-N 3.28Å; R549-D571 WeakPolarHBondContact CD-OD2 3.25Å; R549-D571 IonicContact CZ-OD2 3.06Å; R549-D571 IonicContact NE-OD2 2.65Å; R549-D571 IonicContact NH1-OD2 3.52Å; R549-D571 PolarHBondContact NH1-OD2 3.46Å
550	H	86.4	Confident	84.1	Confident	19 Å²	19	72.1 Å²	72.1	9%	0.088	36%	0.362	C	S	.	.	H	α-helix	trans	-70.2	-38.4	176	169.2	53.8	0	0	0	112.4	C537 F541 A546 L547 Q548 R552 I553 H554	C537-H550 PolarHBondContact SG-NE2 2.85Å; F541-H550 HydrophobicContact CE1-CB 4.13Å; F541-H550 HydrophobicContact CE2-CB 3.93Å; F541-H550 AromaticContact CE2-CD2 3.33Å; F541-H550 WeakPolarHBondContact CE2-CD2 3.5Å; F541-H550 AromaticContact CE2-CG 3.72Å; F541-H550 HydrophobicContact CZ-CB 3.51Å; F541-H550 AromaticContact CZ-CD2 3.47Å; F541-H550 VanDerWaalsContact CZ-CD2 3.47Å; F541-H550 WeakPolarHBondContact CZ-CD2 3.39Å; F541-H550 AromaticContact CZ-CG 3.38Å; A546-H550 WeakPolarHBondContact O-CB 3.09Å; A546-H550 PolarHBondContact O-N 3.27Å; L547-H550 CarbonylContact O-C 3.55Å; L547-H550 WeakPolarHBondContact O-CA 3.48Å; L547-H550 WeakPolarHBondContact O-CB 3.34Å; L547-H550 PolarHBondContact O-N 2.8Å; Q548-H550 VanDerWaalsContact C-N 3.32Å; Q548-H550 PolarHBondContact O-N 3.39Å; H550-R552 PolarHBondContact O-N 2.83Å; H550-I553 VanDerWaalsContact O-CB 3.24Å; H550-I553 WeakPolarHBondContact O-CB 3.41Å; H550-I553 WeakPolarHBondContact O-CG1 3.31Å; H550-I553 PolarHBondContact O-N 2.97Å; H550-H554 AromaticContact CE1-CD2 3.98Å; H550-H554 AromaticContact CE1-NE2 3.35Å; H550-H554 PolarHBondContact CE1-NE2 2.71Å; H550-H554 AromaticContact NE2-CD2 3.77Å; H550-H554 AromaticContact NE2-NE2 3.12Å; H550-H554 PolarHBondContact NE2-NE2 3.47Å; H550-H554 VanDerWaalsContact NE2-NE2 3.12Å
551	Q	86	Confident	83.9	Confident	70 Å²	70	73.4 Å²	73.4	33%	0.327	37%	0.37	S	S	.	.	H	α-helix	trans	-57.9	-31.8	177.5	-75.3	169.8	-45.8	0	0	112.7	L547 Q548 I553 H554 T555	L547-Q551 HydrophobicContact CD1-CG 3.97Å; L547-Q551 HydrophobicContact CG-CG 4.41Å; L547-Q551 WeakPolarHBondContact O-CG 3.31Å; L547-Q551 PolarHBondContact O-N 3.46Å; Q548-Q551 PolarHBondContact O-N 2.9Å; Q551-I553 PolarHBondContact O-N 3.17Å; Q551-I553 VanDerWaalsContact O-N 3.15Å; Q551-H554 WeakPolarHBondContact O-CB 3.29Å; Q551-H554 PolarHBondContact O-N 2.2Å; Q551-T555 PolarHBondContact O-N 2.77Å
552	R	85.4	Confident	83.9	Confident	63 Å²	63	71.2 Å²	71.2	24%	0.238	36%	0.36	C	S	.	.	H	α-helix	trans	-62	-16.5	172.4	-64.7	-178	-177.7	169.2	1.7	115	H550 G556 E557 Y560 T570	H550-R552 PolarHBondContact O-N 2.83Å; R552-G556 CarbonylContact O-C 3.23Å; R552-G556 WeakPolarHBondContact O-CA 3.47Å; R552-G556 PolarHBondContact O-N 3.1Å; R552-G556 VanDerWaalsContact O-N 3.17Å; R552-E557 HydrophobicContact CB-CB 4.21Å; R552-E557 HydrophobicContact CG-CB 4.1Å; R552-E557 PolarHBondContact O-N 2.95Å; R552-Y560 VanDerWaalsContact NH1-CE2 3.33Å; R552-Y560 PolarHBondContact NH1-OH 3.33Å; R552-T570 PolarHBondContact NH1-O 3.45Å; R552-T570 VanDerWaalsContact NH1-O 3.15Å
553	I	82.9	Confident	83.7	Confident	116 Å²	116	73 Å²	73	60%	0.595	39%	0.386	S	S	*	.	H	α-helix	trans	-73.9	-37.9	172	-55.2	179.8	0	0	0	109.7	H550 Q551	H550-I553 VanDerWaalsContact O-CB 3.24Å; H550-I553 WeakPolarHBondContact O-CB 3.41Å; H550-I553 WeakPolarHBondContact O-CG1 3.31Å; H550-I553 PolarHBondContact O-N 2.97Å; Q551-I553 PolarHBondContact O-N 3.17Å; Q551-I553 VanDerWaalsContact O-N 3.15Å
554	H	83.7	Confident	83.3	Confident	82 Å²	82	76.1 Å²	76.1	38%	0.38	40%	0.404	S	S	.	.	H	α-helix	trans	-77.3	-39.7	178.2	-61.2	-64.1	0	0	0	112.7	C537 H550 Q551 G556	C537-H554 PolarHBondContact SG-CE1 3.46Å; C537-H554 PolarHBondContact SG-NE2 2.91Å; H550-H554 AromaticContact CE1-CD2 3.98Å; H550-H554 AromaticContact CE1-NE2 3.35Å; H550-H554 PolarHBondContact CE1-NE2 2.71Å; H550-H554 AromaticContact NE2-CD2 3.77Å; H550-H554 AromaticContact NE2-NE2 3.12Å; H550-H554 PolarHBondContact NE2-NE2 3.47Å; H550-H554 VanDerWaalsContact NE2-NE2 3.12Å; Q551-H554 WeakPolarHBondContact O-CB 3.29Å; Q551-H554 PolarHBondContact O-N 2.2Å; H554-G556 VanDerWaalsContact C-N 3.27Å; H554-G556 PolarHBondContact O-N 3.47Å
555	T	80.9	Confident	83.1	Confident	85 Å²	85	74.9 Å²	74.9	52%	0.521	40%	0.402	S	S	.	.	S	Bend	trans	-80.1	-7.2	175.6	64.8	0	0	0	0	113.6	Q551 E557	Q551-T555 PolarHBondContact O-N 2.77Å; T555-E557 WeakPolarHBondContact CB-OE1 3.43Å; T555-E557 PolarHBondContact O-N 3.11Å; T555-E557 VanDerWaalsContact O-N 3.11Å; T555-E557 WeakPolarHBondContact OG1-CB 3.34Å; T555-E557 VanDerWaalsContact OG1-CD 3.22Å; T555-E557 VanDerWaalsContact OG1-CG 3.3Å; T555-E557 WeakPolarHBondContact OG1-CG 3.33Å; T555-E557 PolarHBondContact OG1-OE1 3.39Å
556	G	80	Confident	82.8	Confident	45 Å²	45	77.1 Å²	77.1	46%	0.464	41%	0.406	S	S	.	.			trans	67.8	1.4	-175.3	0	0	0	0	0	114.9	R552 H554 K558	R552-G556 CarbonylContact O-C 3.23Å; R552-G556 WeakPolarHBondContact O-CA 3.47Å; R552-G556 PolarHBondContact O-N 3.1Å; R552-G556 VanDerWaalsContact O-N 3.17Å; H554-G556 VanDerWaalsContact C-N 3.27Å; H554-G556 PolarHBondContact O-N 3.47Å; G556-K558 PolarHBondContact O-N 2.69Å
557	E	79.9	Confident	82.6	Confident	100 Å²	100	84.2 Å²	84.2	47%	0.467	43%	0.429	S	S	.	.			trans	-57.9	123.4	-176.4	-82.6	169	-125	0	0	112.7	R552 T555 P559	R552-E557 HydrophobicContact CB-CB 4.21Å; R552-E557 HydrophobicContact CG-CB 4.1Å; R552-E557 PolarHBondContact O-N 2.95Å; T555-E557 WeakPolarHBondContact CB-OE1 3.43Å; T555-E557 PolarHBondContact O-N 3.11Å; T555-E557 VanDerWaalsContact O-N 3.11Å; T555-E557 WeakPolarHBondContact OG1-CB 3.34Å; T555-E557 VanDerWaalsContact OG1-CD 3.22Å; T555-E557 VanDerWaalsContact OG1-CG 3.3Å; T555-E557 WeakPolarHBondContact OG1-CG 3.33Å; T555-E557 PolarHBondContact OG1-OE1 3.39Å; E557-P559 HydrophobicContact CB-CG 4.5Å; E557-P559 WeakPolarHBondContact O-CD 3.48Å
558	K	81.8	Confident	82.2	Confident	113 Å²	113	86.5 Å²	86.5	49%	0.491	44%	0.443	S	S	.	.			trans	-124	72.3	176	-68.8	165.5	-174.8	172	0	110.8	G556 Y560 T568 F569 T570	G556-K558 PolarHBondContact O-N 2.69Å; K558-Y560 PolarHBondContact O-N 3.44Å; K558-T568 WeakPolarHBondContact CD-OG1 3.49Å; K558-F569 CarbonylContact C-O 3.49Å; K558-F569 VanDerWaalsContact CA-O 3.28Å; K558-F569 WeakPolarHBondContact CA-O 3.46Å; K558-T570 HydrophobicContact CG-CG2 3.88Å
559	P	82.6	Confident	82.1	Confident	73 Å²	73	83.8 Å²	83.8	47%	0.474	43%	0.43	S	S	.	.			trans	-68.2	-10.1	-169.9	-20.1	34.4	0	0	0	114.9	E557	E557-P559 HydrophobicContact CB-CG 4.5Å; E557-P559 WeakPolarHBondContact O-CD 3.48Å
560	Y	81.4	Confident	81.9	Confident	68 Å²	68	80 Å²	80	27%	0.267	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	93.5	-174.4	-52.8	-63.6	0	0	0	110.5	R552 K558 F569 T570 K572	R552-Y560 VanDerWaalsContact NH1-CE2 3.33Å; R552-Y560 PolarHBondContact NH1-OH 3.33Å; K558-Y560 PolarHBondContact O-N 3.44Å; Y560-F569 PolarHBondContact N-O 3.04Å; Y560-F569 VanDerWaalsContact N-O 3.14Å; Y560-F569 PolarHBondContact O-N 3.41Å; Y560-T570 WeakPolarHBondContact CE2-O 3.4Å; Y560-K572 HydrophobicContact CD1-CB 4.19Å; Y560-K572 HydrophobicContact CD2-CB 4.37Å; Y560-K572 HydrophobicContact CE1-CB 4.08Å; Y560-K572 HydrophobicContact CE2-CB 4.21Å; Y560-K572 VanDerWaalsContact CE2-N 3.28Å; Y560-K572 HydrophobicContact CG-CB 4.35Å
561	M	82.7	Confident	81.8	Confident	115 Å²	115	80.3 Å²	80.3	57%	0.567	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	139.7	173.3	-169.1	178.9	-69.9	0	0	111.2	K566 T568	M561-K566 WeakPolarHBondContact CG-O 3.45Å; M561-K566 HydrophobicContact SD-CB 4.29Å; M561-K566 HydrophobicContact SD-CG 4.46Å; M561-T568 HydrophobicContact CB-CG2 4.15Å; M561-T568 HydrophobicContact CE-CG2 3.89Å; M561-T568 HydrophobicContact CG-CG2 4.06Å
562	C	84.4	Confident	81.5	Confident	1 Å²	1	82.7 Å²	82.7	1%	0.007	43%	0.432	C	S	.	.			trans	-76.3	120.5	166.1	-177.2	0	0	0	0	110.2	L564 K566 R567 F569 L575	C562-L564 PolarHBondContact O-N 2.83Å; C562-K566 WeakPolarHBondContact O-CA 3.3Å; C562-K566 PolarHBondContact O-N 2.71Å; C562-R567 PolarHBondContact N-O 2.95Å; C562-F569 HydrophobicContact CB-CE2 4.33Å; C562-L575 HydrophobicContact CB-CD1 3.73Å
563	G	80.5	Confident	81.3	Confident	75 Å²	75	83 Å²	83	77%	0.773	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-23	178.3	0	0	0	0	0	114.5
564	L	77.7	Confident	81.3	Confident	131 Å²	131	79.7 Å²	79.7	69%	0.686	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-44.7	-173.7	-59.2	174.7	0	0	0	113	C562 H582	C562-L564 PolarHBondContact O-N 2.83Å; L564-H582 HydrophobicContact CD1-CB 3.47Å; L564-H582 VanDerWaalsContact CD1-CB 3.47Å
565	C	82.4	Confident	81.4	Confident	51 Å²	51	77 Å²	77	35%	0.345	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	13	179.8	75.8	0	0	0	0	115	R567 H578 H582	C565-R567 PolarHBondContact O-N 3.29Å; C565-H578 PolarHBondContact SG-NE2 3.29Å; C565-H582 PolarHBondContact SG-NE2 2.62Å
566	K	78.6	Confident	81.4	Confident	162 Å²	162	81.1 Å²	81.1	70%	0.704	42%	0.424	S	S	*	.			trans	59.1	1.7	174.5	-58.5	177.4	-177.5	174.6	0	116.6	M561 C562	M561-K566 WeakPolarHBondContact CG-O 3.45Å; M561-K566 HydrophobicContact SD-CB 4.29Å; M561-K566 HydrophobicContact SD-CG 4.46Å; C562-K566 WeakPolarHBondContact O-CA 3.3Å; C562-K566 PolarHBondContact O-N 2.71Å
567	R	78.9	Confident	81.4	Confident	167 Å²	167	87.3 Å²	87.3	63%	0.63	43%	0.433	S	S	*	.			trans	-60.4	136.3	173.1	-66	179.8	81.9	143.2	3.2	110.6	C562 C565 F569	C562-R567 PolarHBondContact N-O 2.95Å; C565-R567 PolarHBondContact O-N 3.29Å; R567-F569 HydrophobicContact CB-CE2 3.8Å; R567-F569 HydrophobicContact CB-CZ 4Å; R567-F569 WeakPolarHBondContact O-CD2 3.48Å; R567-F569 WeakPolarHBondContact O-CE2 3.46Å
568	T	81.7	Confident	81.5	Confident	60 Å²	60	83.6 Å²	83.6	37%	0.368	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	141.7	-175.6	57.7	0	0	0	0	112.1	K558 M561	K558-T568 WeakPolarHBondContact CD-OG1 3.49Å; M561-T568 HydrophobicContact CB-CG2 4.15Å; M561-T568 HydrophobicContact CE-CG2 3.89Å; M561-T568 HydrophobicContact CG-CG2 4.06Å
569	F	81.8	Confident	81.5	Confident	39 Å²	39	80.9 Å²	80.9	17%	0.171	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	149.6	-172.6	-61.4	-89.2	0	0	0	112.3	K558 Y560 C562 R567 L575 H578	K558-F569 CarbonylContact C-O 3.49Å; K558-F569 VanDerWaalsContact CA-O 3.28Å; K558-F569 WeakPolarHBondContact CA-O 3.46Å; Y560-F569 PolarHBondContact N-O 3.04Å; Y560-F569 VanDerWaalsContact N-O 3.14Å; Y560-F569 PolarHBondContact O-N 3.41Å; C562-F569 HydrophobicContact CB-CE2 4.33Å; R567-F569 HydrophobicContact CB-CE2 3.8Å; R567-F569 HydrophobicContact CB-CZ 4Å; R567-F569 WeakPolarHBondContact O-CD2 3.48Å; R567-F569 WeakPolarHBondContact O-CE2 3.46Å; F569-L575 HydrophobicContact CB-CB 4.27Å; F569-L575 HydrophobicContact CD2-CB 4.18Å; F569-L575 HydrophobicContact CD2-CD1 3.9Å; F569-L575 HydrophobicContact CE2-CD1 4.15Å; F569-L575 HydrophobicContact CG-CB 4.35Å; F569-H578 HydrophobicContact CE1-CB 4.04Å; F569-H578 HydrophobicContact CE2-CB 4.09Å; F569-H578 AromaticContact CE2-CD2 3.37Å; F569-H578 WeakPolarHBondContact CE2-CD2 3.34Å; F569-H578 AromaticContact CE2-CG 3.75Å; F569-H578 HydrophobicContact CZ-CB 3.6Å; F569-H578 AromaticContact CZ-CD2 3.39Å; F569-H578 WeakPolarHBondContact CZ-CD2 3.28Å; F569-H578 AromaticContact CZ-CG 3.3Å; F569-H578 AromaticContact CZ-ND1 3.87Å; F569-H578 AromaticContact CZ-NE2 3.98Å
570	T	81.2	Confident	81.3	Confident	44 Å²	44	83.6 Å²	83.6	27%	0.27	42%	0.417	S	S	.	.	S	Bend	trans	-79.4	-25.5	-179.9	54	0	0	0	0	113.7	R552 K558 Y560	R552-T570 PolarHBondContact NH1-O 3.45Å; R552-T570 VanDerWaalsContact NH1-O 3.15Å; K558-T570 HydrophobicContact CG-CG2 3.88Å; Y560-T570 WeakPolarHBondContact CE2-O 3.4Å
571	D	82.3	Confident	81.2	Confident	26 Å²	26	86.6 Å²	86.6	14%	0.139	44%	0.436	C	S	.	.	S	Bend	trans	-129.7	136.9	-177.2	-169.1	-29.9	0	0	0	111.3	R549 S573 T574 L575	R549-D571 WeakPolarHBondContact CD-OD2 3.25Å; R549-D571 IonicContact CZ-OD2 3.06Å; R549-D571 IonicContact NE-OD2 2.65Å; R549-D571 IonicContact NH1-OD2 3.52Å; R549-D571 PolarHBondContact NH1-OD2 3.46Å; D571-S573 PolarHBondContact O-N 3.4Å; D571-S573 WeakPolarHBondContact OD1-CB 3.27Å; D571-S573 PolarHBondContact OD1-N 2.87Å; D571-S573 PolarHBondContact OD1-OG 3.04Å; D571-T574 HydrophobicContact CB-CG2 4.42Å; D571-T574 PolarHBondContact O-N 2.99Å; D571-T574 VanDerWaalsContact O-N 3.08Å; D571-T574 PolarHBondContact O-OG1 2.8Å; D571-L575 PolarHBondContact O-N 3.32Å
572	K	80.7	Confident	80.8	Confident	120 Å²	120	84.8 Å²	84.8	52%	0.522	43%	0.426	S	S	.	.	H	α-helix	trans	-60.6	-24.8	174.9	-170.7	167.9	-175.7	168.6	0	112.2	Y560 R576	Y560-K572 HydrophobicContact CD1-CB 4.19Å; Y560-K572 HydrophobicContact CD2-CB 4.37Å; Y560-K572 HydrophobicContact CE1-CB 4.08Å; Y560-K572 HydrophobicContact CE2-CB 4.21Å; Y560-K572 VanDerWaalsContact CE2-N 3.28Å; Y560-K572 HydrophobicContact CG-CB 4.35Å; K572-R576 WeakPolarHBondContact O-CB 3.41Å; K572-R576 WeakPolarHBondContact O-CG 3.29Å; K572-R576 PolarHBondContact O-N 2.86Å
573	S	82.2	Confident	80	Confident	70 Å²	70	86.8 Å²	86.8	49%	0.49	45%	0.447	S	S	.	.	H	α-helix	trans	-70.2	-40.6	174.4	-43	0	0	0	0	111.9	D571 R576 R577	D571-S573 PolarHBondContact O-N 3.4Å; D571-S573 WeakPolarHBondContact OD1-CB 3.27Å; D571-S573 PolarHBondContact OD1-N 2.87Å; D571-S573 PolarHBondContact OD1-OG 3.04Å; S573-R576 PolarHBondContact O-N 3Å; S573-R577 PolarHBondContact O-N 3.27Å
574	T	82.6	Confident	79.1	Confident	46 Å²	46	88.1 Å²	88.1	28%	0.282	44%	0.444	S	S	.	.	H	α-helix	trans	-74.4	-36.1	175.7	54.1	0	0	0	0	111.4	D571 R577 H578	D571-T574 HydrophobicContact CB-CG2 4.42Å; D571-T574 PolarHBondContact O-N 2.99Å; D571-T574 VanDerWaalsContact O-N 3.08Å; D571-T574 PolarHBondContact O-OG1 2.8Å; T574-R577 PolarHBondContact O-N 3.24Å; T574-H578 WeakPolarHBondContact O-CB 3.17Å; T574-H578 PolarHBondContact O-N 3.16Å
575	L	84.8	Confident	78.1	Confident	27 Å²	27	89.7 Å²	89.7	14%	0.141	45%	0.454	C	S	.	.	H	α-helix	trans	-58.8	-47.6	167.5	174.4	60.2	0	0	0	111.5	C562 F569 D571 R577 H578 T579	C562-L575 HydrophobicContact CB-CD1 3.73Å; F569-L575 HydrophobicContact CB-CB 4.27Å; F569-L575 HydrophobicContact CD2-CB 4.18Å; F569-L575 HydrophobicContact CD2-CD1 3.9Å; F569-L575 HydrophobicContact CE2-CD1 4.15Å; F569-L575 HydrophobicContact CG-CB 4.35Å; D571-L575 PolarHBondContact O-N 3.32Å; L575-R577 PolarHBondContact O-N 3.15Å; L575-H578 CarbonylContact O-C 3.52Å; L575-H578 WeakPolarHBondContact O-CA 3.49Å; L575-H578 WeakPolarHBondContact O-CB 3.43Å; L575-H578 PolarHBondContact O-N 3.11Å; L575-T579 HydrophobicContact CD1-CG2 3.95Å; L575-T579 HydrophobicContact CG-CG2 4.39Å; L575-T579 PolarHBondContact O-N 3.44Å; L575-T579 PolarHBondContact O-OG1 2.91Å
576	R	81.7	Confident	76.4	Confident	170 Å²	170	91.4 Å²	91.4	64%	0.642	46%	0.462	S	S	*	.	H	α-helix	trans	-56.9	-47	177.9	-86.2	174.9	167.3	179.4	-5.3	112.7	K572 S573 H578 T579 M580	K572-R576 WeakPolarHBondContact O-CB 3.41Å; K572-R576 WeakPolarHBondContact O-CG 3.29Å; K572-R576 PolarHBondContact O-N 2.86Å; S573-R576 PolarHBondContact O-N 3Å; R576-H578 VanDerWaalsContact C-N 3.27Å; R576-H578 PolarHBondContact O-N 3.08Å; R576-T579 WeakPolarHBondContact CA-OG1 3.25Å; R576-T579 PolarHBondContact O-N 2.96Å; R576-T579 PolarHBondContact O-OG1 3.01Å; R576-M580 PolarHBondContact O-N 3.08Å
577	R	80.3	Confident	75	Confident	176 Å²	176	89.9 Å²	89.9	66%	0.664	47%	0.469	S	S	*	.	H	α-helix	trans	-60	-38.8	175	-175.6	174.5	63.9	163.1	0.2	111.8	S573 T574 L575 M580	S573-R577 PolarHBondContact O-N 3.27Å; T574-R577 PolarHBondContact O-N 3.24Å; L575-R577 PolarHBondContact O-N 3.15Å; R577-M580 HydrophobicContact CG-CE 4.48Å
578	H	82.4	Confident	73.2	Confident	22 Å²	22	91.9 Å²	91.9	10%	0.102	48%	0.476	C	S	.	.	H	α-helix	trans	-71.2	-35.2	176.3	175.6	65.2	0	0	0	113.4	C565 F569 T574 L575 R576 M580 I581 H582	C565-H578 PolarHBondContact SG-NE2 3.29Å; F569-H578 HydrophobicContact CE1-CB 4.04Å; F569-H578 HydrophobicContact CE2-CB 4.09Å; F569-H578 AromaticContact CE2-CD2 3.37Å; F569-H578 WeakPolarHBondContact CE2-CD2 3.34Å; F569-H578 AromaticContact CE2-CG 3.75Å; F569-H578 HydrophobicContact CZ-CB 3.6Å; F569-H578 AromaticContact CZ-CD2 3.39Å; F569-H578 WeakPolarHBondContact CZ-CD2 3.28Å; F569-H578 AromaticContact CZ-CG 3.3Å; F569-H578 AromaticContact CZ-ND1 3.87Å; F569-H578 AromaticContact CZ-NE2 3.98Å; T574-H578 WeakPolarHBondContact O-CB 3.17Å; T574-H578 PolarHBondContact O-N 3.16Å; L575-H578 CarbonylContact O-C 3.52Å; L575-H578 WeakPolarHBondContact O-CA 3.49Å; L575-H578 WeakPolarHBondContact O-CB 3.43Å; L575-H578 PolarHBondContact O-N 3.11Å; R576-H578 VanDerWaalsContact C-N 3.27Å; R576-H578 PolarHBondContact O-N 3.08Å; H578-M580 VanDerWaalsContact C-N 3.26Å; H578-M580 PolarHBondContact O-N 3.08Å; H578-I581 VanDerWaalsContact O-CB 3.29Å; H578-I581 WeakPolarHBondContact O-CB 3.11Å; H578-I581 WeakPolarHBondContact O-CG1 3.3Å; H578-I581 PolarHBondContact O-N 3.31Å; H578-H582 AromaticContact CD2-NE2 3.86Å; H578-H582 AromaticContact CE1-NE2 3.29Å; H578-H582 PolarHBondContact CE1-NE2 3.37Å; H578-H582 VanDerWaalsContact CE1-NE2 3.29Å; H578-H582 AromaticContact NE2-CD2 3.86Å; H578-H582 AromaticContact NE2-NE2 3.04Å; H578-H582 PolarHBondContact NE2-NE2 2.75Å; H578-H582 PolarHBondContact O-CD2 2.8Å
579	T	80.1	Confident	71.3	Confident	56 Å²	56	97.5 Å²	97.5	34%	0.344	50%	0.496	S	S	.	.	H	α-helix	trans	-66.9	-25.6	175.4	45.9	0	0	0	0	113.2	L575 R576 I581 H582 G583	L575-T579 HydrophobicContact CD1-CG2 3.95Å; L575-T579 HydrophobicContact CG-CG2 4.39Å; L575-T579 PolarHBondContact O-N 3.44Å; L575-T579 PolarHBondContact O-OG1 2.91Å; R576-T579 WeakPolarHBondContact CA-OG1 3.25Å; R576-T579 PolarHBondContact O-N 2.96Å; R576-T579 PolarHBondContact O-OG1 3.01Å; T579-I581 PolarHBondContact O-N 2.88Å; T579-H582 PolarHBondContact O-N 3.13Å; T579-H582 VanDerWaalsContact O-N 3.13Å; T579-G583 PolarHBondContact O-N 3.15Å
580	M	79.3	Confident	69.2	Low	129 Å²	129	101.4 Å²	101.4	64%	0.635	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-10.9	170.7	-63	-170	-62.8	0	0	113.6	R576 R577 H578	R576-M580 PolarHBondContact O-N 3.08Å; R577-M580 HydrophobicContact CG-CE 4.48Å; H578-M580 VanDerWaalsContact C-N 3.26Å; H578-M580 PolarHBondContact O-N 3.08Å
581	I	78.3	Confident	67	Low	131 Å²	131	108.1 Å²	108.1	67%	0.672	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-22.5	172.6	-52.2	175.6	0	0	0	110.9	H578 T579	H578-I581 VanDerWaalsContact O-CB 3.29Å; H578-I581 WeakPolarHBondContact O-CB 3.11Å; H578-I581 WeakPolarHBondContact O-CG1 3.3Å; H578-I581 PolarHBondContact O-N 3.31Å; T579-I581 PolarHBondContact O-N 2.88Å
582	H	75.4	Confident	64.5	Low	77 Å²	77	114.1 Å²	114.1	36%	0.356	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.8	-13.9	179.9	-57.8	-80.7	0	0	0	113.6	L564 C565 H578 T579	L564-H582 HydrophobicContact CD1-CB 3.47Å; L564-H582 VanDerWaalsContact CD1-CB 3.47Å; C565-H582 PolarHBondContact SG-NE2 2.62Å; H578-H582 AromaticContact CD2-NE2 3.86Å; H578-H582 AromaticContact CE1-NE2 3.29Å; H578-H582 PolarHBondContact CE1-NE2 3.37Å; H578-H582 VanDerWaalsContact CE1-NE2 3.29Å; H578-H582 AromaticContact NE2-CD2 3.86Å; H578-H582 AromaticContact NE2-NE2 3.04Å; H578-H582 PolarHBondContact NE2-NE2 2.75Å; H578-H582 PolarHBondContact O-CD2 2.8Å; T579-H582 PolarHBondContact O-N 3.13Å; T579-H582 VanDerWaalsContact O-N 3.13Å
583	G	67.3	Low	62.3	Low	43 Å²	43	114.2 Å²	114.2	44%	0.443	59%	0.586	S	S	.	*	S	Bend	trans	-106.4	86.6	-173.6	0	0	0	0	0	112.9	T579	T579-G583 PolarHBondContact O-N 3.15Å
584	S	62	Low	59.9	Low	104 Å²	104	114.8 Å²	114.8	73%	0.727	59%	0.586	S	S	*	*	S	Bend	trans	48.3	123.2	159.6	59.5	0	0	0	0	119.2
585	D	55.6	Low	57.8	Low	164 Å²	164	120.3 Å²	120.3	88%	0.877	61%	0.614	S	S	*	*			trans	41.5	89	159.1	-63.8	-27.5	0	0	0	117.5
586	V	48.2	Very low	55.2	Low	87 Å²	87	127.6 Å²	127.6	53%	0.527	65%	0.647	S	S	.	*			trans	-133.5	122.9	161.1	-152.9	0	0	0	0	109.9	W588	V586-W588 VanDerWaalsContact CG1-CD1 3.44Å; V586-W588 PolarHBondContact O-N 3.25Å
587	P	48.6	Very low	52.8	Low	129 Å²	129	122.7 Å²	122.7	84%	0.838	65%	0.65	S	S	*	*			trans	-77.9	60.5	-178.4	32.8	-36.9	0	0	0	112.6
588	W	41.6	Very low	50.3	Low	210 Å²	210	121.8 Å²	121.8	80%	0.795	66%	0.658	S	S	*	*			trans	-105.3	104.2	162.8	-66.6	97.2	0	0	0	108.4	V586 T590	V586-W588 VanDerWaalsContact CG1-CD1 3.44Å; V586-W588 PolarHBondContact O-N 3.25Å; W588-T590 PolarHBondContact O-N 3.37Å
589	K	41.5	Very low	47.9	Very low	178 Å²	178	127 Å²	127	77%	0.774	69%	0.691	S	S	*	*			trans	-71.5	73.3	-176.9	-164.1	174.9	-174.1	177.3	0	110.6	Y591	K589-Y591 WeakPolarHBondContact O-CD2 3.43Å; K589-Y591 PolarHBondContact O-N 3.09Å; K589-Y591 VanDerWaalsContact O-N 3.08Å
590	T	36.8	Very low	45.5	Very low	121 Å²	121	131.2 Å²	131.2	74%	0.742	71%	0.707	S	S	*	*			trans	-68.7	103.8	176.2	48.1	0	0	0	0	109.9	W588 L592	W588-T590 PolarHBondContact O-N 3.37Å; T590-L592 PolarHBondContact O-N 2.7Å
591	Y	35.2	Very low	43.6	Very low	185 Å²	185	134.2 Å²	134.2	73%	0.725	72%	0.719	S	S	*	*			trans	-57.2	120.2	168	-66.3	-94.4	0	0	0	109.2	K589 V593	K589-Y591 WeakPolarHBondContact O-CD2 3.43Å; K589-Y591 PolarHBondContact O-N 3.09Å; K589-Y591 VanDerWaalsContact O-N 3.08Å; Y591-V593 PolarHBondContact O-N 2.34Å
592	L	30.1	Very low	41.3	Very low	152 Å²	152	136 Å²	136	80%	0.796	72%	0.722	S	S	*	*			trans	-78.1	90.3	178.8	-152.1	78.6	0	0	0	108.3	T590 V594	T590-L592 PolarHBondContact O-N 2.7Å; L592-V594 HydrophobicContact CD2-CG2 3.79Å; L592-V594 HydrophobicContact CG-CG2 4.03Å; L592-V594 PolarHBondContact O-N 3.25Å
593	V	34.6	Very low	39.2	Very low	121 Å²	121	142 Å²	142	73%	0.733	75%	0.747	S	S	*	*			trans	-73.3	85.6	172.2	-176.4	0	0	0	0	108.3	Y591 L595	Y591-V593 PolarHBondContact O-N 2.34Å; V593-L595 HydrophobicContact CG1-CD2 4.35Å; V593-L595 HydrophobicContact CG1-CG 4.29Å; V593-L595 PolarHBondContact O-N 2.59Å
594	V	30.6	Very low	37.5	Very low	82 Å²	82	145.5 Å²	145.5	50%	0.497	76%	0.762	S	S	.	*			trans	-77.3	110.9	169.9	178.7	0	0	0	0	107.7	L592 E596	L592-V594 HydrophobicContact CD2-CG2 3.79Å; L592-V594 HydrophobicContact CG-CG2 4.03Å; L592-V594 PolarHBondContact O-N 3.25Å; V594-E596 HydrophobicContact CG1-CB 4.18Å; V594-E596 HydrophobicContact CG1-CG 3.6Å
595	L	40	Very low	35.9	Very low	163 Å²	163	150.4 Å²	150.4	85%	0.853	77%	0.77	S	S	*	*			trans	-95.7	84.8	164.5	-65.6	179.7	0	0	0	108.1	V593	V593-L595 HydrophobicContact CG1-CD2 4.35Å; V593-L595 HydrophobicContact CG1-CG 4.29Å; V593-L595 PolarHBondContact O-N 2.59Å
596	E	30.4	Very low	34.7	Very low	179 Å²	179	147.9 Å²	147.9	84%	0.836	77%	0.766	S	S	*	*			trans	-84.7	132.9	166	-88.2	169	-171.9	0	0	109.5	V594	V594-E596 HydrophobicContact CG1-CB 4.18Å; V594-E596 HydrophobicContact CG1-CG 3.6Å
597	G	31	Very low	33.9	Very low	68 Å²	68	149.5 Å²	149.5	70%	0.701	78%	0.778	S	S	*	*			trans	165.7	79.6	-178.1	0	0	0	0	0	114.9
598	N	26.4	Very low	32.9	Very low	156 Å²	156	149.2 Å²	149.2	83%	0.834	77%	0.774	S	S	*	*			trans	62	112.7	161.8	-54.6	-13.8	0	0	0	117.3
599	V	33.1	Very low	32.2	Very low	132 Å²	132	148.2 Å²	148.2	80%	0.8	78%	0.775	S	S	*	*			cis	80	101.2	41.6	-175.4	0	0	0	0	113.9
600	E	29.9	Very low	31.4	Very low	145 Å²	145	146.4 Å²	146.4	68%	0.678	77%	0.769	S	S	*	*				-164.6	140.9	106.5	-96	-142.4	139.5	0	0	111.9	K602	E600-K602 IonicContact OE1-NZ 2.64Å; E600-K602 PolarHBondContact OE1-NZ 2.88Å; E600-K602 IonicContact OE2-NZ 2.63Å; E600-K602 PolarHBondContact OE2-NZ 3.12Å
601	E	40.2	Very low	30.9	Very low	192 Å²	192	148.9 Å²	148.9	90%	0.897	77%	0.77	S	S	*	*			trans	-102.7	132.5	160.5	-66.1	-169.6	141.7	0	0	109.4
602	K	29.1	Very low	30.4	Very low	167 Å²	167	143.9 Å²	143.9	73%	0.726	78%	0.775	S	S	*	*			trans	-142.3	128.6	158.6	-74.3	-165.6	173.1	70.3	0	112	E600	E600-K602 IonicContact OE1-NZ 2.64Å; E600-K602 PolarHBondContact OE1-NZ 2.88Å; E600-K602 IonicContact OE2-NZ 2.63Å; E600-K602 PolarHBondContact OE2-NZ 3.12Å
603	K	31	Very low	30.1	Very low	203 Å²	203	140 Å²	140	88%	0.883	77%	0.772	S	S	*	*			trans	-154.9	132.4	166.7	-155.9	176.5	-167.7	174.8	0	108.5
604	P	31.7	Very low	29.5	Very low	118 Å²	118	139.3 Å²	139.3	77%	0.766	77%	0.772	S	S	*	*				-145.3	151.1	122.4	35.4	-20.6	0	0	0	115.3
605	K	29	Very low	29.2	Very low	206 Å²	206	144 Å²	144	90%	0.896	79%	0.788	S	S	*	*			trans	33.3	145.4	148.9	-63.4	-179.5	178.4	177.6	0	122.4
606	S	29.1	Very low	28.6	Very low	112 Å²	112	142.2 Å²	142.2	78%	0.783	78%	0.776	S	S	*	*			trans	-82.8	173.2	178.4	51.8	0	0	0	0	114.1
607	P	32.2	Very low	28.4	Very low	121 Å²	121	141.4 Å²	141.4	79%	0.786	77%	0.77	S	S	*	*				-141	172.2	100.4	39.3	-25.9	0	0	0	117.2
608	T	26.8	Very low	28.1	Very low	122 Å²	122	149 Å²	149	75%	0.748	78%	0.777	S	S	*	*			trans	-25.9	148.7	173	52.3	0	0	0	0	123
609	K	27.6	Very low	28.2	Very low	189 Å²	189	146.2 Å²	146.2	82%	0.822	77%	0.77	S	S	*	*			trans	39.8	132.5	135.4	-75.8	-172.1	174.8	-173.2	0	119.1
610	E	25	Very low	27.8	Very low	140 Å²	140	146.2 Å²	146.2	65%	0.654	77%	0.77	S	S	*	*			cis	-162	173.3	42.3	-90.1	-138.9	139.1	0	0	114.4
611	K	26.8	Very low	27.5	Very low	173 Å²	173	143.3 Å²	143.3	75%	0.752	77%	0.771	S	S	*	*			trans	4.5	139.4	157.5	-49.8	-178.1	-172.8	84.2	0	122.4
612	G	23.3	Very low	26.8	Very low	80 Å²	80	139.3 Å²	139.3	83%	0.825	76%	0.764	S	S	*	*				124.1	133.1	118.1	0	0	0	0	0	120.1
613	G	23.9	Very low	26.6	Very low	71 Å²	71	140.8 Å²	140.8	73%	0.732	77%	0.771	S	S	*	*			trans	77.4	141.1	166	0	0	0	0	0	116.5
614	S	23.2	Very low	26.3	Very low	107 Å²	107	135.5 Å²	135.5	75%	0.748	76%	0.759	S	S	*	*			cis	96.6	115.8	16.8	78.8	0	0	0	0	116.5
615	E	24.3	Very low	26	Very low	179 Å²	179	134.7 Å²	134.7	84%	0.836	76%	0.756	S	S	*	*			trans	66	156.2	162.3	-59.2	-175.3	148.5	0	0	116
616	E	25.7	Very low	25.8	Very low	127 Å²	127	130.1 Å²	130.1	59%	0.593	75%	0.751	S	S	*	*			cis	-162.3	172.5	-16.8	-128.9	-156.3	111.6	0	0	109.6
617	K	27.5	Very low	25.6	Very low	162 Å²	162	130.2 Å²	130.2	70%	0.704	75%	0.751	S	S	*	*			trans	65.1	160.8	155.4	-75.8	153.5	-177.4	142.9	0	117.3
618	R	25.1	Very low	25.6	Very low	228 Å²	228	130.7 Å²	130.7	86%	0.86	75%	0.754	S	S	*	*			cis	-168.4	162.3	-31.3	-132.8	-174.3	-178.2	-167.4	1.5	105.9
619	S	27.7	Very low	25.5	Very low	96 Å²	96	131 Å²	131	67%	0.671	76%	0.756	S	S	*	*			cis	-132.6	-137.1	4.3	-47.7	0	0	0	0	109.1
620	T	24.9	Very low	25.8	Very low	132 Å²	132	127 Å²	127	81%	0.81	75%	0.749	S	S	*	*			cis	-135.1	159.8	6.5	39.7	0	0	0	0	111.6
621	A	24.1	Very low	25.7	Very low	84 Å²	84	125.9 Å²	125.9	69%	0.694	75%	0.752	S	S	*	*			trans	28	113.1	160.8	0	0	0	0	0	120.1
622	S	25.4	Very low	25.6	Very low	109 Å²	109	123 Å²	123	76%	0.762	75%	0.749	S	S	*	*				61.9	128.5	65.8	85.5	0	0	0	0	113.4
623	K	25.3	Very low	25.8	Very low	198 Å²	198	127.7 Å²	127.7	86%	0.861	75%	0.749	S	S	*	*			cis	-153.6	175	22	-89.3	-177.8	175.4	175.7	0	108.6
624	S	24.1	Very low	25.7	Very low	91 Å²	91	127.7 Å²	127.7	64%	0.636	74%	0.742	S	S	*	*			cis	-173.6	178	-22.5	56.8	0	0	0	0	108.6
625	S	24.3	Very low	25.8	Very low	101 Å²	101	128.5 Å²	128.5	71%	0.706	74%	0.742	S	S	*	*			trans	53.9	138.5	155	50.5	0	0	0	0	120.5
626	S	24.5	Very low	25.8	Very low	111 Å²	111	126.9 Å²	126.9	78%	0.776	74%	0.739	S	S	*	*			cis	159.9	139.3	-18.7	43.8	0	0	0	0	106.6
627	S	24.9	Very low	25.7	Very low	114 Å²	114	128 Å²	128	80%	0.797	75%	0.749	S	S	*	*			trans	-68.1	168.8	-174	-36	0	0	0	0	114.8
628	P	34	Very low	25.5	Very low	131 Å²	131	124.1 Å²	124.1	85%	0.851	75%	0.747	S	S	*	*				-146.2	-180	80.7	39	-20	0	0	0	117.6
629	V	23.3	Very low	25.5	Very low	128 Å²	128	119.6 Å²	119.6	78%	0.776	74%	0.74	S	S	*	*			trans	-80	152.6	177.9	174	0	0	0	0	108.9
630	P	34.5	Very low	25.4	Very low	106 Å²	106	123 Å²	123	69%	0.688	74%	0.743	S	S	*	*				-165.2	165.8	72.2	46.1	-22.4	0	0	0	124
631	T	23.7	Very low	25.4	Very low	115 Å²	115	122.1 Å²	122.1	71%	0.706	74%	0.742	S	S	*	*			trans	72.5	129.8	139.3	43.8	0	0	0	0	126.5
632	V	24.6	Very low	25.3	Very low	113 Å²	113	123.9 Å²	123.9	69%	0.685	75%	0.749	S	S	*	*			trans	67.3	150.3	141.8	-59.8	0	0	0	0	125.3
633	H	26.2	Very low	25.2	Very low	178 Å²	178	124.9 Å²	124.9	82%	0.824	75%	0.751	S	S	*	*			trans	76.6	157.5	162.7	-58.8	-64.1	0	0	0	119.8
634	A	23.6	Very low	25.2	Very low	72 Å²	72	123.9 Å²	123.9	60%	0.595	75%	0.749	S	S	*	*			cis	-175.9	134.6	-49.7	0	0	0	0	0	110.8
635	V	24.4	Very low	25.1	Very low	124 Å²	124	125 Å²	125	75%	0.752	75%	0.753	S	S	*	*			trans	56.1	159	154.8	-53.8	0	0	0	0	121.7
636	D	23.3	Very low	25	Very low	145 Å²	145	127.4 Å²	127.4	78%	0.775	76%	0.763	S	S	*	*			trans	63	155.8	156	-53.3	-21.1	0	0	0	121.1
637	D	23.8	Very low	25	Very low	151 Å²	151	127.8 Å²	127.8	81%	0.807	76%	0.76	S	S	*	*			cis	-162.7	174.3	-41.5	-156.4	-7.4	0	0	0	109.6
638	A	24.7	Very low	24.9	Very low	79 Å²	79	128.5 Å²	128.5	65%	0.653	76%	0.759	S	S	*	*			trans	55.9	102.8	150.5	0	0	0	0	0	123.8
639	D	23.3	Very low	24.7	Very low	133 Å²	133	127.9 Å²	127.9	71%	0.711	76%	0.755	S	S	*	*				75.1	155.2	114.7	-156.1	24.7	0	0	0	124.4
640	K	27.3	Very low	25	Very low	168 Å²	168	128.2 Å²	128.2	73%	0.73	76%	0.758	S	S	*	*			trans	68.9	103	160.6	-85.3	176.9	-168.2	77.9	0	124.2
641	S	23.5	Very low	24.7	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	77%	0.767	S	S	*	*				55.6	117	105.5	175.2	0	0	0	0	122.7
642	S	23	Very low	25	Very low	121 Å²	121	131.4 Å²	131.4	85%	0.846	76%	0.764	S	S	*	*			trans	-161.1	171.9	132.4	62.3	0	0	0	0	112.7
643	T	23.3	Very low	25.2	Very low	129 Å²	129	132.6 Å²	132.6	79%	0.791	77%	0.771	S	S	*	*			trans	-136.7	153.7	-168.6	51	0	0	0	0	113
644	E	24.5	Very low	25.5	Very low	178 Å²	178	130.5 Å²	130.5	83%	0.832	77%	0.771	S	S	*	*			trans	162.4	115.1	143.4	-90.9	-173.7	164.5	0	0	108.9
645	T	22.4	Very low	25.9	Very low	115 Å²	115	133.1 Å²	133.1	71%	0.706	77%	0.774	S	S	*	*				76.1	114	71.6	60.2	0	0	0	0	117.3
646	V	22.4	Very low	26.5	Very low	151 Å²	151	131.9 Å²	131.9	92%	0.915	77%	0.769	S	S	*	*			trans	-140.8	153.6	158.2	-177.7	0	0	0	0	107.9
647	V	24.4	Very low	27.2	Very low	119 Å²	119	129.5 Å²	129.5	72%	0.721	77%	0.769	S	S	*	*			trans	-142	167.6	-155	-162.6	0	0	0	0	112.9
648	V	22.1	Very low	28.1	Very low	128 Å²	128	129.2 Å²	129.2	78%	0.776	77%	0.768	S	S	*	*			trans	83.8	146.4	162.5	-172.6	0	0	0	0	116
649	P	30.2	Very low	28.9	Very low	118 Å²	118	135.9 Å²	135.9	77%	0.766	78%	0.776	S	S	*	*			cis	-120.1	178.7	-9.5	25.9	-4.7	0	0	0	115.3
650	T	28.8	Very low	29.5	Very low	136 Å²	136	133.7 Å²	133.7	83%	0.834	78%	0.777	S	S	*	*			trans	-125.4	138.8	164.3	51.4	0	0	0	0	111.1
651	E	29.3	Very low	30	Very low	187 Å²	187	136.4 Å²	136.4	87%	0.874	78%	0.783	S	S	*	*			trans	-149.3	160.8	164.1	-97.3	-79	115.1	0	0	108
652	P	30.8	Very low	30.5	Very low	101 Å²	101	140 Å²	140	66%	0.656	79%	0.787	S	S	*	*			trans	-97.5	155.7	-144	35.6	-37.6	0	0	0	117.2
653	V	28.6	Very low	30.9	Very low	138 Å²	138	137.9 Å²	137.9	84%	0.836	78%	0.783	S	S	*	*			trans	-119.1	126.8	158.2	178.3	0	0	0	0	108.4
654	T	31.3	Very low	31.1	Very low	134 Å²	134	136.7 Å²	136.7	82%	0.822	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-76.6	123.3	-178.7	33.4	0	0	0	0	112.1
655	L	32.9	Very low	31.3	Very low	126 Å²	126	136 Å²	136	66%	0.66	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-81.1	146.8	168.1	-68.4	172.2	0	0	0	110.7
656	P	36.5	Very low	31.5	Very low	98 Å²	98	136.4 Å²	136.4	64%	0.636	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-55.4	143.3	160.7	-22.8	34.4	0	0	0	110.9	D658	P656-D658 PolarHBondContact O-N 3.12Å
657	A	37.8	Very low	31.6	Very low	95 Å²	95	137.7 Å²	137.7	79%	0.785	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-6.5	-161.5	0	0	0	0	0	116.5
658	D	42.5	Very low	31.6	Very low	146 Å²	146	137.7 Å²	137.7	78%	0.781	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-8.1	-168.5	-59.1	-44.9	0	0	0	115	P656	P656-D658 PolarHBondContact O-N 3.12Å
659	W	42.8	Very low	32	Very low	218 Å²	218	136.8 Å²	136.8	83%	0.826	79%	0.79	S	S	*	*			trans	-100.7	28.8	-171.8	-75.2	5.7	0	0	0	114.9
660	A	36.1	Very low	31.8	Very low	88 Å²	88	139.7 Å²	139.7	73%	0.727	79%	0.793	S	S	*	*			trans	-107.3	23.5	-173.6	0	0	0	0	0	115.5
661	R	36.4	Very low	31.8	Very low	224 Å²	224	137.2 Å²	137.2	85%	0.845	79%	0.794	S	S	*	*	S	Bend	trans	-137.6	132.9	174.3	-71	-170.1	173.3	177.4	-1.2	113.5
662	H	35.2	Very low	31.7	Very low	191 Å²	191	131.8 Å²	131.8	88%	0.884	79%	0.788	S	S	*	*	S	Bend	trans	73.6	126.1	-175.6	-52	-73.4	0	0	0	114.6
663	G	30.1	Very low	32	Very low	75 Å²	75	134.5 Å²	134.5	77%	0.773	80%	0.803	S	S	*	*			trans	-98.5	-170.4	-157.8	0	0	0	0	0	116.5
664	A	28.8	Very low	32.2	Very low	104 Å²	104	131.5 Å²	131.5	86%	0.86	80%	0.8	S	S	*	*			trans	-59.8	142.8	-168	0	0	0	0	0	115.4
665	I	28.7	Very low	32	Very low	163 Å²	163	130.1 Å²	130.1	84%	0.836	80%	0.802	S	S	*	*			trans	-94.9	114.8	169.5	-60.3	170.7	0	0	0	108.1
666	T	26	Very low	31.8	Very low	125 Å²	125	131.7 Å²	131.7	77%	0.767	81%	0.809	S	S	*	*			trans	-89.5	132.9	167.3	35.7	0	0	0	0	110.8
667	L	24.6	Very low	31.2	Very low	177 Å²	177	131.3 Å²	131.3	93%	0.927	81%	0.814	S	S	*	*			trans	-83.2	126.8	173.3	-86.7	160	0	0	0	110.2
668	V	25	Very low	30.7	Very low	120 Å²	120	132.4 Å²	132.4	73%	0.727	81%	0.811	S	S	*	*			trans	-125.5	124.1	168.7	179.8	0	0	0	0	108.6
669	S	29	Very low	30	Very low	109 Å²	109	132.2 Å²	132.2	76%	0.762	81%	0.808	S	S	*	*			trans	-104.4	118.3	-177	53.3	0	0	0	0	111.7
670	H	27.6	Very low	29.1	Very low	179 Å²	179	129.5 Å²	129.5	83%	0.829	80%	0.804	S	S	*	*			trans	-135.2	134	163.2	-81.3	-74.9	0	0	0	111.6
671	G	28.7	Very low	28.9	Very low	83 Å²	83	130.7 Å²	130.7	86%	0.856	80%	0.803	S	S	*	*			trans	-86.4	153.5	167.6	0	0	0	0	0	111.5
672	G	27.5	Very low	28.4	Very low	74 Å²	74	128.5 Å²	128.5	76%	0.763	80%	0.802	S	S	*	*			trans	145.1	134.6	-179.7	0	0	0	0	0	111	G674	G672-G674 PolarHBondContact O-N 2.97Å
673	V	35.7	Very low	28.3	Very low	158 Å²	158	125.4 Å²	125.4	96%	0.958	80%	0.796	S	S	*	*	S	Bend	trans	-96.7	103.5	-167.8	-176.7	0	0	0	0	112.3
674	G	33.9	Very low	28.3	Very low	75 Å²	75	127 Å²	127	77%	0.773	79%	0.793	S	S	*	*			trans	96.1	64.1	145.4	0	0	0	0	0	117.8	G672	G672-G674 PolarHBondContact O-N 2.97Å
675	A	26.1	Very low	28.2	Very low	104 Å²	104	128.4 Å²	128.4	86%	0.86	79%	0.794	S	S	*	*			trans	-95.6	143.6	155.6	0	0	0	0	0	110.5
676	I	29.8	Very low	28.5	Very low	160 Å²	160	124.3 Å²	124.3	82%	0.821	79%	0.791	S	S	*	*			trans	-104.4	108.1	167.6	-61.9	175	0	0	0	106.8
677	A	24.1	Very low	28.7	Very low	89 Å²	89	124.4 Å²	124.4	74%	0.736	79%	0.792	S	S	*	*			trans	-68.7	130.1	171.8	0	0	0	0	0	110
678	V	26.6	Very low	29	Very low	119 Å²	119	124.1 Å²	124.1	72%	0.721	79%	0.786	S	S	*	*			trans	-102.5	113.4	165.8	178	0	0	0	0	106.3	H680	V678-H680 PolarHBondContact O-N 2.78Å
679	I	28.3	Very low	29.2	Very low	142 Å²	142	126 Å²	126	73%	0.728	79%	0.79	S	S	*	*			trans	-84.2	111.7	176.2	-52.4	178.4	0	0	0	107.6	T681	I679-T681 HydrophobicContact CG2-CG2 3.82Å
680	H	23.3	Very low	29.2	Very low	160 Å²	160	128.5 Å²	128.5	74%	0.741	79%	0.79	S	S	*	*			trans	-81.6	130.1	156.2	-94.9	-122.3	0	0	0	108.1	V678	V678-H680 PolarHBondContact O-N 2.78Å
681	T	31.7	Very low	29.2	Very low	113 Å²	113	126 Å²	126	69%	0.693	79%	0.79	S	S	*	*			trans	-118.2	99.7	166.7	53.7	0	0	0	0	108.2	I679	I679-T681 HydrophobicContact CG2-CG2 3.82Å
682	E	25.9	Very low	29.1	Very low	178 Å²	178	130.3 Å²	130.3	83%	0.832	79%	0.791	S	S	*	*			trans	-77.4	135	162.5	-63.2	-168	170.9	0	0	108.4
683	V	32.9	Very low	29	Very low	126 Å²	126	130.3 Å²	130.3	76%	0.764	79%	0.791	S	S	*	*			trans	-107.7	120.9	176.6	179.7	0	0	0	0	107
684	P	30.3	Very low	28.7	Very low	108 Å²	108	129.4 Å²	129.4	70%	0.701	79%	0.786	S	S	*	*			trans	-66.8	138.3	179.9	26.6	-33.2	0	0	0	110.6	G686	P684-G686 PolarHBondContact O-N 2.99Å
685	P	26.4	Very low	28.3	Very low	135 Å²	135	131.3 Å²	131.3	88%	0.877	79%	0.788	S	S	*	*	S	Bend	trans	-76.5	117	-177.5	29.8	-33.6	0	0	0	110.9
686	G	36.2	Very low	28.2	Very low	76 Å²	76	130.9 Å²	130.9	78%	0.784	78%	0.784	S	S	*	*			trans	168.8	13.7	176.6	0	0	0	0	0	120	P684	P684-G686 PolarHBondContact O-N 2.99Å
687	T	29.8	Very low	27.9	Very low	127 Å²	127	131 Å²	131	78%	0.779	79%	0.785	S	S	*	*			trans	-131.6	109.3	-175	-46.2	0	0	0	0	112.7	I689	T687-I689 HydrophobicContact CG2-CG1 4.45Å
688	Q	30.1	Very low	28	Very low	172 Å²	172	132 Å²	132	80%	0.804	78%	0.782	S	S	*	*			trans	-89.1	143.3	164	-64.4	-175.5	11.9	0	0	110.4
689	I	29.7	Very low	27.9	Very low	160 Å²	160	134.3 Å²	134.3	82%	0.821	79%	0.789	S	S	*	*			trans	-137.9	129.8	158.7	-57.3	-178.4	0	0	0	107.2	T687	T687-I689 HydrophobicContact CG2-CG1 4.45Å
690	Q	28.3	Very low	27.9	Very low	160 Å²	160	133.7 Å²	133.7	75%	0.748	79%	0.787	S	S	*	*			trans	-90.3	153.9	179.9	-68.2	-173.7	0.4	0	0	112
691	P	27.5	Very low	28	Very low	127 Å²	127	129.4 Å²	129.4	83%	0.825	79%	0.787	S	S	*	*			trans	-81.4	146.1	176.7	33.4	-34.6	0	0	0	112.4
692	I	27	Very low	27.8	Very low	174 Å²	174	129.3 Å²	129.3	89%	0.892	79%	0.79	S	S	*	*			trans	-118.4	141	165.6	-64.6	179.2	0	0	0	108
693	G	25.5	Very low	27.8	Very low	74 Å²	74	124.8 Å²	124.8	76%	0.763	78%	0.783	S	S	*	*			trans	-91.7	-167.6	-162	0	0	0	0	0	117.3
694	T	29	Very low	27.4	Very low	139 Å²	139	126.5 Å²	126.5	85%	0.853	79%	0.786	S	S	*	*			trans	-105.7	148.1	-168.5	51.2	0	0	0	0	114.5
695	S	25.4	Very low	27	Very low	115 Å²	115	125.6 Å²	125.6	80%	0.804	79%	0.788	S	S	*	*			trans	-130	125.6	159.3	-62.4	0	0	0	0	107
696	A	23.5	Very low	27.3	Very low	94 Å²	94	124.7 Å²	124.7	78%	0.777	78%	0.78	S	S	*	*				67.9	142	74.4	0	0	0	0	0	112.2
697	I	24.1	Very low	27.3	Very low	163 Å²	163	126.8 Å²	126.8	84%	0.836	78%	0.78	S	S	*	*			cis	-137.4	166.8	31.4	-71	170.4	0	0	0	112.3
698	T	25.8	Very low	27.1	Very low	111 Å²	111	129.7 Å²	129.7	68%	0.681	78%	0.782	S	S	*	*			trans	-90.4	168.7	-174.4	48.3	0	0	0	0	115.9
699	L	25.4	Very low	26.9	Very low	167 Å²	167	125.7 Å²	125.7	87%	0.874	77%	0.773	S	S	*	*			trans	-168.3	138.6	136.4	-91.6	178.1	0	0	0	107.3
700	D	27.2	Very low	27.1	Very low	129 Å²	129	125.5 Å²	125.5	69%	0.69	77%	0.772	S	S	*	*			cis	-159.4	-169.8	-33.3	-147.1	84.6	0	0	0	109.4
701	G	26.5	Very low	27.3	Very low	70 Å²	70	123.9 Å²	123.9	72%	0.722	78%	0.775	S	S	*	*			trans	121.6	70.9	168.6	0	0	0	0	0	115.9
702	S	27.4	Very low	27.3	Very low	110 Å²	110	123.9 Å²	123.9	77%	0.769	77%	0.772	S	S	*	*			trans	-63.3	161.1	178	-56.5	0	0	0	0	113.8
703	A	24.9	Very low	27.1	Very low	83 Å²	83	121.4 Å²	121.4	69%	0.686	77%	0.771	S	S	*	*			cis	-153.1	138.3	13.4	0	0	0	0	0	111.5
704	I	24.7	Very low	27.2	Very low	162 Å²	162	124.6 Å²	124.6	83%	0.831	78%	0.775	S	S	*	*				74.8	131.7	96.4	-65.6	176.6	0	0	0	115.3
705	A	22.1	Very low	27	Very low	90 Å²	90	122.5 Å²	122.5	74%	0.744	77%	0.772	S	S	*	*			cis	-166.5	167.7	-17.2	0	0	0	0	0	112.5
706	V	33.2	Very low	27	Very low	116 Å²	116	126 Å²	126	70%	0.703	78%	0.776	S	S	*	*			trans	-82.8	167	164.6	-147.1	0	0	0	0	110.2
707	P	35.4	Very low	27	Very low	119 Å²	119	128.3 Å²	128.3	77%	0.773	78%	0.78	S	S	*	*				-151.7	169.6	104.3	33	-13.7	0	0	0	115.6
708	F	25.8	Very low	27.1	Very low	189 Å²	189	128.5 Å²	128.5	83%	0.829	78%	0.782	S	S	*	*			cis	-162.2	176.8	-37.4	-140.6	-95.5	0	0	0	108
709	S	26.8	Very low	27.1	Very low	87 Å²	87	128.5 Å²	128.5	61%	0.608	79%	0.787	S	S	*	*			trans	-124.7	155.2	-176.6	-55.5	0	0	0	0	113.2
710	I	32.5	Very low	27.2	Very low	157 Å²	157	125.5 Å²	125.5	81%	0.805	78%	0.779	S	S	*	*			trans	72.2	133.5	152.1	-72.6	162.2	0	0	0	114.3
711	P	34	Very low	27	Very low	125 Å²	125	128.5 Å²	128.5	81%	0.812	79%	0.789	S	S	*	*				-148.1	170.4	79.2	39.6	-19.1	0	0	0	119.1
712	V	26	Very low	27.1	Very low	127 Å²	127	129.5 Å²	129.5	77%	0.77	79%	0.791	S	S	*	*			trans	-94.4	147.3	169.9	170.3	0	0	0	0	109.9
713	S	24.9	Very low	27.7	Very low	123 Å²	123	129.5 Å²	129.5	86%	0.86	79%	0.788	S	S	*	*			trans	-161	164.3	149.7	-88.8	0	0	0	0	113.1
714	V	26.7	Very low	27.8	Very low	141 Å²	141	131 Å²	131	86%	0.855	79%	0.794	S	S	*	*			trans	-110.4	145.4	-176.7	173.9	0	0	0	0	109.9
715	A	24.1	Very low	27.8	Very low	95 Å²	95	126.8 Å²	126.8	79%	0.785	79%	0.79	S	S	*	*			trans	-147.1	147	163	0	0	0	0	0	112
716	Q	26	Very low	28	Very low	188 Å²	188	127.6 Å²	127.6	88%	0.879	79%	0.79	S	S	*	*			trans	-113.5	145.6	157.4	-63.8	175.8	-63.7	0	0	107.5
717	T	23.1	Very low	27.6	Very low	143 Å²	143	130.1 Å²	130.1	88%	0.877	80%	0.799	S	S	*	*			trans	-156.9	160.2	153.6	23.2	0	0	0	0	110.2
718	L	26.1	Very low	27.1	Very low	167 Å²	167	129.5 Å²	129.5	87%	0.874	80%	0.798	S	S	*	*			trans	-94.8	179.6	167.8	-81.6	161.9	0	0	0	110.6
719	S	26.3	Very low	27.2	Very low	111 Å²	111	126.6 Å²	126.6	78%	0.776	80%	0.795	S	S	*	*			trans	-38.2	161.1	178.5	-40.1	0	0	0	0	116.1
720	S	27.1	Very low	27.5	Very low	103 Å²	103	128.4 Å²	128.4	72%	0.72	81%	0.805	S	S	*	*			cis	-166	179.5	37.2	50.2	0	0	0	0	114.9
721	E	24.5	Very low	27.1	Very low	192 Å²	192	126.8 Å²	126.8	90%	0.897	80%	0.802	S	S	*	*			trans	82	167.1	162.8	-55.5	-163.5	116.7	0	0	119.7
722	A	26.8	Very low	26.6	Very low	91 Å²	91	128.2 Å²	128.2	75%	0.752	80%	0.802	S	S	*	*			trans	-139.6	-168.6	-160.9	0	0	0	0	0	108.6
723	P	39.9	Very low	26.5	Very low	110 Å²	110	126.7 Å²	126.7	71%	0.714	80%	0.798	S	S	*	*			cis	-145.4	-179.8	10.8	43.1	-22.5	0	0	0	118.8
724	S	27.6	Very low	26.5	Very low	116 Å²	116	127.1 Å²	127.1	81%	0.811	79%	0.794	S	S	*	*			trans	75.8	140.4	143	68.2	0	0	0	0	122.9
725	G	25.7	Very low	27.2	Very low	73 Å²	73	125.6 Å²	125.6	75%	0.753	79%	0.788	S	S	*	*			trans	102.6	150.6	159.4	0	0	0	0	0	117.2
726	S	25.1	Very low	27.4	Very low	106 Å²	106	127.4 Å²	127.4	74%	0.741	79%	0.789	S	S	*	*				-175.3	137.7	-71.4	50.7	0	0	0	0	111.2
727	L	24.9	Very low	27.5	Very low	169 Å²	169	123.3 Å²	123.3	89%	0.885	78%	0.781	S	S	*	*			trans	65.9	160.8	167.6	-58.1	169.3	0	0	0	115.1
728	S	24.6	Very low	27.8	Very low	107 Å²	107	125.7 Å²	125.7	75%	0.748	78%	0.782	S	S	*	*			cis	-161	163.7	-12.3	34.8	0	0	0	0	110.5
729	V	28.7	Very low	28	Very low	127 Å²	127	123.3 Å²	123.3	77%	0.77	77%	0.774	S	S	*	*			trans	-82.7	160.6	172.1	-146.2	0	0	0	0	111.2
730	P	33.6	Very low	28.2	Very low	125 Å²	125	124.9 Å²	124.9	81%	0.812	77%	0.773	S	S	*	*				-147.3	177.3	104.3	39	-22.7	0	0	0	116.5
731	T	23.3	Very low	28.3	Very low	124 Å²	124	127 Å²	127	76%	0.761	78%	0.776	S	S	*	*			trans	-105.1	163.9	-172.6	-35.4	0	0	0	0	112.3
732	L	24.3	Very low	28.4	Very low	154 Å²	154	121.6 Å²	121.6	81%	0.806	76%	0.764	S	S	*	*				164.7	145.5	125.7	-87.8	162.4	0	0	0	116.8
733	S	23.7	Very low	28.7	Very low	96 Å²	96	122.2 Å²	122.2	67%	0.671	76%	0.763	S	S	*	*			trans	59	135.1	149.9	-56.7	0	0	0	0	122.5
734	V	24.3	Very low	27.9	Very low	131 Å²	131	124.5 Å²	124.5	79%	0.794	77%	0.769	S	S	*	*			cis	79.9	135.6	39.9	172.8	0	0	0	0	111.7
735	P	40.7	Very low	28	Very low	110 Å²	110	125.8 Å²	125.8	71%	0.714	77%	0.765	S	S	*	*			cis	-143.7	169.4	31.1	27	-0.1	0	0	0	121
736	V	29.4	Very low	28.2	Very low	133 Å²	133	127.6 Å²	127.6	81%	0.806	77%	0.767	S	S	*	*				43	150.6	130	179.4	0	0	0	0	122.3
737	S	28.3	Very low	28.6	Very low	102 Å²	102	127.7 Å²	127.7	71%	0.713	76%	0.763	S	S	*	*			cis	175.8	158.6	-28.1	-75.3	0	0	0	0	109.1
738	E	28.1	Very low	29	Very low	192 Å²	192	125.1 Å²	125.1	90%	0.897	75%	0.754	S	S	*	*			trans	-157	-178.5	147.3	-130.2	173.9	-171.1	0	0	113.5
739	T	32.1	Very low	29.4	Very low	117 Å²	117	124.7 Å²	124.7	72%	0.718	75%	0.751	S	S	*	*			trans	-132.8	175.6	-151.1	42.7	0	0	0	0	112.9
740	L	29.8	Very low	29.6	Very low	145 Å²	145	125.6 Å²	125.6	76%	0.759	75%	0.751	S	S	*	*			cis	-165.4	162.9	-6	-110.9	162.6	0	0	0	105
741	L	28.5	Very low	29.6	Very low	147 Å²	147	127.1 Å²	127.1	77%	0.77	75%	0.751	S	S	*	*			cis	-114.1	-165.2	1.8	-77.5	152.3	0	0	0	109
742	A	27.6	Very low	29.7	Very low	79 Å²	79	130.7 Å²	130.7	65%	0.653	76%	0.759	S	S	*	*			cis	72.7	140.5	20.6	0	0	0	0	0	116.1
743	S	33.1	Very low	30	Very low	103 Å²	103	127.6 Å²	127.6	72%	0.72	76%	0.756	S	S	*	*			cis	-142	168.7	-10.3	-47.7	0	0	0	0	108.4
744	D	23.2	Very low	30.5	Very low	158 Å²	158	128.2 Å²	128.2	85%	0.845	77%	0.767	S	S	*	*			cis	-125.4	156.7	15.2	-74.6	-50.4	0	0	0	113.9
745	I	29.3	Very low	30.5	Very low	143 Å²	143	127 Å²	127	73%	0.733	77%	0.771	S	S	*	*			trans	-140.1	128.9	-175.3	-70.8	178.4	0	0	0	105.7	T747	I745-T747 WeakPolarHBondContact CG2-OG1 3.44Å
746	S	30.8	Very low	30.3	Very low	112 Å²	112	126.6 Å²	126.6	78%	0.783	78%	0.777	S	S	*	*				60.7	174.9	87.2	-124.1	0	0	0	0	113.2
747	T	32.2	Very low	30.4	Very low	107 Å²	107	129.7 Å²	129.7	66%	0.656	78%	0.782	S	S	*	*			cis	-156.5	176.6	21	-19.8	0	0	0	0	112.2	I745	I745-T747 WeakPolarHBondContact CG2-OG1 3.44Å
748	T	33.8	Very low	30.4	Very low	116 Å²	116	128.6 Å²	128.6	71%	0.712	78%	0.78	S	S	*	*			trans	-53.8	164.1	170	54.2	0	0	0	0	118.1
749	S	31.9	Very low	30.4	Very low	98 Å²	98	125.4 Å²	125.4	69%	0.685	77%	0.773	S	S	*	*				26	133.7	125.2	-140.2	0	0	0	0	118.8
750	L	32.9	Very low	30.1	Very low	146 Å²	146	127.7 Å²	127.7	76%	0.764	78%	0.78	S	S	*	*				-162	166.8	60.4	-89.9	168.2	0	0	0	114.5
751	L	34.9	Very low	30.2	Very low	156 Å²	156	125.2 Å²	125.2	82%	0.817	78%	0.781	S	S	*	*			trans	16.3	138.7	147.8	-64.1	166.1	0	0	0	122.4
752	E	25.2	Very low	30.6	Very low	199 Å²	199	124 Å²	124	93%	0.93	78%	0.781	S	S	*	*				-151.8	176.3	127.1	-138.8	176.6	-151.5	0	0	111.6
753	A	30.8	Very low	31.3	Very low	90 Å²	90	125.5 Å²	125.5	74%	0.744	79%	0.785	S	S	*	*			trans	-148	148.2	-165.5	0	0	0	0	0	116.8
754	A	34	Very low	31.1	Very low	108 Å²	108	125.5 Å²	125.5	89%	0.893	78%	0.784	S	S	*	*			trans	57.2	123.9	152.8	0	0	0	0	0	121.4
755	A	23.9	Very low	31.2	Very low	107 Å²	107	125.2 Å²	125.2	88%	0.884	78%	0.778	S	S	*	*			trans	-149.2	140.3	153.3	0	0	0	0	0	110.7
756	A	37.2	Very low	31.1	Very low	101 Å²	101	125.2 Å²	125.2	84%	0.835	78%	0.78	S	S	*	*			trans	-161.3	125.4	173.1	0	0	0	0	0	111.7
757	Q	31.6	Very low	30.7	Very low	197 Å²	197	127 Å²	127	92%	0.921	78%	0.781	S	S	*	*			trans	-164.3	159.3	171	-92	175	23.7	0	0	108.3
758	A	28.1	Very low	31.7	Very low	79 Å²	79	126.4 Å²	126.4	65%	0.653	78%	0.778	S	S	*	*			cis	-173.4	-175.2	-25.5	0	0	0	0	0	110.3
759	V	27.9	Very low	31.3	Very low	126 Å²	126	127.4 Å²	127.4	76%	0.764	79%	0.785	S	S	*	*			trans	70	110.8	156.6	-136.1	0	0	0	0	120
760	L	24.9	Very low	31.2	Very low	164 Å²	164	127 Å²	127	86%	0.859	78%	0.781	S	S	*	*				170.4	141	104.4	-92.7	172.2	0	0	0	113.1
761	A	33.3	Very low	31	Very low	94 Å²	94	128.5 Å²	128.5	78%	0.777	78%	0.784	S	S	*	*			trans	-159.9	138.6	165.5	0	0	0	0	0	110.2
762	P	36.8	Very low	30.6	Very low	120 Å²	120	126.2 Å²	126.2	78%	0.779	78%	0.782	S	S	*	*			trans	-138.6	-167.6	151.3	45.7	-30.6	0	0	0	110.7
763	P	42.6	Very low	30.8	Very low	112 Å²	112	122.1 Å²	122.1	73%	0.727	77%	0.766	S	S	*	*				-136.5	-173.1	-97.3	38.9	-17.5	0	0	0	115.9
764	S	27.6	Very low	30.6	Very low	102 Å²	102	126.6 Å²	126.6	71%	0.713	77%	0.769	S	S	*	*			trans	67.1	158.7	161.9	91.9	0	0	0	0	117.7
765	E	26.3	Very low	30.3	Very low	153 Å²	153	128.8 Å²	128.8	72%	0.715	76%	0.763	S	S	*	*			cis	-159.6	167.3	-1.3	-143.6	167.9	-101	0	0	113.1
766	N	25.7	Very low	30.5	Very low	142 Å²	142	131.5 Å²	131.5	76%	0.759	76%	0.757	S	S	*	*			trans	75.6	166	158.1	-61.6	-45.7	0	0	0	121.5
767	N	23.9	Very low	31	Very low	151 Å²	151	131.4 Å²	131.4	81%	0.807	75%	0.748	S	S	*	*			trans	-156.4	-172.2	-155.6	-168.9	39.1	0	0	0	108.2
768	P	53.3	Low	30.6	Very low	94 Å²	94	129.4 Å²	129.4	61%	0.61	74%	0.743	S	S	*	*				-105.5	177.6	-56	35.5	-23.4	0	0	0	113.1
769	T	25.3	Very low	30.8	Very low	137 Å²	137	132.5 Å²	132.5	84%	0.84	75%	0.747	S	S	*	*			trans	170.5	161.8	148.8	22.5	0	0	0	0	108.9
770	S	29.6	Very low	30.7	Very low	88 Å²	88	135.5 Å²	135.5	62%	0.615	75%	0.753	S	S	*	*			cis	-178	142.2	-49.8	48.9	0	0	0	0	108
771	E	28	Very low	30.9	Very low	178 Å²	178	133 Å²	133	83%	0.832	75%	0.745	S	S	*	*			trans	68.9	122.3	167.8	-55.9	-175.9	147.6	0	0	116.1
772	S	26.9	Very low	30.5	Very low	109 Å²	109	134.7 Å²	134.7	76%	0.762	75%	0.745	S	S	*	*				89.1	154.7	93.5	85.4	0	0	0	0	112.4
773	D	28.4	Very low	30	Very low	112 Å²	112	136.2 Å²	136.2	60%	0.599	75%	0.745	S	S	*	*			cis	-155.9	169.5	8.8	-157.8	-2.4	0	0	0	112.6
774	K	27.7	Very low	29.3	Very low	184 Å²	184	137.2 Å²	137.2	80%	0.8	75%	0.749	S	S	*	*			trans	66	152.4	154.7	-82.5	147.9	-169.2	142.1	0	123.4
775	M	26.3	Very low	29.3	Very low	155 Å²	155	135.5 Å²	135.5	76%	0.764	75%	0.748	S	S	*	*			trans	-110.7	157.5	-158.7	-69.6	169.1	55.9	0	0	114.2
776	H	28.7	Very low	29.5	Very low	164 Å²	164	138 Å²	138	76%	0.759	76%	0.759	S	S	*	*			trans	63.5	174.1	143.6	-85.4	-113.5	0	0	0	117.4
777	P	47.2	Very low	29.6	Very low	99 Å²	99	134.4 Å²	134.4	64%	0.643	76%	0.755	S	S	*	*				-128.9	-172.9	-69.8	38.8	-21.6	0	0	0	111.3
778	D	25	Very low	29.9	Very low	155 Å²	155	135.9 Å²	135.9	83%	0.829	76%	0.762	S	S	*	*				-167.1	153.3	129.7	-108.4	-29.6	0	0	0	113.7
779	I	31.8	Very low	28.8	Very low	144 Å²	144	140.4 Å²	140.4	74%	0.738	78%	0.775	S	S	*	*			trans	-144	114.2	174.2	-59.7	177.1	0	0	0	108.9	T781	I779-T781 HydrophobicContact CG2-CG2 4.01Å
780	E	26.1	Very low	28.9	Very low	188 Å²	188	137.3 Å²	137.3	88%	0.879	77%	0.77	S	S	*	*			trans	-108.7	112	161.7	-71.4	-158.4	130.2	0	0	110.9
781	T	27.3	Very low	29.1	Very low	112 Å²	112	142.6 Å²	142.6	69%	0.687	78%	0.782	S	S	*	*			trans	-108.2	98.3	167.7	50.6	0	0	0	0	109.4	I779 I783	I779-T781 HydrophobicContact CG2-CG2 4.01Å; T781-I783 PolarHBondContact O-N 3.39Å
782	V	25.4	Very low	29.1	Very low	129 Å²	129	143.1 Å²	143.1	78%	0.782	79%	0.785	S	S	*	*			trans	-63.8	121.5	175.3	179	0	0	0	0	110	V784	V782-V784 HydrophobicContact CG1-CG2 4.45Å
783	I	27	Very low	29.4	Very low	152 Å²	152	146.4 Å²	146.4	78%	0.779	79%	0.788	S	S	*	*			trans	-91.4	132.1	172.7	-61.3	171.9	0	0	0	108	T781	T781-I783 PolarHBondContact O-N 3.39Å
784	V	28.1	Very low	29.5	Very low	133 Å²	133	147.8 Å²	147.8	81%	0.806	79%	0.791	S	S	*	*			trans	-116.2	117.8	167.3	-179.4	0	0	0	0	107.7	V782	V782-V784 HydrophobicContact CG1-CG2 4.45Å
785	G	27.9	Very low	29.6	Very low	67 Å²	67	146.2 Å²	146.2	69%	0.691	79%	0.786	S	S	*	*			trans	-111.7	140.1	174	0	0	0	0	0	110.9
786	E	29	Very low	29.8	Very low	206 Å²	206	145.2 Å²	145.2	96%	0.963	78%	0.783	S	S	*	*			trans	-82.7	132.1	174.4	-62.4	176.4	136.4	0	0	110.1
787	G	27.8	Very low	29.9	Very low	65 Å²	65	144.6 Å²	144.6	67%	0.67	79%	0.785	S	S	*	*			trans	-117.2	114.4	-179.4	0	0	0	0	0	112.7
788	L	31.8	Very low	29.1	Very low	183 Å²	183	146.1 Å²	146.1	96%	0.958	79%	0.787	S	S	*	*			trans	-89.9	128.2	167.7	-71.9	171.8	0	0	0	109.9
789	H	28.8	Very low	29.4	Very low	188 Å²	188	145.5 Å²	145.5	87%	0.87	78%	0.784	S	S	*	*			trans	-88.1	134.2	179.1	-83.1	64.2	0	0	0	112.4
790	G	28.3	Very low	29.3	Very low	73 Å²	73	141.3 Å²	141.3	75%	0.753	78%	0.776	S	S	*	*			trans	-113.5	159.3	155.6	0	0	0	0	0	109.7
791	K	33.4	Very low	29.7	Very low	199 Å²	199	141.2 Å²	141.2	87%	0.865	78%	0.776	S	S	*	*			trans	-118.7	138	-174.9	-64.2	-179.2	178	-176.8	0	112.2
792	E	29	Very low	29.8	Very low	189 Å²	189	141.9 Å²	141.9	88%	0.883	78%	0.775	S	S	*	*			trans	-179.5	122.3	152	-97.2	145.3	-162.1	0	0	103.7
793	Q	31.7	Very low	30.3	Very low	178 Å²	178	144 Å²	144	83%	0.832	77%	0.774	S	S	*	*				52.6	125.4	64.2	-104.1	178.9	-49.7	0	0	111.8
794	E	30.1	Very low	30.5	Very low	140 Å²	140	142.4 Å²	142.4	65%	0.654	77%	0.771	S	S	*	*			cis	-145.9	173.9	28.3	-62.6	-168.2	79.7	0	0	115.1
795	Q	30.9	Very low	30.7	Very low	152 Å²	152	139.5 Å²	139.5	71%	0.71	76%	0.761	S	S	*	*			trans	24.7	150.7	136.2	-60.7	-178.4	62.6	0	0	121.2
796	L	31.3	Very low	30.9	Very low	134 Å²	134	142.9 Å²	142.9	70%	0.702	76%	0.764	S	S	*	*			cis	-171.8	179.8	-7.2	-110.6	173.9	0	0	0	108
797	L	31.1	Very low	31.2	Very low	151 Å²	151	141.2 Å²	141.2	79%	0.791	76%	0.756	S	S	*	*			trans	71.5	155	165.8	-55.7	-172.6	0	0	0	117.5
798	D	29.9	Very low	31.5	Very low	130 Å²	130	142.4 Å²	142.4	70%	0.695	76%	0.759	S	S	*	*			cis	-164.1	161.2	-36.9	-152.2	-11.2	0	0	0	108.6
799	D	30.4	Very low	31.5	Very low	143 Å²	143	141.4 Å²	141.4	77%	0.765	75%	0.75	S	S	*	*			trans	53.1	158.8	171.1	-86.8	-46.7	0	0	0	118.6
800	G	30.8	Very low	31.8	Very low	55 Å²	55	137.5 Å²	137.5	57%	0.567	74%	0.74	S	S	*	*			cis	154.3	129.5	-7.3	0	0	0	0	0	112.5
801	Q	33.6	Very low	32	Very low	187 Å²	187	139.2 Å²	139.2	87%	0.874	74%	0.735	S	S	*	*			trans	68.9	163.9	161.3	-55.7	-176.3	39.2	0	0	118.5
802	N	29.8	Very low	32.2	Very low	125 Å²	125	137.9 Å²	137.9	67%	0.668	73%	0.73	S	S	*	*			cis	-172.4	159.6	-41.9	-159.3	-10.4	0	0	0	108.7
803	K	35.5	Very low	32.4	Very low	173 Å²	173	133.8 Å²	133.8	75%	0.752	71%	0.714	S	S	*	*			trans	66.6	160	164.9	-57.4	171.2	-174.9	174.8	0	116.1
804	T	30.3	Very low	32.8	Very low	119 Å²	119	132.8 Å²	132.8	73%	0.73	71%	0.709	S	S	*	*			cis	-152.9	155.9	-18.5	17	0	0	0	0	106.6
805	A	34.3	Very low	32.9	Very low	72 Å²	72	130.2 Å²	130.2	60%	0.595	71%	0.707	S	S	*	*				47.3	135.2	93.1	0	0	0	0	0	114.4
806	D	31	Very low	33.1	Very low	138 Å²	138	128.2 Å²	128.2	74%	0.738	71%	0.709	S	S	*	*			cis	-153.9	173.7	29	-95.9	-54.6	0	0	0	115
807	E	34.8	Very low	33.6	Very low	171 Å²	171	132 Å²	132	80%	0.799	74%	0.737	S	S	*	*			trans	48.3	121.6	145.1	-69.6	173.2	161.4	0	0	120.6
808	A	34.8	Very low	33.7	Very low	90 Å²	90	131 Å²	131	74%	0.744	74%	0.735	S	S	*	*				75.4	153	83.6	0	0	0	0	0	113.1
809	E	32.8	Very low	33.9	Very low	162 Å²	162	131.1 Å²	131.1	76%	0.757	74%	0.737	S	S	*	*			cis	-159	150.7	34.2	-108.1	-156.4	122.2	0	0	112.2
810	T	33.7	Very low	34.1	Very low	107 Å²	107	130.4 Å²	130.4	66%	0.656	74%	0.735	S	S	*	*			trans	62.3	159.3	143.2	70.1	0	0	0	0	120.8
811	T	33.7	Very low	34.3	Very low	108 Å²	108	134.8 Å²	134.8	66%	0.663	75%	0.745	S	S	*	*			cis	-161.8	151.1	-20.5	25.7	0	0	0	0	109.9
812	K	36.3	Very low	34.3	Very low	172 Å²	172	131.6 Å²	131.6	75%	0.748	74%	0.737	S	S	*	*			trans	68	159.8	142.6	-75.7	174.6	164.2	-166.7	0	118.7
813	D	34.4	Very low	34.6	Very low	103 Å²	103	132 Å²	132	55%	0.551	74%	0.741	S	S	*	*			cis	-144.3	166.5	-0.9	-126.5	-29.9	0	0	0	113
814	Q	38.6	Very low	34.6	Very low	157 Å²	157	129.1 Å²	129.1	73%	0.734	74%	0.741	S	S	*	*			trans	10.2	153	143.7	-72	166.4	74.8	0	0	121.5
815	S	33.3	Very low	34.9	Very low	86 Å²	86	129.8 Å²	129.8	60%	0.601	74%	0.742	S	S	*	*			cis	-179.9	166.3	-9	53.5	0	0	0	0	110.2
816	S	34.4	Very low	34.9	Very low	110 Å²	110	134.7 Å²	134.7	77%	0.769	75%	0.754	S	S	*	*			trans	63.7	149.2	158	68.5	0	0	0	0	118.5
817	V	41.8	Very low	35.3	Very low	212 Å²	212	134.4 Å²	134.4	100%	1.285	76%	0.755	S	S	*	*			cis	-119.7	0	1.2	174.6	0	0	0	0	109.3

Retrieved 817 of 817 residues in 1138.6 ms (Link to these results)

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