PEX6_CRIGR Loading...

Peroxisomal ATPase PEX6

Component of the PEX1-PEX6 AAA ATPase complex, a protein dislocase complex that mediates the ATP-dependent extraction of the PEX5 receptor from peroxisomal membranes, an essential step for PEX5 recycling^1,2. Specifically recognizes PEX5 monoubiquitinated at 'Cys-11', and pulls it out of the peroxisome lumen through the PEX2-PEX10-PEX12 retrotranslocation channel (By similarity). Extraction by the PEX1-PEX6 AAA ATPase complex is accompanied by unfolding of the TPR repeats and release of bound cargo from PEX5 (By similarity).

AlphaFold DB , UniProt , Accession A0A061IR73, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene PEX6, Length 980 aa.

						>PEX6_CRIGR|A0A061IR73|PEX6
MALAVLRVLDPFPAETPPLAVLLPPGGPWPATGLGLVLALRPASESPAGPALLVAALEGPGSQNGQRGPGPPQLLVSRALLRLLALGPGARVRARPVRRPPALGWALLGSAPGPGPGPRVGPLLVRRGESLPVPGSRVLETRPALQGLLGPGTRLAVTELRGRAKLGPESTQHSRLPPPPVASSFAVSHAVRQLKGVLGGTGDALGVTRSCLRGLGLFQGEWVWVARVGEFPNTSQPHLAKVQLLEPRWDLSERLGPSSGQLGEPLADGLVFVPATLAFNLGCDPLEVGELRIQRYLEGSIIPEDRGSCSLMSGPPFARELHIEIVSSPHYSANGDYDHVLYRHFHTPRVVQEGDVLCVPTVGQVEILEGSPEKLPRWREVFFKVKKAVGEAPDGPASAFLADTTHTSLYMAGSALSRVPLLPSGRSTPWDSLSPPGLEALVNELCAILKPHLQPGGTLLTGTSCVLLQGPPGSGKTTAVTAACSRLGLHLLKVPCYSLCADSSGAVETKLQAAFSRARRCRPAVLLLTAIDLLGRDRDGLDEDARVVATLRHLLLDEDPVSNCPPLMVVATTSRAQDLPTDVHTAFPHELEVPVLSEEQRLSVLQALTAHLPLGQEVNLLQLARRCAGFVVGDLYALLTHTSRVACARIRASGLAGGLSEEDEGELCAAGFPLLAEDFGQALDQLQTAHSQAVGAPKIPSVSWHDVGGLQDVKKEILETIQLPLEHPELLSLGLRRSGLLLHGPPGTGKTLLAKAVATECSLTFLSVKGPELINMYVGQSEENVREVFARARAAAPCIIFFDELDSLAPSRGRSGDSGGVMDRVVSQLLAELDGLHSTQDVFVIGATNRPDLLDPALLRPGRFDKLVFVGASEDRASQLRVLSAITRKFKLEASVSLVNVLDRCPPQLTGADLYSLCSDAMTTALKRRVRDLEEGLEMGSSALLLTMEDLLQAAARLQPSVSEQELLRYKRIQRKFAAC
					

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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	50.2	Low	57	Low	164 Å²	164	67.8 Å²	67.8	81%	0.808	36%	0.357	S	S	*	.				0	134.5	0	-75	-171.6	-176.8	0	0	107.3	A94 R95	M1-A94 WeakPolarHBondContact CA-O 3.32Å; M1-R95 HydrophobicContact CG-CB 4.16Å; M1-R95 HydrophobicContact CG-CG 4.18Å
2	A	50.9	Low	56.9	Low	18 Å²	18	65.7 Å²	65.7	15%	0.149	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	146.2	177.8	0	0	0	0	0	111.1	P28 W29 A94	A2-P28 HydrophobicContact CB-CG 4.3Å; A2-W29 HydrophobicContact CB-CH2 3.61Å; A2-W29 HydrophobicContact CB-CZ2 3.97Å; A2-W29 HydrophobicContact CB-CZ3 4.21Å; A2-A94 PolarHBondContact N-O 3.23Å; A2-A94 PolarHBondContact O-N 3.41Å
3	L	52	Low	56.9	Low	81 Å²	81	64.6 Å²	64.6	42%	0.424	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	114.4	-179.6	-143.7	151.8	0	0	0	108	P72 R91 R93	L3-P72 VanDerWaalsContact O-CD 3.25Å; L3-P72 WeakPolarHBondContact O-CD 2.86Å; L3-P72 VanDerWaalsContact O-CG 3.28Å; L3-P72 WeakPolarHBondContact O-CG 3.45Å; L3-R91 HydrophobicContact CD2-CB 4.07Å; L3-R91 HydrophobicContact CD2-CG 4.39Å; L3-R93 HydrophobicContact CG-CG 4.37Å
4	A	59.4	Low	56.1	Low	0 Å²	0	67.7 Å²	67.7	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	157.5	-170.3	0	0	0	0	0	112.7	P72 L74 R91 V92	A4-P72 CarbonylContact C-O 3.55Å; A4-P72 WeakPolarHBondContact CA-O 3.3Å; A4-P72 HydrophobicContact CB-CG 4.27Å; A4-P72 VanDerWaalsContact CB-O 3.23Å; A4-P72 WeakPolarHBondContact CB-O 3.32Å; A4-L74 HydrophobicContact CB-CD1 3.89Å; A4-L74 HydrophobicContact CB-CG 3.9Å; A4-R91 WeakPolarHBondContact O-CA 3.3Å; A4-V92 PolarHBondContact N-O 3.38Å; A4-V92 PolarHBondContact O-N 2.79Å
5	V	63.5	Low	55.3	Low	25 Å²	25	76.3 Å²	76.3	15%	0.152	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.6	178	179.4	0	0	0	0	110.1	P71 P72 Q73 L74 R91	V5-P71 HydrophobicContact CG2-CB 4.32Å; V5-P71 HydrophobicContact CG2-CG 3.65Å; V5-P72 PolarHBondContact N-O 2.94Å; V5-Q73 WeakPolarHBondContact O-CA 3.37Å; V5-L74 PolarHBondContact O-N 3.31Å; V5-R91 HydrophobicContact CG2-CG 4.14Å
6	L	61.9	Low	54.6	Low	1 Å²	1	73.6 Å²	73.6	1%	0.005	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	128.6	177.1	-60.6	177.3	0	0	0	111.4	L40 L74 V76 L81 L86 G89 A90 V92	L6-L40 HydrophobicContact CD2-CD1 4.39Å; L6-L74 WeakPolarHBondContact CA-O 3.48Å; L6-L74 HydrophobicContact CD2-CB 3.71Å; L6-L74 HydrophobicContact CD2-CD1 3.96Å; L6-L74 HydrophobicContact CD2-CG 4.45Å; L6-V76 HydrophobicContact CB-CG2 4.13Å; L6-V76 HydrophobicContact CD2-CG2 3.63Å; L6-V76 HydrophobicContact CG-CG2 4.36Å; L6-L81 HydrophobicContact CB-CD2 4.28Å; L6-L81 HydrophobicContact CD1-CD2 3.82Å; L6-L86 HydrophobicContact CD1-CD1 3.93Å; L6-G89 WeakPolarHBondContact O-CA 3.47Å; L6-G89 PolarHBondContact O-N 3.09Å; L6-A90 PolarHBondContact N-O 3.17Å; L6-A90 VanDerWaalsContact N-O 3.11Å; L6-V92 HydrophobicContact CD1-CG1 4.21Å; L6-V92 HydrophobicContact CD1-CG2 4.39Å; L6-V92 HydrophobicContact CD2-CG2 3.83Å; L6-V92 HydrophobicContact CG-CG2 3.86Å
7	R	64.1	Low	54.3	Low	144 Å²	144	73 Å²	73	54%	0.543	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.5	171.2	-87.1	-164	176.5	-171.3	-1.2	111.6	L74 L75 V76	R7-L74 PolarHBondContact N-O 3.26Å; R7-L75 HydrophobicContact CB-CD2 4Å; R7-L75 WeakPolarHBondContact O-CA 3.34Å; R7-V76 PolarHBondContact O-N 2.97Å
8	V	63.4	Low	53.9	Low	45 Å²	45	73.8 Å²	73.8	27%	0.273	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	137.2	176.6	177	0	0	0	0	110.2	V76 R78 L81 P88	V8-V76 WeakPolarHBondContact CA-O 3.42Å; V8-R78 HydrophobicContact CG1-CG 3.39Å; V8-R78 HydrophobicContact CG2-CG 4.37Å; V8-L81 HydrophobicContact CG2-CD1 3.2Å; V8-L81 HydrophobicContact CG2-CG 4.47Å; V8-P88 HydrophobicContact CG2-CB 4.04Å
9	L	59.4	Low	53.7	Low	55 Å²	55	73.4 Å²	73.4	29%	0.288	41%	0.41	S	S	.	.			trans	-116.6	123.9	172.5	-170.1	132.7	0	0	0	110.3	P11 F12 L75 V76	L9-P11 WeakPolarHBondContact CD2-O 3.34Å; L9-F12 HydrophobicContact CB-CD2 4.2Å; L9-F12 HydrophobicContact CD2-CD2 4.12Å; L9-L75 HydrophobicContact CD1-CD1 3.89Å; L9-L75 HydrophobicContact CD1-CD2 4.34Å; L9-V76 PolarHBondContact N-O 3.28Å
10	D	51.5	Low	53.6	Low	90 Å²	90	69.8 Å²	69.8	48%	0.481	39%	0.39	S	S	.	.	S	Bend	trans	-132.5	128.6	175.7	-68.2	-49.1	0	0	0	109.2	R78	D10-R78 IonicContact OD1-NE 3.23Å; D10-R78 IonicContact OD2-CZ 3.94Å; D10-R78 IonicContact OD2-NE 2.68Å; D10-R78 PolarHBondContact OD2-NE 3.3Å; D10-R78 IonicContact OD2-NH2 3.13Å; D10-R78 PolarHBondContact OD2-NH2 2.98Å
11	P	50.8	Low	53.7	Low	123 Å²	123	66.7 Å²	66.7	80%	0.799	37%	0.373	S	S	*	.	S	Bend	cis	-75	133	-4.6	30.5	-32.7	0	0	0	111.9	L9	L9-P11 WeakPolarHBondContact CD2-O 3.34Å
12	F	56.2	Low	54.1	Low	42 Å²	42	59.3 Å²	59.3	18%	0.184	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-71.5	136.8	173.1	-154.3	-102.3	0	0	0	109.8	L9 A14 T16 L22	L9-F12 HydrophobicContact CB-CD2 4.2Å; L9-F12 HydrophobicContact CD2-CD2 4.12Å; F12-A14 PolarHBondContact O-N 2.65Å; F12-T16 WeakPolarHBondContact CD1-OG1 2.94Å; F12-T16 WeakPolarHBondContact CE1-OG1 3.34Å; F12-L22 HydrophobicContact CE2-CD1 4.13Å; F12-L22 HydrophobicContact CZ-CD1 4.19Å; F12-L22 HydrophobicContact CZ-CG 4.38Å
13	P	55.8	Low	54.4	Low	52 Å²	52	59.5 Å²	59.5	34%	0.338	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-57.1	123.8	-175.5	-21.9	31.5	0	0	0	111.6	E15 T16 L22	P13-E15 PolarHBondContact O-N 3.37Å; P13-T16 HydrophobicContact CB-CG2 4.24Å; P13-T16 PolarHBondContact O-N 3.19Å; P13-T16 VanDerWaalsContact O-N 3.14Å; P13-T16 PolarHBondContact O-OG1 2.64Å; P13-L22 HydrophobicContact CG-CD1 4.31Å
14	A	46.4	Very low	54.5	Low	108 Å²	108	58 Å²	58	89%	0.893	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-16.9	-174.9	0	0	0	0	0	114	F12	F12-A14 PolarHBondContact O-N 2.65Å
15	E	43.2	Very low	54.1	Low	197 Å²	197	62.4 Å²	62.4	92%	0.921	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-1.4	-178.4	-61.2	-176.9	169.5	0	0	113.7	P13	P13-E15 PolarHBondContact O-N 3.37Å
16	T	44.4	Very low	53.5	Low	32 Å²	32	65.2 Å²	65.2	20%	0.196	39%	0.393	C	S	.	.	S	Bend	trans	-105.9	138.7	-177.3	55.8	0	0	0	0	111.9	F12 P13 L57	F12-T16 WeakPolarHBondContact CD1-OG1 2.94Å; F12-T16 WeakPolarHBondContact CE1-OG1 3.34Å; P13-T16 HydrophobicContact CB-CG2 4.24Å; P13-T16 PolarHBondContact O-N 3.19Å; P13-T16 VanDerWaalsContact O-N 3.14Å; P13-T16 PolarHBondContact O-OG1 2.64Å; T16-L57 HydrophobicContact CG2-CD1 4.46Å
17	P	49.2	Very low	53.2	Low	64 Å²	64	66.7 Å²	66.7	42%	0.416	41%	0.408	S	S	.	.			trans	-64	146	-179.3	24.5	-30.1	0	0	0	110.2	L19 A20	P17-L19 PolarHBondContact O-N 3.39Å; P17-A20 HydrophobicContact CG-CB 4.01Å; P17-A20 WeakPolarHBondContact O-CB 3.44Å; P17-A20 PolarHBondContact O-N 2.86Å
18	P	48.1	Very low	52.4	Low	88 Å²	88	64.5 Å²	64.5	57%	0.571	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-15.7	-173	24	-34.3	0	0	0	113.9	S77	P18-S77 PolarHBondContact O-OG 3.31Å; P18-S77 VanDerWaalsContact O-OG 3.08Å
19	L	50	Low	51.9	Low	66 Å²	66	64.1 Å²	64.1	35%	0.346	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	1.2	179.3	-64	172	0	0	0	115.2	P17 L80 L83 L123	P17-L19 PolarHBondContact O-N 3.39Å; L19-L80 VanDerWaalsContact CA-CD1 3.47Å; L19-L80 HydrophobicContact CB-CD1 4.24Å; L19-L80 HydrophobicContact CD2-CD1 3.91Å; L19-L80 WeakPolarHBondContact O-CD1 3.46Å; L19-L83 HydrophobicContact CD2-CD1 3.8Å; L19-L123 HydrophobicContact CD1-CD2 3.95Å
20	A	51.2	Low	51.3	Low	1 Å²	1	65.3 Å²	65.3	1%	0.008	42%	0.417	C	S	.	.			trans	-79.8	152.7	-179.7	0	0	0	0	0	113.2	P17	P17-A20 HydrophobicContact CG-CB 4.01Å; P17-A20 WeakPolarHBondContact O-CB 3.44Å; P17-A20 PolarHBondContact O-N 2.86Å
21	V	56.5	Low	50.8	Low	5 Å²	5	65 Å²	65	3%	0.03	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.2	172.8	-176.6	0	0	0	0	108.8	L53 A56 L57 L74 V76	V21-L53 HydrophobicContact CG2-CB 4.24Å; V21-L53 HydrophobicContact CG2-CD1 3.47Å; V21-L53 VanDerWaalsContact CG2-CD1 3.47Å; V21-L53 HydrophobicContact CG2-CG 4.49Å; V21-A56 WeakPolarHBondContact O-CA 3.44Å; V21-L57 PolarHBondContact O-N 3.38Å; V21-L74 HydrophobicContact CG1-CB 3.93Å; V21-L74 HydrophobicContact CG1-CD2 3.99Å; V21-L74 HydrophobicContact CG1-CG 4.4Å; V21-V76 HydrophobicContact CG2-CG1 4.47Å
22	L	57.1	Low	50.1	Low	9 Å²	9	65.2 Å²	65.2	5%	0.047	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	131.5	178.2	-66.6	171.2	0	0	0	110.6	F12 P13 L57 L75	F12-L22 HydrophobicContact CE2-CD1 4.13Å; F12-L22 HydrophobicContact CZ-CD1 4.19Å; F12-L22 HydrophobicContact CZ-CG 4.38Å; P13-L22 HydrophobicContact CG-CD1 4.31Å; L22-L57 WeakPolarHBondContact CA-O 3.26Å; L22-L57 HydrophobicContact CD2-CB 3.83Å; L22-L75 HydrophobicContact CB-CB 4.07Å; L22-L75 PolarHBondContact N-O 3.08Å; L22-L75 PolarHBondContact O-N 3.27Å; L22-L75 VanDerWaalsContact O-N 3.13Å
23	L	59.2	Low	49.3	Very low	22 Å²	22	66.5 Å²	66.5	12%	0.115	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.2	175.6	-67.7	176.8	0	0	0	110.4	W29 L38 A56 L57 G59 L74	L23-W29 HydrophobicContact CD1-CG 4.37Å; L23-L38 HydrophobicContact CD2-CD1 4.37Å; L23-A56 HydrophobicContact CD1-CB 3.47Å; L23-A56 VanDerWaalsContact CD1-CB 3.47Å; L23-A56 HydrophobicContact CG-CB 3.81Å; L23-L57 PolarHBondContact N-O 3.03Å; L23-L57 VanDerWaalsContact N-O 3.1Å; L23-G59 PolarHBondContact O-N 3.1Å; L23-L74 HydrophobicContact CD2-CD2 3.3Å
24	P	53.9	Low	48.5	Very low	50 Å²	50	71.7 Å²	71.7	33%	0.325	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-70.9	140.3	169.2	27.6	-30.9	0	0	0	110.5	G26 Q73	P24-G26 PolarHBondContact O-N 3.06Å; P24-Q73 VanDerWaalsContact CD-O 3.23Å; P24-Q73 WeakPolarHBondContact CD-O 3.36Å
25	P	51.3	Low	48.5	Very low	91 Å²	91	69 Å²	69	59%	0.591	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	132.8	177	23.9	-31.9	0	0	0	110.9
26	G	50.2	Low	48.7	Very low	85 Å²	85	61.9 Å²	61.9	88%	0.876	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.4	14	175.6	0	0	0	0	0	117.4	P24	P24-G26 PolarHBondContact O-N 3.06Å
27	G	54.9	Low	49	Very low	31 Å²	31	61.9 Å²	61.9	32%	0.32	43%	0.426	S	S	.	.	S	Bend	trans	-76.8	172.8	168.7	0	0	0	0	0	113.7	W29	G27-W29 PolarHBondContact O-N 3.37Å
28	P	47	Very low	49	Very low	99 Å²	99	59.1 Å²	59.1	64%	0.643	41%	0.408	S	S	*	.	S	Bend	trans	-71.7	24.4	-179.7	33.4	-37.7	0	0	0	113.7	A2	A2-P28 HydrophobicContact CB-CG 4.3Å
29	W	54	Low	49.3	Very low	37 Å²	37	55.8 Å²	55.8	14%	0.14	39%	0.387	C	S	.	.	S	Bend	trans	-92.9	137.4	-177.2	-49.2	107.2	0	0	0	108.5	A2 L23 G27 A31 L38 A94	A2-W29 HydrophobicContact CB-CH2 3.61Å; A2-W29 HydrophobicContact CB-CZ2 3.97Å; A2-W29 HydrophobicContact CB-CZ3 4.21Å; L23-W29 HydrophobicContact CD1-CG 4.37Å; G27-W29 PolarHBondContact O-N 3.37Å; W29-A31 PolarHBondContact O-N 3.26Å; W29-L38 HydrophobicContact CE3-CD2 4.49Å; W29-L38 HydrophobicContact CZ3-CD2 4.11Å; W29-A94 HydrophobicContact CH2-CB 3.56Å; W29-A94 HydrophobicContact CZ2-CB 4.41Å; W29-A94 HydrophobicContact CZ3-CB 4.3Å
30	P	46.4	Very low	49.3	Very low	80 Å²	80	52.9 Å²	52.9	52%	0.519	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-57.4	126.7	178.7	23.3	-31.8	0	0	0	109.8	T32	P30-T32 PolarHBondContact O-N 2.83Å
31	A	41.8	Very low	49.4	Very low	84 Å²	84	58.9 Å²	58.9	69%	0.694	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-68.4	121.8	174.4	0	0	0	0	0	108.9	W29	W29-A31 PolarHBondContact O-N 3.26Å
32	T	34.9	Very low	49.3	Very low	127 Å²	127	60.3 Å²	60.3	78%	0.779	40%	0.404	S	S	*	.			trans	147.5	134.1	152.5	43.8	0	0	0	0	113.2	P30	P30-T32 PolarHBondContact O-N 2.83Å
33	G	40.5	Very low	48.8	Very low	69 Å²	69	62.1 Å²	62.1	71%	0.711	42%	0.42	S	S	*	.			trans	81.9	131.3	151.5	0	0	0	0	0	118	G35	G33-G35 PolarHBondContact O-N 3.48Å
34	L	37.7	Very low	48.3	Very low	161 Å²	161	64.6 Å²	64.6	84%	0.843	44%	0.44	S	S	*	.	S	Bend	trans	-48.5	129.6	170.9	-78.6	155.7	0	0	0	111.9	L57	L34-L57 HydrophobicContact CD2-CD2 3.44Å; L34-L57 VanDerWaalsContact CD2-CD2 3.44Å
35	G	47.7	Very low	47.6	Very low	52 Å²	52	72.1 Å²	72.1	54%	0.536	47%	0.471	S	S	.	.			trans	118	25.5	164.5	0	0	0	0	0	117.8	G33 V37	G33-G35 PolarHBondContact O-N 3.48Å; G35-V37 PolarHBondContact O-N 3.44Å
36	L	47.2	Very low	46.9	Very low	47 Å²	47	70.5 Å²	70.5	25%	0.246	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	120.4	174.1	-135.2	113	0	0	0	110.9	L38 A55 A56 P96	L36-L38 HydrophobicContact CD2-CD2 3.89Å; L36-L38 HydrophobicContact CD2-CG 4.34Å; L36-A55 WeakPolarHBondContact O-CA 3.43Å; L36-A56 HydrophobicContact CB-CB 4.29Å; L36-A56 PolarHBondContact O-N 3.45Å; L36-P96 HydrophobicContact CD2-CB 3.7Å; L36-P96 HydrophobicContact CG-CB 4.49Å
37	V	50.5	Low	46.3	Very low	32 Å²	32	72.5 Å²	72.5	19%	0.194	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	127.5	172.3	-179.4	0	0	0	0	109.2	G35 L52 V97	G35-V37 PolarHBondContact O-N 3.44Å; V37-L52 HydrophobicContact CG1-CD2 3.84Å; V37-V97 PolarHBondContact O-N 2.91Å
38	L	49.4	Very low	45.5	Very low	6 Å²	6	73.2 Å²	73.2	3%	0.031	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.1	-179	-70.4	171.6	0	0	0	110.2	L23 W29 L36 L53 A56 R95 P96	L23-L38 HydrophobicContact CD2-CD1 4.37Å; W29-L38 HydrophobicContact CE3-CD2 4.49Å; W29-L38 HydrophobicContact CZ3-CD2 4.11Å; L36-L38 HydrophobicContact CD2-CD2 3.89Å; L36-L38 HydrophobicContact CD2-CG 4.34Å; L38-L53 PolarHBondContact N-O 3.22Å; L38-L53 VanDerWaalsContact N-O 3.15Å; L38-L53 PolarHBondContact O-N 3.35Å; L38-A56 HydrophobicContact CD1-CB 4.06Å; L38-R95 WeakPolarHBondContact CA-O 3.44Å; L38-P96 HydrophobicContact CD2-CB 4.35Å
39	A	53.5	Low	45.2	Very low	17 Å²	17	71.4 Å²	71.4	14%	0.14	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	123.3	165.6	0	0	0	0	0	108.9	L52 A94 R95 V97	A39-L52 HydrophobicContact CB-CD2 3.89Å; A39-L52 HydrophobicContact CB-CG 4.44Å; A39-A94 WeakPolarHBondContact O-CA 3.12Å; A39-R95 PolarHBondContact N-O 3.46Å; A39-R95 PolarHBondContact O-N 3.02Å; A39-V97 HydrophobicContact CB-CG2 3.99Å
40	L	49.7	Very low	44.6	Very low	6 Å²	6	73.6 Å²	73.6	3%	0.031	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.2	175.2	-62.9	-174.5	0	0	0	110.5	L6 A51 L53 L74 V92 R93 A94	L6-L40 HydrophobicContact CD2-CD1 4.39Å; L40-A51 PolarHBondContact N-O 3.41Å; L40-A51 PolarHBondContact O-N 3.45Å; L40-L53 HydrophobicContact CD1-CD1 3.5Å; L40-L53 VanDerWaalsContact CD1-CD1 3.5Å; L40-L53 HydrophobicContact CD1-CG 4.41Å; L40-L53 HydrophobicContact CG-CD1 4.28Å; L40-L74 HydrophobicContact CD1-CD1 4.45Å; L40-L74 HydrophobicContact CD2-CD1 3.79Å; L40-V92 HydrophobicContact CD2-CG2 4.26Å; L40-R93 WeakPolarHBondContact CA-O 3.42Å; L40-A94 HydrophobicContact CD2-CB 3.53Å
41	R	53.5	Low	44.4	Very low	126 Å²	126	71.5 Å²	71.5	48%	0.475	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.2	170.2	-168.6	173.8	178.9	166	-0.7	110	V92 R93	R41-V92 CarbonylContact O-C 3.56Å; R41-V92 WeakPolarHBondContact O-CA 3.41Å; R41-R93 PolarHBondContact N-O 3.37Å; R41-R93 PolarHBondContact O-N 3.35Å
42	P	54.4	Low	44.2	Very low	36 Å²	36	70 Å²	70	23%	0.234	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	143.1	172.6	23.2	-30	0	0	0	110.4	S44 L86	P42-S44 PolarHBondContact O-N 2.96Å; P42-L86 HydrophobicContact CB-CD2 4.4Å
43	A	47.2	Very low	44.8	Very low	46 Å²	46	64.7 Å²	64.7	38%	0.38	42%	0.416	S	S	.	.	S	Bend	trans	-75.6	-7.8	-175.4	0	0	0	0	0	114.3	R91	A43-R91 HydrophobicContact CB-CB 4.24Å; A43-R91 WeakPolarHBondContact CB-O 3.38Å; A43-R91 PolarHBondContact N-O 2.81Å; A43-R91 VanDerWaalsContact N-O 3.13Å
44	S	47.8	Very low	44.9	Very low	75 Å²	75	64.1 Å²	64.1	52%	0.524	40%	0.399	S	S	.	.	S	Bend	trans	-75.4	142.3	176.9	53.4	0	0	0	0	112.1	P42 S46	P42-S44 PolarHBondContact O-N 2.96Å; S44-S46 PolarHBondContact O-N 3.46Å
45	E	39.3	Very low	45.3	Very low	208 Å²	208	57.8 Å²	57.8	97%	0.972	37%	0.37	S	S	*	.	S	Bend	trans	-69.1	29	-171.8	-66.6	-178.6	150.3	0	0	116.4
46	S	36.4	Very low	45.2	Very low	57 Å²	57	56 Å²	56	40%	0.399	35%	0.349	S	S	.	.	S	Bend	trans	-93.6	147.2	173.5	58.6	0	0	0	0	112	S44 A48	S44-S46 PolarHBondContact O-N 3.46Å; S46-A48 PolarHBondContact O-N 3.27Å
47	P	38.3	Very low	45.2	Very low	126 Å²	126	56.2 Å²	56.2	82%	0.818	35%	0.351	S	S	*	.			trans	-80.6	44.9	-179	36.3	-35.6	0	0	0	111.3
48	A	38.6	Very low	45.1	Very low	47 Å²	47	62.1 Å²	62.1	39%	0.388	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-74.4	126.3	169.6	0	0	0	0	0	109	S46	S46-A48 PolarHBondContact O-N 3.27Å
49	G	41.1	Very low	44.8	Very low	61 Å²	61	62.7 Å²	62.7	63%	0.629	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-60	156.1	-179.6	0	0	0	0	0	113	A51	G49-A51 PolarHBondContact O-N 3.49Å
50	P	39.8	Very low	44.2	Very low	82 Å²	82	67.5 Å²	67.5	53%	0.532	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-65.9	129.9	-179.9	27.7	-33.3	0	0	0	111
51	A	44.1	Very low	43.6	Very low	36 Å²	36	70.2 Å²	70.2	30%	0.298	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	118.3	169.3	0	0	0	0	0	108.8	L40 G49 L84	L40-A51 PolarHBondContact N-O 3.41Å; L40-A51 PolarHBondContact O-N 3.45Å; G49-A51 PolarHBondContact O-N 3.49Å; A51-L84 HydrophobicContact CB-CD2 3.76Å
52	L	37.4	Very low	42.7	Very low	54 Å²	54	69.6 Å²	69.6	28%	0.283	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	119.1	174.5	-85.3	158	0	0	0	109.3	V37 A39 V97 W105	V37-L52 HydrophobicContact CG1-CD2 3.84Å; A39-L52 HydrophobicContact CB-CD2 3.89Å; A39-L52 HydrophobicContact CB-CG 4.44Å; L52-V97 HydrophobicContact CD2-CG2 4.09Å; L52-W105 HydrophobicContact CD1-CH2 4.38Å; L52-W105 HydrophobicContact CD1-CZ2 3.9Å
53	L	46.8	Very low	41.7	Very low	15 Å²	15	76.3 Å²	76.3	8%	0.079	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129.8	172.3	-64.7	-179.4	0	0	0	109.9	V21 L38 L40 L80 L84	V21-L53 HydrophobicContact CG2-CB 4.24Å; V21-L53 HydrophobicContact CG2-CD1 3.47Å; V21-L53 VanDerWaalsContact CG2-CD1 3.47Å; V21-L53 HydrophobicContact CG2-CG 4.49Å; L38-L53 PolarHBondContact N-O 3.22Å; L38-L53 VanDerWaalsContact N-O 3.15Å; L38-L53 PolarHBondContact O-N 3.35Å; L40-L53 HydrophobicContact CD1-CD1 3.5Å; L40-L53 VanDerWaalsContact CD1-CD1 3.5Å; L40-L53 HydrophobicContact CD1-CG 4.41Å; L40-L53 HydrophobicContact CG-CD1 4.28Å; L53-L80 HydrophobicContact CD1-CD1 4.22Å; L53-L80 HydrophobicContact CD1-CD2 3.75Å; L53-L80 HydrophobicContact CD2-CD1 3.73Å; L53-L80 HydrophobicContact CD2-CD2 4.36Å; L53-L80 HydrophobicContact CD2-CG 4.47Å; L53-L84 HydrophobicContact CD1-CD1 4.34Å
54	V	42.9	Very low	41	Very low	57 Å²	57	81.1 Å²	81.1	35%	0.345	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	134.9	-177.6	178	0	0	0	0	110.4
55	A	46.5	Very low	40.3	Very low	28 Å²	28	81 Å²	81	23%	0.231	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59.1	98.3	169.9	0	0	0	0	0	116.3	L36	L36-A55 WeakPolarHBondContact O-CA 3.43Å
56	A	45.1	Very low	40	Very low	13 Å²	13	80.5 Å²	80.5	11%	0.107	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	123.1	156.7	0	0	0	0	0	110.2	V21 L23 L36 L38	V21-A56 WeakPolarHBondContact O-CA 3.44Å; L23-A56 HydrophobicContact CD1-CB 3.47Å; L23-A56 VanDerWaalsContact CD1-CB 3.47Å; L23-A56 HydrophobicContact CG-CB 3.81Å; L36-A56 HydrophobicContact CB-CB 4.29Å; L36-A56 PolarHBondContact O-N 3.45Å; L38-A56 HydrophobicContact CD1-CB 4.06Å
57	L	47.9	Very low	40.1	Very low	52 Å²	52	90.3 Å²	90.3	27%	0.272	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	139.9	173.3	-78.4	151.6	0	0	0	109	T16 V21 L22 L23 L34 G59	T16-L57 HydrophobicContact CG2-CD1 4.46Å; V21-L57 PolarHBondContact O-N 3.38Å; L22-L57 WeakPolarHBondContact CA-O 3.26Å; L22-L57 HydrophobicContact CD2-CB 3.83Å; L23-L57 PolarHBondContact N-O 3.03Å; L23-L57 VanDerWaalsContact N-O 3.1Å; L34-L57 HydrophobicContact CD2-CD2 3.44Å; L34-L57 VanDerWaalsContact CD2-CD2 3.44Å; L57-G59 PolarHBondContact O-N 3.1Å
58	E	46.9	Very low	39.9	Very low	156 Å²	156	87 Å²	87	73%	0.729	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	125	173.1	-74.2	-172.8	160.1	0	0	109.4
59	G	44.4	Very low	40	Very low	18 Å²	18	91.9 Å²	91.9	19%	0.186	56%	0.559	C	S	.	*	P	Polyproline II helix	trans	-73.5	155	175.4	0	0	0	0	0	112.1	L23 L57 G61	L23-G59 PolarHBondContact O-N 3.1Å; L57-G59 PolarHBondContact O-N 3.1Å; G59-G61 PolarHBondContact O-N 2.96Å
60	P	39.4	Very low	40.5	Very low	119 Å²	119	91.4 Å²	91.4	77%	0.773	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-59.9	131	176.2	24.5	-32.2	0	0	0	110.5	S62	P60-S62 PolarHBondContact O-N 3.22Å
61	G	36.9	Very low	41.1	Very low	63 Å²	63	90.3 Å²	90.3	65%	0.649	55%	0.547	S	S	*	.			trans	-58.8	110.2	-177.1	0	0	0	0	0	112.1	G59 Q63	G59-G61 PolarHBondContact O-N 2.96Å; G61-Q63 PolarHBondContact O-N 2.98Å
62	S	34.8	Very low	41.9	Very low	113 Å²	113	90.4 Å²	90.4	79%	0.79	55%	0.545	S	S	*	.			trans	-81	105.3	167	170.9	0	0	0	0	108.8	P60 N64	P60-S62 PolarHBondContact O-N 3.22Å; S62-N64 PolarHBondContact O-N 2.87Å
63	Q	34.3	Very low	43	Very low	176 Å²	176	91.5 Å²	91.5	82%	0.822	55%	0.548	S	S	*	.			trans	-70	106.9	161.5	-71.2	-174.1	2	0	0	108.5	G61	G61-Q63 PolarHBondContact O-N 2.98Å
64	N	31.6	Very low	43.8	Very low	148 Å²	148	90.9 Å²	90.9	79%	0.791	55%	0.545	S	S	*	.			trans	149.8	114.9	137.5	-78.3	-23	0	0	0	112.6	S62	S62-N64 PolarHBondContact O-N 2.87Å
65	G	33.2	Very low	44.8	Very low	73 Å²	73	90 Å²	90	75%	0.753	54%	0.538	S	S	*	.			trans	61.7	88.9	131.8	0	0	0	0	0	119.4
66	Q	34.3	Very low	45.7	Very low	196 Å²	196	88.7 Å²	88.7	92%	0.916	53%	0.527	S	S	*	.				173.9	102	116.6	-93.8	173	10.7	0	0	109.3	G68	Q66-G68 PolarHBondContact O-N 2.95Å
67	R	36.8	Very low	46.6	Very low	263 Å²	263	88.5 Å²	88.5	99%	0.992	53%	0.525	S	S	*	.			trans	-74	102	170.6	-113.6	177.2	-178.6	175.9	0.6	108.3
68	G	35.7	Very low	47.2	Very low	58 Å²	58	93.1 Å²	93.1	60%	0.598	54%	0.539	S	S	*	.			trans	-98.5	152.4	159.2	0	0	0	0	0	110.4	Q66 G70	Q66-G68 PolarHBondContact O-N 2.95Å; G68-G70 PolarHBondContact O-N 3.07Å
69	P	40.8	Very low	47.6	Very low	148 Å²	148	88.1 Å²	88.1	96%	0.961	53%	0.525	S	S	*	.			trans	-77.8	64.9	175.5	34.5	-33.1	0	0	0	109.6
70	G	50	Low	48.2	Very low	51 Å²	51	87.4 Å²	87.4	53%	0.526	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-99.9	153.2	178.2	0	0	0	0	0	112	G68	G68-G70 PolarHBondContact O-N 3.07Å
71	P	53.2	Low	49	Very low	59 Å²	59	82.2 Å²	82.2	38%	0.383	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-58.9	148.7	171.9	26.1	-34.4	0	0	0	111.2	V5	V5-P71 HydrophobicContact CG2-CB 4.32Å; V5-P71 HydrophobicContact CG2-CG 3.65Å
72	P	60	Low	49.9	Very low	39 Å²	39	89.1 Å²	89.1	25%	0.253	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-54.3	140.1	-178.2	21	-32.9	0	0	0	111.9	L3 A4 V5	L3-P72 VanDerWaalsContact O-CD 3.25Å; L3-P72 WeakPolarHBondContact O-CD 2.86Å; L3-P72 VanDerWaalsContact O-CG 3.28Å; L3-P72 WeakPolarHBondContact O-CG 3.45Å; A4-P72 CarbonylContact C-O 3.55Å; A4-P72 WeakPolarHBondContact CA-O 3.3Å; A4-P72 HydrophobicContact CB-CG 4.27Å; A4-P72 VanDerWaalsContact CB-O 3.23Å; A4-P72 WeakPolarHBondContact CB-O 3.32Å; V5-P72 PolarHBondContact N-O 2.94Å
73	Q	62.3	Low	50.7	Low	77 Å²	77	89.8 Å²	89.8	36%	0.36	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	140.6	-175.3	-61.6	-179.1	17	0	0	111.2	V5 P24	V5-Q73 WeakPolarHBondContact O-CA 3.37Å; P24-Q73 VanDerWaalsContact CD-O 3.23Å; P24-Q73 WeakPolarHBondContact CD-O 3.36Å
74	L	63.6	Low	51.5	Low	1 Å²	1	83.6 Å²	83.6	1%	0.005	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.5	172.6	-67.6	176	0	0	0	108.7	A4 V5 L6 R7 V21 L23 L40 V92 A94	A4-L74 HydrophobicContact CB-CD1 3.89Å; A4-L74 HydrophobicContact CB-CG 3.9Å; V5-L74 PolarHBondContact O-N 3.31Å; L6-L74 WeakPolarHBondContact CA-O 3.48Å; L6-L74 HydrophobicContact CD2-CB 3.71Å; L6-L74 HydrophobicContact CD2-CD1 3.96Å; L6-L74 HydrophobicContact CD2-CG 4.45Å; R7-L74 PolarHBondContact N-O 3.26Å; V21-L74 HydrophobicContact CG1-CB 3.93Å; V21-L74 HydrophobicContact CG1-CD2 3.99Å; V21-L74 HydrophobicContact CG1-CG 4.4Å; L23-L74 HydrophobicContact CD2-CD2 3.3Å; L40-L74 HydrophobicContact CD1-CD1 4.45Å; L40-L74 HydrophobicContact CD2-CD1 3.79Å; L74-V92 HydrophobicContact CD1-CG2 4.17Å; L74-A94 HydrophobicContact CD1-CB 4.47Å
75	L	63.7	Low	52.6	Low	40 Å²	40	81 Å²	81	21%	0.209	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.3	-179	-64.3	170.6	0	0	0	110	R7 L9 L22	R7-L75 HydrophobicContact CB-CD2 4Å; R7-L75 WeakPolarHBondContact O-CA 3.34Å; L9-L75 HydrophobicContact CD1-CD1 3.89Å; L9-L75 HydrophobicContact CD1-CD2 4.34Å; L22-L75 HydrophobicContact CB-CB 4.07Å; L22-L75 PolarHBondContact N-O 3.08Å; L22-L75 PolarHBondContact O-N 3.27Å; L22-L75 VanDerWaalsContact O-N 3.13Å
76	V	64.1	Low	53.7	Low	0 Å²	0	79.6 Å²	79.6	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	149.8	-167	-145.2	0	0	0	0	111.9	L6 R7 V8 L9 V21 L80	L6-V76 HydrophobicContact CB-CG2 4.13Å; L6-V76 HydrophobicContact CD2-CG2 3.63Å; L6-V76 HydrophobicContact CG-CG2 4.36Å; R7-V76 PolarHBondContact O-N 2.97Å; V8-V76 WeakPolarHBondContact CA-O 3.42Å; L9-V76 PolarHBondContact N-O 3.28Å; V21-V76 HydrophobicContact CG2-CG1 4.47Å; V76-L80 HydrophobicContact CG1-CB 3.91Å; V76-L80 HydrophobicContact CG1-CD2 3.2Å; V76-L80 HydrophobicContact CG1-CG 4.03Å
77	S	64.8	Low	54.6	Low	9 Å²	9	72.3 Å²	72.3	6%	0.063	41%	0.407	C	S	.	.			trans	-71.4	150.1	173.3	78.5	0	0	0	0	111.7	P18 A79 L80 L81	P18-S77 PolarHBondContact O-OG 3.31Å; P18-S77 VanDerWaalsContact O-OG 3.08Å; S77-A79 PolarHBondContact O-N 3.32Å; S77-L80 PolarHBondContact O-N 2.99Å; S77-L80 WeakPolarHBondContact OG-CB 3.49Å; S77-L80 PolarHBondContact OG-N 3.5Å; S77-L80 VanDerWaalsContact OG-N 3.16Å; S77-L81 PolarHBondContact O-N 3.42Å
78	R	60	Low	55.5	Low	148 Å²	148	64.7 Å²	64.7	56%	0.558	39%	0.391	S	S	*	.	H	α-helix	trans	-59.2	-32.7	172.8	-72.6	-173.6	-176	-167.1	-3.3	112.7	V8 D10 L80 R82	V8-R78 HydrophobicContact CG1-CG 3.39Å; V8-R78 HydrophobicContact CG2-CG 4.37Å; D10-R78 IonicContact OD1-NE 3.23Å; D10-R78 IonicContact OD2-CZ 3.94Å; D10-R78 IonicContact OD2-NE 2.68Å; D10-R78 PolarHBondContact OD2-NE 3.3Å; D10-R78 IonicContact OD2-NH2 3.13Å; D10-R78 PolarHBondContact OD2-NH2 2.98Å; R78-L80 VanDerWaalsContact C-N 3.34Å; R78-R82 WeakPolarHBondContact O-CG 3.49Å; R78-R82 PolarHBondContact O-N 3.3Å
79	A	56.7	Low	56.6	Low	52 Å²	52	64 Å²	64	43%	0.43	38%	0.384	S	S	.	.	H	α-helix	trans	-63.7	-41.5	178.3	0	0	0	0	0	111.3	S77 R82 L83	S77-A79 PolarHBondContact O-N 3.32Å; A79-R82 PolarHBondContact O-N 3.28Å; A79-L83 WeakPolarHBondContact O-CG 3.49Å; A79-L83 PolarHBondContact O-N 2.94Å; A79-L83 VanDerWaalsContact O-N 3.08Å
80	L	56.5	Low	57.5	Low	2 Å²	2	58.1 Å²	58.1	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-72.3	-35.4	179.6	-169.6	134	0	0	0	113.1	L19 L53 V76 S77 R78 R82 L83 L84	L19-L80 VanDerWaalsContact CA-CD1 3.47Å; L19-L80 HydrophobicContact CB-CD1 4.24Å; L19-L80 HydrophobicContact CD2-CD1 3.91Å; L19-L80 WeakPolarHBondContact O-CD1 3.46Å; L53-L80 HydrophobicContact CD1-CD1 4.22Å; L53-L80 HydrophobicContact CD1-CD2 3.75Å; L53-L80 HydrophobicContact CD2-CD1 3.73Å; L53-L80 HydrophobicContact CD2-CD2 4.36Å; L53-L80 HydrophobicContact CD2-CG 4.47Å; V76-L80 HydrophobicContact CG1-CB 3.91Å; V76-L80 HydrophobicContact CG1-CD2 3.2Å; V76-L80 HydrophobicContact CG1-CG 4.03Å; S77-L80 PolarHBondContact O-N 2.99Å; S77-L80 WeakPolarHBondContact OG-CB 3.49Å; S77-L80 PolarHBondContact OG-N 3.5Å; S77-L80 VanDerWaalsContact OG-N 3.16Å; R78-L80 VanDerWaalsContact C-N 3.34Å; L80-R82 VanDerWaalsContact C-N 3.3Å; L80-R82 PolarHBondContact O-N 3.42Å; L80-L83 PolarHBondContact O-N 3.45Å; L80-L84 HydrophobicContact CD2-CD1 3.5Å; L80-L84 VanDerWaalsContact CD2-CD1 3.5Å; L80-L84 HydrophobicContact CD2-CG 4.06Å; L80-L84 HydrophobicContact CG-CD1 4.44Å; L80-L84 WeakPolarHBondContact O-CG 3.38Å; L80-L84 PolarHBondContact O-N 2.98Å
81	L	56.5	Low	58	Low	10 Å²	10	63.8 Å²	63.8	5%	0.052	35%	0.354	C	S	.	.	H	α-helix	trans	-61.9	-38.7	172.4	-77.8	-178.6	0	0	0	112.6	L6 V8 S77 L84 A85 L86 P88	L6-L81 HydrophobicContact CB-CD2 4.28Å; L6-L81 HydrophobicContact CD1-CD2 3.82Å; V8-L81 HydrophobicContact CG2-CD1 3.2Å; V8-L81 HydrophobicContact CG2-CG 4.47Å; S77-L81 PolarHBondContact O-N 3.42Å; L81-L84 PolarHBondContact O-N 3.47Å; L81-A85 PolarHBondContact O-N 3.24Å; L81-A85 VanDerWaalsContact O-N 3.15Å; L81-L86 HydrophobicContact CD2-CB 4.31Å; L81-L86 PolarHBondContact O-N 2.92Å; L81-L86 VanDerWaalsContact O-N 3.14Å; L81-P88 HydrophobicContact CD1-CB 4.16Å
82	R	55.5	Low	58.2	Low	209 Å²	209	61 Å²	61	79%	0.789	34%	0.336	S	S	*	.	H	α-helix	trans	-64.2	-42.4	173.5	-71.5	179.5	-177.8	172.4	0.2	111.6	R78 A79 L80 A85	R78-R82 WeakPolarHBondContact O-CG 3.49Å; R78-R82 PolarHBondContact O-N 3.3Å; A79-R82 PolarHBondContact O-N 3.28Å; L80-R82 VanDerWaalsContact C-N 3.3Å; L80-R82 PolarHBondContact O-N 3.42Å; R82-A85 PolarHBondContact O-N 2.91Å
83	L	51.9	Low	58	Low	127 Å²	127	65.7 Å²	65.7	67%	0.665	35%	0.348	S	S	*	.	H	α-helix	trans	-63.5	-38.6	177.1	-76.3	169.2	0	0	0	112.8	L19 A79 L80 A85	L19-L83 HydrophobicContact CD2-CD1 3.8Å; A79-L83 WeakPolarHBondContact O-CG 3.49Å; A79-L83 PolarHBondContact O-N 2.94Å; A79-L83 VanDerWaalsContact O-N 3.08Å; L80-L83 PolarHBondContact O-N 3.45Å; L83-A85 VanDerWaalsContact C-N 3.27Å; L83-A85 PolarHBondContact O-N 3.07Å
84	L	50.1	Low	57.6	Low	46 Å²	46	62 Å²	62	24%	0.241	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-3.6	177.8	-67.2	-178.2	0	0	0	113.8	A51 L53 L80 L81 L86	A51-L84 HydrophobicContact CB-CD2 3.76Å; L53-L84 HydrophobicContact CD1-CD1 4.34Å; L80-L84 HydrophobicContact CD2-CD1 3.5Å; L80-L84 VanDerWaalsContact CD2-CD1 3.5Å; L80-L84 HydrophobicContact CD2-CG 4.06Å; L80-L84 HydrophobicContact CG-CD1 4.44Å; L80-L84 WeakPolarHBondContact O-CG 3.38Å; L80-L84 PolarHBondContact O-N 2.98Å; L81-L84 PolarHBondContact O-N 3.47Å; L84-L86 HydrophobicContact CB-CB 4.39Å; L84-L86 HydrophobicContact CB-CD1 4.09Å; L84-L86 HydrophobicContact CB-CG 4.12Å; L84-L86 HydrophobicContact CD1-CD1 4.28Å; L84-L86 PolarHBondContact O-N 3.34Å; L84-L86 VanDerWaalsContact O-N 3.16Å
85	A	54.7	Low	57	Low	94 Å²	94	68.8 Å²	68.8	78%	0.777	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	31.2	-171.3	0	0	0	0	0	113.7	L81 R82 L83	L81-A85 PolarHBondContact O-N 3.24Å; L81-A85 VanDerWaalsContact O-N 3.15Å; R82-A85 PolarHBondContact O-N 2.91Å; L83-A85 VanDerWaalsContact C-N 3.27Å; L83-A85 PolarHBondContact O-N 3.07Å
86	L	57.3	Low	56.3	Low	43 Å²	43	69.4 Å²	69.4	23%	0.225	36%	0.363	C	S	.	.			trans	-106.4	138.2	179.8	-69.2	174.7	0	0	0	110.8	L6 P42 L81 L84 A90 V92	L6-L86 HydrophobicContact CD1-CD1 3.93Å; P42-L86 HydrophobicContact CB-CD2 4.4Å; L81-L86 HydrophobicContact CD2-CB 4.31Å; L81-L86 PolarHBondContact O-N 2.92Å; L81-L86 VanDerWaalsContact O-N 3.14Å; L84-L86 HydrophobicContact CB-CB 4.39Å; L84-L86 HydrophobicContact CB-CD1 4.09Å; L84-L86 HydrophobicContact CB-CG 4.12Å; L84-L86 HydrophobicContact CD1-CD1 4.28Å; L84-L86 PolarHBondContact O-N 3.34Å; L84-L86 VanDerWaalsContact O-N 3.16Å; L86-A90 HydrophobicContact CB-CB 4.34Å; L86-A90 HydrophobicContact CD2-CB 4.34Å; L86-V92 HydrophobicContact CD1-CG1 4.13Å
87	G	51.8	Low	55.5	Low	43 Å²	43	71.1 Å²	71.1	44%	0.443	37%	0.373	S	S	.	.			trans	-74	153.1	173.2	0	0	0	0	0	112.8	G89 A90	G87-G89 PolarHBondContact O-N 3.03Å; G87-A90 WeakPolarHBondContact O-CB 3.39Å; G87-A90 PolarHBondContact O-N 3.18Å
88	P	55.7	Low	54.3	Low	102 Å²	102	82.2 Å²	82.2	66%	0.662	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	127.8	171.2	25.9	-32.7	0	0	0	110	V8 L81	V8-P88 HydrophobicContact CG2-CB 4.04Å; L81-P88 HydrophobicContact CD1-CB 4.16Å
89	G	59.9	Low	53.3	Low	43 Å²	43	85.8 Å²	85.8	44%	0.443	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.6	2.5	-175.8	0	0	0	0	0	115.9	L6 G87	L6-G89 WeakPolarHBondContact O-CA 3.47Å; L6-G89 PolarHBondContact O-N 3.09Å; G87-G89 PolarHBondContact O-N 3.03Å
90	A	60.2	Low	52	Low	26 Å²	26	85.8 Å²	85.8	22%	0.215	42%	0.423	C	S	.	.			trans	-63.5	140.5	176.1	0	0	0	0	0	112.7	L6 L86 G87	L6-A90 PolarHBondContact N-O 3.17Å; L6-A90 VanDerWaalsContact N-O 3.11Å; L86-A90 HydrophobicContact CB-CB 4.34Å; L86-A90 HydrophobicContact CD2-CB 4.34Å; G87-A90 WeakPolarHBondContact O-CB 3.39Å; G87-A90 PolarHBondContact O-N 3.18Å
91	R	58.9	Low	50.8	Low	170 Å²	170	90.4 Å²	90.4	64%	0.642	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.7	174.8	-68.5	-178.3	-177	-174.4	1.8	110.4	L3 A4 V5 A43	L3-R91 HydrophobicContact CD2-CB 4.07Å; L3-R91 HydrophobicContact CD2-CG 4.39Å; A4-R91 WeakPolarHBondContact O-CA 3.3Å; V5-R91 HydrophobicContact CG2-CG 4.14Å; A43-R91 HydrophobicContact CB-CB 4.24Å; A43-R91 WeakPolarHBondContact CB-O 3.38Å; A43-R91 PolarHBondContact N-O 2.81Å; A43-R91 VanDerWaalsContact N-O 3.13Å
92	V	58.9	Low	49.5	Very low	1 Å²	1	94.6 Å²	94.6	1%	0.006	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	142.5	-179.5	-75.9	0	0	0	0	111	A4 L6 L40 R41 L74 L86	A4-V92 PolarHBondContact N-O 3.38Å; A4-V92 PolarHBondContact O-N 2.79Å; L6-V92 HydrophobicContact CD1-CG1 4.21Å; L6-V92 HydrophobicContact CD1-CG2 4.39Å; L6-V92 HydrophobicContact CD2-CG2 3.83Å; L6-V92 HydrophobicContact CG-CG2 3.86Å; L40-V92 HydrophobicContact CD2-CG2 4.26Å; R41-V92 CarbonylContact O-C 3.56Å; R41-V92 WeakPolarHBondContact O-CA 3.41Å; L74-V92 HydrophobicContact CD1-CG2 4.17Å; L86-V92 HydrophobicContact CD1-CG1 4.13Å
93	R	54.8	Low	48.4	Very low	136 Å²	136	92.2 Å²	92.2	51%	0.513	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.2	167.7	-68	-177.1	-176.1	174	3.6	108.5	L3 L40 R41	L3-R93 HydrophobicContact CG-CG 4.37Å; L40-R93 WeakPolarHBondContact CA-O 3.42Å; R41-R93 PolarHBondContact N-O 3.37Å; R41-R93 PolarHBondContact O-N 3.35Å
94	A	53.9	Low	47.3	Very low	0 Å²	0	87.5 Å²	87.5	0%	0	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.2	-178.5	0	0	0	0	0	111	M1 A2 W29 A39 L40 L74	M1-A94 WeakPolarHBondContact CA-O 3.32Å; A2-A94 PolarHBondContact N-O 3.23Å; A2-A94 PolarHBondContact O-N 3.41Å; W29-A94 HydrophobicContact CH2-CB 3.56Å; W29-A94 HydrophobicContact CZ2-CB 4.41Å; W29-A94 HydrophobicContact CZ3-CB 4.3Å; A39-A94 WeakPolarHBondContact O-CA 3.12Å; L40-A94 HydrophobicContact CD2-CB 3.53Å; L74-A94 HydrophobicContact CD1-CB 4.47Å
95	R	51.7	Low	46.5	Very low	144 Å²	144	89.3 Å²	89.3	54%	0.543	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	128.8	178	-173	-178.1	-177.9	170.3	-0.1	110.6	M1 L38 A39	M1-R95 HydrophobicContact CG-CB 4.16Å; M1-R95 HydrophobicContact CG-CG 4.18Å; L38-R95 WeakPolarHBondContact CA-O 3.44Å; A39-R95 PolarHBondContact N-O 3.46Å; A39-R95 PolarHBondContact O-N 3.02Å
96	P	48	Very low	45.2	Very low	52 Å²	52	87.3 Å²	87.3	34%	0.338	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	131.6	170.4	30.5	-33.7	0	0	0	110.6	L36 L38	L36-P96 HydrophobicContact CD2-CB 3.7Å; L36-P96 HydrophobicContact CG-CB 4.49Å; L38-P96 HydrophobicContact CD2-CB 4.35Å
97	V	46.9	Very low	44	Very low	36 Å²	36	90.5 Å²	90.5	22%	0.218	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	116.5	177.6	-179.3	0	0	0	0	107.9	V37 A39 L52 R99	V37-V97 PolarHBondContact O-N 2.91Å; A39-V97 HydrophobicContact CB-CG2 3.99Å; L52-V97 HydrophobicContact CD2-CG2 4.09Å; V97-R99 WeakPolarHBondContact CG1-O 3.24Å
98	R	40.7	Very low	42.9	Very low	242 Å²	242	93.8 Å²	93.8	91%	0.913	48%	0.484	S	S	*	.	S	Bend	trans	-79.9	-22.2	-176.1	-83.5	-174.6	173.2	-178.5	-2.7	113.9
99	R	37.9	Very low	41.5	Very low	223 Å²	223	91.9 Å²	91.9	84%	0.842	48%	0.483	S	S	*	.	S	Bend	trans	-158.6	139.7	164	-69.2	-170.1	176.9	166.7	-3.1	108.9	V97	V97-R99 WeakPolarHBondContact CG1-O 3.24Å
100	P	31.1	Very low	40.1	Very low	53 Å²	53	95.1 Å²	95.1	34%	0.344	50%	0.499	S	S	.	.			trans	-74.4	142.6	173.6	29.5	-30.9	0	0	0	110.6	L124	P100-L124 HydrophobicContact CG-CD1 3.95Å; P100-L124 HydrophobicContact CG-CD2 4.43Å
101	P	29.6	Very low	38.5	Very low	99 Å²	99	98.3 Å²	98.3	64%	0.643	53%	0.525	S	S	*	.			trans	-63.8	136.1	174.4	25.8	-32.2	0	0	0	110.6	L103	P101-L103 PolarHBondContact O-N 2.87Å; P101-L103 VanDerWaalsContact O-N 3.12Å
102	A	30.7	Very low	37.1	Very low	98 Å²	98	96 Å²	96	81%	0.81	53%	0.532	S	S	*	.	S	Bend	trans	-71.4	-1.3	-169.4	0	0	0	0	0	115.3
103	L	32.3	Very low	35.8	Very low	158 Å²	158	98.9 Å²	98.9	83%	0.827	56%	0.562	S	S	*	*	S	Bend	trans	-107.1	87.3	-178.7	-71.2	165.5	0	0	0	110	P101	P101-L103 PolarHBondContact O-N 2.87Å; P101-L103 VanDerWaalsContact O-N 3.12Å
104	G	28.8	Very low	34.6	Very low	29 Å²	29	99.3 Å²	99.3	30%	0.299	58%	0.582	S	S	.	*	S	Bend	trans	151.4	-18.5	167.2	0	0	0	0	0	115.3	R126 R127	G104-R126 CarbonylContact O-C 3.56Å; G104-R126 WeakPolarHBondContact O-CA 3.47Å; G104-R126 VanDerWaalsContact O-CG 3.28Å; G104-R126 WeakPolarHBondContact O-CG 3.28Å; G104-R127 PolarHBondContact O-N 3.11Å
105	W	32.6	Very low	33.5	Very low	83 Å²	83	102.1 Å²	102.1	31%	0.314	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.9	125.6	-169.6	-56.4	86	0	0	0	111.9	L52 L124 V125 R126	L52-W105 HydrophobicContact CD1-CH2 4.38Å; L52-W105 HydrophobicContact CD1-CZ2 3.9Å; W105-L124 HydrophobicContact CB-CD2 3.54Å; W105-L124 HydrophobicContact CE3-CB 4.2Å; W105-L124 HydrophobicContact CG-CD2 4.38Å; W105-V125 CarbonylContact C-O 3.58Å; W105-V125 VanDerWaalsContact CA-O 3.29Å; W105-V125 WeakPolarHBondContact CA-O 3.48Å; W105-V125 VanDerWaalsContact CE3-C 3.49Å; W105-R126 HydrophobicContact CD2-CB 4.3Å; W105-R126 HydrophobicContact CE3-CB 4.02Å; W105-R126 HydrophobicContact CH2-CB 4.17Å; W105-R126 HydrophobicContact CZ2-CB 4.45Å; W105-R126 HydrophobicContact CZ3-CB 3.95Å
106	A	28.2	Very low	32.5	Very low	52 Å²	52	102.2 Å²	102.2	43%	0.43	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.5	130	170.2	0	0	0	0	0	109.5	V125	A106-V125 PolarHBondContact N-O 3.32Å; A106-V125 PolarHBondContact O-N 2.89Å
107	L	30.9	Very low	31.7	Very low	110 Å²	110	102.5 Å²	102.5	58%	0.576	64%	0.643	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.5	107.3	173	-157.2	130.7	0	0	0	107.1	G109 P122	L107-G109 PolarHBondContact O-N 2.84Å; L107-P122 HydrophobicContact CD1-CB 4.13Å; L107-P122 HydrophobicContact CD1-CG 4.25Å; L107-P122 HydrophobicContact CD2-CB 3.56Å; L107-P122 HydrophobicContact CD2-CG 4.25Å; L107-P122 HydrophobicContact CG-CB 3.78Å; L107-P122 HydrophobicContact CG-CG 4.44Å
108	L	29.2	Very low	30.7	Very low	113 Å²	113	107.1 Å²	107.1	59%	0.592	67%	0.674	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.8	111.6	174.5	-84.1	163.2	0	0	0	107.9	L123 V125	L108-L123 PolarHBondContact N-O 3.5Å; L108-V125 HydrophobicContact CD1-CG2 4.3Å
109	G	27.4	Very low	30	Very low	62 Å²	62	107.5 Å²	107.5	64%	0.639	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-58.2	147.4	-179.1	0	0	0	0	0	112.7	L107 A111	L107-G109 PolarHBondContact O-N 2.84Å; G109-A111 PolarHBondContact O-N 3.08Å
110	S	29.4	Very low	29.6	Very low	111 Å²	111	102.9 Å²	102.9	78%	0.776	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-62.4	117.2	169.9	56.2	0	0	0	0	110.1
111	A	27.1	Very low	29.5	Very low	92 Å²	92	103 Å²	103	76%	0.76	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-77.4	129.9	163.5	0	0	0	0	0	109.2	G109 G113	G109-A111 PolarHBondContact O-N 3.08Å; A111-G113 PolarHBondContact O-N 3.13Å
112	P	29.6	Very low	29.6	Very low	123 Å²	123	101.9 Å²	101.9	80%	0.799	68%	0.675	S	S	*	*			trans	-77.1	106.4	174.2	29.4	-30.1	0	0	0	110
113	G	30.8	Very low	29.7	Very low	61 Å²	61	101.8 Å²	101.8	63%	0.629	66%	0.66	S	S	*	*			trans	-83.6	148.4	161.7	0	0	0	0	0	110.8	A111 G115	A111-G113 PolarHBondContact O-N 3.13Å; G113-G115 PolarHBondContact O-N 3.23Å
114	P	29.1	Very low	29.8	Very low	144 Å²	144	96.7 Å²	96.7	94%	0.935	63%	0.634	S	S	*	*	S	Bend	trans	-79.9	103.7	-178.5	32	-30.2	0	0	0	110.1
115	G	31.4	Very low	30.1	Very low	60 Å²	60	97.2 Å²	97.2	62%	0.619	63%	0.631	S	S	*	*	S	Bend	trans	-177.8	147.7	170.1	0	0	0	0	0	112.4	G113 G117	G113-G115 PolarHBondContact O-N 3.23Å; G115-G117 PolarHBondContact O-N 3.01Å
116	P	31.3	Very low	30.1	Very low	146 Å²	146	100.2 Å²	100.2	95%	0.948	64%	0.642	S	S	*	*			trans	-83.8	101.8	173.7	32.6	-26.9	0	0	0	108.8
117	G	29.9	Very low	30.2	Very low	57 Å²	57	108.7 Å²	108.7	59%	0.588	66%	0.663	S	S	*	*			trans	-157.3	155.1	174.9	0	0	0	0	0	111.1	G115	G115-G117 PolarHBondContact O-N 3.01Å
118	P	26.6	Very low	30.5	Very low	134 Å²	134	107.4 Å²	107.4	87%	0.87	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-69.3	142.9	-171.2	27.8	-32.2	0	0	0	112.2
119	R	26.5	Very low	30.6	Very low	250 Å²	250	108.5 Å²	108.5	94%	0.943	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-71.5	125.9	-169.7	-63.3	176.3	177	-179.6	-1.9	111.8
120	V	28.7	Very low	30.7	Very low	126 Å²	126	111.1 Å²	111.1	76%	0.764	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-80.1	135.4	168.6	179.8	0	0	0	0	109.2
121	G	30	Very low	30.8	Very low	56 Å²	56	112.5 Å²	112.5	58%	0.577	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-74.5	165.7	177.5	0	0	0	0	0	114
122	P	32	Very low	30.9	Very low	74 Å²	74	113.9 Å²	113.9	48%	0.481	69%	0.686	S	S	.	*	P	Polyproline II helix	trans	-72.2	145	-170.3	28.2	-34.1	0	0	0	114.1	L107	L107-P122 HydrophobicContact CD1-CB 4.13Å; L107-P122 HydrophobicContact CD1-CG 4.25Å; L107-P122 HydrophobicContact CD2-CB 3.56Å; L107-P122 HydrophobicContact CD2-CG 4.25Å; L107-P122 HydrophobicContact CG-CB 3.78Å; L107-P122 HydrophobicContact CG-CG 4.44Å
123	L	32	Very low	31	Very low	96 Å²	96	113.9 Å²	113.9	50%	0.503	68%	0.684	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.1	134.4	174	-108.3	150.2	0	0	0	110.4	L19 L108	L19-L123 HydrophobicContact CD1-CD2 3.95Å; L108-L123 PolarHBondContact N-O 3.5Å
124	L	34.1	Very low	30.9	Very low	52 Å²	52	117 Å²	117	27%	0.272	69%	0.693	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102	127.3	177.1	-81.3	147	0	0	0	109.8	P100 W105	P100-L124 HydrophobicContact CG-CD1 3.95Å; P100-L124 HydrophobicContact CG-CD2 4.43Å; W105-L124 HydrophobicContact CB-CD2 3.54Å; W105-L124 HydrophobicContact CE3-CB 4.2Å; W105-L124 HydrophobicContact CG-CD2 4.38Å
125	V	34.8	Very low	30.8	Very low	39 Å²	39	113.8 Å²	113.8	24%	0.236	69%	0.686	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.1	141.5	175.2	-178.1	0	0	0	0	110.2	W105 A106 L108	W105-V125 CarbonylContact C-O 3.58Å; W105-V125 VanDerWaalsContact CA-O 3.29Å; W105-V125 WeakPolarHBondContact CA-O 3.48Å; W105-V125 VanDerWaalsContact CE3-C 3.49Å; A106-V125 PolarHBondContact N-O 3.32Å; A106-V125 PolarHBondContact O-N 2.89Å; L108-V125 HydrophobicContact CD1-CG2 4.3Å
126	R	33.9	Very low	30.5	Very low	146 Å²	146	116.3 Å²	116.3	55%	0.551	69%	0.694	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76.4	141.4	-179.7	-163.7	-178.9	179.4	-173.3	-0.7	111.4	G104 W105 G128	G104-R126 CarbonylContact O-C 3.56Å; G104-R126 WeakPolarHBondContact O-CA 3.47Å; G104-R126 VanDerWaalsContact O-CG 3.28Å; G104-R126 WeakPolarHBondContact O-CG 3.28Å; W105-R126 HydrophobicContact CD2-CB 4.3Å; W105-R126 HydrophobicContact CE3-CB 4.02Å; W105-R126 HydrophobicContact CH2-CB 4.17Å; W105-R126 HydrophobicContact CZ2-CB 4.45Å; W105-R126 HydrophobicContact CZ3-CB 3.95Å; R126-G128 PolarHBondContact O-N 3.32Å; R126-G128 VanDerWaalsContact O-N 3.11Å
127	R	30.1	Very low	30	Very low	231 Å²	231	121.4 Å²	121.4	87%	0.872	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	110.6	170.9	-118.9	-175.8	177.9	-177	-0.4	109.2	G104	G104-R127 PolarHBondContact O-N 3.11Å
128	G	36.1	Very low	29.7	Very low	83 Å²	83	125.3 Å²	125.3	86%	0.856	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.3	-1.8	172.9	0	0	0	0	0	117.2	R126	R126-G128 PolarHBondContact O-N 3.32Å; R126-G128 VanDerWaalsContact O-N 3.11Å
129	E	32.3	Very low	29.4	Very low	136 Å²	136	127.1 Å²	127.1	64%	0.636	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-90.3	132.8	172.5	-76.9	-178.2	165.6	0	0	111.7
130	S	28.5	Very low	29.2	Very low	116 Å²	116	123.2 Å²	123.2	81%	0.811	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-81.3	125.6	169.1	49.1	0	0	0	0	110.3	P132	S130-P132 WeakPolarHBondContact O-CD 3.38Å
131	L	31.7	Very low	28.9	Very low	141 Å²	141	123.7 Å²	123.7	74%	0.738	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-69.2	125.1	173.4	-75.6	160.8	0	0	0	109.9	V133	L131-V133 PolarHBondContact O-N 2.82Å
132	P	29.9	Very low	28.6	Very low	120 Å²	120	132.4 Å²	132.4	78%	0.779	72%	0.719	S	S	*	*			trans	-90.1	79.6	175.5	34.8	-29.8	0	0	0	109.7	S130	S130-P132 WeakPolarHBondContact O-CD 3.38Å
133	V	31.2	Very low	28.6	Very low	124 Å²	124	134.8 Å²	134.8	75%	0.752	74%	0.735	S	S	*	*			trans	-147.7	131.7	159.5	-169.4	0	0	0	0	110	L131	L131-V133 PolarHBondContact O-N 2.82Å
134	P	29.1	Very low	28.3	Very low	126 Å²	126	135.1 Å²	135.1	82%	0.818	75%	0.751	S	S	*	*			trans	-79.5	128	176.9	30.8	-31.9	0	0	0	113
135	G	26.7	Very low	28.1	Very low	76 Å²	76	140.5 Å²	140.5	78%	0.784	78%	0.779	S	S	*	*			trans	81	134.5	156.5	0	0	0	0	0	117.6
136	S	25.1	Very low	27.9	Very low	114 Å²	114	148 Å²	148	80%	0.797	81%	0.811	S	S	*	*			cis	-162.7	129.6	-12.3	55.9	0	0	0	0	108.6
137	R	22.1	Very low	27.7	Very low	253 Å²	253	144.6 Å²	144.6	96%	0.955	82%	0.823	S	S	*	*			trans	-156.7	84.1	143.8	-78.3	-157	-179.4	176.8	-0.3	107.2
138	V	22.3	Very low	27.8	Very low	139 Å²	139	141.7 Å²	141.7	84%	0.842	82%	0.823	S	S	*	*			trans	-97.2	119.1	160.9	176.2	0	0	0	0	105.7
139	L	21.2	Very low	27.5	Very low	172 Å²	172	145.7 Å²	145.7	90%	0.901	82%	0.824	S	S	*	*			trans	-112.1	104.5	157.8	-92.8	165.1	0	0	0	104.9
140	E	22.1	Very low	27.5	Very low	168 Å²	168	142 Å²	142	79%	0.785	82%	0.823	S	S	*	*			trans	-157.5	122.5	147.3	-111.8	167.6	-157.6	0	0	110.5
141	T	22	Very low	27.4	Very low	136 Å²	136	143.4 Å²	143.4	83%	0.834	83%	0.829	S	S	*	*			trans	51.2	122.4	153.6	59.7	0	0	0	0	120.9
142	R	23.9	Very low	27.6	Very low	239 Å²	239	140.2 Å²	140.2	90%	0.902	83%	0.83	S	S	*	*			trans	-73.7	169.7	160.7	-67	-176	176.7	178.4	-0.1	110.2
143	P	32.5	Very low	27.5	Very low	124 Å²	124	140.4 Å²	140.4	81%	0.805	83%	0.829	S	S	*	*			cis	-137.1	133.2	9.5	35.3	-14.3	0	0	0	115.5
144	A	25.1	Very low	27.2	Very low	102 Å²	102	146 Å²	146	84%	0.843	84%	0.837	S	S	*	*			trans	-158.4	110.7	144.9	0	0	0	0	0	107.7
145	L	29.7	Very low	26.9	Very low	166 Å²	166	148.1 Å²	148.1	87%	0.869	84%	0.84	S	S	*	*			trans	-66.2	167	163.9	-92.8	161	0	0	0	109.8
146	Q	30	Very low	26.6	Very low	195 Å²	195	149 Å²	149	91%	0.911	84%	0.841	S	S	*	*			trans	83.1	100.6	167.1	-77.3	165.8	-54.1	0	0	117
147	G	29.3	Very low	26.5	Very low	76 Å²	76	150 Å²	150	78%	0.784	84%	0.842	S	S	*	*	S	Bend	trans	-176.2	-36.2	148.3	0	0	0	0	0	115.5
148	L	32.7	Very low	26.5	Very low	169 Å²	169	144.5 Å²	144.5	89%	0.885	84%	0.836	S	S	*	*	S	Bend	trans	-137	25.1	-153.9	-86.2	164.2	0	0	0	117.5
149	L	29.8	Very low	26.6	Very low	168 Å²	168	146.5 Å²	146.5	88%	0.88	84%	0.836	S	S	*	*			trans	-136.7	110.5	166.4	-70.9	170.7	0	0	0	110.2
150	G	33.1	Very low	26.6	Very low	59 Å²	59	146.8 Å²	146.8	61%	0.608	84%	0.838	S	S	*	*			trans	-66.3	163.9	170.7	0	0	0	0	0	112.2	G152	G150-G152 PolarHBondContact O-N 3.48Å
151	P	26.3	Very low	26.8	Very low	144 Å²	144	150.2 Å²	150.2	94%	0.935	84%	0.844	S	S	*	*	S	Bend	trans	-73.8	111.5	-176.6	30.1	-31.9	0	0	0	109.8
152	G	35.7	Very low	27	Very low	74 Å²	74	147.6 Å²	147.6	76%	0.763	84%	0.844	S	S	*	*			trans	167.8	-6.4	170.5	0	0	0	0	0	121	G150	G150-G152 PolarHBondContact O-N 3.48Å
153	T	27.1	Very low	27.1	Very low	124 Å²	124	148.5 Å²	148.5	76%	0.761	85%	0.847	S	S	*	*			trans	-118	105.2	-172	17.4	0	0	0	0	113.3
154	R	24.6	Very low	26.8	Very low	242 Å²	242	147.2 Å²	147.2	91%	0.913	85%	0.847	S	S	*	*			trans	-96.3	133.4	163.6	-64.4	179.9	178.4	-177.2	-0.7	108.3
155	L	22.7	Very low	26.9	Very low	170 Å²	170	152.6 Å²	152.6	89%	0.89	85%	0.851	S	S	*	*			trans	-135.3	126	166.2	-89.3	166.2	0	0	0	111.3
156	A	22.3	Very low	26.8	Very low	96 Å²	96	152.9 Å²	152.9	79%	0.793	85%	0.853	S	S	*	*			trans	-88.6	150.7	178.5	0	0	0	0	0	110.9
157	V	22.1	Very low	26.5	Very low	135 Å²	135	146.7 Å²	146.7	82%	0.818	84%	0.841	S	S	*	*			trans	-110.4	125.6	177.4	179.1	0	0	0	0	108.5
158	T	22.8	Very low	27	Very low	137 Å²	137	148.8 Å²	148.8	84%	0.84	84%	0.841	S	S	*	*			trans	-129.7	131.6	165	43.9	0	0	0	0	109.2
159	E	22.9	Very low	26.6	Very low	181 Å²	181	149.8 Å²	149.8	85%	0.846	84%	0.841	S	S	*	*			trans	-84.8	138.4	178.1	-67.5	-173.4	158.3	0	0	111
160	L	23	Very low	26.6	Very low	177 Å²	177	146.7 Å²	146.7	93%	0.927	83%	0.833	S	S	*	*			trans	-127.8	117.9	165	-86.8	165.2	0	0	0	110.1
161	R	25	Very low	26.2	Very low	241 Å²	241	150.6 Å²	150.6	91%	0.909	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-78.9	146.4	170	-80.4	-176.3	177.1	-178.1	-0	111.3
162	G	26.7	Very low	26.3	Very low	81 Å²	81	151.6 Å²	151.6	84%	0.835	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-81	154.6	175.8	0	0	0	0	0	115.1
163	R	25.1	Very low	25.8	Very low	257 Å²	257	155.9 Å²	155.9	97%	0.97	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-74	143	177.2	-97.3	177.1	169.2	174.7	-3.6	113
164	A	26.1	Very low	26.1	Very low	97 Å²	97	155.1 Å²	155.1	80%	0.802	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-86	149.3	162.8	0	0	0	0	0	111.5
165	K	28.1	Very low	26.1	Very low	215 Å²	215	155.6 Å²	155.6	94%	0.935	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-97.3	128.7	167.6	-84.9	-177.3	176	179.4	0	109.9
166	L	27.6	Very low	26.3	Very low	173 Å²	173	155.4 Å²	155.4	91%	0.906	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-92	145.3	170.2	-94.2	142.1	0	0	0	110.2
167	G	24.5	Very low	26.7	Very low	64 Å²	64	156.1 Å²	156.1	66%	0.66	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-81.4	168	154.5	0	0	0	0	0	111.3
168	P	39.1	Very low	27.1	Very low	120 Å²	120	155.1 Å²	155.1	78%	0.779	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-96.3	142.6	-161.6	36.5	-30.3	0	0	0	112.4
169	E	24.3	Very low	27.5	Very low	191 Å²	191	153.9 Å²	153.9	89%	0.893	83%	0.826	S	S	*	*				-178.4	150.7	108.3	-94.6	-176.4	-175.1	0	0	110.9
170	S	29.2	Very low	28	Very low	102 Å²	102	151.4 Å²	151.4	71%	0.713	83%	0.825	S	S	*	*			trans	-70.3	142.2	-166	49.9	0	0	0	0	115.3
171	T	24.7	Very low	28.6	Very low	142 Å²	142	150 Å²	150	87%	0.871	82%	0.823	S	S	*	*				172.1	161.3	120.4	32.1	0	0	0	0	112.2
172	Q	29.3	Very low	28.9	Very low	165 Å²	165	142.6 Å²	142.6	77%	0.771	81%	0.814	S	S	*	*			trans	-74.1	166.5	-164.1	-64.9	162.4	-30.3	0	0	115.2
173	H	25	Very low	29.6	Very low	163 Å²	163	142.6 Å²	142.6	76%	0.755	80%	0.801	S	S	*	*			trans	96.8	100.1	161.1	-61.8	-66.6	0	0	0	120
174	S	32.6	Very low	30.4	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	77%	0.772	S	S	*	*			trans	37.4	106.7	138.1	61	0	0	0	0	119.8
175	R	25.2	Very low	31.2	Very low	251 Å²	251	129.6 Å²	129.6	95%	0.947	74%	0.74	S	S	*	*			trans	-125.8	122.6	143.3	-77.8	-173.5	175.7	-179.9	-0.9	109.4
176	L	26.2	Very low	31.5	Very low	166 Å²	166	123.3 Å²	123.3	87%	0.869	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-52.8	151.8	173.2	-77	144	0	0	0	111.3
177	P	31.9	Very low	32.1	Very low	111 Å²	111	120.2 Å²	120.2	72%	0.721	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-65.7	146.2	172.9	28.7	-32.2	0	0	0	110.4
178	P	30.6	Very low	32.8	Very low	114 Å²	114	121 Å²	121	74%	0.74	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-65	150.2	169.1	29.4	-32.6	0	0	0	109.6
179	P	29.9	Very low	32.9	Very low	112 Å²	112	123.1 Å²	123.1	73%	0.727	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-65.4	157.9	-177.1	28.6	-34	0	0	0	111.4	V181	P179-V181 PolarHBondContact O-N 3.4Å
180	P	34	Very low	33.9	Very low	129 Å²	129	115.4 Å²	115.4	84%	0.838	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-60.9	131.4	177.5	25.9	-33.3	0	0	0	110.4	A182	P180-A182 PolarHBondContact O-N 3.19Å
181	V	35.4	Very low	35.2	Very low	146 Å²	146	113.7 Å²	113.7	89%	0.885	67%	0.665	S	S	*	*			trans	-62.8	103.5	173.7	179.9	0	0	0	0	108	P179 S183	P179-V181 PolarHBondContact O-N 3.4Å; V181-S183 PolarHBondContact O-N 3.49Å
182	A	32.2	Very low	37.2	Very low	86 Å²	86	112.1 Å²	112.1	71%	0.711	64%	0.643	S	S	*	*			trans	-59.7	129.4	169.3	0	0	0	0	0	108.9	P180 S184	P180-A182 PolarHBondContact O-N 3.19Å; A182-S184 PolarHBondContact O-N 3.38Å
183	S	39.9	Very low	39.1	Very low	81 Å²	81	109.4 Å²	109.4	57%	0.566	63%	0.63	S	S	*	*			trans	-59.1	126.4	175.3	55.2	0	0	0	0	109.7	V181 F185 A186	V181-S183 PolarHBondContact O-N 3.49Å; S183-F185 PolarHBondContact O-N 3.44Å; S183-A186 WeakPolarHBondContact O-CB 3.48Å; S183-A186 PolarHBondContact O-N 2.83Å; S183-A186 VanDerWaalsContact O-N 3.12Å
184	S	43.7	Very low	41.3	Very low	52 Å²	52	102.4 Å²	102.4	36%	0.364	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.7	2.8	-176.7	54.9	0	0	0	0	114.3	A182 G214	A182-S184 PolarHBondContact O-N 3.38Å; S184-G214 PolarHBondContact OG-O 3.4Å
185	F	41.5	Very low	43	Very low	29 Å²	29	103.3 Å²	103.3	13%	0.127	59%	0.589	C	S	.	*	T	Hydrogen-bonded Turn	trans	-114.4	15.5	173.2	-91.6	-88	0	0	0	113.7	S183 V187 R192 L215 R295	S183-F185 PolarHBondContact O-N 3.44Å; F185-V187 PolarHBondContact O-N 3.5Å; F185-V187 VanDerWaalsContact O-N 3.08Å; F185-R192 HydrophobicContact CE2-CG 4.22Å; F185-R192 HydrophobicContact CZ-CG 4.12Å; F185-L215 WeakPolarHBondContact CD2-O 3.49Å; F185-L215 HydrophobicContact CE2-CB 4.43Å; F185-L215 HydrophobicContact CE2-CD2 4.47Å; F185-L215 WeakPolarHBondContact CE2-O 3.48Å; F185-R295 HydrophobicContact CD1-CG 4.5Å; F185-R295 HydrophobicContact CE1-CG 4.23Å
186	A	35	Very low	44.9	Very low	84 Å²	84	91.9 Å²	91.9	69%	0.694	55%	0.549	S	S	*	.	S	Bend	trans	-64.1	-5.4	167.7	0	0	0	0	0	113.5	S183	S183-A186 WeakPolarHBondContact O-CB 3.48Å; S183-A186 PolarHBondContact O-N 2.83Å; S183-A186 VanDerWaalsContact O-N 3.12Å
187	V	39.2	Very low	46.9	Very low	107 Å²	107	85.1 Å²	85.1	65%	0.648	51%	0.514	S	S	*	.	S	Bend	trans	-113.6	118.6	174	-174.1	0	0	0	0	109.5	F185 H189	F185-V187 PolarHBondContact O-N 3.5Å; F185-V187 VanDerWaalsContact O-N 3.08Å; V187-H189 PolarHBondContact O-N 3.32Å
188	S	39.2	Very low	48.5	Very low	82 Å²	82	81.4 Å²	81.4	57%	0.573	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	1.2	-166.2	-170.3	0	0	0	0	117.7
189	H	42.3	Very low	49.8	Very low	163 Å²	163	76.5 Å²	76.5	76%	0.755	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.3	19.7	-170.3	-73.5	-70.6	0	0	0	115.6	V187 V191	V187-H189 PolarHBondContact O-N 3.32Å; H189-V191 PolarHBondContact O-N 3.1Å; H189-V191 VanDerWaalsContact O-N 3.12Å
190	A	45.8	Very low	51	Low	29 Å²	29	72.7 Å²	72.7	24%	0.24	44%	0.439	C	S	.	.			trans	-74.3	105.8	-177.8	0	0	0	0	0	112.5
191	V	56.2	Low	51.9	Low	66 Å²	66	72.8 Å²	72.8	40%	0.4	44%	0.438	S	S	.	.			trans	-72.9	126.2	167.8	-171.7	0	0	0	0	108.9	H189 R292 Q294	H189-V191 PolarHBondContact O-N 3.1Å; H189-V191 VanDerWaalsContact O-N 3.12Å; V191-R292 HydrophobicContact CG1-CB 3.74Å; V191-R292 HydrophobicContact CG1-CG 3.89Å; V191-Q294 HydrophobicContact CB-CG 4.45Å; V191-Q294 HydrophobicContact CG1-CG 4.21Å; V191-Q294 HydrophobicContact CG2-CG 3.99Å
192	R	65.6	Low	53.1	Low	110 Å²	110	67.6 Å²	67.6	42%	0.415	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	138.7	177	-66.9	-71.3	-175.2	175	-3.4	110.4	F185 L215 R292 I293	F185-R192 HydrophobicContact CE2-CG 4.22Å; F185-R192 HydrophobicContact CZ-CG 4.12Å; R192-L215 HydrophobicContact CB-CD2 4.18Å; R192-L215 HydrophobicContact CG-CD2 4.22Å; R192-R292 WeakPolarHBondContact O-CA 3.42Å; R192-I293 PolarHBondContact N-O 3.47Å; R192-I293 PolarHBondContact O-N 3.33Å
193	Q	70.2	Confident	54.6	Low	107 Å²	107	65.9 Å²	65.9	50%	0.5	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.7	173.8	-68.5	173.8	-53.2	0	0	109.2	V228 E290 L291	Q193-V228 HydrophobicContact CG-CG2 3.99Å; Q193-E290 PolarHBondContact NE2-OE2 3.24Å; Q193-L291 CarbonylContact C-O 3.44Å; Q193-L291 VanDerWaalsContact CA-O 3.3Å; Q193-L291 WeakPolarHBondContact CA-O 3.44Å
194	L	70.3	Confident	56.2	Low	16 Å²	16	62.4 Å²	62.4	8%	0.084	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	152.7	175.3	-65.1	170.3	0	0	0	109.2	L215 V271 E290 L291 I293	L194-L215 HydrophobicContact CD1-CD1 3.69Å; L194-L215 HydrophobicContact CD1-CD2 4.13Å; L194-L215 HydrophobicContact CD1-CG 4.5Å; L194-V271 HydrophobicContact CB-CG2 3.76Å; L194-V271 HydrophobicContact CD1-CG2 3.41Å; L194-V271 VanDerWaalsContact CD1-CG2 3.41Å; L194-V271 HydrophobicContact CG-CG2 4.15Å; L194-E290 CarbonylContact O-C 3.58Å; L194-E290 WeakPolarHBondContact O-CA 3.44Å; L194-L291 PolarHBondContact N-O 3.05Å; L194-L291 PolarHBondContact O-N 2.59Å; L194-I293 HydrophobicContact CD1-CD1 3.54Å; L194-I293 HydrophobicContact CD1-CG1 4.17Å
195	K	69.6	Low	57.8	Low	129 Å²	129	60 Å²	60	56%	0.561	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	120.9	175.7	-71.2	-173.9	178.4	-176.1	0	109.4	G269 L270 V271 E290	K195-G269 PolarHBondContact N-O 2.79Å; K195-L270 HydrophobicContact CB-CD2 4.09Å; K195-L270 WeakPolarHBondContact O-CA 3.46Å; K195-V271 PolarHBondContact O-N 3.35Å; K195-E290 HydrophobicContact CG-CG 4.39Å
196	G	65.3	Low	59.6	Low	10 Å²	10	58.6 Å²	58.6	10%	0.103	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	142.9	174.4	0	0	0	0	0	111.5	V271 V288 G289	G196-V271 CarbonylContact C-O 3.4Å; G196-V271 WeakPolarHBondContact CA-O 3.23Å; G196-V288 WeakPolarHBondContact O-CB 3.08Å; G196-G289 PolarHBondContact N-O 3.07Å
197	V	66.3	Low	61.6	Low	25 Å²	25	54.7 Å²	54.7	15%	0.152	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	140.9	165.7	178.4	0	0	0	0	107.5	G199 L255 L270 V271 F272 V273	V197-G199 PolarHBondContact O-N 3.22Å; V197-L255 HydrophobicContact CG1-CD1 4.01Å; V197-L270 HydrophobicContact CG2-CD2 3.61Å; V197-V271 PolarHBondContact N-O 2.81Å; V197-F272 HydrophobicContact CB-CD1 4.32Å; V197-F272 HydrophobicContact CB-CE1 4.31Å; V197-F272 HydrophobicContact CG1-CD1 4.35Å; V197-F272 HydrophobicContact CG1-CE1 4.08Å; V197-F272 CarbonylContact O-C 3.41Å; V197-F272 VanDerWaalsContact O-CA 3.27Å; V197-F272 WeakPolarHBondContact O-CA 3.42Å; V197-V273 PolarHBondContact O-N 3.42Å
198	L	66.6	Low	63.4	Low	32 Å²	32	50.3 Å²	50.3	17%	0.168	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	125.9	174.3	-78.6	-172.4	0	0	0	111.2	A278 P285 V288 L433	L198-A278 HydrophobicContact CD2-CB 3.43Å; L198-A278 VanDerWaalsContact CD2-CB 3.43Å; L198-P285 HydrophobicContact CD1-CB 3.41Å; L198-P285 VanDerWaalsContact CD1-CB 3.41Å; L198-P285 WeakPolarHBondContact CD1-O 3.06Å; L198-P285 HydrophobicContact CG-CB 4.48Å; L198-P285 VanDerWaalsContact CG-O 3.28Å; L198-P285 WeakPolarHBondContact CG-O 3.45Å; L198-V288 HydrophobicContact CD2-CG2 4.11Å; L198-V288 HydrophobicContact CG-CG2 3.86Å; L198-L433 HydrophobicContact CD1-CD1 4.32Å
199	G	57.9	Low	64.9	Low	11 Å²	11	54 Å²	54	11%	0.113	29%	0.288	C	S	.	.			trans	170.2	153.6	175	0	0	0	0	0	111.7	V197 F272 V273	V197-G199 PolarHBondContact O-N 3.22Å; G199-F272 CarbonylContact O-C 3.58Å; G199-F272 VanDerWaalsContact O-C 3.31Å; G199-F272 WeakPolarHBondContact O-CB 3.39Å; G199-V273 PolarHBondContact N-O 3.37Å; G199-V273 CarbonylContact O-C 3.6Å; G199-V273 PolarHBondContact O-N 3.47Å
200	G	55.5	Low	66.1	Low	32 Å²	32	49 Å²	49	33%	0.33	27%	0.271	S	S	.	.			trans	111.5	169.9	-176.6	0	0	0	0	0	113.1
201	T	52.3	Low	67.3	Low	132 Å²	132	48 Å²	48	81%	0.81	26%	0.263	S	S	*	.	S	Bend	trans	-131.4	129.8	-178.3	51.5	0	0	0	0	109.1
202	G	61.3	Low	68.2	Low	36 Å²	36	46 Å²	46	37%	0.371	25%	0.25	S	C	.	.	S	Bend	trans	87.3	-156.9	179.7	0	0	0	0	0	113.5	A204 P274	G202-A204 VanDerWaalsContact C-N 3.33Å; G202-A204 PolarHBondContact O-N 3.16Å; G202-P274 WeakPolarHBondContact O-CB 3.45Å; G202-P274 WeakPolarHBondContact O-CG 3.39Å
203	D	63.5	Low	68.4	Low	51 Å²	51	48.9 Å²	48.9	27%	0.273	26%	0.26	S	S	.	.	S	Bend	trans	-98.1	24.3	-169.1	-47.9	-44.5	0	0	0	112.7	R349	D203-R349 IonicContact OD2-NH1 3.42Å; D203-R349 PolarHBondContact OD2-NH1 2.98Å
204	A	74.1	Confident	68.2	Low	8 Å²	8	46.1 Å²	46.1	7%	0.066	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135.3	-172.6	0	0	0	0	0	112.8	G202 K241 Q243 P274	G202-A204 VanDerWaalsContact C-N 3.33Å; G202-A204 PolarHBondContact O-N 3.16Å; A204-K241 CarbonylContact C-O 3.58Å; A204-K241 WeakPolarHBondContact CA-O 3.34Å; A204-K241 HydrophobicContact CB-CB 4.49Å; A204-K241 WeakPolarHBondContact CB-O 3.34Å; A204-Q243 HydrophobicContact CB-CB 4.12Å; A204-Q243 VanDerWaalsContact CB-CD 3.41Å; A204-Q243 HydrophobicContact CB-CG 3.66Å; A204-P274 WeakPolarHBondContact O-CD 3.31Å; A204-P274 WeakPolarHBondContact O-CG 3.49Å
205	L	77	Confident	68.2	Low	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	123.2	172.5	-62.9	173.3	0	0	0	110	V225 A240 K241 V242 Q243 V271 V273 L277 I293	L205-V225 HydrophobicContact CD1-CG2 3.44Å; L205-V225 VanDerWaalsContact CD1-CG2 3.44Å; L205-V225 HydrophobicContact CD2-CG2 4.42Å; L205-V225 HydrophobicContact CG-CG2 4.34Å; L205-A240 HydrophobicContact CD1-CB 3.95Å; L205-A240 HydrophobicContact CD2-CB 4.45Å; L205-A240 HydrophobicContact CG-CB 3.78Å; L205-K241 PolarHBondContact N-O 3.12Å; L205-V242 HydrophobicContact CD1-CG2 4.48Å; L205-Q243 PolarHBondContact O-N 3.42Å; L205-V271 HydrophobicContact CB-CG1 4.14Å; L205-V271 HydrophobicContact CD2-CG1 4.19Å; L205-V273 HydrophobicContact CD2-CG1 4.29Å; L205-V273 HydrophobicContact CD2-CG2 4.14Å; L205-L277 HydrophobicContact CD2-CD2 3.92Å; L205-I293 HydrophobicContact CD1-CD1 4.21Å
206	G	77.9	Confident	68	Low	1 Å²	1	41 Å²	41	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	120.4	173.8	0	0	0	0	0	111.6	Q243 F272	G206-Q243 WeakPolarHBondContact CA-O 3.49Å; G206-F272 PolarHBondContact N-O 2.92Å; G206-F272 PolarHBondContact O-N 2.76Å
207	V	77.2	Confident	68.3	Low	1 Å²	1	40.8 Å²	40.8	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	145.2	179.1	-173.8	0	0	0	0	110.1	C211 L212 L215 V242 Q243 L245 V271	V207-C211 HydrophobicContact CG1-CB 3.48Å; V207-C211 VanDerWaalsContact CG1-CB 3.48Å; V207-C211 VanDerWaalsContact CG1-SG 3.51Å; V207-L212 HydrophobicContact CG1-CB 4.3Å; V207-L215 HydrophobicContact CG1-CD1 4.47Å; V207-V242 HydrophobicContact CB-CG1 4.25Å; V207-V242 HydrophobicContact CG2-CG1 3.84Å; V207-Q243 PolarHBondContact N-O 3.04Å; V207-L245 PolarHBondContact O-N 3.47Å; V207-L245 VanDerWaalsContact O-N 3.16Å; V207-V271 HydrophobicContact CG2-CG1 4.12Å; V207-V271 HydrophobicContact CG2-CG2 4.22Å
208	T	77	Confident	68.6	Low	16 Å²	16	46.2 Å²	46.2	10%	0.098	26%	0.264	C	S	.	.			trans	-70.1	158.5	174.4	63.3	0	0	0	0	111.5	S210 C211 L212 L266	T208-S210 VanDerWaalsContact C-N 3.28Å; T208-S210 PolarHBondContact O-N 3.21Å; T208-S210 PolarHBondContact OG1-OG 3.39Å; T208-C211 PolarHBondContact O-N 3Å; T208-C211 WeakPolarHBondContact OG1-CB 3.42Å; T208-C211 PolarHBondContact OG1-N 3.46Å; T208-L212 WeakPolarHBondContact O-CB 3.34Å; T208-L212 PolarHBondContact O-N 3.48Å; T208-L266 HydrophobicContact CG2-CB 4.2Å; T208-L266 HydrophobicContact CG2-CD1 4.13Å; T208-L266 HydrophobicContact CG2-CD2 3.8Å; T208-L266 HydrophobicContact CG2-CG 4.27Å
209	R	71.2	Confident	69.1	Low	160 Å²	160	51.1 Å²	51.1	60%	0.604	29%	0.287	S	S	*	.	H	α-helix	trans	-61.9	-35.1	179.4	-161	176.6	-177.4	178.4	2.7	113.1	R213 L244	R209-R213 WeakPolarHBondContact O-CG 3.29Å; R209-R213 PolarHBondContact O-N 2.97Å; R209-L244 HydrophobicContact CB-CD1 3.75Å; R209-L244 HydrophobicContact CG-CD1 4.13Å
210	S	68.1	Low	69.8	Low	56 Å²	56	51.4 Å²	51.4	39%	0.392	29%	0.289	S	S	.	.	H	α-helix	trans	-69.4	-46.4	177	50.7	0	0	0	0	111	T208 R213 G214 D268	T208-S210 VanDerWaalsContact C-N 3.28Å; T208-S210 PolarHBondContact O-N 3.21Å; T208-S210 PolarHBondContact OG1-OG 3.39Å; S210-R213 PolarHBondContact O-N 3.26Å; S210-G214 PolarHBondContact O-N 3.17Å; S210-D268 WeakPolarHBondContact CB-OD1 3.34Å; S210-D268 PolarHBondContact OG-OD1 3.47Å
211	C	70.5	Confident	70.9	Confident	9 Å²	9	50.9 Å²	50.9	6%	0.061	28%	0.278	C	S	.	.	H	α-helix	trans	-64.2	-42.6	178.2	-173.8	0	0	0	0	111.7	V207 T208 R213 G214 L215	V207-C211 HydrophobicContact CG1-CB 3.48Å; V207-C211 VanDerWaalsContact CG1-CB 3.48Å; V207-C211 VanDerWaalsContact CG1-SG 3.51Å; T208-C211 PolarHBondContact O-N 3Å; T208-C211 WeakPolarHBondContact OG1-CB 3.42Å; T208-C211 PolarHBondContact OG1-N 3.46Å; C211-R213 VanDerWaalsContact C-N 3.31Å; C211-R213 PolarHBondContact O-N 3.01Å; C211-G214 PolarHBondContact O-N 2.86Å; C211-G214 VanDerWaalsContact O-N 3.15Å; C211-L215 WeakPolarHBondContact O-CB 3.38Å; C211-L215 VanDerWaalsContact O-CG 3.22Å; C211-L215 WeakPolarHBondContact O-CG 3.42Å; C211-L215 PolarHBondContact O-N 3.37Å
212	L	73.8	Confident	72.2	Confident	24 Å²	24	46.9 Å²	46.9	13%	0.126	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-39.2	175.5	-173.1	149.8	0	0	0	112.2	V207 T208 G216 L217 V242	V207-L212 HydrophobicContact CG1-CB 4.3Å; T208-L212 WeakPolarHBondContact O-CB 3.34Å; T208-L212 PolarHBondContact O-N 3.48Å; L212-G216 PolarHBondContact O-N 3.39Å; L212-L217 WeakPolarHBondContact CD2-O 3.3Å; L212-L217 WeakPolarHBondContact CG-O 3.32Å; L212-L217 PolarHBondContact O-N 3.45Å; L212-V242 HydrophobicContact CD1-CG1 4.26Å
213	R	70.4	Confident	73.1	Confident	170 Å²	170	45.1 Å²	45.1	64%	0.642	23%	0.23	S	C	*	.	H	α-helix	trans	-70	-40	173.5	-74.7	175.1	173.9	-177.2	-2.8	112.8	R209 S210 C211 L215 G216	R209-R213 WeakPolarHBondContact O-CG 3.29Å; R209-R213 PolarHBondContact O-N 2.97Å; S210-R213 PolarHBondContact O-N 3.26Å; C211-R213 VanDerWaalsContact C-N 3.31Å; C211-R213 PolarHBondContact O-N 3.01Å; R213-L215 VanDerWaalsContact C-N 3.29Å; R213-L215 PolarHBondContact O-N 3.19Å; R213-G216 PolarHBondContact O-N 3.46Å; R213-G216 VanDerWaalsContact O-N 3.13Å
214	G	66.3	Low	73.9	Confident	49 Å²	49	44.6 Å²	44.6	51%	0.505	23%	0.225	S	C	.	.	H	α-helix	trans	-65.8	-31.8	176.3	0	0	0	0	0	113.2	S184 S210 C211	S184-G214 PolarHBondContact OG-O 3.4Å; S210-G214 PolarHBondContact O-N 3.17Å; C211-G214 PolarHBondContact O-N 2.86Å; C211-G214 VanDerWaalsContact O-N 3.15Å
215	L	69.4	Low	74.2	Confident	9 Å²	9	44.2 Å²	44.2	5%	0.047	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-7.5	172.6	-63.5	169.2	0	0	0	113.1	F185 R192 L194 V207 C211 R213 L217	F185-L215 WeakPolarHBondContact CD2-O 3.49Å; F185-L215 HydrophobicContact CE2-CB 4.43Å; F185-L215 HydrophobicContact CE2-CD2 4.47Å; F185-L215 WeakPolarHBondContact CE2-O 3.48Å; R192-L215 HydrophobicContact CB-CD2 4.18Å; R192-L215 HydrophobicContact CG-CD2 4.22Å; L194-L215 HydrophobicContact CD1-CD1 3.69Å; L194-L215 HydrophobicContact CD1-CD2 4.13Å; L194-L215 HydrophobicContact CD1-CG 4.5Å; V207-L215 HydrophobicContact CG1-CD1 4.47Å; C211-L215 WeakPolarHBondContact O-CB 3.38Å; C211-L215 VanDerWaalsContact O-CG 3.22Å; C211-L215 WeakPolarHBondContact O-CG 3.42Å; C211-L215 PolarHBondContact O-N 3.37Å; R213-L215 VanDerWaalsContact C-N 3.29Å; R213-L215 PolarHBondContact O-N 3.19Å; L215-L217 HydrophobicContact CB-CD1 3.94Å; L215-L217 HydrophobicContact CB-CG 4.03Å; L215-L217 HydrophobicContact CD1-CD1 4.16Å; L215-L217 PolarHBondContact O-N 3.35Å
216	G	66	Low	74.3	Confident	28 Å²	28	45.3 Å²	45.3	29%	0.289	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	17.8	-178	0	0	0	0	0	115.3	L212 R213 R295	L212-G216 PolarHBondContact O-N 3.39Å; R213-G216 PolarHBondContact O-N 3.46Å; R213-G216 VanDerWaalsContact O-N 3.13Å; G216-R295 PolarHBondContact O-NH2 3.14Å
217	L	72.3	Confident	74.1	Confident	6 Å²	6	48.8 Å²	48.8	3%	0.031	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-84.3	155.7	-179.5	-65.3	168.8	0	0	0	110.6	L212 L215 E221 V223 V242 R295	L212-L217 WeakPolarHBondContact CD2-O 3.3Å; L212-L217 WeakPolarHBondContact CG-O 3.32Å; L212-L217 PolarHBondContact O-N 3.45Å; L215-L217 HydrophobicContact CB-CD1 3.94Å; L215-L217 HydrophobicContact CB-CG 4.03Å; L215-L217 HydrophobicContact CD1-CD1 4.16Å; L215-L217 PolarHBondContact O-N 3.35Å; L217-E221 WeakPolarHBondContact CA-OE2 3.46Å; L217-E221 WeakPolarHBondContact CB-OE2 3.41Å; L217-E221 WeakPolarHBondContact CD2-OE2 3.45Å; L217-V223 HydrophobicContact CD1-CG2 4.12Å; L217-V223 HydrophobicContact CD2-CG2 4.29Å; L217-V242 HydrophobicContact CD1-CG2 4.31Å; L217-R295 HydrophobicContact CD2-CG 3.74Å; L217-R295 VanDerWaalsContact CD2-NE 3.33Å
218	F	72.3	Confident	73.5	Confident	139 Å²	139	50.4 Å²	50.4	61%	0.61	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-97.5	155.7	171.2	-65	-71.8	0	0	0	111.7	G220 E221	F218-G220 PolarHBondContact O-N 3.44Å; F218-E221 HydrophobicContact CB-CG 3.93Å; F218-E221 VanDerWaalsContact CD2-OE1 3.27Å; F218-E221 WeakPolarHBondContact CD2-OE1 3.34Å; F218-E221 PolarHBondContact N-OE2 2.75Å; F218-E221 WeakPolarHBondContact O-CB 3.24Å; F218-E221 PolarHBondContact O-N 3.43Å
219	Q	76.4	Confident	72.4	Confident	136 Å²	136	52 Å²	52	64%	0.636	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	124.5	175.4	-179.5	177.9	-0.3	0	0	109.8
220	G	72.3	Confident	70.8	Confident	16 Å²	16	52.7 Å²	52.7	17%	0.165	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	8.4	-179.8	0	0	0	0	0	115.2	F218 K241 V242	F218-G220 PolarHBondContact O-N 3.44Å; G220-K241 VanDerWaalsContact O-CE 3.23Å; G220-K241 WeakPolarHBondContact O-CE 3.5Å; G220-V242 WeakPolarHBondContact CA-O 3.27Å; G220-V242 PolarHBondContact N-O 3.31Å
221	E	79.7	Confident	69.3	Low	21 Å²	21	57.4 Å²	57.4	10%	0.098	30%	0.297	C	S	.	.			trans	-68.9	150	171	-81.5	-174.5	157.8	0	0	112.8	L217 F218 V242 M312	L217-E221 WeakPolarHBondContact CA-OE2 3.46Å; L217-E221 WeakPolarHBondContact CB-OE2 3.41Å; L217-E221 WeakPolarHBondContact CD2-OE2 3.45Å; F218-E221 HydrophobicContact CB-CG 3.93Å; F218-E221 VanDerWaalsContact CD2-OE1 3.27Å; F218-E221 WeakPolarHBondContact CD2-OE1 3.34Å; F218-E221 PolarHBondContact N-OE2 2.75Å; F218-E221 WeakPolarHBondContact O-CB 3.24Å; F218-E221 PolarHBondContact O-N 3.43Å; E221-V242 PolarHBondContact O-N 3.37Å; E221-M312 HydrophobicContact CG-CE 3.44Å; E221-M312 VanDerWaalsContact CG-CE 3.44Å; E221-M312 HydrophobicContact CG-SD 3.53Å; E221-M312 VanDerWaalsContact CG-SD 3.53Å; E221-M312 VanDerWaalsContact OE1-CE 3.28Å; E221-M312 WeakPolarHBondContact OE1-CE 3.27Å
222	W	80.4	Confident	67.8	Low	48 Å²	48	63.3 Å²	63.3	18%	0.182	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	135.8	176.8	-64.2	107.7	0	0	0	111.6	L239 K241 Y296 P315 V350 L401	W222-L239 HydrophobicContact CB-CD1 4.25Å; W222-L239 HydrophobicContact CE3-CD2 4.24Å; W222-L239 HydrophobicContact CE3-CG 4.11Å; W222-K241 HydrophobicContact CE3-CB 4.02Å; W222-K241 HydrophobicContact CH2-CB 4.3Å; W222-K241 HydrophobicContact CH2-CD 4.44Å; W222-K241 HydrophobicContact CZ3-CB 3.78Å; W222-Y296 HydrophobicContact CB-CD1 4.4Å; W222-Y296 HydrophobicContact CB-CG 4.16Å; W222-Y296 WeakPolarHBondContact O-CB 3.47Å; W222-Y296 PolarHBondContact O-N 3.19Å; W222-Y296 VanDerWaalsContact O-N 3.12Å; W222-P315 HydrophobicContact CD2-CG 4.35Å; W222-P315 HydrophobicContact CZ2-CG 4.33Å; W222-V350 HydrophobicContact CE3-CG2 4.22Å; W222-V350 HydrophobicContact CH2-CG2 3.51Å; W222-V350 HydrophobicContact CZ3-CG2 3.23Å; W222-L401 HydrophobicContact CH2-CD2 3.94Å; W222-L401 HydrophobicContact CZ2-CD2 4.14Å
223	V	79.2	Confident	66	Low	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	136.7	-172.6	167.8	0	0	0	0	109.9	L217 V225 A240 V242 I293 Q294	L217-V223 HydrophobicContact CD1-CG2 4.12Å; L217-V223 HydrophobicContact CD2-CG2 4.29Å; V223-V225 HydrophobicContact CG1-CG2 4.33Å; V223-A240 PolarHBondContact N-O 3.41Å; V223-A240 PolarHBondContact O-N 2.81Å; V223-V242 HydrophobicContact CB-CG2 4.14Å; V223-V242 HydrophobicContact CG2-CG2 3.59Å; V223-I293 HydrophobicContact CG1-CB 4.12Å; V223-I293 HydrophobicContact CG1-CG1 4.41Å; V223-I293 HydrophobicContact CG1-CG2 3.35Å; V223-Q294 CarbonylContact C-O 3.59Å; V223-Q294 WeakPolarHBondContact CA-O 3.48Å; V223-Q294 VanDerWaalsContact CG1-O 3.29Å; V223-Q294 WeakPolarHBondContact CG1-O 3.19Å
224	W	80.6	Confident	64.8	Low	40 Å²	40	66.3 Å²	66.3	15%	0.152	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	127.3	165.8	-69.5	114.3	0	0	0	110.7	P237 H238 L239 I293 Q294 Y296 A397 A399	W224-P237 HydrophobicContact CE3-CB 3.98Å; W224-P237 HydrophobicContact CE3-CG 4.4Å; W224-P237 WeakPolarHBondContact CZ3-O 3.49Å; W224-H238 WeakPolarHBondContact CA-O 3.31Å; W224-L239 HydrophobicContact CD2-CD1 4.02Å; W224-L239 HydrophobicContact CE3-CB 4.02Å; W224-L239 HydrophobicContact CE3-CD1 4.23Å; W224-L239 HydrophobicContact CG-CD1 4.49Å; W224-L239 HydrophobicContact CH2-CB 4.15Å; W224-L239 HydrophobicContact CZ2-CD1 4.34Å; W224-L239 HydrophobicContact CZ3-CB 3.75Å; W224-L239 HydrophobicContact CZ3-CD1 4.48Å; W224-I293 WeakPolarHBondContact O-CA 3.47Å; W224-Q294 HydrophobicContact CB-CB 4.25Å; W224-Q294 PolarHBondContact N-O 3.48Å; W224-Q294 PolarHBondContact O-N 3.08Å; W224-Y296 AromaticContact CE2-CD2 3.74Å; W224-Y296 AromaticContact CZ2-CD2 3.94Å; W224-Y296 HydrophobicContact CZ2-CD2 3.94Å; W224-Y296 AromaticContact CZ2-CE2 3.83Å; W224-Y296 HydrophobicContact CZ2-CE2 3.83Å; W224-Y296 AromaticContact NE1-CD2 3.41Å; W224-A397 HydrophobicContact CH2-CB 4.28Å; W224-A397 WeakPolarHBondContact CH2-O 3.16Å; W224-A397 HydrophobicContact CZ3-CB 4.38Å; W224-A399 HydrophobicContact CH2-CB 3.77Å; W224-A399 HydrophobicContact CZ3-CB 4.28Å
225	V	79.4	Confident	64.3	Low	0 Å²	0	66 Å²	66	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.4	177.9	-169.1	0	0	0	0	109.1	L205 V223 P237 H238 A240 L281 L291 R292	L205-V225 HydrophobicContact CD1-CG2 3.44Å; L205-V225 VanDerWaalsContact CD1-CG2 3.44Å; L205-V225 HydrophobicContact CD2-CG2 4.42Å; L205-V225 HydrophobicContact CG-CG2 4.34Å; V223-V225 HydrophobicContact CG1-CG2 4.33Å; V225-P237 CarbonylContact O-C 3.59Å; V225-P237 WeakPolarHBondContact O-CA 3.39Å; V225-H238 PolarHBondContact N-O 3.35Å; V225-H238 PolarHBondContact O-N 3.17Å; V225-A240 HydrophobicContact CG2-CB 4Å; V225-L281 HydrophobicContact CB-CD1 4.31Å; V225-L281 HydrophobicContact CB-CD2 4.41Å; V225-L281 HydrophobicContact CG1-CD1 3.66Å; V225-L281 HydrophobicContact CG1-CD2 4.35Å; V225-L281 VanDerWaalsContact O-CD2 3.31Å; V225-L281 WeakPolarHBondContact O-CD2 3.34Å; V225-L291 HydrophobicContact CG1-CB 4.3Å; V225-L291 HydrophobicContact CG1-CD1 4.38Å; V225-L291 HydrophobicContact CG1-CD2 4.29Å; V225-R292 WeakPolarHBondContact CA-O 3.44Å
226	A	79.1	Confident	64.1	Low	22 Å²	22	70.8 Å²	70.8	18%	0.182	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	152.1	173.1	0	0	0	0	0	110.8	P237 L291 R292	A226-P237 HydrophobicContact CB-CB 4.37Å; A226-L291 CarbonylContact O-C 3.49Å; A226-L291 WeakPolarHBondContact O-CA 3.48Å; A226-R292 HydrophobicContact CB-CB 4.49Å; A226-R292 PolarHBondContact N-O 3.49Å; A226-R292 PolarHBondContact O-N 2.73Å
227	R	74.4	Confident	64.4	Low	74 Å²	74	71.7 Å²	71.7	28%	0.279	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	141.9	176.7	-173.1	179.3	175.8	174.1	2.1	111.1	G282 D284	R227-G282 PolarHBondContact NH1-O 3.07Å; R227-D284 IonicContact NH2-OD2 3.66Å
228	V	64.8	Low	64.6	Low	35 Å²	35	72.3 Å²	72.3	21%	0.212	38%	0.383	C	S	.	.			trans	-88.1	104.4	167.3	-175.3	0	0	0	0	108	Q193 E290 R292	Q193-V228 HydrophobicContact CG-CG2 3.99Å; V228-E290 HydrophobicContact CB-CB 3.93Å; V228-E290 VanDerWaalsContact CB-O 3.3Å; V228-E290 WeakPolarHBondContact CB-O 3.37Å; V228-E290 HydrophobicContact CG2-CB 3.8Å; V228-E290 VanDerWaalsContact CG2-O 3.25Å; V228-E290 WeakPolarHBondContact CG2-O 3.21Å; V228-E290 PolarHBondContact N-O 2.74Å; V228-R292 HydrophobicContact CG2-CG 3.4Å
229	G	54.9	Low	65.1	Low	51 Å²	51	66 Å²	66	53%	0.526	36%	0.356	S	S	.	.	S	Bend	trans	174	157.9	179	0	0	0	0	0	114
230	E	37.3	Very low	65.3	Low	174 Å²	174	59.6 Å²	59.6	81%	0.813	33%	0.326	S	S	*	.	S	Bend	trans	-49.9	132.5	-158.2	-64.4	173.6	164.3	0	0	115.6
231	F	36.5	Very low	65.7	Low	155 Å²	155	62.5 Å²	62.5	68%	0.68	33%	0.334	S	S	*	.			trans	86.3	108.4	-174.7	-53.1	-72.7	0	0	0	116.1	N233 T234	F231-N233 PolarHBondContact O-N 3.1Å; F231-T234 PolarHBondContact O-OG1 3.05Å
232	P	37.8	Very low	65.7	Low	133 Å²	133	61.6 Å²	61.6	86%	0.864	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-0.7	178.4	27.2	-33.2	0	0	0	114.9
233	N	36.7	Very low	65.6	Low	155 Å²	155	63.6 Å²	63.6	83%	0.829	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-3.6	-171.7	-72.2	-1.3	0	0	0	115	F231	F231-N233 PolarHBondContact O-N 3.1Å
234	T	45.1	Very low	65.2	Low	101 Å²	101	66.6 Å²	66.6	62%	0.62	36%	0.357	S	S	*	.	S	Bend	trans	-110.9	-19.2	-167.7	45.8	0	0	0	0	116	F231	F231-T234 PolarHBondContact O-OG1 3.05Å
235	S	55.5	Low	64.5	Low	42 Å²	42	67.4 Å²	67.4	29%	0.294	36%	0.364	S	S	.	.			trans	-115.7	104.8	177.9	56.9	0	0	0	0	111.2
236	Q	65.4	Low	63.1	Low	110 Å²	110	74.7 Å²	74.7	51%	0.514	40%	0.398	S	S	.	.			trans	-66.6	139	170.6	-69.9	-178.7	-9	0	0	109.3	H238	Q236-H238 PolarHBondContact O-CE1 3.06Å; Q236-H238 PolarHBondContact O-ND1 3.4Å
237	P	73	Confident	61.5	Low	47 Å²	47	78.6 Å²	78.6	31%	0.305	42%	0.421	S	S	.	.			trans	-66.2	135.2	175.2	28	-33.4	0	0	0	109.9	W224 V225 A226 Q352 A397	W224-P237 HydrophobicContact CE3-CB 3.98Å; W224-P237 HydrophobicContact CE3-CG 4.4Å; W224-P237 WeakPolarHBondContact CZ3-O 3.49Å; V225-P237 CarbonylContact O-C 3.59Å; V225-P237 WeakPolarHBondContact O-CA 3.39Å; A226-P237 HydrophobicContact CB-CB 4.37Å; P237-Q352 PolarHBondContact O-NE2 3.08Å; P237-A397 HydrophobicContact CG-CB 4.04Å
238	H	76.7	Confident	59.9	Low	20 Å²	20	84 Å²	84	9%	0.093	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	143.1	179	-69.2	72.5	0	0	0	112.1	W224 V225 Q236 N280 L281 Q352 D355	W224-H238 WeakPolarHBondContact CA-O 3.31Å; V225-H238 PolarHBondContact N-O 3.35Å; V225-H238 PolarHBondContact O-N 3.17Å; Q236-H238 PolarHBondContact O-CE1 3.06Å; Q236-H238 PolarHBondContact O-ND1 3.4Å; H238-N280 PolarHBondContact CE1-O 3.3Å; H238-N280 VanDerWaalsContact CE1-O 3.23Å; H238-L281 HydrophobicContact CB-CD2 3.98Å; H238-Q352 PolarHBondContact CD2-OE1 3.14Å; H238-Q352 VanDerWaalsContact CD2-OE1 3.29Å; H238-D355 IonicContact CD2-OD1 4Å; H238-D355 PolarHBondContact CD2-OD1 3.44Å; H238-D355 IonicContact NE2-OD1 3.84Å; H238-D355 PolarHBondContact NE2-OD1 3.05Å
239	L	81.8	Confident	58.6	Low	6 Å²	6	92.7 Å²	92.7	3%	0.031	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	126.7	-178.4	-170.6	70	0	0	0	110.7	W222 W224 Y296 P315 V350 A399	W222-L239 HydrophobicContact CB-CD1 4.25Å; W222-L239 HydrophobicContact CE3-CD2 4.24Å; W222-L239 HydrophobicContact CE3-CG 4.11Å; W224-L239 HydrophobicContact CD2-CD1 4.02Å; W224-L239 HydrophobicContact CE3-CB 4.02Å; W224-L239 HydrophobicContact CE3-CD1 4.23Å; W224-L239 HydrophobicContact CG-CD1 4.49Å; W224-L239 HydrophobicContact CH2-CB 4.15Å; W224-L239 HydrophobicContact CZ2-CD1 4.34Å; W224-L239 HydrophobicContact CZ3-CB 3.75Å; W224-L239 HydrophobicContact CZ3-CD1 4.48Å; L239-Y296 HydrophobicContact CD1-CD2 3.48Å; L239-Y296 VanDerWaalsContact CD1-CD2 3.48Å; L239-Y296 HydrophobicContact CD1-CE2 4.19Å; L239-Y296 HydrophobicContact CD1-CG 4.05Å; L239-Y296 HydrophobicContact CD2-CD2 4.33Å; L239-Y296 HydrophobicContact CD2-CE2 4.29Å; L239-P315 HydrophobicContact CD2-CB 3.72Å; L239-P315 HydrophobicContact CD2-CG 3.59Å; L239-V350 HydrophobicContact CB-CG1 4.11Å; L239-V350 HydrophobicContact CD2-CG1 4.47Å; L239-A399 HydrophobicContact CB-CB 3.76Å; L239-A399 HydrophobicContact CD2-CB 3.78Å; L239-A399 HydrophobicContact CG-CB 4.41Å
240	A	80.6	Confident	57.8	Low	1 Å²	1	92.4 Å²	92.4	1%	0.008	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	154.5	-179.5	0	0	0	0	0	111.9	L205 V223 V225 L277	L205-A240 HydrophobicContact CD1-CB 3.95Å; L205-A240 HydrophobicContact CD2-CB 4.45Å; L205-A240 HydrophobicContact CG-CB 3.78Å; V223-A240 PolarHBondContact N-O 3.41Å; V223-A240 PolarHBondContact O-N 2.81Å; V225-A240 HydrophobicContact CG2-CB 4Å; A240-L277 HydrophobicContact CB-CD1 3.58Å
241	K	81.1	Confident	58	Low	78 Å²	78	86.4 Å²	86.4	34%	0.339	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	134.1	173.9	-169.5	170.4	-176.5	172	0	110.6	A204 L205 G220 W222	A204-K241 CarbonylContact C-O 3.58Å; A204-K241 WeakPolarHBondContact CA-O 3.34Å; A204-K241 HydrophobicContact CB-CB 4.49Å; A204-K241 WeakPolarHBondContact CB-O 3.34Å; L205-K241 PolarHBondContact N-O 3.12Å; G220-K241 VanDerWaalsContact O-CE 3.23Å; G220-K241 WeakPolarHBondContact O-CE 3.5Å; W222-K241 HydrophobicContact CE3-CB 4.02Å; W222-K241 HydrophobicContact CH2-CB 4.3Å; W222-K241 HydrophobicContact CH2-CD 4.44Å; W222-K241 HydrophobicContact CZ3-CB 3.78Å
242	V	79.1	Confident	58.2	Low	1 Å²	1	83.7 Å²	83.7	1%	0.006	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	125.9	176.3	-179.7	0	0	0	0	110.5	L205 V207 L212 L217 G220 E221 V223	L205-V242 HydrophobicContact CD1-CG2 4.48Å; V207-V242 HydrophobicContact CB-CG1 4.25Å; V207-V242 HydrophobicContact CG2-CG1 3.84Å; L212-V242 HydrophobicContact CD1-CG1 4.26Å; L217-V242 HydrophobicContact CD1-CG2 4.31Å; G220-V242 WeakPolarHBondContact CA-O 3.27Å; G220-V242 PolarHBondContact N-O 3.31Å; E221-V242 PolarHBondContact O-N 3.37Å; V223-V242 HydrophobicContact CB-CG2 4.14Å; V223-V242 HydrophobicContact CG2-CG2 3.59Å
243	Q	78.9	Confident	58.3	Low	90 Å²	90	82.7 Å²	82.7	42%	0.421	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	142.9	175.5	-73.5	-174.8	15.2	0	0	111.6	A204 L205 G206 V207 L245	A204-Q243 HydrophobicContact CB-CB 4.12Å; A204-Q243 VanDerWaalsContact CB-CD 3.41Å; A204-Q243 HydrophobicContact CB-CG 3.66Å; L205-Q243 PolarHBondContact O-N 3.42Å; G206-Q243 WeakPolarHBondContact CA-O 3.49Å; V207-Q243 PolarHBondContact N-O 3.04Å; Q243-L245 PolarHBondContact O-N 3.23Å
244	L	70.6	Confident	58.8	Low	63 Å²	63	81.4 Å²	81.4	33%	0.33	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	119.5	173.4	-174.9	75.5	0	0	0	108.8	R209	R209-L244 HydrophobicContact CB-CD1 3.75Å; R209-L244 HydrophobicContact CG-CD1 4.13Å
245	L	65.1	Low	58.7	Low	58 Å²	58	77.8 Å²	77.8	30%	0.304	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-92.6	127.2	174.3	-135.6	106.8	0	0	0	109.8	V207 Q243 F272	V207-L245 PolarHBondContact O-N 3.47Å; V207-L245 VanDerWaalsContact O-N 3.16Å; Q243-L245 PolarHBondContact O-N 3.23Å; L245-F272 HydrophobicContact CD2-CD2 4.12Å; L245-F272 HydrophobicContact CD2-CE2 4.47Å
246	E	50.4	Low	58	Low	153 Å²	153	76.5 Å²	76.5	72%	0.715	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-76.7	134.4	162.4	-67.3	-171.8	166.5	0	0	108.4	R248	E246-R248 PolarHBondContact O-N 3.09Å
247	P	45.8	Very low	56.6	Low	103 Å²	103	74.9 Å²	74.9	67%	0.669	37%	0.367	S	S	*	.			trans	-64.2	105.8	-176.8	25.7	-32.7	0	0	0	109.8	L266	P247-L266 HydrophobicContact CB-CD1 3.94Å
248	R	41.1	Very low	54.8	Low	188 Å²	188	75.4 Å²	75.4	71%	0.709	37%	0.372	S	S	*	.			trans	-85	129.4	164.6	-68.6	-168.8	177.2	-174.6	1.2	108	E246 D250	E246-R248 PolarHBondContact O-N 3.09Å; R248-D250 PolarHBondContact O-N 3.19Å
249	W	37.3	Very low	53.2	Low	217 Å²	217	76.6 Å²	76.6	82%	0.822	38%	0.383	S	S	*	.	S	Bend	trans	-71.3	-1.6	179.8	47.6	-88.3	0	0	0	113.5	L251	W249-L251 PolarHBondContact O-N 2.87Å
250	D	38.2	Very low	50.9	Low	45 Å²	45	79.2 Å²	79.2	24%	0.241	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	12.5	-177.6	-66.9	-25.2	0	0	0	115.2	R248 R254	R248-D250 PolarHBondContact O-N 3.19Å; D250-R254 PolarHBondContact O-NE 2.69Å
251	L	40.8	Very low	48.5	Very low	49 Å²	49	88.4 Å²	88.4	26%	0.257	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-31	-173.3	-74.9	163.2	0	0	0	113.4	W249 E253 R254 F272	W249-L251 PolarHBondContact O-N 2.87Å; L251-E253 VanDerWaalsContact C-N 3.26Å; L251-E253 PolarHBondContact O-N 3.22Å; L251-R254 PolarHBondContact O-N 3.36Å; L251-R254 VanDerWaalsContact O-N 3.12Å; L251-F272 HydrophobicContact CD1-CE1 3.57Å; L251-F272 HydrophobicContact CD1-CE2 4.36Å; L251-F272 HydrophobicContact CD1-CZ 3.38Å; L251-F272 HydrophobicContact CD2-CD1 4.47Å; L251-F272 HydrophobicContact CD2-CE1 3.84Å; L251-F272 HydrophobicContact CG-CE1 4.37Å
252	S	40.7	Very low	46.4	Very low	98 Å²	98	89.6 Å²	89.6	69%	0.685	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-26.1	-180	50.5	0	0	0	0	113.3	R254	S252-R254 VanDerWaalsContact C-N 3.25Å; S252-R254 PolarHBondContact O-N 2.97Å
253	E	41.3	Very low	44.2	Very low	111 Å²	111	93.3 Å²	93.3	52%	0.519	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-15.7	175.2	-68.7	-171.5	156.1	0	0	113	L251 H611	L251-E253 VanDerWaalsContact C-N 3.26Å; L251-E253 PolarHBondContact O-N 3.22Å; E253-H611 IonicContact OE1-CE1 3.96Å; E253-H611 IonicContact OE1-ND1 3.31Å
254	R	45.3	Very low	41.8	Very low	128 Å²	128	96.6 Å²	96.6	48%	0.483	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-19.8	-166.7	-63.6	-179	-174.1	-163.8	-2	115.5	D250 L251 S252	D250-R254 PolarHBondContact O-NE 2.69Å; L251-R254 PolarHBondContact O-N 3.36Å; L251-R254 VanDerWaalsContact O-N 3.12Å; S252-R254 VanDerWaalsContact C-N 3.25Å; S252-R254 PolarHBondContact O-N 2.97Å
255	L	43.1	Very low	40.3	Very low	26 Å²	26	99.4 Å²	99.4	14%	0.136	54%	0.54	C	S	.	.	S	Bend	trans	-109.6	4.4	-173.2	-71.4	167.2	0	0	0	113.9	V197 S259	V197-L255 HydrophobicContact CG1-CD1 4.01Å; L255-S259 VanDerWaalsContact CB-OG 3.31Å; L255-S259 WeakPolarHBondContact CB-OG 3.29Å
256	G	41.4	Very low	39.4	Very low	14 Å²	14	99.6 Å²	99.6	14%	0.144	54%	0.54	C	S	.	.			trans	67.9	166.4	-176.3	0	0	0	0	0	113.6	S258 S259	G256-S258 VanDerWaalsContact C-N 3.26Å; G256-S258 PolarHBondContact O-N 2.75Å; G256-S259 PolarHBondContact O-N 2.68Å; G256-S259 PolarHBondContact O-OG 3.28Å
257	P	37	Very low	39.3	Very low	76 Å²	76	95.5 Å²	95.5	49%	0.494	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-15.3	-174.3	26.8	-32.9	0	0	0	114.5	P436 S603	P257-P436 HydrophobicContact CG-CB 4.1Å; P257-S603 WeakPolarHBondContact CG-OG 3.45Å
258	S	34.6	Very low	39.6	Very low	58 Å²	58	96.6 Å²	96.6	41%	0.406	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-7.5	-179.6	45.8	0	0	0	0	114.6	G256 G260 E439	G256-S258 VanDerWaalsContact C-N 3.26Å; G256-S258 PolarHBondContact O-N 2.75Å; S258-G260 PolarHBondContact O-N 3.18Å; S258-E439 WeakPolarHBondContact CB-OE1 3.46Å; S258-E439 VanDerWaalsContact CB-OE2 3.25Å; S258-E439 WeakPolarHBondContact CB-OE2 2.96Å; S258-E439 PolarHBondContact OG-OE1 3.36Å; S258-E439 PolarHBondContact OG-OE2 2.92Å
259	S	42.6	Very low	40.5	Very low	46 Å²	46	88.7 Å²	88.7	32%	0.322	51%	0.51	S	S	.	.	S	Bend	trans	-71.5	84	166.2	62.3	0	0	0	0	109.2	L255 G256 Q261	L255-S259 VanDerWaalsContact CB-OG 3.31Å; L255-S259 WeakPolarHBondContact CB-OG 3.29Å; G256-S259 PolarHBondContact O-N 2.68Å; G256-S259 PolarHBondContact O-OG 3.28Å; S259-Q261 PolarHBondContact O-N 2.83Å
260	G	33.3	Very low	42	Very low	60 Å²	60	79.8 Å²	79.8	62%	0.619	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46	132.8	-174.5	0	0	0	0	0	113.3	S258 L262	S258-G260 PolarHBondContact O-N 3.18Å; G260-L262 PolarHBondContact O-N 3.14Å; G260-L262 VanDerWaalsContact O-N 3.15Å
261	Q	30.5	Very low	43.7	Very low	194 Å²	194	77.7 Å²	77.7	91%	0.907	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.8	54.1	157.2	-66	-179.1	-18.3	0	0	116.5	S259 G263	S259-Q261 PolarHBondContact O-N 2.83Å; Q261-G263 PolarHBondContact O-N 3.2Å
262	L	36.3	Very low	45.3	Very low	103 Å²	103	76.1 Å²	76.1	54%	0.539	46%	0.459	S	S	.	.			trans	-92	32.5	158.8	-90	149.6	0	0	0	111.8	G260 E264 L270	G260-L262 PolarHBondContact O-N 3.14Å; G260-L262 VanDerWaalsContact O-N 3.15Å; L262-E264 VanDerWaalsContact C-N 3.28Å; L262-L270 HydrophobicContact CD2-CD1 4.21Å
263	G	32.7	Very low	46.9	Very low	80 Å²	80	71.5 Å²	71.5	83%	0.825	43%	0.426	S	S	*	.			trans	-82.3	-0.8	171.8	0	0	0	0	0	114	Q261	Q261-G263 PolarHBondContact O-N 3.2Å
264	E	30.5	Very low	48.6	Very low	158 Å²	158	66.3 Å²	66.3	74%	0.738	40%	0.402	S	S	*	.	S	Bend	trans	-98.1	147.1	174.5	-71.6	-165.6	162.5	0	0	111.4	L262 L266	L262-E264 VanDerWaalsContact C-N 3.28Å; E264-L266 PolarHBondContact O-N 3.47Å
265	P	37.5	Very low	49.9	Very low	123 Å²	123	61.4 Å²	61.4	80%	0.799	39%	0.389	S	S	*	.	S	Bend	trans	-60.4	109.5	177.2	26	-32.9	0	0	0	109.5	A267	P265-A267 PolarHBondContact O-N 3.41Å
266	L	45.9	Very low	51.6	Low	61 Å²	61	61 Å²	61	32%	0.319	39%	0.387	S	S	.	.			trans	17.8	88.9	164	-79.2	148.4	0	0	0	113.9	T208 P247 E264 D268 F272	T208-L266 HydrophobicContact CG2-CB 4.2Å; T208-L266 HydrophobicContact CG2-CD1 4.13Å; T208-L266 HydrophobicContact CG2-CD2 3.8Å; T208-L266 HydrophobicContact CG2-CG 4.27Å; P247-L266 HydrophobicContact CB-CD1 3.94Å; E264-L266 PolarHBondContact O-N 3.47Å; L266-D268 PolarHBondContact O-N 2.74Å; L266-F272 HydrophobicContact CD2-CE2 3.81Å; L266-F272 HydrophobicContact CD2-CZ 4.11Å
267	A	48.7	Very low	53.3	Low	67 Å²	67	60.9 Å²	60.9	55%	0.554	38%	0.384	S	S	*	.			trans	-55.7	135.4	173.1	0	0	0	0	0	110.6	P265 G269 L270	P265-A267 PolarHBondContact O-N 3.41Å; A267-G269 PolarHBondContact O-N 2.93Å; A267-G269 VanDerWaalsContact O-N 3.13Å; A267-L270 HydrophobicContact CB-CD1 4.38Å
268	D	52.8	Low	55.1	Low	126 Å²	126	57.4 Å²	57.4	67%	0.674	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	115.3	175.6	-75.6	-37.2	0	0	0	109.6	S210 L266	S210-D268 WeakPolarHBondContact CB-OD1 3.34Å; S210-D268 PolarHBondContact OG-OD1 3.47Å; L266-D268 PolarHBondContact O-N 2.74Å
269	G	59.3	Low	57.1	Low	23 Å²	23	56.9 Å²	56.9	24%	0.237	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	127.9	-2	-179.9	0	0	0	0	0	116.4	K195 A267	K195-G269 PolarHBondContact N-O 2.79Å; A267-G269 PolarHBondContact O-N 2.93Å; A267-G269 VanDerWaalsContact O-N 3.13Å
270	L	69.4	Low	58.9	Low	30 Å²	30	56.5 Å²	56.5	16%	0.157	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	135.6	175.4	-67.6	162.1	0	0	0	112	K195 V197 L262 A267	K195-L270 HydrophobicContact CB-CD2 4.09Å; K195-L270 WeakPolarHBondContact O-CA 3.46Å; V197-L270 HydrophobicContact CG2-CD2 3.61Å; L262-L270 HydrophobicContact CD2-CD1 4.21Å; A267-L270 HydrophobicContact CB-CD1 4.38Å
271	V	73.3	Confident	60.9	Low	1 Å²	1	53.9 Å²	53.9	1%	0.006	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.8	175.2	177.1	0	0	0	0	109.8	L194 K195 G196 V197 L205 V207 V273 I293	L194-V271 HydrophobicContact CB-CG2 3.76Å; L194-V271 HydrophobicContact CD1-CG2 3.41Å; L194-V271 VanDerWaalsContact CD1-CG2 3.41Å; L194-V271 HydrophobicContact CG-CG2 4.15Å; K195-V271 PolarHBondContact O-N 3.35Å; G196-V271 CarbonylContact C-O 3.4Å; G196-V271 WeakPolarHBondContact CA-O 3.23Å; V197-V271 PolarHBondContact N-O 2.81Å; L205-V271 HydrophobicContact CB-CG1 4.14Å; L205-V271 HydrophobicContact CD2-CG1 4.19Å; V207-V271 HydrophobicContact CG2-CG1 4.12Å; V207-V271 HydrophobicContact CG2-CG2 4.22Å; V271-V273 HydrophobicContact CG1-CG2 4.4Å; V271-I293 HydrophobicContact CG2-CD1 4.39Å
272	F	74.5	Confident	62.8	Low	16 Å²	16	46.9 Å²	46.9	7%	0.07	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	118.1	174	-72.9	-71.5	0	0	0	110.5	V197 G199 G206 L245 L251 L266	V197-F272 HydrophobicContact CB-CD1 4.32Å; V197-F272 HydrophobicContact CB-CE1 4.31Å; V197-F272 HydrophobicContact CG1-CD1 4.35Å; V197-F272 HydrophobicContact CG1-CE1 4.08Å; V197-F272 CarbonylContact O-C 3.41Å; V197-F272 VanDerWaalsContact O-CA 3.27Å; V197-F272 WeakPolarHBondContact O-CA 3.42Å; G199-F272 CarbonylContact O-C 3.58Å; G199-F272 VanDerWaalsContact O-C 3.31Å; G199-F272 WeakPolarHBondContact O-CB 3.39Å; G206-F272 PolarHBondContact N-O 2.92Å; G206-F272 PolarHBondContact O-N 2.76Å; L245-F272 HydrophobicContact CD2-CD2 4.12Å; L245-F272 HydrophobicContact CD2-CE2 4.47Å; L251-F272 HydrophobicContact CD1-CE1 3.57Å; L251-F272 HydrophobicContact CD1-CE2 4.36Å; L251-F272 HydrophobicContact CD1-CZ 3.38Å; L251-F272 HydrophobicContact CD2-CD1 4.47Å; L251-F272 HydrophobicContact CD2-CE1 3.84Å; L251-F272 HydrophobicContact CG-CE1 4.37Å; L266-F272 HydrophobicContact CD2-CE2 3.81Å; L266-F272 HydrophobicContact CD2-CZ 4.11Å
273	V	76	Confident	64.3	Low	0 Å²	0	42.6 Å²	42.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.3	-179.4	-170.8	0	0	0	0	109.5	V197 G199 L205 V271 L277 A278 V288 L291	V197-V273 PolarHBondContact O-N 3.42Å; G199-V273 PolarHBondContact N-O 3.37Å; G199-V273 CarbonylContact O-C 3.6Å; G199-V273 PolarHBondContact O-N 3.47Å; L205-V273 HydrophobicContact CD2-CG1 4.29Å; L205-V273 HydrophobicContact CD2-CG2 4.14Å; V271-V273 HydrophobicContact CG1-CG2 4.4Å; V273-L277 HydrophobicContact CG1-CB 4.21Å; V273-L277 HydrophobicContact CG1-CD2 3.44Å; V273-L277 VanDerWaalsContact CG1-CD2 3.44Å; V273-L277 HydrophobicContact CG1-CG 4.45Å; V273-A278 HydrophobicContact CB-CB 4.43Å; V273-A278 HydrophobicContact CG1-CB 3.8Å; V273-V288 HydrophobicContact CB-CG1 4.4Å; V273-V288 HydrophobicContact CG2-CG1 4.06Å; V273-L291 HydrophobicContact CG2-CD1 3.5Å; V273-L291 VanDerWaalsContact CG2-CD1 3.5Å
274	P	76.1	Confident	65.8	Low	3 Å²	3	39.9 Å²	39.9	2%	0.019	24%	0.243	C	C	.	.			trans	-58.9	146.3	171.1	-23	32.9	0	0	0	112.2	G202 A204 T276 L277 A278	G202-P274 WeakPolarHBondContact O-CB 3.45Å; G202-P274 WeakPolarHBondContact O-CG 3.39Å; A204-P274 WeakPolarHBondContact O-CD 3.31Å; A204-P274 WeakPolarHBondContact O-CG 3.49Å; P274-T276 VanDerWaalsContact C-N 3.29Å; P274-T276 PolarHBondContact O-N 2.86Å; P274-L277 HydrophobicContact CB-CB 4.34Å; P274-L277 PolarHBondContact O-N 3.19Å; P274-L277 VanDerWaalsContact O-N 3.14Å; P274-A278 WeakPolarHBondContact O-CB 3.37Å; P274-A278 PolarHBondContact O-N 3.07Å
275	A	73.5	Confident	67.4	Low	24 Å²	24	33.4 Å²	33.4	20%	0.198	21%	0.214	C	C	.	.	H	α-helix	trans	-59.6	-36.9	-176.9	0	0	0	0	0	113.5	F279 L421	A275-F279 VanDerWaalsContact O-CB 3.24Å; A275-F279 WeakPolarHBondContact O-CB 3.44Å; A275-F279 PolarHBondContact O-N 3.12Å; A275-L421 WeakPolarHBondContact CB-O 3.45Å
276	T	77	Confident	68.5	Low	17 Å²	17	30.1 Å²	30.1	10%	0.104	19%	0.19	C	C	.	.	H	α-helix	trans	-63.4	-46.6	175.4	48	0	0	0	0	111.7	P274 F279 N280 C358 P420 L422	P274-T276 VanDerWaalsContact C-N 3.29Å; P274-T276 PolarHBondContact O-N 2.86Å; T276-F279 PolarHBondContact O-N 2.75Å; T276-N280 PolarHBondContact O-N 2.75Å; T276-N280 PolarHBondContact O-OD1 3.05Å; T276-C358 HydrophobicContact CG2-CB 3.54Å; T276-P420 HydrophobicContact CG2-CG 4.25Å; T276-L422 HydrophobicContact CG2-CD1 4.23Å
277	L	77.1	Confident	69.3	Low	13 Å²	13	33.6 Å²	33.6	7%	0.068	20%	0.204	C	C	.	.	H	α-helix	trans	-70.7	-40	-179.7	-168.2	133.8	0	0	0	112.2	L205 A240 V273 P274 F279 N280 L281	L205-L277 HydrophobicContact CD2-CD2 3.92Å; A240-L277 HydrophobicContact CB-CD1 3.58Å; V273-L277 HydrophobicContact CG1-CB 4.21Å; V273-L277 HydrophobicContact CG1-CD2 3.44Å; V273-L277 VanDerWaalsContact CG1-CD2 3.44Å; V273-L277 HydrophobicContact CG1-CG 4.45Å; P274-L277 HydrophobicContact CB-CB 4.34Å; P274-L277 PolarHBondContact O-N 3.19Å; P274-L277 VanDerWaalsContact O-N 3.14Å; L277-F279 VanDerWaalsContact C-N 3.26Å; L277-F279 PolarHBondContact O-N 3.48Å; L277-N280 PolarHBondContact O-N 3.04Å; L277-L281 HydrophobicContact CD2-CD1 3.49Å; L277-L281 VanDerWaalsContact CD2-CD1 3.49Å; L277-L281 HydrophobicContact CD2-CG 4.23Å; L277-L281 HydrophobicContact CG-CD1 4.41Å; L277-L281 WeakPolarHBondContact O-CB 3.32Å; L277-L281 VanDerWaalsContact O-CG 3.25Å; L277-L281 WeakPolarHBondContact O-CG 3.33Å; L277-L281 PolarHBondContact O-N 3.15Å
278	A	76.3	Confident	69.8	Low	3 Å²	3	30.5 Å²	30.5	3%	0.025	18%	0.179	C	C	.	.	H	α-helix	trans	-60.7	-38.7	174	0	0	0	0	0	111.7	L198 V273 P274 G282 C283	L198-A278 HydrophobicContact CD2-CB 3.43Å; L198-A278 VanDerWaalsContact CD2-CB 3.43Å; V273-A278 HydrophobicContact CB-CB 4.43Å; V273-A278 HydrophobicContact CG1-CB 3.8Å; P274-A278 WeakPolarHBondContact O-CB 3.37Å; P274-A278 PolarHBondContact O-N 3.07Å; A278-G282 PolarHBondContact O-N 3.11Å; A278-C283 HydrophobicContact CB-CB 4.38Å; A278-C283 WeakPolarHBondContact O-CB 3.26Å; A278-C283 PolarHBondContact O-N 3.3Å
279	F	76.9	Confident	70.3	Confident	46 Å²	46	26 Å²	26	20%	0.202	16%	0.162	C	C	.	.	H	α-helix	trans	-68	-44.9	176.5	173.7	-91.4	0	0	0	112.6	A275 T276 L277 L281 G282 V356 R418 P420	A275-F279 VanDerWaalsContact O-CB 3.24Å; A275-F279 WeakPolarHBondContact O-CB 3.44Å; A275-F279 PolarHBondContact O-N 3.12Å; T276-F279 PolarHBondContact O-N 2.75Å; L277-F279 VanDerWaalsContact C-N 3.26Å; L277-F279 PolarHBondContact O-N 3.48Å; F279-L281 VanDerWaalsContact C-N 3.28Å; F279-L281 PolarHBondContact O-N 2.82Å; F279-G282 WeakPolarHBondContact O-CA 3.37Å; F279-G282 PolarHBondContact O-N 2.99Å; F279-V356 HydrophobicContact CD1-CB 4.47Å; F279-V356 HydrophobicContact CE1-CB 4.06Å; F279-V356 HydrophobicContact CE1-CG2 3.87Å; F279-R418 HydrophobicContact CE2-CB 3.67Å; F279-R418 HydrophobicContact CZ-CB 3.39Å; F279-R418 VanDerWaalsContact CZ-O 3.3Å; F279-R418 WeakPolarHBondContact CZ-O 3.33Å; F279-P420 HydrophobicContact CB-CB 3.67Å; F279-P420 HydrophobicContact CB-CG 4.46Å; F279-P420 HydrophobicContact CD1-CB 4.22Å; F279-P420 HydrophobicContact CD1-CG 4.24Å; F279-P420 HydrophobicContact CD2-CB 4.14Å; F279-P420 HydrophobicContact CG-CB 3.75Å; F279-P420 HydrophobicContact CG-CG 4.27Å
280	N	79.6	Confident	71	Confident	38 Å²	38	28.7 Å²	28.7	20%	0.203	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-32.9	176.8	-66.3	-9	0	0	0	112	H238 T276 L277 G282 D355 V356	H238-N280 PolarHBondContact CE1-O 3.3Å; H238-N280 VanDerWaalsContact CE1-O 3.23Å; T276-N280 PolarHBondContact O-N 2.75Å; T276-N280 PolarHBondContact O-OD1 3.05Å; L277-N280 PolarHBondContact O-N 3.04Å; N280-G282 PolarHBondContact O-N 3.27Å; N280-D355 PolarHBondContact ND2-OD1 2.75Å; N280-V356 PolarHBondContact OD1-N 2.91Å
281	L	74.6	Confident	71.3	Confident	6 Å²	6	27.3 Å²	27.3	3%	0.031	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-8.3	170.7	-70.5	172.7	0	0	0	114.1	V225 H238 L277 F279 C283 L291	V225-L281 HydrophobicContact CB-CD1 4.31Å; V225-L281 HydrophobicContact CB-CD2 4.41Å; V225-L281 HydrophobicContact CG1-CD1 3.66Å; V225-L281 HydrophobicContact CG1-CD2 4.35Å; V225-L281 VanDerWaalsContact O-CD2 3.31Å; V225-L281 WeakPolarHBondContact O-CD2 3.34Å; H238-L281 HydrophobicContact CB-CD2 3.98Å; L277-L281 HydrophobicContact CD2-CD1 3.49Å; L277-L281 VanDerWaalsContact CD2-CD1 3.49Å; L277-L281 HydrophobicContact CD2-CG 4.23Å; L277-L281 HydrophobicContact CG-CD1 4.41Å; L277-L281 WeakPolarHBondContact O-CB 3.32Å; L277-L281 VanDerWaalsContact O-CG 3.25Å; L277-L281 WeakPolarHBondContact O-CG 3.33Å; L277-L281 PolarHBondContact O-N 3.15Å; F279-L281 VanDerWaalsContact C-N 3.28Å; F279-L281 PolarHBondContact O-N 2.82Å; L281-C283 VanDerWaalsContact C-N 3.28Å; L281-C283 PolarHBondContact O-N 3.45Å; L281-L291 HydrophobicContact CD1-CD2 4.23Å
282	G	69.9	Low	71.5	Confident	47 Å²	47	32.5 Å²	32.5	49%	0.485	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	27.5	-175.4	0	0	0	0	0	113.4	R227 A278 F279 N280	R227-G282 PolarHBondContact NH1-O 3.07Å; A278-G282 PolarHBondContact O-N 3.11Å; F279-G282 WeakPolarHBondContact O-CA 3.37Å; F279-G282 PolarHBondContact O-N 2.99Å; N280-G282 PolarHBondContact O-N 3.27Å
283	C	67.9	Low	71.7	Confident	12 Å²	12	31.9 Å²	31.9	8%	0.081	18%	0.178	C	C	.	.			trans	-77.2	140.4	176.3	-71	0	0	0	0	111	A278 L281 V288	A278-C283 HydrophobicContact CB-CB 4.38Å; A278-C283 WeakPolarHBondContact O-CB 3.26Å; A278-C283 PolarHBondContact O-N 3.3Å; L281-C283 VanDerWaalsContact C-N 3.28Å; L281-C283 PolarHBondContact O-N 3.45Å; C283-V288 HydrophobicContact CB-CB 4.45Å; C283-V288 HydrophobicContact CB-CG1 3.97Å; C283-V288 PolarHBondContact SG-O 3.08Å
284	D	65.8	Low	71.7	Confident	24 Å²	24	36.2 Å²	36.2	13%	0.128	20%	0.198	C	C	.	.			trans	-69.6	134.2	169	-75	-59.8	0	0	0	108.2	R227 L286 E287 V288 K450	R227-D284 IonicContact NH2-OD2 3.66Å; D284-L286 VanDerWaalsContact C-N 3.29Å; D284-L286 PolarHBondContact O-N 3.48Å; D284-E287 CarbonylContact O-C 3.49Å; D284-E287 PolarHBondContact O-N 3.39Å; D284-E287 VanDerWaalsContact O-N 3.14Å; D284-V288 PolarHBondContact O-N 3.09Å; D284-K450 IonicContact OD1-NZ 3.59Å; D284-K450 PolarHBondContact OD1-NZ 3.4Å; D284-K450 IonicContact OD2-NZ 3.5Å; D284-K450 PolarHBondContact OD2-NZ 2.99Å
285	P	63.1	Low	71.6	Confident	21 Å²	21	39.9 Å²	39.9	14%	0.136	21%	0.212	C	C	.	.	S	Bend	trans	-69.9	-23.9	-169.2	26.7	-35.4	0	0	0	113.7	L198 L433 R486	L198-P285 HydrophobicContact CD1-CB 3.41Å; L198-P285 VanDerWaalsContact CD1-CB 3.41Å; L198-P285 WeakPolarHBondContact CD1-O 3.06Å; L198-P285 HydrophobicContact CG-CB 4.48Å; L198-P285 VanDerWaalsContact CG-O 3.28Å; L198-P285 WeakPolarHBondContact CG-O 3.45Å; P285-L433 HydrophobicContact CB-CD1 3.76Å; P285-L433 HydrophobicContact CB-CD2 4.38Å; P285-L433 HydrophobicContact CG-CD1 4.16Å; P285-L433 HydrophobicContact CG-CD2 4Å; P285-R486 WeakPolarHBondContact CD-O 3.38Å; P285-R486 HydrophobicContact CG-CB 4.39Å; P285-R486 HydrophobicContact CG-CG 3.92Å
286	L	61.2	Low	71.5	Confident	54 Å²	54	40.4 Å²	40.4	28%	0.283	21%	0.209	S	C	.	.	S	Bend	trans	-86.7	-24.7	174.5	-67.9	171.3	0	0	0	112.7	D284 L433	D284-L286 VanDerWaalsContact C-N 3.29Å; D284-L286 PolarHBondContact O-N 3.48Å; L286-L433 HydrophobicContact CD1-CB 4.39Å; L286-L433 HydrophobicContact CD2-CB 3.91Å; L286-L433 HydrophobicContact CD2-CD1 4.37Å; L286-L433 HydrophobicContact CG-CB 4.15Å
287	E	63.3	Low	70.8	Confident	134 Å²	134	44.5 Å²	44.5	63%	0.626	23%	0.229	S	C	*	.			trans	-134	75.7	-177.3	-69	-178.8	-173.3	0	0	108.7	D284 G289	D284-E287 CarbonylContact O-C 3.49Å; D284-E287 PolarHBondContact O-N 3.39Å; D284-E287 VanDerWaalsContact O-N 3.14Å; E287-G289 PolarHBondContact O-N 3.44Å
288	V	58.3	Low	69.3	Low	3 Å²	3	50.9 Å²	50.9	2%	0.018	26%	0.259	C	S	.	.			trans	-62.2	-14.6	-178.2	-176.2	0	0	0	0	111.5	G196 L198 V273 C283 D284 L291	G196-V288 WeakPolarHBondContact O-CB 3.08Å; L198-V288 HydrophobicContact CD2-CG2 4.11Å; L198-V288 HydrophobicContact CG-CG2 3.86Å; V273-V288 HydrophobicContact CB-CG1 4.4Å; V273-V288 HydrophobicContact CG2-CG1 4.06Å; C283-V288 HydrophobicContact CB-CB 4.45Å; C283-V288 HydrophobicContact CB-CG1 3.97Å; C283-V288 PolarHBondContact SG-O 3.08Å; D284-V288 PolarHBondContact O-N 3.09Å; V288-L291 HydrophobicContact CG1-CD1 4.14Å; V288-L291 HydrophobicContact CG1-CD2 4.45Å
289	G	62.5	Low	67.5	Low	31 Å²	31	53.6 Å²	53.6	32%	0.32	29%	0.287	S	S	.	.			trans	74.1	-172.8	172.8	0	0	0	0	0	112.6	G196 E287	G196-G289 PolarHBondContact N-O 3.07Å; E287-G289 PolarHBondContact O-N 3.44Å
290	E	74.1	Confident	65.4	Low	79 Å²	79	56.4 Å²	56.4	37%	0.369	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	131.1	170.8	-68.4	-176	176.6	0	0	110.2	Q193 L194 K195 V228	Q193-E290 PolarHBondContact NE2-OE2 3.24Å; L194-E290 CarbonylContact O-C 3.58Å; L194-E290 WeakPolarHBondContact O-CA 3.44Å; K195-E290 HydrophobicContact CG-CG 4.39Å; V228-E290 HydrophobicContact CB-CB 3.93Å; V228-E290 VanDerWaalsContact CB-O 3.3Å; V228-E290 WeakPolarHBondContact CB-O 3.37Å; V228-E290 HydrophobicContact CG2-CB 3.8Å; V228-E290 VanDerWaalsContact CG2-O 3.25Å; V228-E290 WeakPolarHBondContact CG2-O 3.21Å; V228-E290 PolarHBondContact N-O 2.74Å
291	L	76.6	Confident	63.1	Low	1 Å²	1	62 Å²	62	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.5	179	-61.5	173	0	0	0	109.6	Q193 L194 V225 A226 V273 L281 V288	Q193-L291 CarbonylContact C-O 3.44Å; Q193-L291 VanDerWaalsContact CA-O 3.3Å; Q193-L291 WeakPolarHBondContact CA-O 3.44Å; L194-L291 PolarHBondContact N-O 3.05Å; L194-L291 PolarHBondContact O-N 2.59Å; V225-L291 HydrophobicContact CG1-CB 4.3Å; V225-L291 HydrophobicContact CG1-CD1 4.38Å; V225-L291 HydrophobicContact CG1-CD2 4.29Å; A226-L291 CarbonylContact O-C 3.49Å; A226-L291 WeakPolarHBondContact O-CA 3.48Å; V273-L291 HydrophobicContact CG2-CD1 3.5Å; V273-L291 VanDerWaalsContact CG2-CD1 3.5Å; L281-L291 HydrophobicContact CD1-CD2 4.23Å; V288-L291 HydrophobicContact CG1-CD1 4.14Å; V288-L291 HydrophobicContact CG1-CD2 4.45Å
292	R	78	Confident	61.1	Low	111 Å²	111	69 Å²	69	42%	0.419	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	122.2	168.5	-63.7	-175.6	175.1	153.3	2.3	108.8	V191 R192 V225 A226 V228	V191-R292 HydrophobicContact CG1-CB 3.74Å; V191-R292 HydrophobicContact CG1-CG 3.89Å; R192-R292 WeakPolarHBondContact O-CA 3.42Å; V225-R292 WeakPolarHBondContact CA-O 3.44Å; A226-R292 HydrophobicContact CB-CB 4.49Å; A226-R292 PolarHBondContact N-O 3.49Å; A226-R292 PolarHBondContact O-N 2.73Å; V228-R292 HydrophobicContact CG2-CG 3.4Å
293	I	77.1	Confident	59.4	Low	3 Å²	3	72 Å²	72	2%	0.015	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.5	175.6	-69.5	-158.4	0	0	0	108.3	R192 L194 L205 V223 W224 V271	R192-I293 PolarHBondContact N-O 3.47Å; R192-I293 PolarHBondContact O-N 3.33Å; L194-I293 HydrophobicContact CD1-CD1 3.54Å; L194-I293 HydrophobicContact CD1-CG1 4.17Å; L205-I293 HydrophobicContact CD1-CD1 4.21Å; V223-I293 HydrophobicContact CG1-CB 4.12Å; V223-I293 HydrophobicContact CG1-CG1 4.41Å; V223-I293 HydrophobicContact CG1-CG2 3.35Å; W224-I293 WeakPolarHBondContact O-CA 3.47Å; V271-I293 HydrophobicContact CG2-CD1 4.39Å
294	Q	76.4	Confident	58	Low	90 Å²	90	80.5 Å²	80.5	42%	0.421	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	143.9	174.2	-63.2	-178.3	9	0	0	110.2	V191 V223 W224	V191-Q294 HydrophobicContact CB-CG 4.45Å; V191-Q294 HydrophobicContact CG1-CG 4.21Å; V191-Q294 HydrophobicContact CG2-CG 3.99Å; V223-Q294 CarbonylContact C-O 3.59Å; V223-Q294 WeakPolarHBondContact CA-O 3.48Å; V223-Q294 VanDerWaalsContact CG1-O 3.29Å; V223-Q294 WeakPolarHBondContact CG1-O 3.19Å; W224-Q294 HydrophobicContact CB-CB 4.25Å; W224-Q294 PolarHBondContact N-O 3.48Å; W224-Q294 PolarHBondContact O-N 3.08Å
295	R	73.6	Confident	56.4	Low	81 Å²	81	86.8 Å²	86.8	31%	0.306	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	142.9	177.2	-73.3	-177.3	177.4	-156.2	-8.2	111	F185 G216 L217 L297	F185-R295 HydrophobicContact CD1-CG 4.5Å; F185-R295 HydrophobicContact CE1-CG 4.23Å; G216-R295 PolarHBondContact O-NH2 3.14Å; L217-R295 HydrophobicContact CD2-CG 3.74Å; L217-R295 VanDerWaalsContact CD2-NE 3.33Å; R295-L297 PolarHBondContact O-N 3.34Å
296	Y	71.9	Confident	55.1	Low	35 Å²	35	98.2 Å²	98.2	14%	0.137	50%	0.5	C	S	.	.			trans	-70.6	117.2	168.5	-174.8	-102.1	0	0	0	109.4	W222 W224 L239	W222-Y296 HydrophobicContact CB-CD1 4.4Å; W222-Y296 HydrophobicContact CB-CG 4.16Å; W222-Y296 WeakPolarHBondContact O-CB 3.47Å; W222-Y296 PolarHBondContact O-N 3.19Å; W222-Y296 VanDerWaalsContact O-N 3.12Å; W224-Y296 AromaticContact CE2-CD2 3.74Å; W224-Y296 AromaticContact CZ2-CD2 3.94Å; W224-Y296 HydrophobicContact CZ2-CD2 3.94Å; W224-Y296 AromaticContact CZ2-CE2 3.83Å; W224-Y296 HydrophobicContact CZ2-CE2 3.83Å; W224-Y296 AromaticContact NE1-CD2 3.41Å; L239-Y296 HydrophobicContact CD1-CD2 3.48Å; L239-Y296 VanDerWaalsContact CD1-CD2 3.48Å; L239-Y296 HydrophobicContact CD1-CE2 4.19Å; L239-Y296 HydrophobicContact CD1-CG 4.05Å; L239-Y296 HydrophobicContact CD2-CD2 4.33Å; L239-Y296 HydrophobicContact CD2-CE2 4.29Å
297	L	61.9	Low	53.6	Low	103 Å²	103	98.2 Å²	98.2	54%	0.539	51%	0.513	S	S	.	.			trans	-127.9	134.2	172	-73	166.6	0	0	0	107.4	R295 G299	R295-L297 PolarHBondContact O-N 3.34Å; L297-G299 PolarHBondContact O-N 2.98Å
298	E	45.4	Very low	52.3	Low	146 Å²	146	97 Å²	97	68%	0.682	52%	0.52	S	S	*	.			trans	-57.4	126.4	168.6	-78.1	174.1	168.4	0	0	109	S300	E298-S300 PolarHBondContact O-N 3.18Å
299	G	40	Very low	51.4	Low	61 Å²	61	103.4 Å²	103.4	63%	0.629	56%	0.562	S	S	*	*	S	Bend	trans	-65.7	103.5	170.3	0	0	0	0	0	110	L297	L297-G299 PolarHBondContact O-N 2.98Å
300	S	32.5	Very low	50.2	Low	104 Å²	104	106.1 Å²	106.1	73%	0.727	58%	0.577	S	S	*	*	S	Bend	trans	54.1	117.6	162.9	65.4	0	0	0	0	116.4	E298	E298-S300 PolarHBondContact O-N 3.18Å
301	I	31.6	Very low	48.7	Very low	156 Å²	156	110.3 Å²	110.3	80%	0.8	60%	0.601	S	S	*	*				-162.9	123.2	64.4	-70.9	149.7	0	0	0	106.5
302	I	31.9	Very low	47.3	Very low	152 Å²	152	115.4 Å²	115.4	78%	0.779	63%	0.626	S	S	*	*			trans	-105.8	120.1	167.2	-62.2	171.4	0	0	0	107.2
303	P	34.1	Very low	46.4	Very low	110 Å²	110	112.4 Å²	112.4	71%	0.714	62%	0.622	S	S	*	*			trans	-71.2	133.9	155.1	31.5	-27.8	0	0	0	107.5	D305	P303-D305 PolarHBondContact O-N 3.11Å
304	E	38.3	Very low	45.8	Very low	192 Å²	192	113.9 Å²	113.9	90%	0.897	64%	0.638	S	S	*	*			trans	-45.2	109.6	-179.2	-61.4	-176.6	146.9	0	0	112.1
305	D	32.3	Very low	45.8	Very low	155 Å²	155	109.9 Å²	109.9	83%	0.829	62%	0.62	S	S	*	*			trans	-145.7	124.4	151.9	-114.8	-22.8	0	0	0	110.1	P303 G307	P303-D305 PolarHBondContact O-N 3.11Å; D305-G307 PolarHBondContact O-N 2.73Å
306	R	35.2	Very low	46.1	Very low	262 Å²	262	108 Å²	108	99%	0.989	62%	0.618	S	S	*	*			trans	-71.4	76.2	-179.2	-70.4	179.1	178.6	179.3	0.4	109.4
307	G	30.7	Very low	46.6	Very low	53 Å²	53	110.5 Å²	110.5	55%	0.546	63%	0.63	S	S	.	*			trans	-108.1	140.6	170.9	0	0	0	0	0	111.5	D305 C309	D305-G307 PolarHBondContact O-N 2.73Å; G307-C309 PolarHBondContact O-N 3.44Å; G307-C309 VanDerWaalsContact O-N 3.14Å
308	S	36	Very low	47.7	Very low	110 Å²	110	105.6 Å²	105.6	77%	0.769	60%	0.604	S	S	*	*			trans	-55.5	112.4	177.5	-170	0	0	0	0	111.5	S310	S308-S310 PolarHBondContact O-N 3.37Å; S308-S310 PolarHBondContact O-OG 3.17Å; S308-S310 PolarHBondContact OG-OG 3.42Å
309	C	39.9	Very low	49.6	Very low	136 Å²	136	105.5 Å²	105.5	92%	0.919	60%	0.598	S	S	*	*			trans	-65.4	70.6	177.8	-53.2	0	0	0	0	112.2	G307	G307-C309 PolarHBondContact O-N 3.44Å; G307-C309 VanDerWaalsContact O-N 3.14Å
310	S	36.2	Very low	51.8	Low	88 Å²	88	106.5 Å²	106.5	62%	0.615	59%	0.586	S	S	*	*			trans	-110.9	2.4	-175.1	-27.1	0	0	0	0	112	S308	S308-S310 PolarHBondContact O-N 3.37Å; S308-S310 PolarHBondContact O-OG 3.17Å; S308-S310 PolarHBondContact OG-OG 3.42Å
311	L	42.5	Very low	54.4	Low	168 Å²	168	101.5 Å²	101.5	88%	0.88	55%	0.551	S	S	*	*	S	Bend	trans	-92	112.9	174.8	-77.5	159	0	0	0	108.1	S313	L311-S313 PolarHBondContact O-N 2.92Å
312	M	48.4	Very low	57.1	Low	107 Å²	107	96.4 Å²	96.4	53%	0.527	52%	0.524	S	S	.	.			trans	-63.3	100.1	167.8	-63.6	-85	79	0	0	107.8	E221 G314	E221-M312 HydrophobicContact CG-CE 3.44Å; E221-M312 VanDerWaalsContact CG-CE 3.44Å; E221-M312 HydrophobicContact CG-SD 3.53Å; E221-M312 VanDerWaalsContact CG-SD 3.53Å; E221-M312 VanDerWaalsContact OE1-CE 3.28Å; E221-M312 WeakPolarHBondContact OE1-CE 3.27Å; M312-G314 PolarHBondContact O-N 3.1Å
313	S	57.8	Low	59.8	Low	48 Å²	48	89.1 Å²	89.1	34%	0.336	49%	0.486	S	S	.	.			trans	-66.5	119.8	171.3	51.7	0	0	0	0	108.8	L311	L311-S313 PolarHBondContact O-N 2.92Å
314	G	65.8	Low	62.4	Low	34 Å²	34	85.3 Å²	85.3	35%	0.351	46%	0.459	S	S	.	.			trans	-106.2	155	177.6	0	0	0	0	0	111.6	M312	M312-G314 PolarHBondContact O-N 3.1Å
315	P	75.6	Confident	64.7	Low	6 Å²	6	76.2 Å²	76.2	4%	0.039	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-60.9	151.4	173.4	25.2	-34.5	0	0	0	112.5	W222 L239 L401	W222-P315 HydrophobicContact CD2-CG 4.35Å; W222-P315 HydrophobicContact CZ2-CG 4.33Å; L239-P315 HydrophobicContact CD2-CB 3.72Å; L239-P315 HydrophobicContact CD2-CG 3.59Å; P315-L401 HydrophobicContact CB-CG 4.45Å; P315-L401 HydrophobicContact CG-CD1 3.89Å; P315-L401 HydrophobicContact CG-CD2 4.07Å; P315-L401 HydrophobicContact CG-CG 3.73Å; P315-L401 WeakPolarHBondContact O-CD1 3.15Å
316	P	80.8	Confident	67.2	Low	41 Å²	41	68.9 Å²	68.9	27%	0.266	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-69.2	156.4	178.8	28.5	-34.1	0	0	0	112.4	F400 L401	P316-F400 HydrophobicContact CG-CD1 4.04Å; P316-F400 HydrophobicContact CG-CE1 4.26Å; P316-F400 CarbonylContact O-C 3.57Å; P316-F400 WeakPolarHBondContact O-CA 3.4Å; P316-L401 PolarHBondContact O-N 3.29Å
317	F	82.3	Confident	69.4	Low	88 Å²	88	57.2 Å²	57.2	39%	0.386	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-78.3	143	174	-69.1	-85.2	0	0	0	111.4	L401 D403 H406	F317-L401 CarbonylContact C-O 3.52Å; F317-L401 WeakPolarHBondContact CA-O 3.32Å; F317-L401 HydrophobicContact CD1-CB 3.7Å; F317-L401 HydrophobicContact CE1-CB 3.91Å; F317-L401 HydrophobicContact CE1-CD1 4.3Å; F317-L401 HydrophobicContact CG-CB 4.35Å; F317-L401 HydrophobicContact CZ-CD1 4.37Å; F317-D403 HydrophobicContact CE1-CB 4.45Å; F317-H406 HydrophobicContact CB-CB 4.1Å; F317-H406 HydrophobicContact CD1-CB 4.31Å; F317-H406 HydrophobicContact CG-CB 4.29Å
318	A	84.1	Confident	71.8	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.008	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	144.9	171.7	0	0	0	0	0	110.5	V389 F400 L401 T407	A318-V389 CarbonylContact C-O 3.53Å; A318-V389 WeakPolarHBondContact CA-O 3.49Å; A318-F400 HydrophobicContact CB-CB 3.83Å; A318-F400 HydrophobicContact CB-CG 4.27Å; A318-L401 PolarHBondContact N-O 3.48Å; A318-T407 HydrophobicContact CB-CG2 4.14Å; A318-T407 WeakPolarHBondContact O-CB 3.37Å; A318-T407 WeakPolarHBondContact O-CG2 3.5Å
319	R	84.8	Confident	73.6	Confident	144 Å²	144	51.1 Å²	51.1	54%	0.543	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-40.1	167.7	-71.2	-179.7	172	-176.6	-2.8	111.2	V389 E391 S408	R319-V389 PolarHBondContact N-O 3.06Å; R319-E391 VanDerWaalsContact CZ-CG 3.46Å; R319-E391 IonicContact CZ-OE1 3.09Å; R319-E391 VanDerWaalsContact NE-CG 3.3Å; R319-E391 IonicContact NE-OE1 2.87Å; R319-E391 PolarHBondContact NE-OE1 2.86Å; R319-E391 IonicContact NH2-OE1 2.6Å; R319-E391 PolarHBondContact NH2-OE1 3.2Å; R319-E391 IonicContact NH2-OE2 3.95Å; R319-S408 PolarHBondContact O-N 3.24Å
320	E	87.2	Confident	75	Confident	81 Å²	81	50.1 Å²	50.1	38%	0.379	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	133.3	-178.1	-59.2	176	175.9	0	0	110.1	V389 S408 Y410	E320-V389 HydrophobicContact CB-CB 4.29Å; E320-V389 PolarHBondContact N-O 3.02Å; E320-V389 PolarHBondContact O-N 3.36Å; E320-S408 WeakPolarHBondContact CA-O 3.44Å; E320-Y410 HydrophobicContact CB-CE2 4.21Å; E320-Y410 HydrophobicContact CG-CE2 4.15Å
321	L	86.7	Confident	76.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	114.5	178.7	-175.7	66.1	0	0	0	110	I323 F345 V351 V385 A388 A402 S408 L409 Y410	L321-I323 HydrophobicContact CD2-CD1 3.69Å; L321-I323 HydrophobicContact CD2-CG1 4.06Å; L321-I323 HydrophobicContact CG-CD1 4.04Å; L321-I323 HydrophobicContact CG-CG1 3.82Å; L321-F345 HydrophobicContact CD2-CE1 4.23Å; L321-F345 HydrophobicContact CD2-CZ 3.99Å; L321-V351 HydrophobicContact CD1-CB 4.26Å; L321-V351 HydrophobicContact CD1-CG1 4.38Å; L321-V351 HydrophobicContact CD1-CG2 4.2Å; L321-V351 HydrophobicContact CD2-CG1 4.41Å; L321-V351 HydrophobicContact CD2-CG2 4.37Å; L321-V385 HydrophobicContact CD1-CG1 3.75Å; L321-A388 HydrophobicContact CD1-CB 3.96Å; L321-A402 HydrophobicContact CD2-CB 3.89Å; L321-S408 PolarHBondContact N-O 2.7Å; L321-L409 WeakPolarHBondContact O-CA 3.44Å; L321-Y410 PolarHBondContact O-N 3.05Å
322	H	87.9	Confident	78.3	Confident	48 Å²	48	41.6 Å²	41.6	22%	0.222	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	119.8	175.8	-63.7	-88.3	0	0	0	110.3	K386 K387 Y410	H322-K386 HydrophobicContact CB-CB 4.36Å; H322-K386 PolarHBondContact O-N 3.38Å; H322-K387 HydrophobicContact CB-CB 4.25Å; H322-K387 PolarHBondContact N-O 3.06Å; H322-K387 PolarHBondContact O-N 2.83Å; H322-Y410 WeakPolarHBondContact CA-O 3.44Å; H322-Y410 AromaticContact CE1-CD2 3.61Å; H322-Y410 AromaticContact CE1-CG 3.84Å; H322-Y410 WeakPolarHBondContact ND1-CB 3.48Å; H322-Y410 AromaticContact ND1-CD2 4Å; H322-Y410 AromaticContact ND1-CG 3.96Å
323	I	89.3	Confident	79.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	142.8	-177	-55.2	-173.9	0	0	0	109.8	L321 F345 L357 F383 K384 L409 Y410 M411 A412	L321-I323 HydrophobicContact CD2-CD1 3.69Å; L321-I323 HydrophobicContact CD2-CG1 4.06Å; L321-I323 HydrophobicContact CG-CD1 4.04Å; L321-I323 HydrophobicContact CG-CG1 3.82Å; I323-F345 HydrophobicContact CD1-CE2 3.99Å; I323-F345 HydrophobicContact CD1-CZ 3.91Å; I323-L357 HydrophobicContact CD1-CD1 4.33Å; I323-F383 HydrophobicContact CG2-CB 3.5Å; I323-F383 VanDerWaalsContact CG2-CB 3.5Å; I323-F383 HydrophobicContact CG2-CD1 3.75Å; I323-F383 HydrophobicContact CG2-CG 3.99Å; I323-K384 WeakPolarHBondContact CA-O 3.47Å; I323-L409 HydrophobicContact CD1-CD1 3.71Å; I323-L409 HydrophobicContact CD1-CD2 4.46Å; I323-L409 HydrophobicContact CD1-CG 4Å; I323-L409 HydrophobicContact CG1-CG 4.46Å; I323-Y410 PolarHBondContact N-O 3.47Å; I323-M411 CarbonylContact O-C 3.57Å; I323-M411 VanDerWaalsContact O-CA 3.31Å; I323-M411 WeakPolarHBondContact O-CA 3.46Å; I323-A412 PolarHBondContact O-N 3.38Å
324	E	88.5	Confident	80.1	Confident	29 Å²	29	43.2 Å²	43.2	14%	0.136	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	139.1	172.2	-57.5	-172.6	159.7	0	0	109.7	F383 K384 K386 A412 A415	E324-F383 CarbonylContact O-C 3.6Å; E324-F383 WeakPolarHBondContact O-CA 3.26Å; E324-K384 PolarHBondContact N-O 3.21Å; E324-K384 PolarHBondContact O-N 2.95Å; E324-K386 HydrophobicContact CG-CB 4.21Å; E324-K386 HydrophobicContact CG-CD 4.41Å; E324-K386 WeakPolarHBondContact OE1-CD 3.45Å; E324-K386 VanDerWaalsContact OE1-CE 3.27Å; E324-K386 WeakPolarHBondContact OE1-CE 3.42Å; E324-K386 IonicContact OE1-NZ 2.69Å; E324-K386 PolarHBondContact OE1-NZ 2.99Å; E324-A412 HydrophobicContact CG-CB 4.36Å; E324-A412 WeakPolarHBondContact CG-O 3.18Å; E324-A415 HydrophobicContact CB-CB 3.76Å; E324-A415 WeakPolarHBondContact OE2-CB 3.43Å
325	I	86.7	Confident	80.3	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	131.8	174.5	-173.9	161.7	0	0	0	109.8	S327 Y331 A333 Y337 V381 F383 G413 S414 A415	I325-S327 PolarHBondContact O-N 2.92Å; I325-Y331 HydrophobicContact CD1-CD2 4.07Å; I325-Y331 HydrophobicContact CD1-CE2 3.92Å; I325-Y331 HydrophobicContact CG1-CD2 4.46Å; I325-Y331 HydrophobicContact CG1-CE2 3.82Å; I325-A333 HydrophobicContact CG2-CB 3.94Å; I325-Y337 HydrophobicContact CD1-CD2 3.75Å; I325-Y337 HydrophobicContact CD1-CE2 3.26Å; I325-V381 HydrophobicContact CD1-CG1 4.21Å; I325-F383 HydrophobicContact CB-CD1 4.18Å; I325-F383 HydrophobicContact CB-CE1 4.02Å; I325-F383 HydrophobicContact CD1-CE1 4.21Å; I325-F383 HydrophobicContact CD1-CZ 4.43Å; I325-F383 HydrophobicContact CG1-CD1 4.44Å; I325-F383 HydrophobicContact CG1-CE1 4.11Å; I325-G413 PolarHBondContact N-O 3.11Å; I325-S414 CarbonylContact O-C 3.51Å; I325-S414 VanDerWaalsContact O-CA 3.23Å; I325-S414 WeakPolarHBondContact O-CA 3.38Å; I325-A415 PolarHBondContact O-N 3.41Å
326	V	85	Confident	80.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	121.3	178.3	178.1	0	0	0	0	109.2	S328 Y331 F382 K384 A415 V419	V326-S328 PolarHBondContact O-N 3.04Å; V326-S328 VanDerWaalsContact O-N 3.08Å; V326-Y331 WeakPolarHBondContact O-CE2 3.46Å; V326-Y331 VanDerWaalsContact O-CZ 3.24Å; V326-Y331 PolarHBondContact O-OH 3.44Å; V326-F382 HydrophobicContact CB-CB 4.15Å; V326-F382 HydrophobicContact CG2-CB 4.15Å; V326-F382 PolarHBondContact N-O 3.27Å; V326-K384 HydrophobicContact CG2-CB 4.13Å; V326-A415 WeakPolarHBondContact CA-O 3.28Å; V326-V419 HydrophobicContact CG1-CG2 3.83Å
327	S	82.3	Confident	80	Confident	18 Å²	18	48 Å²	48	13%	0.126	25%	0.251	C	S	.	.			trans	-66.5	106.9	179.4	-68.6	0	0	0	0	111.2	I325 S414 A415 R520	I325-S327 PolarHBondContact O-N 2.92Å; S327-S414 WeakPolarHBondContact OG-CB 3.49Å; S327-A415 PolarHBondContact N-O 3.3Å; S327-R520 WeakPolarHBondContact CB-O 3.31Å
328	S	80.1	Confident	79.9	Confident	11 Å²	11	49.1 Å²	49.1	8%	0.077	26%	0.261	C	S	.	.			trans	-117.6	156.6	179.7	92.7	0	0	0	0	111.9	V326 H330 Y331	V326-S328 PolarHBondContact O-N 3.04Å; V326-S328 VanDerWaalsContact O-N 3.08Å; S328-H330 PolarHBondContact O-N 2.89Å; S328-H330 PolarHBondContact OG-N 3.45Å; S328-H330 VanDerWaalsContact OG-N 3.09Å; S328-Y331 VanDerWaalsContact O-O 3.06Å; S328-Y331 WeakPolarHBondContact OG-CD1 3.32Å; S328-Y331 WeakPolarHBondContact OG-CE1 3.44Å; S328-Y331 VanDerWaalsContact OG-CZ 3.3Å; S328-Y331 PolarHBondContact OG-N 3.41Å
329	P	73.1	Confident	79.7	Confident	23 Å²	23	55.2 Å²	55.2	15%	0.149	29%	0.289	C	S	.	.	S	Bend	trans	-73.1	-7.2	172.2	31.1	-35.6	0	0	0	113	L492	P329-L492 HydrophobicContact CB-CD1 3.94Å
330	H	70.3	Confident	79.5	Confident	115 Å²	115	48.7 Å²	48.7	53%	0.532	27%	0.265	S	S	.	.	S	Bend	trans	-96	-28.1	-172	-61.8	-56	0	0	0	113.2	S328 W378	S328-H330 PolarHBondContact O-N 2.89Å; S328-H330 PolarHBondContact OG-N 3.45Å; S328-H330 VanDerWaalsContact OG-N 3.09Å; H330-W378 WeakPolarHBondContact O-CZ2 3.26Å; H330-W378 PolarHBondContact O-NE1 2.92Å
331	Y	75.3	Confident	79.3	Confident	15 Å²	15	45.1 Å²	45.1	6%	0.059	25%	0.249	C	C	.	.	S	Bend	trans	-139	155.2	179.5	53.3	-102.1	0	0	0	110.4	I325 V326 S328 V381 F382	I325-Y331 HydrophobicContact CD1-CD2 4.07Å; I325-Y331 HydrophobicContact CD1-CE2 3.92Å; I325-Y331 HydrophobicContact CG1-CD2 4.46Å; I325-Y331 HydrophobicContact CG1-CE2 3.82Å; V326-Y331 WeakPolarHBondContact O-CE2 3.46Å; V326-Y331 VanDerWaalsContact O-CZ 3.24Å; V326-Y331 PolarHBondContact O-OH 3.44Å; S328-Y331 VanDerWaalsContact O-O 3.06Å; S328-Y331 WeakPolarHBondContact OG-CD1 3.32Å; S328-Y331 WeakPolarHBondContact OG-CE1 3.44Å; S328-Y331 VanDerWaalsContact OG-CZ 3.3Å; S328-Y331 PolarHBondContact OG-N 3.41Å; Y331-V381 HydrophobicContact CD1-CG1 4.45Å; Y331-V381 HydrophobicContact CD1-CG2 4.33Å; Y331-V381 HydrophobicContact CD2-CG1 4.2Å; Y331-V381 HydrophobicContact CE1-CG1 4.22Å; Y331-V381 HydrophobicContact CE2-CG1 3.96Å; Y331-V381 HydrophobicContact CG-CG1 4.45Å; Y331-V381 HydrophobicContact CG-CG2 4.5Å; Y331-F382 HydrophobicContact CE1-CD2 4.24Å; Y331-F382 PolarHBondContact OH-N 3.47Å; Y331-F382 PolarHBondContact OH-O 3.42Å
332	S	72.2	Confident	79.2	Confident	62 Å²	62	52 Å²	52	43%	0.434	28%	0.276	S	S	.	.			trans	-77.3	151.4	178.5	55.7	0	0	0	0	111.4	N334 Y337	S332-N334 VanDerWaalsContact C-N 3.29Å; S332-Y337 PolarHBondContact O-OH 2.88Å
333	A	72.1	Confident	78.9	Confident	35 Å²	35	57.8 Å²	57.8	29%	0.289	30%	0.296	S	S	.	.	S	Bend	trans	-81.1	-12.2	172.1	0	0	0	0	0	112.9	I325	I325-A333 HydrophobicContact CG2-CB 3.94Å
334	N	71.4	Confident	78.6	Confident	155 Å²	155	58.7 Å²	58.7	83%	0.829	30%	0.3	S	S	*	.	S	Bend	trans	-106.1	16.5	-169.5	-60.7	-0.9	0	0	0	113.2	S332	S332-N334 VanDerWaalsContact C-N 3.29Å
335	G	70.8	Confident	78.4	Confident	27 Å²	27	57.6 Å²	57.6	28%	0.278	30%	0.295	S	S	.	.	S	Bend	trans	-84.6	162.5	177.2	0	0	0	0	0	113.1	Y337	G335-Y337 WeakPolarHBondContact O-CD2 3.46Å; G335-Y337 WeakPolarHBondContact O-CE2 3.43Å
336	D	73.4	Confident	78.3	Confident	151 Å²	151	63.4 Å²	63.4	81%	0.807	32%	0.322	S	S	*	.			trans	-83.4	113.3	173.6	-64	-26.1	0	0	0	109.9
337	Y	77.5	Confident	78.1	Confident	3 Å²	3	66.7 Å²	66.7	1%	0.012	34%	0.342	C	S	.	.			trans	-112.5	2.8	-175.1	-61.6	-70	0	0	0	114.6	I325 S332 G335 H339 V340 L341 F383	I325-Y337 HydrophobicContact CD1-CD2 3.75Å; I325-Y337 HydrophobicContact CD1-CE2 3.26Å; S332-Y337 PolarHBondContact O-OH 2.88Å; G335-Y337 WeakPolarHBondContact O-CD2 3.46Å; G335-Y337 WeakPolarHBondContact O-CE2 3.43Å; Y337-H339 PolarHBondContact O-N 3.11Å; Y337-V340 WeakPolarHBondContact O-CB 3.38Å; Y337-V340 PolarHBondContact O-N 3.22Å; Y337-L341 PolarHBondContact O-N 3.32Å; Y337-F383 HydrophobicContact CD1-CZ 4.42Å; Y337-F383 HydrophobicContact CD2-CZ 4.47Å; Y337-F383 HydrophobicContact CG-CZ 4.03Å
338	D	79.9	Confident	78	Confident	112 Å²	112	69.5 Å²	69.5	60%	0.599	36%	0.359	S	S	*	.	H	α-helix	trans	-59.1	-45	-170.5	-65.7	-10.3	0	0	0	112.8	V340 L341 Y342	D338-V340 VanDerWaalsContact C-N 3.31Å; D338-V340 PolarHBondContact O-N 3.35Å; D338-L341 PolarHBondContact O-N 2.84Å; D338-Y342 WeakPolarHBondContact O-CB 3.17Å; D338-Y342 PolarHBondContact O-N 3.42Å
339	H	80.1	Confident	78	Confident	128 Å²	128	71.8 Å²	71.8	59%	0.593	37%	0.366	S	S	*	.	H	α-helix	trans	-65.3	-32.9	178.1	-71.4	-38.1	0	0	0	113.2	Y337 R343 E366	Y337-H339 PolarHBondContact O-N 3.11Å; H339-R343 PolarHBondContact O-N 3.44Å; H339-E366 IonicContact CD2-OE2 3.79Å
340	V	79.8	Confident	78.5	Confident	7 Å²	7	71.3 Å²	71.3	4%	0.042	36%	0.363	C	S	.	.	H	α-helix	trans	-71.5	-45.9	178.8	-158	0	0	0	0	110.3	Y337 D338 R343 H344 V359 T361 Q364 I367	Y337-V340 WeakPolarHBondContact O-CB 3.38Å; Y337-V340 PolarHBondContact O-N 3.22Å; D338-V340 VanDerWaalsContact C-N 3.31Å; D338-V340 PolarHBondContact O-N 3.35Å; V340-R343 PolarHBondContact O-N 2.87Å; V340-H344 WeakPolarHBondContact O-CB 3.5Å; V340-H344 PolarHBondContact O-N 3.33Å; V340-V359 HydrophobicContact CB-CG1 4.3Å; V340-V359 HydrophobicContact CG1-CG1 3.4Å; V340-V359 VanDerWaalsContact CG1-CG1 3.4Å; V340-T361 HydrophobicContact CG1-CG2 3.87Å; V340-Q364 VanDerWaalsContact CG2-OE1 3.22Å; V340-I367 HydrophobicContact CG2-CD1 3.94Å
341	L	83.3	Confident	79.2	Confident	6 Å²	6	65.9 Å²	65.9	3%	0.031	34%	0.338	C	S	.	.	H	α-helix	trans	-64.1	-42.6	177.5	-68.5	171.5	0	0	0	111.1	Y337 D338 R343 H344 F345 V359 F383 L409 M411	Y337-L341 PolarHBondContact O-N 3.32Å; D338-L341 PolarHBondContact O-N 2.84Å; L341-R343 VanDerWaalsContact C-N 3.34Å; L341-R343 PolarHBondContact O-N 2.99Å; L341-H344 PolarHBondContact O-N 3.24Å; L341-H344 VanDerWaalsContact O-N 3.13Å; L341-F345 HydrophobicContact CD2-CE2 4.18Å; L341-F345 VanDerWaalsContact O-CD2 3.27Å; L341-F345 WeakPolarHBondContact O-CD2 3.5Å; L341-F345 PolarHBondContact O-N 3.09Å; L341-V359 HydrophobicContact CD2-CG2 4.24Å; L341-F383 HydrophobicContact CD1-CE1 4.27Å; L341-F383 HydrophobicContact CD1-CZ 4.32Å; L341-F383 HydrophobicContact CD2-CD1 4.42Å; L341-F383 HydrophobicContact CD2-CD2 3.99Å; L341-F383 HydrophobicContact CD2-CE1 4.24Å; L341-F383 HydrophobicContact CD2-CE2 3.79Å; L341-F383 HydrophobicContact CD2-CG 4.3Å; L341-F383 HydrophobicContact CD2-CZ 3.93Å; L341-F383 HydrophobicContact CG-CE2 4.49Å; L341-F383 HydrophobicContact CG-CZ 4.25Å; L341-L409 HydrophobicContact CB-CD1 4.39Å; L341-L409 HydrophobicContact CD1-CD1 4.45Å; L341-L409 HydrophobicContact CD1-CD2 4.14Å; L341-M411 HydrophobicContact CD1-CE 3.58Å
342	Y	83.6	Confident	79.5	Confident	146 Å²	146	65.5 Å²	65.5	57%	0.573	34%	0.337	S	S	*	.	H	α-helix	trans	-57	-46	176	-176.5	-96	0	0	0	112.2	D338 H344 H346 T404	D338-Y342 WeakPolarHBondContact O-CB 3.17Å; D338-Y342 PolarHBondContact O-N 3.42Å; Y342-H344 VanDerWaalsContact C-N 3.34Å; Y342-H344 PolarHBondContact O-N 3.26Å; Y342-H346 PolarHBondContact O-N 2.97Å; Y342-T404 HydrophobicContact CD2-CG2 3.95Å; Y342-T404 HydrophobicContact CE2-CG2 3.83Å
343	R	82.4	Confident	80.1	Confident	168 Å²	168	67.8 Å²	67.8	63%	0.634	34%	0.341	S	S	*	.	H	α-helix	trans	-67.2	-35.7	177.3	-171.4	177.6	-177.5	-177.5	0.8	112.3	H339 V340 L341 H346	H339-R343 PolarHBondContact O-N 3.44Å; V340-R343 PolarHBondContact O-N 2.87Å; L341-R343 VanDerWaalsContact C-N 3.34Å; L341-R343 PolarHBondContact O-N 2.99Å; R343-H346 WeakPolarHBondContact O-CB 3.35Å; R343-H346 PolarHBondContact O-N 2.97Å
344	H	82.6	Confident	80.4	Confident	19 Å²	19	68 Å²	68	9%	0.088	35%	0.346	C	S	.	.	H	α-helix	trans	-67.1	-42.4	-178.9	-172.8	77.1	0	0	0	112.8	V340 L341 Y342 R349 C358 V359	V340-H344 WeakPolarHBondContact O-CB 3.5Å; V340-H344 PolarHBondContact O-N 3.33Å; L341-H344 PolarHBondContact O-N 3.24Å; L341-H344 VanDerWaalsContact O-N 3.13Å; Y342-H344 VanDerWaalsContact C-N 3.34Å; Y342-H344 PolarHBondContact O-N 3.26Å; H344-R349 VanDerWaalsContact NE2-CD 3.27Å; H344-R349 WeakPolarHBondContact NE2-CD 3.47Å; H344-R349 PolarHBondContact NE2-NE 3.02Å; H344-R349 PolarHBondContact O-NE 3.46Å; H344-C358 PolarHBondContact CE1-O 3.47Å; H344-V359 HydrophobicContact CB-CG1 3.92Å; H344-V359 HydrophobicContact CB-CG2 4.37Å
345	F	85.4	Confident	81	Confident	7 Å²	7	61 Å²	61	3%	0.031	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	2.7	178.9	-68.2	-68.7	0	0	0	114.1	L321 I323 L341 T347 L357 A402 T404 L409	L321-F345 HydrophobicContact CD2-CE1 4.23Å; L321-F345 HydrophobicContact CD2-CZ 3.99Å; I323-F345 HydrophobicContact CD1-CE2 3.99Å; I323-F345 HydrophobicContact CD1-CZ 3.91Å; L341-F345 HydrophobicContact CD2-CE2 4.18Å; L341-F345 VanDerWaalsContact O-CD2 3.27Å; L341-F345 WeakPolarHBondContact O-CD2 3.5Å; L341-F345 PolarHBondContact O-N 3.09Å; F345-T347 PolarHBondContact O-N 2.78Å; F345-L357 HydrophobicContact CE1-CD1 4.41Å; F345-L357 HydrophobicContact CZ-CD1 3.81Å; F345-A402 HydrophobicContact CD1-CB 3.81Å; F345-A402 HydrophobicContact CE1-CB 3.8Å; F345-T404 HydrophobicContact CB-CG2 4.42Å; F345-T404 PolarHBondContact O-N 3.05Å; F345-L409 HydrophobicContact CD2-CD1 3.8Å; F345-L409 HydrophobicContact CE2-CD1 3.51Å; F345-L409 HydrophobicContact CZ-CD1 4.43Å
346	H	84.1	Confident	81.7	Confident	124 Å²	124	60 Å²	60	57%	0.574	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-24.8	171.5	-167.7	68	0	0	0	112.6	Y342 R343	Y342-H346 PolarHBondContact O-N 2.97Å; R343-H346 WeakPolarHBondContact O-CB 3.35Å; R343-H346 PolarHBondContact O-N 2.97Å
347	T	79.8	Confident	82.2	Confident	68 Å²	68	53.3 Å²	53.3	42%	0.417	26%	0.261	S	S	.	.	S	Bend	trans	-101.6	132.4	165.8	53.9	0	0	0	0	108.7	F345 R349	F345-T347 PolarHBondContact O-N 2.78Å; T347-R349 PolarHBondContact O-N 2.87Å; T347-R349 PolarHBondContact OG1-NH2 3.43Å
348	P	79.8	Confident	82.4	Confident	77 Å²	77	54 Å²	54	50%	0.5	27%	0.267	S	S	.	.			trans	-63.8	127.5	-179.7	25.1	-33.7	0	0	0	110.8	A402 D403	P348-A402 WeakPolarHBondContact CA-O 3.46Å; P348-D403 HydrophobicContact CB-CB 4.36Å
349	R	82.1	Confident	82.5	Confident	59 Å²	59	48.8 Å²	48.8	22%	0.223	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	151.4	-177.9	-70.9	178.2	-171.8	-76.4	-6.2	111.5	D203 H344 T347 L401 A402	D203-R349 IonicContact OD2-NH1 3.42Å; D203-R349 PolarHBondContact OD2-NH1 2.98Å; H344-R349 VanDerWaalsContact NE2-CD 3.27Å; H344-R349 WeakPolarHBondContact NE2-CD 3.47Å; H344-R349 PolarHBondContact NE2-NE 3.02Å; H344-R349 PolarHBondContact O-NE 3.46Å; T347-R349 PolarHBondContact O-N 2.87Å; T347-R349 PolarHBondContact OG1-NH2 3.43Å; R349-L401 CarbonylContact O-C 3.43Å; R349-L401 WeakPolarHBondContact O-CA 3.06Å; R349-A402 PolarHBondContact N-O 3.34Å; R349-A402 PolarHBondContact O-N 3.38Å
350	V	83.3	Confident	82.3	Confident	14 Å²	14	46.1 Å²	46.1	9%	0.085	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	136.6	172.8	179.3	0	0	0	0	109.1	W222 L239 Q352 A399 F400 L401	W222-V350 HydrophobicContact CE3-CG2 4.22Å; W222-V350 HydrophobicContact CH2-CG2 3.51Å; W222-V350 HydrophobicContact CZ3-CG2 3.23Å; L239-V350 HydrophobicContact CB-CG1 4.11Å; L239-V350 HydrophobicContact CD2-CG1 4.47Å; V350-Q352 HydrophobicContact CG1-CG 4.36Å; V350-A399 HydrophobicContact CG1-CB 4.34Å; V350-F400 WeakPolarHBondContact CA-O 3.47Å; V350-L401 HydrophobicContact CG2-CD2 3.84Å
351	V	83.4	Confident	81.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	132.5	172.7	-100.5	0	0	0	0	109.3	L321 L357 V385 F400 A402	L321-V351 HydrophobicContact CD1-CB 4.26Å; L321-V351 HydrophobicContact CD1-CG1 4.38Å; L321-V351 HydrophobicContact CD1-CG2 4.2Å; L321-V351 HydrophobicContact CD2-CG1 4.41Å; L321-V351 HydrophobicContact CD2-CG2 4.37Å; V351-L357 HydrophobicContact CG1-CD1 3.72Å; V351-L357 HydrophobicContact CG1-CD2 3.84Å; V351-L357 HydrophobicContact CG1-CG 4.26Å; V351-V385 HydrophobicContact CB-CG2 4.38Å; V351-V385 HydrophobicContact CG1-CG2 3.69Å; V351-F400 PolarHBondContact N-O 2.52Å; V351-F400 PolarHBondContact O-N 3.5Å; V351-A402 HydrophobicContact CG2-CB 3.47Å; V351-A402 VanDerWaalsContact CG2-CB 3.47Å
352	Q	83.5	Confident	80.7	Confident	8 Å²	8	51 Å²	51	4%	0.037	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	155.7	171.1	-49.1	-174.4	-107.5	0	0	109.9	P237 H238 V350 G354 D355 V385 A399	P237-Q352 PolarHBondContact O-NE2 3.08Å; H238-Q352 PolarHBondContact CD2-OE1 3.14Å; H238-Q352 VanDerWaalsContact CD2-OE1 3.29Å; V350-Q352 HydrophobicContact CG1-CG 4.36Å; Q352-G354 PolarHBondContact O-N 3.37Å; Q352-D355 WeakPolarHBondContact CA-OD2 3.48Å; Q352-D355 WeakPolarHBondContact CB-OD2 3.26Å; Q352-D355 WeakPolarHBondContact CG-OD2 3.17Å; Q352-D355 PolarHBondContact N-OD2 3.28Å; Q352-D355 WeakPolarHBondContact O-CB 3.19Å; Q352-D355 PolarHBondContact O-N 3.23Å; Q352-V385 VanDerWaalsContact O-CB 3.31Å; Q352-V385 WeakPolarHBondContact O-CB 3.36Å; Q352-V385 WeakPolarHBondContact O-CG1 3.46Å; Q352-A399 HydrophobicContact CG-CB 3.66Å
353	E	83.1	Confident	79.3	Confident	110 Å²	110	47.4 Å²	47.4	51%	0.514	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	127.2	175	-170.7	172.1	156.8	0	0	110.3	K386	E353-K386 WeakPolarHBondContact CG-O 3.4Å
354	G	78.9	Confident	77.9	Confident	39 Å²	39	42 Å²	42	40%	0.402	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	94	-12.1	-177.8	0	0	0	0	0	115.6	Q352 V385	Q352-G354 PolarHBondContact O-N 3.37Å; G354-V385 WeakPolarHBondContact CA-O 3.36Å; G354-V385 PolarHBondContact N-O 2.97Å
355	D	83.6	Confident	76.3	Confident	9 Å²	9	46.5 Å²	46.5	5%	0.048	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-64.2	144.2	179.4	-83.4	-29.6	0	0	0	113	H238 N280 Q352 K384 V385	H238-D355 IonicContact CD2-OD1 4Å; H238-D355 PolarHBondContact CD2-OD1 3.44Å; H238-D355 IonicContact NE2-OD1 3.84Å; H238-D355 PolarHBondContact NE2-OD1 3.05Å; N280-D355 PolarHBondContact ND2-OD1 2.75Å; Q352-D355 WeakPolarHBondContact CA-OD2 3.48Å; Q352-D355 WeakPolarHBondContact CB-OD2 3.26Å; Q352-D355 WeakPolarHBondContact CG-OD2 3.17Å; Q352-D355 PolarHBondContact N-OD2 3.28Å; Q352-D355 WeakPolarHBondContact O-CB 3.19Å; Q352-D355 PolarHBondContact O-N 3.23Å; D355-K384 WeakPolarHBondContact O-CA 3.43Å; D355-V385 HydrophobicContact CB-CG2 4.32Å; D355-V385 PolarHBondContact O-N 3.36Å
356	V	85.4	Confident	74.5	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.024	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	118.4	167.4	-178.7	0	0	0	0	109.7	F279 N280 F382 F383	F279-V356 HydrophobicContact CD1-CB 4.47Å; F279-V356 HydrophobicContact CE1-CB 4.06Å; F279-V356 HydrophobicContact CE1-CG2 3.87Å; N280-V356 PolarHBondContact OD1-N 2.91Å; V356-F382 HydrophobicContact CG1-CB 4.1Å; V356-F382 HydrophobicContact CG1-CD1 4.16Å; V356-F383 CarbonylContact C-O 3.57Å; V356-F383 WeakPolarHBondContact CA-O 3.44Å
357	L	84.5	Confident	72.9	Confident	12 Å²	12	49.6 Å²	49.6	6%	0.063	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	136.7	177.2	-58.7	176.8	0	0	0	110.6	I323 F345 V351 F382 F383 V385	I323-L357 HydrophobicContact CD1-CD1 4.33Å; F345-L357 HydrophobicContact CE1-CD1 4.41Å; F345-L357 HydrophobicContact CZ-CD1 3.81Å; V351-L357 HydrophobicContact CG1-CD1 3.72Å; V351-L357 HydrophobicContact CG1-CD2 3.84Å; V351-L357 HydrophobicContact CG1-CG 4.26Å; L357-F382 WeakPolarHBondContact O-CA 3.47Å; L357-F383 HydrophobicContact CB-CB 4.38Å; L357-F383 PolarHBondContact N-O 3.2Å; L357-F383 PolarHBondContact O-N 3.39Å; L357-V385 HydrophobicContact CD1-CG2 3.92Å; L357-V385 HydrophobicContact CG-CG2 4.1Å
358	C	81.4	Confident	71.3	Confident	18 Å²	18	50.1 Å²	50.1	12%	0.122	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	113.6	174.6	178.7	0	0	0	0	110.1	T276 H344 E380 F382 L422	T276-C358 HydrophobicContact CG2-CB 3.54Å; H344-C358 PolarHBondContact CE1-O 3.47Å; C358-E380 VanDerWaalsContact SG-CD 3.59Å; C358-F382 HydrophobicContact CB-CD1 4.13Å; C358-F382 HydrophobicContact CB-CE1 3.85Å; C358-L422 HydrophobicContact CB-CD1 4.22Å
359	V	82.4	Confident	69.6	Low	1 Å²	1	55.5 Å²	55.5	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	110.6	-177.2	-179.6	0	0	0	0	109.7	V340 L341 H344 E380 V381 F383	V340-V359 HydrophobicContact CB-CG1 4.3Å; V340-V359 HydrophobicContact CG1-CG1 3.4Å; V340-V359 VanDerWaalsContact CG1-CG1 3.4Å; L341-V359 HydrophobicContact CD2-CG2 4.24Å; H344-V359 HydrophobicContact CB-CG1 3.92Å; H344-V359 HydrophobicContact CB-CG2 4.37Å; V359-E380 CarbonylContact O-C 3.6Å; V359-E380 VanDerWaalsContact O-CA 3.3Å; V359-E380 WeakPolarHBondContact O-CA 3.33Å; V359-V381 PolarHBondContact N-O 3.41Å; V359-V381 PolarHBondContact O-N 2.94Å; V359-F383 HydrophobicContact CB-CD2 4.12Å; V359-F383 HydrophobicContact CB-CE2 4.05Å; V359-F383 HydrophobicContact CG2-CD2 3.57Å; V359-F383 HydrophobicContact CG2-CE2 3.89Å
360	P	74.9	Confident	67.8	Low	73 Å²	73	56.4 Å²	56.4	47%	0.474	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	132.1	179.4	28.9	-33.2	0	0	0	112	R379 E380	P360-R379 CarbonylContact C-O 3.48Å; P360-R379 WeakPolarHBondContact CA-O 3.48Å; P360-E380 HydrophobicContact CB-CG 4.25Å
361	T	70.4	Confident	65.8	Low	10 Å²	10	58.4 Å²	58.4	6%	0.061	36%	0.357	C	S	.	.			trans	-101.8	13.1	-178.9	46.5	0	0	0	0	113.5	V340 G363 I367 W378 R379 E380 V381	V340-T361 HydrophobicContact CG1-CG2 3.87Å; T361-G363 PolarHBondContact O-N 2.81Å; T361-G363 VanDerWaalsContact O-N 3.07Å; T361-I367 HydrophobicContact CG2-CD1 4.24Å; T361-W378 VanDerWaalsContact OG1-C 3.26Å; T361-W378 PolarHBondContact OG1-O 2.78Å; T361-R379 PolarHBondContact N-O 2.81Å; T361-R379 PolarHBondContact OG1-O 3.03Å; T361-E380 PolarHBondContact OG1-N 3.47Å; T361-V381 HydrophobicContact CG2-CG2 3.67Å
362	V	61	Low	63.8	Low	104 Å²	104	64.9 Å²	64.9	63%	0.63	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	112.2	-176.7	-177.6	0	0	0	0	111.1	R379	V362-R379 HydrophobicContact CG2-CB 4.43Å
363	G	53.4	Low	61.8	Low	71 Å²	71	72.3 Å²	72.3	73%	0.732	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	108	11.4	171.7	0	0	0	0	0	116.8	T361	T361-G363 PolarHBondContact O-N 2.81Å; T361-G363 VanDerWaalsContact O-N 3.07Å
364	Q	53.4	Low	59.6	Low	56 Å²	56	76.6 Å²	76.6	26%	0.262	45%	0.45	S	S	.	.			trans	-108.2	129.2	178.1	-74.7	168.9	-32	0	0	112.1	V340	V340-Q364 VanDerWaalsContact CG2-OE1 3.22Å
365	V	47.8	Very low	57.6	Low	113 Å²	113	81.9 Å²	81.9	69%	0.685	47%	0.469	S	S	*	.			trans	-94.9	-23.3	-177	179.9	0	0	0	0	111.6	I367 L368	V365-I367 PolarHBondContact O-N 3.21Å; V365-L368 HydrophobicContact CB-CD1 4.3Å; V365-L368 HydrophobicContact CG1-CD1 3.91Å; V365-L368 WeakPolarHBondContact O-CB 3.45Å; V365-L368 VanDerWaalsContact O-CD1 3.23Å; V365-L368 WeakPolarHBondContact O-CD1 3.47Å; V365-L368 WeakPolarHBondContact O-CG 3.4Å; V365-L368 PolarHBondContact O-N 3.01Å
366	E	47.4	Very low	55.8	Low	153 Å²	153	86 Å²	86	72%	0.715	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-72.9	-20.4	-170.3	-67.4	170.1	179.3	0	0	114.8	H339 L368	H339-E366 IonicContact CD2-OE2 3.79Å; E366-L368 PolarHBondContact O-N 2.71Å
367	I	50.7	Low	54	Low	43 Å²	43	96.4 Å²	96.4	22%	0.221	54%	0.535	C	S	.	.	G	3₁₀ helix	trans	-73.5	-5.1	176.3	-59.1	167.1	0	0	0	111.5	V340 T361 V365 W378	V340-I367 HydrophobicContact CG2-CD1 3.94Å; T361-I367 HydrophobicContact CG2-CD1 4.24Å; V365-I367 PolarHBondContact O-N 3.21Å; I367-W378 HydrophobicContact CG2-CE3 3.86Å; I367-W378 HydrophobicContact CG2-CZ3 3.53Å
368	L	47.9	Very low	52.6	Low	78 Å²	78	99.9 Å²	99.9	41%	0.408	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-86.9	-14.3	-169.9	-64	167.7	0	0	0	115.2	V365 E366 G370 P376	V365-L368 HydrophobicContact CB-CD1 4.3Å; V365-L368 HydrophobicContact CG1-CD1 3.91Å; V365-L368 WeakPolarHBondContact O-CB 3.45Å; V365-L368 VanDerWaalsContact O-CD1 3.23Å; V365-L368 WeakPolarHBondContact O-CD1 3.47Å; V365-L368 WeakPolarHBondContact O-CG 3.4Å; V365-L368 PolarHBondContact O-N 3.01Å; E366-L368 PolarHBondContact O-N 2.71Å; L368-G370 PolarHBondContact O-N 3.48Å; L368-P376 HydrophobicContact CD2-CB 4.29Å
369	E	43.2	Very low	51.5	Low	190 Å²	190	104.6 Å²	104.6	89%	0.888	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-10.2	-169.8	-68.5	-171.1	161.7	0	0	114.6
370	G	44	Very low	51.1	Low	78 Å²	78	107.2 Å²	107.2	80%	0.804	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-5.5	-173.9	0	0	0	0	0	117.3	L368	L368-G370 PolarHBondContact O-N 3.48Å
371	S	42.2	Very low	51.4	Low	57 Å²	57	103.8 Å²	103.8	40%	0.399	55%	0.552	S	S	.	*			trans	-132.6	123.9	-174.6	64.6	0	0	0	0	113.3	E373	S371-E373 PolarHBondContact O-N 3.44Å
372	P	41.4	Very low	52.1	Low	135 Å²	135	104.3 Å²	104.3	88%	0.877	55%	0.554	S	S	*	*			trans	-75	-2.1	-177.7	29.7	-34.8	0	0	0	114.8	K374	P372-K374 PolarHBondContact O-N 3.48Å
373	E	40.4	Very low	53.4	Low	165 Å²	165	99.4 Å²	99.4	77%	0.771	52%	0.524	S	S	*	.	S	Bend	trans	-94.7	89.1	-178.6	-65.3	-171.5	178.3	0	0	111.9	S371	S371-E373 PolarHBondContact O-N 3.44Å
374	K	38	Very low	55	Low	199 Å²	199	99 Å²	99	87%	0.865	50%	0.502	S	S	*	.			trans	33.3	106.6	154.7	-65.2	178.2	179.3	176.5	0	118.7	P372	P372-K374 PolarHBondContact O-N 3.48Å
375	L	36.4	Very low	56.6	Low	151 Å²	151	96.4 Å²	96.4	79%	0.791	49%	0.49	S	S	*	.	S	Bend	trans	33.6	144.6	145.8	-82.7	151.1	0	0	0	121.1
376	P	45.3	Very low	58.4	Low	95 Å²	95	96.1 Å²	96.1	62%	0.617	48%	0.48	S	S	*	.			trans	-67.7	136.6	-130.7	37.4	-30.4	0	0	0	113.2	L368	L368-P376 HydrophobicContact CD2-CB 4.29Å
377	R	48	Very low	60.1	Low	222 Å²	222	94 Å²	94	84%	0.838	47%	0.468	S	S	*	.			trans	-134	-8.8	173.5	-74	-168.9	178.4	-169.7	-0.4	116.2	R379	R377-R379 PolarHBondContact O-N 3.41Å
378	W	55.8	Low	61.6	Low	86 Å²	86	92.5 Å²	92.5	33%	0.326	46%	0.462	S	S	.	.			trans	-88.3	108.6	-172.5	-45.7	-23.4	0	0	0	108.2	H330 T361 I367	H330-W378 WeakPolarHBondContact O-CZ2 3.26Å; H330-W378 PolarHBondContact O-NE1 2.92Å; T361-W378 VanDerWaalsContact OG1-C 3.26Å; T361-W378 PolarHBondContact OG1-O 2.78Å; I367-W378 HydrophobicContact CG2-CE3 3.86Å; I367-W378 HydrophobicContact CG2-CZ3 3.53Å
379	R	58.3	Low	63.2	Low	116 Å²	116	91.2 Å²	91.2	44%	0.438	46%	0.457	S	S	.	.	S	Bend	trans	-85.3	-28.1	172.8	-69.2	-174.2	175	-171	0.3	111.2	P360 T361 V362 R377	P360-R379 CarbonylContact C-O 3.48Å; P360-R379 WeakPolarHBondContact CA-O 3.48Å; T361-R379 PolarHBondContact N-O 2.81Å; T361-R379 PolarHBondContact OG1-O 3.03Å; V362-R379 HydrophobicContact CG2-CB 4.43Å; R377-R379 PolarHBondContact O-N 3.41Å
380	E	73.4	Confident	64.7	Low	57 Å²	57	83 Å²	83	27%	0.266	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	144.5	-170	-70.5	158.6	-166.6	0	0	111.8	C358 V359 P360 T361 F382 L422	C358-E380 VanDerWaalsContact SG-CD 3.59Å; V359-E380 CarbonylContact O-C 3.6Å; V359-E380 VanDerWaalsContact O-CA 3.3Å; V359-E380 WeakPolarHBondContact O-CA 3.33Å; P360-E380 HydrophobicContact CB-CG 4.25Å; T361-E380 PolarHBondContact OG1-N 3.47Å; E380-F382 HydrophobicContact CB-CZ 4.46Å; E380-L422 WeakPolarHBondContact OE1-CD2 3.28Å; E380-L422 WeakPolarHBondContact OE2-CB 3.19Å
381	V	80.7	Confident	65.5	Low	1 Å²	1	85.3 Å²	85.3	1%	0.006	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	143.6	175.2	178.1	0	0	0	0	108.7	I325 Y331 V359 T361 F383	I325-V381 HydrophobicContact CD1-CG1 4.21Å; Y331-V381 HydrophobicContact CD1-CG1 4.45Å; Y331-V381 HydrophobicContact CD1-CG2 4.33Å; Y331-V381 HydrophobicContact CD2-CG1 4.2Å; Y331-V381 HydrophobicContact CE1-CG1 4.22Å; Y331-V381 HydrophobicContact CE2-CG1 3.96Å; Y331-V381 HydrophobicContact CG-CG1 4.45Å; Y331-V381 HydrophobicContact CG-CG2 4.5Å; V359-V381 PolarHBondContact N-O 3.41Å; V359-V381 PolarHBondContact O-N 2.94Å; T361-V381 HydrophobicContact CG2-CG2 3.67Å; V381-F383 HydrophobicContact CB-CE2 4.04Å; V381-F383 HydrophobicContact CG1-CD2 4.21Å; V381-F383 HydrophobicContact CG1-CE2 3.53Å; V381-F383 HydrophobicContact CG1-CZ 3.8Å
382	F	85.9	Confident	66.1	Low	20 Å²	20	86.3 Å²	86.3	9%	0.088	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	136.4	-175.9	-57.7	-80.9	0	0	0	112.5	V326 Y331 V356 L357 C358 E380 V419 P420 L422	V326-F382 HydrophobicContact CB-CB 4.15Å; V326-F382 HydrophobicContact CG2-CB 4.15Å; V326-F382 PolarHBondContact N-O 3.27Å; Y331-F382 HydrophobicContact CE1-CD2 4.24Å; Y331-F382 PolarHBondContact OH-N 3.47Å; Y331-F382 PolarHBondContact OH-O 3.42Å; V356-F382 HydrophobicContact CG1-CB 4.1Å; V356-F382 HydrophobicContact CG1-CD1 4.16Å; L357-F382 WeakPolarHBondContact O-CA 3.47Å; C358-F382 HydrophobicContact CB-CD1 4.13Å; C358-F382 HydrophobicContact CB-CE1 3.85Å; E380-F382 HydrophobicContact CB-CZ 4.46Å; F382-V419 HydrophobicContact CB-CG2 3.96Å; F382-V419 HydrophobicContact CD1-CG1 3.84Å; F382-V419 HydrophobicContact CD2-CB 4.27Å; F382-V419 HydrophobicContact CD2-CG1 3.32Å; F382-V419 HydrophobicContact CD2-CG2 3.89Å; F382-V419 HydrophobicContact CE1-CG1 3.71Å; F382-V419 HydrophobicContact CE2-CG1 3.19Å; F382-V419 HydrophobicContact CG-CB 4.38Å; F382-V419 HydrophobicContact CG-CG1 3.64Å; F382-V419 HydrophobicContact CG-CG2 3.84Å; F382-V419 HydrophobicContact CZ-CG1 3.39Å; F382-P420 HydrophobicContact CD1-CG 4.17Å; F382-P420 HydrophobicContact CE1-CG 3.76Å; F382-L422 HydrophobicContact CE1-CD1 4.12Å; F382-L422 HydrophobicContact CZ-CD1 4.35Å
383	F	86.8	Confident	66.5	Low	1 Å²	1	84.4 Å²	84.4	0%	0.004	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.7	-177.7	-71.7	-82.7	0	0	0	109.7	I323 E324 I325 Y337 L341 V356 L357 V359 V381 M411	I323-F383 HydrophobicContact CG2-CB 3.5Å; I323-F383 VanDerWaalsContact CG2-CB 3.5Å; I323-F383 HydrophobicContact CG2-CD1 3.75Å; I323-F383 HydrophobicContact CG2-CG 3.99Å; E324-F383 CarbonylContact O-C 3.6Å; E324-F383 WeakPolarHBondContact O-CA 3.26Å; I325-F383 HydrophobicContact CB-CD1 4.18Å; I325-F383 HydrophobicContact CB-CE1 4.02Å; I325-F383 HydrophobicContact CD1-CE1 4.21Å; I325-F383 HydrophobicContact CD1-CZ 4.43Å; I325-F383 HydrophobicContact CG1-CD1 4.44Å; I325-F383 HydrophobicContact CG1-CE1 4.11Å; Y337-F383 HydrophobicContact CD1-CZ 4.42Å; Y337-F383 HydrophobicContact CD2-CZ 4.47Å; Y337-F383 HydrophobicContact CG-CZ 4.03Å; L341-F383 HydrophobicContact CD1-CE1 4.27Å; L341-F383 HydrophobicContact CD1-CZ 4.32Å; L341-F383 HydrophobicContact CD2-CD1 4.42Å; L341-F383 HydrophobicContact CD2-CD2 3.99Å; L341-F383 HydrophobicContact CD2-CE1 4.24Å; L341-F383 HydrophobicContact CD2-CE2 3.79Å; L341-F383 HydrophobicContact CD2-CG 4.3Å; L341-F383 HydrophobicContact CD2-CZ 3.93Å; L341-F383 HydrophobicContact CG-CE2 4.49Å; L341-F383 HydrophobicContact CG-CZ 4.25Å; V356-F383 CarbonylContact C-O 3.57Å; V356-F383 WeakPolarHBondContact CA-O 3.44Å; L357-F383 HydrophobicContact CB-CB 4.38Å; L357-F383 PolarHBondContact N-O 3.2Å; L357-F383 PolarHBondContact O-N 3.39Å; V359-F383 HydrophobicContact CB-CD2 4.12Å; V359-F383 HydrophobicContact CB-CE2 4.05Å; V359-F383 HydrophobicContact CG2-CD2 3.57Å; V359-F383 HydrophobicContact CG2-CE2 3.89Å; V381-F383 HydrophobicContact CB-CE2 4.04Å; V381-F383 HydrophobicContact CG1-CD2 4.21Å; V381-F383 HydrophobicContact CG1-CE2 3.53Å; V381-F383 HydrophobicContact CG1-CZ 3.8Å; F383-M411 HydrophobicContact CE1-CE 4.32Å
384	K	87.8	Confident	66.8	Low	63 Å²	63	84.9 Å²	84.9	27%	0.274	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132	177.6	-172.3	176.3	-178.4	177.1	0	110.4	I323 E324 V326 D355 K386 A415	I323-K384 WeakPolarHBondContact CA-O 3.47Å; E324-K384 PolarHBondContact N-O 3.21Å; E324-K384 PolarHBondContact O-N 2.95Å; V326-K384 HydrophobicContact CG2-CB 4.13Å; D355-K384 WeakPolarHBondContact O-CA 3.43Å; K384-K386 PolarHBondContact O-N 2.68Å; K384-A415 HydrophobicContact CB-CB 4.13Å; K384-A415 HydrophobicContact CD-CB 4.17Å
385	V	87.2	Confident	67.4	Low	1 Å²	1	77.4 Å²	77.4	1%	0.006	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	114.8	174.5	-176.6	0	0	0	0	108.9	L321 V351 Q352 G354 D355 L357	L321-V385 HydrophobicContact CD1-CG1 3.75Å; V351-V385 HydrophobicContact CB-CG2 4.38Å; V351-V385 HydrophobicContact CG1-CG2 3.69Å; Q352-V385 VanDerWaalsContact O-CB 3.31Å; Q352-V385 WeakPolarHBondContact O-CB 3.36Å; Q352-V385 WeakPolarHBondContact O-CG1 3.46Å; G354-V385 WeakPolarHBondContact CA-O 3.36Å; G354-V385 PolarHBondContact N-O 2.97Å; D355-V385 HydrophobicContact CB-CG2 4.32Å; D355-V385 PolarHBondContact O-N 3.36Å; L357-V385 HydrophobicContact CD1-CG2 3.92Å; L357-V385 HydrophobicContact CG-CG2 4.1Å
386	K	84.9	Confident	67.8	Low	108 Å²	108	76.7 Å²	76.7	47%	0.47	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	-42.2	177.5	-170.9	-171.7	-160.6	145.8	0	111.9	H322 E324 E353 K384	H322-K386 HydrophobicContact CB-CB 4.36Å; H322-K386 PolarHBondContact O-N 3.38Å; E324-K386 HydrophobicContact CG-CB 4.21Å; E324-K386 HydrophobicContact CG-CD 4.41Å; E324-K386 WeakPolarHBondContact OE1-CD 3.45Å; E324-K386 VanDerWaalsContact OE1-CE 3.27Å; E324-K386 WeakPolarHBondContact OE1-CE 3.42Å; E324-K386 IonicContact OE1-NZ 2.69Å; E324-K386 PolarHBondContact OE1-NZ 2.99Å; E353-K386 WeakPolarHBondContact CG-O 3.4Å; K384-K386 PolarHBondContact O-N 2.68Å
387	K	83.9	Confident	68.2	Low	109 Å²	109	73.3 Å²	73.3	47%	0.474	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	137.2	-176.3	-169.7	178.7	-178.9	-173.8	0	109.9	H322 V389	H322-K387 HydrophobicContact CB-CB 4.25Å; H322-K387 PolarHBondContact N-O 3.06Å; H322-K387 PolarHBondContact O-N 2.83Å; K387-V389 HydrophobicContact CD-CG2 4.27Å; K387-V389 HydrophobicContact CG-CG2 4.25Å
388	A	82.5	Confident	69.1	Low	11 Å²	11	65 Å²	65	9%	0.091	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.5	170.4	0	0	0	0	0	109.2	L321 F400	L321-A388 HydrophobicContact CD1-CB 3.96Å; A388-F400 HydrophobicContact CB-CD2 3.64Å; A388-F400 HydrophobicContact CB-CE2 4.12Å
389	V	81.1	Confident	70	Confident	50 Å²	50	61.2 Å²	61.2	30%	0.303	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.1	-179.4	-177	0	0	0	0	108.8	A318 R319 E320 K387	A318-V389 CarbonylContact C-O 3.53Å; A318-V389 WeakPolarHBondContact CA-O 3.49Å; R319-V389 PolarHBondContact N-O 3.06Å; E320-V389 HydrophobicContact CB-CB 4.29Å; E320-V389 PolarHBondContact N-O 3.02Å; E320-V389 PolarHBondContact O-N 3.36Å; K387-V389 HydrophobicContact CD-CG2 4.27Å; K387-V389 HydrophobicContact CG-CG2 4.25Å
390	G	74.8	Confident	71.2	Confident	19 Å²	19	56.4 Å²	56.4	20%	0.196	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	180	177.4	0	0	0	0	0	112.6	A392	G390-A392 PolarHBondContact O-N 3.22Å
391	E	61	Low	71.7	Confident	126 Å²	126	54.6 Å²	54.6	59%	0.589	32%	0.322	S	S	*	.	S	Bend	trans	-77.1	85.9	176.2	-66.4	176.7	-153.8	0	0	109.9	R319	R319-E391 VanDerWaalsContact CZ-CG 3.46Å; R319-E391 IonicContact CZ-OE1 3.09Å; R319-E391 VanDerWaalsContact NE-CG 3.3Å; R319-E391 IonicContact NE-OE1 2.87Å; R319-E391 PolarHBondContact NE-OE1 2.86Å; R319-E391 IonicContact NH2-OE1 2.6Å; R319-E391 PolarHBondContact NH2-OE1 3.2Å; R319-E391 IonicContact NH2-OE2 3.95Å
392	A	55.3	Low	71.9	Confident	78 Å²	78	54.5 Å²	54.5	65%	0.645	32%	0.322	S	S	*	.			trans	25.2	136.2	165.2	0	0	0	0	0	120.2	G390	G390-A392 PolarHBondContact O-N 3.22Å
393	P	49	Very low	71.9	Confident	95 Å²	95	54.8 Å²	54.8	62%	0.617	32%	0.324	S	S	*	.				-131.3	151.5	61.7	34.5	-19.3	0	0	0	115.7	G395	P393-G395 PolarHBondContact O-N 3.19Å
394	D	47.4	Very low	71.8	Confident	175 Å²	175	57 Å²	57	94%	0.936	34%	0.338	S	S	*	.			trans	-57	100.3	168	-66.8	-52.5	0	0	0	110.8
395	G	49.5	Very low	71.6	Confident	42 Å²	42	58.8 Å²	58.8	43%	0.433	35%	0.354	S	S	.	.			trans	-145.6	157.8	169.6	0	0	0	0	0	109.9	P393 A397	P393-G395 PolarHBondContact O-N 3.19Å; G395-A397 PolarHBondContact O-N 3.44Å
396	P	45.6	Very low	71.3	Confident	135 Å²	135	64.1 Å²	64.1	88%	0.877	38%	0.379	S	S	*	.	S	Bend	trans	-68.2	3.2	-169.5	26.3	-34.2	0	0	0	115.8
397	A	54.1	Low	71.3	Confident	24 Å²	24	60 Å²	60	20%	0.198	36%	0.362	C	S	.	.			trans	-152	85.6	172.9	0	0	0	0	0	110.3	W224 P237 G395 A399	W224-A397 HydrophobicContact CH2-CB 4.28Å; W224-A397 WeakPolarHBondContact CH2-O 3.16Å; W224-A397 HydrophobicContact CZ3-CB 4.38Å; P237-A397 HydrophobicContact CG-CB 4.04Å; G395-A397 PolarHBondContact O-N 3.44Å; A397-A399 PolarHBondContact O-N 2.93Å
398	S	65.8	Low	71.4	Confident	49 Å²	49	57.8 Å²	57.8	34%	0.343	36%	0.361	S	S	.	.			trans	-83	110	175.1	51.7	0	0	0	0	110.3
399	A	75.3	Confident	71.6	Confident	6 Å²	6	60.3 Å²	60.3	5%	0.05	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132.6	171.8	0	0	0	0	0	109.8	W224 L239 V350 Q352 A397	W224-A399 HydrophobicContact CH2-CB 3.77Å; W224-A399 HydrophobicContact CZ3-CB 4.28Å; L239-A399 HydrophobicContact CB-CB 3.76Å; L239-A399 HydrophobicContact CD2-CB 3.78Å; L239-A399 HydrophobicContact CG-CB 4.41Å; V350-A399 HydrophobicContact CG1-CB 4.34Å; Q352-A399 HydrophobicContact CG-CB 3.66Å; A397-A399 PolarHBondContact O-N 2.93Å
400	F	82.9	Confident	71.9	Confident	15 Å²	15	63.2 Å²	63.2	7%	0.066	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	158.5	-178.3	-58.9	-81.6	0	0	0	111.4	P316 A318 V350 V351 A388	P316-F400 HydrophobicContact CG-CD1 4.04Å; P316-F400 HydrophobicContact CG-CE1 4.26Å; P316-F400 CarbonylContact O-C 3.57Å; P316-F400 WeakPolarHBondContact O-CA 3.4Å; A318-F400 HydrophobicContact CB-CB 3.83Å; A318-F400 HydrophobicContact CB-CG 4.27Å; V350-F400 WeakPolarHBondContact CA-O 3.47Å; V351-F400 PolarHBondContact N-O 2.52Å; V351-F400 PolarHBondContact O-N 3.5Å; A388-F400 HydrophobicContact CB-CD2 3.64Å; A388-F400 HydrophobicContact CB-CE2 4.12Å
401	L	83.9	Confident	72.3	Confident	18 Å²	18	65.9 Å²	65.9	9%	0.094	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	132	166.8	-67.6	171.9	0	0	0	110.7	W222 P315 P316 F317 A318 R349 V350	W222-L401 HydrophobicContact CH2-CD2 3.94Å; W222-L401 HydrophobicContact CZ2-CD2 4.14Å; P315-L401 HydrophobicContact CB-CG 4.45Å; P315-L401 HydrophobicContact CG-CD1 3.89Å; P315-L401 HydrophobicContact CG-CD2 4.07Å; P315-L401 HydrophobicContact CG-CG 3.73Å; P315-L401 WeakPolarHBondContact O-CD1 3.15Å; P316-L401 PolarHBondContact O-N 3.29Å; F317-L401 CarbonylContact C-O 3.52Å; F317-L401 WeakPolarHBondContact CA-O 3.32Å; F317-L401 HydrophobicContact CD1-CB 3.7Å; F317-L401 HydrophobicContact CE1-CB 3.91Å; F317-L401 HydrophobicContact CE1-CD1 4.3Å; F317-L401 HydrophobicContact CG-CB 4.35Å; F317-L401 HydrophobicContact CZ-CD1 4.37Å; A318-L401 PolarHBondContact N-O 3.48Å; R349-L401 CarbonylContact O-C 3.43Å; R349-L401 WeakPolarHBondContact O-CA 3.06Å; V350-L401 HydrophobicContact CG2-CD2 3.84Å
402	A	84.3	Confident	72.8	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.2	171.4	0	0	0	0	0	111.9	L321 F345 P348 R349 V351 T407	L321-A402 HydrophobicContact CD2-CB 3.89Å; F345-A402 HydrophobicContact CD1-CB 3.81Å; F345-A402 HydrophobicContact CE1-CB 3.8Å; P348-A402 WeakPolarHBondContact CA-O 3.46Å; R349-A402 PolarHBondContact N-O 3.34Å; R349-A402 PolarHBondContact O-N 3.38Å; V351-A402 HydrophobicContact CG2-CB 3.47Å; V351-A402 VanDerWaalsContact CG2-CB 3.47Å; A402-T407 HydrophobicContact CB-CG2 4.25Å
403	D	86.2	Confident	73.8	Confident	25 Å²	25	60.5 Å²	60.5	13%	0.134	37%	0.369	C	S	.	.			trans	-151.3	155.3	179.7	-170.2	-1.1	0	0	0	109.3	F317 P348 T405 T407	F317-D403 HydrophobicContact CE1-CB 4.45Å; P348-D403 HydrophobicContact CB-CB 4.36Å; D403-T405 PolarHBondContact O-N 2.99Å; D403-T405 PolarHBondContact OD2-OG1 3.2Å; D403-T407 PolarHBondContact N-OG1 3.21Å; D403-T407 WeakPolarHBondContact O-CB 3.45Å; D403-T407 PolarHBondContact O-N 3.21Å; D403-T407 PolarHBondContact O-OG1 3.12Å
404	T	84.4	Confident	75.3	Confident	48 Å²	48	59 Å²	59	29%	0.294	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23	175.8	54.5	0	0	0	0	115.9	Y342 F345	Y342-T404 HydrophobicContact CD2-CG2 3.95Å; Y342-T404 HydrophobicContact CE2-CG2 3.83Å; F345-T404 HydrophobicContact CB-CG2 4.42Å; F345-T404 PolarHBondContact O-N 3.05Å
405	T	84.4	Confident	76.9	Confident	100 Å²	100	51 Å²	51	61%	0.613	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-32.1	-175.2	51.8	0	0	0	0	114.2	D403	D403-T405 PolarHBondContact O-N 2.99Å; D403-T405 PolarHBondContact OD2-OG1 3.2Å
406	H	80.3	Confident	78.4	Confident	114 Å²	114	52.3 Å²	52.3	53%	0.528	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-16.6	-170.6	-66.4	-65.8	0	0	0	113.5	F317	F317-H406 HydrophobicContact CB-CB 4.1Å; F317-H406 HydrophobicContact CD1-CB 4.31Å; F317-H406 HydrophobicContact CG-CB 4.29Å
407	T	86.2	Confident	80.1	Confident	21 Å²	21	46.7 Å²	46.7	13%	0.129	28%	0.279	C	S	.	.			trans	-121.5	130.1	-166	77.1	0	0	0	0	112	A318 A402 D403	A318-T407 HydrophobicContact CB-CG2 4.14Å; A318-T407 WeakPolarHBondContact O-CB 3.37Å; A318-T407 WeakPolarHBondContact O-CG2 3.5Å; A402-T407 HydrophobicContact CB-CG2 4.25Å; D403-T407 PolarHBondContact N-OG1 3.21Å; D403-T407 WeakPolarHBondContact O-CB 3.45Å; D403-T407 PolarHBondContact O-N 3.21Å; D403-T407 PolarHBondContact O-OG1 3.12Å
408	S	86.6	Confident	81.3	Confident	63 Å²	63	49.7 Å²	49.7	44%	0.441	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	120.3	173	-63.7	0	0	0	0	109.9	R319 E320 L321	R319-S408 PolarHBondContact O-N 3.24Å; E320-S408 WeakPolarHBondContact CA-O 3.44Å; L321-S408 PolarHBondContact N-O 2.7Å
409	L	85.9	Confident	81.9	Confident	64 Å²	64	48.1 Å²	48.1	34%	0.335	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	128	-177.5	-168.5	155.8	0	0	0	110.9	L321 I323 L341 F345	L321-L409 WeakPolarHBondContact O-CA 3.44Å; I323-L409 HydrophobicContact CD1-CD1 3.71Å; I323-L409 HydrophobicContact CD1-CD2 4.46Å; I323-L409 HydrophobicContact CD1-CG 4Å; I323-L409 HydrophobicContact CG1-CG 4.46Å; L341-L409 HydrophobicContact CB-CD1 4.39Å; L341-L409 HydrophobicContact CD1-CD1 4.45Å; L341-L409 HydrophobicContact CD1-CD2 4.14Å; F345-L409 HydrophobicContact CD2-CD1 3.8Å; F345-L409 HydrophobicContact CE2-CD1 3.51Å; F345-L409 HydrophobicContact CZ-CD1 4.43Å
410	Y	86.5	Confident	81.8	Confident	110 Å²	110	48.2 Å²	48.2	43%	0.431	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.6	176.2	-62.5	-79.3	0	0	0	110.4	E320 L321 H322 I323	E320-Y410 HydrophobicContact CB-CE2 4.21Å; E320-Y410 HydrophobicContact CG-CE2 4.15Å; L321-Y410 PolarHBondContact O-N 3.05Å; H322-Y410 WeakPolarHBondContact CA-O 3.44Å; H322-Y410 AromaticContact CE1-CD2 3.61Å; H322-Y410 AromaticContact CE1-CG 3.84Å; H322-Y410 WeakPolarHBondContact ND1-CB 3.48Å; H322-Y410 AromaticContact ND1-CD2 4Å; H322-Y410 AromaticContact ND1-CG 3.96Å; I323-Y410 PolarHBondContact N-O 3.47Å
411	M	83.8	Confident	80.9	Confident	76 Å²	76	50.6 Å²	50.6	37%	0.374	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118	174.4	-164.5	178.1	-59.1	0	0	110.5	I323 L341 F383	I323-M411 CarbonylContact O-C 3.57Å; I323-M411 VanDerWaalsContact O-CA 3.31Å; I323-M411 WeakPolarHBondContact O-CA 3.46Å; L341-M411 HydrophobicContact CD1-CE 3.58Å; F383-M411 HydrophobicContact CE1-CE 4.32Å
412	A	70.6	Confident	79.8	Confident	38 Å²	38	52.1 Å²	52.1	31%	0.314	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	65	-171.7	0	0	0	0	0	112.5	I323 E324	I323-A412 PolarHBondContact O-N 3.38Å; E324-A412 HydrophobicContact CG-CB 4.36Å; E324-A412 WeakPolarHBondContact CG-O 3.18Å
413	G	77.5	Confident	78.3	Confident	52 Å²	52	56.4 Å²	56.4	54%	0.536	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	71	-153.1	177.5	0	0	0	0	0	113.5	I325	I325-G413 PolarHBondContact N-O 3.11Å
414	S	80.9	Confident	76.5	Confident	65 Å²	65	57.8 Å²	57.8	46%	0.455	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.3	-171.2	65.9	0	0	0	0	113.3	I325 S327	I325-S414 CarbonylContact O-C 3.51Å; I325-S414 VanDerWaalsContact O-CA 3.23Å; I325-S414 WeakPolarHBondContact O-CA 3.38Å; S327-S414 WeakPolarHBondContact OG-CB 3.49Å
415	A	81.1	Confident	74.4	Confident	5 Å²	5	58.9 Å²	58.9	4%	0.041	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	147.1	179.6	0	0	0	0	0	112.8	E324 I325 V326 S327 K384	E324-A415 HydrophobicContact CB-CB 3.76Å; E324-A415 WeakPolarHBondContact OE2-CB 3.43Å; I325-A415 PolarHBondContact O-N 3.41Å; V326-A415 WeakPolarHBondContact CA-O 3.28Å; S327-A415 PolarHBondContact N-O 3.3Å; K384-A415 HydrophobicContact CB-CB 4.13Å; K384-A415 HydrophobicContact CD-CB 4.17Å
416	L	80.6	Confident	72.5	Confident	71 Å²	71	64.1 Å²	64.1	37%	0.372	36%	0.364	S	S	.	.			trans	-97.2	107.1	168.8	-65.2	-177.8	0	0	0	108.6	R520 R522	L416-R520 VanDerWaalsContact CD2-O 3.29Å; L416-R520 WeakPolarHBondContact CD2-O 3.29Å; L416-R522 CarbonylContact C-O 3.43Å; L416-R522 WeakPolarHBondContact CA-O 3.48Å; L416-R522 WeakPolarHBondContact CB-O 3.33Å; L416-R522 HydrophobicContact CD1-CB 4.33Å; L416-R522 HydrophobicContact CD2-CB 4.48Å; L416-R522 WeakPolarHBondContact CD2-O 3.29Å
417	S	80.5	Confident	71.1	Confident	17 Å²	17	61.3 Å²	61.3	12%	0.119	36%	0.357	C	S	.	.			trans	-150	159.7	-174.5	-168.7	0	0	0	0	111.9	H490	S417-H490 PolarHBondContact O-CD2 3.36Å; S417-H490 PolarHBondContact O-NE2 3.17Å; S417-H490 VanDerWaalsContact O-NE2 3.1Å
418	R	79.8	Confident	69.7	Low	86 Å²	86	63.4 Å²	63.4	33%	0.325	37%	0.37	S	S	.	.			trans	-71.9	161.7	167.3	-70.7	-176.2	-148	158.7	18.8	110.5	F279 L453 G488 L489 P523	F279-R418 HydrophobicContact CE2-CB 3.67Å; F279-R418 HydrophobicContact CZ-CB 3.39Å; F279-R418 VanDerWaalsContact CZ-O 3.3Å; F279-R418 WeakPolarHBondContact CZ-O 3.33Å; R418-L453 VanDerWaalsContact NH2-CB 3.31Å; R418-L453 PolarHBondContact NH2-O 2.99Å; R418-G488 CarbonylContact C-O 3.34Å; R418-G488 VanDerWaalsContact CA-O 3.28Å; R418-G488 WeakPolarHBondContact CA-O 3.47Å; R418-G488 WeakPolarHBondContact CB-O 3.43Å; R418-L489 HydrophobicContact CG-CD2 4.13Å; R418-P523 HydrophobicContact CG-CG 3.59Å
419	V	79	Confident	68.4	Low	17 Å²	17	61.8 Å²	61.8	10%	0.103	36%	0.358	C	S	.	.			trans	-132.6	137.5	-177.5	162.8	0	0	0	0	111.5	V326 F382 G488 H490	V326-V419 HydrophobicContact CG1-CG2 3.83Å; F382-V419 HydrophobicContact CB-CG2 3.96Å; F382-V419 HydrophobicContact CD1-CG1 3.84Å; F382-V419 HydrophobicContact CD2-CB 4.27Å; F382-V419 HydrophobicContact CD2-CG1 3.32Å; F382-V419 HydrophobicContact CD2-CG2 3.89Å; F382-V419 HydrophobicContact CE1-CG1 3.71Å; F382-V419 HydrophobicContact CE2-CG1 3.19Å; F382-V419 HydrophobicContact CG-CB 4.38Å; F382-V419 HydrophobicContact CG-CG1 3.64Å; F382-V419 HydrophobicContact CG-CG2 3.84Å; F382-V419 HydrophobicContact CZ-CG1 3.39Å; V419-G488 PolarHBondContact N-O 3.36Å; V419-G488 CarbonylContact O-C 3.53Å; V419-G488 WeakPolarHBondContact O-CA 3.42Å; V419-H490 WeakPolarHBondContact CG2-CE1 2.91Å
420	P	71.6	Confident	67.4	Low	7 Å²	7	60.8 Å²	60.8	5%	0.045	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-68.7	143.7	174.4	25.7	-31.9	0	0	0	112.2	T276 F279 F382 L422	T276-P420 HydrophobicContact CG2-CG 4.25Å; F279-P420 HydrophobicContact CB-CB 3.67Å; F279-P420 HydrophobicContact CB-CG 4.46Å; F279-P420 HydrophobicContact CD1-CB 4.22Å; F279-P420 HydrophobicContact CD1-CG 4.24Å; F279-P420 HydrophobicContact CD2-CB 4.14Å; F279-P420 HydrophobicContact CG-CB 3.75Å; F279-P420 HydrophobicContact CG-CG 4.27Å; F382-P420 HydrophobicContact CD1-CG 4.17Å; F382-P420 HydrophobicContact CE1-CG 3.76Å; P420-L422 HydrophobicContact CB-CD1 4.46Å; P420-L422 HydrophobicContact CG-CD1 4.3Å
421	L	65.1	Low	66.2	Low	66 Å²	66	59.6 Å²	59.6	35%	0.346	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-79.2	121.6	166.8	-175.3	78.6	0	0	0	109.7	A275 L433	A275-L421 WeakPolarHBondContact CB-O 3.45Å; L421-L433 HydrophobicContact CD2-CD2 3.55Å; L421-L433 HydrophobicContact CD2-CG 3.95Å
422	L	60	Low	65.4	Low	50 Å²	50	57.1 Å²	57.1	26%	0.262	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-102.1	130.4	163.7	-82.8	92.4	0	0	0	110.5	T276 C358 E380 F382 P420 S424	T276-L422 HydrophobicContact CG2-CD1 4.23Å; C358-L422 HydrophobicContact CB-CD1 4.22Å; E380-L422 WeakPolarHBondContact OE1-CD2 3.28Å; E380-L422 WeakPolarHBondContact OE2-CB 3.19Å; F382-L422 HydrophobicContact CE1-CD1 4.12Å; F382-L422 HydrophobicContact CZ-CD1 4.35Å; P420-L422 HydrophobicContact CB-CD1 4.46Å; P420-L422 HydrophobicContact CG-CD1 4.3Å; L422-S424 PolarHBondContact O-N 3.45Å; L422-S424 VanDerWaalsContact O-N 3.09Å
423	P	52.8	Low	65.1	Low	89 Å²	89	56.1 Å²	56.1	58%	0.578	33%	0.33	S	S	*	.			trans	-67.6	112	178.6	24.3	-29.9	0	0	0	109.8	G425	P423-G425 PolarHBondContact O-N 3.06Å
424	S	48.4	Very low	64.7	Low	54 Å²	54	54 Å²	54	38%	0.378	31%	0.307	S	S	.	.			trans	-66.8	131.7	174.1	78.8	0	0	0	0	109.5	L422 R426 S427	L422-S424 PolarHBondContact O-N 3.45Å; L422-S424 VanDerWaalsContact O-N 3.09Å; S424-R426 CarbonylContact O-C 3.44Å; S424-R426 PolarHBondContact O-N 2.87Å; S424-S427 PolarHBondContact O-N 2.95Å
425	G	40.3	Very low	64.6	Low	71 Å²	71	50.9 Å²	50.9	73%	0.732	29%	0.285	S	S	*	.	S	Bend	trans	-61.5	16.7	-174.8	0	0	0	0	0	118.2	P423	P423-G425 PolarHBondContact O-N 3.06Å
426	R	44.6	Very low	64.3	Low	210 Å²	210	50.9 Å²	50.9	79%	0.792	29%	0.285	S	S	*	.	S	Bend	trans	-128	72	159.6	-80.7	-175.5	163.4	-176.2	-5.5	106.4	S424 T428	S424-R426 CarbonylContact O-C 3.44Å; S424-R426 PolarHBondContact O-N 2.87Å; R426-T428 PolarHBondContact O-N 3.47Å
427	S	50.8	Low	64.1	Low	55 Å²	55	48 Å²	48	39%	0.385	27%	0.272	S	S	.	.			trans	-68.9	103.9	177.1	51.4	0	0	0	0	108.2	S424	S424-S427 PolarHBondContact O-N 2.95Å
428	T	58.4	Low	64.1	Low	65 Å²	65	47.4 Å²	47.4	40%	0.399	27%	0.267	S	S	.	.			trans	-69.7	148.1	157	67.1	0	0	0	0	107.2	R426 W430 D431	R426-T428 PolarHBondContact O-N 3.47Å; T428-W430 PolarHBondContact O-N 3.06Å; T428-D431 PolarHBondContact O-N 3.19Å; T428-D431 PolarHBondContact OG1-OD2 3.04Å
429	P	59.1	Low	64.3	Low	29 Å²	29	45.9 Å²	45.9	19%	0.188	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-56.5	-17.3	179	20.5	-32.2	0	0	0	113.2	S432 A607 L608	P429-S432 VanDerWaalsContact O-CB 3.29Å; P429-S432 WeakPolarHBondContact O-CB 3.34Å; P429-A607 HydrophobicContact CB-CB 4.18Å; P429-L608 HydrophobicContact CG-CD2 3.75Å
430	W	63.8	Low	64.5	Low	44 Å²	44	47.5 Å²	47.5	17%	0.167	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-79.6	-19.1	177.8	-51.3	118.9	0	0	0	114.8	T428 T478 V604 L608 V632	T428-W430 PolarHBondContact O-N 3.06Å; W430-T478 HydrophobicContact CB-CG2 3.85Å; W430-T478 HydrophobicContact CE3-CG2 4.02Å; W430-T478 WeakPolarHBondContact O-CG2 3.37Å; W430-V604 HydrophobicContact CH2-CG1 3.99Å; W430-L608 HydrophobicContact CH2-CD1 4.35Å; W430-L608 HydrophobicContact CH2-CD2 4.13Å; W430-L608 HydrophobicContact CH2-CG 4.49Å; W430-L608 HydrophobicContact CZ2-CD1 3.96Å; W430-L608 HydrophobicContact CZ2-CD2 3.3Å; W430-L608 HydrophobicContact CZ2-CG 4.03Å; W430-V632 HydrophobicContact CE3-CG1 4.44Å; W430-V632 HydrophobicContact CH2-CG1 3.03Å; W430-V632 HydrophobicContact CZ2-CG1 3.88Å; W430-V632 HydrophobicContact CZ3-CG1 3.36Å
431	D	61.2	Low	65.1	Low	84 Å²	84	47.4 Å²	47.4	45%	0.449	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-88.6	5.1	174.6	-57.6	-51	0	0	0	111.8	T428	T428-D431 PolarHBondContact O-N 3.19Å; T428-D431 PolarHBondContact OG1-OD2 3.04Å
432	S	68	Low	66.2	Low	24 Å²	24	44.3 Å²	44.3	17%	0.168	26%	0.262	C	S	.	.	S	Bend	trans	-70	149.3	174.6	-175.7	0	0	0	0	111.5	P429 S434	P429-S432 VanDerWaalsContact O-CB 3.29Å; P429-S432 WeakPolarHBondContact O-CB 3.34Å; S432-S434 PolarHBondContact O-N 3.21Å; S432-S434 PolarHBondContact OG-N 3.19Å
433	L	64.6	Low	67.5	Low	17 Å²	17	45.7 Å²	45.7	9%	0.089	27%	0.27	C	S	.	.	S	Bend	trans	-63.6	-22.9	175	-70.4	164.9	0	0	0	113.1	L198 P285 L286 L421 R486	L198-L433 HydrophobicContact CD1-CD1 4.32Å; P285-L433 HydrophobicContact CB-CD1 3.76Å; P285-L433 HydrophobicContact CB-CD2 4.38Å; P285-L433 HydrophobicContact CG-CD1 4.16Å; P285-L433 HydrophobicContact CG-CD2 4Å; L286-L433 HydrophobicContact CD1-CB 4.39Å; L286-L433 HydrophobicContact CD2-CB 3.91Å; L286-L433 HydrophobicContact CD2-CD1 4.37Å; L286-L433 HydrophobicContact CG-CB 4.15Å; L421-L433 HydrophobicContact CD2-CD2 3.55Å; L421-L433 HydrophobicContact CD2-CG 3.95Å; L433-R486 HydrophobicContact CD2-CB 4.44Å
434	S	69.1	Low	69.1	Low	8 Å²	8	46.3 Å²	46.3	6%	0.056	27%	0.265	C	S	.	.	S	Bend	trans	-136.5	88	175.8	51.1	0	0	0	0	108.6	S432	S432-S434 PolarHBondContact O-N 3.21Å; S432-S434 PolarHBondContact OG-N 3.19Å
435	P	77.9	Confident	71	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.247	C	C	.	.			trans	-62	130.4	175.1	22.6	-30.8	0	0	0	109.3	G437 L438 V442 T478 A482	P435-G437 PolarHBondContact O-N 2.98Å; P435-L438 HydrophobicContact CG-CB 4.13Å; P435-L438 PolarHBondContact O-N 3.4Å; P435-V442 HydrophobicContact CG-CG2 4.2Å; P435-T478 HydrophobicContact CB-CG2 4.39Å; P435-A482 HydrophobicContact CG-CB 3.93Å
436	P	75.3	Confident	73.1	Confident	5 Å²	5	40.8 Å²	40.8	3%	0.032	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	140.1	-177.7	24.2	-33.4	0	0	0	110.4	P257 L438 S603 V604 A607	P257-P436 HydrophobicContact CG-CB 4.1Å; P436-L438 PolarHBondContact O-N 3.27Å; P436-S603 WeakPolarHBondContact CB-OG 3.44Å; P436-V604 HydrophobicContact CB-CG2 4.38Å; P436-V604 HydrophobicContact CG-CG2 4.45Å; P436-V604 WeakPolarHBondContact O-CG2 3.06Å; P436-A607 HydrophobicContact CB-CB 4.42Å; P436-A607 HydrophobicContact CG-CB 3.58Å
437	G	75.3	Confident	75	Confident	9 Å²	9	33.9 Å²	33.9	9%	0.093	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	-13.9	-178.7	0	0	0	0	0	115.9	P435	P435-G437 PolarHBondContact O-N 2.98Å
438	L	81.6	Confident	76.5	Confident	6 Å²	6	32.9 Å²	32.9	3%	0.031	19%	0.193	C	C	.	.			trans	-114.5	12.1	179.2	-66.7	175	0	0	0	113.3	P435 P436 A440 L441 V442 A479 V593 V632	P435-L438 HydrophobicContact CG-CB 4.13Å; P435-L438 PolarHBondContact O-N 3.4Å; P436-L438 PolarHBondContact O-N 3.27Å; L438-A440 PolarHBondContact O-N 2.94Å; L438-L441 PolarHBondContact O-N 2.85Å; L438-V442 WeakPolarHBondContact O-CG2 3.19Å; L438-V442 PolarHBondContact O-N 3.2Å; L438-A479 HydrophobicContact CD1-CB 4.45Å; L438-V593 HydrophobicContact CD2-CG1 4.17Å; L438-V632 HydrophobicContact CD1-CG2 4.41Å; L438-V632 HydrophobicContact CG-CG2 4.48Å
439	E	82.3	Confident	77.7	Confident	53 Å²	53	29.9 Å²	29.9	25%	0.248	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-41.7	-172.6	-58.3	-178	171.1	0	0	113	S258 L441 V442 N443	S258-E439 WeakPolarHBondContact CB-OE1 3.46Å; S258-E439 VanDerWaalsContact CB-OE2 3.25Å; S258-E439 WeakPolarHBondContact CB-OE2 2.96Å; S258-E439 PolarHBondContact OG-OE1 3.36Å; S258-E439 PolarHBondContact OG-OE2 2.92Å; E439-L441 PolarHBondContact O-N 3.45Å; E439-V442 PolarHBondContact O-N 2.82Å; E439-N443 WeakPolarHBondContact O-CB 3.41Å; E439-N443 PolarHBondContact O-N 3.19Å; E439-N443 PolarHBondContact O-ND2 3Å
440	A	84.2	Confident	78.7	Confident	52 Å²	52	32.5 Å²	32.5	43%	0.43	18%	0.183	S	C	.	.	H	α-helix	trans	-59	-47.2	177.7	0	0	0	0	0	111.6	L438 V442 N443 E444	L438-A440 PolarHBondContact O-N 2.94Å; A440-V442 PolarHBondContact O-N 3.49Å; A440-N443 WeakPolarHBondContact O-CB 3.37Å; A440-N443 PolarHBondContact O-N 3.42Å; A440-E444 PolarHBondContact O-N 3.31Å
441	L	85.1	Confident	79.3	Confident	4 Å²	4	32.9 Å²	32.9	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-67.9	-36.6	-179.7	-172.4	140.5	0	0	0	112.2	L438 E439 N443 E444 L445 L468 A479 V593	L438-L441 PolarHBondContact O-N 2.85Å; E439-L441 PolarHBondContact O-N 3.45Å; L441-N443 VanDerWaalsContact C-N 3.35Å; L441-E444 PolarHBondContact O-N 2.87Å; L441-L445 HydrophobicContact CD2-CD1 3.6Å; L441-L445 HydrophobicContact CD2-CG 4.25Å; L441-L445 WeakPolarHBondContact O-CB 3.33Å; L441-L445 WeakPolarHBondContact O-CG 3.39Å; L441-L445 PolarHBondContact O-N 3.33Å; L441-L468 HydrophobicContact CD1-CD2 4.23Å; L441-L468 HydrophobicContact CD2-CD2 4.14Å; L441-L468 HydrophobicContact CG-CD2 4.47Å; L441-A479 HydrophobicContact CD2-CB 3.35Å; L441-V593 HydrophobicContact CD1-CB 4.12Å; L441-V593 HydrophobicContact CD1-CG1 4.33Å; L441-V593 HydrophobicContact CD1-CG2 3.71Å
442	V	87.2	Confident	79.8	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-65	-40.3	173.3	174	0	0	0	0	110.9	P435 L438 E439 A440 C446 A479 A482 A483	P435-V442 HydrophobicContact CG-CG2 4.2Å; L438-V442 WeakPolarHBondContact O-CG2 3.19Å; L438-V442 PolarHBondContact O-N 3.2Å; E439-V442 PolarHBondContact O-N 2.82Å; A440-V442 PolarHBondContact O-N 3.49Å; V442-C446 WeakPolarHBondContact O-CB 3.5Å; V442-C446 PolarHBondContact O-N 2.94Å; V442-C446 PolarHBondContact O-SG 2.98Å; V442-A479 HydrophobicContact CG2-CB 4.05Å; V442-A482 HydrophobicContact CG1-CB 4.38Å; V442-A482 HydrophobicContact CG2-CB 4.03Å; V442-A483 HydrophobicContact CG1-CB 4.27Å
443	N	87	Confident	80	Confident	80 Å²	80	29.9 Å²	29.9	43%	0.428	17%	0.172	S	C	.	.	H	α-helix	trans	-63.3	-44.8	176.3	-71.2	-30.7	0	0	0	111.9	E439 A440 L441 C446 A447 R486	E439-N443 WeakPolarHBondContact O-CB 3.41Å; E439-N443 PolarHBondContact O-N 3.19Å; E439-N443 PolarHBondContact O-ND2 3Å; A440-N443 WeakPolarHBondContact O-CB 3.37Å; A440-N443 PolarHBondContact O-N 3.42Å; L441-N443 VanDerWaalsContact C-N 3.35Å; N443-C446 PolarHBondContact O-N 3.22Å; N443-A447 WeakPolarHBondContact O-CB 3.3Å; N443-A447 PolarHBondContact O-N 3.37Å; N443-R486 PolarHBondContact OD1-NH1 2.92Å
444	E	86.9	Confident	80.2	Confident	101 Å²	101	35 Å²	35	47%	0.472	20%	0.196	S	C	.	.	H	α-helix	trans	-63.3	-46.2	176.5	-73.7	177.7	-179.1	0	0	112.1	A440 L441 C446 A447 I448	A440-E444 PolarHBondContact O-N 3.31Å; L441-E444 PolarHBondContact O-N 2.87Å; E444-C446 VanDerWaalsContact C-N 3.31Å; E444-C446 PolarHBondContact O-N 2.81Å; E444-A447 WeakPolarHBondContact O-CB 3.44Å; E444-A447 PolarHBondContact O-N 3Å; E444-A447 VanDerWaalsContact O-N 3.1Å; E444-I448 WeakPolarHBondContact O-CG1 3.39Å; E444-I448 PolarHBondContact O-N 2.97Å
445	L	87.4	Confident	79.6	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-44.3	173.8	-78.3	174.5	0	0	0	111.5	L441 A447 I448 L449 V466 L468 V480 A483 L591	L441-L445 HydrophobicContact CD2-CD1 3.6Å; L441-L445 HydrophobicContact CD2-CG 4.25Å; L441-L445 WeakPolarHBondContact O-CB 3.33Å; L441-L445 WeakPolarHBondContact O-CG 3.39Å; L441-L445 PolarHBondContact O-N 3.33Å; L445-A447 VanDerWaalsContact C-N 3.32Å; L445-A447 PolarHBondContact O-N 2.86Å; L445-I448 PolarHBondContact O-N 2.84Å; L445-L449 WeakPolarHBondContact O-CB 3.17Å; L445-L449 WeakPolarHBondContact O-CG 3.42Å; L445-L449 PolarHBondContact O-N 2.9Å; L445-V466 HydrophobicContact CD2-CG1 4.03Å; L445-L468 HydrophobicContact CD1-CD1 4.28Å; L445-L468 HydrophobicContact CD1-CD2 4.44Å; L445-L468 HydrophobicContact CD2-CD1 4.47Å; L445-L468 HydrophobicContact CD2-CD2 4.29Å; L445-V480 HydrophobicContact CD1-CG2 4.25Å; L445-A483 HydrophobicContact CB-CB 3.93Å; L445-A483 HydrophobicContact CD1-CB 4.26Å; L445-L591 HydrophobicContact CD2-CD1 3.48Å; L445-L591 VanDerWaalsContact CD2-CD1 3.48Å; L445-L591 HydrophobicContact CG-CD1 3.91Å
446	C	85.5	Confident	78.3	Confident	9 Å²	9	43.2 Å²	43.2	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-37.6	175.9	-73.4	0	0	0	0	112.2	V442 N443 E444 I448 L449 K450	V442-C446 WeakPolarHBondContact O-CB 3.5Å; V442-C446 PolarHBondContact O-N 2.94Å; V442-C446 PolarHBondContact O-SG 2.98Å; N443-C446 PolarHBondContact O-N 3.22Å; E444-C446 VanDerWaalsContact C-N 3.31Å; E444-C446 PolarHBondContact O-N 2.81Å; C446-I448 VanDerWaalsContact C-N 3.34Å; C446-I448 PolarHBondContact O-N 2.75Å; C446-L449 PolarHBondContact O-N 2.83Å; C446-K450 WeakPolarHBondContact O-CB 3.45Å; C446-K450 PolarHBondContact O-N 2.77Å
447	A	83.8	Confident	77.2	Confident	65 Å²	65	43.7 Å²	43.7	54%	0.537	26%	0.262	S	S	.	.	H	α-helix	trans	-65.6	-34.7	177.3	0	0	0	0	0	112.6	N443 E444 L445 P451	N443-A447 WeakPolarHBondContact O-CB 3.3Å; N443-A447 PolarHBondContact O-N 3.37Å; E444-A447 WeakPolarHBondContact O-CB 3.44Å; E444-A447 PolarHBondContact O-N 3Å; E444-A447 VanDerWaalsContact O-N 3.1Å; L445-A447 VanDerWaalsContact C-N 3.32Å; L445-A447 PolarHBondContact O-N 2.86Å; A447-P451 WeakPolarHBondContact O-CD 3.49Å; A447-P451 WeakPolarHBondContact O-CG 3.41Å
448	I	83.1	Confident	76	Confident	34 Å²	34	48.9 Å²	48.9	17%	0.174	29%	0.292	C	S	.	.	H	α-helix	trans	-76.2	-40.3	177.1	-66.5	161.2	0	0	0	111.6	E444 L445 C446 P451 H452 V466 L591	E444-I448 WeakPolarHBondContact O-CG1 3.39Å; E444-I448 PolarHBondContact O-N 2.97Å; L445-I448 PolarHBondContact O-N 2.84Å; C446-I448 VanDerWaalsContact C-N 3.34Å; C446-I448 PolarHBondContact O-N 2.75Å; I448-P451 WeakPolarHBondContact O-CD 3.07Å; I448-H452 PolarHBondContact O-CE1 3.07Å; I448-H452 PolarHBondContact O-ND1 2.92Å; I448-V466 HydrophobicContact CG2-CG2 3.88Å; I448-L591 HydrophobicContact CD1-CD1 3.83Å; I448-L591 HydrophobicContact CD1-CD2 4.1Å; I448-L591 HydrophobicContact CD1-CG 4.22Å
449	L	82.8	Confident	74.4	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-81.9	-31.3	-175	-61.9	173.6	0	0	0	113	L445 C446 H452 L487 M568	L445-L449 WeakPolarHBondContact O-CB 3.17Å; L445-L449 WeakPolarHBondContact O-CG 3.42Å; L445-L449 PolarHBondContact O-N 2.9Å; C446-L449 PolarHBondContact O-N 2.83Å; L449-H452 PolarHBondContact O-N 2.99Å; L449-L487 HydrophobicContact CB-CD1 3.54Å; L449-L487 HydrophobicContact CD1-CD1 4.1Å; L449-L487 HydrophobicContact CG-CD1 4.48Å; L449-M568 HydrophobicContact CB-SD 4.24Å; L449-M568 HydrophobicContact CD2-CB 4.32Å; L449-M568 HydrophobicContact CD2-CG 4.23Å; L449-M568 HydrophobicContact CD2-SD 3.65Å; L449-M568 HydrophobicContact CG-SD 4.42Å
450	K	79.8	Confident	73.1	Confident	83 Å²	83	57.8 Å²	57.8	36%	0.361	34%	0.341	S	S	.	.	S	Bend	trans	-62.2	-38.5	-175.8	-174.8	170.3	-176.1	165.1	0	115.3	D284 C446 H452 L453 L487	D284-K450 IonicContact OD1-NZ 3.59Å; D284-K450 PolarHBondContact OD1-NZ 3.4Å; D284-K450 IonicContact OD2-NZ 3.5Å; D284-K450 PolarHBondContact OD2-NZ 2.99Å; C446-K450 WeakPolarHBondContact O-CB 3.45Å; C446-K450 PolarHBondContact O-N 2.77Å; K450-H452 VanDerWaalsContact C-N 3.33Å; K450-H452 PolarHBondContact O-N 3.18Å; K450-L453 WeakPolarHBondContact O-CB 3.5Å; K450-L453 PolarHBondContact O-N 2.95Å; K450-L487 HydrophobicContact CB-CD2 4.23Å
451	P	77.6	Confident	71.3	Confident	52 Å²	52	61.9 Å²	61.9	34%	0.338	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-61.7	-37.5	177.9	-25.9	35.1	0	0	0	113.7	A447 I448 L453 Q454 L460	A447-P451 WeakPolarHBondContact O-CD 3.49Å; A447-P451 WeakPolarHBondContact O-CG 3.41Å; I448-P451 WeakPolarHBondContact O-CD 3.07Å; P451-L453 PolarHBondContact O-N 3.05Å; P451-L453 VanDerWaalsContact O-N 3.13Å; P451-Q454 PolarHBondContact O-N 2.9Å; P451-L460 HydrophobicContact CB-CD1 4.01Å
452	H	71.9	Confident	69.7	Low	27 Å²	27	63.8 Å²	63.8	13%	0.125	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-68.3	-10.3	179.2	-62.9	96.8	0	0	0	113.7	I448 L449 K450 P566 M568	I448-H452 PolarHBondContact O-CE1 3.07Å; I448-H452 PolarHBondContact O-ND1 2.92Å; L449-H452 PolarHBondContact O-N 2.99Å; K450-H452 VanDerWaalsContact C-N 3.33Å; K450-H452 PolarHBondContact O-N 3.18Å; H452-P566 HydrophobicContact CB-CG 4.4Å; H452-M568 HydrophobicContact CB-CE 3.39Å
453	L	72.1	Confident	68.3	Low	18 Å²	18	64.9 Å²	64.9	9%	0.094	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-96.8	-9.5	-177.2	-71.3	-177.2	0	0	0	113.5	R418 K450 P451 L487 L489 M568	R418-L453 VanDerWaalsContact NH2-CB 3.31Å; R418-L453 PolarHBondContact NH2-O 2.99Å; K450-L453 WeakPolarHBondContact O-CB 3.5Å; K450-L453 PolarHBondContact O-N 2.95Å; P451-L453 PolarHBondContact O-N 3.05Å; P451-L453 VanDerWaalsContact O-N 3.13Å; L453-L487 HydrophobicContact CD1-CB 4.21Å; L453-L487 HydrophobicContact CD1-CD1 4.32Å; L453-L487 HydrophobicContact CD1-CD2 4.38Å; L453-L489 HydrophobicContact CD1-CD1 4.23Å; L453-L489 HydrophobicContact CD1-CD2 3.94Å; L453-L489 HydrophobicContact CD1-CG 4.36Å; L453-L489 HydrophobicContact CD2-CD2 3.61Å; L453-L489 HydrophobicContact CG-CD2 4.43Å; L453-M568 HydrophobicContact CD2-CE 3.65Å; L453-M568 HydrophobicContact CG-CE 3.93Å
454	Q	68.4	Low	67.4	Low	126 Å²	126	61.3 Å²	61.3	59%	0.589	37%	0.369	S	S	*	.	S	Bend	trans	-87.8	145.1	-177.1	-67.1	-176.3	-15.7	0	0	111.8	P451 G456 G457	P451-Q454 PolarHBondContact O-N 2.9Å; Q454-G456 PolarHBondContact O-N 3.04Å; Q454-G457 PolarHBondContact O-N 2.87Å
455	P	55.6	Low	67.2	Low	135 Å²	135	56.6 Å²	56.6	88%	0.877	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	96	174.7	26.8	-31.5	0	0	0	109.3
456	G	51.2	Low	67.3	Low	45 Å²	45	56.6 Å²	56.6	46%	0.464	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	139.3	-15.4	-168.3	0	0	0	0	0	113.6	Q454 T458 L459	Q454-G456 PolarHBondContact O-N 3.04Å; G456-T458 PolarHBondContact O-N 2.83Å; G456-T458 VanDerWaalsContact O-N 3.14Å; G456-L459 PolarHBondContact O-N 3.29Å
457	G	52.2	Low	67.5	Low	14 Å²	14	56.2 Å²	56.2	14%	0.144	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-65	-9.8	174.8	0	0	0	0	0	114.6	Q454 L459 L460	Q454-G457 PolarHBondContact O-N 2.87Å; G457-L459 PolarHBondContact O-N 3.47Å; G457-L460 WeakPolarHBondContact O-CB 3.28Å; G457-L460 PolarHBondContact O-N 3.09Å; G457-L460 VanDerWaalsContact O-N 3.09Å
458	T	49.6	Very low	67.9	Low	118 Å²	118	53.1 Å²	53.1	72%	0.724	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-64.5	-13.8	172.3	44.4	0	0	0	0	113.7	G456	G456-T458 PolarHBondContact O-N 2.83Å; G456-T458 VanDerWaalsContact O-N 3.14Å
459	L	49	Very low	68.1	Low	152 Å²	152	52 Å²	52	80%	0.796	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-86	-14.4	173.2	-69.6	168.8	0	0	0	113.5	G456 G457 T461	G456-L459 PolarHBondContact O-N 3.29Å; G457-L459 PolarHBondContact O-N 3.47Å; L459-T461 VanDerWaalsContact C-N 3.27Å; L459-T461 PolarHBondContact O-N 3.43Å
460	L	53.8	Low	68.2	Low	95 Å²	95	52.5 Å²	52.5	50%	0.497	32%	0.319	S	S	.	.			trans	-78.9	83.7	169.8	-66.7	168.7	0	0	0	107.3	P451 G457 G462	P451-L460 HydrophobicContact CB-CD1 4.01Å; G457-L460 WeakPolarHBondContact O-CB 3.28Å; G457-L460 PolarHBondContact O-N 3.09Å; G457-L460 VanDerWaalsContact O-N 3.09Å; L460-G462 VanDerWaalsContact C-N 3.29Å; L460-G462 PolarHBondContact O-N 3.02Å
461	T	46.6	Very low	68.3	Low	138 Å²	138	51.7 Å²	51.7	85%	0.847	32%	0.322	S	S	*	.			trans	-70.2	86.3	175	53.3	0	0	0	0	109.2	L459	L459-T461 VanDerWaalsContact C-N 3.27Å; L459-T461 PolarHBondContact O-N 3.43Å
462	G	52.8	Low	68.5	Low	43 Å²	43	54.2 Å²	54.2	44%	0.443	34%	0.338	S	S	.	.	S	Bend	trans	-167.9	135.1	175.6	0	0	0	0	0	110.4	L460 S464	L460-G462 VanDerWaalsContact C-N 3.29Å; L460-G462 PolarHBondContact O-N 3.02Å; G462-S464 PolarHBondContact O-N 2.9Å
463	T	57.9	Low	68.9	Low	25 Å²	25	55.1 Å²	55.1	15%	0.153	35%	0.354	C	S	.	.			trans	-57.7	125.5	173.7	46.1	0	0	0	0	109.2	C465 L555 L556 E558 P588	T463-C465 PolarHBondContact O-N 3.26Å; T463-L555 VanDerWaalsContact CG2-O 3.22Å; T463-L555 WeakPolarHBondContact CG2-O 3.45Å; T463-L556 HydrophobicContact CG2-CD2 4.23Å; T463-E558 HydrophobicContact CG2-CG 4.39Å; T463-P588 WeakPolarHBondContact O-CG 3.5Å
464	S	67.6	Low	69.4	Low	4 Å²	4	54.5 Å²	54.5	3%	0.028	35%	0.352	C	S	.	.			trans	-78.8	53.4	178.6	57.1	0	0	0	0	111.5	G462 L567 M568 V569	G462-S464 PolarHBondContact O-N 2.9Å; S464-L567 PolarHBondContact OG-O 3.31Å; S464-M568 WeakPolarHBondContact OG-CA 3.35Å; S464-M568 WeakPolarHBondContact OG-CG 3.5Å; S464-V569 PolarHBondContact O-N 3Å
465	C	83	Confident	70.2	Confident	3 Å²	3	49 Å²	49	2%	0.02	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.1	-178.8	-69.8	0	0	0	0	110.2	T463 V569 F587 P588	T463-C465 PolarHBondContact O-N 3.26Å; C465-V569 CarbonylContact C-O 3.54Å; C465-V569 VanDerWaalsContact CA-O 3.27Å; C465-V569 WeakPolarHBondContact CA-O 3.27Å; C465-F587 HydrophobicContact CB-CD1 3.61Å; C465-F587 HydrophobicContact CB-CE1 3.91Å; C465-F587 HydrophobicContact CB-CG 4.45Å; C465-P588 WeakPolarHBondContact O-CD 3.23Å
466	V	89.1	Confident	71.7	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.7	177.5	-175.6	0	0	0	0	109.9	L445 I448 V569 V570 A571 H589 L591	L445-V466 HydrophobicContact CD2-CG1 4.03Å; I448-V466 HydrophobicContact CG2-CG2 3.88Å; V466-V569 PolarHBondContact N-O 3.28Å; V466-V570 HydrophobicContact CB-CG2 4.33Å; V466-V570 CarbonylContact O-C 3.49Å; V466-V570 WeakPolarHBondContact O-CA 3.37Å; V466-A571 PolarHBondContact O-N 3.23Å; V466-H589 WeakPolarHBondContact CA-O 3.39Å; V466-H589 HydrophobicContact CG1-CB 4.44Å; V466-H589 HydrophobicContact CG2-CB 4.27Å; V466-L591 HydrophobicContact CG1-CD1 3.86Å; V466-L591 HydrophobicContact CG1-CG 4.23Å
467	L	90.4	Very high	73.5	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.1	174	-175.9	63.7	0	0	0	110	Q469 I531 A571 T573 L579 F587 H589 E590 L591	L467-Q469 HydrophobicContact CD2-CG 4.33Å; L467-Q469 HydrophobicContact CG-CG 4.15Å; L467-I531 HydrophobicContact CD1-CG2 4.41Å; L467-A571 HydrophobicContact CD1-CB 3.99Å; L467-T573 HydrophobicContact CD1-CG2 3.92Å; L467-T573 HydrophobicContact CD2-CG2 4.41Å; L467-T573 HydrophobicContact CG-CG2 4.23Å; L467-L579 HydrophobicContact CD2-CD2 3.97Å; L467-F587 HydrophobicContact CB-CB 3.87Å; L467-F587 HydrophobicContact CB-CD1 3.96Å; L467-F587 HydrophobicContact CB-CD2 4.38Å; L467-F587 HydrophobicContact CB-CG 3.81Å; L467-H589 PolarHBondContact N-O 2.77Å; L467-E590 HydrophobicContact CB-CG 4.37Å; L467-E590 HydrophobicContact CD2-CG 4.4Å; L467-L591 PolarHBondContact O-N 2.95Å
468	L	90.6	Very high	75.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	119.1	174.9	-75.8	166.6	0	0	0	110.7	L441 L445 K476 V480 V570 A571 T572 T573 L591	L441-L468 HydrophobicContact CD1-CD2 4.23Å; L441-L468 HydrophobicContact CD2-CD2 4.14Å; L441-L468 HydrophobicContact CG-CD2 4.47Å; L445-L468 HydrophobicContact CD1-CD1 4.28Å; L445-L468 HydrophobicContact CD1-CD2 4.44Å; L445-L468 HydrophobicContact CD2-CD1 4.47Å; L445-L468 HydrophobicContact CD2-CD2 4.29Å; L468-K476 HydrophobicContact CB-CD 4.22Å; L468-K476 HydrophobicContact CB-CG 4.49Å; L468-V480 HydrophobicContact CD1-CG2 3.23Å; L468-V570 HydrophobicContact CD1-CG1 3.63Å; L468-V570 HydrophobicContact CG-CG1 4.24Å; L468-A571 PolarHBondContact N-O 2.93Å; L468-T572 HydrophobicContact CB-CG2 4.29Å; L468-T572 HydrophobicContact CD1-CG2 4.44Å; L468-T572 CarbonylContact O-C 3.56Å; L468-T572 WeakPolarHBondContact O-CA 3.43Å; L468-T573 PolarHBondContact O-N 3.18Å; L468-L591 CarbonylContact C-O 3.58Å; L468-L591 WeakPolarHBondContact CA-O 3.31Å; L468-L591 HydrophobicContact CD2-CB 3.72Å; L468-L591 HydrophobicContact CD2-CD1 4.13Å
469	Q	88.6	Confident	77	Confident	11 Å²	11	39.2 Å²	39.2	5%	0.051	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	146.7	-176.7	-54.4	-180	8.1	0	0	110.8	L467 T573 E590 L591 E592 V593	L467-Q469 HydrophobicContact CD2-CG 4.33Å; L467-Q469 HydrophobicContact CG-CG 4.15Å; Q469-T573 HydrophobicContact CB-CG2 4.24Å; Q469-T573 HydrophobicContact CG-CG2 3.75Å; Q469-E590 PolarHBondContact NE2-OE2 3.13Å; Q469-L591 PolarHBondContact N-O 3.44Å; Q469-E592 HydrophobicContact CB-CG 4.24Å; Q469-V593 WeakPolarHBondContact O-CG2 3.36Å; Q469-V593 PolarHBondContact O-N 3.24Å
470	G	85.1	Confident	78.9	Confident	13 Å²	13	32 Å²	32	13%	0.134	22%	0.216	C	C	.	.			trans	153.3	177.3	169.1	0	0	0	0	0	113.3	K476 T573 S574	G470-K476 PolarHBondContact O-NZ 3.31Å; G470-T573 PolarHBondContact N-O 3.47Å; G470-S574 CarbonylContact C-O 3.59Å; G470-S574 VanDerWaalsContact O-CA 3.3Å; G470-S574 WeakPolarHBondContact O-CA 3.37Å; G470-S574 VanDerWaalsContact O-O 3.08Å
471	P	81.5	Confident	80.5	Confident	65 Å²	65	28.7 Å²	28.7	42%	0.422	20%	0.199	S	C	.	.			trans	-64.1	152.1	-176.4	25.1	-32.9	0	0	0	112.9	S474 K476 V631	P471-S474 WeakPolarHBondContact O-CB 3.42Å; P471-S474 PolarHBondContact O-N 3.01Å; P471-S474 PolarHBondContact O-OG 3.27Å; P471-K476 PolarHBondContact O-NZ 3.31Å; P471-V631 HydrophobicContact CB-CG2 4.43Å; P471-V631 HydrophobicContact CG-CG2 4.09Å
472	P	82.5	Confident	82.3	Confident	106 Å²	106	22.2 Å²	22.2	69%	0.688	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	143.7	174.3	26.9	-34.3	0	0	0	110.3	S474	P472-S474 VanDerWaalsContact C-N 3.33Å; P472-S474 PolarHBondContact O-N 3.45Å
473	G	79.6	Confident	83.9	Confident	45 Å²	45	20.2 Å²	20.2	46%	0.464	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	82	0.7	-178.5	0	0	0	0	0	115.6	G475 V631 G633	G473-G475 PolarHBondContact O-N 3.33Å; G473-V631 WeakPolarHBondContact O-CG1 3.2Å; G473-G633 PolarHBondContact O-N 3.37Å
474	S	82.5	Confident	85.2	Confident	6 Å²	6	19.1 Å²	19.1	4%	0.042	13%	0.132	C	C	.	.	S	Bend	trans	-69.9	4	178.9	73.5	0	0	0	0	116.3	P471 P472 K476	P471-S474 WeakPolarHBondContact O-CB 3.42Å; P471-S474 PolarHBondContact O-N 3.01Å; P471-S474 PolarHBondContact O-OG 3.27Å; P472-S474 VanDerWaalsContact C-N 3.33Å; P472-S474 PolarHBondContact O-N 3.45Å; S474-K476 VanDerWaalsContact C-N 3.35Å; S474-K476 PolarHBondContact OG-NZ 2.78Å
475	G	85.1	Confident	85.8	Confident	10 Å²	10	20.2 Å²	20.2	10%	0.103	14%	0.14	C	C	.	.	S	Bend	trans	76.5	20.3	179.3	0	0	0	0	0	113.8	G473 T477 T478 A479	G473-G475 PolarHBondContact O-N 3.33Å; G475-T477 VanDerWaalsContact C-N 3.31Å; G475-T477 PolarHBondContact O-N 2.81Å; G475-T478 CarbonylContact O-C 3.56Å; G475-T478 WeakPolarHBondContact O-CA 3.36Å; G475-T478 WeakPolarHBondContact O-CB 3.38Å; G475-T478 PolarHBondContact O-N 3.48Å; G475-A479 PolarHBondContact O-N 3.37Å
476	K	88	Confident	85.6	Confident	20 Å²	20	21.8 Å²	21.8	9%	0.087	15%	0.145	C	C	.	.	H	α-helix	trans	-49	-49.8	175.7	-74.8	-178.4	-79.7	-79.4	0	112.9	L468 G470 P471 S474 T478 A479 V480 T572 V593	L468-K476 HydrophobicContact CB-CD 4.22Å; L468-K476 HydrophobicContact CB-CG 4.49Å; G470-K476 PolarHBondContact O-NZ 3.31Å; P471-K476 PolarHBondContact O-NZ 3.31Å; S474-K476 VanDerWaalsContact C-N 3.35Å; S474-K476 PolarHBondContact OG-NZ 2.78Å; K476-T478 VanDerWaalsContact C-N 3.3Å; K476-T478 PolarHBondContact O-N 2.99Å; K476-A479 PolarHBondContact O-N 2.82Å; K476-V480 WeakPolarHBondContact O-CG2 3.4Å; K476-V480 PolarHBondContact O-N 3.19Å; K476-T572 HydrophobicContact CB-CG2 3.88Å; K476-T572 HydrophobicContact CD-CG2 4.3Å; K476-V593 HydrophobicContact CD-CG2 4.16Å; K476-V593 HydrophobicContact CG-CG2 3.53Å
477	T	88.2	Confident	85.2	Confident	58 Å²	58	22.5 Å²	22.5	36%	0.356	15%	0.149	S	C	.	.	H	α-helix	trans	-64.1	-37.5	179.1	53.2	0	0	0	0	111.9	G475 T481 L527 T529	G475-T477 VanDerWaalsContact C-N 3.31Å; G475-T477 PolarHBondContact O-N 2.81Å; T477-T481 WeakPolarHBondContact O-CB 3.36Å; T477-T481 PolarHBondContact O-N 3.15Å; T477-T481 PolarHBondContact O-OG1 3.37Å; T477-L527 HydrophobicContact CG2-CD2 4.26Å; T477-T529 HydrophobicContact CG2-CG2 3.71Å
478	T	87.2	Confident	84.6	Confident	28 Å²	28	22.8 Å²	22.8	17%	0.172	15%	0.152	C	C	.	.	H	α-helix	trans	-65.8	-44.2	176.1	-48.9	0	0	0	0	111.2	W430 P435 G475 K476 T481 A482	W430-T478 HydrophobicContact CB-CG2 3.85Å; W430-T478 HydrophobicContact CE3-CG2 4.02Å; W430-T478 WeakPolarHBondContact O-CG2 3.37Å; P435-T478 HydrophobicContact CB-CG2 4.39Å; G475-T478 CarbonylContact O-C 3.56Å; G475-T478 WeakPolarHBondContact O-CA 3.36Å; G475-T478 WeakPolarHBondContact O-CB 3.38Å; G475-T478 PolarHBondContact O-N 3.48Å; K476-T478 VanDerWaalsContact C-N 3.3Å; K476-T478 PolarHBondContact O-N 2.99Å; T478-T481 WeakPolarHBondContact O-CB 3.31Å; T478-T481 PolarHBondContact O-N 3.2Å; T478-T481 VanDerWaalsContact O-N 3.16Å; T478-A482 WeakPolarHBondContact O-CB 3.43Å; T478-A482 PolarHBondContact O-N 3.25Å
479	A	88.1	Confident	84.3	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64	-43.2	178.2	0	0	0	0	0	112.4	L438 L441 V442 G475 K476 T481 A482 A483	L438-A479 HydrophobicContact CD1-CB 4.45Å; L441-A479 HydrophobicContact CD2-CB 3.35Å; V442-A479 HydrophobicContact CG2-CB 4.05Å; G475-A479 PolarHBondContact O-N 3.37Å; K476-A479 PolarHBondContact O-N 2.82Å; A479-T481 VanDerWaalsContact C-N 3.3Å; A479-T481 PolarHBondContact O-N 3.15Å; A479-A482 PolarHBondContact O-N 3.47Å; A479-A483 WeakPolarHBondContact O-CB 3.45Å; A479-A483 PolarHBondContact O-N 2.64Å
480	V	89	Confident	84.2	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-62.9	-40.3	173.1	178.3	0	0	0	0	110.8	L445 L468 K476 A483 C484 L491 V525 L527 V570	L445-V480 HydrophobicContact CD1-CG2 4.25Å; L468-V480 HydrophobicContact CD1-CG2 3.23Å; K476-V480 WeakPolarHBondContact O-CG2 3.4Å; K476-V480 PolarHBondContact O-N 3.19Å; V480-A483 PolarHBondContact O-N 2.89Å; V480-C484 WeakPolarHBondContact O-CB 3.22Å; V480-C484 PolarHBondContact O-N 3.42Å; V480-C484 PolarHBondContact O-SG 3.43Å; V480-L491 HydrophobicContact CG1-CD1 4.12Å; V480-V525 HydrophobicContact CG1-CG1 4.32Å; V480-L527 HydrophobicContact CB-CD1 4.34Å; V480-L527 HydrophobicContact CB-CD2 4.21Å; V480-L527 HydrophobicContact CG1-CD1 4.13Å; V480-L527 HydrophobicContact CG1-CD2 4.12Å; V480-L527 HydrophobicContact CG1-CG 4.49Å; V480-L527 HydrophobicContact CG2-CD1 4.08Å; V480-V570 HydrophobicContact CG1-CG1 4.46Å; V480-V570 HydrophobicContact CG2-CG1 3.74Å
481	T	86.9	Confident	84.2	Confident	25 Å²	25	23.5 Å²	23.5	15%	0.153	15%	0.153	C	C	.	.	H	α-helix	trans	-61.9	-44.6	177.2	-54.2	0	0	0	0	111.4	T477 T478 A479 S485 L491 K493	T477-T481 WeakPolarHBondContact O-CB 3.36Å; T477-T481 PolarHBondContact O-N 3.15Å; T477-T481 PolarHBondContact O-OG1 3.37Å; T478-T481 WeakPolarHBondContact O-CB 3.31Å; T478-T481 PolarHBondContact O-N 3.2Å; T478-T481 VanDerWaalsContact O-N 3.16Å; A479-T481 VanDerWaalsContact C-N 3.3Å; A479-T481 PolarHBondContact O-N 3.15Å; T481-S485 VanDerWaalsContact O-CB 3.31Å; T481-S485 WeakPolarHBondContact O-CB 3.3Å; T481-S485 PolarHBondContact O-N 2.97Å; T481-S485 PolarHBondContact O-OG 2.85Å; T481-L491 HydrophobicContact CG2-CD2 3.94Å; T481-L491 WeakPolarHBondContact OG1-CD2 3.46Å; T481-K493 VanDerWaalsContact OG1-CE 3.25Å; T481-K493 WeakPolarHBondContact OG1-CE 3.41Å; T481-K493 PolarHBondContact OG1-NZ 3.45Å
482	A	84	Confident	84.5	Confident	2 Å²	2	20.8 Å²	20.8	2%	0.017	13%	0.134	C	C	.	.	H	α-helix	trans	-64.4	-44.6	176.4	0	0	0	0	0	112	P435 V442 T478 A479 S485 R486	P435-A482 HydrophobicContact CG-CB 3.93Å; V442-A482 HydrophobicContact CG1-CB 4.38Å; V442-A482 HydrophobicContact CG2-CB 4.03Å; T478-A482 WeakPolarHBondContact O-CB 3.43Å; T478-A482 PolarHBondContact O-N 3.25Å; A479-A482 PolarHBondContact O-N 3.47Å; A482-S485 PolarHBondContact O-N 2.94Å; A482-R486 WeakPolarHBondContact O-CB 3.45Å; A482-R486 PolarHBondContact O-N 3.17Å
483	A	86.1	Confident	84.8	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-62.5	-44.2	177.7	0	0	0	0	0	112.3	V442 L445 A479 V480 S485 R486 L487	V442-A483 HydrophobicContact CG1-CB 4.27Å; L445-A483 HydrophobicContact CB-CB 3.93Å; L445-A483 HydrophobicContact CD1-CB 4.26Å; A479-A483 WeakPolarHBondContact O-CB 3.45Å; A479-A483 PolarHBondContact O-N 2.64Å; V480-A483 PolarHBondContact O-N 2.89Å; A483-S485 VanDerWaalsContact C-N 3.31Å; A483-S485 PolarHBondContact O-N 3.35Å; A483-R486 PolarHBondContact O-N 3.5Å; A483-L487 WeakPolarHBondContact O-CG 3.47Å; A483-L487 PolarHBondContact O-N 2.8Å; A483-L487 VanDerWaalsContact O-N 3.09Å
484	C	85.5	Confident	85.3	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.007	11%	0.106	C	C	.	.	H	α-helix	trans	-62.3	-41.9	175.2	-65.8	0	0	0	0	111.1	V480 L487 G488 L489 L491 V525	V480-C484 WeakPolarHBondContact O-CB 3.22Å; V480-C484 PolarHBondContact O-N 3.42Å; V480-C484 PolarHBondContact O-SG 3.43Å; C484-L487 PolarHBondContact O-N 3.07Å; C484-G488 PolarHBondContact O-N 2.89Å; C484-L489 HydrophobicContact CB-CB 4.4Å; C484-L489 PolarHBondContact O-N 2.92Å; C484-L491 HydrophobicContact CB-CB 4.32Å; C484-V525 VanDerWaalsContact SG-CG2 3.57Å
485	S	81.1	Confident	85.5	Confident	28 Å²	28	20.7 Å²	20.7	20%	0.196	11%	0.114	C	C	.	.	H	α-helix	trans	-66.3	-37.2	179.1	-57.5	0	0	0	0	112.2	T481 A482 A483 G488	T481-S485 VanDerWaalsContact O-CB 3.31Å; T481-S485 WeakPolarHBondContact O-CB 3.3Å; T481-S485 PolarHBondContact O-N 2.97Å; T481-S485 PolarHBondContact O-OG 2.85Å; A482-S485 PolarHBondContact O-N 2.94Å; A483-S485 VanDerWaalsContact C-N 3.31Å; A483-S485 PolarHBondContact O-N 3.35Å; S485-G488 PolarHBondContact O-N 3.18Å
486	R	79.1	Confident	85.5	Confident	35 Å²	35	20.2 Å²	20.2	13%	0.132	11%	0.11	C	C	.	.	H	α-helix	trans	-67	-35.3	175.5	-177	171.4	177.5	-177.8	3.2	112.8	P285 L433 N443 A482 A483	P285-R486 WeakPolarHBondContact CD-O 3.38Å; P285-R486 HydrophobicContact CG-CB 4.39Å; P285-R486 HydrophobicContact CG-CG 3.92Å; L433-R486 HydrophobicContact CD2-CB 4.44Å; N443-R486 PolarHBondContact OD1-NH1 2.92Å; A482-R486 WeakPolarHBondContact O-CB 3.45Å; A482-R486 PolarHBondContact O-N 3.17Å; A483-R486 PolarHBondContact O-N 3.5Å
487	L	79.8	Confident	85.4	Confident	17 Å²	17	27.2 Å²	27.2	9%	0.089	14%	0.137	C	C	.	.	H	α-helix	trans	-88.6	-8.5	178.7	-64	174.7	0	0	0	113.7	L449 K450 L453 A483 C484 L489	L449-L487 HydrophobicContact CB-CD1 3.54Å; L449-L487 HydrophobicContact CD1-CD1 4.1Å; L449-L487 HydrophobicContact CG-CD1 4.48Å; K450-L487 HydrophobicContact CB-CD2 4.23Å; L453-L487 HydrophobicContact CD1-CB 4.21Å; L453-L487 HydrophobicContact CD1-CD1 4.32Å; L453-L487 HydrophobicContact CD1-CD2 4.38Å; A483-L487 WeakPolarHBondContact O-CG 3.47Å; A483-L487 PolarHBondContact O-N 2.8Å; A483-L487 VanDerWaalsContact O-N 3.09Å; C484-L487 PolarHBondContact O-N 3.07Å; L487-L489 HydrophobicContact CB-CD1 3.99Å; L487-L489 HydrophobicContact CB-CG 3.85Å; L487-L489 HydrophobicContact CD1-CD1 4Å
488	G	78.8	Confident	85.3	Confident	6 Å²	6	27 Å²	27	6%	0.062	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	31.6	-175.6	0	0	0	0	0	114	R418 V419 C484 S485	R418-G488 CarbonylContact C-O 3.34Å; R418-G488 VanDerWaalsContact CA-O 3.28Å; R418-G488 WeakPolarHBondContact CA-O 3.47Å; R418-G488 WeakPolarHBondContact CB-O 3.43Å; V419-G488 PolarHBondContact N-O 3.36Å; V419-G488 CarbonylContact O-C 3.53Å; V419-G488 WeakPolarHBondContact O-CA 3.42Å; C484-G488 PolarHBondContact O-N 2.89Å; S485-G488 PolarHBondContact O-N 3.18Å
489	L	84	Confident	85.1	Confident	12 Å²	12	26 Å²	26	6%	0.063	13%	0.131	C	C	.	.			trans	-91.6	145.7	-179.7	-58.9	175.3	0	0	0	111.7	R418 L453 C484 L487 P523 V525 M568	R418-L489 HydrophobicContact CG-CD2 4.13Å; L453-L489 HydrophobicContact CD1-CD1 4.23Å; L453-L489 HydrophobicContact CD1-CD2 3.94Å; L453-L489 HydrophobicContact CD1-CG 4.36Å; L453-L489 HydrophobicContact CD2-CD2 3.61Å; L453-L489 HydrophobicContact CG-CD2 4.43Å; C484-L489 HydrophobicContact CB-CB 4.4Å; C484-L489 PolarHBondContact O-N 2.92Å; L487-L489 HydrophobicContact CB-CD1 3.99Å; L487-L489 HydrophobicContact CB-CG 3.85Å; L487-L489 HydrophobicContact CD1-CD1 4Å; L489-P523 HydrophobicContact CD2-CB 3.98Å; L489-P523 HydrophobicContact CD2-CG 4.28Å; L489-V525 HydrophobicContact CB-CG2 4.21Å; L489-V525 HydrophobicContact CD1-CG2 3.68Å; L489-M568 HydrophobicContact CD1-SD 3.93Å
490	H	85.4	Confident	84.8	Confident	8 Å²	8	28.7 Å²	28.7	4%	0.037	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	132.4	171.3	-68.4	-61.8	0	0	0	110.6	S417 V419 C521 P523 A524 V525	S417-H490 PolarHBondContact O-CD2 3.36Å; S417-H490 PolarHBondContact O-NE2 3.17Å; S417-H490 VanDerWaalsContact O-NE2 3.1Å; V419-H490 WeakPolarHBondContact CG2-CE1 2.91Å; H490-C521 PolarHBondContact CD2-O 3.5Å; H490-P523 PolarHBondContact N-O 3.32Å; H490-A524 HydrophobicContact CB-CB 3.93Å; H490-A524 CarbonylContact O-C 3.53Å; H490-A524 WeakPolarHBondContact O-CA 3.24Å; H490-A524 WeakPolarHBondContact O-CB 3.34Å; H490-V525 PolarHBondContact O-N 2.9Å
491	L	86.7	Confident	84.5	Confident	19 Å²	19	30.3 Å²	30.3	10%	0.099	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	115.5	179.4	178.7	59.7	0	0	0	110.8	V480 T481 C484 K493 V525 L527	V480-L491 HydrophobicContact CG1-CD1 4.12Å; T481-L491 HydrophobicContact CG2-CD2 3.94Å; T481-L491 WeakPolarHBondContact OG1-CD2 3.46Å; C484-L491 HydrophobicContact CB-CB 4.32Å; L491-K493 HydrophobicContact CD1-CG 4.41Å; L491-K493 HydrophobicContact CD2-CD 4.36Å; L491-K493 HydrophobicContact CD2-CG 4.15Å; L491-K493 HydrophobicContact CG-CG 3.92Å; L491-V525 HydrophobicContact CD1-CB 4.37Å; L491-V525 HydrophobicContact CD1-CG1 4.4Å; L491-L527 HydrophobicContact CD1-CB 3.8Å; L491-L527 HydrophobicContact CD1-CD2 4.35Å
492	L	87.9	Confident	84	Confident	7 Å²	7	35.8 Å²	35.8	4%	0.037	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	105	171.1	-176.7	63.8	0	0	0	109.3	P329 V494 R517 A518 V525 L526 L527	P329-L492 HydrophobicContact CB-CD1 3.94Å; L492-V494 HydrophobicContact CD2-CG2 4.28Å; L492-V494 HydrophobicContact CG-CG2 3.98Å; L492-R517 HydrophobicContact CD2-CB 4.42Å; L492-R517 HydrophobicContact CD2-CG 4.06Å; L492-A518 HydrophobicContact CD2-CB 3.9Å; L492-V525 PolarHBondContact N-O 3.34Å; L492-L526 HydrophobicContact CB-CD1 4.44Å; L492-L526 HydrophobicContact CD2-CD1 3.98Å; L492-L526 HydrophobicContact CG-CD1 4.22Å; L492-L527 PolarHBondContact O-N 3.18Å
493	K	88.8	Confident	84.1	Confident	109 Å²	109	38.8 Å²	38.8	47%	0.474	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	118.2	176.4	-56.6	-175.3	177.3	177.6	0	109.2	T481 L491 L527	T481-K493 VanDerWaalsContact OG1-CE 3.25Å; T481-K493 WeakPolarHBondContact OG1-CE 3.41Å; T481-K493 PolarHBondContact OG1-NZ 3.45Å; L491-K493 HydrophobicContact CD1-CG 4.41Å; L491-K493 HydrophobicContact CD2-CD 4.36Å; L491-K493 HydrophobicContact CD2-CG 4.15Å; L491-K493 HydrophobicContact CG-CG 3.92Å; K493-L527 HydrophobicContact CG-CD2 4.27Å
494	V	89.6	Confident	84	Confident	14 Å²	14	40.7 Å²	40.7	9%	0.085	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	106.3	175.6	-177	0	0	0	0	108.3	L492 C496 L499 A514 L526 L527 L528 T529	L492-V494 HydrophobicContact CD2-CG2 4.28Å; L492-V494 HydrophobicContact CG-CG2 3.98Å; V494-C496 PolarHBondContact O-N 2.9Å; V494-L499 HydrophobicContact CG1-CD1 3.77Å; V494-L499 HydrophobicContact CG1-CD2 3.79Å; V494-L499 HydrophobicContact CG1-CG 3.83Å; V494-A514 HydrophobicContact CG1-CB 4.44Å; V494-A514 HydrophobicContact CG2-CB 4.43Å; V494-L526 HydrophobicContact CB-CD1 4.37Å; V494-L526 HydrophobicContact CG2-CD1 3.67Å; V494-L527 PolarHBondContact N-O 3.11Å; V494-L528 HydrophobicContact CB-CD2 4.18Å; V494-L528 HydrophobicContact CG1-CD2 4.45Å; V494-T529 PolarHBondContact O-N 3.44Å; V494-T529 VanDerWaalsContact O-N 3.12Å
495	P	87.1	Confident	83.9	Confident	32 Å²	32	42.4 Å²	42.4	21%	0.208	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	128.3	173.4	27.2	-29.4	0	0	0	111.1	Y497 S498 T529	P495-Y497 HydrophobicContact CB-CD1 3.54Å; P495-Y497 HydrophobicContact CB-CE1 3.25Å; P495-Y497 HydrophobicContact CB-CG 4.38Å; P495-Y497 HydrophobicContact CG-CD1 4.33Å; P495-Y497 HydrophobicContact CG-CE1 3.72Å; P495-Y497 PolarHBondContact O-N 2.97Å; P495-S498 WeakPolarHBondContact O-CB 3.36Å; P495-S498 PolarHBondContact O-N 3.15Å; P495-S498 PolarHBondContact O-OG 3.34Å; P495-T529 VanDerWaalsContact CA-OG1 3.23Å; P495-T529 WeakPolarHBondContact CA-OG1 3.24Å
496	C	84.7	Confident	84.2	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.007	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-28.7	-176.4	-67.3	0	0	0	0	112.6	V494 S498 L499 C500 T529 A530	V494-C496 PolarHBondContact O-N 2.9Å; C496-S498 PolarHBondContact O-N 2.82Å; C496-S498 VanDerWaalsContact O-N 3.15Å; C496-L499 WeakPolarHBondContact O-CB 3.5Å; C496-L499 PolarHBondContact O-N 3.01Å; C496-C500 PolarHBondContact O-N 3.34Å; C496-C500 PolarHBondContact O-SG 3.33Å; C496-T529 VanDerWaalsContact CB-O 3.25Å; C496-T529 WeakPolarHBondContact CB-O 3.32Å; C496-T529 PolarHBondContact N-O 3.15Å; C496-T529 PolarHBondContact SG-O 2.95Å; C496-A530 WeakPolarHBondContact CB-O 3.5Å
497	Y	84.5	Confident	84.6	Confident	167 Å²	167	41.4 Å²	41.4	66%	0.655	24%	0.243	S	C	*	.	H	α-helix	trans	-59.4	-26.8	172.7	77.4	-104.2	0	0	0	113.5	P495 L499	P495-Y497 HydrophobicContact CB-CD1 3.54Å; P495-Y497 HydrophobicContact CB-CE1 3.25Å; P495-Y497 HydrophobicContact CB-CG 4.38Å; P495-Y497 HydrophobicContact CG-CD1 4.33Å; P495-Y497 HydrophobicContact CG-CE1 3.72Å; P495-Y497 PolarHBondContact O-N 2.97Å; Y497-L499 VanDerWaalsContact C-N 3.34Å
498	S	86.5	Confident	85	Confident	52 Å²	52	43.8 Å²	43.8	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-78.7	-22.7	177.5	71.4	0	0	0	0	112.8	P495 C496 K510	P495-S498 WeakPolarHBondContact O-CB 3.36Å; P495-S498 PolarHBondContact O-N 3.15Å; P495-S498 PolarHBondContact O-OG 3.34Å; C496-S498 PolarHBondContact O-N 2.82Å; C496-S498 VanDerWaalsContact O-N 3.15Å; S498-K510 PolarHBondContact O-NZ 2.78Å
499	L	83.8	Confident	85.5	Confident	8 Å²	8	47.5 Å²	47.5	4%	0.042	28%	0.275	C	S	.	.	H	α-helix	trans	-80.4	-30.4	176.8	-58.8	177.8	0	0	0	111.1	V494 C496 Y497 A501 K510 L511 A514 L528 L534	V494-L499 HydrophobicContact CG1-CD1 3.77Å; V494-L499 HydrophobicContact CG1-CD2 3.79Å; V494-L499 HydrophobicContact CG1-CG 3.83Å; C496-L499 WeakPolarHBondContact O-CB 3.5Å; C496-L499 PolarHBondContact O-N 3.01Å; Y497-L499 VanDerWaalsContact C-N 3.34Å; L499-A501 PolarHBondContact O-N 3.37Å; L499-K510 HydrophobicContact CD2-CB 4.16Å; L499-L511 HydrophobicContact CD1-CD1 3.88Å; L499-A514 HydrophobicContact CD2-CB 4.39Å; L499-L528 HydrophobicContact CD1-CD2 4.49Å; L499-L534 HydrophobicContact CB-CD1 4.17Å; L499-L534 HydrophobicContact CD1-CD1 4.45Å
500	C	82.1	Confident	85.8	Confident	56 Å²	56	51 Å²	51	38%	0.378	29%	0.289	S	S	.	.			trans	-54.2	133.2	172.2	-58.6	0	0	0	0	110.7	C496 K510	C496-C500 PolarHBondContact O-N 3.34Å; C496-C500 PolarHBondContact O-SG 3.33Å; C500-K510 PolarHBondContact O-NZ 3.47Å
501	A	81.4	Confident	85.9	Confident	36 Å²	36	50.6 Å²	50.6	30%	0.298	29%	0.288	S	S	.	.			trans	-145.7	165.5	179.1	0	0	0	0	0	108.5	L499 S503 A506 V507	L499-A501 PolarHBondContact O-N 3.37Å; A501-S503 PolarHBondContact O-N 3.19Å; A501-S503 VanDerWaalsContact O-N 3.15Å; A501-A506 HydrophobicContact CB-CB 3.7Å; A501-V507 HydrophobicContact CB-CG2 3.92Å
502	D	78.1	Confident	86.1	Confident	140 Å²	140	53.8 Å²	53.8	75%	0.749	30%	0.302	S	S	*	.	S	Bend	trans	-67.7	-13.4	-176.7	-63	-37.6	0	0	0	113.9	R538	D502-R538 IonicContact OD1-CZ 2.7Å; D502-R538 IonicContact OD1-NH2 3Å; D502-R538 PolarHBondContact OD1-NH2 2.96Å
503	S	84.8	Confident	86.1	Confident	66 Å²	66	56 Å²	56	46%	0.462	32%	0.322	S	S	.	.	S	Bend	trans	-132.4	142.3	176.8	69.1	0	0	0	0	112.1	A501 G505 A506 V507	A501-S503 PolarHBondContact O-N 3.19Å; A501-S503 VanDerWaalsContact O-N 3.15Å; S503-G505 VanDerWaalsContact C-N 3.28Å; S503-G505 PolarHBondContact O-N 3.5Å; S503-A506 WeakPolarHBondContact O-CB 3.49Å; S503-A506 PolarHBondContact O-N 3.44Å; S503-A506 VanDerWaalsContact OG-CB 3.3Å; S503-A506 WeakPolarHBondContact OG-CB 3.17Å; S503-A506 PolarHBondContact OG-N 3.05Å; S503-V507 PolarHBondContact O-N 3.13Å; S503-V507 VanDerWaalsContact O-N 3.14Å
504	S	83.6	Confident	86.1	Confident	41 Å²	41	51.4 Å²	51.4	29%	0.287	30%	0.304	S	S	.	.	H	α-helix	trans	-59.3	-34.8	179.1	50.2	0	0	0	0	113.3	V507 E508	S504-V507 PolarHBondContact O-N 3.1Å; S504-E508 PolarHBondContact O-N 3.36Å
505	G	84.7	Confident	86	Confident	36 Å²	36	50.9 Å²	50.9	37%	0.371	30%	0.3	S	S	.	.	H	α-helix	trans	-67.7	-32.7	174.3	0	0	0	0	0	113.9	S503 T509	S503-G505 VanDerWaalsContact C-N 3.28Å; S503-G505 PolarHBondContact O-N 3.5Å; G505-T509 WeakPolarHBondContact O-CG2 3.34Å; G505-T509 PolarHBondContact O-N 3.26Å; G505-T509 VanDerWaalsContact O-N 3.1Å; G505-T509 PolarHBondContact O-OG1 3.28Å; G505-T509 VanDerWaalsContact O-OG1 3.13Å
506	A	86.3	Confident	86	Confident	31 Å²	31	51.8 Å²	51.8	26%	0.256	31%	0.307	S	S	.	.	H	α-helix	trans	-71.1	-35.1	173.2	0	0	0	0	0	111.6	A501 S503 T509 K510	A501-A506 HydrophobicContact CB-CB 3.7Å; S503-A506 WeakPolarHBondContact O-CB 3.49Å; S503-A506 PolarHBondContact O-N 3.44Å; S503-A506 VanDerWaalsContact OG-CB 3.3Å; S503-A506 WeakPolarHBondContact OG-CB 3.17Å; S503-A506 PolarHBondContact OG-N 3.05Å; A506-T509 WeakPolarHBondContact CA-OG1 3.38Å; A506-T509 PolarHBondContact O-OG1 3.32Å; A506-K510 WeakPolarHBondContact O-CB 3.28Å; A506-K510 VanDerWaalsContact O-CG 3.3Å; A506-K510 WeakPolarHBondContact O-CG 3.32Å; A506-K510 PolarHBondContact O-N 3.39Å; A506-K510 VanDerWaalsContact O-N 3.15Å
507	V	87.2	Confident	86.1	Confident	12 Å²	12	57 Å²	57	7%	0.073	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-45.1	173.2	-179.4	0	0	0	0	110.6	A501 S503 S504 K510 L511 L534 V547	A501-V507 HydrophobicContact CB-CG2 3.92Å; S503-V507 PolarHBondContact O-N 3.13Å; S503-V507 VanDerWaalsContact O-N 3.14Å; S504-V507 PolarHBondContact O-N 3.1Å; V507-K510 PolarHBondContact O-N 3.24Å; V507-L511 WeakPolarHBondContact O-CB 3.34Å; V507-L511 PolarHBondContact O-N 3.39Å; V507-L534 HydrophobicContact CG1-CD1 4.16Å; V507-V547 HydrophobicContact CB-CG2 4.37Å; V507-V547 HydrophobicContact CG1-CG1 3.85Å; V507-V547 HydrophobicContact CG1-CG2 4.3Å
508	E	88.5	Confident	86.1	Confident	66 Å²	66	49 Å²	49	31%	0.308	30%	0.296	S	S	.	.	H	α-helix	trans	-59.2	-50.3	177.5	165.9	163.9	-137.9	0	0	112.5	S504 K510 L511 Q512 T550	S504-E508 PolarHBondContact O-N 3.36Å; E508-K510 VanDerWaalsContact C-N 3.31Å; E508-K510 PolarHBondContact O-N 2.99Å; E508-L511 WeakPolarHBondContact O-CB 3.48Å; E508-L511 PolarHBondContact O-N 3.38Å; E508-L511 VanDerWaalsContact O-N 3.12Å; E508-Q512 HydrophobicContact CG-CG 4.42Å; E508-Q512 WeakPolarHBondContact O-CG 3.44Å; E508-Q512 PolarHBondContact O-N 3.48Å; E508-Q512 PolarHBondContact OE1-NE2 3.33Å; E508-T550 HydrophobicContact CG-CG2 3.88Å; E508-T550 WeakPolarHBondContact OE1-CG2 3.39Å; E508-T550 PolarHBondContact OE1-OG1 3.22Å
509	T	89.5	Confident	86	Confident	85 Å²	85	49.2 Å²	49.2	52%	0.521	29%	0.288	S	S	.	.	H	α-helix	trans	-62.2	-39	-179.9	50.4	0	0	0	0	111.9	G505 A506 A513	G505-T509 WeakPolarHBondContact O-CG2 3.34Å; G505-T509 PolarHBondContact O-N 3.26Å; G505-T509 VanDerWaalsContact O-N 3.1Å; G505-T509 PolarHBondContact O-OG1 3.28Å; G505-T509 VanDerWaalsContact O-OG1 3.13Å; A506-T509 WeakPolarHBondContact CA-OG1 3.38Å; A506-T509 PolarHBondContact O-OG1 3.32Å; T509-A513 VanDerWaalsContact O-CB 3.26Å; T509-A513 WeakPolarHBondContact O-CB 3.41Å; T509-A513 PolarHBondContact O-N 3.02Å
510	K	89.7	Confident	86	Confident	84 Å²	84	56.8 Å²	56.8	37%	0.365	32%	0.316	S	S	.	.	H	α-helix	trans	-65	-41.2	172.7	-74.7	178.1	177.5	-173.6	0	112.4	S498 L499 C500 A506 V507 E508 A513 A514	S498-K510 PolarHBondContact O-NZ 2.78Å; L499-K510 HydrophobicContact CD2-CB 4.16Å; C500-K510 PolarHBondContact O-NZ 3.47Å; A506-K510 WeakPolarHBondContact O-CB 3.28Å; A506-K510 VanDerWaalsContact O-CG 3.3Å; A506-K510 WeakPolarHBondContact O-CG 3.32Å; A506-K510 PolarHBondContact O-N 3.39Å; A506-K510 VanDerWaalsContact O-N 3.15Å; V507-K510 PolarHBondContact O-N 3.24Å; E508-K510 VanDerWaalsContact C-N 3.31Å; E508-K510 PolarHBondContact O-N 2.99Å; K510-A513 PolarHBondContact O-N 3.13Å; K510-A514 WeakPolarHBondContact O-CB 3.29Å; K510-A514 PolarHBondContact O-N 3.42Å
511	L	88.9	Confident	85.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.9	-48.3	178.3	-170.4	70.2	0	0	0	110.6	L499 V507 E508 A513 A514 F515 T550 L551 L554	L499-L511 HydrophobicContact CD1-CD1 3.88Å; V507-L511 WeakPolarHBondContact O-CB 3.34Å; V507-L511 PolarHBondContact O-N 3.39Å; E508-L511 WeakPolarHBondContact O-CB 3.48Å; E508-L511 PolarHBondContact O-N 3.38Å; E508-L511 VanDerWaalsContact O-N 3.12Å; L511-A513 VanDerWaalsContact C-N 3.31Å; L511-A513 PolarHBondContact O-N 3.34Å; L511-A514 WeakPolarHBondContact O-CB 3.23Å; L511-A514 PolarHBondContact O-N 3.25Å; L511-A514 VanDerWaalsContact O-N 3.14Å; L511-F515 HydrophobicContact CD1-CD2 4.24Å; L511-F515 HydrophobicContact CD1-CE2 3.89Å; L511-F515 HydrophobicContact CG-CD2 4.23Å; L511-F515 HydrophobicContact CG-CE2 4.18Å; L511-F515 WeakPolarHBondContact O-CD2 3.44Å; L511-F515 PolarHBondContact O-N 3.49Å; L511-T550 HydrophobicContact CD2-CG2 4.38Å; L511-L551 HydrophobicContact CD1-CD1 4.37Å; L511-L551 HydrophobicContact CD2-CB 3.93Å; L511-L551 HydrophobicContact CD2-CD1 4.33Å; L511-L554 HydrophobicContact CB-CD1 4.44Å; L511-L554 HydrophobicContact CD2-CD1 3.76Å; L511-L554 HydrophobicContact CG-CD1 3.71Å
512	Q	89.5	Confident	85.8	Confident	87 Å²	87	54.3 Å²	54.3	41%	0.407	29%	0.293	S	S	.	.	H	α-helix	trans	-60.4	-39.4	174.3	-68.9	175.7	0.7	0	0	112	E508 S516 L554	E508-Q512 HydrophobicContact CG-CG 4.42Å; E508-Q512 WeakPolarHBondContact O-CG 3.44Å; E508-Q512 PolarHBondContact O-N 3.48Å; E508-Q512 PolarHBondContact OE1-NE2 3.33Å; Q512-S516 WeakPolarHBondContact O-CB 3.44Å; Q512-S516 PolarHBondContact O-N 3.34Å; Q512-S516 PolarHBondContact O-OG 3.1Å; Q512-L554 HydrophobicContact CG-CD1 4.22Å
513	A	89.1	Confident	85.8	Confident	54 Å²	54	48 Å²	48	45%	0.446	26%	0.26	S	S	.	.	H	α-helix	trans	-64.3	-38.5	174.6	0	0	0	0	0	112.5	T509 K510 L511 S516 R517	T509-A513 VanDerWaalsContact O-CB 3.26Å; T509-A513 WeakPolarHBondContact O-CB 3.41Å; T509-A513 PolarHBondContact O-N 3.02Å; K510-A513 PolarHBondContact O-N 3.13Å; L511-A513 VanDerWaalsContact C-N 3.31Å; L511-A513 PolarHBondContact O-N 3.34Å; A513-S516 WeakPolarHBondContact CA-OG 3.18Å; A513-S516 PolarHBondContact O-OG 3.33Å; A513-R517 WeakPolarHBondContact O-CB 3.38Å; A513-R517 PolarHBondContact O-N 3.48Å
514	A	87.9	Confident	85.8	Confident	12 Å²	12	45 Å²	45	10%	0.099	24%	0.239	C	C	.	.	H	α-helix	trans	-67.1	-46.3	177	0	0	0	0	0	111.9	V494 L499 K510 L511 R517 A518	V494-A514 HydrophobicContact CG1-CB 4.44Å; V494-A514 HydrophobicContact CG2-CB 4.43Å; L499-A514 HydrophobicContact CD2-CB 4.39Å; K510-A514 WeakPolarHBondContact O-CB 3.29Å; K510-A514 PolarHBondContact O-N 3.42Å; L511-A514 WeakPolarHBondContact O-CB 3.23Å; L511-A514 PolarHBondContact O-N 3.25Å; L511-A514 VanDerWaalsContact O-N 3.14Å; A514-R517 PolarHBondContact O-N 3.28Å; A514-A518 PolarHBondContact O-N 2.98Å
515	F	88.4	Confident	86	Confident	2 Å²	2	43 Å²	43	1%	0.009	23%	0.225	C	C	.	.	H	α-helix	trans	-64.4	-43.3	176.2	-86.5	-101.8	0	0	0	111.8	L511 R517 A518 R519 L526 L528 L554 L555 L567 V569	L511-F515 HydrophobicContact CD1-CD2 4.24Å; L511-F515 HydrophobicContact CD1-CE2 3.89Å; L511-F515 HydrophobicContact CG-CD2 4.23Å; L511-F515 HydrophobicContact CG-CE2 4.18Å; L511-F515 WeakPolarHBondContact O-CD2 3.44Å; L511-F515 PolarHBondContact O-N 3.49Å; F515-R517 VanDerWaalsContact C-N 3.33Å; F515-R517 PolarHBondContact O-N 3.39Å; F515-A518 WeakPolarHBondContact O-CB 3.46Å; F515-A518 PolarHBondContact O-N 3.41Å; F515-A518 VanDerWaalsContact O-N 3.09Å; F515-R519 WeakPolarHBondContact O-CG 3.48Å; F515-R519 PolarHBondContact O-N 3.34Å; F515-L526 HydrophobicContact CD1-CD2 3.97Å; F515-L526 HydrophobicContact CD2-CD2 3.91Å; F515-L526 HydrophobicContact CE1-CD2 3.81Å; F515-L526 HydrophobicContact CE2-CD2 3.75Å; F515-L526 HydrophobicContact CG-CD2 4.04Å; F515-L526 HydrophobicContact CZ-CD2 3.7Å; F515-L528 HydrophobicContact CZ-CD1 4.5Å; F515-L554 HydrophobicContact CB-CD2 4.47Å; F515-L554 HydrophobicContact CD1-CB 4.07Å; F515-L554 HydrophobicContact CD2-CB 4.33Å; F515-L554 HydrophobicContact CD2-CD1 3.93Å; F515-L554 HydrophobicContact CE1-CB 3.97Å; F515-L554 HydrophobicContact CE2-CB 4.25Å; F515-L554 HydrophobicContact CE2-CD1 4.29Å; F515-L554 HydrophobicContact CG-CB 4.24Å; F515-L554 HydrophobicContact CG-CD1 4.24Å; F515-L554 HydrophobicContact CZ-CB 4.06Å; F515-L555 HydrophobicContact CE1-CD2 4.45Å; F515-L555 HydrophobicContact CZ-CD2 4.09Å; F515-L567 HydrophobicContact CD1-CD2 4.17Å; F515-V569 HydrophobicContact CE1-CG2 4.12Å
516	S	87.3	Confident	86.2	Confident	51 Å²	51	41.3 Å²	41.3	36%	0.357	21%	0.207	S	C	.	.	H	α-helix	trans	-65.2	-33.2	176.3	60.8	0	0	0	0	113.1	Q512 A513 R520	Q512-S516 WeakPolarHBondContact O-CB 3.44Å; Q512-S516 PolarHBondContact O-N 3.34Å; Q512-S516 PolarHBondContact O-OG 3.1Å; A513-S516 WeakPolarHBondContact CA-OG 3.18Å; A513-S516 PolarHBondContact O-OG 3.33Å; S516-R520 WeakPolarHBondContact O-CG 3.39Å; S516-R520 PolarHBondContact O-N 3.39Å; S516-R520 PolarHBondContact O-NE 2.79Å
517	R	86.1	Confident	86.5	Confident	111 Å²	111	39.8 Å²	39.8	42%	0.419	20%	0.195	S	C	.	.	H	α-helix	trans	-64.5	-41.6	169.3	178.6	178.3	160.4	177.3	-3.6	111.7	L492 A513 A514 F515 R520 C521	L492-R517 HydrophobicContact CD2-CB 4.42Å; L492-R517 HydrophobicContact CD2-CG 4.06Å; A513-R517 WeakPolarHBondContact O-CB 3.38Å; A513-R517 PolarHBondContact O-N 3.48Å; A514-R517 PolarHBondContact O-N 3.28Å; F515-R517 VanDerWaalsContact C-N 3.33Å; F515-R517 PolarHBondContact O-N 3.39Å; R517-R520 PolarHBondContact O-N 3.27Å; R517-C521 PolarHBondContact O-SG 3.33Å; R517-C521 VanDerWaalsContact O-SG 3.4Å
518	A	85.3	Confident	86.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-42.4	177.1	0	0	0	0	0	112.2	L492 A514 F515 R520 C521 L526 L567	L492-A518 HydrophobicContact CD2-CB 3.9Å; A514-A518 PolarHBondContact O-N 2.98Å; F515-A518 WeakPolarHBondContact O-CB 3.46Å; F515-A518 PolarHBondContact O-N 3.41Å; F515-A518 VanDerWaalsContact O-N 3.09Å; A518-R520 PolarHBondContact O-N 3.48Å; A518-C521 PolarHBondContact O-N 3.22Å; A518-L526 HydrophobicContact CB-CB 4.24Å; A518-L526 HydrophobicContact CB-CD1 4.29Å; A518-L526 HydrophobicContact CB-CD2 4.45Å; A518-L567 HydrophobicContact CB-CD1 3.7Å; A518-L567 HydrophobicContact CB-CD2 4.16Å
519	R	83.9	Confident	86.8	Confident	56 Å²	56	37.6 Å²	37.6	21%	0.211	19%	0.186	C	C	.	.	H	α-helix	trans	-59.4	-31.6	176.8	-68.5	-172.8	-175.3	-178.6	6.8	112.6	F515 C521 R522 D557 D559 L567	F515-R519 WeakPolarHBondContact O-CG 3.48Å; F515-R519 PolarHBondContact O-N 3.34Å; R519-C521 VanDerWaalsContact C-N 3.33Å; R519-C521 PolarHBondContact O-N 2.78Å; R519-R522 WeakPolarHBondContact O-CD 3.42Å; R519-R522 WeakPolarHBondContact O-CG 3.47Å; R519-D557 IonicContact CZ-OD2 2.73Å; R519-D557 IonicContact NH1-OD2 3.74Å; R519-D557 PolarHBondContact NH1-OD2 3.27Å; R519-D557 VanDerWaalsContact NH1-OD2 3.14Å; R519-D557 IonicContact NH2-OD2 3.14Å; R519-D557 PolarHBondContact NH2-OD2 3.3Å; R519-D559 IonicContact CZ-OD1 2.82Å; R519-D559 IonicContact CZ-OD2 3.78Å; R519-D559 IonicContact NE-OD2 3.57Å; R519-D559 IonicContact NH1-OD1 3.42Å; R519-D559 PolarHBondContact NH1-OD1 3.4Å; R519-D559 IonicContact NH1-OD2 2.71Å; R519-L567 HydrophobicContact CG-CD2 4.09Å
520	R	83.4	Confident	86.6	Confident	166 Å²	166	35.1 Å²	35.1	63%	0.626	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-17.7	176	-75.5	-177.8	-76	-178.1	-2	114.9	S327 L416 S516 R517 A518	S327-R520 WeakPolarHBondContact CB-O 3.31Å; L416-R520 VanDerWaalsContact CD2-O 3.29Å; L416-R520 WeakPolarHBondContact CD2-O 3.29Å; S516-R520 WeakPolarHBondContact O-CG 3.39Å; S516-R520 PolarHBondContact O-N 3.39Å; S516-R520 PolarHBondContact O-NE 2.79Å; R517-R520 PolarHBondContact O-N 3.27Å; A518-R520 PolarHBondContact O-N 3.48Å
521	C	79.9	Confident	86.4	Confident	12 Å²	12	31.2 Å²	31.2	8%	0.081	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	21.2	-175.2	-52.2	0	0	0	0	113	H490 R517 A518 R519 A524	H490-C521 PolarHBondContact CD2-O 3.5Å; R517-C521 PolarHBondContact O-SG 3.33Å; R517-C521 VanDerWaalsContact O-SG 3.4Å; A518-C521 PolarHBondContact O-N 3.22Å; R519-C521 VanDerWaalsContact C-N 3.33Å; R519-C521 PolarHBondContact O-N 2.78Å; C521-A524 HydrophobicContact CB-CB 4.35Å; C521-A524 WeakPolarHBondContact O-CB 3.25Å
522	R	79.5	Confident	86.2	Confident	28 Å²	28	32.3 Å²	32.3	11%	0.106	16%	0.163	C	C	.	.			trans	-60.7	146.6	-177.2	-77.4	172	168.7	159.1	1.8	112.1	L416 R519 D559 P565	L416-R522 CarbonylContact C-O 3.43Å; L416-R522 WeakPolarHBondContact CA-O 3.48Å; L416-R522 WeakPolarHBondContact CB-O 3.33Å; L416-R522 HydrophobicContact CD1-CB 4.33Å; L416-R522 HydrophobicContact CD2-CB 4.48Å; L416-R522 WeakPolarHBondContact CD2-O 3.29Å; R519-R522 WeakPolarHBondContact O-CD 3.42Å; R519-R522 WeakPolarHBondContact O-CG 3.47Å; R522-D559 IonicContact CZ-OD2 2.75Å; R522-D559 IonicContact NH1-OD2 3.94Å; R522-D559 PolarHBondContact NH1-OD2 3.14Å; R522-D559 IonicContact NH2-OD2 3.79Å; R522-D559 PolarHBondContact NH2-OD2 2.98Å; R522-P565 HydrophobicContact CB-CG 4.28Å; R522-P565 WeakPolarHBondContact CD-O 3.18Å
523	P	79.4	Confident	85.7	Confident	8 Å²	8	32.3 Å²	32.3	5%	0.052	17%	0.166	C	C	.	.	S	Bend	cis	-72.1	120.3	-9.7	29.7	-32.3	0	0	0	111.5	R418 L489 H490 P565	R418-P523 HydrophobicContact CG-CG 3.59Å; L489-P523 HydrophobicContact CD2-CB 3.98Å; L489-P523 HydrophobicContact CD2-CG 4.28Å; H490-P523 PolarHBondContact N-O 3.32Å; P523-P565 HydrophobicContact CB-CB 4.04Å; P523-P565 HydrophobicContact CB-CG 4.05Å; P523-P565 HydrophobicContact CG-CG 4.36Å
524	A	83.4	Confident	85.3	Confident	2 Å²	2	30.3 Å²	30.3	2%	0.017	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	151.3	-178.5	0	0	0	0	0	111.2	H490 C521 M568	H490-A524 HydrophobicContact CB-CB 3.93Å; H490-A524 CarbonylContact O-C 3.53Å; H490-A524 WeakPolarHBondContact O-CA 3.24Å; H490-A524 WeakPolarHBondContact O-CB 3.34Å; C521-A524 HydrophobicContact CB-CB 4.35Å; C521-A524 WeakPolarHBondContact O-CB 3.25Å; A524-M568 PolarHBondContact O-N 3.18Å
525	V	87.6	Confident	84.4	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	119.2	166.6	-179.6	0	0	0	0	108.3	V480 C484 L489 H490 L491 L492 M568 V570	V480-V525 HydrophobicContact CG1-CG1 4.32Å; C484-V525 VanDerWaalsContact SG-CG2 3.57Å; L489-V525 HydrophobicContact CB-CG2 4.21Å; L489-V525 HydrophobicContact CD1-CG2 3.68Å; H490-V525 PolarHBondContact O-N 2.9Å; L491-V525 HydrophobicContact CD1-CB 4.37Å; L491-V525 HydrophobicContact CD1-CG1 4.4Å; L492-V525 PolarHBondContact N-O 3.34Å; V525-M568 WeakPolarHBondContact CA-O 3.13Å; V525-M568 HydrophobicContact CG2-CB 4.12Å; V525-M568 HydrophobicContact CG2-SD 4.33Å; V525-V570 HydrophobicContact CG1-CB 4.14Å; V525-V570 HydrophobicContact CG1-CG2 3.63Å
526	L	90.2	Very high	83.7	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	110	168.5	176.8	63.8	0	0	0	108.4	L492 V494 F515 A518 L528 L567 M568 V569 V570	L492-L526 HydrophobicContact CB-CD1 4.44Å; L492-L526 HydrophobicContact CD2-CD1 3.98Å; L492-L526 HydrophobicContact CG-CD1 4.22Å; V494-L526 HydrophobicContact CB-CD1 4.37Å; V494-L526 HydrophobicContact CG2-CD1 3.67Å; F515-L526 HydrophobicContact CD1-CD2 3.97Å; F515-L526 HydrophobicContact CD2-CD2 3.91Å; F515-L526 HydrophobicContact CE1-CD2 3.81Å; F515-L526 HydrophobicContact CE2-CD2 3.75Å; F515-L526 HydrophobicContact CG-CD2 4.04Å; F515-L526 HydrophobicContact CZ-CD2 3.7Å; A518-L526 HydrophobicContact CB-CB 4.24Å; A518-L526 HydrophobicContact CB-CD1 4.29Å; A518-L526 HydrophobicContact CB-CD2 4.45Å; L526-L528 HydrophobicContact CD1-CD2 4.38Å; L526-L528 HydrophobicContact CD2-CD2 4.33Å; L526-L528 HydrophobicContact CG-CD2 4.22Å; L526-L528 HydrophobicContact CG-CG 4.35Å; L526-L567 HydrophobicContact CB-CD1 4.33Å; L526-M568 PolarHBondContact N-O 3.33Å; L526-V569 HydrophobicContact CB-CG2 4.49Å; L526-V569 HydrophobicContact CD2-CG2 4.49Å; L526-V570 PolarHBondContact O-N 3.26Å
527	L	92.3	Very high	82.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	107.2	176.8	177.3	61.4	0	0	0	110	T477 V480 L491 L492 K493 V494 T529 V570 T572	T477-L527 HydrophobicContact CG2-CD2 4.26Å; V480-L527 HydrophobicContact CB-CD1 4.34Å; V480-L527 HydrophobicContact CB-CD2 4.21Å; V480-L527 HydrophobicContact CG1-CD1 4.13Å; V480-L527 HydrophobicContact CG1-CD2 4.12Å; V480-L527 HydrophobicContact CG1-CG 4.49Å; V480-L527 HydrophobicContact CG2-CD1 4.08Å; L491-L527 HydrophobicContact CD1-CB 3.8Å; L491-L527 HydrophobicContact CD1-CD2 4.35Å; L492-L527 PolarHBondContact O-N 3.18Å; K493-L527 HydrophobicContact CG-CD2 4.27Å; V494-L527 PolarHBondContact N-O 3.11Å; L527-T529 HydrophobicContact CD2-CG2 4.16Å; L527-T529 HydrophobicContact CG-CG2 3.94Å; L527-V570 CarbonylContact C-O 3.53Å; L527-V570 VanDerWaalsContact CA-O 3.29Å; L527-V570 WeakPolarHBondContact CA-O 3.04Å; L527-V570 HydrophobicContact CD1-CB 4.19Å; L527-V570 HydrophobicContact CD1-CG1 4.04Å; L527-V570 WeakPolarHBondContact CD1-O 3.19Å; L527-T572 HydrophobicContact CD1-CG2 3.85Å
528	L	90.7	Very high	81.6	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	110.2	172.6	-62.6	178.5	0	0	0	109.3	V494 L499 F515 L526 I531 L551 V569 V570 A571 T572	V494-L528 HydrophobicContact CB-CD2 4.18Å; V494-L528 HydrophobicContact CG1-CD2 4.45Å; L499-L528 HydrophobicContact CD1-CD2 4.49Å; F515-L528 HydrophobicContact CZ-CD1 4.5Å; L526-L528 HydrophobicContact CD1-CD2 4.38Å; L526-L528 HydrophobicContact CD2-CD2 4.33Å; L526-L528 HydrophobicContact CG-CD2 4.22Å; L526-L528 HydrophobicContact CG-CG 4.35Å; L528-I531 HydrophobicContact CD1-CD1 4.44Å; L528-L551 HydrophobicContact CD1-CD1 4.42Å; L528-V569 HydrophobicContact CD1-CG1 4.17Å; L528-V570 PolarHBondContact N-O 3.27Å; L528-A571 HydrophobicContact CB-CB 4.42Å; L528-A571 WeakPolarHBondContact O-CA 3.41Å; L528-T572 PolarHBondContact O-N 2.94Å
529	T	90.1	Very high	80.3	Confident	30 Å²	30	46.9 Å²	46.9	18%	0.184	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	131.1	-179.7	73.4	0	0	0	0	112.1	T477 V494 P495 C496 L527 T572	T477-T529 HydrophobicContact CG2-CG2 3.71Å; V494-T529 PolarHBondContact O-N 3.44Å; V494-T529 VanDerWaalsContact O-N 3.12Å; P495-T529 VanDerWaalsContact CA-OG1 3.23Å; P495-T529 WeakPolarHBondContact CA-OG1 3.24Å; C496-T529 VanDerWaalsContact CB-O 3.25Å; C496-T529 WeakPolarHBondContact CB-O 3.32Å; C496-T529 PolarHBondContact N-O 3.15Å; C496-T529 PolarHBondContact SG-O 2.95Å; L527-T529 HydrophobicContact CD2-CG2 4.16Å; L527-T529 HydrophobicContact CG-CG2 3.94Å; T529-T572 WeakPolarHBondContact CA-OG1 3.48Å
530	A	85.4	Confident	79.2	Confident	33 Å²	33	46.3 Å²	46.3	27%	0.273	23%	0.229	S	C	.	.			trans	61.3	60	-177.9	0	0	0	0	0	112.6	C496 D532 L533 T572	C496-A530 WeakPolarHBondContact CB-O 3.5Å; A530-D532 WeakPolarHBondContact CA-OD1 3.44Å; A530-D532 VanDerWaalsContact CB-OD1 3.31Å; A530-D532 WeakPolarHBondContact CB-OD1 3.46Å; A530-D532 PolarHBondContact O-N 3.41Å; A530-L533 HydrophobicContact CB-CD1 3.96Å; A530-L533 HydrophobicContact CB-CG 4.26Å; A530-L533 PolarHBondContact O-N 3.4Å; A530-T572 WeakPolarHBondContact CA-O 3.43Å; A530-T572 PolarHBondContact N-O 2.96Å; A530-T572 VanDerWaalsContact N-O 3.16Å; A530-T572 PolarHBondContact N-OG1 3.32Å
531	I	87.1	Confident	78	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-65.9	-19.8	178.1	-167.7	164.6	0	0	0	112.8	L467 L528 L533 L534 L551 A571 T572 L579 V583 F587	L467-I531 HydrophobicContact CD1-CG2 4.41Å; L528-I531 HydrophobicContact CD1-CD1 4.44Å; I531-L533 PolarHBondContact O-N 3.09Å; I531-L534 WeakPolarHBondContact O-CB 3.33Å; I531-L534 PolarHBondContact O-N 3.21Å; I531-L551 HydrophobicContact CD1-CD1 4.23Å; I531-L551 HydrophobicContact CD1-CD2 4.34Å; I531-A571 HydrophobicContact CB-CB 4.38Å; I531-A571 HydrophobicContact CD1-CB 3.94Å; I531-A571 HydrophobicContact CG2-CB 4.16Å; I531-T572 PolarHBondContact N-O 3.49Å; I531-L579 HydrophobicContact CG1-CD1 4.17Å; I531-L579 HydrophobicContact CG2-CD1 3.8Å; I531-V583 HydrophobicContact CD1-CG1 3.95Å; I531-F587 HydrophobicContact CD1-CE2 4.17Å; I531-F587 HydrophobicContact CD1-CZ 4.09Å
532	D	83.2	Confident	77.4	Confident	24 Å²	24	51 Å²	51	13%	0.128	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-56.2	-26.6	171.2	49.8	-17.3	0	0	0	113.4	A530 L534 R536 S574 D578	A530-D532 WeakPolarHBondContact CA-OD1 3.44Å; A530-D532 VanDerWaalsContact CB-OD1 3.31Å; A530-D532 WeakPolarHBondContact CB-OD1 3.46Å; A530-D532 PolarHBondContact O-N 3.41Å; D532-L534 VanDerWaalsContact C-N 3.35Å; D532-R536 PolarHBondContact O-NE 2.99Å; D532-S574 PolarHBondContact OD2-OG 3.34Å; D532-D578 HydrophobicContact CB-CB 4.3Å
533	L	80.3	Confident	77.1	Confident	87 Å²	87	55.4 Å²	55.4	46%	0.455	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-79.4	-17	175.1	-61.3	176.4	0	0	0	113.5	A530 I531	A530-L533 HydrophobicContact CB-CD1 3.96Å; A530-L533 HydrophobicContact CB-CG 4.26Å; A530-L533 PolarHBondContact O-N 3.4Å; I531-L533 PolarHBondContact O-N 3.09Å
534	L	80	Confident	77.1	Confident	12 Å²	12	57.5 Å²	57.5	6%	0.063	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	125.4	-176.1	-156.5	89.7	0	0	0	110	L499 V507 I531 D532 V547 L551	L499-L534 HydrophobicContact CB-CD1 4.17Å; L499-L534 HydrophobicContact CD1-CD1 4.45Å; V507-L534 HydrophobicContact CG1-CD1 4.16Å; I531-L534 WeakPolarHBondContact O-CB 3.33Å; I531-L534 PolarHBondContact O-N 3.21Å; D532-L534 VanDerWaalsContact C-N 3.35Å; L534-V547 HydrophobicContact CD2-CG1 4.08Å; L534-V547 HydrophobicContact CG-CG1 3.98Å; L534-L551 HydrophobicContact CD2-CB 4.35Å; L534-L551 HydrophobicContact CD2-CD1 3.23Å; L534-L551 HydrophobicContact CD2-CG 4.31Å
535	G	69.5	Low	77	Confident	6 Å²	6	61 Å²	61	6%	0.062	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	8.6	178	0	0	0	0	0	114.9	E543 D544	G535-E543 CarbonylContact O-C 3.47Å; G535-E543 VanDerWaalsContact O-CA 3.3Å; G535-E543 WeakPolarHBondContact O-CA 3.43Å; G535-D544 PolarHBondContact O-N 2.82Å
536	R	73.2	Confident	76.8	Confident	106 Å²	106	70.1 Å²	70.1	40%	0.4	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-97.2	135	166.9	-64.7	-174.3	-179.6	-164.5	-4.3	110.1	D532 D578	D532-R536 PolarHBondContact O-NE 2.99Å; R536-D578 IonicContact CZ-OD1 3.35Å; R536-D578 IonicContact NH1-OD1 3.98Å; R536-D578 VanDerWaalsContact NH2-CG 3.27Å; R536-D578 PolarHBondContact NH2-O 3.04Å; R536-D578 IonicContact NH2-OD1 3.67Å; R536-D578 PolarHBondContact NH2-OD1 3.48Å
537	D	66.3	Low	76.6	Confident	74 Å²	74	70.4 Å²	70.4	40%	0.396	36%	0.362	S	S	.	.			trans	-68.2	166.5	171.2	-159.1	-2.1	0	0	0	110.9	D539 G540 D542	D537-D539 PolarHBondContact O-N 3.4Å; D537-D539 VanDerWaalsContact O-N 3.09Å; D537-G540 PolarHBondContact O-N 3.46Å; D537-D542 PolarHBondContact N-O 3.49Å
538	R	62.6	Low	76.3	Confident	203 Å²	203	70.6 Å²	70.6	77%	0.766	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.3	-178.7	-86.4	-173.6	165.7	-151.4	0.1	113.9	D502	D502-R538 IonicContact OD1-CZ 2.7Å; D502-R538 IonicContact OD1-NH2 3Å; D502-R538 PolarHBondContact OD1-NH2 2.96Å
539	D	58.3	Low	76.1	Confident	135 Å²	135	73.2 Å²	73.2	72%	0.722	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-7.1	179.5	-66.2	-26.8	0	0	0	113	D537 L541	D537-D539 PolarHBondContact O-N 3.4Å; D537-D539 VanDerWaalsContact O-N 3.09Å; D539-L541 PolarHBondContact O-N 3.08Å
540	G	59.9	Low	75.9	Confident	44 Å²	44	72.8 Å²	72.8	45%	0.454	38%	0.382	S	S	.	.	S	Bend	trans	69.8	5.6	174.8	0	0	0	0	0	115.6	D537	D537-G540 PolarHBondContact O-N 3.46Å
541	L	59.6	Low	76	Confident	154 Å²	154	71.3 Å²	71.3	81%	0.806	37%	0.37	S	S	*	.	S	Bend	trans	-99.6	-35	-175.8	-68.5	169	0	0	0	113.2	D539	D539-L541 PolarHBondContact O-N 3.08Å
542	D	66.6	Low	76	Confident	122 Å²	122	75.3 Å²	75.3	65%	0.652	39%	0.385	S	S	*	.	S	Bend	trans	-113.3	147	-177.1	-76.3	-25.4	0	0	0	112.2	D537	D537-D542 PolarHBondContact N-O 3.49Å
543	E	73.3	Confident	76.2	Confident	121 Å²	121	79.9 Å²	79.9	57%	0.565	41%	0.405	S	S	*	.	B	Isolated β-bridge	trans	-90.1	131.7	179	-64.8	-174.2	162.9	0	0	111.9	G535 A545	G535-E543 CarbonylContact O-C 3.47Å; G535-E543 VanDerWaalsContact O-CA 3.3Å; G535-E543 WeakPolarHBondContact O-CA 3.43Å; E543-A545 PolarHBondContact O-N 2.84Å
544	D	80.7	Confident	76.4	Confident	52 Å²	52	76.8 Å²	76.8	28%	0.278	39%	0.389	S	S	.	.			trans	-77.1	84.7	172.9	-91.5	-33.4	0	0	0	110.6	G535 R546 V547 V548	G535-D544 PolarHBondContact O-N 2.82Å; D544-R546 PolarHBondContact O-N 3.28Å; D544-V547 HydrophobicContact CB-CB 4.24Å; D544-V547 HydrophobicContact CB-CG2 4.14Å; D544-V547 PolarHBondContact O-N 3.03Å; D544-V548 PolarHBondContact O-N 2.83Å; D544-V548 VanDerWaalsContact O-N 3.14Å
545	A	80.5	Confident	76.5	Confident	76 Å²	76	76.5 Å²	76.5	63%	0.628	39%	0.387	S	S	*	.	H	α-helix	trans	-52.3	-30.4	-178.1	0	0	0	0	0	114.1	E543 A549	E543-A545 PolarHBondContact O-N 2.84Å; A545-A549 VanDerWaalsContact O-CB 3.23Å; A545-A549 WeakPolarHBondContact O-CB 3.47Å; A545-A549 PolarHBondContact O-N 3.43Å
546	R	83.4	Confident	76.9	Confident	190 Å²	190	80 Å²	80	72%	0.717	40%	0.404	S	S	*	.	H	α-helix	trans	-68.4	-47.9	177.7	-67.8	-176.8	-179.7	177.5	1.1	112.5	D544 V548 A549 T550	D544-R546 PolarHBondContact O-N 3.28Å; R546-V548 VanDerWaalsContact C-N 3.32Å; R546-A549 PolarHBondContact O-N 3.2Å; R546-T550 PolarHBondContact O-N 3.42Å; R546-T550 PolarHBondContact O-OG1 3.49Å; R546-T550 VanDerWaalsContact O-OG1 3.13Å
547	V	85.6	Confident	77	Confident	6 Å²	6	77.8 Å²	77.8	4%	0.036	40%	0.4	C	S	.	.	H	α-helix	trans	-66.8	-40.1	-179.3	178.3	0	0	0	0	110	V507 L534 D544 T550 L551	V507-V547 HydrophobicContact CB-CG2 4.37Å; V507-V547 HydrophobicContact CG1-CG1 3.85Å; V507-V547 HydrophobicContact CG1-CG2 4.3Å; L534-V547 HydrophobicContact CD2-CG1 4.08Å; L534-V547 HydrophobicContact CG-CG1 3.98Å; D544-V547 HydrophobicContact CB-CB 4.24Å; D544-V547 HydrophobicContact CB-CG2 4.14Å; D544-V547 PolarHBondContact O-N 3.03Å; V547-T550 PolarHBondContact O-N 3.23Å; V547-L551 WeakPolarHBondContact O-CB 3.41Å; V547-L551 PolarHBondContact O-N 2.96Å
548	V	85.8	Confident	76.8	Confident	5 Å²	5	79 Å²	79	3%	0.03	40%	0.404	C	S	.	.	H	α-helix	trans	-61.7	-45.2	175.2	172.1	0	0	0	0	111.4	D544 R546 L551 R552 P580 D582 V583	D544-V548 PolarHBondContact O-N 2.83Å; D544-V548 VanDerWaalsContact O-N 3.14Å; R546-V548 VanDerWaalsContact C-N 3.32Å; V548-L551 PolarHBondContact O-N 3.46Å; V548-R552 WeakPolarHBondContact O-CB 3.47Å; V548-R552 PolarHBondContact O-N 3.29Å; V548-P580 HydrophobicContact CG1-CB 4.31Å; V548-P580 HydrophobicContact CG2-CB 4.27Å; V548-P580 HydrophobicContact CG2-CG 4.02Å; V548-D582 HydrophobicContact CG1-CB 3.84Å; V548-V583 HydrophobicContact CG1-CG2 3.81Å
549	A	85.8	Confident	76.6	Confident	55 Å²	55	72.2 Å²	72.2	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-44.8	177.2	0	0	0	0	0	112.6	A545 R546 R552 H553	A545-A549 VanDerWaalsContact O-CB 3.23Å; A545-A549 WeakPolarHBondContact O-CB 3.47Å; A545-A549 PolarHBondContact O-N 3.43Å; R546-A549 PolarHBondContact O-N 3.2Å; A549-R552 PolarHBondContact O-N 3.43Å; A549-H553 WeakPolarHBondContact O-CB 3.47Å; A549-H553 PolarHBondContact O-N 3.38Å
550	T	86.8	Confident	76.3	Confident	22 Å²	22	71.6 Å²	71.6	14%	0.135	39%	0.386	C	S	.	.	H	α-helix	trans	-63	-43.1	176.1	-56	0	0	0	0	111.1	E508 L511 R546 V547 H553 L554	E508-T550 HydrophobicContact CG-CG2 3.88Å; E508-T550 WeakPolarHBondContact OE1-CG2 3.39Å; E508-T550 PolarHBondContact OE1-OG1 3.22Å; L511-T550 HydrophobicContact CD2-CG2 4.38Å; R546-T550 PolarHBondContact O-N 3.42Å; R546-T550 PolarHBondContact O-OG1 3.49Å; R546-T550 VanDerWaalsContact O-OG1 3.13Å; V547-T550 PolarHBondContact O-N 3.23Å; T550-H553 PolarHBondContact O-N 3.4Å; T550-L554 HydrophobicContact CG2-CD1 4.07Å; T550-L554 HydrophobicContact CG2-CG 4.47Å; T550-L554 WeakPolarHBondContact O-CG 3.45Å; T550-L554 PolarHBondContact O-N 3.38Å
551	L	87.5	Confident	75.8	Confident	2 Å²	2	75 Å²	75	1%	0.01	40%	0.398	C	S	.	.	H	α-helix	trans	-62.7	-46.7	177	179.7	126.8	0	0	0	111.3	L511 L528 I531 L534 V547 V548 H553 L554 L555 V583	L511-L551 HydrophobicContact CD1-CD1 4.37Å; L511-L551 HydrophobicContact CD2-CB 3.93Å; L511-L551 HydrophobicContact CD2-CD1 4.33Å; L528-L551 HydrophobicContact CD1-CD1 4.42Å; I531-L551 HydrophobicContact CD1-CD1 4.23Å; I531-L551 HydrophobicContact CD1-CD2 4.34Å; L534-L551 HydrophobicContact CD2-CB 4.35Å; L534-L551 HydrophobicContact CD2-CD1 3.23Å; L534-L551 HydrophobicContact CD2-CG 4.31Å; V547-L551 WeakPolarHBondContact O-CB 3.41Å; V547-L551 PolarHBondContact O-N 2.96Å; V548-L551 PolarHBondContact O-N 3.46Å; L551-H553 VanDerWaalsContact C-N 3.3Å; L551-H553 PolarHBondContact O-N 3.36Å; L551-L554 PolarHBondContact O-N 3.27Å; L551-L554 VanDerWaalsContact O-N 3.17Å; L551-L555 HydrophobicContact CD2-CD1 3.54Å; L551-L555 HydrophobicContact CD2-CG 4.3Å; L551-L555 HydrophobicContact CG-CD1 4.1Å; L551-L555 HydrophobicContact CG-CG 4.34Å; L551-L555 VanDerWaalsContact O-CG 3.31Å; L551-L555 WeakPolarHBondContact O-CG 3.4Å; L551-L555 PolarHBondContact O-N 3.13Å; L551-V583 HydrophobicContact CD2-CB 4.11Å; L551-V583 HydrophobicContact CD2-CG1 3.44Å; L551-V583 VanDerWaalsContact CD2-CG1 3.44Å; L551-V583 HydrophobicContact CD2-CG2 3.58Å
552	R	86.6	Confident	75.5	Confident	86 Å²	86	72.3 Å²	72.3	33%	0.325	39%	0.392	S	S	.	.	H	α-helix	trans	-57.2	-44.8	175.2	-178	-176	176.4	107.3	-0.2	111.4	V548 A549 L555 L556 D582 T585	V548-R552 WeakPolarHBondContact O-CB 3.47Å; V548-R552 PolarHBondContact O-N 3.29Å; A549-R552 PolarHBondContact O-N 3.43Å; R552-L555 PolarHBondContact O-N 2.92Å; R552-L556 HydrophobicContact CG-CD1 3.8Å; R552-L556 HydrophobicContact CG-CG 4.49Å; R552-L556 WeakPolarHBondContact O-CB 3.36Å; R552-L556 VanDerWaalsContact O-CG 3.32Å; R552-L556 WeakPolarHBondContact O-CG 3.37Å; R552-L556 PolarHBondContact O-N 3.31Å; R552-D582 PolarHBondContact NH1-O 2.87Å; R552-T585 PolarHBondContact NH1-OG1 3.24Å
553	H	87.1	Confident	74.9	Confident	119 Å²	119	74.1 Å²	74.1	55%	0.551	40%	0.401	S	S	*	.	H	α-helix	trans	-59	-49.2	175.7	-175.7	-71.6	0	0	0	110.9	A549 T550 L551 L555 L556 D557	A549-H553 WeakPolarHBondContact O-CB 3.47Å; A549-H553 PolarHBondContact O-N 3.38Å; T550-H553 PolarHBondContact O-N 3.4Å; L551-H553 VanDerWaalsContact C-N 3.3Å; L551-H553 PolarHBondContact O-N 3.36Å; H553-L555 VanDerWaalsContact C-N 3.31Å; H553-L555 PolarHBondContact O-N 3.37Å; H553-L556 PolarHBondContact O-N 3.46Å; H553-D557 WeakPolarHBondContact O-CB 3.36Å; H553-D557 PolarHBondContact O-N 2.86Å
554	L	84.6	Confident	74.2	Confident	22 Å²	22	71.7 Å²	71.7	12%	0.115	40%	0.397	C	S	.	.	H	α-helix	trans	-66.3	-28.5	-179.1	-70.3	172.4	0	0	0	114.1	L511 Q512 F515 T550 L551	L511-L554 HydrophobicContact CB-CD1 4.44Å; L511-L554 HydrophobicContact CD2-CD1 3.76Å; L511-L554 HydrophobicContact CG-CD1 3.71Å; Q512-L554 HydrophobicContact CG-CD1 4.22Å; F515-L554 HydrophobicContact CB-CD2 4.47Å; F515-L554 HydrophobicContact CD1-CB 4.07Å; F515-L554 HydrophobicContact CD2-CB 4.33Å; F515-L554 HydrophobicContact CD2-CD1 3.93Å; F515-L554 HydrophobicContact CE1-CB 3.97Å; F515-L554 HydrophobicContact CE2-CB 4.25Å; F515-L554 HydrophobicContact CE2-CD1 4.29Å; F515-L554 HydrophobicContact CG-CB 4.24Å; F515-L554 HydrophobicContact CG-CD1 4.24Å; F515-L554 HydrophobicContact CZ-CB 4.06Å; T550-L554 HydrophobicContact CG2-CD1 4.07Å; T550-L554 HydrophobicContact CG2-CG 4.47Å; T550-L554 WeakPolarHBondContact O-CG 3.45Å; T550-L554 PolarHBondContact O-N 3.38Å; L551-L554 PolarHBondContact O-N 3.27Å; L551-L554 VanDerWaalsContact O-N 3.17Å
555	L	83	Confident	73.4	Confident	6 Å²	6	71.3 Å²	71.3	3%	0.031	40%	0.398	C	S	.	.	H	α-helix	trans	-75.1	-33.1	174.4	-70.1	177.3	0	0	0	112.6	T463 F515 L551 R552 H553 V569 V583 A586 F587	T463-L555 VanDerWaalsContact CG2-O 3.22Å; T463-L555 WeakPolarHBondContact CG2-O 3.45Å; F515-L555 HydrophobicContact CE1-CD2 4.45Å; F515-L555 HydrophobicContact CZ-CD2 4.09Å; L551-L555 HydrophobicContact CD2-CD1 3.54Å; L551-L555 HydrophobicContact CD2-CG 4.3Å; L551-L555 HydrophobicContact CG-CD1 4.1Å; L551-L555 HydrophobicContact CG-CG 4.34Å; L551-L555 VanDerWaalsContact O-CG 3.31Å; L551-L555 WeakPolarHBondContact O-CG 3.4Å; L551-L555 PolarHBondContact O-N 3.13Å; R552-L555 PolarHBondContact O-N 2.92Å; H553-L555 VanDerWaalsContact C-N 3.31Å; H553-L555 PolarHBondContact O-N 3.37Å; L555-V569 HydrophobicContact CD2-CB 4.12Å; L555-V569 HydrophobicContact CD2-CG1 3.7Å; L555-V569 HydrophobicContact CD2-CG2 4.21Å; L555-V583 HydrophobicContact CD1-CG1 4.49Å; L555-A586 HydrophobicContact CB-CB 4.25Å; L555-A586 HydrophobicContact CD1-CB 3.86Å; L555-F587 HydrophobicContact CD1-CE2 3.97Å; L555-F587 HydrophobicContact CD1-CZ 3.9Å; L555-F587 HydrophobicContact CD2-CZ 4.42Å
556	L	78.3	Confident	72.8	Confident	79 Å²	79	69.7 Å²	69.7	41%	0.414	38%	0.381	S	S	.	.	H	α-helix	trans	-93	-12.5	-179.1	-63.3	176	0	0	0	113.8	T463 R552 H553 E558	T463-L556 HydrophobicContact CG2-CD2 4.23Å; R552-L556 HydrophobicContact CG-CD1 3.8Å; R552-L556 HydrophobicContact CG-CG 4.49Å; R552-L556 WeakPolarHBondContact O-CB 3.36Å; R552-L556 VanDerWaalsContact O-CG 3.32Å; R552-L556 WeakPolarHBondContact O-CG 3.37Å; R552-L556 PolarHBondContact O-N 3.31Å; H553-L556 PolarHBondContact O-N 3.46Å; L556-E558 PolarHBondContact O-N 2.9Å
557	D	73.9	Confident	72.6	Confident	60 Å²	60	61.7 Å²	61.7	32%	0.321	35%	0.352	S	S	.	.			trans	-73.5	89.7	-179	-171.4	42.1	0	0	0	110.8	R519 H553	R519-D557 IonicContact CZ-OD2 2.73Å; R519-D557 IonicContact NH1-OD2 3.74Å; R519-D557 PolarHBondContact NH1-OD2 3.27Å; R519-D557 VanDerWaalsContact NH1-OD2 3.14Å; R519-D557 IonicContact NH2-OD2 3.14Å; R519-D557 PolarHBondContact NH2-OD2 3.3Å; H553-D557 WeakPolarHBondContact O-CB 3.36Å; H553-D557 PolarHBondContact O-N 2.86Å
558	E	62.4	Low	72.5	Confident	101 Å²	101	61.5 Å²	61.5	47%	0.472	35%	0.351	S	S	.	.			trans	-79.9	114.8	168.4	-72.2	-67.8	153.1	0	0	109.1	T463 L556 P560	T463-E558 HydrophobicContact CG2-CG 4.39Å; L556-E558 PolarHBondContact O-N 2.9Å; E558-P560 WeakPolarHBondContact O-CD 3.48Å; E558-P560 VanDerWaalsContact O-N 3.16Å
559	D	58.1	Low	72.6	Confident	59 Å²	59	61.6 Å²	61.6	32%	0.316	35%	0.351	S	S	.	.			trans	-62.9	116.4	174.8	-69.2	-44.9	0	0	0	108.6	R519 R522 V561	R519-D559 IonicContact CZ-OD1 2.82Å; R519-D559 IonicContact CZ-OD2 3.78Å; R519-D559 IonicContact NE-OD2 3.57Å; R519-D559 IonicContact NH1-OD1 3.42Å; R519-D559 PolarHBondContact NH1-OD1 3.4Å; R519-D559 IonicContact NH1-OD2 2.71Å; R522-D559 IonicContact CZ-OD2 2.75Å; R522-D559 IonicContact NH1-OD2 3.94Å; R522-D559 PolarHBondContact NH1-OD2 3.14Å; R522-D559 IonicContact NH2-OD2 3.79Å; R522-D559 PolarHBondContact NH2-OD2 2.98Å; D559-V561 PolarHBondContact O-N 3.27Å
560	P	52.9	Low	72.9	Confident	122 Å²	122	59 Å²	59	79%	0.792	33%	0.33	S	S	*	.			trans	-75.4	4.9	-172.7	29.9	-35.3	0	0	0	114	E558 S562	E558-P560 WeakPolarHBondContact O-CD 3.48Å; E558-P560 VanDerWaalsContact O-N 3.16Å; P560-S562 PolarHBondContact O-N 3.36Å
561	V	50.3	Low	73.1	Confident	117 Å²	117	58 Å²	58	71%	0.709	32%	0.323	S	S	*	.			trans	-85.8	84.5	-176.5	-170.2	0	0	0	0	109.6	D559 N563	D559-V561 PolarHBondContact O-N 3.27Å; V561-N563 PolarHBondContact O-N 3.47Å; V561-N563 VanDerWaalsContact O-N 3.08Å
562	S	52.2	Low	73.2	Confident	96 Å²	96	58.3 Å²	58.3	67%	0.671	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.6	104.8	170.4	-175.2	0	0	0	0	112.7	P560	P560-S562 PolarHBondContact O-N 3.36Å
563	N	54.9	Low	73.3	Confident	160 Å²	160	54.3 Å²	54.3	86%	0.856	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	154.8	-9.1	155.3	-84.1	-13.1	0	0	0	113	V561	V561-N563 PolarHBondContact O-N 3.47Å; V561-N563 VanDerWaalsContact O-N 3.08Å
564	C	58.7	Low	73.2	Confident	70 Å²	70	50.5 Å²	50.5	47%	0.473	30%	0.297	S	S	.	.	S	Bend	trans	-90.7	142.1	177.1	-67.5	0	0	0	0	111.5
565	P	62.6	Low	72.9	Confident	45 Å²	45	56.2 Å²	56.2	29%	0.292	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-65.3	144.6	175.4	25.5	-31	0	0	0	111.1	R522 P523	R522-P565 HydrophobicContact CB-CG 4.28Å; R522-P565 WeakPolarHBondContact CD-O 3.18Å; P523-P565 HydrophobicContact CB-CB 4.04Å; P523-P565 HydrophobicContact CB-CG 4.05Å; P523-P565 HydrophobicContact CG-CG 4.36Å
566	P	68.6	Low	72.5	Confident	42 Å²	42	57.3 Å²	57.3	27%	0.273	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-64.9	149.2	-173.3	25.6	-33.8	0	0	0	112.3	H452	H452-P566 HydrophobicContact CB-CG 4.4Å
567	L	78.4	Confident	72.2	Confident	21 Å²	21	61.3 Å²	61.3	11%	0.11	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-80.9	123.1	167.7	173.5	65.8	0	0	0	108	S464 F515 A518 R519 L526 V569	S464-L567 PolarHBondContact OG-O 3.31Å; F515-L567 HydrophobicContact CD1-CD2 4.17Å; A518-L567 HydrophobicContact CB-CD1 3.7Å; A518-L567 HydrophobicContact CB-CD2 4.16Å; R519-L567 HydrophobicContact CG-CD2 4.09Å; L526-L567 HydrophobicContact CB-CD1 4.33Å; L567-V569 HydrophobicContact CG-CG2 4.46Å
568	M	84.8	Confident	72.2	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.015	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	136	176.5	-64	167.5	-178.3	0	0	109.3	L449 H452 L453 S464 L489 A524 V525 L526	L449-M568 HydrophobicContact CB-SD 4.24Å; L449-M568 HydrophobicContact CD2-CB 4.32Å; L449-M568 HydrophobicContact CD2-CG 4.23Å; L449-M568 HydrophobicContact CD2-SD 3.65Å; L449-M568 HydrophobicContact CG-SD 4.42Å; H452-M568 HydrophobicContact CB-CE 3.39Å; L453-M568 HydrophobicContact CD2-CE 3.65Å; L453-M568 HydrophobicContact CG-CE 3.93Å; S464-M568 WeakPolarHBondContact OG-CA 3.35Å; S464-M568 WeakPolarHBondContact OG-CG 3.5Å; L489-M568 HydrophobicContact CD1-SD 3.93Å; A524-M568 PolarHBondContact O-N 3.18Å; V525-M568 WeakPolarHBondContact CA-O 3.13Å; V525-M568 HydrophobicContact CG2-CB 4.12Å; V525-M568 HydrophobicContact CG2-SD 4.33Å; L526-M568 PolarHBondContact N-O 3.33Å
569	V	88	Confident	73.1	Confident	6 Å²	6	56.5 Å²	56.5	4%	0.036	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.6	178	-174.2	0	0	0	0	108.9	S464 C465 V466 F515 L526 L528 L555 L567	S464-V569 PolarHBondContact O-N 3Å; C465-V569 CarbonylContact C-O 3.54Å; C465-V569 VanDerWaalsContact CA-O 3.27Å; C465-V569 WeakPolarHBondContact CA-O 3.27Å; V466-V569 PolarHBondContact N-O 3.28Å; F515-V569 HydrophobicContact CE1-CG2 4.12Å; L526-V569 HydrophobicContact CB-CG2 4.49Å; L526-V569 HydrophobicContact CD2-CG2 4.49Å; L528-V569 HydrophobicContact CD1-CG1 4.17Å; L555-V569 HydrophobicContact CD2-CB 4.12Å; L555-V569 HydrophobicContact CD2-CG1 3.7Å; L555-V569 HydrophobicContact CD2-CG2 4.21Å; L567-V569 HydrophobicContact CG-CG2 4.46Å
570	V	90.9	Very high	74.3	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.9	173.4	-178.6	0	0	0	0	107.8	V466 L468 V480 V525 L526 L527 L528	V466-V570 HydrophobicContact CB-CG2 4.33Å; V466-V570 CarbonylContact O-C 3.49Å; V466-V570 WeakPolarHBondContact O-CA 3.37Å; L468-V570 HydrophobicContact CD1-CG1 3.63Å; L468-V570 HydrophobicContact CG-CG1 4.24Å; V480-V570 HydrophobicContact CG1-CG1 4.46Å; V480-V570 HydrophobicContact CG2-CG1 3.74Å; V525-V570 HydrophobicContact CG1-CB 4.14Å; V525-V570 HydrophobicContact CG1-CG2 3.63Å; L526-V570 PolarHBondContact O-N 3.26Å; L527-V570 CarbonylContact C-O 3.53Å; L527-V570 VanDerWaalsContact CA-O 3.29Å; L527-V570 WeakPolarHBondContact CA-O 3.04Å; L527-V570 HydrophobicContact CD1-CB 4.19Å; L527-V570 HydrophobicContact CD1-CG1 4.04Å; L527-V570 WeakPolarHBondContact CD1-O 3.19Å; L528-V570 PolarHBondContact N-O 3.27Å
571	A	90.7	Very high	75.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	144.5	175.8	0	0	0	0	0	110	V466 L467 L468 L528 I531 F587	V466-A571 PolarHBondContact O-N 3.23Å; L467-A571 HydrophobicContact CD1-CB 3.99Å; L468-A571 PolarHBondContact N-O 2.93Å; L528-A571 HydrophobicContact CB-CB 4.42Å; L528-A571 WeakPolarHBondContact O-CA 3.41Å; I531-A571 HydrophobicContact CB-CB 4.38Å; I531-A571 HydrophobicContact CD1-CB 3.94Å; I531-A571 HydrophobicContact CG2-CB 4.16Å; A571-F587 HydrophobicContact CB-CE1 3.69Å; A571-F587 HydrophobicContact CB-CE2 4.37Å; A571-F587 HydrophobicContact CB-CZ 3.49Å; A571-F587 VanDerWaalsContact CB-CZ 3.49Å
572	T	91.2	Very high	77.1	Confident	9 Å²	9	51.7 Å²	51.7	6%	0.055	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132.3	172.5	68.7	0	0	0	0	110	L468 K476 L527 L528 T529 A530 I531	L468-T572 HydrophobicContact CB-CG2 4.29Å; L468-T572 HydrophobicContact CD1-CG2 4.44Å; L468-T572 CarbonylContact O-C 3.56Å; L468-T572 WeakPolarHBondContact O-CA 3.43Å; K476-T572 HydrophobicContact CB-CG2 3.88Å; K476-T572 HydrophobicContact CD-CG2 4.3Å; L527-T572 HydrophobicContact CD1-CG2 3.85Å; L528-T572 PolarHBondContact O-N 2.94Å; T529-T572 WeakPolarHBondContact CA-OG1 3.48Å; A530-T572 WeakPolarHBondContact CA-O 3.43Å; A530-T572 PolarHBondContact N-O 2.96Å; A530-T572 VanDerWaalsContact N-O 3.16Å; A530-T572 PolarHBondContact N-OG1 3.32Å; I531-T572 PolarHBondContact N-O 3.49Å
573	T	88.5	Confident	78.5	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	157.5	171.7	-172	0	0	0	0	111.3	L467 L468 Q469 G470 R575	L467-T573 HydrophobicContact CD1-CG2 3.92Å; L467-T573 HydrophobicContact CD2-CG2 4.41Å; L467-T573 HydrophobicContact CG-CG2 4.23Å; L468-T573 PolarHBondContact O-N 3.18Å; Q469-T573 HydrophobicContact CB-CG2 4.24Å; Q469-T573 HydrophobicContact CG-CG2 3.75Å; G470-T573 PolarHBondContact N-O 3.47Å; T573-R575 PolarHBondContact OG1-O 2.92Å
574	S	83.5	Confident	79.9	Confident	39 Å²	39	42.3 Å²	42.3	27%	0.273	23%	0.23	S	C	.	.	S	Bend	trans	-81	-48.2	174.4	58.7	0	0	0	0	111.6	G470 D532	G470-S574 CarbonylContact C-O 3.59Å; G470-S574 VanDerWaalsContact O-CA 3.3Å; G470-S574 WeakPolarHBondContact O-CA 3.37Å; G470-S574 VanDerWaalsContact O-O 3.08Å; D532-S574 PolarHBondContact OD2-OG 3.34Å
575	R	79	Confident	81	Confident	143 Å²	143	43.5 Å²	43.5	54%	0.54	24%	0.235	S	C	.	.			trans	-131.3	144.7	174.4	-57.9	177	171.5	-172.8	-5	109.8	T573 Q577 D578	T573-R575 PolarHBondContact OG1-O 2.92Å; R575-Q577 VanDerWaalsContact C-N 3.32Å; R575-D578 HydrophobicContact CB-CB 4.42Å; R575-D578 WeakPolarHBondContact CB-OD2 3.3Å; R575-D578 WeakPolarHBondContact CD-OD2 3.43Å
576	A	73.6	Confident	82	Confident	28 Å²	28	41.5 Å²	41.5	23%	0.231	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-67.8	-34.5	176.1	0	0	0	0	0	112.5	D578 L579	A576-D578 PolarHBondContact O-N 3.39Å; A576-L579 WeakPolarHBondContact O-CB 3.37Å; A576-L579 PolarHBondContact O-N 3.09Å
577	Q	73.6	Confident	82.8	Confident	163 Å²	163	39.9 Å²	39.9	76%	0.762	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-66.5	-21.5	-176.8	-59.8	174.6	5.8	0	0	113.4	R575 L579	R575-Q577 VanDerWaalsContact C-N 3.32Å; Q577-L579 VanDerWaalsContact C-N 3.26Å; Q577-L579 PolarHBondContact O-N 3.03Å
578	D	74.1	Confident	83	Confident	49 Å²	49	42.4 Å²	42.4	26%	0.262	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-81.1	-7.1	-177.4	-83.4	-45.4	0	0	0	113.4	D532 R536 R575 A576	D532-D578 HydrophobicContact CB-CB 4.3Å; R536-D578 IonicContact CZ-OD1 3.35Å; R536-D578 IonicContact NH1-OD1 3.98Å; R536-D578 VanDerWaalsContact NH2-CG 3.27Å; R536-D578 PolarHBondContact NH2-O 3.04Å; R536-D578 IonicContact NH2-OD1 3.67Å; R536-D578 PolarHBondContact NH2-OD1 3.48Å; R575-D578 HydrophobicContact CB-CB 4.42Å; R575-D578 WeakPolarHBondContact CB-OD2 3.3Å; R575-D578 WeakPolarHBondContact CD-OD2 3.43Å; A576-D578 PolarHBondContact O-N 3.39Å
579	L	81.1	Confident	83	Confident	12 Å²	12	46 Å²	46	6%	0.063	25%	0.245	C	C	.	.	S	Bend	trans	-94.4	136.9	-176.2	-169	70.5	0	0	0	111.2	L467 I531 A576 Q577 T581 V583 H584	L467-L579 HydrophobicContact CD2-CD2 3.97Å; I531-L579 HydrophobicContact CG1-CD1 4.17Å; I531-L579 HydrophobicContact CG2-CD1 3.8Å; A576-L579 WeakPolarHBondContact O-CB 3.37Å; A576-L579 PolarHBondContact O-N 3.09Å; Q577-L579 VanDerWaalsContact C-N 3.26Å; Q577-L579 PolarHBondContact O-N 3.03Å; L579-T581 PolarHBondContact O-N 3.33Å; L579-V583 HydrophobicContact CD1-CB 4.18Å; L579-V583 HydrophobicContact CD1-CG1 3.85Å; L579-V583 HydrophobicContact CD2-CB 4.37Å; L579-V583 HydrophobicContact CD2-CG1 4.11Å; L579-V583 HydrophobicContact CG-CB 4.11Å; L579-V583 HydrophobicContact CG-CG1 4.13Å; L579-H584 HydrophobicContact CD2-CB 4.01Å
580	P	82.2	Confident	82.9	Confident	8 Å²	8	50.1 Å²	50.1	5%	0.052	26%	0.264	C	S	.	.			trans	-58.2	139.4	172.9	-24.3	34.1	0	0	0	111.6	V548 D582 V583 H584	V548-P580 HydrophobicContact CG1-CB 4.31Å; V548-P580 HydrophobicContact CG2-CB 4.27Å; V548-P580 HydrophobicContact CG2-CG 4.02Å; P580-D582 PolarHBondContact O-N 3.49Å; P580-D582 VanDerWaalsContact O-N 3.16Å; P580-V583 HydrophobicContact CB-CG2 4.25Å; P580-V583 HydrophobicContact CG-CG2 4.49Å; P580-V583 PolarHBondContact O-N 3.06Å; P580-H584 PolarHBondContact O-N 3.32Å
581	T	80.9	Confident	82.8	Confident	106 Å²	106	51 Å²	51	65%	0.65	27%	0.269	S	S	*	.	H	α-helix	trans	-57.1	-35.9	-175.8	52.6	0	0	0	0	112.6	L579 V583 H584 T585	L579-T581 PolarHBondContact O-N 3.33Å; T581-V583 VanDerWaalsContact C-N 3.29Å; T581-V583 PolarHBondContact O-N 3.2Å; T581-H584 PolarHBondContact O-N 3.3Å; T581-T585 WeakPolarHBondContact O-CG2 3.4Å; T581-T585 PolarHBondContact O-N 3.27Å; T581-T585 VanDerWaalsContact O-N 3.1Å; T581-T585 PolarHBondContact O-OG1 3.25Å
582	D	80.6	Confident	82.5	Confident	82 Å²	82	58 Å²	58	44%	0.439	30%	0.301	S	S	.	.	H	α-helix	trans	-65	-33.5	179.6	-74	-11.5	0	0	0	112.8	V548 R552 P580 T585	V548-D582 HydrophobicContact CG1-CB 3.84Å; R552-D582 PolarHBondContact NH1-O 2.87Å; P580-D582 PolarHBondContact O-N 3.49Å; P580-D582 VanDerWaalsContact O-N 3.16Å; D582-T585 PolarHBondContact O-OG1 3.21Å
583	V	82.5	Confident	82.2	Confident	4 Å²	4	58.4 Å²	58.4	2%	0.024	30%	0.304	C	S	.	.	H	α-helix	trans	-80.1	-40	177.5	-179.2	0	0	0	0	110	I531 V548 L551 L555 L579 P580 T581 T585 A586 F587	I531-V583 HydrophobicContact CD1-CG1 3.95Å; V548-V583 HydrophobicContact CG1-CG2 3.81Å; L551-V583 HydrophobicContact CD2-CB 4.11Å; L551-V583 HydrophobicContact CD2-CG1 3.44Å; L551-V583 VanDerWaalsContact CD2-CG1 3.44Å; L551-V583 HydrophobicContact CD2-CG2 3.58Å; L555-V583 HydrophobicContact CD1-CG1 4.49Å; L579-V583 HydrophobicContact CD1-CB 4.18Å; L579-V583 HydrophobicContact CD1-CG1 3.85Å; L579-V583 HydrophobicContact CD2-CB 4.37Å; L579-V583 HydrophobicContact CD2-CG1 4.11Å; L579-V583 HydrophobicContact CG-CB 4.11Å; L579-V583 HydrophobicContact CG-CG1 4.13Å; P580-V583 HydrophobicContact CB-CG2 4.25Å; P580-V583 HydrophobicContact CG-CG2 4.49Å; P580-V583 PolarHBondContact O-N 3.06Å; T581-V583 VanDerWaalsContact C-N 3.29Å; T581-V583 PolarHBondContact O-N 3.2Å; V583-T585 VanDerWaalsContact C-N 3.31Å; V583-T585 PolarHBondContact O-N 3.43Å; V583-A586 WeakPolarHBondContact O-CB 3.48Å; V583-A586 PolarHBondContact O-N 3.48Å; V583-F587 HydrophobicContact CG1-CD2 4.38Å; V583-F587 HydrophobicContact CG1-CE2 3.7Å; V583-F587 WeakPolarHBondContact O-CD2 3.44Å
584	H	83.8	Confident	81.6	Confident	56 Å²	56	61.5 Å²	61.5	26%	0.259	32%	0.324	S	S	.	.	H	α-helix	trans	-55.8	-44.8	176.6	-168.5	-73.9	0	0	0	112	L579 P580 T581 A586 F587 E590	L579-H584 HydrophobicContact CD2-CB 4.01Å; P580-H584 PolarHBondContact O-N 3.32Å; T581-H584 PolarHBondContact O-N 3.3Å; H584-A586 PolarHBondContact O-N 3.18Å; H584-A586 VanDerWaalsContact O-N 3.16Å; H584-F587 PolarHBondContact O-N 2.97Å; H584-F587 VanDerWaalsContact O-N 3.14Å; H584-E590 IonicContact CE1-OE1 3.98Å; H584-E590 PolarHBondContact CE1-OE1 3.25Å; H584-E590 IonicContact CE1-OE2 2.76Å; H584-E590 IonicContact ND1-OE1 2.78Å; H584-E590 IonicContact NE2-OE1 3.97Å; H584-E590 PolarHBondContact NE2-OE1 3.43Å; H584-E590 IonicContact NE2-OE2 3.64Å
585	T	83.3	Confident	81.4	Confident	95 Å²	95	64.8 Å²	64.8	58%	0.583	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-16.6	177.7	58.3	0	0	0	0	114.6	R552 T581 D582 V583 F587	R552-T585 PolarHBondContact NH1-OG1 3.24Å; T581-T585 WeakPolarHBondContact O-CG2 3.4Å; T581-T585 PolarHBondContact O-N 3.27Å; T581-T585 VanDerWaalsContact O-N 3.1Å; T581-T585 PolarHBondContact O-OG1 3.25Å; D582-T585 PolarHBondContact O-OG1 3.21Å; V583-T585 VanDerWaalsContact C-N 3.31Å; V583-T585 PolarHBondContact O-N 3.43Å; T585-F587 VanDerWaalsContact C-N 3.31Å
586	A	82.3	Confident	81.6	Confident	3 Å²	3	58.8 Å²	58.8	3%	0.025	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-10	177.4	0	0	0	0	0	113.1	L555 V583 H584 P588	L555-A586 HydrophobicContact CB-CB 4.25Å; L555-A586 HydrophobicContact CD1-CB 3.86Å; V583-A586 WeakPolarHBondContact O-CB 3.48Å; V583-A586 PolarHBondContact O-N 3.48Å; H584-A586 PolarHBondContact O-N 3.18Å; H584-A586 VanDerWaalsContact O-N 3.16Å; A586-P588 WeakPolarHBondContact O-CD 3.14Å
587	F	85.2	Confident	82	Confident	7 Å²	7	59.8 Å²	59.8	3%	0.031	33%	0.326	C	S	.	.			trans	-104.4	104	177.9	-68.2	-80.3	0	0	0	110.9	C465 L467 I531 L555 A571 V583 H584 T585 H589	C465-F587 HydrophobicContact CB-CD1 3.61Å; C465-F587 HydrophobicContact CB-CE1 3.91Å; C465-F587 HydrophobicContact CB-CG 4.45Å; L467-F587 HydrophobicContact CB-CB 3.87Å; L467-F587 HydrophobicContact CB-CD1 3.96Å; L467-F587 HydrophobicContact CB-CD2 4.38Å; L467-F587 HydrophobicContact CB-CG 3.81Å; I531-F587 HydrophobicContact CD1-CE2 4.17Å; I531-F587 HydrophobicContact CD1-CZ 4.09Å; L555-F587 HydrophobicContact CD1-CE2 3.97Å; L555-F587 HydrophobicContact CD1-CZ 3.9Å; L555-F587 HydrophobicContact CD2-CZ 4.42Å; A571-F587 HydrophobicContact CB-CE1 3.69Å; A571-F587 HydrophobicContact CB-CE2 4.37Å; A571-F587 HydrophobicContact CB-CZ 3.49Å; A571-F587 VanDerWaalsContact CB-CZ 3.49Å; V583-F587 HydrophobicContact CG1-CD2 4.38Å; V583-F587 HydrophobicContact CG1-CE2 3.7Å; V583-F587 WeakPolarHBondContact O-CD2 3.44Å; H584-F587 PolarHBondContact O-N 2.97Å; H584-F587 VanDerWaalsContact O-N 3.14Å; T585-F587 VanDerWaalsContact C-N 3.31Å; F587-H589 VanDerWaalsContact C-N 3.34Å
588	P	82.6	Confident	82.4	Confident	74 Å²	74	55.4 Å²	55.4	48%	0.481	31%	0.306	S	S	.	.	S	Bend	trans	-74	-22.3	178.2	27.9	-35.3	0	0	0	114	T463 C465 A586	T463-P588 WeakPolarHBondContact O-CG 3.5Å; C465-P588 WeakPolarHBondContact O-CD 3.23Å; A586-P588 WeakPolarHBondContact O-CD 3.14Å
589	H	84.9	Confident	82.9	Confident	79 Å²	79	60.8 Å²	60.8	37%	0.366	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.4	-178.1	-63.9	-46.7	0	0	0	110.8	V466 L467 F587	V466-H589 WeakPolarHBondContact CA-O 3.39Å; V466-H589 HydrophobicContact CG1-CB 4.44Å; V466-H589 HydrophobicContact CG2-CB 4.27Å; L467-H589 PolarHBondContact N-O 2.77Å; F587-H589 VanDerWaalsContact C-N 3.34Å
590	E	87.1	Confident	83.1	Confident	93 Å²	93	63.1 Å²	63.1	44%	0.435	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130	174.7	-69.8	175.6	-139.4	0	0	109.7	L467 Q469 H584	L467-E590 HydrophobicContact CB-CG 4.37Å; L467-E590 HydrophobicContact CD2-CG 4.4Å; Q469-E590 PolarHBondContact NE2-OE2 3.13Å; H584-E590 IonicContact CE1-OE1 3.98Å; H584-E590 PolarHBondContact CE1-OE1 3.25Å; H584-E590 IonicContact CE1-OE2 2.76Å; H584-E590 IonicContact ND1-OE1 2.78Å; H584-E590 IonicContact NE2-OE1 3.97Å; H584-E590 PolarHBondContact NE2-OE1 3.43Å; H584-E590 IonicContact NE2-OE2 3.64Å
591	L	88.1	Confident	83.3	Confident	20 Å²	20	64 Å²	64	11%	0.105	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	119.9	178.3	-67.7	178.1	0	0	0	109.3	L445 I448 V466 L467 L468 Q469	L445-L591 HydrophobicContact CD2-CD1 3.48Å; L445-L591 VanDerWaalsContact CD2-CD1 3.48Å; L445-L591 HydrophobicContact CG-CD1 3.91Å; I448-L591 HydrophobicContact CD1-CD1 3.83Å; I448-L591 HydrophobicContact CD1-CD2 4.1Å; I448-L591 HydrophobicContact CD1-CG 4.22Å; V466-L591 HydrophobicContact CG1-CD1 3.86Å; V466-L591 HydrophobicContact CG1-CG 4.23Å; L467-L591 PolarHBondContact O-N 2.95Å; L468-L591 CarbonylContact C-O 3.58Å; L468-L591 WeakPolarHBondContact CA-O 3.31Å; L468-L591 HydrophobicContact CD2-CB 3.72Å; L468-L591 HydrophobicContact CD2-CD1 4.13Å; Q469-L591 PolarHBondContact N-O 3.44Å
592	E	84.8	Confident	83.7	Confident	146 Å²	146	60.7 Å²	60.7	68%	0.682	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	134.9	172.7	-66.2	-172.2	162.9	0	0	110.2	Q469 P594	Q469-E592 HydrophobicContact CB-CG 4.24Å; E592-P594 VanDerWaalsContact O-CD 3.29Å; E592-P594 WeakPolarHBondContact O-CD 3.3Å
593	V	84.3	Confident	84	Confident	17 Å²	17	57.8 Å²	57.8	10%	0.103	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-73.2	116.8	171.2	-176.4	0	0	0	0	108.5	L438 L441 Q469 K476	L438-V593 HydrophobicContact CD2-CG1 4.17Å; L441-V593 HydrophobicContact CD1-CB 4.12Å; L441-V593 HydrophobicContact CD1-CG1 4.33Å; L441-V593 HydrophobicContact CD1-CG2 3.71Å; Q469-V593 WeakPolarHBondContact O-CG2 3.36Å; Q469-V593 PolarHBondContact O-N 3.24Å; K476-V593 HydrophobicContact CD-CG2 4.16Å; K476-V593 HydrophobicContact CG-CG2 3.53Å
594	P	76.9	Confident	84.3	Confident	67 Å²	67	57.6 Å²	57.6	44%	0.435	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-66.5	151.8	-179.5	28	-34.8	0	0	0	111.3	E592	E592-P594 VanDerWaalsContact O-CD 3.29Å; E592-P594 WeakPolarHBondContact O-CD 3.3Å
595	V	79	Confident	84.5	Confident	109 Å²	109	55 Å²	55	66%	0.661	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-66.7	137.3	169.8	-177.9	0	0	0	0	108.9	S597	V595-S597 PolarHBondContact O-N 3.25Å
596	L	82.4	Confident	84.6	Confident	16 Å²	16	55 Å²	55	8%	0.084	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-70.3	127	-175.8	-60.5	170.1	0	0	0	111.7	Q600 R601 V632 L635	L596-Q600 HydrophobicContact CB-CB 4.44Å; L596-Q600 HydrophobicContact CD2-CB 4.33Å; L596-R601 HydrophobicContact CB-CG 3.53Å; L596-R601 HydrophobicContact CD1-CG 3.99Å; L596-R601 HydrophobicContact CG-CG 4.44Å; L596-R601 PolarHBondContact O-NE 3.23Å; L596-V632 HydrophobicContact CD1-CG2 3.73Å; L596-V632 HydrophobicContact CD2-CG2 4.23Å; L596-V632 HydrophobicContact CG-CG2 4.43Å; L596-L635 HydrophobicContact CD1-CD1 4.27Å
597	S	82.3	Confident	84.7	Confident	50 Å²	50	55.7 Å²	55.7	35%	0.35	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-66.3	165.9	171.3	76.3	0	0	0	0	112.2	V595 E599 Q600 R601	V595-S597 PolarHBondContact O-N 3.25Å; S597-E599 VanDerWaalsContact C-N 3.28Å; S597-E599 PolarHBondContact O-N 3.46Å; S597-Q600 PolarHBondContact O-N 2.91Å; S597-Q600 VanDerWaalsContact OG-CG 3.28Å; S597-Q600 WeakPolarHBondContact OG-CG 3.36Å; S597-Q600 PolarHBondContact OG-N 3.08Å; S597-R601 WeakPolarHBondContact O-CB 3.3Å; S597-R601 WeakPolarHBondContact O-CG 3.37Å; S597-R601 PolarHBondContact O-N 3.41Å; S597-R601 PolarHBondContact O-NE 2.91Å
598	E	82.2	Confident	84.6	Confident	71 Å²	71	56.2 Å²	56.2	33%	0.332	30%	0.295	S	S	.	.	H	α-helix	trans	-56.6	-43.1	174.7	-175.4	179.2	161.2	0	0	111.7	R601 L602 A624 R625	E598-R601 PolarHBondContact O-N 2.67Å; E598-L602 WeakPolarHBondContact O-CB 3.5Å; E598-L602 PolarHBondContact O-N 2.87Å; E598-A624 HydrophobicContact CG-CB 4.47Å; E598-R625 HydrophobicContact CG-CG 4.32Å; E598-R625 WeakPolarHBondContact OE1-CG 3.33Å; E598-R625 IonicContact OE1-CZ 3.62Å; E598-R625 IonicContact OE1-NE 3.97Å; E598-R625 PolarHBondContact OE1-NE 2.95Å; E598-R625 IonicContact OE1-NH2 2.99Å
599	E	83.8	Confident	84.6	Confident	161 Å²	161	53.1 Å²	53.1	75%	0.752	28%	0.275	S	S	*	.	H	α-helix	trans	-65.5	-42.3	178.9	-60.7	-177.4	172.1	0	0	112	S597 L602 S603	S597-E599 VanDerWaalsContact C-N 3.28Å; S597-E599 PolarHBondContact O-N 3.46Å; E599-L602 PolarHBondContact O-N 3.35Å; E599-S603 PolarHBondContact O-N 3.22Å
600	Q	85.9	Confident	84.3	Confident	61 Å²	61	52.6 Å²	52.6	29%	0.285	29%	0.285	S	S	.	.	H	α-helix	trans	-65.8	-41.3	177.1	-72.3	171.5	-12	0	0	111.6	L596 S597 L602 S603 V604	L596-Q600 HydrophobicContact CB-CB 4.44Å; L596-Q600 HydrophobicContact CD2-CB 4.33Å; S597-Q600 PolarHBondContact O-N 2.91Å; S597-Q600 VanDerWaalsContact OG-CG 3.28Å; S597-Q600 WeakPolarHBondContact OG-CG 3.36Å; S597-Q600 PolarHBondContact OG-N 3.08Å; Q600-L602 VanDerWaalsContact C-N 3.33Å; Q600-L602 PolarHBondContact O-N 2.95Å; Q600-S603 WeakPolarHBondContact O-CB 3.47Å; Q600-S603 PolarHBondContact O-N 2.82Å; Q600-V604 WeakPolarHBondContact O-CG2 3.25Å; Q600-V604 PolarHBondContact O-N 3.33Å
601	R	87.8	Confident	83.6	Confident	26 Å²	26	53.4 Å²	53.4	10%	0.098	29%	0.288	C	S	.	.	H	α-helix	trans	-63	-40.7	175.1	-72.6	-179.8	-77.2	148.5	2.4	111.7	L596 S597 E598 V604 L605 A624 C627 A628 L635	L596-R601 HydrophobicContact CB-CG 3.53Å; L596-R601 HydrophobicContact CD1-CG 3.99Å; L596-R601 HydrophobicContact CG-CG 4.44Å; L596-R601 PolarHBondContact O-NE 3.23Å; S597-R601 WeakPolarHBondContact O-CB 3.3Å; S597-R601 WeakPolarHBondContact O-CG 3.37Å; S597-R601 PolarHBondContact O-N 3.41Å; S597-R601 PolarHBondContact O-NE 2.91Å; E598-R601 PolarHBondContact O-N 2.67Å; R601-V604 PolarHBondContact O-N 3.13Å; R601-L605 WeakPolarHBondContact O-CB 3.36Å; R601-L605 WeakPolarHBondContact O-CG 3.46Å; R601-L605 PolarHBondContact O-N 2.68Å; R601-A624 HydrophobicContact CB-CB 4.39Å; R601-A624 PolarHBondContact NH1-O 3.35Å; R601-C627 PolarHBondContact NH1-O 3.26Å; R601-A628 VanDerWaalsContact NH1-N 3.11Å; R601-L635 HydrophobicContact CB-CD1 4.37Å; R601-L635 HydrophobicContact CG-CD1 4.24Å
602	L	88.8	Confident	83	Confident	37 Å²	37	55.8 Å²	55.8	19%	0.194	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-44.8	174.3	177.1	150.2	0	0	0	111.4	E598 E599 Q600 V604 L605 Q606 L621 A624	E598-L602 WeakPolarHBondContact O-CB 3.5Å; E598-L602 PolarHBondContact O-N 2.87Å; E599-L602 PolarHBondContact O-N 3.35Å; Q600-L602 VanDerWaalsContact C-N 3.33Å; Q600-L602 PolarHBondContact O-N 2.95Å; L602-V604 VanDerWaalsContact C-N 3.35Å; L602-V604 PolarHBondContact O-N 3.07Å; L602-L605 PolarHBondContact O-N 3.35Å; L602-Q606 VanDerWaalsContact CD2-CD 3.42Å; L602-Q606 HydrophobicContact CD2-CG 4.2Å; L602-Q606 VanDerWaalsContact CD2-NE2 3.3Å; L602-Q606 WeakPolarHBondContact O-CB 3.47Å; L602-Q606 VanDerWaalsContact O-CG 3.3Å; L602-Q606 WeakPolarHBondContact O-CG 3.31Å; L602-Q606 PolarHBondContact O-N 3.44Å; L602-L621 HydrophobicContact CD1-CB 3.88Å; L602-L621 HydrophobicContact CD1-CD1 3.94Å; L602-L621 HydrophobicContact CD1-CG 4.13Å; L602-A624 HydrophobicContact CB-CB 4.11Å
603	S	86.8	Confident	82.6	Confident	22 Å²	22	51.8 Å²	51.8	15%	0.154	29%	0.287	C	S	.	.	H	α-helix	trans	-59.6	-43.9	176	-176.7	0	0	0	0	112.1	P257 P436 E599 Q600 Q606 A607	P257-S603 WeakPolarHBondContact CG-OG 3.45Å; P436-S603 WeakPolarHBondContact CB-OG 3.44Å; E599-S603 PolarHBondContact O-N 3.22Å; Q600-S603 WeakPolarHBondContact O-CB 3.47Å; Q600-S603 PolarHBondContact O-N 2.82Å; S603-Q606 PolarHBondContact O-N 3.37Å; S603-A607 WeakPolarHBondContact O-CB 3.39Å; S603-A607 PolarHBondContact O-N 3.15Å
604	V	87.5	Confident	82.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.8	-47.8	174.9	172.4	0	0	0	0	111.1	W430 P436 Q600 R601 L602 Q606 A607 L608 L635	W430-V604 HydrophobicContact CH2-CG1 3.99Å; P436-V604 HydrophobicContact CB-CG2 4.38Å; P436-V604 HydrophobicContact CG-CG2 4.45Å; P436-V604 WeakPolarHBondContact O-CG2 3.06Å; Q600-V604 WeakPolarHBondContact O-CG2 3.25Å; Q600-V604 PolarHBondContact O-N 3.33Å; R601-V604 PolarHBondContact O-N 3.13Å; L602-V604 VanDerWaalsContact C-N 3.35Å; L602-V604 PolarHBondContact O-N 3.07Å; V604-Q606 VanDerWaalsContact C-N 3.35Å; V604-Q606 PolarHBondContact O-N 3.4Å; V604-A607 PolarHBondContact O-N 2.9Å; V604-L608 HydrophobicContact CG1-CD1 3.67Å; V604-L608 HydrophobicContact CG1-CG 4.27Å; V604-L608 WeakPolarHBondContact O-CB 3.44Å; V604-L608 VanDerWaalsContact O-CG 3.24Å; V604-L608 WeakPolarHBondContact O-CG 3.45Å; V604-L608 PolarHBondContact O-N 3.15Å; V604-L635 HydrophobicContact CB-CD1 4.08Å; V604-L635 HydrophobicContact CG1-CB 4.42Å; V604-L635 HydrophobicContact CG1-CD1 3.73Å
605	L	87.9	Confident	82.7	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-62.3	-40.7	178.4	-75.3	172.5	0	0	0	112.1	R601 L602 L608 T609 L623 A624 L635	R601-L605 WeakPolarHBondContact O-CB 3.36Å; R601-L605 WeakPolarHBondContact O-CG 3.46Å; R601-L605 PolarHBondContact O-N 2.68Å; L602-L605 PolarHBondContact O-N 3.35Å; L605-L608 PolarHBondContact O-N 3.43Å; L605-T609 WeakPolarHBondContact O-CB 3.4Å; L605-T609 VanDerWaalsContact O-CG2 3.29Å; L605-T609 WeakPolarHBondContact O-CG2 3.41Å; L605-T609 PolarHBondContact O-N 3.38Å; L605-T609 PolarHBondContact O-OG1 3.1Å; L605-L623 HydrophobicContact CD1-CB 4.34Å; L605-A624 HydrophobicContact CD1-CB 4.21Å; L605-L635 HydrophobicContact CD2-CB 4.43Å; L605-L635 HydrophobicContact CD2-CD2 4.18Å; L605-L635 HydrophobicContact CG-CD2 4.37Å
606	Q	87.3	Confident	82.6	Confident	95 Å²	95	55.9 Å²	55.9	44%	0.444	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-46.4	175.3	-76.3	177.2	-17.3	0	0	111.7	L602 S603 V604 L608 T609 A610 L620	L602-Q606 VanDerWaalsContact CD2-CD 3.42Å; L602-Q606 HydrophobicContact CD2-CG 4.2Å; L602-Q606 VanDerWaalsContact CD2-NE2 3.3Å; L602-Q606 WeakPolarHBondContact O-CB 3.47Å; L602-Q606 VanDerWaalsContact O-CG 3.3Å; L602-Q606 WeakPolarHBondContact O-CG 3.31Å; L602-Q606 PolarHBondContact O-N 3.44Å; S603-Q606 PolarHBondContact O-N 3.37Å; V604-Q606 VanDerWaalsContact C-N 3.35Å; V604-Q606 PolarHBondContact O-N 3.4Å; Q606-L608 PolarHBondContact O-N 3.24Å; Q606-T609 PolarHBondContact O-N 2.94Å; Q606-T609 PolarHBondContact O-OG1 3.47Å; Q606-A610 PolarHBondContact O-N 3.27Å; Q606-L620 HydrophobicContact CG-CD1 3.8Å
607	A	82.6	Confident	82.5	Confident	18 Å²	18	62 Å²	62	15%	0.149	33%	0.326	C	S	.	.	H	α-helix	trans	-64.9	-39.5	178.7	0	0	0	0	0	112.4	P429 P436 S603 V604	P429-A607 HydrophobicContact CB-CB 4.18Å; P436-A607 HydrophobicContact CB-CB 4.42Å; P436-A607 HydrophobicContact CG-CB 3.58Å; S603-A607 WeakPolarHBondContact O-CB 3.39Å; S603-A607 PolarHBondContact O-N 3.15Å; V604-A607 PolarHBondContact O-N 2.9Å
608	L	83.6	Confident	82.6	Confident	17 Å²	17	60.6 Å²	60.6	9%	0.089	32%	0.315	C	S	.	.	H	α-helix	trans	-73.5	-29.8	179.1	-64.9	170.9	0	0	0	113.2	P429 W430 V604 L605 Q606 L635 Y636 L639	P429-L608 HydrophobicContact CG-CD2 3.75Å; W430-L608 HydrophobicContact CH2-CD1 4.35Å; W430-L608 HydrophobicContact CH2-CD2 4.13Å; W430-L608 HydrophobicContact CH2-CG 4.49Å; W430-L608 HydrophobicContact CZ2-CD1 3.96Å; W430-L608 HydrophobicContact CZ2-CD2 3.3Å; W430-L608 HydrophobicContact CZ2-CG 4.03Å; V604-L608 HydrophobicContact CG1-CD1 3.67Å; V604-L608 HydrophobicContact CG1-CG 4.27Å; V604-L608 WeakPolarHBondContact O-CB 3.44Å; V604-L608 VanDerWaalsContact O-CG 3.24Å; V604-L608 WeakPolarHBondContact O-CG 3.45Å; V604-L608 PolarHBondContact O-N 3.15Å; L605-L608 PolarHBondContact O-N 3.43Å; Q606-L608 PolarHBondContact O-N 3.24Å; L608-L635 HydrophobicContact CD1-CB 4.5Å; L608-Y636 HydrophobicContact CD2-CD2 4.2Å; L608-L639 HydrophobicContact CB-CD1 3.28Å; L608-L639 HydrophobicContact CD1-CD1 3.9Å; L608-L639 HydrophobicContact CG-CD1 4.15Å
609	T	82.8	Confident	82.9	Confident	9 Å²	9	60.8 Å²	60.8	6%	0.055	32%	0.318	C	S	.	.	H	α-helix	trans	-89.7	-7.4	179.9	56.3	0	0	0	0	114	L605 Q606 H611 L612 L614 L620 L639	L605-T609 WeakPolarHBondContact O-CB 3.4Å; L605-T609 VanDerWaalsContact O-CG2 3.29Å; L605-T609 WeakPolarHBondContact O-CG2 3.41Å; L605-T609 PolarHBondContact O-N 3.38Å; L605-T609 PolarHBondContact O-OG1 3.1Å; Q606-T609 PolarHBondContact O-N 2.94Å; Q606-T609 PolarHBondContact O-OG1 3.47Å; T609-H611 PolarHBondContact O-N 2.97Å; T609-H611 VanDerWaalsContact O-N 3.12Å; T609-L612 PolarHBondContact O-N 3.38Å; T609-L614 HydrophobicContact CG2-CD1 4.25Å; T609-L614 HydrophobicContact CG2-CD2 4.11Å; T609-L620 HydrophobicContact CG2-CD2 4.29Å; T609-L639 HydrophobicContact CG2-CD1 4.45Å; T609-L639 HydrophobicContact CG2-CD2 3.75Å
610	A	79.3	Confident	83.1	Confident	69 Å²	69	54.5 Å²	54.5	57%	0.57	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-36	-179.6	0	0	0	0	0	113.7	Q606	Q606-A610 PolarHBondContact O-N 3.27Å
611	H	71.5	Confident	83.1	Confident	109 Å²	109	54.9 Å²	54.9	51%	0.505	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	0.1	-179.6	-54.1	-55.1	0	0	0	114	E253 T609	E253-H611 IonicContact OE1-CE1 3.96Å; E253-H611 IonicContact OE1-ND1 3.31Å; T609-H611 PolarHBondContact O-N 2.97Å; T609-H611 VanDerWaalsContact O-N 3.12Å
612	L	76.1	Confident	82.9	Confident	70 Å²	70	59.2 Å²	59.2	37%	0.366	32%	0.315	S	S	.	.	S	Bend	trans	-105.8	136.2	-175.5	-67	172.6	0	0	0	111.3	T609 L614 L639 L674	T609-L612 PolarHBondContact O-N 3.38Å; L612-L614 PolarHBondContact O-N 2.85Å; L612-L614 VanDerWaalsContact O-N 3.14Å; L612-L639 HydrophobicContact CD1-CD1 4.41Å; L612-L639 HydrophobicContact CD1-CD2 4.1Å; L612-L674 HydrophobicContact CD1-CD1 4.26Å
613	P	77.1	Confident	82.8	Confident	62 Å²	62	58.3 Å²	58.3	40%	0.403	31%	0.31	S	S	.	.			trans	-71.4	108.5	172.9	28.8	-33	0	0	0	110.4	F672 P673 L674	P613-F672 WeakPolarHBondContact CG-O 3.48Å; P613-P673 VanDerWaalsContact O-CA 3.31Å; P613-P673 WeakPolarHBondContact O-CA 3.39Å; P613-L674 PolarHBondContact O-N 3.29Å
614	L	83.1	Confident	82.8	Confident	59 Å²	59	57.2 Å²	57.2	31%	0.309	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-92.6	143.7	175	-63.3	176.9	0	0	0	111.8	T609 L612 L620 L674 F679	T609-L614 HydrophobicContact CG2-CD1 4.25Å; T609-L614 HydrophobicContact CG2-CD2 4.11Å; L612-L614 PolarHBondContact O-N 2.85Å; L612-L614 VanDerWaalsContact O-N 3.14Å; L614-L620 HydrophobicContact CD1-CD2 4.19Å; L614-L674 HydrophobicContact CD2-CB 4.38Å; L614-L674 HydrophobicContact CD2-CD1 4.44Å; L614-F679 HydrophobicContact CD2-CE2 4.08Å; L614-F679 HydrophobicContact CD2-CZ 4.05Å
615	G	78.6	Confident	82.5	Confident	14 Å²	14	64.2 Å²	64.2	14%	0.144	33%	0.329	C	S	.	.			trans	-69.5	151.4	166.9	0	0	0	0	0	112	E617 V618 L674	G615-E617 PolarHBondContact O-N 3.3Å; G615-E617 VanDerWaalsContact O-N 3.13Å; G615-V618 PolarHBondContact O-N 3.47Å; G615-V618 VanDerWaalsContact O-N 3.15Å; G615-L674 PolarHBondContact N-O 2.96Å
616	Q	77.3	Confident	82	Confident	207 Å²	207	69.8 Å²	69.8	97%	0.967	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.2	-179.4	-67.3	-179.8	-1.3	0	0	113.6	V618	Q616-V618 VanDerWaalsContact C-N 3.31Å
617	E	81.4	Confident	81.6	Confident	143 Å²	143	65.2 Å²	65.2	67%	0.668	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-12.7	-179.2	-60.8	175.2	178.8	0	0	113.1	G615 N619 A676	G615-E617 PolarHBondContact O-N 3.3Å; G615-E617 VanDerWaalsContact O-N 3.13Å; E617-N619 PolarHBondContact O-N 2.99Å; E617-A676 HydrophobicContact CB-CB 4.28Å
618	V	84	Confident	81.2	Confident	21 Å²	21	66.3 Å²	66.3	13%	0.127	34%	0.337	C	S	.	.			trans	-81.4	111.8	-174	-177.6	0	0	0	0	110.2	G615 Q616 L620 L623 L674 A676 F679	G615-V618 PolarHBondContact O-N 3.47Å; G615-V618 VanDerWaalsContact O-N 3.15Å; Q616-V618 VanDerWaalsContact C-N 3.31Å; V618-L620 HydrophobicContact CG1-CD2 4.33Å; V618-L623 HydrophobicContact CG1-CD1 3.78Å; V618-L674 WeakPolarHBondContact CG2-O 3.39Å; V618-A676 HydrophobicContact CG2-CB 4.46Å; V618-F679 HydrophobicContact CG1-CD2 4Å; V618-F679 HydrophobicContact CG1-CE2 3.78Å; V618-F679 HydrophobicContact CG1-CZ 4.44Å; V618-F679 HydrophobicContact CG2-CD2 4.09Å; V618-F679 HydrophobicContact CG2-CE2 4.04Å
619	N	87.4	Confident	80.6	Confident	75 Å²	75	67 Å²	67	40%	0.401	35%	0.349	S	S	.	.			trans	-99.1	106.5	173.1	-171.7	-21.5	0	0	0	111.1	E617 L621 Q622 L623	E617-N619 PolarHBondContact O-N 2.99Å; N619-L621 VanDerWaalsContact C-N 3.26Å; N619-L621 PolarHBondContact O-N 3.4Å; N619-L621 WeakPolarHBondContact OD1-CB 3.37Å; N619-L621 PolarHBondContact OD1-N 3.29Å; N619-Q622 HydrophobicContact CB-CB 4.21Å; N619-Q622 HydrophobicContact CB-CG 4.2Å; N619-Q622 PolarHBondContact O-N 3.42Å; N619-Q622 PolarHBondContact OD1-N 3.38Å; N619-L623 PolarHBondContact O-N 2.94Å; N619-L623 VanDerWaalsContact O-N 3.14Å
620	L	88.1	Confident	80.6	Confident	30 Å²	30	67.1 Å²	67.1	16%	0.157	35%	0.349	C	S	.	.	H	α-helix	trans	-62.4	-30.1	-179.1	-62.4	179.3	0	0	0	113.4	Q606 T609 L614 V618 L623 A624	Q606-L620 HydrophobicContact CG-CD1 3.8Å; T609-L620 HydrophobicContact CG2-CD2 4.29Å; L614-L620 HydrophobicContact CD1-CD2 4.19Å; V618-L620 HydrophobicContact CG1-CD2 4.33Å; L620-L623 HydrophobicContact CD2-CD1 4.39Å; L620-L623 PolarHBondContact O-N 3.48Å; L620-A624 WeakPolarHBondContact O-CB 3.22Å; L620-A624 PolarHBondContact O-N 3.39Å
621	L	86.4	Confident	80.8	Confident	68 Å²	68	64.9 Å²	64.9	36%	0.356	33%	0.328	S	S	.	.	H	α-helix	trans	-71.1	-40.5	179.2	-175.8	140.8	0	0	0	111.5	L602 N619 L623 A624 R625	L602-L621 HydrophobicContact CD1-CB 3.88Å; L602-L621 HydrophobicContact CD1-CD1 3.94Å; L602-L621 HydrophobicContact CD1-CG 4.13Å; N619-L621 VanDerWaalsContact C-N 3.26Å; N619-L621 PolarHBondContact O-N 3.4Å; N619-L621 WeakPolarHBondContact OD1-CB 3.37Å; N619-L621 PolarHBondContact OD1-N 3.29Å; L621-L623 VanDerWaalsContact C-N 3.32Å; L621-L623 PolarHBondContact O-N 2.67Å; L621-A624 PolarHBondContact O-N 3.44Å; L621-R625 WeakPolarHBondContact O-CG 3.42Å; L621-R625 PolarHBondContact O-N 2.93Å; L621-R625 VanDerWaalsContact O-N 3.1Å
622	Q	84.3	Confident	81.6	Confident	118 Å²	118	60 Å²	60	55%	0.551	31%	0.305	S	S	*	.	H	α-helix	trans	-65.5	-37.8	173.1	-71.7	-179.1	-20.4	0	0	111.8	N619 R625 R626	N619-Q622 HydrophobicContact CB-CB 4.21Å; N619-Q622 HydrophobicContact CB-CG 4.2Å; N619-Q622 PolarHBondContact O-N 3.42Å; N619-Q622 PolarHBondContact OD1-N 3.38Å; Q622-R625 PolarHBondContact O-N 3.46Å; Q622-R626 WeakPolarHBondContact O-CG 3.48Å; Q622-R626 PolarHBondContact O-N 3.05Å; Q622-R626 VanDerWaalsContact O-N 3.13Å
623	L	86.3	Confident	82	Confident	17 Å²	17	58 Å²	58	9%	0.089	30%	0.302	C	S	.	.	H	α-helix	trans	-64.3	-43.6	174.4	-68.5	176.8	0	0	0	111.7	L605 V618 N619 L620 L621 R625 R626 C627 F679	L605-L623 HydrophobicContact CD1-CB 4.34Å; V618-L623 HydrophobicContact CG1-CD1 3.78Å; N619-L623 PolarHBondContact O-N 2.94Å; N619-L623 VanDerWaalsContact O-N 3.14Å; L620-L623 HydrophobicContact CD2-CD1 4.39Å; L620-L623 PolarHBondContact O-N 3.48Å; L621-L623 VanDerWaalsContact C-N 3.32Å; L621-L623 PolarHBondContact O-N 2.67Å; L623-R625 VanDerWaalsContact C-N 3.32Å; L623-R625 PolarHBondContact O-N 3.48Å; L623-R626 PolarHBondContact O-N 3.46Å; L623-C627 WeakPolarHBondContact O-CB 3.36Å; L623-C627 PolarHBondContact O-N 3.19Å; L623-C627 PolarHBondContact O-SG 2.91Å; L623-F679 HydrophobicContact CD1-CB 4.36Å; L623-F679 HydrophobicContact CD1-CD1 3.77Å; L623-F679 HydrophobicContact CD1-CD2 4.29Å; L623-F679 HydrophobicContact CD1-CE1 4.05Å; L623-F679 HydrophobicContact CD1-CG 3.9Å; L623-F679 HydrophobicContact CD1-CZ 4.45Å; L623-F679 HydrophobicContact CD2-CB 3.96Å; L623-F679 HydrophobicContact CD2-CD1 4.47Å; L623-F679 HydrophobicContact CD2-CG 4.37Å
624	A	85.7	Confident	82.5	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-57.5	-44.2	176.1	0	0	0	0	0	111.7	E598 R601 L602 L605 L620 L621 R626 C627	E598-A624 HydrophobicContact CG-CB 4.47Å; R601-A624 HydrophobicContact CB-CB 4.39Å; R601-A624 PolarHBondContact NH1-O 3.35Å; L602-A624 HydrophobicContact CB-CB 4.11Å; L605-A624 HydrophobicContact CD1-CB 4.21Å; L620-A624 WeakPolarHBondContact O-CB 3.22Å; L620-A624 PolarHBondContact O-N 3.39Å; L621-A624 PolarHBondContact O-N 3.44Å; A624-R626 PolarHBondContact O-N 3.11Å; A624-C627 PolarHBondContact O-N 2.57Å
625	R	81	Confident	82.8	Confident	147 Å²	147	54.2 Å²	54.2	56%	0.555	28%	0.279	S	S	*	.	H	α-helix	trans	-59.2	-47.1	175.2	-71.4	178.4	-178.2	-174.2	-2.5	112.8	E598 L621 Q622 L623 C627	E598-R625 HydrophobicContact CG-CG 4.32Å; E598-R625 WeakPolarHBondContact OE1-CG 3.33Å; E598-R625 IonicContact OE1-CZ 3.62Å; E598-R625 IonicContact OE1-NE 3.97Å; E598-R625 PolarHBondContact OE1-NE 2.95Å; E598-R625 IonicContact OE1-NH2 2.99Å; L621-R625 WeakPolarHBondContact O-CG 3.42Å; L621-R625 PolarHBondContact O-N 2.93Å; L621-R625 VanDerWaalsContact O-N 3.1Å; Q622-R625 PolarHBondContact O-N 3.46Å; L623-R625 VanDerWaalsContact C-N 3.32Å; L623-R625 PolarHBondContact O-N 3.48Å; R625-C627 VanDerWaalsContact C-N 3.25Å; R625-C627 PolarHBondContact O-N 2.89Å
626	R	79.2	Confident	83.2	Confident	117 Å²	117	59.6 Å²	59.6	44%	0.442	30%	0.295	S	S	.	.	H	α-helix	trans	-69.8	-19.7	-179.3	-66.7	-177	66.2	-166.4	-1.8	113.8	Q622 L623 A624 A628 L683 D684 Q687	Q622-R626 WeakPolarHBondContact O-CG 3.48Å; Q622-R626 PolarHBondContact O-N 3.05Å; Q622-R626 VanDerWaalsContact O-N 3.13Å; L623-R626 PolarHBondContact O-N 3.46Å; A624-R626 PolarHBondContact O-N 3.11Å; R626-A628 VanDerWaalsContact C-N 3.26Å; R626-A628 PolarHBondContact O-N 3.33Å; R626-L683 HydrophobicContact CB-CD2 3.64Å; R626-D684 IonicContact NH2-OD1 2.82Å; R626-Q687 PolarHBondContact O-NE2 2.68Å
627	C	78.8	Confident	83.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	36.8	177.4	-61.2	0	0	0	0	112.4	R601 L623 A624 R625 G629 F630 L635	R601-C627 PolarHBondContact NH1-O 3.26Å; L623-C627 WeakPolarHBondContact O-CB 3.36Å; L623-C627 PolarHBondContact O-N 3.19Å; L623-C627 PolarHBondContact O-SG 2.91Å; A624-C627 PolarHBondContact O-N 2.57Å; R625-C627 VanDerWaalsContact C-N 3.25Å; R625-C627 PolarHBondContact O-N 2.89Å; C627-G629 PolarHBondContact O-N 3.41Å; C627-F630 HydrophobicContact CB-CB 4.1Å; C627-F630 HydrophobicContact CB-CD2 3.8Å; C627-F630 HydrophobicContact CB-CE2 4.44Å; C627-F630 HydrophobicContact CB-CG 3.96Å; C627-F630 WeakPolarHBondContact O-CB 3.34Å; C627-F630 PolarHBondContact O-N 3.46Å; C627-L635 HydrophobicContact CB-CD2 3.93Å
628	A	72.7	Confident	84.2	Confident	40 Å²	40	44.1 Å²	44.1	33%	0.331	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	134	175.6	0	0	0	0	0	111.1	R601 R626 F630	R601-A628 VanDerWaalsContact NH1-N 3.11Å; R626-A628 VanDerWaalsContact C-N 3.26Å; R626-A628 PolarHBondContact O-N 3.33Å; A628-F630 PolarHBondContact O-N 3.06Å
629	G	72.1	Confident	84.4	Confident	32 Å²	32	43.7 Å²	43.7	33%	0.33	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	-2.5	-177.7	0	0	0	0	0	115.7	C627	C627-G629 PolarHBondContact O-N 3.41Å
630	F	81.6	Confident	84.5	Confident	11 Å²	11	42 Å²	42	5%	0.048	22%	0.217	C	C	.	.			trans	-73	136.9	179.8	-80.4	21.8	0	0	0	111.3	C627 A628 D634 L635 L683 L686 Q687	C627-F630 HydrophobicContact CB-CB 4.1Å; C627-F630 HydrophobicContact CB-CD2 3.8Å; C627-F630 HydrophobicContact CB-CE2 4.44Å; C627-F630 HydrophobicContact CB-CG 3.96Å; C627-F630 WeakPolarHBondContact O-CB 3.34Å; C627-F630 PolarHBondContact O-N 3.46Å; A628-F630 PolarHBondContact O-N 3.06Å; F630-D634 HydrophobicContact CB-CB 4Å; F630-D634 HydrophobicContact CD2-CB 3.94Å; F630-D634 HydrophobicContact CG-CB 4Å; F630-L635 HydrophobicContact CB-CD2 4.11Å; F630-L635 HydrophobicContact CB-CG 4.42Å; F630-L635 HydrophobicContact CD2-CD2 4.31Å; F630-L683 HydrophobicContact CE2-CD1 3.58Å; F630-L683 HydrophobicContact CZ-CD1 3.82Å; F630-L686 HydrophobicContact CE2-CB 4.39Å; F630-L686 HydrophobicContact CZ-CB 4.3Å; F630-Q687 HydrophobicContact CE1-CG 4.22Å; F630-Q687 HydrophobicContact CZ-CG 3.87Å
631	V	85	Confident	84.5	Confident	22 Å²	22	42.9 Å²	42.9	13%	0.133	22%	0.22	C	C	.	.			trans	-86.2	161.6	177	-171	0	0	0	0	109.5	P471 G473 G633 D634 L635	P471-V631 HydrophobicContact CB-CG2 4.43Å; P471-V631 HydrophobicContact CG-CG2 4.09Å; G473-V631 WeakPolarHBondContact O-CG1 3.2Å; V631-G633 PolarHBondContact O-N 3.18Å; V631-G633 VanDerWaalsContact O-N 3.16Å; V631-D634 WeakPolarHBondContact CB-OD2 3.36Å; V631-D634 PolarHBondContact N-OD2 3.3Å; V631-D634 WeakPolarHBondContact O-CA 3.35Å; V631-D634 WeakPolarHBondContact O-CB 3.46Å; V631-D634 PolarHBondContact O-N 3.25Å; V631-L635 PolarHBondContact O-N 3.16Å
632	V	86.9	Confident	84.7	Confident	6 Å²	6	39.6 Å²	39.6	4%	0.036	20%	0.203	C	C	.	.	H	α-helix	trans	-47.8	-44.1	176.7	-175.8	0	0	0	0	112.4	W430 L438 L596 D634 L635 Y636	W430-V632 HydrophobicContact CE3-CG1 4.44Å; W430-V632 HydrophobicContact CH2-CG1 3.03Å; W430-V632 HydrophobicContact CZ2-CG1 3.88Å; W430-V632 HydrophobicContact CZ3-CG1 3.36Å; L438-V632 HydrophobicContact CD1-CG2 4.41Å; L438-V632 HydrophobicContact CG-CG2 4.48Å; L596-V632 HydrophobicContact CD1-CG2 3.73Å; L596-V632 HydrophobicContact CD2-CG2 4.23Å; L596-V632 HydrophobicContact CG-CG2 4.43Å; V632-D634 PolarHBondContact O-N 2.9Å; V632-L635 PolarHBondContact O-N 2.72Å; V632-Y636 PolarHBondContact O-N 3.06Å; V632-Y636 VanDerWaalsContact O-N 3.14Å
633	G	85.9	Confident	84.8	Confident	28 Å²	28	36 Å²	36	29%	0.289	19%	0.191	S	C	.	.	H	α-helix	trans	-63.4	-36.4	176	0	0	0	0	0	113.9	G473 V631 Y636 A637	G473-G633 PolarHBondContact O-N 3.37Å; V631-G633 PolarHBondContact O-N 3.18Å; V631-G633 VanDerWaalsContact O-N 3.16Å; G633-Y636 PolarHBondContact O-N 2.98Å; G633-A637 WeakPolarHBondContact O-CB 3.38Å; G633-A637 PolarHBondContact O-N 2.87Å
634	D	87.4	Confident	84.9	Confident	43 Å²	43	43 Å²	43	23%	0.23	22%	0.216	C	C	.	.	H	α-helix	trans	-70	-36.1	177.7	-59	-36	0	0	0	111.4	F630 V631 V632 Y636 A637 L638 H690	F630-D634 HydrophobicContact CB-CB 4Å; F630-D634 HydrophobicContact CD2-CB 3.94Å; F630-D634 HydrophobicContact CG-CB 4Å; V631-D634 WeakPolarHBondContact CB-OD2 3.36Å; V631-D634 PolarHBondContact N-OD2 3.3Å; V631-D634 WeakPolarHBondContact O-CA 3.35Å; V631-D634 WeakPolarHBondContact O-CB 3.46Å; V631-D634 PolarHBondContact O-N 3.25Å; V632-D634 PolarHBondContact O-N 2.9Å; D634-Y636 VanDerWaalsContact C-N 3.34Å; D634-A637 CarbonylContact O-C 3.51Å; D634-A637 WeakPolarHBondContact O-CB 3.35Å; D634-A637 PolarHBondContact O-N 3.26Å; D634-L638 WeakPolarHBondContact O-CB 3.38Å; D634-L638 PolarHBondContact O-N 3.48Å; D634-H690 IonicContact OD2-ND1 3.27Å
635	L	88.3	Confident	85	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-38.5	173.4	-62.7	175.8	0	0	0	111.6	L596 R601 V604 L605 L608 C627 F630 V631 V632 L638 L639	L596-L635 HydrophobicContact CD1-CD1 4.27Å; R601-L635 HydrophobicContact CB-CD1 4.37Å; R601-L635 HydrophobicContact CG-CD1 4.24Å; V604-L635 HydrophobicContact CB-CD1 4.08Å; V604-L635 HydrophobicContact CG1-CB 4.42Å; V604-L635 HydrophobicContact CG1-CD1 3.73Å; L605-L635 HydrophobicContact CD2-CB 4.43Å; L605-L635 HydrophobicContact CD2-CD2 4.18Å; L605-L635 HydrophobicContact CG-CD2 4.37Å; L608-L635 HydrophobicContact CD1-CB 4.5Å; C627-L635 HydrophobicContact CB-CD2 3.93Å; F630-L635 HydrophobicContact CB-CD2 4.11Å; F630-L635 HydrophobicContact CB-CG 4.42Å; F630-L635 HydrophobicContact CD2-CD2 4.31Å; V631-L635 PolarHBondContact O-N 3.16Å; V632-L635 PolarHBondContact O-N 2.72Å; L635-L638 WeakPolarHBondContact O-CB 3.42Å; L635-L638 PolarHBondContact O-N 2.97Å; L635-L639 PolarHBondContact O-N 2.95Å
636	Y	87.9	Confident	85.3	Confident	126 Å²	126	36.6 Å²	36.6	49%	0.494	19%	0.193	S	C	.	.	H	α-helix	trans	-66.2	-43.6	171.7	-175.6	-101.8	0	0	0	111.3	L608 V632 G633 D634 L638 L639 T640	L608-Y636 HydrophobicContact CD2-CD2 4.2Å; V632-Y636 PolarHBondContact O-N 3.06Å; V632-Y636 VanDerWaalsContact O-N 3.14Å; G633-Y636 PolarHBondContact O-N 2.98Å; D634-Y636 VanDerWaalsContact C-N 3.34Å; Y636-L638 VanDerWaalsContact C-N 3.27Å; Y636-L638 PolarHBondContact O-N 3.32Å; Y636-L639 PolarHBondContact O-N 3.19Å; Y636-T640 HydrophobicContact CD1-CG2 4.24Å; Y636-T640 HydrophobicContact CE1-CG2 3.88Å; Y636-T640 PolarHBondContact O-N 3.33Å; Y636-T640 VanDerWaalsContact O-N 3.14Å
637	A	88.7	Confident	85.4	Confident	24 Å²	24	33.4 Å²	33.4	20%	0.198	19%	0.188	C	C	.	.	H	α-helix	trans	-58.5	-41	174.9	0	0	0	0	0	111.2	G633 D634 L639 T640 H641 L686	G633-A637 WeakPolarHBondContact O-CB 3.38Å; G633-A637 PolarHBondContact O-N 2.87Å; D634-A637 CarbonylContact O-C 3.51Å; D634-A637 WeakPolarHBondContact O-CB 3.35Å; D634-A637 PolarHBondContact O-N 3.26Å; A637-L639 VanDerWaalsContact C-N 3.3Å; A637-L639 PolarHBondContact O-N 3.47Å; A637-T640 WeakPolarHBondContact CA-OG1 3.41Å; A637-T640 PolarHBondContact O-N 3.27Å; A637-T640 PolarHBondContact O-OG1 3.45Å; A637-H641 PolarHBondContact O-CD2 3.1Å; A637-H641 VanDerWaalsContact O-CD2 3.27Å; A637-H641 PolarHBondContact O-N 2.89Å; A637-L686 HydrophobicContact CB-CD1 4.41Å; A637-L686 HydrophobicContact CB-CD2 4.24Å
638	L	91	Very high	85.7	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-54.5	-45.3	175.7	180	66.6	0	0	0	111.9	D634 L635 Y636 H641 T642 A682 L683 L686	D634-L638 WeakPolarHBondContact O-CB 3.38Å; D634-L638 PolarHBondContact O-N 3.48Å; L635-L638 WeakPolarHBondContact O-CB 3.42Å; L635-L638 PolarHBondContact O-N 2.97Å; Y636-L638 VanDerWaalsContact C-N 3.27Å; Y636-L638 PolarHBondContact O-N 3.32Å; L638-H641 PolarHBondContact O-N 3.29Å; L638-T642 VanDerWaalsContact O-CB 3.31Å; L638-T642 WeakPolarHBondContact O-CB 3.37Å; L638-T642 PolarHBondContact O-N 3.03Å; L638-T642 PolarHBondContact O-OG1 2.85Å; L638-A682 HydrophobicContact CD1-CB 4.05Å; L638-L683 HydrophobicContact CD1-CB 4.08Å; L638-L683 HydrophobicContact CD1-CD1 4.06Å; L638-L683 HydrophobicContact CD2-CD1 4.43Å; L638-L686 HydrophobicContact CB-CD1 3.69Å; L638-L686 HydrophobicContact CD1-CD1 3.88Å; L638-L686 HydrophobicContact CG-CD1 4.42Å
639	L	88.7	Confident	86.2	Confident	12 Å²	12	37.6 Å²	37.6	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-66	-40.5	177.4	-68.1	170.7	0	0	0	112.2	L608 T609 L612 L635 Y636 A637 T642 S643 F679	L608-L639 HydrophobicContact CB-CD1 3.28Å; L608-L639 HydrophobicContact CD1-CD1 3.9Å; L608-L639 HydrophobicContact CG-CD1 4.15Å; T609-L639 HydrophobicContact CG2-CD1 4.45Å; T609-L639 HydrophobicContact CG2-CD2 3.75Å; L612-L639 HydrophobicContact CD1-CD1 4.41Å; L612-L639 HydrophobicContact CD1-CD2 4.1Å; L635-L639 PolarHBondContact O-N 2.95Å; Y636-L639 PolarHBondContact O-N 3.19Å; A637-L639 VanDerWaalsContact C-N 3.3Å; A637-L639 PolarHBondContact O-N 3.47Å; L639-T642 PolarHBondContact O-N 3.02Å; L639-S643 PolarHBondContact O-N 3Å; L639-S643 PolarHBondContact O-OG 2.77Å; L639-F679 HydrophobicContact CD2-CE1 3.87Å; L639-F679 HydrophobicContact CD2-CZ 4.08Å
640	T	88.1	Confident	86.5	Confident	40 Å²	40	37.9 Å²	37.9	25%	0.245	20%	0.201	C	C	.	.	H	α-helix	trans	-66.5	-37.2	176.8	66.5	0	0	0	0	112.7	Y636 A637 S643 R644	Y636-T640 HydrophobicContact CD1-CG2 4.24Å; Y636-T640 HydrophobicContact CE1-CG2 3.88Å; Y636-T640 PolarHBondContact O-N 3.33Å; Y636-T640 VanDerWaalsContact O-N 3.14Å; A637-T640 WeakPolarHBondContact CA-OG1 3.41Å; A637-T640 PolarHBondContact O-N 3.27Å; A637-T640 PolarHBondContact O-OG1 3.45Å; T640-S643 WeakPolarHBondContact CA-OG 3.06Å; T640-S643 PolarHBondContact O-OG 2.7Å; T640-R644 VanDerWaalsContact O-CG 3.29Å; T640-R644 WeakPolarHBondContact O-CG 3.48Å; T640-R644 PolarHBondContact O-N 2.87Å
641	H	89.9	Confident	86.3	Confident	48 Å²	48	44.8 Å²	44.8	22%	0.222	23%	0.227	C	C	.	.	H	α-helix	trans	-69	-43	174.3	-85	-96.1	0	0	0	110.9	A637 L638 S643 R644 V645 A682 L686	A637-H641 PolarHBondContact O-CD2 3.1Å; A637-H641 VanDerWaalsContact O-CD2 3.27Å; A637-H641 PolarHBondContact O-N 2.89Å; L638-H641 PolarHBondContact O-N 3.29Å; H641-S643 VanDerWaalsContact C-N 3.33Å; H641-S643 PolarHBondContact O-N 3.14Å; H641-R644 WeakPolarHBondContact O-CB 3.1Å; H641-R644 PolarHBondContact O-N 2.84Å; H641-R644 VanDerWaalsContact O-N 3.1Å; H641-V645 WeakPolarHBondContact O-CG2 3.37Å; H641-V645 PolarHBondContact O-N 3.29Å; H641-A682 HydrophobicContact CB-CB 3.85Å; H641-L686 HydrophobicContact CB-CD1 4.41Å
642	T	90.5	Very high	85.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.9	-43.9	175.6	-52.9	0	0	0	0	110.7	L638 L639 R644 V645 A646 L674 D678 F679 A682	L638-T642 VanDerWaalsContact O-CB 3.31Å; L638-T642 WeakPolarHBondContact O-CB 3.37Å; L638-T642 PolarHBondContact O-N 3.03Å; L638-T642 PolarHBondContact O-OG1 2.85Å; L639-T642 PolarHBondContact O-N 3.02Å; T642-R644 VanDerWaalsContact C-N 3.31Å; T642-R644 PolarHBondContact O-N 3Å; T642-V645 PolarHBondContact O-N 2.93Å; T642-A646 WeakPolarHBondContact O-CB 3.39Å; T642-A646 PolarHBondContact O-N 2.87Å; T642-L674 HydrophobicContact CG2-CB 4.26Å; T642-L674 HydrophobicContact CG2-CD1 4.2Å; T642-L674 HydrophobicContact CG2-CD2 4.16Å; T642-L674 HydrophobicContact CG2-CG 4.44Å; T642-D678 HydrophobicContact CG2-CB 3.64Å; T642-F679 HydrophobicContact CG2-CD1 3.82Å; T642-F679 HydrophobicContact CG2-CD2 3.83Å; T642-F679 HydrophobicContact CG2-CE1 3.91Å; T642-F679 HydrophobicContact CG2-CE2 3.9Å; T642-F679 HydrophobicContact CG2-CG 3.79Å; T642-F679 HydrophobicContact CG2-CZ 3.95Å; T642-F679 WeakPolarHBondContact OG1-CD1 3.44Å; T642-A682 WeakPolarHBondContact OG1-CB 3.23Å
643	S	86.1	Confident	85.1	Confident	42 Å²	42	51.9 Å²	51.9	29%	0.294	28%	0.283	S	S	.	.	H	α-helix	trans	-63.8	-36.2	175.8	64.1	0	0	0	0	112.5	L639 T640 H641 C647	L639-S643 PolarHBondContact O-N 3Å; L639-S643 PolarHBondContact O-OG 2.77Å; T640-S643 WeakPolarHBondContact CA-OG 3.06Å; T640-S643 PolarHBondContact O-OG 2.7Å; H641-S643 VanDerWaalsContact C-N 3.33Å; H641-S643 PolarHBondContact O-N 3.14Å; S643-C647 WeakPolarHBondContact O-CB 3.49Å; S643-C647 PolarHBondContact O-N 3.47Å; S643-C647 PolarHBondContact O-SG 3.39Å
644	R	87	Confident	83.9	Confident	163 Å²	163	51.8 Å²	51.8	62%	0.615	28%	0.282	S	S	*	.	H	α-helix	trans	-67.7	-43.9	175.8	-76.2	171.6	178.1	171.5	-0.2	112.1	T640 H641 T642 C647 A648	T640-R644 VanDerWaalsContact O-CG 3.29Å; T640-R644 WeakPolarHBondContact O-CG 3.48Å; T640-R644 PolarHBondContact O-N 2.87Å; H641-R644 WeakPolarHBondContact O-CB 3.1Å; H641-R644 PolarHBondContact O-N 2.84Å; H641-R644 VanDerWaalsContact O-N 3.1Å; T642-R644 VanDerWaalsContact C-N 3.31Å; T642-R644 PolarHBondContact O-N 3Å; R644-C647 WeakPolarHBondContact O-CB 3.32Å; R644-C647 PolarHBondContact O-N 2.85Å; R644-A648 WeakPolarHBondContact O-CB 3.25Å; R644-A648 PolarHBondContact O-N 2.89Å
645	V	88.7	Confident	82.2	Confident	14 Å²	14	57.4 Å²	57.4	9%	0.085	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-45.5	177.1	172.4	0	0	0	0	110.4	H641 T642 C647 A648 R649 D678 Q681	H641-V645 WeakPolarHBondContact O-CG2 3.37Å; H641-V645 PolarHBondContact O-N 3.29Å; T642-V645 PolarHBondContact O-N 2.93Å; V645-C647 PolarHBondContact O-N 3.42Å; V645-A648 WeakPolarHBondContact O-CB 3.28Å; V645-A648 PolarHBondContact O-N 2.88Å; V645-A648 VanDerWaalsContact O-N 3.11Å; V645-R649 PolarHBondContact O-N 3.22Å; V645-D678 HydrophobicContact CG1-CB 4.19Å; V645-Q681 HydrophobicContact CG1-CB 4.13Å; V645-Q681 VanDerWaalsContact CG1-OE1 3.3Å; V645-Q681 HydrophobicContact CG2-CB 4.49Å
646	A	86.2	Confident	80.4	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-61.2	-42.7	175.8	0	0	0	0	0	111.9	T642 A648 R649 I650 F672 L674 D678	T642-A646 WeakPolarHBondContact O-CB 3.39Å; T642-A646 PolarHBondContact O-N 2.87Å; A646-A648 PolarHBondContact O-N 3.3Å; A646-R649 PolarHBondContact O-N 3.25Å; A646-I650 WeakPolarHBondContact O-CD1 3.22Å; A646-I650 VanDerWaalsContact O-CG1 3.25Å; A646-I650 WeakPolarHBondContact O-CG1 3.39Å; A646-I650 PolarHBondContact O-N 2.77Å; A646-F672 HydrophobicContact CB-CD2 3.59Å; A646-F672 HydrophobicContact CB-CE2 3.4Å; A646-F672 HydrophobicContact CB-CZ 4.45Å; A646-L674 HydrophobicContact CB-CD2 3.83Å; A646-D678 HydrophobicContact CB-CB 4.46Å
647	C	82.3	Confident	78.8	Confident	49 Å²	49	60.7 Å²	60.7	33%	0.331	37%	0.372	S	S	.	.	H	α-helix	trans	-59.1	-43.8	171.6	-78.4	0	0	0	0	112.2	S643 R644 V645 I650 R651 F672	S643-C647 WeakPolarHBondContact O-CB 3.49Å; S643-C647 PolarHBondContact O-N 3.47Å; S643-C647 PolarHBondContact O-SG 3.39Å; R644-C647 WeakPolarHBondContact O-CB 3.32Å; R644-C647 PolarHBondContact O-N 2.85Å; V645-C647 PolarHBondContact O-N 3.42Å; C647-I650 PolarHBondContact O-N 2.98Å; C647-R651 WeakPolarHBondContact O-CB 2.85Å; C647-R651 WeakPolarHBondContact O-CG 3.05Å; C647-R651 PolarHBondContact O-N 2.59Å; C647-F672 WeakPolarHBondContact SG-CE1 3.37Å; C647-F672 WeakPolarHBondContact SG-CZ 3.45Å
648	A	84.5	Confident	77.3	Confident	58 Å²	58	62.6 Å²	62.6	48%	0.479	39%	0.394	S	S	.	.	H	α-helix	trans	-64.5	-42.3	179	0	0	0	0	0	111.9	R644 V645 A646 I650 R651 A652	R644-A648 WeakPolarHBondContact O-CB 3.25Å; R644-A648 PolarHBondContact O-N 2.89Å; V645-A648 WeakPolarHBondContact O-CB 3.28Å; V645-A648 PolarHBondContact O-N 2.88Å; V645-A648 VanDerWaalsContact O-N 3.11Å; A646-A648 PolarHBondContact O-N 3.3Å; A648-I650 PolarHBondContact O-N 3.4Å; A648-R651 PolarHBondContact O-N 3.27Å; A648-A652 WeakPolarHBondContact O-CB 3.37Å; A648-A652 PolarHBondContact O-N 3.3Å
649	R	84.1	Confident	75.9	Confident	70 Å²	70	65.2 Å²	65.2	26%	0.264	41%	0.407	S	S	.	.	H	α-helix	trans	-59.2	-46.5	173.1	179.9	-172.2	63.5	-144.5	-12.6	111.3	V645 A646 A652 S653 L675 D678	V645-R649 PolarHBondContact O-N 3.22Å; A646-R649 PolarHBondContact O-N 3.25Å; R649-A652 PolarHBondContact O-N 3.1Å; R649-S653 WeakPolarHBondContact O-CB 3.18Å; R649-S653 PolarHBondContact O-N 3.34Å; R649-S653 PolarHBondContact O-OG 3.19Å; R649-L675 VanDerWaalsContact NH1-CD1 3.28Å; R649-D678 IonicContact CZ-OD1 3.01Å; R649-D678 VanDerWaalsContact CZ-OD1 3.27Å; R649-D678 IonicContact CZ-OD2 2.77Å; R649-D678 IonicContact NE-OD1 3.53Å; R649-D678 IonicContact NH1-OD1 2.9Å; R649-D678 PolarHBondContact NH1-OD1 2.91Å; R649-D678 IonicContact NH1-OD2 3.68Å; R649-D678 PolarHBondContact NH1-OD2 3.34Å; R649-D678 IonicContact NH2-OD1 3.63Å; R649-D678 IonicContact NH2-OD2 2.71Å; R649-D678 PolarHBondContact NH2-OD2 2.88Å
650	I	78.3	Confident	74.9	Confident	38 Å²	38	67.5 Å²	67.5	20%	0.195	42%	0.424	C	S	.	.	H	α-helix	trans	-64	-44.6	-179.1	-68	162.6	0	0	0	110.3	A646 C647 A648 A652 S653 G654 L667 F672	A646-I650 WeakPolarHBondContact O-CD1 3.22Å; A646-I650 VanDerWaalsContact O-CG1 3.25Å; A646-I650 WeakPolarHBondContact O-CG1 3.39Å; A646-I650 PolarHBondContact O-N 2.77Å; C647-I650 PolarHBondContact O-N 2.98Å; A648-I650 PolarHBondContact O-N 3.4Å; I650-A652 VanDerWaalsContact C-N 3.3Å; I650-A652 PolarHBondContact O-N 3.31Å; I650-S653 WeakPolarHBondContact CA-OG 3.38Å; I650-S653 CarbonylContact O-C 3.49Å; I650-S653 PolarHBondContact O-N 2.98Å; I650-S653 VanDerWaalsContact O-N 3.14Å; I650-S653 PolarHBondContact O-OG 2.86Å; I650-G654 PolarHBondContact O-N 3.03Å; I650-L667 HydrophobicContact CG2-CD1 4.32Å; I650-F672 HydrophobicContact CD1-CB 3.28Å; I650-F672 HydrophobicContact CD1-CD1 3.99Å; I650-F672 HydrophobicContact CD1-CD2 4.02Å; I650-F672 HydrophobicContact CD1-CG 3.5Å; I650-F672 VanDerWaalsContact CD1-CG 3.5Å
651	R	76.5	Confident	74	Confident	157 Å²	157	74 Å²	74	59%	0.592	45%	0.452	S	S	*	.	H	α-helix	trans	-58.8	-39.8	173.8	-77	178.5	171	176.6	-4.1	112.6	C647 A648 L659 E664	C647-R651 WeakPolarHBondContact O-CB 2.85Å; C647-R651 WeakPolarHBondContact O-CG 3.05Å; C647-R651 PolarHBondContact O-N 2.59Å; A648-R651 PolarHBondContact O-N 3.27Å; R651-L659 HydrophobicContact CG-CD1 4.11Å; R651-E664 IonicContact CZ-OE1 3.2Å; R651-E664 IonicContact NE-OE1 3.2Å; R651-E664 IonicContact NH2-OE1 3.14Å; R651-E664 PolarHBondContact NH2-OE1 2.75Å
652	A	76.7	Confident	72.7	Confident	87 Å²	87	79.1 Å²	79.1	72%	0.719	48%	0.476	S	S	*	.	H	α-helix	trans	-72.5	-28.7	176.9	0	0	0	0	0	113.3	A648 R649 I650	A648-A652 WeakPolarHBondContact O-CB 3.37Å; A648-A652 PolarHBondContact O-N 3.3Å; R649-A652 PolarHBondContact O-N 3.1Å; I650-A652 VanDerWaalsContact C-N 3.3Å; I650-A652 PolarHBondContact O-N 3.31Å
653	S	70.9	Confident	71.4	Confident	89 Å²	89	82.8 Å²	82.8	62%	0.622	50%	0.495	S	S	*	.	H	α-helix	trans	-85.4	-18.3	176.7	70.2	0	0	0	0	114	R649 I650	R649-S653 WeakPolarHBondContact O-CB 3.18Å; R649-S653 PolarHBondContact O-N 3.34Å; R649-S653 PolarHBondContact O-OG 3.19Å; I650-S653 WeakPolarHBondContact CA-OG 3.38Å; I650-S653 CarbonylContact O-C 3.49Å; I650-S653 PolarHBondContact O-N 2.98Å; I650-S653 VanDerWaalsContact O-N 3.14Å; I650-S653 PolarHBondContact O-OG 2.86Å
654	G	59.6	Low	70.4	Confident	26 Å²	26	84 Å²	84	27%	0.268	50%	0.497	S	S	.	.	S	Bend	trans	-62.2	138	172.3	0	0	0	0	0	110.1	I650	I650-G654 PolarHBondContact O-N 3.03Å
655	L	51.9	Low	69.3	Low	161 Å²	161	78.2 Å²	78.2	84%	0.843	49%	0.488	S	S	*	.			trans	-41.9	149.4	-179.5	-110.7	79.7	0	0	0	112.1	G657 G658	L655-G657 PolarHBondContact O-N 3.13Å; L655-G658 PolarHBondContact O-N 3.14Å
656	A	50	Low	68	Low	122 Å²	122	84.2 Å²	84.2	100%	1.008	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	13.5	-176.1	0	0	0	0	0	117.7
657	G	55.9	Low	66.9	Low	74 Å²	74	87.6 Å²	87.6	76%	0.763	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	9.7	178.8	0	0	0	0	0	116.1	L655	L655-G657 PolarHBondContact O-N 3.13Å
658	G	56.5	Low	65.9	Low	63 Å²	63	90.1 Å²	90.1	65%	0.649	55%	0.55	S	S	*	.			trans	74.7	164.8	-175.7	0	0	0	0	0	113.1	L655	L655-G658 PolarHBondContact O-N 3.14Å
659	L	61	Low	64.7	Low	57 Å²	57	91 Å²	91	30%	0.298	56%	0.557	S	S	.	*			trans	-92	134.1	177	-64.3	169.7	0	0	0	109.2	R651 D663 E664 L667	R651-L659 HydrophobicContact CG-CD1 4.11Å; L659-D663 HydrophobicContact CB-CB 4.48Å; L659-D663 HydrophobicContact CD2-CB 4.37Å; L659-E664 HydrophobicContact CB-CG 3.84Å; L659-E664 HydrophobicContact CD1-CG 4.26Å; L659-L667 HydrophobicContact CD1-CD1 3.97Å; L659-L667 HydrophobicContact CD2-CD1 4.12Å
660	S	68.4	Low	63.5	Low	59 Å²	59	91.7 Å²	91.7	41%	0.413	58%	0.577	S	S	.	*			trans	-67.9	154.6	168.5	-176.8	0	0	0	0	110.3	E662 D663 E664	S660-E662 PolarHBondContact O-N 2.96Å; S660-E662 VanDerWaalsContact O-N 3.16Å; S660-D663 WeakPolarHBondContact CB-OD2 3.42Å; S660-D663 PolarHBondContact N-OD2 3.05Å; S660-D663 WeakPolarHBondContact O-CB 3.37Å; S660-D663 PolarHBondContact O-N 2.91Å; S660-E664 PolarHBondContact O-N 2.9Å
661	E	68.3	Low	62.8	Low	178 Å²	178	91.6 Å²	91.6	83%	0.832	59%	0.586	S	S	*	*	H	α-helix	trans	-56.9	-29.9	174.1	-68.6	-171.8	163	0	0	111.9	G665	E661-G665 PolarHBondContact O-N 3.12Å
662	E	62.3	Low	62.6	Low	154 Å²	154	86.6 Å²	86.6	72%	0.72	57%	0.568	S	S	*	*	H	α-helix	trans	-70.8	-41.8	175	-62.4	-178	169.5	0	0	111.9	S660 G665 E666	S660-E662 PolarHBondContact O-N 2.96Å; S660-E662 VanDerWaalsContact O-N 3.16Å; E662-G665 PolarHBondContact O-N 3.37Å; E662-E666 WeakPolarHBondContact O-CG 3.46Å; E662-E666 PolarHBondContact O-N 3.41Å
663	D	64.9	Low	62.8	Low	77 Å²	77	85.7 Å²	85.7	41%	0.412	56%	0.555	S	S	.	*	H	α-helix	trans	-66.6	-39	176	-62.3	-44.1	0	0	0	111.2	L659 S660 G665 E666 L667	L659-D663 HydrophobicContact CB-CB 4.48Å; L659-D663 HydrophobicContact CD2-CB 4.37Å; S660-D663 WeakPolarHBondContact CB-OD2 3.42Å; S660-D663 PolarHBondContact N-OD2 3.05Å; S660-D663 WeakPolarHBondContact O-CB 3.37Å; S660-D663 PolarHBondContact O-N 2.91Å; D663-G665 VanDerWaalsContact C-N 3.33Å; D663-E666 PolarHBondContact O-N 3.12Å; D663-L667 WeakPolarHBondContact O-CB 3.37Å; D663-L667 WeakPolarHBondContact O-CD1 3.34Å; D663-L667 WeakPolarHBondContact O-CG 3.27Å; D663-L667 PolarHBondContact O-N 2.95Å
664	E	65.1	Low	63.6	Low	69 Å²	69	81.7 Å²	81.7	32%	0.322	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-39.9	173.9	-71.3	-159.1	141.6	0	0	111.4	R651 L659 S660 L667 C668	R651-E664 IonicContact CZ-OE1 3.2Å; R651-E664 IonicContact NE-OE1 3.2Å; R651-E664 IonicContact NH2-OE1 3.14Å; R651-E664 PolarHBondContact NH2-OE1 2.75Å; L659-E664 HydrophobicContact CB-CG 3.84Å; L659-E664 HydrophobicContact CD1-CG 4.26Å; S660-E664 PolarHBondContact O-N 2.9Å; E664-L667 PolarHBondContact O-N 3.01Å; E664-C668 WeakPolarHBondContact O-CB 3.41Å; E664-C668 PolarHBondContact O-N 3.46Å; E664-C668 PolarHBondContact O-SG 2.82Å
665	G	63.1	Low	65	Low	41 Å²	41	83 Å²	83	42%	0.423	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-43.6	175.6	0	0	0	0	0	113.2	E661 E662 D663 C668 A669	E661-G665 PolarHBondContact O-N 3.12Å; E662-G665 PolarHBondContact O-N 3.37Å; D663-G665 VanDerWaalsContact C-N 3.33Å; G665-C668 PolarHBondContact O-N 3.34Å; G665-A669 WeakPolarHBondContact O-CB 3.42Å; G665-A669 PolarHBondContact O-N 2.72Å
666	E	60.5	Low	66.7	Low	140 Å²	140	77.3 Å²	77.3	65%	0.654	50%	0.504	S	S	*	.	H	α-helix	trans	-66.9	-40	176.3	-71.4	-169.7	177.4	0	0	112.5	E662 D663 A669 A670	E662-E666 WeakPolarHBondContact O-CG 3.46Å; E662-E666 PolarHBondContact O-N 3.41Å; D663-E666 PolarHBondContact O-N 3.12Å; E666-A669 PolarHBondContact O-N 3.05Å; E666-A670 WeakPolarHBondContact O-CB 3.25Å; E666-A670 PolarHBondContact O-N 2.76Å
667	L	63.7	Low	68.5	Low	70 Å²	70	77.6 Å²	77.6	37%	0.366	48%	0.484	S	S	.	.	H	α-helix	trans	-65.3	-41.6	175.8	-74.2	168.5	0	0	0	112.1	I650 L659 D663 E664 A669 A670 G671	I650-L667 HydrophobicContact CG2-CD1 4.32Å; L659-L667 HydrophobicContact CD1-CD1 3.97Å; L659-L667 HydrophobicContact CD2-CD1 4.12Å; D663-L667 WeakPolarHBondContact O-CB 3.37Å; D663-L667 WeakPolarHBondContact O-CD1 3.34Å; D663-L667 WeakPolarHBondContact O-CG 3.27Å; D663-L667 PolarHBondContact O-N 2.95Å; E664-L667 PolarHBondContact O-N 3.01Å; L667-A669 VanDerWaalsContact C-N 3.33Å; L667-A670 PolarHBondContact O-N 2.85Å; L667-G671 PolarHBondContact O-N 2.97Å; L667-G671 VanDerWaalsContact O-N 3.09Å
668	C	61.9	Low	70.2	Confident	103 Å²	103	74.1 Å²	74.1	70%	0.696	45%	0.448	S	S	*	.	H	α-helix	trans	-65.2	-37	175.3	-69.5	0	0	0	0	111.9	E664 G665	E664-C668 WeakPolarHBondContact O-CB 3.41Å; E664-C668 PolarHBondContact O-N 3.46Å; E664-C668 PolarHBondContact O-SG 2.82Å; G665-C668 PolarHBondContact O-N 3.34Å
669	A	59.4	Low	71.8	Confident	76 Å²	76	71.2 Å²	71.2	63%	0.628	42%	0.418	S	S	*	.	H	α-helix	trans	-72.6	-33.8	176.9	0	0	0	0	0	113	G665 E666 L667	G665-A669 WeakPolarHBondContact O-CB 3.42Å; G665-A669 PolarHBondContact O-N 2.72Å; E666-A669 PolarHBondContact O-N 3.05Å; L667-A669 VanDerWaalsContact C-N 3.33Å
670	A	59.1	Low	73.1	Confident	84 Å²	84	69.2 Å²	69.2	69%	0.694	41%	0.411	S	S	*	.	H	α-helix	trans	-73.4	-29.3	177.8	0	0	0	0	0	112.7	E666 L667	E666-A670 WeakPolarHBondContact O-CB 3.25Å; E666-A670 PolarHBondContact O-N 2.76Å; L667-A670 PolarHBondContact O-N 2.85Å
671	G	62.7	Low	74.1	Confident	37 Å²	37	71.5 Å²	71.5	38%	0.381	42%	0.415	S	S	.	.			trans	69.5	137.3	-171.4	0	0	0	0	0	111.3	L667	L667-G671 PolarHBondContact O-N 2.97Å; L667-G671 VanDerWaalsContact O-N 3.09Å
672	F	73	Confident	75.2	Confident	51 Å²	51	63 Å²	63	22%	0.224	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-102.6	137.5	177.5	51.9	-93.1	0	0	0	111.4	P613 A646 C647 I650 L674	P613-F672 WeakPolarHBondContact CG-O 3.48Å; A646-F672 HydrophobicContact CB-CD2 3.59Å; A646-F672 HydrophobicContact CB-CE2 3.4Å; A646-F672 HydrophobicContact CB-CZ 4.45Å; C647-F672 WeakPolarHBondContact SG-CE1 3.37Å; C647-F672 WeakPolarHBondContact SG-CZ 3.45Å; I650-F672 HydrophobicContact CD1-CB 3.28Å; I650-F672 HydrophobicContact CD1-CD1 3.99Å; I650-F672 HydrophobicContact CD1-CD2 4.02Å; I650-F672 HydrophobicContact CD1-CG 3.5Å; I650-F672 VanDerWaalsContact CD1-CG 3.5Å; F672-L674 HydrophobicContact CD2-CD2 3.95Å; F672-L674 HydrophobicContact CE2-CD2 3.6Å; F672-L674 PolarHBondContact O-N 3.27Å
673	P	81.1	Confident	76.4	Confident	69 Å²	69	55.7 Å²	55.7	45%	0.448	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-68.4	132.4	176.7	28.7	-33.3	0	0	0	110.5	P613	P613-P673 VanDerWaalsContact O-CA 3.31Å; P613-P673 WeakPolarHBondContact O-CA 3.39Å
674	L	87.3	Confident	77.3	Confident	4 Å²	4	56 Å²	56	2%	0.021	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-79.5	123.3	171	-56.2	179.7	0	0	0	108.9	L612 P613 L614 G615 V618 T642 A646 F672 F679	L612-L674 HydrophobicContact CD1-CD1 4.26Å; P613-L674 PolarHBondContact O-N 3.29Å; L614-L674 HydrophobicContact CD2-CB 4.38Å; L614-L674 HydrophobicContact CD2-CD1 4.44Å; G615-L674 PolarHBondContact N-O 2.96Å; V618-L674 WeakPolarHBondContact CG2-O 3.39Å; T642-L674 HydrophobicContact CG2-CB 4.26Å; T642-L674 HydrophobicContact CG2-CD1 4.2Å; T642-L674 HydrophobicContact CG2-CD2 4.16Å; T642-L674 HydrophobicContact CG2-CG 4.44Å; A646-L674 HydrophobicContact CB-CD2 3.83Å; F672-L674 HydrophobicContact CD2-CD2 3.95Å; F672-L674 HydrophobicContact CE2-CD2 3.6Å; F672-L674 PolarHBondContact O-N 3.27Å; L674-F679 HydrophobicContact CB-CE2 3.77Å; L674-F679 HydrophobicContact CB-CZ 4.34Å; L674-F679 HydrophobicContact CD1-CE2 4.37Å; L674-F679 HydrophobicContact CD1-CZ 4.1Å
675	L	88.1	Confident	78.2	Confident	55 Å²	55	57 Å²	57	29%	0.288	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-96.6	161.5	179.3	-56.6	-173.1	0	0	0	111.1	R649 E677 D678 F679	R649-L675 VanDerWaalsContact NH1-CD1 3.28Å; L675-E677 PolarHBondContact O-N 2.94Å; L675-D678 PolarHBondContact N-OD2 3.21Å; L675-D678 WeakPolarHBondContact O-CB 3.44Å; L675-D678 PolarHBondContact O-N 2.86Å; L675-D678 VanDerWaalsContact O-N 3.1Å; L675-F679 WeakPolarHBondContact O-CD2 3.06Å; L675-F679 PolarHBondContact O-N 3.42Å
676	A	88.7	Confident	79.2	Confident	41 Å²	41	56 Å²	56	34%	0.339	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-32.9	178.3	0	0	0	0	0	112.6	E617 V618 D678 F679 G680	E617-A676 HydrophobicContact CB-CB 4.28Å; V618-A676 HydrophobicContact CG2-CB 4.46Å; A676-D678 VanDerWaalsContact C-N 3.34Å; A676-D678 PolarHBondContact O-N 2.64Å; A676-F679 PolarHBondContact O-N 3.32Å; A676-G680 PolarHBondContact O-N 3.11Å
677	E	88.3	Confident	79.9	Confident	127 Å²	127	51.6 Å²	51.6	59%	0.593	31%	0.312	S	S	*	.	H	α-helix	trans	-62.4	-38.8	175.2	-63	-177.3	170.6	0	0	112.6	L675 F679 G680 Q681	L675-E677 PolarHBondContact O-N 2.94Å; E677-F679 VanDerWaalsContact C-N 3.35Å; E677-G680 PolarHBondContact O-N 3.44Å; E677-Q681 PolarHBondContact O-N 3.27Å
678	D	90.8	Very high	80.5	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.011	31%	0.313	C	S	.	.	H	α-helix	trans	-65.4	-42.7	179	-57.9	-44.1	0	0	0	110.4	T642 V645 A646 R649 L675 A676 G680 Q681 A682	T642-D678 HydrophobicContact CG2-CB 3.64Å; V645-D678 HydrophobicContact CG1-CB 4.19Å; A646-D678 HydrophobicContact CB-CB 4.46Å; R649-D678 IonicContact CZ-OD1 3.01Å; R649-D678 VanDerWaalsContact CZ-OD1 3.27Å; R649-D678 IonicContact CZ-OD2 2.77Å; R649-D678 IonicContact NE-OD1 3.53Å; R649-D678 IonicContact NH1-OD1 2.9Å; R649-D678 PolarHBondContact NH1-OD1 2.91Å; R649-D678 IonicContact NH1-OD2 3.68Å; R649-D678 PolarHBondContact NH1-OD2 3.34Å; R649-D678 IonicContact NH2-OD1 3.63Å; R649-D678 IonicContact NH2-OD2 2.71Å; R649-D678 PolarHBondContact NH2-OD2 2.88Å; L675-D678 PolarHBondContact N-OD2 3.21Å; L675-D678 WeakPolarHBondContact O-CB 3.44Å; L675-D678 PolarHBondContact O-N 2.86Å; L675-D678 VanDerWaalsContact O-N 3.1Å; A676-D678 VanDerWaalsContact C-N 3.34Å; A676-D678 PolarHBondContact O-N 2.64Å; D678-G680 VanDerWaalsContact C-N 3.33Å; D678-Q681 PolarHBondContact O-N 3.45Å; D678-A682 VanDerWaalsContact O-CB 3.24Å; D678-A682 WeakPolarHBondContact O-CB 3.28Å; D678-A682 PolarHBondContact O-N 3.35Å
679	F	90.4	Very high	81	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-64	-39.5	176	-80.1	-77.4	0	0	0	111.5	L614 V618 L623 L639 T642 L674 L675 A676 E677 L683	L614-F679 HydrophobicContact CD2-CE2 4.08Å; L614-F679 HydrophobicContact CD2-CZ 4.05Å; V618-F679 HydrophobicContact CG1-CD2 4Å; V618-F679 HydrophobicContact CG1-CE2 3.78Å; V618-F679 HydrophobicContact CG1-CZ 4.44Å; V618-F679 HydrophobicContact CG2-CD2 4.09Å; V618-F679 HydrophobicContact CG2-CE2 4.04Å; L623-F679 HydrophobicContact CD1-CB 4.36Å; L623-F679 HydrophobicContact CD1-CD1 3.77Å; L623-F679 HydrophobicContact CD1-CD2 4.29Å; L623-F679 HydrophobicContact CD1-CE1 4.05Å; L623-F679 HydrophobicContact CD1-CG 3.9Å; L623-F679 HydrophobicContact CD1-CZ 4.45Å; L623-F679 HydrophobicContact CD2-CB 3.96Å; L623-F679 HydrophobicContact CD2-CD1 4.47Å; L623-F679 HydrophobicContact CD2-CG 4.37Å; L639-F679 HydrophobicContact CD2-CE1 3.87Å; L639-F679 HydrophobicContact CD2-CZ 4.08Å; T642-F679 HydrophobicContact CG2-CD1 3.82Å; T642-F679 HydrophobicContact CG2-CD2 3.83Å; T642-F679 HydrophobicContact CG2-CE1 3.91Å; T642-F679 HydrophobicContact CG2-CE2 3.9Å; T642-F679 HydrophobicContact CG2-CG 3.79Å; T642-F679 HydrophobicContact CG2-CZ 3.95Å; T642-F679 WeakPolarHBondContact OG1-CD1 3.44Å; L674-F679 HydrophobicContact CB-CE2 3.77Å; L674-F679 HydrophobicContact CB-CZ 4.34Å; L674-F679 HydrophobicContact CD1-CE2 4.37Å; L674-F679 HydrophobicContact CD1-CZ 4.1Å; L675-F679 WeakPolarHBondContact O-CD2 3.06Å; L675-F679 PolarHBondContact O-N 3.42Å; A676-F679 PolarHBondContact O-N 3.32Å; E677-F679 VanDerWaalsContact C-N 3.35Å; F679-L683 WeakPolarHBondContact O-CB 3.46Å; F679-L683 PolarHBondContact O-N 3.4Å
680	G	88.6	Confident	81.4	Confident	15 Å²	15	47.5 Å²	47.5	16%	0.155	28%	0.28	C	S	.	.	H	α-helix	trans	-58.7	-52.9	175.4	0	0	0	0	0	112	A676 E677 D678 A682 L683 D684	A676-G680 PolarHBondContact O-N 3.11Å; E677-G680 PolarHBondContact O-N 3.44Å; D678-G680 VanDerWaalsContact C-N 3.33Å; G680-A682 PolarHBondContact O-N 3.14Å; G680-L683 PolarHBondContact O-N 3.27Å; G680-D684 VanDerWaalsContact O-CG 3.3Å; G680-D684 PolarHBondContact O-N 3.14Å
681	Q	89.2	Confident	81.8	Confident	106 Å²	106	44.6 Å²	44.6	50%	0.495	26%	0.255	S	S	.	.	H	α-helix	trans	-64.3	-41.8	179.7	-67.5	-178.5	19.3	0	0	112.6	V645 E677 D678 L683 D684 Q685	V645-Q681 HydrophobicContact CG1-CB 4.13Å; V645-Q681 VanDerWaalsContact CG1-OE1 3.3Å; V645-Q681 HydrophobicContact CG2-CB 4.49Å; E677-Q681 PolarHBondContact O-N 3.27Å; D678-Q681 PolarHBondContact O-N 3.45Å; Q681-L683 VanDerWaalsContact C-N 3.34Å; Q681-D684 PolarHBondContact O-N 2.82Å; Q681-Q685 WeakPolarHBondContact O-CG 3.46Å; Q681-Q685 PolarHBondContact O-N 3.17Å; Q681-Q685 VanDerWaalsContact O-N 3.11Å
682	A	90.4	Very high	81.9	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.9	-39.4	177.8	0	0	0	0	0	111.9	L638 H641 T642 D678 G680 Q685 L686	L638-A682 HydrophobicContact CD1-CB 4.05Å; H641-A682 HydrophobicContact CB-CB 3.85Å; T642-A682 WeakPolarHBondContact OG1-CB 3.23Å; D678-A682 VanDerWaalsContact O-CB 3.24Å; D678-A682 WeakPolarHBondContact O-CB 3.28Å; D678-A682 PolarHBondContact O-N 3.35Å; G680-A682 PolarHBondContact O-N 3.14Å; A682-Q685 PolarHBondContact O-N 3.33Å; A682-L686 WeakPolarHBondContact O-CB 3.4Å; A682-L686 PolarHBondContact O-N 3.31Å
683	L	87.6	Confident	81.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.3	-42.9	178.2	-171.6	68.2	0	0	0	111.4	R626 F630 L638 F679 G680 Q681 Q685 L686 Q687	R626-L683 HydrophobicContact CB-CD2 3.64Å; F630-L683 HydrophobicContact CE2-CD1 3.58Å; F630-L683 HydrophobicContact CZ-CD1 3.82Å; L638-L683 HydrophobicContact CD1-CB 4.08Å; L638-L683 HydrophobicContact CD1-CD1 4.06Å; L638-L683 HydrophobicContact CD2-CD1 4.43Å; F679-L683 WeakPolarHBondContact O-CB 3.46Å; F679-L683 PolarHBondContact O-N 3.4Å; G680-L683 PolarHBondContact O-N 3.27Å; Q681-L683 VanDerWaalsContact C-N 3.34Å; L683-Q685 VanDerWaalsContact C-N 3.31Å; L683-Q685 PolarHBondContact O-N 3.36Å; L683-L686 PolarHBondContact O-N 3.42Å; L683-Q687 HydrophobicContact CD1-CG 4.3Å; L683-Q687 HydrophobicContact CG-CG 4.19Å; L683-Q687 VanDerWaalsContact O-CB 3.32Å; L683-Q687 WeakPolarHBondContact O-CB 3.35Å; L683-Q687 VanDerWaalsContact O-CG 3.28Å; L683-Q687 WeakPolarHBondContact O-CG 3.29Å; L683-Q687 PolarHBondContact O-N 2.79Å
684	D	83.8	Confident	79.9	Confident	84 Å²	84	52.3 Å²	52.3	45%	0.449	30%	0.295	S	S	.	.	H	α-helix	trans	-62.3	-41.7	177.7	-66.4	-14.2	0	0	0	110.8	R626 G680 Q681 T688	R626-D684 IonicContact NH2-OD1 2.82Å; G680-D684 VanDerWaalsContact O-CG 3.3Å; G680-D684 PolarHBondContact O-N 3.14Å; Q681-D684 PolarHBondContact O-N 2.82Å; D684-T688 WeakPolarHBondContact O-CG2 3.36Å; D684-T688 PolarHBondContact O-N 3.38Å; D684-T688 PolarHBondContact O-OG1 2.83Å
685	Q	85.3	Confident	78.3	Confident	91 Å²	91	54.1 Å²	54.1	43%	0.425	32%	0.315	S	S	.	.	H	α-helix	trans	-61	-48	173.9	-72.4	175.5	10.4	0	0	111.9	Q681 A682 L683 T688 A689	Q681-Q685 WeakPolarHBondContact O-CG 3.46Å; Q681-Q685 PolarHBondContact O-N 3.17Å; Q681-Q685 VanDerWaalsContact O-N 3.11Å; A682-Q685 PolarHBondContact O-N 3.33Å; L683-Q685 VanDerWaalsContact C-N 3.31Å; L683-Q685 PolarHBondContact O-N 3.36Å; Q685-T688 PolarHBondContact O-N 3.07Å; Q685-T688 PolarHBondContact O-OG1 3.35Å; Q685-A689 PolarHBondContact O-N 2.72Å
686	L	82.7	Confident	76.6	Confident	20 Å²	20	52.4 Å²	52.4	11%	0.105	31%	0.309	C	S	.	.	H	α-helix	trans	-68.4	-38.8	179.6	-79.8	172.6	0	0	0	112.9	F630 A637 L638 H641 A682 L683 T688 A689 H690	F630-L686 HydrophobicContact CE2-CB 4.39Å; F630-L686 HydrophobicContact CZ-CB 4.3Å; A637-L686 HydrophobicContact CB-CD1 4.41Å; A637-L686 HydrophobicContact CB-CD2 4.24Å; L638-L686 HydrophobicContact CB-CD1 3.69Å; L638-L686 HydrophobicContact CD1-CD1 3.88Å; L638-L686 HydrophobicContact CG-CD1 4.42Å; H641-L686 HydrophobicContact CB-CD1 4.41Å; A682-L686 WeakPolarHBondContact O-CB 3.4Å; A682-L686 PolarHBondContact O-N 3.31Å; L683-L686 PolarHBondContact O-N 3.42Å; L686-T688 VanDerWaalsContact C-N 3.31Å; L686-T688 PolarHBondContact O-N 2.75Å; L686-A689 PolarHBondContact O-N 3.27Å; L686-H690 WeakPolarHBondContact O-CB 3.45Å; L686-H690 PolarHBondContact O-N 3.5Å
687	Q	77	Confident	75	Confident	46 Å²	46	51.3 Å²	51.3	22%	0.215	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-38.9	174.7	-75.2	-179	-14.5	0	0	111	R626 F630 L683 S691	R626-Q687 PolarHBondContact O-NE2 2.68Å; F630-Q687 HydrophobicContact CE1-CG 4.22Å; F630-Q687 HydrophobicContact CZ-CG 3.87Å; L683-Q687 HydrophobicContact CD1-CG 4.3Å; L683-Q687 HydrophobicContact CG-CG 4.19Å; L683-Q687 VanDerWaalsContact O-CB 3.32Å; L683-Q687 WeakPolarHBondContact O-CB 3.35Å; L683-Q687 VanDerWaalsContact O-CG 3.28Å; L683-Q687 WeakPolarHBondContact O-CG 3.29Å; L683-Q687 PolarHBondContact O-N 2.79Å; Q687-S691 VanDerWaalsContact O-CB 3.23Å; Q687-S691 WeakPolarHBondContact O-CB 3.31Å; Q687-S691 PolarHBondContact O-N 3.49Å; Q687-S691 PolarHBondContact O-OG 3.49Å
688	T	74.9	Confident	73.5	Confident	66 Å²	66	51.7 Å²	51.7	41%	0.405	30%	0.298	S	S	.	.	H	α-helix	trans	-65.1	-43	173.5	56	0	0	0	0	112.5	D684 Q685 L686 Q692	D684-T688 WeakPolarHBondContact O-CG2 3.36Å; D684-T688 PolarHBondContact O-N 3.38Å; D684-T688 PolarHBondContact O-OG1 2.83Å; Q685-T688 PolarHBondContact O-N 3.07Å; Q685-T688 PolarHBondContact O-OG1 3.35Å; L686-T688 VanDerWaalsContact C-N 3.31Å; L686-T688 PolarHBondContact O-N 2.75Å; T688-Q692 WeakPolarHBondContact O-CB 3.46Å; T688-Q692 VanDerWaalsContact O-CG 3.27Å; T688-Q692 WeakPolarHBondContact O-CG 3.29Å; T688-Q692 PolarHBondContact O-N 2.78Å
689	A	73.4	Confident	72.3	Confident	47 Å²	47	54.9 Å²	54.9	39%	0.388	31%	0.314	S	S	.	.	H	α-helix	trans	-66	-42.9	177.2	0	0	0	0	0	112.2	Q685 L686 Q692 A693	Q685-A689 PolarHBondContact O-N 2.72Å; L686-A689 PolarHBondContact O-N 3.27Å; A689-Q692 PolarHBondContact O-N 2.93Å; A689-A693 WeakPolarHBondContact O-CB 3.46Å; A689-A693 PolarHBondContact O-N 3.14Å
690	H	67.8	Low	71.2	Confident	51 Å²	51	55.4 Å²	55.4	24%	0.236	32%	0.318	C	S	.	.	H	α-helix	trans	-65.6	-42.7	177.4	-171.7	87.4	0	0	0	111.4	D634 L686 Q692 A693 V694	D634-H690 IonicContact OD2-ND1 3.27Å; L686-H690 WeakPolarHBondContact O-CB 3.45Å; L686-H690 PolarHBondContact O-N 3.5Å; H690-Q692 VanDerWaalsContact C-N 3.31Å; H690-Q692 PolarHBondContact O-N 2.85Å; H690-A693 PolarHBondContact O-N 3.34Å; H690-V694 WeakPolarHBondContact O-CB 3.33Å; H690-V694 PolarHBondContact O-N 3.25Å
691	S	66.2	Low	70.4	Confident	23 Å²	23	60.2 Å²	60.2	16%	0.161	35%	0.349	C	S	.	.	H	α-helix	trans	-59.7	-40.9	173.6	-58.2	0	0	0	0	111.6	Q687 G695 A696	Q687-S691 VanDerWaalsContact O-CB 3.23Å; Q687-S691 WeakPolarHBondContact O-CB 3.31Å; Q687-S691 PolarHBondContact O-N 3.49Å; Q687-S691 PolarHBondContact O-OG 3.49Å; S691-G695 CarbonylContact O-C 3.18Å; S691-G695 WeakPolarHBondContact O-CA 3.4Å; S691-G695 PolarHBondContact O-N 2.94Å; S691-G695 VanDerWaalsContact O-N 3.08Å; S691-A696 WeakPolarHBondContact CB-O 3.49Å; S691-A696 PolarHBondContact O-N 3.39Å
692	Q	65.2	Low	70.1	Confident	161 Å²	161	56.4 Å²	56.4	75%	0.752	33%	0.333	S	S	*	.	H	α-helix	trans	-69.8	-41.6	177.3	-73.7	173.2	-0.9	0	0	112.7	T688 A689 H690	T688-Q692 WeakPolarHBondContact O-CB 3.46Å; T688-Q692 VanDerWaalsContact O-CG 3.27Å; T688-Q692 WeakPolarHBondContact O-CG 3.29Å; T688-Q692 PolarHBondContact O-N 2.78Å; A689-Q692 PolarHBondContact O-N 2.93Å; H690-Q692 VanDerWaalsContact C-N 3.31Å; H690-Q692 PolarHBondContact O-N 2.85Å
693	A	57.6	Low	69.8	Low	89 Å²	89	58 Å²	58	74%	0.736	34%	0.344	S	S	*	.	H	α-helix	trans	-74.3	-40.4	-175.9	0	0	0	0	0	113.3	A689 H690	A689-A693 WeakPolarHBondContact O-CB 3.46Å; A689-A693 PolarHBondContact O-N 3.14Å; H690-A693 PolarHBondContact O-N 3.34Å
694	V	55.1	Low	69.7	Low	69 Å²	69	59.5 Å²	59.5	42%	0.418	35%	0.35	S	S	.	.	H	α-helix	trans	-88.8	-9.2	179.9	-177.7	0	0	0	0	111.1	H690 A696	H690-V694 WeakPolarHBondContact O-CB 3.33Å; H690-V694 PolarHBondContact O-N 3.25Å; V694-A696 HydrophobicContact CB-CB 3.61Å; V694-A696 HydrophobicContact CG1-CB 3.7Å; V694-A696 PolarHBondContact O-N 2.9Å
695	G	52.8	Low	69.7	Low	42 Å²	42	61.5 Å²	61.5	43%	0.433	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	28.6	-163.2	0	0	0	0	0	111.1	S691	S691-G695 CarbonylContact O-C 3.18Å; S691-G695 WeakPolarHBondContact O-CA 3.4Å; S691-G695 PolarHBondContact O-N 2.94Å; S691-G695 VanDerWaalsContact O-N 3.08Å
696	A	52.3	Low	69.7	Low	19 Å²	19	60 Å²	60	16%	0.157	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-82.4	154.7	-167.8	0	0	0	0	0	113	S691 V694 K698	S691-A696 WeakPolarHBondContact CB-O 3.49Å; S691-A696 PolarHBondContact O-N 3.39Å; V694-A696 HydrophobicContact CB-CB 3.61Å; V694-A696 HydrophobicContact CG1-CB 3.7Å; V694-A696 PolarHBondContact O-N 2.9Å; A696-K698 PolarHBondContact O-N 3.45Å
697	P	55.4	Low	69.8	Low	17 Å²	17	59.8 Å²	59.8	11%	0.11	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-59	124.4	-174.3	21.5	-34.2	0	0	0	114.3	F765 L766 A795	P697-F765 CarbonylContact C-O 3.5Å; P697-F765 WeakPolarHBondContact CA-O 3.2Å; P697-F765 WeakPolarHBondContact CB-O 3.35Å; P697-L766 HydrophobicContact CB-CB 3.9Å; P697-L766 HydrophobicContact CB-CD1 4.3Å; P697-L766 HydrophobicContact CG-CB 4.44Å; P697-A795 HydrophobicContact CG-CB 4.14Å
698	K	57.7	Low	70.1	Confident	136 Å²	136	58.3 Å²	58.3	59%	0.591	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-87.2	131.6	175.5	-175.4	176.1	-178	177	0	109.9	A696 P700 F765	A696-K698 PolarHBondContact O-N 3.45Å; K698-P700 WeakPolarHBondContact O-CD 3.41Å; K698-P700 VanDerWaalsContact O-N 3.15Å; K698-F765 PolarHBondContact N-O 2.88Å
699	I	65.3	Low	70.5	Confident	68 Å²	68	55.2 Å²	55.2	35%	0.349	33%	0.329	S	S	.	.			trans	-63.4	115.9	165.5	-55.9	172.2	0	0	0	107.4
700	P	67.6	Low	71	Confident	14 Å²	14	54.7 Å²	54.7	9%	0.091	32%	0.319	C	S	.	.			trans	-65.1	146.9	179.3	24.1	-29.4	0	0	0	109.7	K698 V702 K755 A758 T759 F765	K698-P700 WeakPolarHBondContact O-CD 3.41Å; K698-P700 VanDerWaalsContact O-N 3.15Å; P700-V702 HydrophobicContact CB-CG2 4.48Å; P700-V702 PolarHBondContact O-N 3.31Å; P700-K755 HydrophobicContact CB-CB 3.71Å; P700-K755 HydrophobicContact CB-CD 4.17Å; P700-K755 HydrophobicContact CB-CG 3.8Å; P700-K755 HydrophobicContact CG-CB 3.69Å; P700-K755 HydrophobicContact CG-CG 3.94Å; P700-K755 WeakPolarHBondContact CG-O 3.15Å; P700-A758 HydrophobicContact CG-CB 4.27Å; P700-T759 WeakPolarHBondContact CG-OG1 3.48Å; P700-T759 PolarHBondContact O-OG1 2.8Å; P700-F765 HydrophobicContact CG-CB 4.32Å; P700-F765 HydrophobicContact CG-CD1 4.32Å; P700-F765 HydrophobicContact CG-CG 4.26Å
701	S	71.4	Confident	71.7	Confident	115 Å²	115	56.7 Å²	56.7	80%	0.804	33%	0.329	S	S	*	.			trans	-86.3	27.8	178.3	65.6	0	0	0	0	112.5
702	V	82.7	Confident	72.7	Confident	26 Å²	26	62.4 Å²	62.4	16%	0.158	36%	0.357	C	S	.	.			trans	-104.4	124.2	-173.9	-175.7	0	0	0	0	108.2	P700 D706 K755 A756 T759	P700-V702 HydrophobicContact CB-CG2 4.48Å; P700-V702 PolarHBondContact O-N 3.31Å; V702-D706 HydrophobicContact CG1-CB 3.94Å; V702-K755 HydrophobicContact CB-CB 4.28Å; V702-K755 HydrophobicContact CG2-CB 4.28Å; V702-A756 HydrophobicContact CG1-CB 4.25Å; V702-A756 WeakPolarHBondContact O-CA 3.12Å; V702-T759 WeakPolarHBondContact O-CB 3.4Å; V702-T759 PolarHBondContact O-OG1 2.85Å
703	S	84.6	Confident	73.7	Confident	34 Å²	34	55.5 Å²	55.5	24%	0.238	33%	0.326	C	S	.	.			trans	-97.9	165.6	-179.8	66.4	0	0	0	0	112	H705 D706	S703-H705 PolarHBondContact O-N 3.46Å; S703-H705 VanDerWaalsContact O-N 3.08Å; S703-H705 PolarHBondContact OG-N 3.34Å; S703-D706 PolarHBondContact N-OD2 3.06Å; S703-D706 WeakPolarHBondContact O-CB 3.25Å; S703-D706 PolarHBondContact O-N 3.35Å; S703-D706 PolarHBondContact OG-OD2 3.43Å
704	W	84.6	Confident	75.1	Confident	32 Å²	32	52.1 Å²	52.1	12%	0.121	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-57.3	-25.5	172.3	-86.2	136.8	0	0	0	113.8	D706 V707 K714 L718 L753 A756 V757 E760	W704-D706 VanDerWaalsContact C-N 3.27Å; W704-D706 PolarHBondContact O-N 3.02Å; W704-V707 PolarHBondContact O-N 3.3Å; W704-K714 HydrophobicContact CD2-CD 4.46Å; W704-K714 HydrophobicContact CE3-CD 3.63Å; W704-K714 HydrophobicContact CE3-CG 4.07Å; W704-K714 HydrophobicContact CH2-CB 4.09Å; W704-K714 HydrophobicContact CH2-CD 4.33Å; W704-K714 HydrophobicContact CH2-CG 3.9Å; W704-K714 HydrophobicContact CZ3-CB 4.1Å; W704-K714 HydrophobicContact CZ3-CD 3.54Å; W704-K714 HydrophobicContact CZ3-CG 3.43Å; W704-K714 VanDerWaalsContact CZ3-CG 3.43Å; W704-K714 PolarHBondContact O-NZ 3.03Å; W704-K714 VanDerWaalsContact O-NZ 3.14Å; W704-L718 HydrophobicContact CZ2-CD1 3.99Å; W704-L718 HydrophobicContact CZ2-CD2 3.8Å; W704-L718 HydrophobicContact CZ2-CG 3.76Å; W704-L753 HydrophobicContact CH2-CD1 3.89Å; W704-L753 HydrophobicContact CZ3-CD1 3.55Å; W704-A756 HydrophobicContact CD2-CB 4.39Å; W704-A756 HydrophobicContact CE3-CB 4.02Å; W704-A756 HydrophobicContact CZ3-CB 4.26Å; W704-V757 HydrophobicContact CH2-CG2 3.37Å; W704-V757 HydrophobicContact CZ2-CB 4.39Å; W704-V757 HydrophobicContact CZ2-CG2 3.56Å; W704-V757 HydrophobicContact CZ3-CG2 4.4Å; W704-E760 HydrophobicContact CB-CG 4.4Å; W704-E760 VanDerWaalsContact CB-OE1 3.31Å; W704-E760 WeakPolarHBondContact CB-OE1 3.41Å; W704-E760 VanDerWaalsContact CD1-OE2 3.3Å; W704-E760 HydrophobicContact CD2-CG 4.3Å; W704-E760 HydrophobicContact CG-CG 3.7Å; W704-E760 PolarHBondContact N-OE1 3.39Å; W704-E760 VanDerWaalsContact NE1-CG 3.26Å
705	H	85	Confident	76.6	Confident	126 Å²	126	55.1 Å²	55.1	58%	0.583	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-71.5	-22.5	-179.9	-61.1	84.2	0	0	0	112.8	S703 V707	S703-H705 PolarHBondContact O-N 3.46Å; S703-H705 VanDerWaalsContact O-N 3.08Å; S703-H705 PolarHBondContact OG-N 3.34Å; H705-V707 VanDerWaalsContact C-N 3.35Å
706	D	84.6	Confident	78.2	Confident	58 Å²	58	56 Å²	56	31%	0.31	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-82.9	-15.6	177.1	-60.1	-49.1	0	0	0	112.3	V702 S703 W704	V702-D706 HydrophobicContact CG1-CB 3.94Å; S703-D706 PolarHBondContact N-OD2 3.06Å; S703-D706 WeakPolarHBondContact O-CB 3.25Å; S703-D706 PolarHBondContact O-N 3.35Å; S703-D706 PolarHBondContact OG-OD2 3.43Å; W704-D706 VanDerWaalsContact C-N 3.27Å; W704-D706 PolarHBondContact O-N 3.02Å
707	V	85.7	Confident	79.8	Confident	17 Å²	17	55.2 Å²	55.2	10%	0.103	29%	0.288	C	S	.	.	S	Bend	trans	-100.2	105.9	176.9	-176.3	0	0	0	0	109	W704 H705 K714 L753 A756	W704-V707 PolarHBondContact O-N 3.3Å; H705-V707 VanDerWaalsContact C-N 3.35Å; V707-K714 PolarHBondContact O-NZ 2.93Å; V707-L753 HydrophobicContact CG1-CD1 4.31Å; V707-A756 HydrophobicContact CG2-CB 3.76Å
708	G	82.6	Confident	81.2	Confident	15 Å²	15	56.3 Å²	56.3	16%	0.155	29%	0.293	C	S	.	.			trans	-82.9	149.6	174	0	0	0	0	0	113	V882	G708-V882 VanDerWaalsContact O-CG2 3.29Å; G708-V882 WeakPolarHBondContact O-CG2 3.46Å
709	G	83.2	Confident	82.4	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.01	29%	0.288	C	S	.	.	S	Bend	trans	76.3	-160.6	175.2	0	0	0	0	0	115.2	Q711 K714	G709-Q711 PolarHBondContact O-N 3.42Å; G709-Q711 PolarHBondContact O-NE2 3.4Å; G709-K714 WeakPolarHBondContact O-CE 3.47Å
710	L	83.1	Confident	83.1	Confident	36 Å²	36	51.9 Å²	51.9	19%	0.188	27%	0.274	C	S	.	.			trans	54.5	39.4	169.5	-64.5	163.5	0	0	0	116.1	D712 V713 K714 V870	L710-D712 VanDerWaalsContact C-N 3.34Å; L710-D712 PolarHBondContact O-N 2.93Å; L710-V713 HydrophobicContact CB-CB 4.28Å; L710-V713 HydrophobicContact CD2-CG2 4.34Å; L710-V713 PolarHBondContact O-N 3.13Å; L710-K714 WeakPolarHBondContact O-CG 3.36Å; L710-K714 PolarHBondContact O-N 2.64Å; L710-V870 HydrophobicContact CD1-CG1 3.83Å; L710-V870 HydrophobicContact CD2-CG1 4.34Å
711	Q	84.1	Confident	83.7	Confident	93 Å²	93	51.4 Å²	51.4	44%	0.435	27%	0.27	S	S	.	.	H	α-helix	trans	-60	-40	-171.9	-63.8	-61.6	-36.9	0	0	113.8	G709 K714 K715 R881	G709-Q711 PolarHBondContact O-N 3.42Å; G709-Q711 PolarHBondContact O-NE2 3.4Å; Q711-K714 PolarHBondContact O-N 3.41Å; Q711-K715 WeakPolarHBondContact O-CB 3.35Å; Q711-K715 PolarHBondContact O-N 3.21Å; Q711-R881 VanDerWaalsContact CG-NH1 3.29Å
712	D	85.6	Confident	84.1	Confident	143 Å²	143	49.4 Å²	49.4	77%	0.765	25%	0.248	S	C	*	.	H	α-helix	trans	-65.4	-43.8	-179.2	-53.4	-37.6	0	0	0	111.2	L710 K714 K715 E716	L710-D712 VanDerWaalsContact C-N 3.34Å; L710-D712 PolarHBondContact O-N 2.93Å; D712-K714 PolarHBondContact O-N 2.99Å; D712-K715 PolarHBondContact O-N 3.33Å; D712-E716 PolarHBondContact O-N 2.85Å
713	V	86.9	Confident	83.9	Confident	16 Å²	16	52.2 Å²	52.2	10%	0.097	26%	0.262	C	S	.	.	H	α-helix	trans	-62.2	-43.1	175.4	166.3	0	0	0	0	111.2	L710 K715 E716 I717 L753 V868 V870	L710-V713 HydrophobicContact CB-CB 4.28Å; L710-V713 HydrophobicContact CD2-CG2 4.34Å; L710-V713 PolarHBondContact O-N 3.13Å; V713-K715 VanDerWaalsContact C-N 3.34Å; V713-K715 PolarHBondContact O-N 2.8Å; V713-E716 PolarHBondContact O-N 3.03Å; V713-I717 HydrophobicContact CG1-CD1 3.8Å; V713-I717 VanDerWaalsContact O-CG1 3.27Å; V713-I717 WeakPolarHBondContact O-CG1 3.27Å; V713-I717 PolarHBondContact O-N 2.83Å; V713-I717 VanDerWaalsContact O-N 3.1Å; V713-L753 HydrophobicContact CG1-CD2 3.62Å; V713-V868 HydrophobicContact CB-CG1 4.2Å; V713-V868 HydrophobicContact CG1-CG1 3.67Å; V713-V868 HydrophobicContact CG2-CG1 3.92Å; V713-V870 HydrophobicContact CG1-CG2 4.36Å
714	K	87.4	Confident	83.5	Confident	18 Å²	18	51.3 Å²	51.3	8%	0.078	26%	0.255	C	S	.	.	H	α-helix	trans	-60.4	-45.8	176.7	-68.3	-171.7	177.9	-166.7	0	111.5	W704 V707 G709 L710 Q711 D712 I717 L718 L753	W704-K714 HydrophobicContact CD2-CD 4.46Å; W704-K714 HydrophobicContact CE3-CD 3.63Å; W704-K714 HydrophobicContact CE3-CG 4.07Å; W704-K714 HydrophobicContact CH2-CB 4.09Å; W704-K714 HydrophobicContact CH2-CD 4.33Å; W704-K714 HydrophobicContact CH2-CG 3.9Å; W704-K714 HydrophobicContact CZ3-CB 4.1Å; W704-K714 HydrophobicContact CZ3-CD 3.54Å; W704-K714 HydrophobicContact CZ3-CG 3.43Å; W704-K714 VanDerWaalsContact CZ3-CG 3.43Å; W704-K714 PolarHBondContact O-NZ 3.03Å; W704-K714 VanDerWaalsContact O-NZ 3.14Å; V707-K714 PolarHBondContact O-NZ 2.93Å; G709-K714 WeakPolarHBondContact O-CE 3.47Å; L710-K714 WeakPolarHBondContact O-CG 3.36Å; L710-K714 PolarHBondContact O-N 2.64Å; Q711-K714 PolarHBondContact O-N 3.41Å; D712-K714 PolarHBondContact O-N 2.99Å; K714-I717 PolarHBondContact O-N 2.89Å; K714-L718 WeakPolarHBondContact O-CB 3.41Å; K714-L718 WeakPolarHBondContact O-CG 3.43Å; K714-L718 PolarHBondContact O-N 3.16Å; K714-L753 HydrophobicContact CG-CD1 4.32Å
715	K	87.1	Confident	83	Confident	131 Å²	131	52.9 Å²	52.9	57%	0.57	27%	0.266	S	S	*	.	H	α-helix	trans	-61.9	-45.6	179.6	-175.9	176.8	172.1	-179.3	0	111.3	Q711 D712 V713 I717 L718 E719	Q711-K715 WeakPolarHBondContact O-CB 3.35Å; Q711-K715 PolarHBondContact O-N 3.21Å; D712-K715 PolarHBondContact O-N 3.33Å; V713-K715 VanDerWaalsContact C-N 3.34Å; V713-K715 PolarHBondContact O-N 2.8Å; K715-I717 PolarHBondContact O-N 2.86Å; K715-L718 PolarHBondContact O-N 3.02Å; K715-E719 WeakPolarHBondContact CE-OE1 3.43Å; K715-E719 HydrophobicContact CG-CG 4.49Å; K715-E719 WeakPolarHBondContact CG-OE1 3.05Å; K715-E719 IonicContact NZ-OE1 3.93Å; K715-E719 WeakPolarHBondContact O-CB 3.25Å; K715-E719 WeakPolarHBondContact O-CG 3.31Å; K715-E719 PolarHBondContact O-N 3.03Å
716	E	85.9	Confident	82.5	Confident	61 Å²	61	52.1 Å²	52.1	29%	0.285	26%	0.262	S	S	.	.	H	α-helix	trans	-64.6	-39.7	-179.9	-174.6	169.4	-160.9	0	0	112.8	D712 V713 T720 K866 V868	D712-E716 PolarHBondContact O-N 2.85Å; V713-E716 PolarHBondContact O-N 3.03Å; E716-T720 WeakPolarHBondContact O-CB 3.43Å; E716-T720 PolarHBondContact O-N 3Å; E716-T720 VanDerWaalsContact O-N 3.07Å; E716-T720 PolarHBondContact O-OG1 3.5Å; E716-K866 IonicContact OE1-NZ 2.88Å; E716-K866 PolarHBondContact OE1-NZ 2.91Å; E716-V868 HydrophobicContact CG-CG2 4.48Å
717	I	86.2	Confident	82	Confident	2 Å²	2	54 Å²	54	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-69.1	-43.2	178.1	-63.4	167.9	0	0	0	110.8	V713 K714 K715 T720 I721 L740 L742 L753 V757	V713-I717 HydrophobicContact CG1-CD1 3.8Å; V713-I717 VanDerWaalsContact O-CG1 3.27Å; V713-I717 WeakPolarHBondContact O-CG1 3.27Å; V713-I717 PolarHBondContact O-N 2.83Å; V713-I717 VanDerWaalsContact O-N 3.1Å; K714-I717 PolarHBondContact O-N 2.89Å; K715-I717 PolarHBondContact O-N 2.86Å; I717-T720 PolarHBondContact O-N 3.16Å; I717-I721 HydrophobicContact CG2-CD1 3.72Å; I717-I721 PolarHBondContact O-N 3.14Å; I717-L740 HydrophobicContact CD1-CD2 4.24Å; I717-L740 HydrophobicContact CG1-CD1 4.14Å; I717-L740 HydrophobicContact CG1-CD2 3.92Å; I717-L742 HydrophobicContact CD1-CD2 3.85Å; I717-L753 HydrophobicContact CD1-CD1 4.4Å; I717-L753 HydrophobicContact CD1-CD2 3.54Å; I717-L753 HydrophobicContact CD1-CG 3.93Å; I717-V757 HydrophobicContact CB-CG2 4.45Å; I717-V757 HydrophobicContact CG2-CB 4.34Å; I717-V757 HydrophobicContact CG2-CG1 3.83Å; I717-V757 HydrophobicContact CG2-CG2 3.56Å
718	L	84	Confident	81.2	Confident	41 Å²	41	56.5 Å²	56.5	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-60.9	-49.4	176.2	-76.7	170.3	0	0	0	111.1	W704 K714 K715 T720 I721 Q722	W704-L718 HydrophobicContact CZ2-CD1 3.99Å; W704-L718 HydrophobicContact CZ2-CD2 3.8Å; W704-L718 HydrophobicContact CZ2-CG 3.76Å; K714-L718 WeakPolarHBondContact O-CB 3.41Å; K714-L718 WeakPolarHBondContact O-CG 3.43Å; K714-L718 PolarHBondContact O-N 3.16Å; K715-L718 PolarHBondContact O-N 3.02Å; L718-T720 PolarHBondContact O-N 3.35Å; L718-I721 PolarHBondContact O-N 3.1Å; L718-Q722 WeakPolarHBondContact O-CA 3.29Å; L718-Q722 WeakPolarHBondContact O-CB 3.32Å; L718-Q722 PolarHBondContact O-N 3.33Å
719	E	81.9	Confident	80.7	Confident	102 Å²	102	63.6 Å²	63.6	48%	0.477	32%	0.315	S	S	.	.	H	α-helix	trans	-59.7	-30.3	176.5	-73.9	175.7	-175.2	0	0	112.6	K715 L723	K715-E719 WeakPolarHBondContact CE-OE1 3.43Å; K715-E719 HydrophobicContact CG-CG 4.49Å; K715-E719 WeakPolarHBondContact CG-OE1 3.05Å; K715-E719 IonicContact NZ-OE1 3.93Å; K715-E719 WeakPolarHBondContact O-CB 3.25Å; K715-E719 WeakPolarHBondContact O-CG 3.31Å; K715-E719 PolarHBondContact O-N 3.03Å; E719-L723 WeakPolarHBondContact O-CB 3.22Å
720	T	80.6	Confident	79.8	Confident	9 Å²	9	67.3 Å²	67.3	6%	0.055	33%	0.334	C	S	.	.	H	α-helix	trans	-77.5	-33.1	-179.6	-61.8	0	0	0	0	113	E716 I717 L718 P724 R737 L740	E716-T720 WeakPolarHBondContact O-CB 3.43Å; E716-T720 PolarHBondContact O-N 3Å; E716-T720 VanDerWaalsContact O-N 3.07Å; E716-T720 PolarHBondContact O-OG1 3.5Å; I717-T720 PolarHBondContact O-N 3.16Å; L718-T720 PolarHBondContact O-N 3.35Å; T720-P724 VanDerWaalsContact O-CD 3.23Å; T720-P724 WeakPolarHBondContact O-CD 3.31Å; T720-P724 VanDerWaalsContact O-CG 3.24Å; T720-P724 WeakPolarHBondContact O-CG 3.14Å; T720-R737 HydrophobicContact CG2-CB 4.5Å; T720-R737 PolarHBondContact OG1-NH1 3.21Å; T720-R737 VanDerWaalsContact OG1-NH1 3.09Å; T720-L740 HydrophobicContact CG2-CD1 4.19Å
721	I	80.6	Confident	78.8	Confident	4 Å²	4	66.7 Å²	66.7	2%	0.021	33%	0.331	C	S	.	.	H	α-helix	trans	-101.9	-41.6	-174.7	-64.8	167.9	0	0	0	111.8	I717 L718 P724 L725 V757 L763 I799 I845	I717-I721 HydrophobicContact CG2-CD1 3.72Å; I717-I721 PolarHBondContact O-N 3.14Å; L718-I721 PolarHBondContact O-N 3.1Å; I721-P724 WeakPolarHBondContact O-CD 3.38Å; I721-L725 HydrophobicContact CG2-CD1 4.07Å; I721-L725 WeakPolarHBondContact O-CD1 3.45Å; I721-L725 WeakPolarHBondContact O-CG 3.32Å; I721-V757 HydrophobicContact CD1-CG1 3.45Å; I721-V757 VanDerWaalsContact CD1-CG1 3.45Å; I721-L763 HydrophobicContact CG2-CD1 3.95Å; I721-I799 HydrophobicContact CD1-CD1 4.44Å; I721-I845 HydrophobicContact CD1-CD1 3.96Å
722	Q	80.3	Confident	77.7	Confident	73 Å²	73	66.7 Å²	66.7	34%	0.341	34%	0.341	S	S	.	.	H	α-helix	trans	-72.8	-39.9	-177.3	-170.2	174.6	-2.4	0	0	112.1	L718 L725 E726	L718-Q722 WeakPolarHBondContact O-CA 3.29Å; L718-Q722 WeakPolarHBondContact O-CB 3.32Å; L718-Q722 PolarHBondContact O-N 3.33Å; Q722-L725 PolarHBondContact O-N 3.28Å; Q722-L725 VanDerWaalsContact O-N 3.1Å; Q722-E726 HydrophobicContact CG-CG 4.09Å; Q722-E726 WeakPolarHBondContact CG-OE1 3.43Å; Q722-E726 PolarHBondContact NE2-OE1 3.01Å; Q722-E726 WeakPolarHBondContact O-CG 3.3Å; Q722-E726 PolarHBondContact O-N 2.86Å
723	L	77.4	Confident	76.4	Confident	85 Å²	85	66.2 Å²	66.2	45%	0.445	34%	0.338	S	S	.	.	H	α-helix	trans	-62	-44.7	-177.6	-169.1	84.4	0	0	0	112.8	E719 L725 H727	E719-L723 WeakPolarHBondContact O-CB 3.22Å; L723-L725 VanDerWaalsContact C-N 3.3Å; L723-L725 PolarHBondContact O-N 2.92Å; L723-H727 PolarHBondContact O-N 3.48Å
724	P	75.9	Confident	74.9	Confident	15 Å²	15	68.3 Å²	68.3	10%	0.097	36%	0.363	C	S	.	.	H	α-helix	trans	-56.8	-38.8	170.1	-31.1	39	0	0	0	114.6	T720 I721 H727 L731 F843	T720-P724 VanDerWaalsContact O-CD 3.23Å; T720-P724 WeakPolarHBondContact O-CD 3.31Å; T720-P724 VanDerWaalsContact O-CG 3.24Å; T720-P724 WeakPolarHBondContact O-CG 3.14Å; I721-P724 WeakPolarHBondContact O-CD 3.38Å; P724-H727 CarbonylContact O-C 3.48Å; P724-L731 HydrophobicContact CB-CD1 4Å; P724-L731 HydrophobicContact CB-CD2 3.9Å; P724-L731 HydrophobicContact CB-CG 4.36Å; P724-L731 HydrophobicContact CG-CD2 4.22Å; P724-F843 HydrophobicContact CB-CE1 4Å; P724-F843 HydrophobicContact CB-CZ 3.83Å; P724-F843 HydrophobicContact CG-CE1 4.12Å; P724-F843 HydrophobicContact CG-CZ 4.41Å
725	L	74.3	Confident	73.4	Confident	65 Å²	65	73.2 Å²	73.2	34%	0.34	39%	0.389	S	S	.	.	H	α-helix	trans	-74.9	-37.9	-176.2	-70	168.1	0	0	0	112.3	I721 Q722 L723 C761 L763 F843	I721-L725 HydrophobicContact CG2-CD1 4.07Å; I721-L725 WeakPolarHBondContact O-CD1 3.45Å; I721-L725 WeakPolarHBondContact O-CG 3.32Å; Q722-L725 PolarHBondContact O-N 3.28Å; Q722-L725 VanDerWaalsContact O-N 3.1Å; L723-L725 VanDerWaalsContact C-N 3.3Å; L723-L725 PolarHBondContact O-N 2.92Å; L725-C761 HydrophobicContact CD1-CB 4.4Å; L725-L763 HydrophobicContact CD1-CD1 3.84Å; L725-L763 HydrophobicContact CD1-CD2 4.14Å; L725-L763 HydrophobicContact CD1-CG 4.34Å; L725-L763 HydrophobicContact CD2-CD2 4.41Å; L725-F843 HydrophobicContact CD1-CE2 4.45Å; L725-F843 HydrophobicContact CD2-CE2 3.96Å; L725-F843 HydrophobicContact CD2-CZ 4.37Å; L725-F843 HydrophobicContact CG-CE2 4.16Å; L725-F843 HydrophobicContact CG-CZ 4.29Å
726	E	74.5	Confident	72	Confident	109 Å²	109	72.7 Å²	72.7	51%	0.509	38%	0.383	S	S	.	.	H	α-helix	trans	-77.9	-31.6	179.1	-70.5	-179	169.7	0	0	112.5	Q722	Q722-E726 HydrophobicContact CG-CG 4.09Å; Q722-E726 WeakPolarHBondContact CG-OE1 3.43Å; Q722-E726 PolarHBondContact NE2-OE1 3.01Å; Q722-E726 WeakPolarHBondContact O-CG 3.3Å; Q722-E726 PolarHBondContact O-N 2.86Å
727	H	74.1	Confident	70.7	Confident	97 Å²	97	74.4 Å²	74.4	45%	0.449	39%	0.387	S	S	.	.			trans	-130.1	70.9	-175.9	-62.9	-54.9	0	0	0	112.2	L723 P724 E729 L730	L723-H727 PolarHBondContact O-N 3.48Å; P724-H727 CarbonylContact O-C 3.48Å; H727-E729 PolarHBondContact O-N 2.87Å; H727-E729 VanDerWaalsContact O-N 3.16Å; H727-L730 HydrophobicContact CB-CB 4.38Å; H727-L730 HydrophobicContact CB-CD1 3.67Å; H727-L730 HydrophobicContact CB-CG 3.95Å; H727-L730 PolarHBondContact O-N 3.14Å; H727-L730 VanDerWaalsContact O-N 3.07Å
728	P	70.5	Confident	69.6	Low	71 Å²	71	75 Å²	75	46%	0.461	39%	0.392	S	S	.	.	H	α-helix	trans	-61.5	-25.9	178.9	25	-34.3	0	0	0	112.7	L730 L731	P728-L730 VanDerWaalsContact C-N 3.28Å; P728-L730 PolarHBondContact O-N 3.04Å; P728-L731 WeakPolarHBondContact O-CB 3.35Å; P728-L731 PolarHBondContact O-N 3.39Å
729	E	70.2	Confident	69.5	Low	163 Å²	163	73.5 Å²	73.5	76%	0.762	39%	0.386	S	S	*	.	H	α-helix	trans	-62	-33.2	175.8	-62.6	-177.7	-174	0	0	112.7	H727 L731 S732	H727-E729 PolarHBondContact O-N 2.87Å; H727-E729 VanDerWaalsContact O-N 3.16Å; E729-L731 VanDerWaalsContact C-N 3.26Å; E729-L731 PolarHBondContact O-N 3.34Å; E729-S732 WeakPolarHBondContact O-CB 3.46Å; E729-S732 PolarHBondContact O-N 3.2Å; E729-S732 PolarHBondContact O-OG 2.95Å
730	L	64.4	Low	69.9	Low	80 Å²	80	68.9 Å²	68.9	42%	0.419	37%	0.365	S	S	.	.	H	α-helix	trans	-71.5	-22.1	178.9	-64.8	177.4	0	0	0	112.5	H727 P728 S732 L733	H727-L730 HydrophobicContact CB-CB 4.38Å; H727-L730 HydrophobicContact CB-CD1 3.67Å; H727-L730 HydrophobicContact CB-CG 3.95Å; H727-L730 PolarHBondContact O-N 3.14Å; H727-L730 VanDerWaalsContact O-N 3.07Å; P728-L730 VanDerWaalsContact C-N 3.28Å; P728-L730 PolarHBondContact O-N 3.04Å; L730-S732 PolarHBondContact O-N 3.13Å; L730-L733 HydrophobicContact CD2-CD1 4.1Å; L730-L733 PolarHBondContact O-N 3.34Å
731	L	62.5	Low	70.3	Confident	23 Å²	23	68.4 Å²	68.4	12%	0.12	36%	0.362	C	S	.	.	H	α-helix	trans	-70.4	-22.9	174.7	-60.3	170.2	0	0	0	112.4	P724 P728 E729 L733 G734 L735 R736	P724-L731 HydrophobicContact CB-CD1 4Å; P724-L731 HydrophobicContact CB-CD2 3.9Å; P724-L731 HydrophobicContact CB-CG 4.36Å; P724-L731 HydrophobicContact CG-CD2 4.22Å; P728-L731 WeakPolarHBondContact O-CB 3.35Å; P728-L731 PolarHBondContact O-N 3.39Å; E729-L731 VanDerWaalsContact C-N 3.26Å; E729-L731 PolarHBondContact O-N 3.34Å; L731-L733 PolarHBondContact O-N 2.93Å; L731-G734 PolarHBondContact O-N 2.93Å; L731-L735 VanDerWaalsContact CD2-O 3.3Å; L731-L735 WeakPolarHBondContact CD2-O 3.43Å; L731-R736 PolarHBondContact O-NE 2.81Å
732	S	60.3	Low	70.9	Confident	92 Å²	92	68.3 Å²	68.3	64%	0.643	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-20.3	176.2	74.1	0	0	0	0	112.9	E729 L730 G734	E729-S732 WeakPolarHBondContact O-CB 3.46Å; E729-S732 PolarHBondContact O-N 3.2Å; E729-S732 PolarHBondContact O-OG 2.95Å; L730-S732 PolarHBondContact O-N 3.13Å; S732-G734 PolarHBondContact O-N 2.87Å
733	L	59	Low	71.4	Confident	134 Å²	134	65.1 Å²	65.1	70%	0.702	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	6.8	176.1	-65.2	167.7	0	0	0	113.7	L730 L731	L730-L733 HydrophobicContact CD2-CD1 4.1Å; L730-L733 PolarHBondContact O-N 3.34Å; L731-L733 PolarHBondContact O-N 2.93Å
734	G	56.2	Low	72	Confident	60 Å²	60	61 Å²	61	62%	0.619	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.2	3	174.9	0	0	0	0	0	115.4	L731 S732 R736	L731-G734 PolarHBondContact O-N 2.93Å; S732-G734 PolarHBondContact O-N 2.87Å; G734-R736 PolarHBondContact O-N 3.02Å
735	L	55.5	Low	72.7	Confident	121 Å²	121	60.3 Å²	60.3	63%	0.634	32%	0.321	S	S	*	.			trans	-80.4	64.5	170.9	-76.3	162	0	0	0	110.6	L731	L731-L735 VanDerWaalsContact CD2-O 3.3Å; L731-L735 WeakPolarHBondContact CD2-O 3.43Å
736	R	58.2	Low	73.3	Confident	119 Å²	119	60.5 Å²	60.5	45%	0.449	33%	0.325	S	S	.	.			trans	-97.5	115.8	176.7	-61.3	-172.9	-174.4	-180	4.3	108.9	L731 G734 H837	L731-R736 PolarHBondContact O-NE 2.81Å; G734-R736 PolarHBondContact O-N 3.02Å; R736-H837 PolarHBondContact NH1-O 3.29Å
737	R	59.2	Low	73.8	Confident	97 Å²	97	56.7 Å²	56.7	37%	0.366	32%	0.316	S	S	.	.			trans	-102.1	114	177	-64.8	-175.2	-178.4	173.8	7	108.3	T720 D865	T720-R737 HydrophobicContact CG2-CB 4.5Å; T720-R737 PolarHBondContact OG1-NH1 3.21Å; T720-R737 VanDerWaalsContact OG1-NH1 3.09Å; R737-D865 WeakPolarHBondContact CA-OD2 3.43Å
738	S	62.9	Low	74.4	Confident	16 Å²	16	52.8 Å²	52.8	11%	0.112	30%	0.299	C	S	.	.			trans	-90.1	-23.4	-168.2	-53.3	0	0	0	0	113.5	H837 G862 R863 D865	S738-H837 PolarHBondContact OG-CD2 3.3Å; S738-H837 VanDerWaalsContact OG-CD2 3.28Å; S738-H837 PolarHBondContact OG-NE2 3.36Å; S738-G862 WeakPolarHBondContact CB-O 3.42Å; S738-G862 PolarHBondContact OG-O 3.45Å; S738-R863 CarbonylContact C-O 3.59Å; S738-D865 PolarHBondContact N-OD2 3.41Å
739	G	81.2	Confident	75.1	Confident	9 Å²	9	50.6 Å²	50.6	9%	0.093	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	152.9	-177	0	0	0	0	0	116.3	V844 R863 D865 K866	G739-V844 CarbonylContact C-O 3.59Å; G739-V844 WeakPolarHBondContact CA-O 3.49Å; G739-R863 VanDerWaalsContact CA-O 3.31Å; G739-R863 WeakPolarHBondContact CA-O 3.37Å; G739-R863 PolarHBondContact N-O 3.15Å; G739-D865 PolarHBondContact O-N 2.91Å; G739-D865 VanDerWaalsContact O-N 3.12Å; G739-K866 PolarHBondContact O-N 3.12Å
740	L	89.2	Confident	76.1	Confident	4 Å²	4	43.4 Å²	43.4	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.1	-179.6	-171.2	117.9	0	0	0	110.3	I717 T720 L742 V844 I845 G846 K866 V868	I717-L740 HydrophobicContact CD1-CD2 4.24Å; I717-L740 HydrophobicContact CG1-CD1 4.14Å; I717-L740 HydrophobicContact CG1-CD2 3.92Å; T720-L740 HydrophobicContact CG2-CD1 4.19Å; L740-L742 HydrophobicContact CD2-CD2 3.45Å; L740-L742 VanDerWaalsContact CD2-CD2 3.45Å; L740-L742 HydrophobicContact CD2-CG 3.89Å; L740-V844 PolarHBondContact N-O 2.97Å; L740-I845 HydrophobicContact CB-CG1 4.48Å; L740-I845 HydrophobicContact CD2-CG2 4.19Å; L740-I845 CarbonylContact O-C 3.55Å; L740-I845 VanDerWaalsContact O-CA 3.27Å; L740-I845 WeakPolarHBondContact O-CA 3.12Å; L740-G846 PolarHBondContact O-N 2.86Å; L740-K866 CarbonylContact C-O 3.59Å; L740-K866 WeakPolarHBondContact CA-O 3.49Å; L740-K866 HydrophobicContact CD1-CB 4.1Å; L740-V868 HydrophobicContact CD1-CG2 3.79Å; L740-V868 HydrophobicContact CD2-CG2 4.4Å; L740-V868 HydrophobicContact CG-CG2 4.11Å
741	L	90.9	Very high	77.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	111.4	177.2	-175.4	63.9	0	0	0	110.7	L805 G846 T848 L854 L859 F864 K866 L867 V868	L741-L805 HydrophobicContact CD1-CD2 3.83Å; L741-G846 CarbonylContact C-O 3.56Å; L741-G846 WeakPolarHBondContact CA-O 3.43Å; L741-T848 HydrophobicContact CD1-CG2 4.11Å; L741-T848 HydrophobicContact CG-CG2 4.45Å; L741-L854 HydrophobicContact CD2-CD2 4.27Å; L741-L859 HydrophobicContact CD2-CD2 3.51Å; L741-F864 HydrophobicContact CB-CB 4.06Å; L741-F864 HydrophobicContact CB-CD1 4.01Å; L741-F864 HydrophobicContact CB-CG 4.1Å; L741-K866 PolarHBondContact N-O 3.08Å; L741-L867 HydrophobicContact CD2-CD2 3.89Å; L741-V868 PolarHBondContact O-N 3.22Å
742	L	92.2	Very high	78.5	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	117.9	171.9	-58.7	179.7	0	0	0	109.7	I717 L740 K750 L753 A754 I845 G846 A847 T848 V868 V870	I717-L742 HydrophobicContact CD1-CD2 3.85Å; L740-L742 HydrophobicContact CD2-CD2 3.45Å; L740-L742 VanDerWaalsContact CD2-CD2 3.45Å; L740-L742 HydrophobicContact CD2-CG 3.89Å; L742-K750 HydrophobicContact CB-CB 4.5Å; L742-K750 HydrophobicContact CB-CD 4.34Å; L742-K750 HydrophobicContact CB-CG 4.42Å; L742-K750 HydrophobicContact CD1-CB 4.47Å; L742-L753 HydrophobicContact CD1-CD2 4.36Å; L742-L753 HydrophobicContact CD2-CD2 4.27Å; L742-A754 HydrophobicContact CD1-CB 4.42Å; L742-I845 HydrophobicContact CD1-CG2 3.9Å; L742-I845 HydrophobicContact CG-CG2 4.05Å; L742-G846 PolarHBondContact N-O 3.03Å; L742-A847 HydrophobicContact CB-CB 4.44Å; L742-A847 WeakPolarHBondContact O-CA 3.42Å; L742-T848 PolarHBondContact O-N 3.49Å; L742-V868 HydrophobicContact CD2-CB 4.04Å; L742-V868 HydrophobicContact CD2-CG1 4.3Å; L742-V870 HydrophobicContact CB-CG2 4.41Å; L742-V870 HydrophobicContact CD2-CG2 4.1Å
743	H	91.2	Very high	79.9	Confident	6 Å²	6	40.4 Å²	40.4	3%	0.028	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	146.3	176.2	74	97	0	0	0	112.2	T848 P851 V868 F869 V870	H743-T848 WeakPolarHBondContact CA-O 2.96Å; H743-T848 HydrophobicContact CB-CG2 3.88Å; H743-P851 HydrophobicContact CB-CB 4.21Å; H743-P851 HydrophobicContact CB-CG 4.16Å; H743-V868 PolarHBondContact CD2-O 2.94Å; H743-V868 PolarHBondContact N-O 3.25Å; H743-F869 AromaticContact CE1-CD2 3.52Å; H743-F869 AromaticContact ND1-CD2 3.73Å; H743-F869 CarbonylContact O-C 3.58Å; H743-F869 WeakPolarHBondContact O-CA 3.46Å; H743-V870 PolarHBondContact O-N 3.23Å
744	G	90.4	Very high	81.3	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.201	C	C	.	.			trans	163.1	177.3	179.2	0	0	0	0	0	112.8	K750 T848	G744-K750 PolarHBondContact O-NZ 3.13Å; G744-T848 PolarHBondContact N-O 2.63Å
745	P	89.1	Confident	82.8	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	-59.2	154.5	179.7	20.5	-27.5	0	0	0	112.3	T748 K750 V962 L967 Y970	P745-T748 HydrophobicContact CG-CG2 3.74Å; P745-T748 PolarHBondContact O-OG1 3.25Å; P745-T748 VanDerWaalsContact O-OG1 3.09Å; P745-K750 PolarHBondContact O-NZ 3.34Å; P745-V962 HydrophobicContact CB-CG1 4.42Å; P745-V962 HydrophobicContact CB-CG2 4.22Å; P745-L967 HydrophobicContact CG-CD2 4.45Å; P745-Y970 HydrophobicContact CB-CD2 4.01Å; P745-Y970 HydrophobicContact CB-CE2 3.7Å; P745-Y970 HydrophobicContact CG-CD2 4.34Å; P745-Y970 HydrophobicContact CG-CE2 4.5Å
746	P	87.9	Confident	84.3	Confident	68 Å²	68	28.5 Å²	28.5	44%	0.442	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	151.6	174.7	27.9	-34.5	0	0	0	110.6	T748	P746-T748 PolarHBondContact O-N 3.26Å
747	G	85.4	Confident	85.7	Confident	30 Å²	30	22.9 Å²	22.9	31%	0.309	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	80	6.3	176.4	0	0	0	0	0	116.5	G749 G911 A912	G747-G749 VanDerWaalsContact C-N 3.34Å; G747-G911 PolarHBondContact O-N 3.29Å; G747-A912 PolarHBondContact O-N 3.14Å
748	T	86.4	Confident	86.9	Confident	14 Å²	14	18.2 Å²	18.2	9%	0.086	12%	0.116	C	C	.	.	S	Bend	trans	-86.4	1.8	175.4	57.6	0	0	0	0	114.9	P745 P746 V870	P745-T748 HydrophobicContact CG-CG2 3.74Å; P745-T748 PolarHBondContact O-OG1 3.25Å; P745-T748 VanDerWaalsContact O-OG1 3.09Å; P746-T748 PolarHBondContact O-N 3.26Å; T748-V870 PolarHBondContact OG1-O 3.13Å
749	G	85.9	Confident	87.8	Confident	26 Å²	26	19.2 Å²	19.2	27%	0.268	12%	0.121	S	C	.	.			trans	83.3	25.8	174	0	0	0	0	0	115.5	G747 T751 L752 L753	G747-G749 VanDerWaalsContact C-N 3.34Å; G749-T751 VanDerWaalsContact C-N 3.33Å; G749-T751 PolarHBondContact O-N 3.06Å; G749-L752 WeakPolarHBondContact O-CB 3.45Å; G749-L752 PolarHBondContact O-N 3.33Å; G749-L753 WeakPolarHBondContact O-CB 3.47Å; G749-L753 PolarHBondContact O-N 2.85Å
750	K	90.3	Very high	87.9	Confident	11 Å²	11	22.9 Å²	22.9	5%	0.048	14%	0.136	C	C	.	.	H	α-helix	trans	-50.8	-48.4	175.8	-64.5	-177.3	-73.5	-83.3	0	113	L742 G744 P745 L752 L753 A754 A847 N849 V870	L742-K750 HydrophobicContact CB-CB 4.5Å; L742-K750 HydrophobicContact CB-CD 4.34Å; L742-K750 HydrophobicContact CB-CG 4.42Å; L742-K750 HydrophobicContact CD1-CB 4.47Å; G744-K750 PolarHBondContact O-NZ 3.13Å; P745-K750 PolarHBondContact O-NZ 3.34Å; K750-L752 VanDerWaalsContact C-N 3.35Å; K750-L752 PolarHBondContact O-N 3.08Å; K750-L753 WeakPolarHBondContact O-CB 3.33Å; K750-L753 PolarHBondContact O-N 3.15Å; K750-A754 PolarHBondContact O-N 2.92Å; K750-A754 VanDerWaalsContact O-N 3.11Å; K750-A847 HydrophobicContact CB-CB 4.3Å; K750-N849 WeakPolarHBondContact CE-OD1 3.4Å; K750-N849 PolarHBondContact NZ-OD1 3.21Å; K750-V870 HydrophobicContact CG-CB 4.07Å; K750-V870 HydrophobicContact CG-CG1 4.31Å; K750-V870 HydrophobicContact CG-CG2 4.21Å
751	T	88.8	Confident	87.3	Confident	41 Å²	41	24 Å²	24	25%	0.252	14%	0.143	S	C	.	.	H	α-helix	trans	-65.6	-34.6	176.5	-42.6	0	0	0	0	112.6	G749 K755 F801 D803	G749-T751 VanDerWaalsContact C-N 3.33Å; G749-T751 PolarHBondContact O-N 3.06Å; T751-K755 VanDerWaalsContact O-CG 3.28Å; T751-K755 WeakPolarHBondContact O-CG 3.33Å; T751-K755 PolarHBondContact O-N 2.89Å; T751-F801 HydrophobicContact CG2-CE1 3.81Å; T751-F801 HydrophobicContact CG2-CZ 4.29Å; T751-D803 PolarHBondContact OG1-OD2 3.05Å
752	L	88.4	Confident	86.6	Confident	90 Å²	90	28.6 Å²	28.6	47%	0.471	18%	0.176	S	C	.	.	H	α-helix	trans	-71.4	-37.1	176.6	-69.4	174.9	0	0	0	111.7	G749 K750 K755 A756	G749-L752 WeakPolarHBondContact O-CB 3.45Å; G749-L752 PolarHBondContact O-N 3.33Å; K750-L752 VanDerWaalsContact C-N 3.35Å; K750-L752 PolarHBondContact O-N 3.08Å; L752-K755 PolarHBondContact O-N 2.79Å; L752-A756 PolarHBondContact O-N 3.19Å
753	L	89.4	Confident	85.9	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-63.6	-49.8	177.9	-178.3	65.1	0	0	0	111.2	W704 V707 V713 K714 I717 L742 G749 K750 K755 A756 V757 V870	W704-L753 HydrophobicContact CH2-CD1 3.89Å; W704-L753 HydrophobicContact CZ3-CD1 3.55Å; V707-L753 HydrophobicContact CG1-CD1 4.31Å; V713-L753 HydrophobicContact CG1-CD2 3.62Å; K714-L753 HydrophobicContact CG-CD1 4.32Å; I717-L753 HydrophobicContact CD1-CD1 4.4Å; I717-L753 HydrophobicContact CD1-CD2 3.54Å; I717-L753 HydrophobicContact CD1-CG 3.93Å; L742-L753 HydrophobicContact CD1-CD2 4.36Å; L742-L753 HydrophobicContact CD2-CD2 4.27Å; G749-L753 WeakPolarHBondContact O-CB 3.47Å; G749-L753 PolarHBondContact O-N 2.85Å; K750-L753 WeakPolarHBondContact O-CB 3.33Å; K750-L753 PolarHBondContact O-N 3.15Å; L753-K755 VanDerWaalsContact C-N 3.26Å; L753-K755 PolarHBondContact O-N 3.19Å; L753-A756 PolarHBondContact O-N 2.91Å; L753-V757 WeakPolarHBondContact O-CG2 2.95Å; L753-V757 PolarHBondContact O-N 2.84Å; L753-V870 HydrophobicContact CD2-CG2 4.17Å
754	A	87.9	Confident	85.2	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-37.7	177.2	0	0	0	0	0	112.3	L742 K750 A758 F765 F801 I845	L742-A754 HydrophobicContact CD1-CB 4.42Å; K750-A754 PolarHBondContact O-N 2.92Å; K750-A754 VanDerWaalsContact O-N 3.11Å; A754-A758 PolarHBondContact O-N 2.86Å; A754-F765 HydrophobicContact CB-CE2 4.11Å; A754-F765 HydrophobicContact CB-CZ 4.45Å; A754-F801 HydrophobicContact CB-CD2 3.33Å; A754-F801 HydrophobicContact CB-CE2 3.35Å; A754-F801 HydrophobicContact CB-CG 4.07Å; A754-F801 HydrophobicContact CB-CZ 4.12Å; A754-I845 HydrophobicContact CB-CD1 4.49Å; A754-I845 HydrophobicContact CB-CG2 4.32Å
755	K	87.8	Confident	85	Confident	65 Å²	65	30.3 Å²	30.3	28%	0.283	19%	0.186	S	C	.	.	H	α-helix	trans	-63.7	-48.2	174.6	-76.1	175.4	-178.5	178.9	0	112.1	P700 V702 T751 L752 L753 V757 A758 T759 F765	P700-K755 HydrophobicContact CB-CB 3.71Å; P700-K755 HydrophobicContact CB-CD 4.17Å; P700-K755 HydrophobicContact CB-CG 3.8Å; P700-K755 HydrophobicContact CG-CB 3.69Å; P700-K755 HydrophobicContact CG-CG 3.94Å; P700-K755 WeakPolarHBondContact CG-O 3.15Å; V702-K755 HydrophobicContact CB-CB 4.28Å; V702-K755 HydrophobicContact CG2-CB 4.28Å; T751-K755 VanDerWaalsContact O-CG 3.28Å; T751-K755 WeakPolarHBondContact O-CG 3.33Å; T751-K755 PolarHBondContact O-N 2.89Å; L752-K755 PolarHBondContact O-N 2.79Å; L753-K755 VanDerWaalsContact C-N 3.26Å; L753-K755 PolarHBondContact O-N 3.19Å; K755-V757 VanDerWaalsContact C-N 3.29Å; K755-V757 PolarHBondContact O-N 3.27Å; K755-A758 PolarHBondContact O-N 3.12Å; K755-T759 PolarHBondContact O-N 2.84Å; K755-T759 VanDerWaalsContact O-N 3.17Å; K755-T759 PolarHBondContact O-OG1 3.29Å; K755-F765 HydrophobicContact CG-CD1 4.38Å; K755-F765 HydrophobicContact CG-CE1 3.7Å; K755-F765 HydrophobicContact CG-CE2 4.42Å; K755-F765 HydrophobicContact CG-CZ 3.73Å
756	A	87.8	Confident	84.8	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-40.5	179.3	0	0	0	0	0	112.5	V702 W704 V707 L752 L753 A758 T759 E760	V702-A756 HydrophobicContact CG1-CB 4.25Å; V702-A756 WeakPolarHBondContact O-CA 3.12Å; W704-A756 HydrophobicContact CD2-CB 4.39Å; W704-A756 HydrophobicContact CE3-CB 4.02Å; W704-A756 HydrophobicContact CZ3-CB 4.26Å; V707-A756 HydrophobicContact CG2-CB 3.76Å; L752-A756 PolarHBondContact O-N 3.19Å; L753-A756 PolarHBondContact O-N 2.91Å; A756-A758 VanDerWaalsContact C-N 3.34Å; A756-A758 PolarHBondContact O-N 3.22Å; A756-T759 PolarHBondContact O-N 3.33Å; A756-E760 WeakPolarHBondContact O-CB 3.44Å; A756-E760 WeakPolarHBondContact O-CG 3.33Å; A756-E760 PolarHBondContact O-N 2.99Å; A756-E760 VanDerWaalsContact O-N 3.11Å
757	V	87.1	Confident	84.7	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.6	-44	176.6	170.5	0	0	0	0	111.5	W704 I717 I721 L753 K755 E760 C761 I799	W704-V757 HydrophobicContact CH2-CG2 3.37Å; W704-V757 HydrophobicContact CZ2-CB 4.39Å; W704-V757 HydrophobicContact CZ2-CG2 3.56Å; W704-V757 HydrophobicContact CZ3-CG2 4.4Å; I717-V757 HydrophobicContact CB-CG2 4.45Å; I717-V757 HydrophobicContact CG2-CB 4.34Å; I717-V757 HydrophobicContact CG2-CG1 3.83Å; I717-V757 HydrophobicContact CG2-CG2 3.56Å; I721-V757 HydrophobicContact CD1-CG1 3.45Å; I721-V757 VanDerWaalsContact CD1-CG1 3.45Å; L753-V757 WeakPolarHBondContact O-CG2 2.95Å; L753-V757 PolarHBondContact O-N 2.84Å; K755-V757 VanDerWaalsContact C-N 3.29Å; K755-V757 PolarHBondContact O-N 3.27Å; V757-E760 PolarHBondContact O-N 3.34Å; V757-C761 PolarHBondContact O-N 2.92Å; V757-C761 PolarHBondContact O-SG 3.14Å; V757-I799 HydrophobicContact CG1-CD1 4.3Å
758	A	84.4	Confident	84.8	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.2	-40.3	-179.7	0	0	0	0	0	112.7	P700 A754 K755 A756 E760 S762 L763 F765 I799	P700-A758 HydrophobicContact CG-CB 4.27Å; A754-A758 PolarHBondContact O-N 2.86Å; K755-A758 PolarHBondContact O-N 3.12Å; A756-A758 VanDerWaalsContact C-N 3.34Å; A756-A758 PolarHBondContact O-N 3.22Å; A758-E760 VanDerWaalsContact C-N 3.32Å; A758-E760 PolarHBondContact O-N 3.48Å; A758-S762 PolarHBondContact O-N 3.39Å; A758-S762 VanDerWaalsContact O-N 3.12Å; A758-L763 PolarHBondContact O-N 2.89Å; A758-F765 HydrophobicContact CB-CB 3.77Å; A758-F765 HydrophobicContact CB-CD2 3.61Å; A758-F765 HydrophobicContact CB-CG 4.02Å; A758-I799 HydrophobicContact CB-CD1 3.99Å
759	T	82.9	Confident	84.7	Confident	37 Å²	37	33 Å²	33	23%	0.227	19%	0.188	C	C	.	.	H	α-helix	trans	-62.9	-40.3	176.5	-51.7	0	0	0	0	111.9	P700 V702 K755 A756 S762	P700-T759 WeakPolarHBondContact CG-OG1 3.48Å; P700-T759 PolarHBondContact O-OG1 2.8Å; V702-T759 WeakPolarHBondContact O-CB 3.4Å; V702-T759 PolarHBondContact O-OG1 2.85Å; K755-T759 PolarHBondContact O-N 2.84Å; K755-T759 VanDerWaalsContact O-N 3.17Å; K755-T759 PolarHBondContact O-OG1 3.29Å; A756-T759 PolarHBondContact O-N 3.33Å; T759-S762 PolarHBondContact O-N 3.33Å
760	E	82.8	Confident	84.4	Confident	85 Å²	85	31.9 Å²	31.9	40%	0.397	18%	0.177	S	C	.	.	H	α-helix	trans	-76.6	-36.2	-174.5	-69.2	-90.3	-179.9	0	0	112	W704 A756 V757 A758 S762	W704-E760 HydrophobicContact CB-CG 4.4Å; W704-E760 VanDerWaalsContact CB-OE1 3.31Å; W704-E760 WeakPolarHBondContact CB-OE1 3.41Å; W704-E760 VanDerWaalsContact CD1-OE2 3.3Å; W704-E760 HydrophobicContact CD2-CG 4.3Å; W704-E760 HydrophobicContact CG-CG 3.7Å; W704-E760 PolarHBondContact N-OE1 3.39Å; W704-E760 VanDerWaalsContact NE1-CG 3.26Å; A756-E760 WeakPolarHBondContact O-CB 3.44Å; A756-E760 WeakPolarHBondContact O-CG 3.33Å; A756-E760 PolarHBondContact O-N 2.99Å; A756-E760 VanDerWaalsContact O-N 3.11Å; V757-E760 PolarHBondContact O-N 3.34Å; A758-E760 VanDerWaalsContact C-N 3.32Å; A758-E760 PolarHBondContact O-N 3.48Å; E760-S762 PolarHBondContact O-N 2.98Å
761	C	76.5	Confident	83.9	Confident	27 Å²	27	34.9 Å²	34.9	18%	0.182	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-2.6	171.2	-55.5	0	0	0	0	112.7	L725 V757 L763	L725-C761 HydrophobicContact CD1-CB 4.4Å; V757-C761 PolarHBondContact O-N 2.92Å; V757-C761 PolarHBondContact O-SG 3.14Å; C761-L763 HydrophobicContact CB-CD1 3.57Å; C761-L763 HydrophobicContact CB-CG 3.65Å; C761-L763 PolarHBondContact O-N 3.4Å
762	S	76.1	Confident	83.4	Confident	98 Å²	98	38.2 Å²	38.2	69%	0.685	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	36	-174.2	-59.6	0	0	0	0	113.6	A758 T759 E760	A758-S762 PolarHBondContact O-N 3.39Å; A758-S762 VanDerWaalsContact O-N 3.12Å; T759-S762 PolarHBondContact O-N 3.33Å; E760-S762 PolarHBondContact O-N 2.98Å
763	L	77.9	Confident	82.9	Confident	5 Å²	5	34.3 Å²	34.3	3%	0.026	19%	0.189	C	C	.	.			trans	-96.1	152	-178.4	-63.6	171.9	0	0	0	111.1	I721 L725 A758 C761 P797 I799	I721-L763 HydrophobicContact CG2-CD1 3.95Å; L725-L763 HydrophobicContact CD1-CD1 3.84Å; L725-L763 HydrophobicContact CD1-CD2 4.14Å; L725-L763 HydrophobicContact CD1-CG 4.34Å; L725-L763 HydrophobicContact CD2-CD2 4.41Å; A758-L763 PolarHBondContact O-N 2.89Å; C761-L763 HydrophobicContact CB-CD1 3.57Å; C761-L763 HydrophobicContact CB-CG 3.65Å; C761-L763 PolarHBondContact O-N 3.4Å; L763-P797 HydrophobicContact CD2-CB 3.72Å; L763-P797 HydrophobicContact CD2-CG 3.92Å; L763-I799 HydrophobicContact CB-CD1 4.24Å; L763-I799 HydrophobicContact CB-CG1 4.32Å; L763-I799 HydrophobicContact CD1-CD1 3.61Å; L763-I799 HydrophobicContact CD1-CG1 3.74Å
764	T	77	Confident	82.4	Confident	29 Å²	29	36.7 Å²	36.7	18%	0.178	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	134.5	171.3	60.9	0	0	0	0	109.5	A795 P797 C798 I799	T764-A795 PolarHBondContact OG1-O 3.5Å; T764-A795 VanDerWaalsContact OG1-O 3.07Å; T764-P797 PolarHBondContact OG1-O 2.95Å; T764-C798 CarbonylContact O-C 3.54Å; T764-C798 WeakPolarHBondContact O-CA 3.4Å; T764-C798 VanDerWaalsContact OG1-CA 3.29Å; T764-C798 WeakPolarHBondContact OG1-CA 3.37Å; T764-C798 WeakPolarHBondContact OG1-CB 3.47Å; T764-I799 PolarHBondContact O-N 3.22Å
765	F	84.6	Confident	81.8	Confident	8 Å²	8	39.6 Å²	39.6	4%	0.035	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	109.6	-174.7	-179.8	-100.7	0	0	0	112.3	P697 K698 P700 A754 K755 A758 I799 F801	P697-F765 CarbonylContact C-O 3.5Å; P697-F765 WeakPolarHBondContact CA-O 3.2Å; P697-F765 WeakPolarHBondContact CB-O 3.35Å; K698-F765 PolarHBondContact N-O 2.88Å; P700-F765 HydrophobicContact CG-CB 4.32Å; P700-F765 HydrophobicContact CG-CD1 4.32Å; P700-F765 HydrophobicContact CG-CG 4.26Å; A754-F765 HydrophobicContact CB-CE2 4.11Å; A754-F765 HydrophobicContact CB-CZ 4.45Å; K755-F765 HydrophobicContact CG-CD1 4.38Å; K755-F765 HydrophobicContact CG-CE1 3.7Å; K755-F765 HydrophobicContact CG-CE2 4.42Å; K755-F765 HydrophobicContact CG-CZ 3.73Å; A758-F765 HydrophobicContact CB-CB 3.77Å; A758-F765 HydrophobicContact CB-CD2 3.61Å; A758-F765 HydrophobicContact CB-CG 4.02Å; F765-I799 HydrophobicContact CD2-CG2 4.26Å; F765-F801 HydrophobicContact CD2-CB 4.31Å; F765-F801 HydrophobicContact CE1-CB 4.38Å; F765-F801 HydrophobicContact CE2-CB 3.39Å; F765-F801 HydrophobicContact CE2-CD1 4.44Å; F765-F801 HydrophobicContact CE2-CD2 4.46Å; F765-F801 AromaticContact CE2-CG 3.87Å; F765-F801 HydrophobicContact CE2-CG 3.87Å; F765-F801 HydrophobicContact CZ-CB 3.43Å; F765-F801 VanDerWaalsContact CZ-CB 3.43Å; F765-F801 AromaticContact CZ-CD1 3.73Å; F765-F801 HydrophobicContact CZ-CD1 3.73Å; F765-F801 HydrophobicContact CZ-CD2 4.47Å; F765-F801 AromaticContact CZ-CG 3.62Å; F765-F801 HydrophobicContact CZ-CG 3.62Å
766	L	86	Confident	80.8	Confident	13 Å²	13	45.5 Å²	45.5	7%	0.068	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	101.5	178.9	-174.3	61.8	0	0	0	109.6	P697 V768 V788 A792 I799 I800 F801	P697-L766 HydrophobicContact CB-CB 3.9Å; P697-L766 HydrophobicContact CB-CD1 4.3Å; P697-L766 HydrophobicContact CG-CB 4.44Å; L766-V768 HydrophobicContact CG-CG2 4.1Å; L766-V788 HydrophobicContact CD2-CG1 3.84Å; L766-A792 HydrophobicContact CD2-CB 4.12Å; L766-I799 PolarHBondContact N-O 3.22Å; L766-I800 HydrophobicContact CD2-CG1 4.47Å; L766-F801 PolarHBondContact O-N 3.06Å
767	S	86.1	Confident	79.9	Confident	48 Å²	48	54.3 Å²	54.3	34%	0.336	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	124.5	175.3	-164.2	0	0	0	0	110
768	V	86.4	Confident	78.9	Confident	9 Å²	9	59.6 Å²	59.6	6%	0.055	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	127.2	174.5	-174.2	0	0	0	0	108.7	L766 L773 V788 F801 F802 D803	L766-V768 HydrophobicContact CG-CG2 4.1Å; V768-L773 HydrophobicContact CG1-CD1 3.42Å; V768-L773 VanDerWaalsContact CG1-CD1 3.42Å; V768-L773 HydrophobicContact CG1-CD2 3.8Å; V768-L773 HydrophobicContact CG1-CG 3.45Å; V768-L773 VanDerWaalsContact CG1-CG 3.45Å; V768-V788 HydrophobicContact CG2-CG1 3.82Å; V768-V788 HydrophobicContact CG2-CG2 4.15Å; V768-F801 PolarHBondContact N-O 3.36Å; V768-F802 HydrophobicContact CB-CD1 4.13Å; V768-F802 HydrophobicContact CB-CE1 4.27Å; V768-F802 HydrophobicContact CG1-CD1 4.44Å; V768-F802 HydrophobicContact CG1-CE1 4.43Å; V768-F802 WeakPolarHBondContact O-CA 3.16Å; V768-D803 PolarHBondContact O-N 3.4Å
769	K	85.1	Confident	78.4	Confident	99 Å²	99	61.2 Å²	61.2	43%	0.43	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	140.1	174.6	-56.4	-176.6	-168.3	155.6	0	109.9	P771 E772	K769-P771 VanDerWaalsContact C-N 3.34Å; K769-E772 HydrophobicContact CB-CG 4.02Å; K769-E772 WeakPolarHBondContact CD-OE1 3.33Å; K769-E772 PolarHBondContact N-OE2 2.87Å; K769-E772 IonicContact NZ-OE1 3.37Å; K769-E772 WeakPolarHBondContact O-CB 3.29Å; K769-E772 PolarHBondContact O-N 3.21Å
770	G	79.1	Confident	78.3	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.021	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-48.5	-46.4	179.6	0	0	0	0	0	114.7	E772 L773 I774 D803 S807	G770-E772 VanDerWaalsContact C-N 3.31Å; G770-E772 PolarHBondContact O-N 2.86Å; G770-L773 PolarHBondContact O-N 2.91Å; G770-I774 WeakPolarHBondContact O-CG1 3.31Å; G770-D803 PolarHBondContact N-O 2.88Å; G770-S807 WeakPolarHBondContact CA-OG 3.48Å
771	P	78.9	Confident	78.3	Confident	74 Å²	74	60.2 Å²	60.2	48%	0.481	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-65.9	-25.6	178.3	-23.9	34.9	0	0	0	115.2	K769 L773 I774	K769-P771 VanDerWaalsContact C-N 3.34Å; P771-L773 PolarHBondContact O-N 2.94Å; P771-I774 PolarHBondContact O-N 2.74Å
772	E	78.7	Confident	78.7	Confident	111 Å²	111	61 Å²	61	52%	0.519	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-71.4	-21.9	-178.2	-68	169.5	178.8	0	0	112.2	K769 G770	K769-E772 HydrophobicContact CB-CG 4.02Å; K769-E772 WeakPolarHBondContact CD-OE1 3.33Å; K769-E772 PolarHBondContact N-OE2 2.87Å; K769-E772 IonicContact NZ-OE1 3.37Å; K769-E772 WeakPolarHBondContact O-CB 3.29Å; K769-E772 PolarHBondContact O-N 3.21Å; G770-E772 VanDerWaalsContact C-N 3.31Å; G770-E772 PolarHBondContact O-N 2.86Å
773	L	78.8	Confident	79.1	Confident	8 Å²	8	60.2 Å²	60.2	4%	0.042	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-89.9	-13.7	179.1	-68.6	175.5	0	0	0	113.8	V768 G770 P771 S781 N784 V785 V788 F802 L808	V768-L773 HydrophobicContact CG1-CD1 3.42Å; V768-L773 VanDerWaalsContact CG1-CD1 3.42Å; V768-L773 HydrophobicContact CG1-CD2 3.8Å; V768-L773 HydrophobicContact CG1-CG 3.45Å; V768-L773 VanDerWaalsContact CG1-CG 3.45Å; G770-L773 PolarHBondContact O-N 2.91Å; P771-L773 PolarHBondContact O-N 2.94Å; L773-S781 WeakPolarHBondContact O-CB 3.4Å; L773-N784 HydrophobicContact CD2-CB 4.2Å; L773-V785 HydrophobicContact CD1-CG2 4.27Å; L773-V788 HydrophobicContact CD2-CG2 3.92Å; L773-F802 HydrophobicContact CD1-CD1 4.5Å; L773-F802 HydrophobicContact CD1-CE1 4.14Å; L773-L808 HydrophobicContact CB-CD1 3.92Å; L773-L808 HydrophobicContact CD1-CD1 3.97Å; L773-L808 HydrophobicContact CD1-CD2 3.79Å
774	I	78.2	Confident	79.4	Confident	51 Å²	51	61.4 Å²	61.4	26%	0.262	32%	0.317	S	S	.	.			trans	-97.6	103.1	-172	-61.5	168.6	0	0	0	109.5	G770 P771 S807 L808 M822	G770-I774 WeakPolarHBondContact O-CG1 3.31Å; P771-I774 PolarHBondContact O-N 2.74Å; I774-S807 WeakPolarHBondContact CD1-O 3.39Å; I774-L808 HydrophobicContact CG1-CD1 4.19Å; I774-M822 HydrophobicContact CB-CE 4.27Å; I774-M822 HydrophobicContact CD1-CE 4.19Å; I774-M822 HydrophobicContact CD1-SD 4.01Å; I774-M822 HydrophobicContact CG1-CE 3.99Å; I774-M822 HydrophobicContact CG1-SD 4.37Å; I774-M822 HydrophobicContact CG2-CE 3.38Å; I774-M822 HydrophobicContact CG2-SD 4.49Å
775	N	75.1	Confident	79.9	Confident	63 Å²	63	60 Å²	60	34%	0.337	31%	0.309	S	S	.	.			trans	-103.8	145.2	168.1	-77.5	-38.5	0	0	0	110.9	Y777 Q780 S781 N784	N775-Y777 PolarHBondContact O-N 2.8Å; N775-Q780 HydrophobicContact CB-CB 4.29Å; N775-Q780 HydrophobicContact CB-CG 4.43Å; N775-S781 PolarHBondContact N-OG 3.06Å; N775-S781 PolarHBondContact O-OG 3.44Å; N775-N784 PolarHBondContact ND2-ND2 3.32Å
776	M	67.6	Low	80	Confident	188 Å²	188	64.8 Å²	64.8	93%	0.926	33%	0.326	S	S	*	.	S	Bend	trans	-72.7	-15.6	177.9	-60.8	-172.8	87.3	0	0	113.1
777	Y	67.9	Low	79.9	Confident	186 Å²	186	66.7 Å²	66.7	73%	0.729	34%	0.335	S	S	*	.	S	Bend	trans	-77.1	130.3	178.1	-66.2	-82.5	0	0	0	110.9	N775 G779 Q780	N775-Y777 PolarHBondContact O-N 2.8Å; Y777-G779 PolarHBondContact O-N 3.28Å; Y777-Q780 PolarHBondContact O-N 2.95Å
778	V	66.2	Low	79.8	Confident	110 Å²	110	65.2 Å²	65.2	67%	0.667	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	129.2	-176.5	-177.8	0	0	0	0	110.3	Q780	V778-Q780 VanDerWaalsContact C-N 3.28Å; V778-Q780 PolarHBondContact O-N 2.89Å
779	G	75.1	Confident	79.8	Confident	35 Å²	35	64.8 Å²	64.8	36%	0.361	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	-27.5	176.5	0	0	0	0	0	115.4	Y777 S781 E782 E783	Y777-G779 PolarHBondContact O-N 3.28Å; G779-S781 VanDerWaalsContact C-N 3.34Å; G779-S781 PolarHBondContact O-N 3.34Å; G779-E782 PolarHBondContact O-N 2.91Å; G779-E783 PolarHBondContact O-N 2.92Å
780	Q	80.1	Confident	79.6	Confident	100 Å²	100	62.1 Å²	62.1	47%	0.467	32%	0.318	S	S	.	.	H	α-helix	trans	-62	-40.3	-178.5	-161.9	77.9	37.3	0	0	112.4	N775 Y777 V778 E782 E783 N784	N775-Q780 HydrophobicContact CB-CB 4.29Å; N775-Q780 HydrophobicContact CB-CG 4.43Å; Y777-Q780 PolarHBondContact O-N 2.95Å; V778-Q780 VanDerWaalsContact C-N 3.28Å; V778-Q780 PolarHBondContact O-N 2.89Å; Q780-E782 VanDerWaalsContact C-N 3.33Å; Q780-E782 PolarHBondContact O-N 3.1Å; Q780-E783 PolarHBondContact O-N 3.02Å; Q780-N784 WeakPolarHBondContact O-CB 3.46Å; Q780-N784 PolarHBondContact O-N 3.34Å; Q780-N784 PolarHBondContact O-OD1 3.09Å
781	S	83.6	Confident	79.5	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-67.4	-32.2	-179.4	-53.5	0	0	0	0	112.8	L773 N775 G779 V785	L773-S781 WeakPolarHBondContact O-CB 3.4Å; N775-S781 PolarHBondContact N-OG 3.06Å; N775-S781 PolarHBondContact O-OG 3.44Å; G779-S781 VanDerWaalsContact C-N 3.34Å; G779-S781 PolarHBondContact O-N 3.34Å; S781-V785 WeakPolarHBondContact O-CG2 3.49Å; S781-V785 PolarHBondContact O-N 3.33Å
782	E	85.3	Confident	79.6	Confident	43 Å²	43	62.7 Å²	62.7	20%	0.201	31%	0.31	C	S	.	.	H	α-helix	trans	-72	-43.1	176.7	-66.5	170.6	-145.6	0	0	110.9	G779 Q780 N784 V785 R786 R824 V825 Q828	G779-E782 PolarHBondContact O-N 2.91Å; Q780-E782 VanDerWaalsContact C-N 3.33Å; Q780-E782 PolarHBondContact O-N 3.1Å; E782-N784 VanDerWaalsContact C-N 3.35Å; E782-V785 PolarHBondContact O-N 2.95Å; E782-R786 PolarHBondContact O-N 2.97Å; E782-R786 VanDerWaalsContact O-N 3.1Å; E782-R824 HydrophobicContact CG-CB 4.32Å; E782-R824 WeakPolarHBondContact OE1-CB 3.47Å; E782-R824 WeakPolarHBondContact OE1-CD 3.4Å; E782-V825 HydrophobicContact CG-CG2 4.31Å; E782-Q828 HydrophobicContact CB-CG 4.48Å
783	E	83.4	Confident	79.5	Confident	82 Å²	82	61.6 Å²	61.6	38%	0.383	30%	0.301	S	S	.	.	H	α-helix	trans	-64.2	-40.9	176.2	-171.9	57.5	-155.4	0	0	111.4	G779 Q780 V785 R786 E787	G779-E783 PolarHBondContact O-N 2.92Å; Q780-E783 PolarHBondContact O-N 3.02Å; E783-V785 VanDerWaalsContact C-N 3.28Å; E783-V785 PolarHBondContact O-N 2.85Å; E783-R786 WeakPolarHBondContact O-CB 3.25Å; E783-R786 PolarHBondContact O-N 3.46Å; E783-R786 VanDerWaalsContact O-N 3.13Å; E783-E787 WeakPolarHBondContact O-CB 3.42Å; E783-E787 PolarHBondContact O-N 2.68Å
784	N	84.3	Confident	79.1	Confident	30 Å²	30	64.3 Å²	64.3	16%	0.16	33%	0.325	C	S	.	.	H	α-helix	trans	-58.4	-40	175	-72.7	-3	0	0	0	112.2	L773 N775 Q780 E782 E787 V788	L773-N784 HydrophobicContact CD2-CB 4.2Å; N775-N784 PolarHBondContact ND2-ND2 3.32Å; Q780-N784 WeakPolarHBondContact O-CB 3.46Å; Q780-N784 PolarHBondContact O-N 3.34Å; Q780-N784 PolarHBondContact O-OD1 3.09Å; E782-N784 VanDerWaalsContact C-N 3.35Å; N784-E787 PolarHBondContact O-N 2.84Å; N784-V788 WeakPolarHBondContact O-CG2 3.24Å; N784-V788 PolarHBondContact O-N 3.09Å
785	V	87.4	Confident	78.6	Confident	1 Å²	1	63 Å²	63	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-64.2	-47.2	175.1	172.3	0	0	0	0	110.4	L773 S781 E782 E783 E787 V788 F789 V825 Q828 L829 E832	L773-V785 HydrophobicContact CD1-CG2 4.27Å; S781-V785 WeakPolarHBondContact O-CG2 3.49Å; S781-V785 PolarHBondContact O-N 3.33Å; E782-V785 PolarHBondContact O-N 2.95Å; E783-V785 VanDerWaalsContact C-N 3.28Å; E783-V785 PolarHBondContact O-N 2.85Å; V785-E787 VanDerWaalsContact C-N 3.28Å; V785-E787 PolarHBondContact O-N 3.43Å; V785-V788 PolarHBondContact O-N 3.23Å; V785-F789 HydrophobicContact CG1-CD2 3.97Å; V785-F789 HydrophobicContact CG1-CE2 3.87Å; V785-F789 VanDerWaalsContact O-CD2 3.3Å; V785-F789 WeakPolarHBondContact O-CD2 3.07Å; V785-F789 PolarHBondContact O-N 2.88Å; V785-V825 HydrophobicContact CG2-CG1 4.11Å; V785-Q828 HydrophobicContact CB-CG 4.44Å; V785-Q828 HydrophobicContact CG1-CG 4.26Å; V785-L829 HydrophobicContact CG1-CD1 4.46Å; V785-E832 HydrophobicContact CG1-CG 4.41Å
786	R	86.6	Confident	78.5	Confident	107 Å²	107	61.8 Å²	61.8	40%	0.404	32%	0.32	S	S	.	.	H	α-helix	trans	-57.3	-43.3	175.9	-71.9	-177.9	-178.6	165.2	5.6	112.1	E782 E783 V788 F789 A790 Q828	E782-R786 PolarHBondContact O-N 2.97Å; E782-R786 VanDerWaalsContact O-N 3.1Å; E783-R786 WeakPolarHBondContact O-CB 3.25Å; E783-R786 PolarHBondContact O-N 3.46Å; E783-R786 VanDerWaalsContact O-N 3.13Å; R786-V788 PolarHBondContact O-N 2.89Å; R786-F789 PolarHBondContact O-N 3.16Å; R786-A790 VanDerWaalsContact O-CB 3.31Å; R786-A790 WeakPolarHBondContact O-CB 3.17Å; R786-A790 PolarHBondContact O-N 2.9Å; R786-Q828 HydrophobicContact CG-CG 4.21Å; R786-Q828 VanDerWaalsContact NE-CD 3.3Å
787	E	83.3	Confident	78.9	Confident	54 Å²	54	55.3 Å²	55.3	25%	0.252	29%	0.292	S	S	.	.	H	α-helix	trans	-63.9	-41.6	-179.5	-162.8	-174	-178.7	0	0	111.3	E783 N784 V785 F789 A790 R791	E783-E787 WeakPolarHBondContact O-CB 3.42Å; E783-E787 PolarHBondContact O-N 2.68Å; N784-E787 PolarHBondContact O-N 2.84Å; V785-E787 VanDerWaalsContact C-N 3.28Å; V785-E787 PolarHBondContact O-N 3.43Å; E787-F789 PolarHBondContact O-N 2.95Å; E787-A790 PolarHBondContact O-N 3.29Å; E787-R791 HydrophobicContact CG-CG 4.37Å; E787-R791 WeakPolarHBondContact O-CB 3.28Å; E787-R791 VanDerWaalsContact O-CG 3.22Å; E787-R791 WeakPolarHBondContact O-CG 3.2Å; E787-R791 PolarHBondContact O-N 3.14Å; E787-R791 IonicContact OE1-CZ 3.15Å; E787-R791 VanDerWaalsContact OE1-CZ 3.31Å; E787-R791 IonicContact OE1-NE 3.62Å; E787-R791 PolarHBondContact OE1-NE 3.21Å; E787-R791 VanDerWaalsContact OE1-NE 3.13Å; E787-R791 IonicContact OE1-NH2 2.72Å; E787-R791 PolarHBondContact OE1-NH2 3.32Å; E787-R791 IonicContact OE2-CZ 2.82Å; E787-R791 IonicContact OE2-NH2 2.78Å; E787-R791 PolarHBondContact OE2-NH2 3.09Å
788	V	85.5	Confident	79.5	Confident	16 Å²	16	46.5 Å²	46.5	10%	0.097	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-48.2	175.3	163.2	0	0	0	0	111.5	L766 V768 L773 N784 V785 R786 R791 A792 I800 F802	L766-V788 HydrophobicContact CD2-CG1 3.84Å; V768-V788 HydrophobicContact CG2-CG1 3.82Å; V768-V788 HydrophobicContact CG2-CG2 4.15Å; L773-V788 HydrophobicContact CD2-CG2 3.92Å; N784-V788 WeakPolarHBondContact O-CG2 3.24Å; N784-V788 PolarHBondContact O-N 3.09Å; V785-V788 PolarHBondContact O-N 3.23Å; R786-V788 PolarHBondContact O-N 2.89Å; V788-R791 PolarHBondContact O-N 3.38Å; V788-A792 WeakPolarHBondContact O-CB 3.41Å; V788-A792 PolarHBondContact O-N 2.64Å; V788-I800 HydrophobicContact CG1-CG2 4.34Å; V788-F802 HydrophobicContact CG1-CZ 4.5Å
789	F	86.3	Confident	80.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-69.8	-34.3	178.4	-77.1	-84.1	0	0	0	112.3	V785 R786 E787 A792 R793 I800 F802 L829 E832 L833 L836 V844	V785-F789 HydrophobicContact CG1-CD2 3.97Å; V785-F789 HydrophobicContact CG1-CE2 3.87Å; V785-F789 VanDerWaalsContact O-CD2 3.3Å; V785-F789 WeakPolarHBondContact O-CD2 3.07Å; V785-F789 PolarHBondContact O-N 2.88Å; R786-F789 PolarHBondContact O-N 3.16Å; E787-F789 PolarHBondContact O-N 2.95Å; F789-A792 PolarHBondContact O-N 2.92Å; F789-R793 WeakPolarHBondContact O-CG 3.5Å; F789-R793 PolarHBondContact O-N 2.96Å; F789-I800 HydrophobicContact CD1-CD1 3.53Å; F789-I800 HydrophobicContact CE1-CD1 3.67Å; F789-I800 HydrophobicContact CG-CD1 4.31Å; F789-F802 HydrophobicContact CE2-CE2 4.44Å; F789-F802 AromaticContact CE2-CZ 3.8Å; F789-F802 HydrophobicContact CE2-CZ 3.8Å; F789-F802 AromaticContact CZ-CE2 3.83Å; F789-F802 HydrophobicContact CZ-CE2 3.83Å; F789-F802 AromaticContact CZ-CZ 3.65Å; F789-F802 HydrophobicContact CZ-CZ 3.65Å; F789-L829 HydrophobicContact CE2-CD1 3.61Å; F789-L829 HydrophobicContact CZ-CD1 3.69Å; F789-E832 HydrophobicContact CB-CB 4.39Å; F789-E832 HydrophobicContact CB-CG 4.28Å; F789-E832 WeakPolarHBondContact CB-OE2 3.3Å; F789-E832 HydrophobicContact CD1-CB 4.07Å; F789-E832 HydrophobicContact CD2-CB 3.49Å; F789-E832 VanDerWaalsContact CD2-CB 3.49Å; F789-E832 HydrophobicContact CD2-CG 3.63Å; F789-E832 HydrophobicContact CE1-CB 4.18Å; F789-E832 HydrophobicContact CE2-CB 3.63Å; F789-E832 HydrophobicContact CE2-CG 4.13Å; F789-E832 HydrophobicContact CG-CB 3.73Å; F789-E832 HydrophobicContact CG-CG 4.02Å; F789-E832 HydrophobicContact CZ-CB 3.97Å; F789-L833 HydrophobicContact CE1-CD2 4.24Å; F789-L833 HydrophobicContact CZ-CD2 4.15Å; F789-L833 HydrophobicContact CZ-CG 4.46Å; F789-L836 HydrophobicContact CD1-CD1 3.88Å; F789-L836 HydrophobicContact CD1-CD2 4.22Å; F789-L836 HydrophobicContact CD1-CG 4.17Å; F789-L836 HydrophobicContact CE1-CD1 3.62Å; F789-L836 HydrophobicContact CE1-CG 4.29Å; F789-V844 HydrophobicContact CE1-CG2 4.27Å
790	A	80.8	Confident	81.2	Confident	44 Å²	44	39.6 Å²	39.6	36%	0.364	21%	0.209	S	C	.	.	H	α-helix	trans	-64.8	-43.6	173.9	0	0	0	0	0	111.9	R786 E787 A792 R793 A794	R786-A790 VanDerWaalsContact O-CB 3.31Å; R786-A790 WeakPolarHBondContact O-CB 3.17Å; R786-A790 PolarHBondContact O-N 2.9Å; E787-A790 PolarHBondContact O-N 3.29Å; A790-A792 VanDerWaalsContact C-N 3.33Å; A790-A792 PolarHBondContact O-N 3.34Å; A790-R793 PolarHBondContact O-N 2.89Å; A790-A794 PolarHBondContact O-N 3.21Å
791	R	77.3	Confident	81.7	Confident	88 Å²	88	34.8 Å²	34.8	33%	0.332	19%	0.186	S	C	.	.	H	α-helix	trans	-61.6	-41.8	174.1	-72.8	175.8	-172.6	-170	8.9	111.3	E787 V788 A794 A795	E787-R791 HydrophobicContact CG-CG 4.37Å; E787-R791 WeakPolarHBondContact O-CB 3.28Å; E787-R791 VanDerWaalsContact O-CG 3.22Å; E787-R791 WeakPolarHBondContact O-CG 3.2Å; E787-R791 PolarHBondContact O-N 3.14Å; E787-R791 IonicContact OE1-CZ 3.15Å; E787-R791 VanDerWaalsContact OE1-CZ 3.31Å; E787-R791 IonicContact OE1-NE 3.62Å; E787-R791 PolarHBondContact OE1-NE 3.21Å; E787-R791 VanDerWaalsContact OE1-NE 3.13Å; E787-R791 IonicContact OE1-NH2 2.72Å; E787-R791 PolarHBondContact OE1-NH2 3.32Å; E787-R791 IonicContact OE2-CZ 2.82Å; E787-R791 IonicContact OE2-NH2 2.78Å; E787-R791 PolarHBondContact OE2-NH2 3.09Å; V788-R791 PolarHBondContact O-N 3.38Å; R791-A794 PolarHBondContact O-N 2.94Å; R791-A795 WeakPolarHBondContact O-CB 3.33Å; R791-A795 PolarHBondContact O-N 3.28Å; R791-A795 VanDerWaalsContact O-N 3.08Å
792	A	79.6	Confident	82.1	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.5	-47.7	175.6	0	0	0	0	0	111.9	L766 V788 F789 A790 A794 A795 A796 C798 I800 V842	L766-A792 HydrophobicContact CD2-CB 4.12Å; V788-A792 WeakPolarHBondContact O-CB 3.41Å; V788-A792 PolarHBondContact O-N 2.64Å; F789-A792 PolarHBondContact O-N 2.92Å; A790-A792 VanDerWaalsContact C-N 3.33Å; A790-A792 PolarHBondContact O-N 3.34Å; A792-A794 VanDerWaalsContact C-N 3.3Å; A792-A794 PolarHBondContact O-N 3.2Å; A792-A795 CarbonylContact O-C 3.54Å; A792-A795 PolarHBondContact O-N 2.88Å; A792-A796 PolarHBondContact O-N 3.28Å; A792-A796 VanDerWaalsContact O-N 3.17Å; A792-C798 PolarHBondContact O-SG 3.22Å; A792-I800 HydrophobicContact CB-CD1 3.35Å; A792-I800 HydrophobicContact CB-CG1 3.55Å; A792-V842 HydrophobicContact CB-CG1 4.34Å
793	R	77.7	Confident	82.3	Confident	87 Å²	87	34.2 Å²	34.2	33%	0.328	18%	0.184	S	C	.	.	H	α-helix	trans	-58.7	-39.2	175.9	-74	-176.6	-67.2	-100.7	3.7	112.6	F789 A790 A795 A796 E832 L836 V842	F789-R793 WeakPolarHBondContact O-CG 3.5Å; F789-R793 PolarHBondContact O-N 2.96Å; A790-R793 PolarHBondContact O-N 2.89Å; R793-A795 VanDerWaalsContact C-N 3.29Å; R793-A795 PolarHBondContact O-N 3.21Å; R793-A796 WeakPolarHBondContact O-CB 3.23Å; R793-A796 PolarHBondContact O-N 3.3Å; R793-E832 IonicContact CZ-OE2 2.81Å; R793-E832 IonicContact NH1-OE2 3.47Å; R793-E832 PolarHBondContact NH1-OE2 3.16Å; R793-E832 IonicContact NH2-OE2 3.13Å; R793-E832 PolarHBondContact NH2-OE2 2.96Å; R793-L836 HydrophobicContact CG-CD2 4.44Å; R793-V842 HydrophobicContact CG-CG2 4.38Å
794	A	69.7	Low	82.6	Confident	66 Å²	66	34.2 Å²	34.2	55%	0.545	18%	0.184	S	C	.	.	H	α-helix	trans	-69	-26.6	175.9	0	0	0	0	0	113.2	A790 R791 A792	A790-A794 PolarHBondContact O-N 3.21Å; R791-A794 PolarHBondContact O-N 2.94Å; A792-A794 VanDerWaalsContact C-N 3.3Å; A792-A794 PolarHBondContact O-N 3.2Å
795	A	69.1	Low	82.8	Confident	23 Å²	23	32.9 Å²	32.9	19%	0.19	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	13.2	-179.1	0	0	0	0	0	113.7	P697 T764 R791 A792 R793 P797	P697-A795 HydrophobicContact CG-CB 4.14Å; T764-A795 PolarHBondContact OG1-O 3.5Å; T764-A795 VanDerWaalsContact OG1-O 3.07Å; R791-A795 WeakPolarHBondContact O-CB 3.33Å; R791-A795 PolarHBondContact O-N 3.28Å; R791-A795 VanDerWaalsContact O-N 3.08Å; A792-A795 CarbonylContact O-C 3.54Å; A792-A795 PolarHBondContact O-N 2.88Å; R793-A795 VanDerWaalsContact C-N 3.29Å; R793-A795 PolarHBondContact O-N 3.21Å; A795-P797 CarbonylContact O-C 3.56Å
796	A	71.1	Confident	82.8	Confident	37 Å²	37	34.3 Å²	34.3	31%	0.306	19%	0.185	S	C	.	.			trans	-60.7	137.5	-179.3	0	0	0	0	0	112	A792 R793 D841 V842	A792-A796 PolarHBondContact O-N 3.28Å; A792-A796 VanDerWaalsContact O-N 3.17Å; R793-A796 WeakPolarHBondContact O-CB 3.23Å; R793-A796 PolarHBondContact O-N 3.3Å; A796-D841 HydrophobicContact CB-CB 3.85Å; A796-V842 HydrophobicContact CB-CG2 4.34Å
797	P	76.6	Confident	82.7	Confident	53 Å²	53	31.2 Å²	31.2	34%	0.344	18%	0.179	S	C	.	.	S	Bend	cis	-80.1	131.2	4.3	33.8	-36.6	0	0	0	113.3	L763 T764 A795 D841	L763-P797 HydrophobicContact CD2-CB 3.72Å; L763-P797 HydrophobicContact CD2-CG 3.92Å; T764-P797 PolarHBondContact OG1-O 2.95Å; A795-P797 CarbonylContact O-C 3.56Å; P797-D841 VanDerWaalsContact CA-O 3.26Å; P797-D841 WeakPolarHBondContact CA-O 3.39Å; P797-D841 HydrophobicContact CB-CB 4.11Å
798	C	81.1	Confident	82.7	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	152.9	-171.8	78.5	0	0	0	0	114.1	T764 A792 D841 F843	T764-C798 CarbonylContact O-C 3.54Å; T764-C798 WeakPolarHBondContact O-CA 3.4Å; T764-C798 VanDerWaalsContact OG1-CA 3.29Å; T764-C798 WeakPolarHBondContact OG1-CA 3.37Å; T764-C798 WeakPolarHBondContact OG1-CB 3.47Å; A792-C798 PolarHBondContact O-SG 3.22Å; C798-D841 PolarHBondContact N-O 3.34Å; C798-F843 PolarHBondContact O-N 2.91Å
799	I	87.1	Confident	82.6	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	124.1	168	-66.8	169.4	0	0	0	109.3	I721 V757 A758 L763 T764 F765 L766 F843 I845	I721-I799 HydrophobicContact CD1-CD1 4.44Å; V757-I799 HydrophobicContact CG1-CD1 4.3Å; A758-I799 HydrophobicContact CB-CD1 3.99Å; L763-I799 HydrophobicContact CB-CD1 4.24Å; L763-I799 HydrophobicContact CB-CG1 4.32Å; L763-I799 HydrophobicContact CD1-CD1 3.61Å; L763-I799 HydrophobicContact CD1-CG1 3.74Å; T764-I799 PolarHBondContact O-N 3.22Å; F765-I799 HydrophobicContact CD2-CG2 4.26Å; L766-I799 PolarHBondContact N-O 3.22Å; I799-F843 CarbonylContact C-O 3.53Å; I799-F843 WeakPolarHBondContact CA-O 3.4Å; I799-F843 HydrophobicContact CG1-CB 4.19Å; I799-I845 HydrophobicContact CG2-CB 4.45Å; I799-I845 HydrophobicContact CG2-CD1 3.68Å; I799-I845 HydrophobicContact CG2-CG1 3.9Å
800	I	89.7	Confident	82.5	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	119.2	166.8	-49.8	177	0	0	0	108.5	L766 V788 F789 A792 F802 V842 F843 V844 I845	L766-I800 HydrophobicContact CD2-CG1 4.47Å; V788-I800 HydrophobicContact CG1-CG2 4.34Å; F789-I800 HydrophobicContact CD1-CD1 3.53Å; F789-I800 HydrophobicContact CE1-CD1 3.67Å; F789-I800 HydrophobicContact CG-CD1 4.31Å; A792-I800 HydrophobicContact CB-CD1 3.35Å; A792-I800 HydrophobicContact CB-CG1 3.55Å; I800-F802 HydrophobicContact CB-CE2 4.37Å; I800-F802 HydrophobicContact CG2-CD2 4.04Å; I800-F802 HydrophobicContact CG2-CE1 4.23Å; I800-F802 HydrophobicContact CG2-CE2 3.49Å; I800-F802 VanDerWaalsContact CG2-CE2 3.49Å; I800-F802 HydrophobicContact CG2-CZ 3.6Å; I800-V842 HydrophobicContact CD1-CG1 3.82Å; I800-V842 HydrophobicContact CG1-CG1 4.06Å; I800-F843 PolarHBondContact N-O 3.24Å; I800-V844 HydrophobicContact CB-CG2 4.48Å; I800-V844 HydrophobicContact CD1-CG2 4.42Å; I800-V844 CarbonylContact O-C 3.54Å; I800-V844 WeakPolarHBondContact O-CA 3.34Å; I800-I845 PolarHBondContact O-N 2.79Å
801	F	91.4	Very high	82.4	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	110	176.4	-179.9	-104.8	0	0	0	110.8	T751 A754 F765 L766 V768 D803 I845 A847	T751-F801 HydrophobicContact CG2-CE1 3.81Å; T751-F801 HydrophobicContact CG2-CZ 4.29Å; A754-F801 HydrophobicContact CB-CD2 3.33Å; A754-F801 HydrophobicContact CB-CE2 3.35Å; A754-F801 HydrophobicContact CB-CG 4.07Å; A754-F801 HydrophobicContact CB-CZ 4.12Å; F765-F801 HydrophobicContact CD2-CB 4.31Å; F765-F801 HydrophobicContact CE1-CB 4.38Å; F765-F801 HydrophobicContact CE2-CB 3.39Å; F765-F801 HydrophobicContact CE2-CD1 4.44Å; F765-F801 HydrophobicContact CE2-CD2 4.46Å; F765-F801 AromaticContact CE2-CG 3.87Å; F765-F801 HydrophobicContact CE2-CG 3.87Å; F765-F801 HydrophobicContact CZ-CB 3.43Å; F765-F801 VanDerWaalsContact CZ-CB 3.43Å; F765-F801 AromaticContact CZ-CD1 3.73Å; F765-F801 HydrophobicContact CZ-CD1 3.73Å; F765-F801 HydrophobicContact CZ-CD2 4.47Å; F765-F801 AromaticContact CZ-CG 3.62Å; F765-F801 HydrophobicContact CZ-CG 3.62Å; L766-F801 PolarHBondContact O-N 3.06Å; V768-F801 PolarHBondContact N-O 3.36Å; F801-D803 HydrophobicContact CD1-CB 4.33Å; F801-D803 HydrophobicContact CE1-CB 3.64Å; F801-D803 HydrophobicContact CZ-CB 4.29Å; F801-I845 CarbonylContact C-O 3.58Å; F801-I845 VanDerWaalsContact CA-O 3.26Å; F801-I845 WeakPolarHBondContact CA-O 3.21Å; F801-I845 HydrophobicContact CD2-CB 3.97Å; F801-I845 HydrophobicContact CD2-CG2 3.71Å; F801-I845 HydrophobicContact CE2-CG2 3.99Å; F801-A847 HydrophobicContact CE2-CB 3.73Å; F801-A847 HydrophobicContact CZ-CB 3.56Å
802	F	91.3	Very high	82.3	Confident	4 Å²	4	29.4 Å²	29.4	2%	0.018	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	108.1	172.5	-67.4	-73.6	0	0	0	109.9	V768 L773 V788 F789 I800 L805 L808 L829 V844 I845 G846 A847	V768-F802 HydrophobicContact CB-CD1 4.13Å; V768-F802 HydrophobicContact CB-CE1 4.27Å; V768-F802 HydrophobicContact CG1-CD1 4.44Å; V768-F802 HydrophobicContact CG1-CE1 4.43Å; V768-F802 WeakPolarHBondContact O-CA 3.16Å; L773-F802 HydrophobicContact CD1-CD1 4.5Å; L773-F802 HydrophobicContact CD1-CE1 4.14Å; V788-F802 HydrophobicContact CG1-CZ 4.5Å; F789-F802 HydrophobicContact CE2-CE2 4.44Å; F789-F802 AromaticContact CE2-CZ 3.8Å; F789-F802 HydrophobicContact CE2-CZ 3.8Å; F789-F802 AromaticContact CZ-CE2 3.83Å; F789-F802 HydrophobicContact CZ-CE2 3.83Å; F789-F802 AromaticContact CZ-CZ 3.65Å; F789-F802 HydrophobicContact CZ-CZ 3.65Å; I800-F802 HydrophobicContact CB-CE2 4.37Å; I800-F802 HydrophobicContact CG2-CD2 4.04Å; I800-F802 HydrophobicContact CG2-CE1 4.23Å; I800-F802 HydrophobicContact CG2-CE2 3.49Å; I800-F802 VanDerWaalsContact CG2-CE2 3.49Å; I800-F802 HydrophobicContact CG2-CZ 3.6Å; F802-L805 HydrophobicContact CB-CD1 4.04Å; F802-L805 HydrophobicContact CG-CD1 4.42Å; F802-L808 HydrophobicContact CD1-CD2 4.26Å; F802-L808 HydrophobicContact CE1-CD2 4.46Å; F802-L829 HydrophobicContact CE2-CD1 4.32Å; F802-L829 HydrophobicContact CZ-CD1 4.05Å; F802-V844 HydrophobicContact CD2-CG1 3.64Å; F802-V844 HydrophobicContact CE2-CG1 3.65Å; F802-I845 PolarHBondContact N-O 2.89Å; F802-G846 CarbonylContact O-C 3.31Å; F802-A847 PolarHBondContact O-N 2.88Å
803	D	90	Very high	81.6	Confident	26 Å²	26	33 Å²	33	14%	0.139	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	145.7	171.3	-145.6	-15	0	0	0	110.4	T751 V768 G770 F801 L805	T751-D803 PolarHBondContact OG1-OD2 3.05Å; V768-D803 PolarHBondContact O-N 3.4Å; G770-D803 PolarHBondContact N-O 2.88Å; F801-D803 HydrophobicContact CD1-CB 4.33Å; F801-D803 HydrophobicContact CE1-CB 3.64Å; F801-D803 HydrophobicContact CZ-CB 4.29Å; D803-L805 PolarHBondContact O-N 3.17Å
804	E	88.9	Confident	80.7	Confident	83 Å²	83	37 Å²	37	39%	0.388	22%	0.219	S	C	.	.	S	Bend	trans	54.3	48.1	-177.3	-57.4	-179.1	159.9	0	0	112.9	D806 S807 A847	E804-D806 PolarHBondContact O-N 2.99Å; E804-S807 PolarHBondContact O-N 2.84Å; E804-S807 PolarHBondContact O-OG 3.01Å; E804-S807 VanDerWaalsContact O-OG 3.05Å; E804-A847 PolarHBondContact N-O 3.12Å
805	L	88.4	Confident	80.1	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-57.3	-24.8	-178.4	-172.2	65.7	0	0	0	112.9	L741 F802 D803 S807 L808 A809 L829 A847 L854 L858 F864	L741-L805 HydrophobicContact CD1-CD2 3.83Å; F802-L805 HydrophobicContact CB-CD1 4.04Å; F802-L805 HydrophobicContact CG-CD1 4.42Å; D803-L805 PolarHBondContact O-N 3.17Å; L805-S807 VanDerWaalsContact C-N 3.26Å; L805-S807 PolarHBondContact O-N 2.89Å; L805-L808 HydrophobicContact CD1-CD2 4.29Å; L805-L808 PolarHBondContact O-N 3.09Å; L805-A809 PolarHBondContact O-N 2.77Å; L805-L829 HydrophobicContact CD1-CD2 4.2Å; L805-A847 PolarHBondContact N-O 3.46Å; L805-L854 HydrophobicContact CB-CD1 4.26Å; L805-L854 HydrophobicContact CD2-CD1 3.72Å; L805-L854 HydrophobicContact CG-CD1 3.78Å; L805-L858 HydrophobicContact CD2-CD1 4.44Å; L805-F864 HydrophobicContact CD2-CD2 4.46Å; L805-F864 HydrophobicContact CD2-CE2 3.63Å; L805-F864 HydrophobicContact CD2-CZ 3.78Å
806	D	87.7	Confident	79.5	Confident	31 Å²	31	39.4 Å²	39.4	17%	0.166	24%	0.242	C	C	.	.	H	α-helix	trans	-64.3	-23.9	174	46.8	-53.5	0	0	0	114	E804 T848	E804-D806 PolarHBondContact O-N 2.99Å; D806-T848 WeakPolarHBondContact CB-OG1 2.96Å; D806-T848 VanDerWaalsContact CG-OG1 3.24Å; D806-T848 PolarHBondContact OD1-OG1 2.94Å
807	S	84.4	Confident	78.9	Confident	42 Å²	42	42.1 Å²	42.1	29%	0.294	25%	0.252	S	S	.	.	H	α-helix	trans	-81.2	-29.5	173.5	80.9	0	0	0	0	112.5	G770 I774 E804 L805	G770-S807 WeakPolarHBondContact CA-OG 3.48Å; I774-S807 WeakPolarHBondContact CD1-O 3.39Å; E804-S807 PolarHBondContact O-N 2.84Å; E804-S807 PolarHBondContact O-OG 3.01Å; E804-S807 VanDerWaalsContact O-OG 3.05Å; L805-S807 VanDerWaalsContact C-N 3.26Å; L805-S807 PolarHBondContact O-N 2.89Å
808	L	83.4	Confident	77.9	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-83.5	-35.5	-179	-173	66.7	0	0	0	112.2	L773 I774 F802 L805 P810 V825 L829	L773-L808 HydrophobicContact CB-CD1 3.92Å; L773-L808 HydrophobicContact CD1-CD1 3.97Å; L773-L808 HydrophobicContact CD1-CD2 3.79Å; I774-L808 HydrophobicContact CG1-CD1 4.19Å; F802-L808 HydrophobicContact CD1-CD2 4.26Å; F802-L808 HydrophobicContact CE1-CD2 4.46Å; L805-L808 HydrophobicContact CD1-CD2 4.29Å; L805-L808 PolarHBondContact O-N 3.09Å; L808-P810 VanDerWaalsContact C-CD 3.47Å; L808-V825 HydrophobicContact CD1-CG1 3.76Å; L808-V825 HydrophobicContact CG-CG1 4.45Å; L808-L829 HydrophobicContact CD2-CD2 3.96Å
809	A	83.1	Confident	77.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	-130.8	64.4	-175.2	0	0	0	0	0	113.8	L805 V826 D855 L858	L805-A809 PolarHBondContact O-N 2.77Å; A809-V826 HydrophobicContact CB-CG2 3.76Å; A809-D855 PolarHBondContact O-N 2.86Å; A809-D855 VanDerWaalsContact O-N 3.15Å; A809-L858 HydrophobicContact CB-CD1 3.39Å
810	P	83.4	Confident	76.7	Confident	24 Å²	24	49.6 Å²	49.6	16%	0.156	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-65.1	152.9	171.7	29.9	-34.8	0	0	0	111	L808 R812 L853	L808-P810 VanDerWaalsContact C-CD 3.47Å; P810-R812 PolarHBondContact O-N 3.08Å; P810-L853 CarbonylContact C-O 3.59Å; P810-L853 WeakPolarHBondContact CA-O 3.44Å
811	S	79.9	Confident	76.2	Confident	24 Å²	24	50.9 Å²	50.9	17%	0.168	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-56.1	126.6	175	61.1	0	0	0	0	111.1	G813 R814 L853	S811-G813 PolarHBondContact O-N 2.71Å; S811-R814 PolarHBondContact O-N 3.16Å; S811-R814 WeakPolarHBondContact OG-CD 3.45Å; S811-L853 PolarHBondContact N-O 2.98Å
812	R	73.8	Confident	75.6	Confident	115 Å²	115	52 Å²	52	43%	0.434	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	133.7	-178.3	-61.5	178.3	-178.6	-117.8	-2.6	111.7	P810 R814 S827 D855	P810-R812 PolarHBondContact O-N 3.08Å; R812-R814 PolarHBondContact O-N 3.25Å; R812-S827 PolarHBondContact NH1-OG 3.16Å; R812-S827 PolarHBondContact NH2-OG 3.38Å; R812-D855 IonicContact CZ-OD2 3.78Å; R812-D855 IonicContact NE-OD2 3.71Å; R812-D855 PolarHBondContact NE-OD2 3.36Å
813	G	64.8	Low	75.3	Confident	76 Å²	76	54.9 Å²	54.9	78%	0.784	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	1.4	176.2	0	0	0	0	0	116.8	S811	S811-G813 PolarHBondContact O-N 2.71Å
814	R	60.4	Low	75	Confident	172 Å²	172	59.6 Å²	59.6	65%	0.649	36%	0.362	S	S	*	.	S	Bend	trans	-89.1	-23.9	175.5	-121.2	-174	-174.9	165.8	-1.7	114	S811 R812	S811-R814 PolarHBondContact O-N 3.16Å; S811-R814 WeakPolarHBondContact OG-CD 3.45Å; R812-R814 PolarHBondContact O-N 3.25Å
815	S	56	Low	74.9	Confident	59 Å²	59	55.7 Å²	55.7	41%	0.413	34%	0.343	S	S	.	.	S	Bend	trans	-103.4	116.6	178.2	-51.1	0	0	0	0	108.4	D817	S815-D817 PolarHBondContact O-N 3.29Å
816	G	56	Low	74.9	Confident	80 Å²	80	55.7 Å²	55.7	83%	0.825	34%	0.343	S	S	*	.			trans	-73.1	50.5	179.6	0	0	0	0	0	113.3	S818	G816-S818 PolarHBondContact O-N 3.21Å
817	D	59.3	Low	74.9	Confident	93 Å²	93	56.6 Å²	56.6	50%	0.497	35%	0.352	S	S	.	.			trans	-80.6	108.2	-177.9	-78.5	-15.5	0	0	0	110.2	S815 G819 G820 M822	S815-D817 PolarHBondContact O-N 3.29Å; D817-G819 PolarHBondContact O-N 2.9Å; D817-G820 PolarHBondContact O-N 3.11Å; D817-M822 WeakPolarHBondContact OD2-CG 3.48Å
818	S	56.1	Low	75.2	Confident	137 Å²	137	55.7 Å²	55.7	96%	0.958	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	4.3	-177.3	-53.3	0	0	0	0	116.3	G816	G816-S818 PolarHBondContact O-N 3.21Å
819	G	65.4	Low	75.4	Confident	46 Å²	46	55.7 Å²	55.7	47%	0.474	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-4.2	-178	0	0	0	0	0	116.3	D817 V821	D817-G819 PolarHBondContact O-N 2.9Å; G819-V821 PolarHBondContact O-N 2.92Å
820	G	76.9	Confident	75.7	Confident	27 Å²	27	56.3 Å²	56.3	28%	0.278	35%	0.346	S	S	.	.			trans	59.4	14.9	-179.5	0	0	0	0	0	115.2	D817 M822 D823 R824	D817-G820 PolarHBondContact O-N 3.11Å; G820-M822 PolarHBondContact O-N 2.93Å; G820-D823 PolarHBondContact O-N 2.98Å; G820-R824 WeakPolarHBondContact O-CG 3.46Å; G820-R824 PolarHBondContact O-N 2.84Å
821	V	78.6	Confident	75.9	Confident	27 Å²	27	57.6 Å²	57.6	16%	0.164	36%	0.359	C	S	.	.	H	α-helix	trans	-61.6	-44	-176	179	0	0	0	0	110.6	G819 D823 R824 V825	G819-V821 PolarHBondContact O-N 2.92Å; V821-D823 PolarHBondContact O-N 2.81Å; V821-R824 PolarHBondContact O-N 2.9Å; V821-V825 HydrophobicContact CG1-CG2 4.41Å; V821-V825 WeakPolarHBondContact O-CG2 3.23Å; V821-V825 PolarHBondContact O-N 2.79Å
822	M	80.1	Confident	76.3	Confident	24 Å²	24	57.6 Å²	57.6	12%	0.118	36%	0.357	C	S	.	.	H	α-helix	trans	-60.5	-44.9	177.8	-68.2	-60.1	107.2	0	0	112.1	I774 D817 G820 R824 V825 V826	I774-M822 HydrophobicContact CB-CE 4.27Å; I774-M822 HydrophobicContact CD1-CE 4.19Å; I774-M822 HydrophobicContact CD1-SD 4.01Å; I774-M822 HydrophobicContact CG1-CE 3.99Å; I774-M822 HydrophobicContact CG1-SD 4.37Å; I774-M822 HydrophobicContact CG2-CE 3.38Å; I774-M822 HydrophobicContact CG2-SD 4.49Å; D817-M822 WeakPolarHBondContact OD2-CG 3.48Å; G820-M822 PolarHBondContact O-N 2.93Å; M822-R824 VanDerWaalsContact C-N 3.27Å; M822-R824 PolarHBondContact O-N 2.87Å; M822-V825 PolarHBondContact O-N 3.25Å; M822-V826 VanDerWaalsContact O-CG2 3.32Å; M822-V826 WeakPolarHBondContact O-CG2 3.48Å; M822-V826 PolarHBondContact O-N 2.9Å
823	D	84.2	Confident	76.9	Confident	65 Å²	65	52.2 Å²	52.2	35%	0.348	34%	0.337	S	S	.	.	H	α-helix	trans	-63	-34.5	180	-72.8	-24	0	0	0	112.4	G820 V821 S827	G820-D823 PolarHBondContact O-N 2.98Å; V821-D823 PolarHBondContact O-N 2.81Å; D823-S827 WeakPolarHBondContact O-CB 3.36Å; D823-S827 PolarHBondContact O-N 2.68Å; D823-S827 PolarHBondContact O-OG 2.94Å
824	R	84.4	Confident	77.8	Confident	125 Å²	125	52 Å²	52	47%	0.472	32%	0.318	S	S	.	.	H	α-helix	trans	-72.6	-43.7	175.9	-62.3	177.5	-168.7	174.7	3.3	111.9	E782 G820 V821 M822 V826 S827 Q828	E782-R824 HydrophobicContact CG-CB 4.32Å; E782-R824 WeakPolarHBondContact OE1-CB 3.47Å; E782-R824 WeakPolarHBondContact OE1-CD 3.4Å; G820-R824 WeakPolarHBondContact O-CG 3.46Å; G820-R824 PolarHBondContact O-N 2.84Å; V821-R824 PolarHBondContact O-N 2.9Å; M822-R824 VanDerWaalsContact C-N 3.27Å; M822-R824 PolarHBondContact O-N 2.87Å; R824-V826 VanDerWaalsContact C-N 3.32Å; R824-V826 PolarHBondContact O-N 2.9Å; R824-S827 CarbonylContact O-C 3.57Å; R824-S827 PolarHBondContact O-N 2.81Å; R824-S827 VanDerWaalsContact O-N 3.09Å; R824-Q828 PolarHBondContact O-N 2.8Å
825	V	86.7	Confident	78.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.8	-44.4	174.7	172.6	0	0	0	0	110.8	E782 V785 L808 V821 M822 S827 Q828 L829	E782-V825 HydrophobicContact CG-CG2 4.31Å; V785-V825 HydrophobicContact CG2-CG1 4.11Å; L808-V825 HydrophobicContact CD1-CG1 3.76Å; L808-V825 HydrophobicContact CG-CG1 4.45Å; V821-V825 HydrophobicContact CG1-CG2 4.41Å; V821-V825 WeakPolarHBondContact O-CG2 3.23Å; V821-V825 PolarHBondContact O-N 2.79Å; M822-V825 PolarHBondContact O-N 3.25Å; V825-S827 VanDerWaalsContact C-N 3.34Å; V825-S827 PolarHBondContact O-N 2.94Å; V825-Q828 PolarHBondContact O-N 2.84Å; V825-L829 WeakPolarHBondContact O-CB 3.41Å; V825-L829 PolarHBondContact O-N 3.09Å
826	V	87.4	Confident	79.4	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-60.4	-45.1	173.7	174.5	0	0	0	0	110.8	A809 M822 R824 Q828 L829 L830 D855	A809-V826 HydrophobicContact CB-CG2 3.76Å; M822-V826 VanDerWaalsContact O-CG2 3.32Å; M822-V826 WeakPolarHBondContact O-CG2 3.48Å; M822-V826 PolarHBondContact O-N 2.9Å; R824-V826 VanDerWaalsContact C-N 3.32Å; R824-V826 PolarHBondContact O-N 2.9Å; V826-Q828 VanDerWaalsContact C-N 3.32Å; V826-Q828 PolarHBondContact O-N 2.98Å; V826-L829 PolarHBondContact O-N 3.27Å; V826-L830 HydrophobicContact CG1-CD1 4.32Å; V826-L830 HydrophobicContact CG1-CG 4.42Å; V826-L830 VanDerWaalsContact O-CG 3.26Å; V826-L830 WeakPolarHBondContact O-CG 3.27Å; V826-L830 PolarHBondContact O-N 3.4Å; V826-D855 HydrophobicContact CG1-CB 4.49Å
827	S	88.8	Confident	79.6	Confident	50 Å²	50	42.2 Å²	42.2	35%	0.35	26%	0.261	S	S	.	.	H	α-helix	trans	-63.8	-37.4	179.4	-55.7	0	0	0	0	112.2	R812 D823 R824 V825 L830 A831	R812-S827 PolarHBondContact NH1-OG 3.16Å; R812-S827 PolarHBondContact NH2-OG 3.38Å; D823-S827 WeakPolarHBondContact O-CB 3.36Å; D823-S827 PolarHBondContact O-N 2.68Å; D823-S827 PolarHBondContact O-OG 2.94Å; R824-S827 CarbonylContact O-C 3.57Å; R824-S827 PolarHBondContact O-N 2.81Å; R824-S827 VanDerWaalsContact O-N 3.09Å; V825-S827 VanDerWaalsContact C-N 3.34Å; V825-S827 PolarHBondContact O-N 2.94Å; S827-L830 PolarHBondContact O-N 2.89Å; S827-A831 PolarHBondContact O-N 3.49Å
828	Q	89.8	Confident	79.5	Confident	23 Å²	23	42.3 Å²	42.3	11%	0.107	27%	0.268	C	S	.	.	H	α-helix	trans	-67.8	-43	174	-174.6	59.4	40.7	0	0	111.7	E782 V785 R786 R824 V825 V826 L830 A831 E832	E782-Q828 HydrophobicContact CB-CG 4.48Å; V785-Q828 HydrophobicContact CB-CG 4.44Å; V785-Q828 HydrophobicContact CG1-CG 4.26Å; R786-Q828 HydrophobicContact CG-CG 4.21Å; R786-Q828 VanDerWaalsContact NE-CD 3.3Å; R824-Q828 PolarHBondContact O-N 2.8Å; V825-Q828 PolarHBondContact O-N 2.84Å; V826-Q828 VanDerWaalsContact C-N 3.32Å; V826-Q828 PolarHBondContact O-N 2.98Å; Q828-L830 VanDerWaalsContact C-N 3.3Å; Q828-L830 PolarHBondContact O-N 3.34Å; Q828-A831 PolarHBondContact O-N 3.34Å; Q828-E832 PolarHBondContact NE2-OE1 2.77Å; Q828-E832 WeakPolarHBondContact O-CG 3.28Å; Q828-E832 PolarHBondContact O-N 2.65Å
829	L	89.1	Confident	79.6	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-59	-42.7	174.9	179.6	64.1	0	0	0	111.3	V785 F789 F802 L805 L808 V825 V826 E832 L833 L858	V785-L829 HydrophobicContact CG1-CD1 4.46Å; F789-L829 HydrophobicContact CE2-CD1 3.61Å; F789-L829 HydrophobicContact CZ-CD1 3.69Å; F802-L829 HydrophobicContact CE2-CD1 4.32Å; F802-L829 HydrophobicContact CZ-CD1 4.05Å; L805-L829 HydrophobicContact CD1-CD2 4.2Å; L808-L829 HydrophobicContact CD2-CD2 3.96Å; V825-L829 WeakPolarHBondContact O-CB 3.41Å; V825-L829 PolarHBondContact O-N 3.09Å; V826-L829 PolarHBondContact O-N 3.27Å; L829-E832 PolarHBondContact O-N 3.35Å; L829-L833 HydrophobicContact CG-CD1 4.26Å; L829-L833 VanDerWaalsContact O-CG 3.28Å; L829-L833 WeakPolarHBondContact O-CG 3.33Å; L829-L833 PolarHBondContact O-N 2.8Å; L829-L858 HydrophobicContact CD2-CD2 4.23Å
830	L	88.6	Confident	79.3	Confident	13 Å²	13	41.8 Å²	41.8	7%	0.068	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-43.3	175.1	-67.2	-179.3	0	0	0	112	V826 S827 Q828 L833 D834 A857 L858 R863	V826-L830 HydrophobicContact CG1-CD1 4.32Å; V826-L830 HydrophobicContact CG1-CG 4.42Å; V826-L830 VanDerWaalsContact O-CG 3.26Å; V826-L830 WeakPolarHBondContact O-CG 3.27Å; V826-L830 PolarHBondContact O-N 3.4Å; S827-L830 PolarHBondContact O-N 2.89Å; Q828-L830 VanDerWaalsContact C-N 3.3Å; Q828-L830 PolarHBondContact O-N 3.34Å; L830-L833 PolarHBondContact O-N 2.95Å; L830-D834 WeakPolarHBondContact O-CB 3.49Å; L830-D834 PolarHBondContact O-N 3.14Å; L830-A857 HydrophobicContact CD1-CB 3.92Å; L830-L858 HydrophobicContact CD2-CD2 3.36Å; L830-L858 HydrophobicContact CD2-CG 3.93Å; L830-L858 HydrophobicContact CG-CD2 4.48Å; L830-R863 VanDerWaalsContact CD2-NH1 3.33Å
831	A	88.1	Confident	79.1	Confident	52 Å²	52	44.2 Å²	44.2	43%	0.43	25%	0.249	S	C	.	.	H	α-helix	trans	-63.4	-40	177.9	0	0	0	0	0	112.3	S827 Q828 D834 G835	S827-A831 PolarHBondContact O-N 3.49Å; Q828-A831 PolarHBondContact O-N 3.34Å; A831-D834 PolarHBondContact O-N 3.28Å; A831-G835 PolarHBondContact O-N 3.05Å
832	E	87.6	Confident	79.3	Confident	23 Å²	23	43.5 Å²	43.5	11%	0.107	24%	0.244	C	C	.	.	H	α-helix	trans	-67.8	-43.4	175.9	-69.2	-63.9	151.3	0	0	112.1	V785 F789 R793 Q828 L829 D834 G835 L836	V785-E832 HydrophobicContact CG1-CG 4.41Å; F789-E832 HydrophobicContact CB-CB 4.39Å; F789-E832 HydrophobicContact CB-CG 4.28Å; F789-E832 WeakPolarHBondContact CB-OE2 3.3Å; F789-E832 HydrophobicContact CD1-CB 4.07Å; F789-E832 HydrophobicContact CD2-CB 3.49Å; F789-E832 VanDerWaalsContact CD2-CB 3.49Å; F789-E832 HydrophobicContact CD2-CG 3.63Å; F789-E832 HydrophobicContact CE1-CB 4.18Å; F789-E832 HydrophobicContact CE2-CB 3.63Å; F789-E832 HydrophobicContact CE2-CG 4.13Å; F789-E832 HydrophobicContact CG-CB 3.73Å; F789-E832 HydrophobicContact CG-CG 4.02Å; F789-E832 HydrophobicContact CZ-CB 3.97Å; R793-E832 IonicContact CZ-OE2 2.81Å; R793-E832 IonicContact NH1-OE2 3.47Å; R793-E832 PolarHBondContact NH1-OE2 3.16Å; R793-E832 IonicContact NH2-OE2 3.13Å; R793-E832 PolarHBondContact NH2-OE2 2.96Å; Q828-E832 PolarHBondContact NE2-OE1 2.77Å; Q828-E832 WeakPolarHBondContact O-CG 3.28Å; Q828-E832 PolarHBondContact O-N 2.65Å; L829-E832 PolarHBondContact O-N 3.35Å; E832-D834 VanDerWaalsContact C-N 3.31Å; E832-D834 PolarHBondContact O-N 2.73Å; E832-G835 WeakPolarHBondContact O-CA 3.5Å; E832-G835 PolarHBondContact O-N 3.32Å; E832-L836 WeakPolarHBondContact O-CG 3.32Å; E832-L836 PolarHBondContact O-N 3.23Å
833	L	86.3	Confident	79.6	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-41.5	174.8	-69.9	173.7	0	0	0	111.6	F789 L829 L830 G835 L836 H837 V844 L858 R863 F864	F789-L833 HydrophobicContact CE1-CD2 4.24Å; F789-L833 HydrophobicContact CZ-CD2 4.15Å; F789-L833 HydrophobicContact CZ-CG 4.46Å; L829-L833 HydrophobicContact CG-CD1 4.26Å; L829-L833 VanDerWaalsContact O-CG 3.28Å; L829-L833 WeakPolarHBondContact O-CG 3.33Å; L829-L833 PolarHBondContact O-N 2.8Å; L830-L833 PolarHBondContact O-N 2.95Å; L833-G835 VanDerWaalsContact C-N 3.29Å; L833-G835 PolarHBondContact O-N 2.84Å; L833-L836 HydrophobicContact CD2-CD1 4.48Å; L833-L836 PolarHBondContact O-N 2.87Å; L833-H837 PolarHBondContact O-CE1 3.4Å; L833-H837 VanDerWaalsContact O-CE1 3.23Å; L833-H837 PolarHBondContact O-ND1 2.93Å; L833-H837 VanDerWaalsContact O-ND1 3.14Å; L833-V844 HydrophobicContact CD2-CB 4.2Å; L833-V844 HydrophobicContact CD2-CG1 4.08Å; L833-V844 HydrophobicContact CD2-CG2 3.85Å; L833-L858 HydrophobicContact CD1-CD2 3.79Å; L833-R863 HydrophobicContact CB-CG 4.36Å; L833-R863 HydrophobicContact CD1-CB 4.49Å; L833-F864 HydrophobicContact CD1-CE2 4.16Å
834	D	83.2	Confident	79.8	Confident	72 Å²	72	40.3 Å²	40.3	39%	0.385	23%	0.227	S	C	.	.	H	α-helix	trans	-67.6	-30.5	175	-65.2	-16.3	0	0	0	111.3	L830 A831 E832 H837 R863	L830-D834 WeakPolarHBondContact O-CB 3.49Å; L830-D834 PolarHBondContact O-N 3.14Å; A831-D834 PolarHBondContact O-N 3.28Å; E832-D834 VanDerWaalsContact C-N 3.31Å; E832-D834 PolarHBondContact O-N 2.73Å; D834-H837 VanDerWaalsContact C-ND1 3.31Å; D834-H837 WeakPolarHBondContact CA-ND1 3.13Å; D834-H837 PolarHBondContact O-ND1 2.97Å; D834-R863 IonicContact OD1-CZ 3.89Å; D834-R863 IonicContact OD1-NE 2.82Å; D834-R863 PolarHBondContact OD1-NE 2.97Å; D834-R863 IonicContact OD1-NH2 2.77Å; D834-R863 PolarHBondContact OD1-NH2 3.23Å; D834-R863 IonicContact OD2-CZ 2.75Å; D834-R863 IonicContact OD2-NE 2.86Å; D834-R863 IonicContact OD2-NH2 3.64Å; D834-R863 PolarHBondContact OD2-NH2 3.14Å
835	G	78.2	Confident	80.2	Confident	35 Å²	35	34.5 Å²	34.5	36%	0.361	21%	0.205	S	C	.	.	H	α-helix	trans	-73	-28.2	175.5	0	0	0	0	0	114.9	A831 E832 L833 H837 S838	A831-G835 PolarHBondContact O-N 3.05Å; E832-G835 WeakPolarHBondContact O-CA 3.5Å; E832-G835 PolarHBondContact O-N 3.32Å; L833-G835 VanDerWaalsContact C-N 3.29Å; L833-G835 PolarHBondContact O-N 2.84Å; G835-H837 PolarHBondContact O-N 2.87Å; G835-S838 PolarHBondContact O-N 3.4Å; G835-S838 PolarHBondContact O-OG 3.36Å
836	L	71.6	Confident	80.4	Confident	10 Å²	10	34.5 Å²	34.5	5%	0.052	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-64.9	-19.7	-179.3	-75.2	-177	0	0	0	114	F789 R793 E832 L833 S838 T839 V842 V844	F789-L836 HydrophobicContact CD1-CD1 3.88Å; F789-L836 HydrophobicContact CD1-CD2 4.22Å; F789-L836 HydrophobicContact CD1-CG 4.17Å; F789-L836 HydrophobicContact CE1-CD1 3.62Å; F789-L836 HydrophobicContact CE1-CG 4.29Å; R793-L836 HydrophobicContact CG-CD2 4.44Å; E832-L836 WeakPolarHBondContact O-CG 3.32Å; E832-L836 PolarHBondContact O-N 3.23Å; L833-L836 HydrophobicContact CD2-CD1 4.48Å; L833-L836 PolarHBondContact O-N 2.87Å; L836-S838 PolarHBondContact O-N 3.04Å; L836-T839 PolarHBondContact O-N 2.75Å; L836-T839 VanDerWaalsContact O-O 3.05Å; L836-T839 PolarHBondContact O-OG1 2.91Å; L836-V842 HydrophobicContact CD1-CG1 4.06Å; L836-V842 HydrophobicContact CD2-CB 3.99Å; L836-V842 HydrophobicContact CD2-CG1 3.9Å; L836-V842 HydrophobicContact CD2-CG2 4.46Å; L836-V844 HydrophobicContact CD1-CG2 3.47Å; L836-V844 VanDerWaalsContact CD1-CG2 3.47Å
837	H	61	Low	80.7	Confident	60 Å²	60	34.4 Å²	34.4	28%	0.278	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-58.5	-18.6	177.5	-62.8	82.3	0	0	0	114.6	R736 S738 L833 D834 G835 G862	R736-H837 PolarHBondContact NH1-O 3.29Å; S738-H837 PolarHBondContact OG-CD2 3.3Å; S738-H837 VanDerWaalsContact OG-CD2 3.28Å; S738-H837 PolarHBondContact OG-NE2 3.36Å; L833-H837 PolarHBondContact O-CE1 3.4Å; L833-H837 VanDerWaalsContact O-CE1 3.23Å; L833-H837 PolarHBondContact O-ND1 2.93Å; L833-H837 VanDerWaalsContact O-ND1 3.14Å; D834-H837 VanDerWaalsContact C-ND1 3.31Å; D834-H837 WeakPolarHBondContact CA-ND1 3.13Å; D834-H837 PolarHBondContact O-ND1 2.97Å; G835-H837 PolarHBondContact O-N 2.87Å; H837-G862 PolarHBondContact CE1-O 3.01Å; H837-G862 WeakPolarHBondContact NE2-CA 3.34Å; H837-G862 PolarHBondContact NE2-O 2.99Å
838	S	58.1	Low	80.8	Confident	94 Å²	94	32.1 Å²	32.1	66%	0.657	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-86.3	-22.7	177.7	64.1	0	0	0	0	113.7	G835 L836	G835-S838 PolarHBondContact O-N 3.4Å; G835-S838 PolarHBondContact O-OG 3.36Å; L836-S838 PolarHBondContact O-N 3.04Å
839	T	57.8	Low	80.8	Confident	55 Å²	55	33 Å²	33	34%	0.337	19%	0.194	S	C	.	.			trans	-109.1	116	-174.9	23	0	0	0	0	109.7	L836 D841	L836-T839 PolarHBondContact O-N 2.75Å; L836-T839 VanDerWaalsContact O-O 3.05Å; L836-T839 PolarHBondContact O-OG1 2.91Å; T839-D841 PolarHBondContact O-N 2.72Å
840	Q	59.4	Low	80.7	Confident	117 Å²	117	39.4 Å²	39.4	55%	0.547	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-8.3	-164.6	-66	-178.9	1.4	0	0	114.9
841	D	72.7	Confident	80.6	Confident	78 Å²	78	39 Å²	39	42%	0.417	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	7.8	-159.2	-60.7	-30.8	0	0	0	114.6	A796 P797 C798 T839	A796-D841 HydrophobicContact CB-CB 3.85Å; P797-D841 VanDerWaalsContact CA-O 3.26Å; P797-D841 WeakPolarHBondContact CA-O 3.39Å; P797-D841 HydrophobicContact CB-CB 4.11Å; C798-D841 PolarHBondContact N-O 3.34Å; T839-D841 PolarHBondContact O-N 2.72Å
842	V	81.9	Confident	80.5	Confident	12 Å²	12	39.5 Å²	39.5	7%	0.073	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119.6	-179.6	-179.6	0	0	0	0	110.5	A792 R793 A796 I800 L836	A792-V842 HydrophobicContact CB-CG1 4.34Å; R793-V842 HydrophobicContact CG-CG2 4.38Å; A796-V842 HydrophobicContact CB-CG2 4.34Å; I800-V842 HydrophobicContact CD1-CG1 3.82Å; I800-V842 HydrophobicContact CG1-CG1 4.06Å; L836-V842 HydrophobicContact CD1-CG1 4.06Å; L836-V842 HydrophobicContact CD2-CB 3.99Å; L836-V842 HydrophobicContact CD2-CG1 3.9Å; L836-V842 HydrophobicContact CD2-CG2 4.46Å
843	F	86.3	Confident	80.4	Confident	20 Å²	20	40.9 Å²	40.9	9%	0.088	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	140.2	177.8	-61.8	-83.9	0	0	0	111.1	P724 L725 C798 I799 I800	P724-F843 HydrophobicContact CB-CE1 4Å; P724-F843 HydrophobicContact CB-CZ 3.83Å; P724-F843 HydrophobicContact CG-CE1 4.12Å; P724-F843 HydrophobicContact CG-CZ 4.41Å; L725-F843 HydrophobicContact CD1-CE2 4.45Å; L725-F843 HydrophobicContact CD2-CE2 3.96Å; L725-F843 HydrophobicContact CD2-CZ 4.37Å; L725-F843 HydrophobicContact CG-CE2 4.16Å; L725-F843 HydrophobicContact CG-CZ 4.29Å; C798-F843 PolarHBondContact O-N 2.91Å; I799-F843 CarbonylContact C-O 3.53Å; I799-F843 WeakPolarHBondContact CA-O 3.4Å; I799-F843 HydrophobicContact CG1-CB 4.19Å; I800-F843 PolarHBondContact N-O 3.24Å
844	V	89.8	Confident	80.5	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.2	177.7	-173.2	0	0	0	0	111	G739 L740 F789 I800 F802 L833 L836 F864	G739-V844 CarbonylContact C-O 3.59Å; G739-V844 WeakPolarHBondContact CA-O 3.49Å; L740-V844 PolarHBondContact N-O 2.97Å; F789-V844 HydrophobicContact CE1-CG2 4.27Å; I800-V844 HydrophobicContact CB-CG2 4.48Å; I800-V844 HydrophobicContact CD1-CG2 4.42Å; I800-V844 CarbonylContact O-C 3.54Å; I800-V844 WeakPolarHBondContact O-CA 3.34Å; F802-V844 HydrophobicContact CD2-CG1 3.64Å; F802-V844 HydrophobicContact CE2-CG1 3.65Å; L833-V844 HydrophobicContact CD2-CB 4.2Å; L833-V844 HydrophobicContact CD2-CG1 4.08Å; L833-V844 HydrophobicContact CD2-CG2 3.85Å; L836-V844 HydrophobicContact CD1-CG2 3.47Å; L836-V844 VanDerWaalsContact CD1-CG2 3.47Å; V844-F864 HydrophobicContact CG1-CE1 3.95Å; V844-F864 HydrophobicContact CG1-CZ 4.05Å
845	I	91.4	Very high	80.7	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.015	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	117.2	172.3	-57.3	179.5	0	0	0	108.4	I721 L740 L742 A754 I799 I800 F801 F802	I721-I845 HydrophobicContact CD1-CD1 3.96Å; L740-I845 HydrophobicContact CB-CG1 4.48Å; L740-I845 HydrophobicContact CD2-CG2 4.19Å; L740-I845 CarbonylContact O-C 3.55Å; L740-I845 VanDerWaalsContact O-CA 3.27Å; L740-I845 WeakPolarHBondContact O-CA 3.12Å; L742-I845 HydrophobicContact CD1-CG2 3.9Å; L742-I845 HydrophobicContact CG-CG2 4.05Å; A754-I845 HydrophobicContact CB-CD1 4.49Å; A754-I845 HydrophobicContact CB-CG2 4.32Å; I799-I845 HydrophobicContact CG2-CB 4.45Å; I799-I845 HydrophobicContact CG2-CD1 3.68Å; I799-I845 HydrophobicContact CG2-CG1 3.9Å; I800-I845 PolarHBondContact O-N 2.79Å; F801-I845 CarbonylContact C-O 3.58Å; F801-I845 VanDerWaalsContact CA-O 3.26Å; F801-I845 WeakPolarHBondContact CA-O 3.21Å; F801-I845 HydrophobicContact CD2-CB 3.97Å; F801-I845 HydrophobicContact CD2-CG2 3.71Å; F801-I845 HydrophobicContact CE2-CG2 3.99Å; F802-I845 PolarHBondContact N-O 2.89Å
846	G	92.3	Very high	81	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	143.1	170.4	0	0	0	0	0	110.8	L740 L741 L742 F802	L740-G846 PolarHBondContact O-N 2.86Å; L741-G846 CarbonylContact C-O 3.56Å; L741-G846 WeakPolarHBondContact CA-O 3.43Å; L742-G846 PolarHBondContact N-O 3.03Å; F802-G846 CarbonylContact O-C 3.31Å
847	A	92.9	Very high	81.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.8	167.5	0	0	0	0	0	110.4	L742 K750 F801 F802 E804 L805	L742-A847 HydrophobicContact CB-CB 4.44Å; L742-A847 WeakPolarHBondContact O-CA 3.42Å; K750-A847 HydrophobicContact CB-CB 4.3Å; F801-A847 HydrophobicContact CE2-CB 3.73Å; F801-A847 HydrophobicContact CZ-CB 3.56Å; F802-A847 PolarHBondContact O-N 2.88Å; E804-A847 PolarHBondContact N-O 3.12Å; L805-A847 PolarHBondContact N-O 3.46Å
848	T	91.1	Very high	83	Confident	1 Å²	1	38 Å²	38	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	144.5	174.3	-176.1	0	0	0	0	111.7	L741 L742 H743 G744 D806 R850 P851	L741-T848 HydrophobicContact CD1-CG2 4.11Å; L741-T848 HydrophobicContact CG-CG2 4.45Å; L742-T848 PolarHBondContact O-N 3.49Å; H743-T848 WeakPolarHBondContact CA-O 2.96Å; H743-T848 HydrophobicContact CB-CG2 3.88Å; G744-T848 PolarHBondContact N-O 2.63Å; D806-T848 WeakPolarHBondContact CB-OG1 2.96Å; D806-T848 VanDerWaalsContact CG-OG1 3.24Å; D806-T848 PolarHBondContact OD1-OG1 2.94Å; T848-R850 PolarHBondContact OG1-N 3.31Å; T848-P851 HydrophobicContact CG2-CB 4.11Å
849	N	90.3	Very high	84.2	Confident	42 Å²	42	35.4 Å²	35.4	23%	0.225	18%	0.183	C	C	.	.	S	Bend	trans	-87.6	-22.9	169.1	-64	-47.3	0	0	0	111.4	K750 Y970	K750-N849 WeakPolarHBondContact CE-OD1 3.4Å; K750-N849 PolarHBondContact NZ-OD1 3.21Å; N849-Y970 WeakPolarHBondContact O-CE1 3.48Å; N849-Y970 PolarHBondContact O-OH 3.37Å; N849-Y970 VanDerWaalsContact O-OH 3.12Å
850	R	87	Confident	85.6	Confident	136 Å²	136	40.5 Å²	40.5	51%	0.513	20%	0.196	S	C	.	.			trans	-131.7	78.1	-172.6	-67.1	-172.8	176.5	178	1.1	111.3	T848 D852 L853	T848-R850 PolarHBondContact OG1-N 3.31Å; R850-D852 WeakPolarHBondContact CA-OD1 3.33Å; R850-D852 WeakPolarHBondContact CB-OD1 3.34Å; R850-D852 PolarHBondContact O-N 3.19Å; R850-D852 VanDerWaalsContact O-N 3.11Å; R850-L853 HydrophobicContact CB-CB 4.39Å; R850-L853 HydrophobicContact CB-CD1 3.96Å; R850-L853 HydrophobicContact CB-CG 4.07Å; R850-L853 HydrophobicContact CG-CD1 4.41Å; R850-L853 PolarHBondContact O-N 2.99Å; R850-L853 VanDerWaalsContact O-N 3.11Å
851	P	86.6	Confident	86.4	Confident	5 Å²	5	40.9 Å²	40.9	3%	0.032	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.5	178.5	30.2	-37.8	0	0	0	113.1	H743 T848 L853 I973 F977	H743-P851 HydrophobicContact CB-CB 4.21Å; H743-P851 HydrophobicContact CB-CG 4.16Å; T848-P851 HydrophobicContact CG2-CB 4.11Å; P851-L853 VanDerWaalsContact C-N 3.31Å; P851-I973 HydrophobicContact CG-CG2 3.81Å; P851-F977 HydrophobicContact CB-CE2 3.89Å; P851-F977 HydrophobicContact CB-CZ 4.21Å; P851-F977 HydrophobicContact CG-CE2 4.09Å
852	D	85.2	Confident	86.5	Confident	62 Å²	62	38.1 Å²	38.1	33%	0.332	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-14.9	175.1	57.1	-38.5	0	0	0	114.3	R850 R969	R850-D852 WeakPolarHBondContact CA-OD1 3.33Å; R850-D852 WeakPolarHBondContact CB-OD1 3.34Å; R850-D852 PolarHBondContact O-N 3.19Å; R850-D852 VanDerWaalsContact O-N 3.11Å; D852-R969 IonicContact OD2-CZ 3.03Å; D852-R969 IonicContact OD2-NH2 3.96Å; D852-R969 PolarHBondContact OD2-NH2 2.89Å
853	L	85.3	Confident	86.6	Confident	51 Å²	51	39.1 Å²	39.1	27%	0.267	20%	0.201	S	C	.	.	S	Bend	trans	-96.8	-11.1	176.5	-63.2	-177.5	0	0	0	113.3	P810 S811 R850 P851	P810-L853 CarbonylContact C-O 3.59Å; P810-L853 WeakPolarHBondContact CA-O 3.44Å; S811-L853 PolarHBondContact N-O 2.98Å; R850-L853 HydrophobicContact CB-CB 4.39Å; R850-L853 HydrophobicContact CB-CD1 3.96Å; R850-L853 HydrophobicContact CB-CG 4.07Å; R850-L853 HydrophobicContact CG-CD1 4.41Å; R850-L853 PolarHBondContact O-N 2.99Å; R850-L853 VanDerWaalsContact O-N 3.11Å; P851-L853 VanDerWaalsContact C-N 3.31Å
854	L	87.6	Confident	86.6	Confident	9 Å²	9	38.3 Å²	38.3	5%	0.047	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-73.5	146.8	-175.6	-162	105.9	0	0	0	111.9	L741 L805 P856 L858 L859	L741-L854 HydrophobicContact CD2-CD2 4.27Å; L805-L854 HydrophobicContact CB-CD1 4.26Å; L805-L854 HydrophobicContact CD2-CD1 3.72Å; L805-L854 HydrophobicContact CG-CD1 3.78Å; L854-P856 WeakPolarHBondContact O-CD 3.14Å; L854-L858 HydrophobicContact CD1-CD1 4.12Å; L854-L858 HydrophobicContact CD2-CB 3.78Å; L854-L858 HydrophobicContact CD2-CD1 3.94Å; L854-L858 HydrophobicContact CG-CD1 3.9Å; L854-L859 HydrophobicContact CD2-CD1 4.5Å; L854-L859 HydrophobicContact CD2-CD2 3.84Å; L854-L859 HydrophobicContact CD2-CG 3.97Å
855	D	87.8	Confident	86.1	Confident	11 Å²	11	40.6 Å²	40.6	6%	0.059	21%	0.21	C	C	.	.			trans	-62.5	120.6	169.6	-172.9	-13.1	0	0	0	110.5	A809 R812 V826 A857 L858	A809-D855 PolarHBondContact O-N 2.86Å; A809-D855 VanDerWaalsContact O-N 3.15Å; R812-D855 IonicContact CZ-OD2 3.78Å; R812-D855 IonicContact NE-OD2 3.71Å; R812-D855 PolarHBondContact NE-OD2 3.36Å; V826-D855 HydrophobicContact CG1-CB 4.49Å; D855-A857 PolarHBondContact O-N 3.17Å; D855-A857 VanDerWaalsContact OD1-CB 3.29Å; D855-A857 WeakPolarHBondContact OD1-CB 3.32Å; D855-A857 PolarHBondContact OD1-N 2.92Å; D855-L858 WeakPolarHBondContact O-CB 3.36Å; D855-L858 PolarHBondContact O-N 3.39Å
856	P	86	Confident	85.7	Confident	89 Å²	89	43.6 Å²	43.6	58%	0.578	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-60.3	-17	177.3	26.2	-36.7	0	0	0	113.5	L854 L858 L859	L854-P856 WeakPolarHBondContact O-CD 3.14Å; P856-L858 PolarHBondContact O-N 2.92Å; P856-L859 PolarHBondContact O-N 2.93Å
857	A	86.9	Confident	85.4	Confident	12 Å²	12	46.1 Å²	46.1	10%	0.099	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-60.1	-30.3	172.9	0	0	0	0	0	112.7	L830 D855 L859 R863	L830-A857 HydrophobicContact CD1-CB 3.92Å; D855-A857 PolarHBondContact O-N 3.17Å; D855-A857 VanDerWaalsContact OD1-CB 3.29Å; D855-A857 WeakPolarHBondContact OD1-CB 3.32Å; D855-A857 PolarHBondContact OD1-N 2.92Å; A857-L859 VanDerWaalsContact C-N 3.29Å; A857-L859 PolarHBondContact O-N 3.38Å; A857-R863 WeakPolarHBondContact O-CD 3.38Å; A857-R863 PolarHBondContact O-NH1 3.13Å
858	L	85.9	Confident	85.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-71.4	-24.7	178	-74.4	169.8	0	0	0	113.1	L805 A809 L829 L830 L833 L854 D855 P856 R860 R863 F864	L805-L858 HydrophobicContact CD2-CD1 4.44Å; A809-L858 HydrophobicContact CB-CD1 3.39Å; L829-L858 HydrophobicContact CD2-CD2 4.23Å; L830-L858 HydrophobicContact CD2-CD2 3.36Å; L830-L858 HydrophobicContact CD2-CG 3.93Å; L830-L858 HydrophobicContact CG-CD2 4.48Å; L833-L858 HydrophobicContact CD1-CD2 3.79Å; L854-L858 HydrophobicContact CD1-CD1 4.12Å; L854-L858 HydrophobicContact CD2-CB 3.78Å; L854-L858 HydrophobicContact CD2-CD1 3.94Å; L854-L858 HydrophobicContact CG-CD1 3.9Å; D855-L858 WeakPolarHBondContact O-CB 3.36Å; D855-L858 PolarHBondContact O-N 3.39Å; P856-L858 PolarHBondContact O-N 2.92Å; L858-R860 VanDerWaalsContact C-N 3.29Å; L858-R860 PolarHBondContact O-N 3.32Å; L858-R863 WeakPolarHBondContact O-CB 3.43Å; L858-F864 HydrophobicContact CB-CD2 4.06Å; L858-F864 HydrophobicContact CB-CE2 4.44Å; L858-F864 HydrophobicContact CD2-CD2 4.38Å; L858-F864 HydrophobicContact CD2-CE2 4.07Å; L858-F864 WeakPolarHBondContact O-CD2 3.15Å; L858-F864 PolarHBondContact O-N 3.05Å
859	L	85	Confident	85.1	Confident	39 Å²	39	48.2 Å²	48.2	20%	0.204	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-87.7	3.3	-177.9	-57.3	-178.7	0	0	0	113.3	L741 L854 P856 A857 L867 F977	L741-L859 HydrophobicContact CD2-CD2 3.51Å; L854-L859 HydrophobicContact CD2-CD1 4.5Å; L854-L859 HydrophobicContact CD2-CD2 3.84Å; L854-L859 HydrophobicContact CD2-CG 3.97Å; P856-L859 PolarHBondContact O-N 2.93Å; A857-L859 VanDerWaalsContact C-N 3.29Å; A857-L859 PolarHBondContact O-N 3.38Å; L859-L867 HydrophobicContact CD2-CD1 4.5Å; L859-L867 HydrophobicContact CD2-CD2 3.86Å; L859-L867 HydrophobicContact CD2-CG 4.41Å; L859-F977 HydrophobicContact CD1-CD1 4.18Å; L859-F977 HydrophobicContact CD1-CE1 3.44Å; L859-F977 VanDerWaalsContact CD1-CE1 3.44Å; L859-F977 HydrophobicContact CD1-CZ 4.21Å
860	R	85.3	Confident	85	Confident	161 Å²	161	46.2 Å²	46.2	61%	0.608	24%	0.235	S	C	*	.	S	Bend	trans	-73.4	145.7	178.3	-67.6	-176	-178.8	-177.6	1	110.3	L858 G862 R863	L858-R860 VanDerWaalsContact C-N 3.29Å; L858-R860 PolarHBondContact O-N 3.32Å; R860-G862 PolarHBondContact O-N 2.9Å; R860-R863 PolarHBondContact O-N 3.35Å; R860-R863 VanDerWaalsContact O-N 3.14Å
861	P	77.1	Confident	84.8	Confident	125 Å²	125	40.3 Å²	40.3	81%	0.812	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	137.7	172.8	-23.7	32.9	0	0	0	111.6	D865	P861-D865 WeakPolarHBondContact CA-OD1 3.32Å
862	G	74.3	Confident	84.5	Confident	20 Å²	20	41 Å²	41	21%	0.206	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	98	-9.9	-167.7	0	0	0	0	0	113.9	S738 H837 R860 D865	S738-G862 WeakPolarHBondContact CB-O 3.42Å; S738-G862 PolarHBondContact OG-O 3.45Å; H837-G862 PolarHBondContact CE1-O 3.01Å; H837-G862 WeakPolarHBondContact NE2-CA 3.34Å; H837-G862 PolarHBondContact NE2-O 2.99Å; R860-G862 PolarHBondContact O-N 2.9Å; G862-D865 WeakPolarHBondContact CA-OD1 3.47Å; G862-D865 PolarHBondContact N-OD1 3.33Å
863	R	85.6	Confident	84.1	Confident	33 Å²	33	39.1 Å²	39.1	13%	0.125	21%	0.214	C	C	.	.	S	Bend	trans	-119.6	-101.1	-177	-63.7	168.6	-178.8	174.9	-4.5	109.8	S738 G739 L830 L833 D834 A857 L858 R860 D865	S738-R863 CarbonylContact C-O 3.59Å; G739-R863 VanDerWaalsContact CA-O 3.31Å; G739-R863 WeakPolarHBondContact CA-O 3.37Å; G739-R863 PolarHBondContact N-O 3.15Å; L830-R863 VanDerWaalsContact CD2-NH1 3.33Å; L833-R863 HydrophobicContact CB-CG 4.36Å; L833-R863 HydrophobicContact CD1-CB 4.49Å; D834-R863 IonicContact OD1-CZ 3.89Å; D834-R863 IonicContact OD1-NE 2.82Å; D834-R863 PolarHBondContact OD1-NE 2.97Å; D834-R863 IonicContact OD1-NH2 2.77Å; D834-R863 PolarHBondContact OD1-NH2 3.23Å; D834-R863 IonicContact OD2-CZ 2.75Å; D834-R863 IonicContact OD2-NE 2.86Å; D834-R863 IonicContact OD2-NH2 3.64Å; D834-R863 PolarHBondContact OD2-NH2 3.14Å; A857-R863 WeakPolarHBondContact O-CD 3.38Å; A857-R863 PolarHBondContact O-NH1 3.13Å; L858-R863 WeakPolarHBondContact O-CB 3.43Å; R860-R863 PolarHBondContact O-N 3.35Å; R860-R863 VanDerWaalsContact O-N 3.14Å; R863-D865 PolarHBondContact N-OD1 2.89Å; R863-D865 PolarHBondContact O-N 3Å
864	F	86.1	Confident	83.3	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.013	23%	0.228	C	C	.	.	S	Bend	trans	-89.3	81.3	168.2	-68.3	-70.4	0	0	0	110	L741 L805 L833 V844 L858 K866	L741-F864 HydrophobicContact CB-CB 4.06Å; L741-F864 HydrophobicContact CB-CD1 4.01Å; L741-F864 HydrophobicContact CB-CG 4.1Å; L805-F864 HydrophobicContact CD2-CD2 4.46Å; L805-F864 HydrophobicContact CD2-CE2 3.63Å; L805-F864 HydrophobicContact CD2-CZ 3.78Å; L833-F864 HydrophobicContact CD1-CE2 4.16Å; V844-F864 HydrophobicContact CG1-CE1 3.95Å; V844-F864 HydrophobicContact CG1-CZ 4.05Å; L858-F864 HydrophobicContact CB-CD2 4.06Å; L858-F864 HydrophobicContact CB-CE2 4.44Å; L858-F864 HydrophobicContact CD2-CD2 4.38Å; L858-F864 HydrophobicContact CD2-CE2 4.07Å; L858-F864 WeakPolarHBondContact O-CD2 3.15Å; L858-F864 PolarHBondContact O-N 3.05Å; F864-K866 VanDerWaalsContact C-N 3.28Å; F864-K866 PolarHBondContact O-N 3.38Å
865	D	77.9	Confident	83	Confident	50 Å²	50	46.9 Å²	46.9	27%	0.267	25%	0.252	S	S	.	.			trans	-68	-29	-176.4	-61.5	-31.3	0	0	0	113.1	R737 S738 G739 P861 G862 R863	R737-D865 WeakPolarHBondContact CA-OD2 3.43Å; S738-D865 PolarHBondContact N-OD2 3.41Å; G739-D865 PolarHBondContact O-N 2.91Å; G739-D865 VanDerWaalsContact O-N 3.12Å; P861-D865 WeakPolarHBondContact CA-OD1 3.32Å; G862-D865 WeakPolarHBondContact CA-OD1 3.47Å; G862-D865 PolarHBondContact N-OD1 3.33Å; R863-D865 PolarHBondContact N-OD1 2.89Å; R863-D865 PolarHBondContact O-N 3Å
866	K	82.9	Confident	82.8	Confident	66 Å²	66	51 Å²	51	29%	0.287	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	114.7	-174.6	-78.6	-66	-163.1	158.3	0	111.4	E716 G739 L740 L741 F864	E716-K866 IonicContact OE1-NZ 2.88Å; E716-K866 PolarHBondContact OE1-NZ 2.91Å; G739-K866 PolarHBondContact O-N 3.12Å; L740-K866 CarbonylContact C-O 3.59Å; L740-K866 WeakPolarHBondContact CA-O 3.49Å; L740-K866 HydrophobicContact CD1-CB 4.1Å; L741-K866 PolarHBondContact N-O 3.08Å; F864-K866 VanDerWaalsContact C-N 3.28Å; F864-K866 PolarHBondContact O-N 3.38Å
867	L	87.1	Confident	82.8	Confident	54 Å²	54	49.9 Å²	49.9	28%	0.283	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.4	171	-70.5	121.5	0	0	0	109.7	L741 L859 F977	L741-L867 HydrophobicContact CD2-CD2 3.89Å; L859-L867 HydrophobicContact CD2-CD1 4.5Å; L859-L867 HydrophobicContact CD2-CD2 3.86Å; L859-L867 HydrophobicContact CD2-CG 4.41Å; L867-F977 HydrophobicContact CD2-CD1 4.45Å
868	V	88.7	Confident	82.7	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.012	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.9	179.7	-178.3	0	0	0	0	109.7	V713 E716 L740 L741 L742 H743	V713-V868 HydrophobicContact CB-CG1 4.2Å; V713-V868 HydrophobicContact CG1-CG1 3.67Å; V713-V868 HydrophobicContact CG2-CG1 3.92Å; E716-V868 HydrophobicContact CG-CG2 4.48Å; L740-V868 HydrophobicContact CD1-CG2 3.79Å; L740-V868 HydrophobicContact CD2-CG2 4.4Å; L740-V868 HydrophobicContact CG-CG2 4.11Å; L741-V868 PolarHBondContact O-N 3.22Å; L742-V868 HydrophobicContact CD2-CB 4.04Å; L742-V868 HydrophobicContact CD2-CG1 4.3Å; H743-V868 PolarHBondContact CD2-O 2.94Å; H743-V868 PolarHBondContact N-O 3.25Å
869	F	89.2	Confident	82.8	Confident	42 Å²	42	49.7 Å²	49.7	18%	0.184	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	117	179.1	178.6	-112.1	0	0	0	111.1	H743 Q974	H743-F869 AromaticContact CE1-CD2 3.52Å; H743-F869 AromaticContact ND1-CD2 3.73Å; H743-F869 CarbonylContact O-C 3.58Å; H743-F869 WeakPolarHBondContact O-CA 3.46Å; F869-Q974 HydrophobicContact CB-CG 4.15Å; F869-Q974 VanDerWaalsContact CD1-CD 3.46Å; F869-Q974 HydrophobicContact CD1-CG 4.3Å; F869-Q974 HydrophobicContact CG-CG 4.06Å
870	V	88.4	Confident	83	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.268	C	S	.	.			trans	-101.6	84.4	176.5	-170.5	0	0	0	0	109.3	L710 V713 L742 H743 T748 K750 L753	L710-V870 HydrophobicContact CD1-CG1 3.83Å; L710-V870 HydrophobicContact CD2-CG1 4.34Å; V713-V870 HydrophobicContact CG1-CG2 4.36Å; L742-V870 HydrophobicContact CB-CG2 4.41Å; L742-V870 HydrophobicContact CD2-CG2 4.1Å; H743-V870 PolarHBondContact O-N 3.23Å; T748-V870 PolarHBondContact OG1-O 3.13Å; K750-V870 HydrophobicContact CG-CB 4.07Å; K750-V870 HydrophobicContact CG-CG1 4.31Å; K750-V870 HydrophobicContact CG-CG2 4.21Å; L753-V870 HydrophobicContact CD2-CG2 4.17Å
871	G	82.3	Confident	83.2	Confident	13 Å²	13	47.8 Å²	47.8	13%	0.134	26%	0.257	C	S	.	.			trans	-77.2	166.6	-179.2	0	0	0	0	0	114.6
872	A	80.3	Confident	83.8	Confident	19 Å²	19	42.7 Å²	42.7	16%	0.157	22%	0.224	C	C	.	.			trans	-65.3	147.2	166.4	0	0	0	0	0	109.9	E874 L967	A872-E874 PolarHBondContact O-N 3.42Å; A872-E874 VanDerWaalsContact O-N 3.17Å; A872-L967 HydrophobicContact CB-CD2 3.97Å
873	S	75.6	Confident	84.5	Confident	22 Å²	22	41.8 Å²	41.8	15%	0.154	21%	0.214	C	C	.	.			trans	-72.9	108.7	179.3	-68.5	0	0	0	0	109.9	Q879	S873-Q879 WeakPolarHBondContact O-CG 3.34Å; S873-Q879 PolarHBondContact O-NE2 3.06Å
874	E	70.1	Confident	84.7	Confident	119 Å²	119	42.1 Å²	42.1	56%	0.556	22%	0.222	S	C	*	.			trans	-82.1	-30.1	177.5	-60.7	-172	179.1	0	0	111.7	A872 K971	A872-E874 PolarHBondContact O-N 3.42Å; A872-E874 VanDerWaalsContact O-N 3.17Å; E874-K971 VanDerWaalsContact CD-NZ 3.33Å; E874-K971 WeakPolarHBondContact OE1-CE 3.23Å; E874-K971 IonicContact OE1-NZ 2.64Å; E874-K971 PolarHBondContact OE1-NZ 2.92Å; E874-K971 IonicContact OE2-NZ 3.19Å; E874-K971 PolarHBondContact OE2-NZ 2.88Å
875	D	81.3	Confident	84.8	Confident	105 Å²	105	42.4 Å²	42.4	56%	0.561	22%	0.224	S	C	*	.	S	Bend	trans	-79.2	131.6	179.6	-46.6	-49.8	0	0	0	111.9	A877 S878 Q879	D875-A877 PolarHBondContact O-N 3Å; D875-S878 WeakPolarHBondContact O-CB 3.33Å; D875-S878 PolarHBondContact O-N 3.14Å; D875-S878 PolarHBondContact OD2-OG 3.19Å; D875-Q879 WeakPolarHBondContact O-CG 3.36Å; D875-Q879 PolarHBondContact O-N 3.27Å
876	R	83.2	Confident	85.4	Confident	97 Å²	97	41.2 Å²	41.2	37%	0.366	22%	0.218	S	C	.	.	H	α-helix	trans	-55.8	-37.2	171.3	-69.6	-62.4	-163.6	173.5	10.2	112.5	S878 Q879 L880 L902 C905	R876-S878 VanDerWaalsContact C-N 3.33Å; R876-S878 PolarHBondContact O-N 3.12Å; R876-Q879 PolarHBondContact O-N 2.78Å; R876-L880 WeakPolarHBondContact O-CB 3.18Å; R876-L880 PolarHBondContact O-N 3.22Å; R876-L902 PolarHBondContact NH1-O 3.14Å; R876-L902 WeakPolarHBondContact O-CD2 3.47Å; R876-C905 PolarHBondContact NH1-O 3.02Å; R876-C905 PolarHBondContact NH2-O 2.82Å
877	A	85.7	Confident	85.6	Confident	65 Å²	65	38.4 Å²	38.4	54%	0.537	21%	0.206	S	C	.	.	H	α-helix	trans	-66.6	-33.4	176.1	0	0	0	0	0	112.9	D875 R881	D875-A877 PolarHBondContact O-N 3Å; A877-R881 WeakPolarHBondContact O-CG 3.48Å; A877-R881 PolarHBondContact O-N 3.06Å; A877-R881 PolarHBondContact O-NE 2.99Å
878	S	85.9	Confident	85.6	Confident	8 Å²	8	43.2 Å²	43.2	6%	0.056	22%	0.221	C	C	.	.	H	α-helix	trans	-74.8	-42.6	176.3	-64.4	0	0	0	0	110.9	D875 R876 L880 R881 V882	D875-S878 WeakPolarHBondContact O-CB 3.33Å; D875-S878 PolarHBondContact O-N 3.14Å; D875-S878 PolarHBondContact OD2-OG 3.19Å; R876-S878 VanDerWaalsContact C-N 3.33Å; R876-S878 PolarHBondContact O-N 3.12Å; S878-L880 PolarHBondContact O-N 3.25Å; S878-R881 WeakPolarHBondContact O-CB 3.28Å; S878-R881 PolarHBondContact O-N 3.49Å; S878-R881 PolarHBondContact OG-NH2 2.94Å; S878-V882 WeakPolarHBondContact O-CG2 3.19Å; S878-V882 PolarHBondContact O-N 3.02Å
879	Q	87	Confident	85.4	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-41.7	173.5	-68.6	178	-7.6	0	0	112.6	S873 D875 R876 R881 V882 L883 L902 P907	S873-Q879 WeakPolarHBondContact O-CG 3.34Å; S873-Q879 PolarHBondContact O-NE2 3.06Å; D875-Q879 WeakPolarHBondContact O-CG 3.36Å; D875-Q879 PolarHBondContact O-N 3.27Å; R876-Q879 PolarHBondContact O-N 2.78Å; Q879-R881 VanDerWaalsContact C-N 3.32Å; Q879-R881 PolarHBondContact O-N 3.43Å; Q879-V882 WeakPolarHBondContact O-CB 3.45Å; Q879-V882 PolarHBondContact O-N 3.26Å; Q879-L883 WeakPolarHBondContact O-CB 3.42Å; Q879-L883 PolarHBondContact O-N 3.12Å; Q879-L902 HydrophobicContact CB-CD1 3.87Å; Q879-L902 HydrophobicContact CB-CD2 3.81Å; Q879-L902 HydrophobicContact CB-CG 4.44Å; Q879-P907 PolarHBondContact NE2-O 3.14Å
880	L	89.4	Confident	85.2	Confident	60 Å²	60	49.8 Å²	49.8	31%	0.314	25%	0.249	S	C	.	.	H	α-helix	trans	-60.9	-41.8	175.3	-175.2	152.2	0	0	0	111.5	R876 S878 V882 L883 S884 V899 L902	R876-L880 WeakPolarHBondContact O-CB 3.18Å; R876-L880 PolarHBondContact O-N 3.22Å; S878-L880 PolarHBondContact O-N 3.25Å; L880-V882 VanDerWaalsContact C-N 3.34Å; L880-V882 PolarHBondContact O-N 2.91Å; L880-L883 PolarHBondContact O-N 2.8Å; L880-S884 VanDerWaalsContact O-CB 3.28Å; L880-S884 WeakPolarHBondContact O-CB 3.29Å; L880-S884 PolarHBondContact O-N 3.02Å; L880-V899 HydrophobicContact CD1-CG2 3.57Å; L880-L902 HydrophobicContact CB-CD2 4.16Å
881	R	88.9	Confident	85.2	Confident	100 Å²	100	56 Å²	56	38%	0.377	28%	0.276	S	S	.	.	H	α-helix	trans	-63.1	-39.7	175.3	-74.8	-179.1	-73.7	168.8	-3.5	112	Q711 A877 S878 Q879 A885	Q711-R881 VanDerWaalsContact CG-NH1 3.29Å; A877-R881 WeakPolarHBondContact O-CG 3.48Å; A877-R881 PolarHBondContact O-N 3.06Å; A877-R881 PolarHBondContact O-NE 2.99Å; S878-R881 WeakPolarHBondContact O-CB 3.28Å; S878-R881 PolarHBondContact O-N 3.49Å; S878-R881 PolarHBondContact OG-NH2 2.94Å; Q879-R881 VanDerWaalsContact C-N 3.32Å; Q879-R881 PolarHBondContact O-N 3.43Å; R881-A885 WeakPolarHBondContact O-CB 3.23Å; R881-A885 PolarHBondContact O-N 2.92Å
882	V	89.5	Confident	85.4	Confident	17 Å²	17	58 Å²	58	10%	0.103	28%	0.283	C	S	.	.	H	α-helix	trans	-63.4	-49.1	174.6	176.2	0	0	0	0	110.9	G708 S878 Q879 L880 S884 A885 I886 L914	G708-V882 VanDerWaalsContact O-CG2 3.29Å; G708-V882 WeakPolarHBondContact O-CG2 3.46Å; S878-V882 WeakPolarHBondContact O-CG2 3.19Å; S878-V882 PolarHBondContact O-N 3.02Å; Q879-V882 WeakPolarHBondContact O-CB 3.45Å; Q879-V882 PolarHBondContact O-N 3.26Å; L880-V882 VanDerWaalsContact C-N 3.34Å; L880-V882 PolarHBondContact O-N 2.91Å; V882-S884 VanDerWaalsContact C-N 3.33Å; V882-S884 PolarHBondContact O-N 3.02Å; V882-A885 PolarHBondContact O-N 2.89Å; V882-I886 HydrophobicContact CG1-CD1 3.8Å; V882-I886 WeakPolarHBondContact O-CG1 3.45Å; V882-I886 PolarHBondContact O-N 3.42Å; V882-L914 HydrophobicContact CB-CD1 4.08Å; V882-L914 HydrophobicContact CG1-CD1 3.71Å
883	L	89.4	Confident	85.7	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-62.6	-40.4	178.6	-174.3	63.1	0	0	0	111.6	Q879 L880 I886 T887 L898 L914 L917	Q879-L883 WeakPolarHBondContact O-CB 3.42Å; Q879-L883 PolarHBondContact O-N 3.12Å; L880-L883 PolarHBondContact O-N 2.8Å; L883-I886 PolarHBondContact O-N 3.13Å; L883-T887 HydrophobicContact CD1-CG2 4.24Å; L883-T887 HydrophobicContact CG-CG2 4.41Å; L883-T887 WeakPolarHBondContact O-CB 3.41Å; L883-T887 VanDerWaalsContact O-CG2 3.26Å; L883-T887 WeakPolarHBondContact O-CG2 3.41Å; L883-T887 PolarHBondContact O-N 3.25Å; L883-T887 PolarHBondContact O-OG1 2.9Å; L883-L898 HydrophobicContact CD2-CB 4.12Å; L883-L898 HydrophobicContact CD2-CD2 4.17Å; L883-L898 HydrophobicContact CG-CD2 4.26Å; L883-L914 HydrophobicContact CD1-CD2 4.46Å; L883-L917 HydrophobicContact CD1-CD2 4.28Å
884	S	89.8	Confident	86	Confident	41 Å²	41	65.3 Å²	65.3	29%	0.287	33%	0.332	S	S	.	.	H	α-helix	trans	-62.4	-40.8	174.4	-179.5	0	0	0	0	112.2	L880 V882 T887 R888	L880-S884 VanDerWaalsContact O-CB 3.28Å; L880-S884 WeakPolarHBondContact O-CB 3.29Å; L880-S884 PolarHBondContact O-N 3.02Å; V882-S884 VanDerWaalsContact C-N 3.33Å; V882-S884 PolarHBondContact O-N 3.02Å; S884-T887 WeakPolarHBondContact CA-OG1 3.35Å; S884-T887 PolarHBondContact O-OG1 3.46Å; S884-T887 VanDerWaalsContact O-OG1 3.11Å; S884-R888 WeakPolarHBondContact O-CG 3.47Å; S884-R888 PolarHBondContact O-N 3.29Å
885	A	89.2	Confident	86.6	Confident	8 Å²	8	63 Å²	63	7%	0.066	33%	0.329	C	S	.	.	H	α-helix	trans	-65.9	-44.6	176.9	0	0	0	0	0	111.8	R881 V882 R888	R881-A885 WeakPolarHBondContact O-CB 3.23Å; R881-A885 PolarHBondContact O-N 2.92Å; V882-A885 PolarHBondContact O-N 2.89Å; A885-R888 WeakPolarHBondContact O-CB 3.3Å; A885-R888 PolarHBondContact O-N 3.09Å
886	I	88.9	Confident	86.8	Confident	25 Å²	25	59.1 Å²	59.1	13%	0.128	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-45.5	178.6	-67.8	167.2	0	0	0	111	V882 L883 R888 K889 F890 L914 Y915 C918	V882-I886 HydrophobicContact CG1-CD1 3.8Å; V882-I886 WeakPolarHBondContact O-CG1 3.45Å; V882-I886 PolarHBondContact O-N 3.42Å; L883-I886 PolarHBondContact O-N 3.13Å; I886-R888 PolarHBondContact O-N 2.91Å; I886-K889 PolarHBondContact O-N 3.41Å; I886-F890 HydrophobicContact CG2-CE2 3.95Å; I886-F890 WeakPolarHBondContact O-CD2 3.47Å; I886-L914 HydrophobicContact CD1-CB 3.84Å; I886-Y915 HydrophobicContact CG2-CD2 3.96Å; I886-C918 HydrophobicContact CG2-CB 4.19Å
887	T	88.3	Confident	87	Confident	8 Å²	8	56.4 Å²	56.4	5%	0.049	31%	0.305	C	S	.	.	H	α-helix	trans	-66.8	-16.3	-175.9	48.4	0	0	0	0	114.2	L883 S884 K889 F890 L892 L898	L883-T887 HydrophobicContact CD1-CG2 4.24Å; L883-T887 HydrophobicContact CG-CG2 4.41Å; L883-T887 WeakPolarHBondContact O-CB 3.41Å; L883-T887 VanDerWaalsContact O-CG2 3.26Å; L883-T887 WeakPolarHBondContact O-CG2 3.41Å; L883-T887 PolarHBondContact O-N 3.25Å; L883-T887 PolarHBondContact O-OG1 2.9Å; S884-T887 WeakPolarHBondContact CA-OG1 3.35Å; S884-T887 PolarHBondContact O-OG1 3.46Å; S884-T887 VanDerWaalsContact O-OG1 3.11Å; T887-K889 PolarHBondContact O-N 3.29Å; T887-F890 CarbonylContact O-C 3.58Å; T887-F890 WeakPolarHBondContact O-CA 3.31Å; T887-F890 PolarHBondContact O-N 3.07Å; T887-L892 HydrophobicContact CG2-CD1 4.14Å; T887-L892 HydrophobicContact CG2-CD2 4.44Å; T887-L898 HydrophobicContact CG2-CD2 3.96Å
888	R	86.4	Confident	87.1	Confident	154 Å²	154	54.9 Å²	54.9	58%	0.581	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.7	172.4	-72.9	169.9	-175.9	-157.8	-2.1	113.8	S884 A885 I886 F890	S884-R888 WeakPolarHBondContact O-CG 3.47Å; S884-R888 PolarHBondContact O-N 3.29Å; A885-R888 WeakPolarHBondContact O-CB 3.3Å; A885-R888 PolarHBondContact O-N 3.09Å; I886-R888 PolarHBondContact O-N 2.91Å; R888-F890 PolarHBondContact O-N 3.2Å
889	K	83.9	Confident	87.3	Confident	150 Å²	150	57.7 Å²	57.7	65%	0.652	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-14	175.8	-64.2	-176.9	179.1	179.5	0	112.7	I886 T887	I886-K889 PolarHBondContact O-N 3.41Å; T887-K889 PolarHBondContact O-N 3.29Å
890	F	86.6	Confident	87.3	Confident	32 Å²	32	61.8 Å²	61.8	14%	0.14	33%	0.326	C	S	.	.	S	Bend	trans	-114.3	149.9	-174.1	-60.2	-87.9	0	0	0	110.7	I886 T887 R888 L892 Y915 C918 M922 L946	I886-F890 HydrophobicContact CG2-CE2 3.95Å; I886-F890 WeakPolarHBondContact O-CD2 3.47Å; T887-F890 CarbonylContact O-C 3.58Å; T887-F890 WeakPolarHBondContact O-CA 3.31Å; T887-F890 PolarHBondContact O-N 3.07Å; R888-F890 PolarHBondContact O-N 3.2Å; F890-L892 PolarHBondContact O-N 2.89Å; F890-Y915 HydrophobicContact CZ-CE2 4.44Å; F890-C918 HydrophobicContact CD2-CB 4.22Å; F890-C918 HydrophobicContact CE2-CB 3.73Å; F890-C918 HydrophobicContact CZ-CB 3.9Å; F890-M922 HydrophobicContact CD1-CB 4.44Å; F890-M922 HydrophobicContact CD1-SD 3.86Å; F890-M922 HydrophobicContact CE1-CB 4.21Å; F890-M922 HydrophobicContact CE1-CG 4.49Å; F890-M922 HydrophobicContact CE1-SD 3.61Å; F890-L946 HydrophobicContact CB-CD1 3.54Å; F890-L946 HydrophobicContact CD1-CD1 3.91Å; F890-L946 HydrophobicContact CG-CD1 4.05Å
891	K	86.8	Confident	87.1	Confident	130 Å²	130	59 Å²	59	57%	0.565	31%	0.311	S	S	*	.			trans	-91.1	106.6	174.8	-68.6	-179.1	177	-178.3	0	109.2	A943 L945 L946	K891-A943 HydrophobicContact CD-CB 3.78Å; K891-L945 HydrophobicContact CB-CD2 4.18Å; K891-L946 PolarHBondContact O-N 3.14Å
892	L	87	Confident	87	Confident	55 Å²	55	54.4 Å²	54.4	29%	0.288	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-89.7	146.7	177.5	-62.5	174.2	0	0	0	111	T887 F890 V896 L898 L946 L951	T887-L892 HydrophobicContact CG2-CD1 4.14Å; T887-L892 HydrophobicContact CG2-CD2 4.44Å; F890-L892 PolarHBondContact O-N 2.89Å; L892-V896 HydrophobicContact CD2-CG1 4.42Å; L892-L898 HydrophobicContact CD1-CD2 4.13Å; L892-L946 HydrophobicContact CD2-CB 4.02Å; L892-L946 HydrophobicContact CD2-CD1 4.41Å; L892-L951 HydrophobicContact CD2-CD1 4.22Å
893	E	86.7	Confident	86.9	Confident	80 Å²	80	58.5 Å²	58.5	37%	0.374	32%	0.316	S	S	.	.			trans	-69.4	146.4	165.9	-165.6	-167.3	147.7	0	0	110.7	S895 V896 L946 T947	E893-S895 PolarHBondContact O-N 3.49Å; E893-S895 VanDerWaalsContact O-N 3.08Å; E893-S895 PolarHBondContact OE1-OG 2.89Å; E893-S895 PolarHBondContact OE2-OG 3.1Å; E893-V896 HydrophobicContact CB-CG2 4.09Å; E893-V896 WeakPolarHBondContact O-CB 3.43Å; E893-V896 WeakPolarHBondContact O-CG2 3.44Å; E893-V896 PolarHBondContact O-N 3.5Å; E893-V896 VanDerWaalsContact O-N 3.09Å; E893-L946 WeakPolarHBondContact CB-O 3.33Å; E893-L946 PolarHBondContact N-O 3.31Å; E893-T947 WeakPolarHBondContact OE2-CG2 3Å
894	A	81.9	Confident	86.6	Confident	115 Å²	115	67.4 Å²	67.4	95%	0.95	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-19	-178.3	0	0	0	0	0	114	V896	A894-V896 VanDerWaalsContact C-N 3.34Å
895	S	82.1	Confident	86.4	Confident	72 Å²	72	65.7 Å²	65.7	50%	0.503	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-9.1	178.4	60.8	0	0	0	0	113.9	E893 S897	E893-S895 PolarHBondContact O-N 3.49Å; E893-S895 VanDerWaalsContact O-N 3.08Å; E893-S895 PolarHBondContact OE1-OG 2.89Å; E893-S895 PolarHBondContact OE2-OG 3.1Å; S895-S897 PolarHBondContact O-N 3.36Å
896	V	85.1	Confident	86.1	Confident	23 Å²	23	67.4 Å²	67.4	14%	0.139	35%	0.348	C	S	.	.			trans	-77.9	118.3	-174.1	178.7	0	0	0	0	111.4	L892 E893 A894 L898 M948 L951	L892-V896 HydrophobicContact CD2-CG1 4.42Å; E893-V896 HydrophobicContact CB-CG2 4.09Å; E893-V896 WeakPolarHBondContact O-CB 3.43Å; E893-V896 WeakPolarHBondContact O-CG2 3.44Å; E893-V896 PolarHBondContact O-N 3.5Å; E893-V896 VanDerWaalsContact O-N 3.09Å; A894-V896 VanDerWaalsContact C-N 3.34Å; V896-L898 HydrophobicContact CG1-CD2 4.32Å; V896-M948 HydrophobicContact CG1-SD 4.17Å; V896-M948 HydrophobicContact CG2-CB 4.48Å; V896-L951 HydrophobicContact CG1-CD1 3.57Å
897	S	87.9	Confident	85.5	Confident	40 Å²	40	69.7 Å²	69.7	28%	0.28	36%	0.364	S	S	.	.			trans	-98.6	110.5	169.8	174.7	0	0	0	0	110.7	S895 V899 N900 V901	S895-S897 PolarHBondContact O-N 3.36Å; S897-V899 PolarHBondContact O-N 3.09Å; S897-N900 PolarHBondContact O-N 3.04Å; S897-N900 PolarHBondContact OG-N 2.87Å; S897-N900 PolarHBondContact OG-OD1 3.05Å; S897-V901 PolarHBondContact O-N 2.75Å
898	L	88.4	Confident	85.1	Confident	32 Å²	32	71.6 Å²	71.6	17%	0.168	37%	0.372	C	S	.	.	H	α-helix	trans	-63.1	-28.8	177.1	-61.5	-178.7	0	0	0	112.9	L883 T887 L892 V896 V901 L902	L883-L898 HydrophobicContact CD2-CB 4.12Å; L883-L898 HydrophobicContact CD2-CD2 4.17Å; L883-L898 HydrophobicContact CG-CD2 4.26Å; T887-L898 HydrophobicContact CG2-CD2 3.96Å; L892-L898 HydrophobicContact CD1-CD2 4.13Å; V896-L898 HydrophobicContact CG1-CD2 4.32Å; L898-V901 PolarHBondContact O-N 3.25Å; L898-L902 WeakPolarHBondContact O-CB 3.07Å; L898-L902 PolarHBondContact O-N 3Å; L898-L902 VanDerWaalsContact O-N 3.1Å
899	V	89.1	Confident	85	Confident	68 Å²	68	64.3 Å²	64.3	41%	0.412	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-48.6	176	-177.6	0	0	0	0	109.7	L880 S897 V901 L902 D903	L880-V899 HydrophobicContact CD1-CG2 3.57Å; S897-V899 PolarHBondContact O-N 3.09Å; V899-V901 VanDerWaalsContact C-N 3.28Å; V899-V901 PolarHBondContact O-N 3.34Å; V899-L902 PolarHBondContact O-N 3.15Å; V899-L902 VanDerWaalsContact O-N 3.08Å; V899-D903 PolarHBondContact O-N 3.08Å
900	N	87.2	Confident	85.2	Confident	86 Å²	86	57.3 Å²	57.3	46%	0.46	32%	0.315	S	S	.	.	H	α-helix	trans	-65	-33.3	-177.8	-67.6	6.5	0	0	0	112.4	S897 R904 M948	S897-N900 PolarHBondContact O-N 3.04Å; S897-N900 PolarHBondContact OG-N 2.87Å; S897-N900 PolarHBondContact OG-OD1 3.05Å; N900-R904 WeakPolarHBondContact O-CG 3.01Å; N900-M948 HydrophobicContact CB-CE 3.56Å
901	V	86.6	Confident	85.3	Confident	1 Å²	1	57 Å²	57	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-65.9	-46.2	173.8	178.9	0	0	0	0	109.7	S897 L898 V899 D903 R904 C905 L917 M948 L951	S897-V901 PolarHBondContact O-N 2.75Å; L898-V901 PolarHBondContact O-N 3.25Å; V899-V901 VanDerWaalsContact C-N 3.28Å; V899-V901 PolarHBondContact O-N 3.34Å; V901-D903 VanDerWaalsContact C-N 3.34Å; V901-D903 PolarHBondContact O-N 3.41Å; V901-R904 PolarHBondContact O-N 3.24Å; V901-C905 PolarHBondContact O-N 2.71Å; V901-C905 PolarHBondContact O-SG 2.99Å; V901-C905 VanDerWaalsContact O-SG 3.37Å; V901-L917 HydrophobicContact CG1-CD2 3.94Å; V901-M948 HydrophobicContact CG2-CE 3.58Å; V901-M948 HydrophobicContact CG2-SD 3.77Å; V901-L951 HydrophobicContact CG1-CB 4.34Å; V901-L951 HydrophobicContact CG2-CB 3.97Å; V901-L951 HydrophobicContact CG2-CD1 4.24Å
902	L	86.4	Confident	85.3	Confident	5 Å²	5	53 Å²	53	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-66.4	-34.1	-177.5	-165.9	72.2	0	0	0	113	R876 Q879 L880 L898 V899 R904 C905 L914	R876-L902 PolarHBondContact NH1-O 3.14Å; R876-L902 WeakPolarHBondContact O-CD2 3.47Å; Q879-L902 HydrophobicContact CB-CD1 3.87Å; Q879-L902 HydrophobicContact CB-CD2 3.81Å; Q879-L902 HydrophobicContact CB-CG 4.44Å; L880-L902 HydrophobicContact CB-CD2 4.16Å; L898-L902 WeakPolarHBondContact O-CB 3.07Å; L898-L902 PolarHBondContact O-N 3Å; L898-L902 VanDerWaalsContact O-N 3.1Å; V899-L902 PolarHBondContact O-N 3.15Å; V899-L902 VanDerWaalsContact O-N 3.08Å; L902-R904 PolarHBondContact O-N 3.39Å; L902-C905 WeakPolarHBondContact O-CB 3.38Å; L902-C905 PolarHBondContact O-N 3.44Å; L902-L914 HydrophobicContact CD1-CD2 4.38Å
903	D	86.5	Confident	85.5	Confident	103 Å²	103	50.7 Å²	50.7	55%	0.551	30%	0.3	S	S	*	.	H	α-helix	trans	-63.3	-29.2	175.8	-72.2	-24.2	0	0	0	112.8	V899 V901 C905	V899-D903 PolarHBondContact O-N 3.08Å; V901-D903 VanDerWaalsContact C-N 3.34Å; V901-D903 PolarHBondContact O-N 3.41Å; D903-C905 VanDerWaalsContact C-N 3.32Å
904	R	84.4	Confident	85.7	Confident	188 Å²	188	47 Å²	47	71%	0.709	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-12.7	176	-61.9	-110.5	-173.9	-164.2	0.5	112.8	N900 V901 L902 L952	N900-R904 WeakPolarHBondContact O-CG 3.01Å; V901-R904 PolarHBondContact O-N 3.24Å; L902-R904 PolarHBondContact O-N 3.39Å; R904-L952 HydrophobicContact CB-CD2 4.32Å; R904-L952 HydrophobicContact CG-CD2 3.77Å
905	C	84.2	Confident	86.1	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.034	26%	0.26	C	S	.	.	S	Bend	trans	-90.8	147.1	-177.4	-75.4	0	0	0	0	112.2	R876 V901 L902 D903 L909	R876-C905 PolarHBondContact NH1-O 3.02Å; R876-C905 PolarHBondContact NH2-O 2.82Å; V901-C905 PolarHBondContact O-N 2.71Å; V901-C905 PolarHBondContact O-SG 2.99Å; V901-C905 VanDerWaalsContact O-SG 3.37Å; L902-C905 WeakPolarHBondContact O-CB 3.38Å; L902-C905 PolarHBondContact O-N 3.44Å; D903-C905 VanDerWaalsContact C-N 3.32Å; C905-L909 HydrophobicContact CB-CD1 3.59Å
906	P	82.7	Confident	86.5	Confident	44 Å²	44	46.2 Å²	46.2	29%	0.286	25%	0.253	S	S	.	.			trans	-55.2	151	170.3	-23.1	32.8	0	0	0	112	Q908 L909	P906-Q908 PolarHBondContact O-N 2.73Å; P906-L909 WeakPolarHBondContact O-CG 3.14Å
907	P	76.4	Confident	86.8	Confident	73 Å²	73	45.1 Å²	45.1	47%	0.474	25%	0.246	S	C	.	.	S	Bend	trans	-72.8	-14.9	178.2	28.9	-34.3	0	0	0	113.5	Q879 L909	Q879-P907 PolarHBondContact NE2-O 3.14Å; P907-L909 PolarHBondContact O-N 2.85Å
908	Q	80.7	Confident	87	Confident	47 Å²	47	43.4 Å²	43.4	22%	0.22	23%	0.234	C	C	.	.			trans	-99.4	49.6	-172.5	-65.1	147.6	32	0	0	112.6	P906 E964 L967	P906-Q908 PolarHBondContact O-N 2.73Å; Q908-E964 HydrophobicContact CG-CG 4.42Å; Q908-E964 PolarHBondContact NE2-OE1 3.12Å; Q908-E964 VanDerWaalsContact OE1-CG 3.24Å; Q908-L967 HydrophobicContact CB-CD1 4.43Å; Q908-L967 HydrophobicContact CG-CD1 4.17Å
909	L	83.9	Confident	87.1	Confident	2 Å²	2	44 Å²	44	1%	0.01	24%	0.241	C	C	.	.			trans	-99.8	135.7	-178.4	-64.9	179.9	0	0	0	112.1	C905 P906 P907 D913 L914 L958 P960	C905-L909 HydrophobicContact CB-CD1 3.59Å; P906-L909 WeakPolarHBondContact O-CG 3.14Å; P907-L909 PolarHBondContact O-N 2.85Å; L909-D913 HydrophobicContact CB-CB 4.33Å; L909-D913 HydrophobicContact CD2-CB 3.84Å; L909-L914 HydrophobicContact CB-CD2 4.3Å; L909-L914 HydrophobicContact CB-CG 4.28Å; L909-L914 HydrophobicContact CD1-CD2 3.79Å; L909-L958 HydrophobicContact CD1-CD2 3.64Å; L909-L958 HydrophobicContact CD2-CD2 3.44Å; L909-L958 VanDerWaalsContact CD2-CD2 3.44Å; L909-L958 HydrophobicContact CD2-CG 4.37Å; L909-L958 HydrophobicContact CG-CD2 4.21Å; L909-P960 HydrophobicContact CD2-CB 4.25Å
910	T	88.4	Confident	87.3	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.018	24%	0.237	C	C	.	.			trans	-86.6	166.7	169.8	68.2	0	0	0	0	110.9	A912 D913 L914 V962	T910-A912 PolarHBondContact O-N 2.86Å; T910-D913 WeakPolarHBondContact CB-OD2 3.29Å; T910-D913 PolarHBondContact N-OD2 3.04Å; T910-D913 PolarHBondContact O-N 3.38Å; T910-D913 PolarHBondContact OG1-N 3.37Å; T910-D913 PolarHBondContact OG1-OD2 3.21Å; T910-L914 PolarHBondContact O-N 2.99Å; T910-L914 VanDerWaalsContact O-N 3.08Å; T910-V962 HydrophobicContact CG2-CB 4.47Å; T910-V962 HydrophobicContact CG2-CG2 3.64Å
911	G	87.9	Confident	87.5	Confident	26 Å²	26	39.6 Å²	39.6	27%	0.268	22%	0.215	S	C	.	.	H	α-helix	trans	-61.3	-33.4	174.2	0	0	0	0	0	112.4	G747 Y915	G747-G911 PolarHBondContact O-N 3.29Å; G911-Y915 WeakPolarHBondContact O-CB 3.43Å; G911-Y915 PolarHBondContact O-N 3.05Å
912	A	88.7	Confident	87.7	Confident	46 Å²	46	43.5 Å²	43.5	38%	0.38	23%	0.234	S	C	.	.	H	α-helix	trans	-66.9	-39.2	173.8	0	0	0	0	0	112.5	G747 T910 Y915 S916	G747-A912 PolarHBondContact O-N 3.14Å; T910-A912 PolarHBondContact O-N 2.86Å; A912-Y915 WeakPolarHBondContact O-CB 3.34Å; A912-Y915 PolarHBondContact O-N 3.44Å; A912-S916 PolarHBondContact O-N 3.46Å
913	D	90.6	Very high	87.9	Confident	5 Å²	5	46.2 Å²	46.2	3%	0.027	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-43.2	176.2	-57.9	-42.9	0	0	0	111.3	L909 T910 Y915 S916 L917 L958 S961	L909-D913 HydrophobicContact CB-CB 4.33Å; L909-D913 HydrophobicContact CD2-CB 3.84Å; T910-D913 WeakPolarHBondContact CB-OD2 3.29Å; T910-D913 PolarHBondContact N-OD2 3.04Å; T910-D913 PolarHBondContact O-N 3.38Å; T910-D913 PolarHBondContact OG1-N 3.37Å; T910-D913 PolarHBondContact OG1-OD2 3.21Å; D913-Y915 VanDerWaalsContact C-N 3.28Å; D913-Y915 PolarHBondContact O-N 3.15Å; D913-S916 WeakPolarHBondContact O-CB 3.45Å; D913-S916 PolarHBondContact O-N 3.14Å; D913-L917 PolarHBondContact O-N 3.16Å; D913-L958 WeakPolarHBondContact O-CD1 3.45Å; D913-S961 WeakPolarHBondContact OD1-CB 3.35Å; D913-S961 PolarHBondContact OD1-N 2.7Å; D913-S961 PolarHBondContact OD1-OG 3.15Å
914	L	89.6	Confident	88.1	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-64.8	-32.8	175.3	-66.7	173.4	0	0	0	112.1	V882 L883 I886 L902 L909 T910 L917 C918	V882-L914 HydrophobicContact CB-CD1 4.08Å; V882-L914 HydrophobicContact CG1-CD1 3.71Å; L883-L914 HydrophobicContact CD1-CD2 4.46Å; I886-L914 HydrophobicContact CD1-CB 3.84Å; L902-L914 HydrophobicContact CD1-CD2 4.38Å; L909-L914 HydrophobicContact CB-CD2 4.3Å; L909-L914 HydrophobicContact CB-CG 4.28Å; L909-L914 HydrophobicContact CD1-CD2 3.79Å; T910-L914 PolarHBondContact O-N 2.99Å; T910-L914 VanDerWaalsContact O-N 3.08Å; L914-L917 WeakPolarHBondContact O-CB 3.35Å; L914-C918 PolarHBondContact O-N 3.29Å; L914-C918 PolarHBondContact O-SG 2.76Å
915	Y	90.6	Very high	88.3	Confident	121 Å²	121	33.3 Å²	33.3	48%	0.475	20%	0.197	S	C	.	.	H	α-helix	trans	-68.8	-42.9	172	-178	-93.3	0	0	0	111.7	I886 F890 G911 A912 D913 L917 C918 S919	I886-Y915 HydrophobicContact CG2-CD2 3.96Å; F890-Y915 HydrophobicContact CZ-CE2 4.44Å; G911-Y915 WeakPolarHBondContact O-CB 3.43Å; G911-Y915 PolarHBondContact O-N 3.05Å; A912-Y915 WeakPolarHBondContact O-CB 3.34Å; A912-Y915 PolarHBondContact O-N 3.44Å; D913-Y915 VanDerWaalsContact C-N 3.28Å; D913-Y915 PolarHBondContact O-N 3.15Å; Y915-L917 VanDerWaalsContact C-N 3.31Å; Y915-L917 PolarHBondContact O-N 3.47Å; Y915-C918 PolarHBondContact O-N 3.36Å; Y915-S919 WeakPolarHBondContact O-CB 3.3Å; Y915-S919 PolarHBondContact O-N 2.81Å
916	S	91	Very high	88.6	Confident	51 Å²	51	37.6 Å²	37.6	36%	0.357	22%	0.219	S	C	.	.	H	α-helix	trans	-59.5	-42.4	174.9	-164.3	0	0	0	0	111.2	A912 D913 C918 S919 D920	A912-S916 PolarHBondContact O-N 3.46Å; D913-S916 WeakPolarHBondContact O-CB 3.45Å; D913-S916 PolarHBondContact O-N 3.14Å; S916-C918 PolarHBondContact O-N 2.84Å; S916-S919 PolarHBondContact O-N 2.98Å; S916-D920 WeakPolarHBondContact O-CB 3.26Å; S916-D920 VanDerWaalsContact O-CG 3.31Å; S916-D920 PolarHBondContact O-N 3.33Å
917	L	91.8	Very high	88.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-53.5	-51.3	173.7	-179.4	96.8	0	0	0	111.6	L883 V901 D913 L914 Y915 D920 A921 A954 A955 L958	L883-L917 HydrophobicContact CD1-CD2 4.28Å; V901-L917 HydrophobicContact CG1-CD2 3.94Å; D913-L917 PolarHBondContact O-N 3.16Å; L914-L917 WeakPolarHBondContact O-CB 3.35Å; Y915-L917 VanDerWaalsContact C-N 3.31Å; Y915-L917 PolarHBondContact O-N 3.47Å; L917-D920 PolarHBondContact O-N 3.16Å; L917-A921 WeakPolarHBondContact O-CB 3.47Å; L917-A921 PolarHBondContact O-N 3.23Å; L917-A954 HydrophobicContact CD1-CB 4.2Å; L917-A954 HydrophobicContact CG-CB 4.42Å; L917-A954 WeakPolarHBondContact O-CB 3.39Å; L917-A955 HydrophobicContact CD1-CB 3.78Å; L917-L958 HydrophobicContact CB-CD1 4.1Å; L917-L958 HydrophobicContact CD1-CB 4.42Å; L917-L958 HydrophobicContact CD1-CD1 4.41Å; L917-L958 HydrophobicContact CD1-CD2 4.14Å
918	C	91.6	Very high	89.4	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.02	23%	0.225	C	C	.	.	H	α-helix	trans	-66.1	-37.7	179.1	-67	0	0	0	0	112.3	I886 F890 L914 Y915 S916 A921 M922	I886-C918 HydrophobicContact CG2-CB 4.19Å; F890-C918 HydrophobicContact CD2-CB 4.22Å; F890-C918 HydrophobicContact CE2-CB 3.73Å; F890-C918 HydrophobicContact CZ-CB 3.9Å; L914-C918 PolarHBondContact O-N 3.29Å; L914-C918 PolarHBondContact O-SG 2.76Å; Y915-C918 PolarHBondContact O-N 3.36Å; S916-C918 PolarHBondContact O-N 2.84Å; C918-A921 PolarHBondContact O-N 2.89Å; C918-M922 WeakPolarHBondContact O-CB 3.3Å; C918-M922 PolarHBondContact O-N 3.11Å
919	S	91.6	Very high	89.5	Confident	44 Å²	44	43 Å²	43	31%	0.308	23%	0.226	S	C	.	.	H	α-helix	trans	-65.4	-40.8	176.7	-171.7	0	0	0	0	112.3	Y915 S916 M922 T923	Y915-S919 WeakPolarHBondContact O-CB 3.3Å; Y915-S919 PolarHBondContact O-N 2.81Å; S916-S919 PolarHBondContact O-N 2.98Å; S919-M922 PolarHBondContact O-N 2.73Å; S919-T923 PolarHBondContact O-N 3.02Å; S919-T923 PolarHBondContact O-OG1 2.99Å
920	D	91.8	Very high	89.6	Confident	63 Å²	63	46 Å²	46	34%	0.337	24%	0.244	S	C	.	.	H	α-helix	trans	-69.5	-39.4	177.1	-74	-14.9	0	0	0	111.7	S916 L917 M922 T923 T924 A954	S916-D920 WeakPolarHBondContact O-CB 3.26Å; S916-D920 VanDerWaalsContact O-CG 3.31Å; S916-D920 PolarHBondContact O-N 3.33Å; L917-D920 PolarHBondContact O-N 3.16Å; D920-M922 VanDerWaalsContact C-N 3.32Å; D920-T923 PolarHBondContact O-N 3Å; D920-T924 PolarHBondContact O-N 2.99Å; D920-T924 PolarHBondContact O-OG1 3.46Å; D920-A954 HydrophobicContact CB-CB 3.98Å
921	A	91.6	Very high	89.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.7	-41.8	172.1	0	0	0	0	0	110.9	L917 C918 T923 T924 A925 L946 D950 L951 A954	L917-A921 WeakPolarHBondContact O-CB 3.47Å; L917-A921 PolarHBondContact O-N 3.23Å; C918-A921 PolarHBondContact O-N 2.89Å; A921-T923 VanDerWaalsContact C-N 3.35Å; A921-T923 PolarHBondContact O-N 2.88Å; A921-T924 WeakPolarHBondContact O-CB 3.48Å; A921-T924 PolarHBondContact O-N 3.19Å; A921-A925 WeakPolarHBondContact O-CB 3.42Å; A921-A925 PolarHBondContact O-N 3.05Å; A921-L946 VanDerWaalsContact C-CD2 3.48Å; A921-L946 HydrophobicContact CB-CD2 3.53Å; A921-D950 HydrophobicContact CB-CB 4.3Å; A921-L951 HydrophobicContact CB-CD2 3.65Å; A921-L951 HydrophobicContact CB-CG 4.04Å; A921-A954 HydrophobicContact CB-CB 4.05Å
922	M	91.1	Very high	89.3	Confident	83 Å²	83	54.3 Å²	54.3	41%	0.409	27%	0.27	S	S	.	.	H	α-helix	trans	-64.9	-39.5	176.6	-174.6	178.2	-176.1	0	0	111.7	F890 C918 S919 D920 T924 A925 L926 L944 L946	F890-M922 HydrophobicContact CD1-CB 4.44Å; F890-M922 HydrophobicContact CD1-SD 3.86Å; F890-M922 HydrophobicContact CE1-CB 4.21Å; F890-M922 HydrophobicContact CE1-CG 4.49Å; F890-M922 HydrophobicContact CE1-SD 3.61Å; C918-M922 WeakPolarHBondContact O-CB 3.3Å; C918-M922 PolarHBondContact O-N 3.11Å; S919-M922 PolarHBondContact O-N 2.73Å; D920-M922 VanDerWaalsContact C-N 3.32Å; M922-T924 VanDerWaalsContact C-N 3.32Å; M922-T924 PolarHBondContact O-N 3.32Å; M922-A925 PolarHBondContact O-N 3.02Å; M922-L926 WeakPolarHBondContact O-CB 3.48Å; M922-L926 PolarHBondContact O-N 2.86Å; M922-L944 HydrophobicContact CE-CD2 4.31Å; M922-L944 HydrophobicContact CG-CD2 3.77Å; M922-L946 HydrophobicContact CB-CD2 4.42Å
923	T	91	Very high	89	Confident	61 Å²	61	56.6 Å²	56.6	37%	0.374	28%	0.275	S	S	.	.	H	α-helix	trans	-65.8	-37.3	176.4	-57	0	0	0	0	111.3	S919 D920 A921 L926 K927	S919-T923 PolarHBondContact O-N 3.02Å; S919-T923 PolarHBondContact O-OG1 2.99Å; D920-T923 PolarHBondContact O-N 3Å; A921-T923 VanDerWaalsContact C-N 3.35Å; A921-T923 PolarHBondContact O-N 2.88Å; T923-L926 PolarHBondContact O-N 2.85Å; T923-K927 WeakPolarHBondContact O-CG 3.33Å; T923-K927 PolarHBondContact O-N 2.92Å
924	T	90.3	Very high	88.8	Confident	21 Å²	21	63.7 Å²	63.7	13%	0.129	31%	0.308	C	S	.	.	H	α-helix	trans	-64.9	-47.2	173.5	-56.8	0	0	0	0	111.2	D920 A921 M922 L926 K927 R928	D920-T924 PolarHBondContact O-N 2.99Å; D920-T924 PolarHBondContact O-OG1 3.46Å; A921-T924 WeakPolarHBondContact O-CB 3.48Å; A921-T924 PolarHBondContact O-N 3.19Å; M922-T924 VanDerWaalsContact C-N 3.32Å; M922-T924 PolarHBondContact O-N 3.32Å; T924-L926 VanDerWaalsContact C-N 3.29Å; T924-L926 PolarHBondContact O-N 3.44Å; T924-K927 PolarHBondContact O-N 3.22Å; T924-R928 PolarHBondContact O-N 3.24Å
925	A	89.6	Confident	88.6	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-61.3	-37.2	175.6	0	0	0	0	0	112.3	A921 M922 R928 R929 L944 D950	A921-A925 WeakPolarHBondContact O-CB 3.42Å; A921-A925 PolarHBondContact O-N 3.05Å; M922-A925 PolarHBondContact O-N 3.02Å; A925-R928 PolarHBondContact O-N 2.77Å; A925-R929 WeakPolarHBondContact O-CB 3.5Å; A925-R929 PolarHBondContact O-N 2.75Å; A925-L944 HydrophobicContact CB-CD2 3.82Å; A925-L944 HydrophobicContact CB-CG 4.31Å; A925-D950 WeakPolarHBondContact CB-OD2 3.2Å
926	L	89.6	Confident	87.7	Confident	94 Å²	94	67.9 Å²	67.9	49%	0.492	35%	0.35	S	S	.	.	H	α-helix	trans	-65.5	-44.1	174.2	-174.6	66.5	0	0	0	111.7	M922 T923 T924 R928 R929 V930 L944	M922-L926 WeakPolarHBondContact O-CB 3.48Å; M922-L926 PolarHBondContact O-N 2.86Å; T923-L926 PolarHBondContact O-N 2.85Å; T924-L926 VanDerWaalsContact C-N 3.29Å; T924-L926 PolarHBondContact O-N 3.44Å; L926-R928 VanDerWaalsContact C-N 3.31Å; L926-R928 PolarHBondContact O-N 3.24Å; L926-R929 PolarHBondContact O-N 3.41Å; L926-R929 VanDerWaalsContact O-N 3.15Å; L926-V930 WeakPolarHBondContact O-CG2 3.45Å; L926-V930 PolarHBondContact O-N 2.76Å; L926-L944 HydrophobicContact CB-CD1 4.17Å; L926-L944 HydrophobicContact CD1-CD1 3.88Å
927	K	89.3	Confident	86.9	Confident	134 Å²	134	70.4 Å²	70.4	58%	0.583	36%	0.359	S	S	*	.	H	α-helix	trans	-60.8	-39.9	175	-74.9	173.6	-179.7	177.6	0	112	T923 T924 R931	T923-K927 WeakPolarHBondContact O-CG 3.33Å; T923-K927 PolarHBondContact O-N 2.92Å; T924-K927 PolarHBondContact O-N 3.22Å; K927-R931 WeakPolarHBondContact O-CG 3.43Å; K927-R931 PolarHBondContact O-N 3.37Å
928	R	85.8	Confident	85.2	Confident	84 Å²	84	79.8 Å²	79.8	32%	0.317	40%	0.403	S	S	.	.	H	α-helix	trans	-60.2	-49.3	171.7	-177	-178.4	67.6	-138	-5.7	110.6	T924 A925 L926 V930 R931 D932 L945 T947 D950	T924-R928 PolarHBondContact O-N 3.24Å; A925-R928 PolarHBondContact O-N 2.77Å; L926-R928 VanDerWaalsContact C-N 3.31Å; L926-R928 PolarHBondContact O-N 3.24Å; R928-V930 VanDerWaalsContact C-N 3.33Å; R928-V930 PolarHBondContact O-N 3.08Å; R928-R931 WeakPolarHBondContact O-CB 3.36Å; R928-R931 PolarHBondContact O-N 2.93Å; R928-R931 VanDerWaalsContact O-N 3.09Å; R928-D932 VanDerWaalsContact O-CG 3.22Å; R928-D932 PolarHBondContact O-N 3.09Å; R928-L945 PolarHBondContact NH2-O 3.01Å; R928-T947 PolarHBondContact NH1-OG1 3.21Å; R928-D950 IonicContact CZ-OD2 3.48Å; R928-D950 VanDerWaalsContact NH1-CG 3.35Å; R928-D950 IonicContact NH1-OD1 3.72Å; R928-D950 PolarHBondContact NH1-OD1 2.9Å; R928-D950 VanDerWaalsContact NH1-OD1 3.15Å; R928-D950 IonicContact NH1-OD2 3.71Å; R928-D950 PolarHBondContact NH1-OD2 2.9Å; R928-D950 IonicContact NH2-OD2 3.61Å; R928-D950 PolarHBondContact NH2-OD2 2.8Å
929	R	83.9	Confident	83.4	Confident	60 Å²	60	84.8 Å²	84.8	23%	0.226	43%	0.427	C	S	.	.	H	α-helix	trans	-61.8	-37.7	-178.7	-171.7	51.8	161.7	177.4	-9	113.6	A925 L926 D932 L933 M939 S941 L944	A925-R929 WeakPolarHBondContact O-CB 3.5Å; A925-R929 PolarHBondContact O-N 2.75Å; L926-R929 PolarHBondContact O-N 3.41Å; L926-R929 VanDerWaalsContact O-N 3.15Å; R929-D932 PolarHBondContact O-N 3.02Å; R929-L933 WeakPolarHBondContact O-CG 3.35Å; R929-L933 PolarHBondContact O-N 3.4Å; R929-L933 VanDerWaalsContact O-N 3.11Å; R929-M939 VanDerWaalsContact CZ-SD 3.54Å; R929-M939 PolarHBondContact NH2-SD 2.94Å; R929-S941 PolarHBondContact NH2-O 2.92Å; R929-L944 HydrophobicContact CB-CD1 4.05Å; R929-L944 HydrophobicContact CG-CD1 4.41Å
930	V	86.6	Confident	81.6	Confident	65 Å²	65	86.8 Å²	86.8	39%	0.394	46%	0.455	S	S	.	.	H	α-helix	trans	-64.7	-41.8	175.2	172	0	0	0	0	110.7	L926 R928 L933 E934	L926-V930 WeakPolarHBondContact O-CG2 3.45Å; L926-V930 PolarHBondContact O-N 2.76Å; R928-V930 VanDerWaalsContact C-N 3.33Å; R928-V930 PolarHBondContact O-N 3.08Å; V930-L933 WeakPolarHBondContact O-CB 3.2Å; V930-L933 PolarHBondContact O-N 3.4Å; V930-E934 WeakPolarHBondContact O-CG 3.34Å; V930-E934 PolarHBondContact O-N 3.38Å
931	R	86	Confident	79.9	Confident	162 Å²	162	86.4 Å²	86.4	61%	0.611	46%	0.457	S	S	*	.	H	α-helix	trans	-62.5	-44.5	174.3	-70	175.2	178.3	-170.2	-3	112.2	K927 R928 L933 E934 E935	K927-R931 WeakPolarHBondContact O-CG 3.43Å; K927-R931 PolarHBondContact O-N 3.37Å; R928-R931 WeakPolarHBondContact O-CB 3.36Å; R928-R931 PolarHBondContact O-N 2.93Å; R928-R931 VanDerWaalsContact O-N 3.09Å; R931-L933 PolarHBondContact O-N 3.47Å; R931-E934 PolarHBondContact O-N 3.4Å; R931-E934 VanDerWaalsContact O-N 3.13Å; R931-E935 WeakPolarHBondContact O-CB 3.27Å; R931-E935 WeakPolarHBondContact O-CG 3.44Å; R931-E935 PolarHBondContact O-N 3.23Å
932	D	83.3	Confident	78.3	Confident	41 Å²	41	92.4 Å²	92.4	22%	0.219	50%	0.499	C	S	.	.	H	α-helix	trans	-59.5	-34.2	177.4	-55.9	-24	0	0	0	111.9	R928 R929 G936 L937	R928-D932 VanDerWaalsContact O-CG 3.22Å; R928-D932 PolarHBondContact O-N 3.09Å; R929-D932 PolarHBondContact O-N 3.02Å; D932-G936 PolarHBondContact O-N 3.28Å; D932-L937 PolarHBondContact O-N 2.94Å
933	L	82.7	Confident	77.1	Confident	95 Å²	95	89.9 Å²	89.9	50%	0.497	49%	0.491	S	S	.	.	H	α-helix	trans	-73.6	-40.7	175.5	-74.8	171.8	0	0	0	112.5	R929 V930 R931 E935 G936 M939	R929-L933 WeakPolarHBondContact O-CG 3.35Å; R929-L933 PolarHBondContact O-N 3.4Å; R929-L933 VanDerWaalsContact O-N 3.11Å; V930-L933 WeakPolarHBondContact O-CB 3.2Å; V930-L933 PolarHBondContact O-N 3.4Å; R931-L933 PolarHBondContact O-N 3.47Å; L933-E935 PolarHBondContact O-N 3.3Å; L933-G936 PolarHBondContact O-N 2.99Å; L933-M939 HydrophobicContact CD2-CG 4.23Å; L933-M939 HydrophobicContact CD2-SD 3.86Å
934	E	85.8	Confident	76.5	Confident	154 Å²	154	89.2 Å²	89.2	72%	0.72	49%	0.485	S	S	*	.	H	α-helix	trans	-63.9	-31.4	174.3	-72.5	174.3	169.8	0	0	111.8	V930 R931	V930-E934 WeakPolarHBondContact O-CG 3.34Å; V930-E934 PolarHBondContact O-N 3.38Å; R931-E934 PolarHBondContact O-N 3.4Å; R931-E934 VanDerWaalsContact O-N 3.13Å
935	E	85.3	Confident	76.4	Confident	145 Å²	145	92 Å²	92	68%	0.678	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-2.9	178.7	-68.5	175.7	-171.2	0	0	114	R931 L933	R931-E935 WeakPolarHBondContact O-CB 3.27Å; R931-E935 WeakPolarHBondContact O-CG 3.44Å; R931-E935 PolarHBondContact O-N 3.23Å; L933-E935 PolarHBondContact O-N 3.3Å
936	G	72.5	Confident	76.3	Confident	65 Å²	65	92.2 Å²	92.2	67%	0.67	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	22.9	170.4	0	0	0	0	0	116.5	D932 L933	D932-G936 PolarHBondContact O-N 3.28Å; L933-G936 PolarHBondContact O-N 2.99Å
937	L	73.3	Confident	76.3	Confident	104 Å²	104	88.9 Å²	88.9	55%	0.545	48%	0.483	S	S	.	.			trans	-80.8	129.9	178.6	-73.5	158.4	0	0	0	112.5	D932	D932-L937 PolarHBondContact O-N 2.94Å
938	E	56.8	Low	76.3	Confident	198 Å²	198	84.2 Å²	84.2	93%	0.925	46%	0.464	S	S	*	.			trans	-68.5	139.2	-178	-72.2	-169.4	162.3	0	0	114
939	M	54.7	Low	76.4	Confident	107 Å²	107	87.4 Å²	87.4	53%	0.527	48%	0.483	S	S	.	.			trans	-91.8	114.9	-168.8	-63.6	-152.9	-67.3	0	0	114	R929 L933	R929-M939 VanDerWaalsContact CZ-SD 3.54Å; R929-M939 PolarHBondContact NH2-SD 2.94Å; L933-M939 HydrophobicContact CD2-CG 4.23Å; L933-M939 HydrophobicContact CD2-SD 3.86Å
940	G	52.3	Low	76.7	Confident	87 Å²	87	85 Å²	85	90%	0.897	47%	0.474	S	S	*	.	S	Bend	trans	-79.6	-13.9	170.8	0	0	0	0	0	116
941	S	55.7	Low	76.8	Confident	54 Å²	54	82 Å²	82	38%	0.378	46%	0.456	S	S	.	.			trans	-156.9	145.7	171	84.7	0	0	0	0	112.7	R929 A943	R929-S941 PolarHBondContact NH2-O 2.92Å; S941-A943 PolarHBondContact O-N 2.89Å; S941-A943 PolarHBondContact OG-N 3.33Å; S941-A943 PolarHBondContact OG-O 2.93Å
942	S	59.1	Low	77	Confident	127 Å²	127	76.7 Å²	76.7	89%	0.888	44%	0.44	S	S	*	.	S	Bend	trans	-74	-1.8	172.1	-56.5	0	0	0	0	113.4
943	A	66.1	Low	77.3	Confident	30 Å²	30	78.8 Å²	78.8	25%	0.248	45%	0.448	C	S	.	.	S	Bend	trans	-98.8	124.6	-174.6	0	0	0	0	0	111.1	K891 S941 L945	K891-A943 HydrophobicContact CD-CB 3.78Å; S941-A943 PolarHBondContact O-N 2.89Å; S941-A943 PolarHBondContact OG-N 3.33Å; S941-A943 PolarHBondContact OG-O 2.93Å; A943-L945 PolarHBondContact O-N 3.15Å
944	L	78.4	Confident	77.7	Confident	46 Å²	46	74.3 Å²	74.3	24%	0.241	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-68.2	117.4	172.6	-164.3	111.1	0	0	0	109.7	M922 A925 L926 R929	M922-L944 HydrophobicContact CE-CD2 4.31Å; M922-L944 HydrophobicContact CG-CD2 3.77Å; A925-L944 HydrophobicContact CB-CD2 3.82Å; A925-L944 HydrophobicContact CB-CG 4.31Å; L926-L944 HydrophobicContact CB-CD1 4.17Å; L926-L944 HydrophobicContact CD1-CD1 3.88Å; R929-L944 HydrophobicContact CB-CD1 4.05Å; R929-L944 HydrophobicContact CG-CD1 4.41Å
945	L	86.8	Confident	77.8	Confident	80 Å²	80	67.4 Å²	67.4	42%	0.419	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-101.3	131.4	177.9	-69.3	164.2	0	0	0	110.2	K891 R928 A943	K891-L945 HydrophobicContact CB-CD2 4.18Å; R928-L945 PolarHBondContact NH2-O 3.01Å; A943-L945 PolarHBondContact O-N 3.15Å
946	L	88.4	Confident	77.9	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.021	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-86	124.8	174.4	-81.3	136.5	0	0	0	110.7	F890 K891 L892 E893 A921 M922	F890-L946 HydrophobicContact CB-CD1 3.54Å; F890-L946 HydrophobicContact CD1-CD1 3.91Å; F890-L946 HydrophobicContact CG-CD1 4.05Å; K891-L946 PolarHBondContact O-N 3.14Å; L892-L946 HydrophobicContact CD2-CB 4.02Å; L892-L946 HydrophobicContact CD2-CD1 4.41Å; E893-L946 WeakPolarHBondContact CB-O 3.33Å; E893-L946 PolarHBondContact N-O 3.31Å; A921-L946 VanDerWaalsContact C-CD2 3.48Å; A921-L946 HydrophobicContact CB-CD2 3.53Å; M922-L946 HydrophobicContact CB-CD2 4.42Å
947	T	89.8	Confident	78.5	Confident	24 Å²	24	69.1 Å²	69.1	15%	0.147	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-95	165.9	176.4	71.3	0	0	0	0	111.2	E893 R928 E949 D950 L951	E893-T947 WeakPolarHBondContact OE2-CG2 3Å; R928-T947 PolarHBondContact NH1-OG1 3.21Å; T947-E949 VanDerWaalsContact C-N 3.25Å; T947-E949 PolarHBondContact O-N 3.07Å; T947-D950 PolarHBondContact N-OD2 3.13Å; T947-D950 PolarHBondContact O-N 3.1Å; T947-D950 VanDerWaalsContact OG1-CG 3.29Å; T947-D950 PolarHBondContact OG1-OD2 2.89Å; T947-L951 PolarHBondContact O-N 3.41Å
948	M	88.7	Confident	79.2	Confident	37 Å²	37	65.1 Å²	65.1	18%	0.182	37%	0.372	C	S	.	.	H	α-helix	trans	-62.2	-34.2	176.9	-172	65.3	-172.5	0	0	112.2	V896 N900 V901 L951 L952	V896-M948 HydrophobicContact CG1-SD 4.17Å; V896-M948 HydrophobicContact CG2-CB 4.48Å; N900-M948 HydrophobicContact CB-CE 3.56Å; V901-M948 HydrophobicContact CG2-CE 3.58Å; V901-M948 HydrophobicContact CG2-SD 3.77Å; M948-L951 PolarHBondContact O-N 3.06Å; M948-L952 HydrophobicContact CE-CD1 4.08Å; M948-L952 HydrophobicContact CE-CD2 4.02Å; M948-L952 HydrophobicContact CE-CG 4Å; M948-L952 HydrophobicContact CG-CD1 4.07Å; M948-L952 HydrophobicContact CG-CG 4.45Å; M948-L952 VanDerWaalsContact O-CG 3.32Å; M948-L952 WeakPolarHBondContact O-CG 3.23Å; M948-L952 PolarHBondContact O-N 3.47Å
949	E	88.4	Confident	80.5	Confident	150 Å²	150	63.5 Å²	63.5	70%	0.701	36%	0.364	S	S	*	.	H	α-helix	trans	-66	-40.7	179.8	-64.2	-178.3	173.1	0	0	112	T947 L951 L952 Q953	T947-E949 VanDerWaalsContact C-N 3.25Å; T947-E949 PolarHBondContact O-N 3.07Å; E949-L951 VanDerWaalsContact C-N 3.31Å; E949-L951 PolarHBondContact O-N 2.88Å; E949-L952 PolarHBondContact O-N 3.07Å; E949-Q953 WeakPolarHBondContact O-CB 3.43Å; E949-Q953 PolarHBondContact O-N 3.33Å
950	D	90.6	Very high	82	Confident	9 Å²	9	61 Å²	61	5%	0.048	36%	0.357	C	S	.	.	H	α-helix	trans	-61.1	-42.5	178.7	-60.3	-37.2	0	0	0	110.8	A921 A925 R928 T947 A954	A921-D950 HydrophobicContact CB-CB 4.3Å; A925-D950 WeakPolarHBondContact CB-OD2 3.2Å; R928-D950 IonicContact CZ-OD2 3.48Å; R928-D950 VanDerWaalsContact NH1-CG 3.35Å; R928-D950 IonicContact NH1-OD1 3.72Å; R928-D950 PolarHBondContact NH1-OD1 2.9Å; R928-D950 VanDerWaalsContact NH1-OD1 3.15Å; R928-D950 IonicContact NH1-OD2 3.71Å; R928-D950 PolarHBondContact NH1-OD2 2.9Å; R928-D950 IonicContact NH2-OD2 3.61Å; R928-D950 PolarHBondContact NH2-OD2 2.8Å; T947-D950 PolarHBondContact N-OD2 3.13Å; T947-D950 PolarHBondContact O-N 3.1Å; T947-D950 VanDerWaalsContact OG1-CG 3.29Å; T947-D950 PolarHBondContact OG1-OD2 2.89Å; D950-A954 WeakPolarHBondContact O-CB 3.27Å; D950-A954 PolarHBondContact O-N 3.27Å
951	L	89.2	Confident	83.5	Confident	3 Å²	3	61 Å²	61	2%	0.016	34%	0.342	C	S	.	.	H	α-helix	trans	-69.9	-39.3	178	-74.6	164.5	0	0	0	112.6	L892 V896 V901 A921 T947 M948 E949 A954 A955	L892-L951 HydrophobicContact CD2-CD1 4.22Å; V896-L951 HydrophobicContact CG1-CD1 3.57Å; V901-L951 HydrophobicContact CG1-CB 4.34Å; V901-L951 HydrophobicContact CG2-CB 3.97Å; V901-L951 HydrophobicContact CG2-CD1 4.24Å; A921-L951 HydrophobicContact CB-CD2 3.65Å; A921-L951 HydrophobicContact CB-CG 4.04Å; T947-L951 PolarHBondContact O-N 3.41Å; M948-L951 PolarHBondContact O-N 3.06Å; E949-L951 VanDerWaalsContact C-N 3.31Å; E949-L951 PolarHBondContact O-N 2.88Å; L951-A954 PolarHBondContact O-N 2.88Å; L951-A955 WeakPolarHBondContact O-CB 3.32Å; L951-A955 PolarHBondContact O-N 2.92Å
952	L	90.1	Very high	84.8	Confident	51 Å²	51	58.6 Å²	58.6	27%	0.267	33%	0.326	S	S	.	.	H	α-helix	trans	-68.7	-38	176.6	-72.1	173.6	0	0	0	111.9	R904 M948 E949 A954 A955 A956	R904-L952 HydrophobicContact CB-CD2 4.32Å; R904-L952 HydrophobicContact CG-CD2 3.77Å; M948-L952 HydrophobicContact CE-CD1 4.08Å; M948-L952 HydrophobicContact CE-CD2 4.02Å; M948-L952 HydrophobicContact CE-CG 4Å; M948-L952 HydrophobicContact CG-CD1 4.07Å; M948-L952 HydrophobicContact CG-CG 4.45Å; M948-L952 VanDerWaalsContact O-CG 3.32Å; M948-L952 WeakPolarHBondContact O-CG 3.23Å; M948-L952 PolarHBondContact O-N 3.47Å; E949-L952 PolarHBondContact O-N 3.07Å; L952-A954 VanDerWaalsContact C-N 3.34Å; L952-A955 PolarHBondContact O-N 2.86Å; L952-A956 PolarHBondContact O-N 2.87Å
953	Q	89.4	Confident	86.1	Confident	85 Å²	85	55 Å²	55	40%	0.397	30%	0.3	S	S	.	.	H	α-helix	trans	-66.4	-38.4	175.9	-168.1	176.9	26.8	0	0	111.5	E949	E949-Q953 WeakPolarHBondContact O-CB 3.43Å; E949-Q953 PolarHBondContact O-N 3.33Å
954	A	90.1	Very high	87	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-65.5	-43.9	172.2	0	0	0	0	0	111.7	L917 D920 A921 D950 L951 L952 A956 R957 L958	L917-A954 HydrophobicContact CD1-CB 4.2Å; L917-A954 HydrophobicContact CG-CB 4.42Å; L917-A954 WeakPolarHBondContact O-CB 3.39Å; D920-A954 HydrophobicContact CB-CB 3.98Å; A921-A954 HydrophobicContact CB-CB 4.05Å; D950-A954 WeakPolarHBondContact O-CB 3.27Å; D950-A954 PolarHBondContact O-N 3.27Å; L951-A954 PolarHBondContact O-N 2.88Å; L952-A954 VanDerWaalsContact C-N 3.34Å; A954-A956 VanDerWaalsContact C-N 3.28Å; A954-A956 PolarHBondContact O-N 2.87Å; A954-R957 PolarHBondContact O-N 3.07Å; A954-L958 PolarHBondContact O-N 2.67Å; A954-L958 VanDerWaalsContact O-N 3.09Å
955	A	88	Confident	87.3	Confident	8 Å²	8	64.8 Å²	64.8	7%	0.066	34%	0.339	C	S	.	.	H	α-helix	trans	-58.9	-37.9	178.4	0	0	0	0	0	112.8	L917 L951 L952 R957 L958	L917-A955 HydrophobicContact CD1-CB 3.78Å; L951-A955 WeakPolarHBondContact O-CB 3.32Å; L951-A955 PolarHBondContact O-N 2.92Å; L952-A955 PolarHBondContact O-N 2.86Å; A955-R957 VanDerWaalsContact C-N 3.27Å; A955-R957 PolarHBondContact O-N 3.42Å; A955-L958 PolarHBondContact O-N 3.39Å
956	A	86.9	Confident	87.3	Confident	89 Å²	89	65.2 Å²	65.2	74%	0.736	34%	0.34	S	S	*	.	H	α-helix	trans	-69	-23.3	177.8	0	0	0	0	0	113.8	L952 A954	L952-A956 PolarHBondContact O-N 2.87Å; A954-A956 VanDerWaalsContact C-N 3.28Å; A954-A956 PolarHBondContact O-N 2.87Å
957	R	86.9	Confident	87	Confident	157 Å²	157	66.3 Å²	66.3	59%	0.592	35%	0.345	S	S	*	.	H	α-helix	trans	-94.8	-15.7	179.3	-68	178.8	-178.7	154.7	5.3	113.2	A954 A955 Q959	A954-R957 PolarHBondContact O-N 3.07Å; A955-R957 VanDerWaalsContact C-N 3.27Å; A955-R957 PolarHBondContact O-N 3.42Å; R957-Q959 PolarHBondContact O-N 2.84Å
958	L	86.5	Confident	86.8	Confident	21 Å²	21	69.6 Å²	69.6	11%	0.11	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-66	123	-174.4	-168.3	82.4	0	0	0	111	L909 D913 L917 A954 A955	L909-L958 HydrophobicContact CD1-CD2 3.64Å; L909-L958 HydrophobicContact CD2-CD2 3.44Å; L909-L958 VanDerWaalsContact CD2-CD2 3.44Å; L909-L958 HydrophobicContact CD2-CG 4.37Å; L909-L958 HydrophobicContact CG-CD2 4.21Å; D913-L958 WeakPolarHBondContact O-CD1 3.45Å; L917-L958 HydrophobicContact CB-CD1 4.1Å; L917-L958 HydrophobicContact CD1-CB 4.42Å; L917-L958 HydrophobicContact CD1-CD1 4.41Å; L917-L958 HydrophobicContact CD1-CD2 4.14Å; A954-L958 PolarHBondContact O-N 2.67Å; A954-L958 VanDerWaalsContact O-N 3.09Å; A955-L958 PolarHBondContact O-N 3.39Å
959	Q	84.9	Confident	86.8	Confident	163 Å²	163	74 Å²	74	76%	0.762	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-102.9	133.8	167.3	-68.4	-177	-8.8	0	0	109.1	R957 S961	R957-Q959 PolarHBondContact O-N 2.84Å; Q959-S961 PolarHBondContact O-N 2.69Å
960	P	84.8	Confident	86.7	Confident	56 Å²	56	68.2 Å²	68.2	36%	0.364	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-67.5	132.2	178.3	27.5	-32.7	0	0	0	110.3	L909 V962	L909-P960 HydrophobicContact CD2-CB 4.25Å; P960-V962 VanDerWaalsContact C-N 3.29Å; P960-V962 PolarHBondContact O-N 3.21Å
961	S	84.2	Confident	86.4	Confident	86 Å²	86	71.1 Å²	71.1	60%	0.601	36%	0.36	S	S	*	.	S	Bend	trans	-72.5	-20.7	-179	-66.5	0	0	0	0	113.9	D913 Q959	D913-S961 WeakPolarHBondContact OD1-CB 3.35Å; D913-S961 PolarHBondContact OD1-N 2.7Å; D913-S961 PolarHBondContact OD1-OG 3.15Å; Q959-S961 PolarHBondContact O-N 2.69Å
962	V	84.4	Confident	86.3	Confident	4 Å²	4	79.2 Å²	79.2	2%	0.024	39%	0.391	C	S	.	.	S	Bend	trans	-120.4	127.8	-176.2	-172.7	0	0	0	0	109.5	P745 T910 P960 E966 L967	P745-V962 HydrophobicContact CB-CG1 4.42Å; P745-V962 HydrophobicContact CB-CG2 4.22Å; T910-V962 HydrophobicContact CG2-CB 4.47Å; T910-V962 HydrophobicContact CG2-CG2 3.64Å; P960-V962 VanDerWaalsContact C-N 3.29Å; P960-V962 PolarHBondContact O-N 3.21Å; V962-E966 HydrophobicContact CG1-CB 3.94Å; V962-L967 HydrophobicContact CG1-CD2 4Å; V962-L967 HydrophobicContact CG1-CG 3.87Å
963	S	86.3	Confident	86	Confident	50 Å²	50	77.6 Å²	77.6	35%	0.35	38%	0.382	S	S	.	.			trans	-79.2	155.5	177.7	64	0	0	0	0	112.6	Q965 E966 L967	S963-Q965 PolarHBondContact O-N 2.71Å; S963-E966 PolarHBondContact N-OE2 2.81Å; S963-E966 PolarHBondContact O-N 3.23Å; S963-E966 VanDerWaalsContact O-N 3.13Å; S963-E966 VanDerWaalsContact OG-CD 3.3Å; S963-E966 VanDerWaalsContact OG-CG 3.24Å; S963-E966 WeakPolarHBondContact OG-CG 3.5Å; S963-E966 PolarHBondContact OG-N 3.46Å; S963-E966 PolarHBondContact OG-OE2 3.26Å; S963-L967 PolarHBondContact O-N 3.18Å; S963-L967 VanDerWaalsContact O-N 3.08Å
964	E	83.6	Confident	85.7	Confident	120 Å²	120	77.2 Å²	77.2	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-56	-36.4	173.1	-69.5	-173.3	173.6	0	0	112.7	Q908 E966 L967 L968	Q908-E964 HydrophobicContact CG-CG 4.42Å; Q908-E964 PolarHBondContact NE2-OE1 3.12Å; Q908-E964 VanDerWaalsContact OE1-CG 3.24Å; E964-E966 VanDerWaalsContact C-N 3.34Å; E964-E966 PolarHBondContact O-N 3.4Å; E964-L967 PolarHBondContact O-N 3.35Å; E964-L968 WeakPolarHBondContact O-CG 2.91Å; E964-L968 PolarHBondContact O-N 2.66Å
965	Q	86.4	Confident	85.4	Confident	162 Å²	162	86.3 Å²	86.3	76%	0.757	41%	0.414	S	S	*	.	H	α-helix	trans	-64.9	-39.5	179.4	-63.6	-176.7	5	0	0	111.7	S963 L968 R969	S963-Q965 PolarHBondContact O-N 2.71Å; Q965-L968 PolarHBondContact O-N 3.42Å; Q965-R969 PolarHBondContact O-N 3.02Å
966	E	84.9	Confident	85.2	Confident	90 Å²	90	93.2 Å²	93.2	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-69.1	-41	175.6	-73.7	167.9	143.1	0	0	111.7	V962 S963 E964 L968 R969 Y970	V962-E966 HydrophobicContact CG1-CB 3.94Å; S963-E966 PolarHBondContact N-OE2 2.81Å; S963-E966 PolarHBondContact O-N 3.23Å; S963-E966 VanDerWaalsContact O-N 3.13Å; S963-E966 VanDerWaalsContact OG-CD 3.3Å; S963-E966 VanDerWaalsContact OG-CG 3.24Å; S963-E966 WeakPolarHBondContact OG-CG 3.5Å; S963-E966 PolarHBondContact OG-N 3.46Å; S963-E966 PolarHBondContact OG-OE2 3.26Å; E964-E966 VanDerWaalsContact C-N 3.34Å; E964-E966 PolarHBondContact O-N 3.4Å; E966-L968 VanDerWaalsContact C-N 3.31Å; E966-L968 PolarHBondContact O-N 3.23Å; E966-R969 CarbonylContact O-C 3.06Å; E966-R969 WeakPolarHBondContact O-CA 3.5Å; E966-R969 VanDerWaalsContact O-CB 3.32Å; E966-R969 WeakPolarHBondContact O-CB 3.44Å; E966-R969 PolarHBondContact O-N 3.49Å; E966-Y970 WeakPolarHBondContact O-CD2 3.27Å; E966-Y970 PolarHBondContact O-N 3.13Å
967	L	83.3	Confident	84.6	Confident	26 Å²	26	91.5 Å²	91.5	14%	0.136	42%	0.419	C	S	.	.	H	α-helix	trans	-59.4	-43	173.8	-71.2	171.8	0	0	0	111.4	P745 A872 Q908 V962 S963 E964 R969 Y970 K971	P745-L967 HydrophobicContact CG-CD2 4.45Å; A872-L967 HydrophobicContact CB-CD2 3.97Å; Q908-L967 HydrophobicContact CB-CD1 4.43Å; Q908-L967 HydrophobicContact CG-CD1 4.17Å; V962-L967 HydrophobicContact CG1-CD2 4Å; V962-L967 HydrophobicContact CG1-CG 3.87Å; S963-L967 PolarHBondContact O-N 3.18Å; S963-L967 VanDerWaalsContact O-N 3.08Å; E964-L967 PolarHBondContact O-N 3.35Å; L967-R969 VanDerWaalsContact C-N 3.32Å; L967-R969 PolarHBondContact O-N 3.49Å; L967-Y970 PolarHBondContact O-N 3.46Å; L967-K971 WeakPolarHBondContact O-CG 3.48Å; L967-K971 PolarHBondContact O-N 3.22Å
968	L	85.8	Confident	83.9	Confident	94 Å²	94	88 Å²	88	49%	0.492	42%	0.424	S	S	.	.	H	α-helix	trans	-62.9	-37.6	173.6	-72.3	171.9	0	0	0	112.1	E964 Q965 E966 K971 R972	E964-L968 WeakPolarHBondContact O-CG 2.91Å; E964-L968 PolarHBondContact O-N 2.66Å; Q965-L968 PolarHBondContact O-N 3.42Å; E966-L968 VanDerWaalsContact C-N 3.31Å; E966-L968 PolarHBondContact O-N 3.23Å; L968-K971 PolarHBondContact O-N 3.22Å; L968-R972 WeakPolarHBondContact O-CG 3.39Å; L968-R972 PolarHBondContact O-N 3.02Å
969	R	87.8	Confident	82.7	Confident	129 Å²	129	91.3 Å²	91.3	49%	0.487	45%	0.454	S	S	.	.	H	α-helix	trans	-61.1	-48	172.9	-179.6	-177.5	171.8	179.4	-2.1	110.9	D852 Q965 E966 L967 K971 R972 I973	D852-R969 IonicContact OD2-CZ 3.03Å; D852-R969 IonicContact OD2-NH2 3.96Å; D852-R969 PolarHBondContact OD2-NH2 2.89Å; Q965-R969 PolarHBondContact O-N 3.02Å; E966-R969 CarbonylContact O-C 3.06Å; E966-R969 WeakPolarHBondContact O-CA 3.5Å; E966-R969 VanDerWaalsContact O-CB 3.32Å; E966-R969 WeakPolarHBondContact O-CB 3.44Å; E966-R969 PolarHBondContact O-N 3.49Å; L967-R969 VanDerWaalsContact C-N 3.32Å; L967-R969 PolarHBondContact O-N 3.49Å; R969-K971 PolarHBondContact O-N 2.74Å; R969-R972 PolarHBondContact O-N 3.42Å; R969-I973 HydrophobicContact CG-CD1 3.95Å; R969-I973 VanDerWaalsContact O-CG1 3.3Å; R969-I973 WeakPolarHBondContact O-CG1 3.31Å; R969-I973 PolarHBondContact O-N 3.07Å
970	Y	86.5	Confident	81.2	Confident	29 Å²	29	91 Å²	91	11%	0.114	47%	0.468	C	S	.	.	H	α-helix	trans	-62.7	-40.2	177	-76.4	-69.2	0	0	0	112.5	P745 N849 E966 L967 R972 I973 Q974	P745-Y970 HydrophobicContact CB-CD2 4.01Å; P745-Y970 HydrophobicContact CB-CE2 3.7Å; P745-Y970 HydrophobicContact CG-CD2 4.34Å; P745-Y970 HydrophobicContact CG-CE2 4.5Å; N849-Y970 WeakPolarHBondContact O-CE1 3.48Å; N849-Y970 PolarHBondContact O-OH 3.37Å; N849-Y970 VanDerWaalsContact O-OH 3.12Å; E966-Y970 WeakPolarHBondContact O-CD2 3.27Å; E966-Y970 PolarHBondContact O-N 3.13Å; L967-Y970 PolarHBondContact O-N 3.46Å; Y970-R972 VanDerWaalsContact C-N 3.35Å; Y970-R972 PolarHBondContact O-N 3.39Å; Y970-I973 PolarHBondContact O-N 3Å; Y970-Q974 WeakPolarHBondContact O-CB 3.15Å; Y970-Q974 PolarHBondContact O-N 3.39Å
971	K	84.6	Confident	81	Confident	70 Å²	70	92.8 Å²	92.8	30%	0.304	47%	0.473	S	S	.	.	H	α-helix	trans	-62.1	-39.3	173.9	-73.9	-177.4	179.2	-174.7	0	112.5	E874 L967 L968 R969 R975	E874-K971 VanDerWaalsContact CD-NZ 3.33Å; E874-K971 WeakPolarHBondContact OE1-CE 3.23Å; E874-K971 IonicContact OE1-NZ 2.64Å; E874-K971 PolarHBondContact OE1-NZ 2.92Å; E874-K971 IonicContact OE2-NZ 3.19Å; E874-K971 PolarHBondContact OE2-NZ 2.88Å; L967-K971 WeakPolarHBondContact O-CG 3.48Å; L967-K971 PolarHBondContact O-N 3.22Å; L968-K971 PolarHBondContact O-N 3.22Å; R969-K971 PolarHBondContact O-N 2.74Å; K971-R975 WeakPolarHBondContact O-CG 3.45Å; K971-R975 PolarHBondContact O-N 2.84Å
972	R	87.2	Confident	80.8	Confident	173 Å²	173	93.2 Å²	93.2	65%	0.653	47%	0.467	S	S	*	.	H	α-helix	trans	-65.4	-42	174.1	-72.9	175.8	-170.6	171.5	3.8	111.5	L968 R969 Y970 R975 K976	L968-R972 WeakPolarHBondContact O-CG 3.39Å; L968-R972 PolarHBondContact O-N 3.02Å; R969-R972 PolarHBondContact O-N 3.42Å; Y970-R972 VanDerWaalsContact C-N 3.35Å; Y970-R972 PolarHBondContact O-N 3.39Å; R972-R975 PolarHBondContact O-N 3.18Å; R972-K976 WeakPolarHBondContact O-CG 3.17Å; R972-K976 PolarHBondContact O-N 2.89Å; R972-K976 VanDerWaalsContact O-N 3.1Å
973	I	84.5	Confident	80.6	Confident	17 Å²	17	98.1 Å²	98.1	9%	0.087	49%	0.491	C	S	.	.	H	α-helix	trans	-62.7	-46	176.9	-70.2	169.2	0	0	0	110.3	P851 R969 Y970 R975 K976 F977	P851-I973 HydrophobicContact CG-CG2 3.81Å; R969-I973 HydrophobicContact CG-CD1 3.95Å; R969-I973 VanDerWaalsContact O-CG1 3.3Å; R969-I973 WeakPolarHBondContact O-CG1 3.31Å; R969-I973 PolarHBondContact O-N 3.07Å; Y970-I973 PolarHBondContact O-N 3Å; I973-R975 VanDerWaalsContact C-N 3.34Å; I973-R975 PolarHBondContact O-N 3.48Å; I973-K976 WeakPolarHBondContact O-CB 3.18Å; I973-K976 PolarHBondContact O-N 3.23Å; I973-K976 VanDerWaalsContact O-N 3.1Å; I973-F977 HydrophobicContact CG2-CD2 3.56Å; I973-F977 HydrophobicContact CG2-CE2 3.47Å; I973-F977 VanDerWaalsContact CG2-CE2 3.47Å; I973-F977 VanDerWaalsContact O-CD2 3.26Å; I973-F977 WeakPolarHBondContact O-CD2 3.06Å; I973-F977 PolarHBondContact O-N 3.22Å
974	Q	82.9	Confident	80.3	Confident	76 Å²	76	100.9 Å²	100.9	36%	0.355	50%	0.5	S	S	.	.	H	α-helix	trans	-56.4	-46.4	175.6	-173.9	-170.7	14	0	0	111.8	F869 Y970 K976 F977 A978	F869-Q974 HydrophobicContact CB-CG 4.15Å; F869-Q974 VanDerWaalsContact CD1-CD 3.46Å; F869-Q974 HydrophobicContact CD1-CG 4.3Å; F869-Q974 HydrophobicContact CG-CG 4.06Å; Y970-Q974 WeakPolarHBondContact O-CB 3.15Å; Y970-Q974 PolarHBondContact O-N 3.39Å; Q974-K976 VanDerWaalsContact C-N 3.29Å; Q974-K976 PolarHBondContact O-N 3.33Å; Q974-F977 PolarHBondContact O-N 2.87Å; Q974-A978 WeakPolarHBondContact O-CB 3.44Å; Q974-A978 PolarHBondContact O-N 2.6Å
975	R	83.9	Confident	80.1	Confident	193 Å²	193	99.8 Å²	99.8	73%	0.728	50%	0.496	S	S	*	.	H	α-helix	trans	-62.6	-34	177	-73.2	179.8	-175	178.5	1	113.2	K971 R972 I973 A979	K971-R975 WeakPolarHBondContact O-CG 3.45Å; K971-R975 PolarHBondContact O-N 2.84Å; R972-R975 PolarHBondContact O-N 3.18Å; I973-R975 VanDerWaalsContact C-N 3.34Å; I973-R975 PolarHBondContact O-N 3.48Å; R975-A979 VanDerWaalsContact O-CB 3.3Å; R975-A979 WeakPolarHBondContact O-CB 3.33Å; R975-A979 PolarHBondContact O-N 2.87Å
976	K	82.5	Confident	79.7	Confident	153 Å²	153	95.6 Å²	95.6	67%	0.665	48%	0.478	S	S	*	.	H	α-helix	trans	-67	-45.6	175.2	-72.3	179.7	178.8	-171.2	0	111.2	R972 I973 Q974 A979 C980	R972-K976 WeakPolarHBondContact O-CG 3.17Å; R972-K976 PolarHBondContact O-N 2.89Å; R972-K976 VanDerWaalsContact O-N 3.1Å; I973-K976 WeakPolarHBondContact O-CB 3.18Å; I973-K976 PolarHBondContact O-N 3.23Å; I973-K976 VanDerWaalsContact O-N 3.1Å; Q974-K976 VanDerWaalsContact C-N 3.29Å; Q974-K976 PolarHBondContact O-N 3.33Å; K976-A979 PolarHBondContact O-N 2.92Å; K976-C980 PolarHBondContact O-N 3.24Å; K976-C980 PolarHBondContact O-SG 3.33Å
977	F	75.5	Confident	79.3	Confident	52 Å²	52	96 Å²	96	23%	0.228	48%	0.483	C	S	.	.	H	α-helix	trans	-73.3	-25.1	179.3	-75.1	-67.1	0	0	0	113.9	P851 L859 L867 I973 Q974 A979	P851-F977 HydrophobicContact CB-CE2 3.89Å; P851-F977 HydrophobicContact CB-CZ 4.21Å; P851-F977 HydrophobicContact CG-CE2 4.09Å; L859-F977 HydrophobicContact CD1-CD1 4.18Å; L859-F977 HydrophobicContact CD1-CE1 3.44Å; L859-F977 VanDerWaalsContact CD1-CE1 3.44Å; L859-F977 HydrophobicContact CD1-CZ 4.21Å; L867-F977 HydrophobicContact CD2-CD1 4.45Å; I973-F977 HydrophobicContact CG2-CD2 3.56Å; I973-F977 HydrophobicContact CG2-CE2 3.47Å; I973-F977 VanDerWaalsContact CG2-CE2 3.47Å; I973-F977 VanDerWaalsContact O-CD2 3.26Å; I973-F977 WeakPolarHBondContact O-CD2 3.06Å; I973-F977 PolarHBondContact O-N 3.22Å; Q974-F977 PolarHBondContact O-N 2.87Å; F977-A979 VanDerWaalsContact C-N 3.33Å
978	A	70.9	Confident	79	Confident	85 Å²	85	101.4 Å²	101.4	70%	0.702	51%	0.509	S	S	*	.	H	α-helix	trans	-79.9	-15.1	172.8	0	0	0	0	0	113.5	Q974	Q974-A978 WeakPolarHBondContact O-CB 3.44Å; Q974-A978 PolarHBondContact O-N 2.6Å
979	A	62	Low	78.4	Confident	89 Å²	89	102 Å²	102	74%	0.736	51%	0.511	S	S	*	.	H	α-helix	trans	-96.8	-14.9	178.3	0	0	0	0	0	113.3	R975 K976 F977	R975-A979 VanDerWaalsContact O-CB 3.3Å; R975-A979 WeakPolarHBondContact O-CB 3.33Å; R975-A979 PolarHBondContact O-N 2.87Å; K976-A979 PolarHBondContact O-N 2.92Å; F977-A979 VanDerWaalsContact C-N 3.33Å
980	C	53.1	Low	77.6	Confident	158 Å²	158	99.5 Å²	99.5	100%	1.068	51%	0.513	S	S	*	.			trans	-87	0	167.4	-67.6	0	0	0	0	109.4	K976	K976-C980 PolarHBondContact O-N 3.24Å; K976-C980 PolarHBondContact O-SG 3.33Å

Retrieved 980 of 980 residues in 820.3 ms (Link to these results)

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