A0A087XZR1_POEFO Loading...

ATP-dependent RNA helicase

ATP-dependent RNA helicase that plays a role in various aspects of RNA metabolism including pre-mRNA splicing and is thereby involved in different biological processes such as cell cycle regulation or innate immunity. Plays an inhibitory role in TP53 transcriptional activity and subsequently in TP53 controlled cell growth arrest and senescence by inhibiting its EP300 mediated acetylation. Negatively regulates cytosolic RNA-mediated innate immune signaling at least in part by affecting RIPK1/IRF7 interactions. Alternatively, possesses antiviral activity by recognizing gammaherpesvirus transcripts in the context of lytic reactivation. Plays an essential role in cell cycle regulation in vascular smooth muscle cells by interacting with and regulating FANCA (Fanconi anemia complementation group A) mRNA. RNA helicase.

AlphaFold DB , UniProt , Accession A0A087XZR1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 835 aa.

						>A0A087XZR1_POEFO|A0A087XZR1
MKPKKGKTVGKRSSSVKLSFDIKGKWKPVELDPHLFAEEGLKDLVCFEELTSYRLVDNEKAEKQLRKEKKRAKKREAEQSLDEPVKKKKQKKRQKVAENDPEMAGCSTNEDVKQEGEASSKKDRESQKEAAAVSEHVQSSNTEKKKKKKQKKKKKKKPRQQTEQAAVTENQEAIKPPEEEKPRLKQRKPPKKQPKNWTNAALSGSEEKNSDVSAWKDLFVPSAVLKALSSLGFTSPTPIQTLALPPAIRDRMDILGAAETGSGKTLAFGIPMIHTILEWKDASEITSEPGDTDESKTREQQVKDGMEASVEDEEMEVDQTLGSDEDEQDSEGEDQDEQLGCVRVIDDVEFDFKENVPEGRKRPLLGLVLTPTRELAVQVKHHIDAVAKYTDIQTAIVVGGMAQQKQRRMLKRRPEIIIATPGRLWDLINEGHPHLLNLRQLKCLVIDEADRMVERGHFAELENLLEMLNTTHFNPTRQTFVFSATLMMVHGLPSRVLQKKKRQLDSRSKLEILMEKVGIKSKPKVLDLTRKEATVETLTETQIHCQKDEKDFYLYYFLLQYPGRTMVFANSIDCIKRLSALLVILDCNPLPLHANMHQKHRLKNLERFAEKQNCVLLTTDVAARGLDIPNVQHVIHYQVPRTSETYVHRSGRTARATKEGLSLLLIGPDDVINFKKISKTLGKDEELATFPVENKCMKAIKERVNLARKIEKIEYYNNREKQHDSWFKQAAEALEVDLDDDLLIGSAKDQETDTEQKKMVKQMKKNLKHLISQPIFKNLVKTKYPTKMGKLALANMPVAGMESALTRISGQKKLKRYFPQQQKQQKQRKRIKKQE
					

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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	36.2	Very low	31.2	Very low	243 Å²	243	167.4 Å²	167.4	100%	1.197	89%	0.891	S	S	*	*				0	140.2	0	-71	157.7	143.8	0	0	110.1
2	K	25.1	Very low	31	Very low	208 Å²	208	173.9 Å²	173.9	90%	0.904	89%	0.894	S	S	*	*			trans	-148.7	129.7	165.9	-79.6	-175.7	176.7	176.1	0	108.3
3	P	32.6	Very low	30.9	Very low	127 Å²	127	169.8 Å²	169.8	83%	0.825	89%	0.89	S	S	*	*			trans	-84.8	152.8	179.2	32.8	-34	0	0	0	112.8
4	K	37.8	Very low	30.7	Very low	207 Å²	207	165.6 Å²	165.6	90%	0.9	88%	0.882	S	S	*	*			trans	-68.8	151.6	168.4	-61.4	171.5	179.4	173.7	0	110.4
5	K	31.2	Very low	30.7	Very low	214 Å²	214	161.3 Å²	161.3	93%	0.93	87%	0.87	S	S	*	*			trans	-135	143.6	150.9	-75.9	-161.3	174	-172.8	0	110.2
6	G	28.6	Very low	30.8	Very low	77 Å²	77	159 Å²	159	79%	0.794	86%	0.863	S	S	*	*			trans	-94.6	-176.7	-170.1	0	0	0	0	0	114.9
7	K	30.4	Very low	31.1	Very low	200 Å²	200	160.6 Å²	160.6	87%	0.87	86%	0.86	S	S	*	*			trans	-71.1	147	178.2	-59.1	173.7	-180	176.1	0	111.8
8	T	28.1	Very low	31.2	Very low	148 Å²	148	159.3 Å²	159.3	91%	0.908	85%	0.852	S	S	*	*			trans	-134	151.4	144.9	29.1	0	0	0	0	108.2
9	V	31	Very low	31.4	Very low	137 Å²	137	154.9 Å²	154.9	83%	0.83	84%	0.835	S	S	*	*			trans	-108.4	135.2	-170.7	175.3	0	0	0	0	110.1
10	G	28.3	Very low	31.9	Very low	71 Å²	71	152.9 Å²	152.9	73%	0.732	82%	0.818	S	S	*	*			trans	-136.6	116.1	169.5	0	0	0	0	0	110.1
11	K	33.5	Very low	32.5	Very low	209 Å²	209	149.5 Å²	149.5	91%	0.909	80%	0.8	S	S	*	*			trans	-65.9	138.1	178	-69.3	179.2	176.5	178.9	0	110.4
12	R	29.6	Very low	33.4	Very low	246 Å²	246	142.3 Å²	142.3	93%	0.928	77%	0.766	S	S	*	*			trans	-132.5	144.3	156.8	-78.3	-171.2	171.1	-177.5	-3.2	108.7
13	S	30	Very low	34.6	Very low	120 Å²	120	137.8 Å²	137.8	84%	0.839	75%	0.746	S	S	*	*			trans	-66.8	140	-178.6	39.9	0	0	0	0	111.6	S15	S13-S15 PolarHBondContact O-N 3.24Å
14	S	27.8	Very low	36.3	Very low	111 Å²	111	133.3 Å²	133.3	78%	0.776	72%	0.723	S	S	*	*			trans	-89.2	96.5	176.9	50.3	0	0	0	0	110.8	V16	S14-V16 PolarHBondContact O-N 3.02Å
15	S	29.7	Very low	37.3	Very low	101 Å²	101	131.2 Å²	131.2	71%	0.706	71%	0.714	S	S	*	*			trans	-68.8	114.1	161.7	56.2	0	0	0	0	109	S13 K17	S13-S15 PolarHBondContact O-N 3.24Å; S15-K17 PolarHBondContact O-N 3.47Å; S15-K17 VanDerWaalsContact O-N 3.11Å
16	V	32.5	Very low	39.2	Very low	125 Å²	125	128.8 Å²	128.8	76%	0.758	70%	0.699	S	S	*	*			trans	-69.6	106.9	-178.9	-179.9	0	0	0	0	109.6	S14 L18	S14-V16 PolarHBondContact O-N 3.02Å; V16-L18 HydrophobicContact CG1-CG 4.41Å; V16-L18 PolarHBondContact O-N 3.13Å
17	K	35.8	Very low	41.1	Very low	186 Å²	186	131.4 Å²	131.4	81%	0.809	69%	0.688	S	S	*	*			trans	-84.6	99.6	167.5	-76	-169.2	171.9	-169	0	109.2	S15 S19	S15-K17 PolarHBondContact O-N 3.47Å; S15-K17 VanDerWaalsContact O-N 3.11Å; K17-S19 PolarHBondContact O-N 3.42Å; K17-S19 VanDerWaalsContact O-N 3.1Å
18	L	33	Very low	43	Very low	137 Å²	137	126 Å²	126	72%	0.717	67%	0.674	S	S	*	*			trans	-67.5	101.6	163.5	-75.4	166.4	0	0	0	108.7	V16 F20	V16-L18 HydrophobicContact CG1-CG 4.41Å; V16-L18 PolarHBondContact O-N 3.13Å; L18-F20 HydrophobicContact CB-CE2 4.17Å; L18-F20 HydrophobicContact CB-CZ 4.36Å
19	S	35.3	Very low	44.9	Very low	76 Å²	76	121.9 Å²	121.9	53%	0.531	65%	0.649	S	S	.	*			trans	-102.9	106.5	173.8	61.7	0	0	0	0	109.6	K17	K17-S19 PolarHBondContact O-N 3.42Å; K17-S19 VanDerWaalsContact O-N 3.1Å
20	F	41.5	Very low	45.9	Very low	114 Å²	114	124.5 Å²	124.5	50%	0.5	65%	0.652	S	S	.	*			trans	-82.9	136.7	170.9	-56.9	-79.6	0	0	0	109.7	L18 L55	L18-F20 HydrophobicContact CB-CE2 4.17Å; L18-F20 HydrophobicContact CB-CZ 4.36Å; F20-L55 HydrophobicContact CB-CD2 3.97Å
21	D	44	Very low	47.4	Very low	83 Å²	83	125 Å²	125	44%	0.444	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	128.4	176.5	-165.9	32	0	0	0	109.1
22	I	55	Low	48.5	Very low	92 Å²	92	120.2 Å²	120.2	47%	0.472	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.5	116.4	-170.4	-48.4	-176.7	0	0	0	109.5	L50 L55	I22-L50 HydrophobicContact CG2-CD2 3.73Å; I22-L55 HydrophobicContact CD1-CD2 4.46Å; I22-L55 HydrophobicContact CG1-CD2 4.01Å
23	K	52	Low	49.8	Very low	112 Å²	112	113.4 Å²	113.4	49%	0.487	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.8	124.8	171.6	-68.3	-174.8	177.4	-177.1	0	110.3	Y53 R54	K23-Y53 CarbonylContact O-C 3.5Å; K23-Y53 VanDerWaalsContact O-CA 3.23Å; K23-Y53 WeakPolarHBondContact O-CA 3.42Å; K23-R54 PolarHBondContact N-O 2.79Å; K23-R54 PolarHBondContact O-N 3.42Å
24	G	67.9	Low	51	Low	33 Å²	33	115.4 Å²	115.4	34%	0.34	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-162	-171.9	174	0	0	0	0	0	110.6
25	K	57.2	Low	52.4	Low	163 Å²	163	116 Å²	116	71%	0.709	60%	0.599	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-114.3	119.9	174.2	-72.5	-173.9	179.4	-179	0	111.1	T51	K25-T51 PolarHBondContact N-O 2.66Å; K25-T51 PolarHBondContact O-N 3.27Å; K25-T51 PolarHBondContact O-OG1 3.38Å
26	W	71.2	Confident	53.7	Low	163 Å²	163	114.6 Å²	114.6	62%	0.617	58%	0.58	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.9	135.6	169.1	-61.9	101.9	0	0	0	110.5	E48 E49 L50	W26-E48 HydrophobicContact CB-CB 4.26Å; W26-E48 WeakPolarHBondContact CB-OE2 3.45Å; W26-E48 HydrophobicContact CD2-CB 4.49Å; W26-E48 HydrophobicContact CE3-CB 3.78Å; W26-E48 WeakPolarHBondContact CZ3-O 3.45Å; W26-E49 CarbonylContact C-O 3.56Å; W26-E49 WeakPolarHBondContact CA-O 3.46Å; W26-L50 HydrophobicContact CD2-CB 4.21Å; W26-L50 HydrophobicContact CD2-CD1 3.88Å; W26-L50 HydrophobicContact CE3-CB 3.85Å; W26-L50 HydrophobicContact CE3-CD1 4.39Å; W26-L50 HydrophobicContact CG-CD1 4.12Å; W26-L50 HydrophobicContact CH2-CB 3.97Å; W26-L50 HydrophobicContact CH2-CD2 4.28Å; W26-L50 HydrophobicContact CZ2-CB 4.3Å; W26-L50 HydrophobicContact CZ2-CD1 4.2Å; W26-L50 HydrophobicContact CZ2-CD2 4.06Å; W26-L50 HydrophobicContact CZ2-CG 4.41Å; W26-L50 HydrophobicContact CZ3-CB 3.74Å
27	K	68.6	Low	54.6	Low	132 Å²	132	112.5 Å²	112.5	57%	0.574	58%	0.575	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-130	130.7	173	-175.4	-164.8	172.2	-163.2	0	108.5	E48 E49	K27-E48 CarbonylContact O-C 3.59Å; K27-E48 VanDerWaalsContact O-CA 3.28Å; K27-E48 WeakPolarHBondContact O-CA 3.43Å; K27-E49 PolarHBondContact N-O 2.97Å; K27-E49 PolarHBondContact O-N 3.25Å
28	P	70.3	Confident	55.1	Low	88 Å²	88	111.6 Å²	111.6	57%	0.571	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-64.1	142.7	175.3	28	-34.8	0	0	0	111.2	F47	P28-F47 WeakPolarHBondContact CA-O 3.43Å
29	V	69.9	Low	56	Low	61 Å²	61	113.4 Å²	113.4	37%	0.37	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.3	123.5	174.1	-174	0	0	0	0	108.4	L31 F47 E49	V29-L31 HydrophobicContact CG1-CD2 4.26Å; V29-L31 HydrophobicContact CG1-CG 4.15Å; V29-F47 HydrophobicContact CB-CB 4.34Å; V29-F47 PolarHBondContact N-O 3.28Å; V29-E49 HydrophobicContact CG2-CB 3.94Å
30	E	51.1	Low	56.9	Low	192 Å²	192	112.9 Å²	112.9	90%	0.897	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-77.5	131.2	172.8	-66.3	179.9	166.3	0	0	109.2
31	L	60.6	Low	57.5	Low	82 Å²	82	111.3 Å²	111.3	43%	0.429	58%	0.582	S	S	.	*			trans	-140.1	146.3	-175	-71.9	171.6	0	0	0	110.3	V29 F36 F47	V29-L31 HydrophobicContact CG1-CD2 4.26Å; V29-L31 HydrophobicContact CG1-CG 4.15Å; L31-F36 HydrophobicContact CB-CE2 4.04Å; L31-F36 HydrophobicContact CB-CZ 4.37Å; L31-F36 HydrophobicContact CD1-CE2 4.47Å; L31-F36 HydrophobicContact CD1-CZ 3.99Å; L31-F47 HydrophobicContact CD1-CB 4.31Å; L31-F47 HydrophobicContact CD1-CD2 3.4Å; L31-F47 HydrophobicContact CD1-CE2 3.93Å; L31-F47 HydrophobicContact CD1-CG 4.12Å
32	D	54.7	Low	57.8	Low	108 Å²	108	114.4 Å²	114.4	58%	0.578	59%	0.592	S	S	*	*			trans	-67.8	124.7	-174.9	-138.2	-37.5	0	0	0	111.3	H34 L35	D32-H34 PolarHBondContact O-N 2.84Å; D32-L35 HydrophobicContact CB-CD1 4.17Å; D32-L35 PolarHBondContact O-N 2.88Å; D32-L35 VanDerWaalsContact O-N 3.11Å
33	P	57.3	Low	57.6	Low	102 Å²	102	117.8 Å²	117.8	66%	0.662	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-57.4	-23	-172.5	-29.3	36.6	0	0	0	115.3	L35 F36	P33-L35 VanDerWaalsContact C-N 3.32Å; P33-L35 PolarHBondContact O-N 2.9Å; P33-F36 PolarHBondContact O-N 3.03Å
34	H	56.7	Low	57.6	Low	162 Å²	162	116.2 Å²	116.2	75%	0.75	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-69.9	-23	-179.8	-75.7	-84.6	0	0	0	114.3	D32 F36 A37	D32-H34 PolarHBondContact O-N 2.84Å; H34-F36 PolarHBondContact O-N 3.18Å; H34-A37 PolarHBondContact O-N 3Å
35	L	57.2	Low	57	Low	125 Å²	125	121.4 Å²	121.4	65%	0.654	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-66.1	-19.8	177.9	-83.6	150.1	0	0	0	113.7	D32 P33	D32-L35 HydrophobicContact CB-CD1 4.17Å; D32-L35 PolarHBondContact O-N 2.88Å; D32-L35 VanDerWaalsContact O-N 3.11Å; P33-L35 VanDerWaalsContact C-N 3.32Å; P33-L35 PolarHBondContact O-N 2.9Å
36	F	55.5	Low	56.9	Low	71 Å²	71	117.2 Å²	117.2	31%	0.311	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-92.5	10	-175.8	-63.5	-85.6	0	0	0	114.2	L31 P33 H34 E38 L41 L44 F47	L31-F36 HydrophobicContact CB-CE2 4.04Å; L31-F36 HydrophobicContact CB-CZ 4.37Å; L31-F36 HydrophobicContact CD1-CE2 4.47Å; L31-F36 HydrophobicContact CD1-CZ 3.99Å; P33-F36 PolarHBondContact O-N 3.03Å; H34-F36 PolarHBondContact O-N 3.18Å; F36-E38 PolarHBondContact O-N 3.29Å; F36-L41 HydrophobicContact CD1-CB 4.39Å; F36-L41 HydrophobicContact CD1-CD1 4.3Å; F36-L44 HydrophobicContact CE1-CD2 4.25Å; F36-F47 HydrophobicContact CE1-CD2 4.43Å; F36-F47 AromaticContact CE1-CE2 3.85Å; F36-F47 HydrophobicContact CE1-CE2 3.85Å; F36-F47 HydrophobicContact CZ-CD2 4.17Å; F36-F47 AromaticContact CZ-CE2 3.92Å; F36-F47 HydrophobicContact CZ-CE2 3.92Å
37	A	52.8	Low	56.7	Low	80 Å²	80	114.1 Å²	114.1	66%	0.661	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-72.5	-22.3	-177.5	0	0	0	0	0	114.3	H34	H34-A37 PolarHBondContact O-N 3Å
38	E	44.6	Very low	56.9	Low	167 Å²	167	112.6 Å²	112.6	78%	0.78	61%	0.609	S	S	*	*	S	Bend	trans	-74.6	150.3	-177.7	-63.5	-155.9	141.7	0	0	113.8	F36 G40	F36-E38 PolarHBondContact O-N 3.29Å; E38-G40 VanDerWaalsContact C-N 3.29Å; E38-G40 PolarHBondContact O-N 3.01Å
39	E	51.9	Low	56.9	Low	175 Å²	175	113.7 Å²	113.7	82%	0.818	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	64.9	-169	-66.5	-131.2	101.8	0	0	114.5	K42	E39-K42 IonicContact OE1-NZ 3.25Å; E39-K42 PolarHBondContact OE1-NZ 3.4Å
40	G	54.8	Low	56.8	Low	66 Å²	66	112.8 Å²	112.8	68%	0.68	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.4	-29	173.3	0	0	0	0	0	116.4	E38	E38-G40 VanDerWaalsContact C-N 3.29Å; E38-G40 PolarHBondContact O-N 3.01Å
41	L	53.5	Low	57.3	Low	81 Å²	81	105.9 Å²	105.9	42%	0.424	57%	0.57	S	S	.	*			trans	-108.9	19.9	-161.8	-62.4	173.6	0	0	0	115.1	F36 D43 L44	F36-L41 HydrophobicContact CD1-CB 4.39Å; F36-L41 HydrophobicContact CD1-CD1 4.3Å; L41-D43 PolarHBondContact O-N 2.8Å; L41-L44 HydrophobicContact CB-CB 4.32Å; L41-L44 HydrophobicContact CD2-CD2 4.46Å; L41-L44 WeakPolarHBondContact O-CB 3.48Å; L41-L44 PolarHBondContact O-N 3.14Å
42	K	50.3	Low	57	Low	147 Å²	147	107.4 Å²	107.4	64%	0.639	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-10.4	-171.6	-69.5	171.5	-178.9	172.8	0	115.7	E39	E39-K42 IonicContact OE1-NZ 3.25Å; E39-K42 PolarHBondContact OE1-NZ 3.4Å
43	D	51.2	Low	57.3	Low	163 Å²	163	109.5 Å²	109.5	87%	0.872	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	3.1	173.5	-64.4	-43.5	0	0	0	113.1	L41	L41-D43 PolarHBondContact O-N 2.8Å
44	L	51.8	Low	56.9	Low	79 Å²	79	114.1 Å²	114.1	41%	0.414	59%	0.592	S	S	.	*			trans	-86.2	124.7	178.5	-148.2	84.6	0	0	0	110.2	F36 L41 F47	F36-L44 HydrophobicContact CE1-CD2 4.25Å; L41-L44 HydrophobicContact CB-CB 4.32Å; L41-L44 HydrophobicContact CD2-CD2 4.46Å; L41-L44 WeakPolarHBondContact O-CB 3.48Å; L41-L44 PolarHBondContact O-N 3.14Å; L44-F47 HydrophobicContact CD2-CD2 3.98Å; L44-F47 HydrophobicContact CD2-CE1 4.19Å; L44-F47 HydrophobicContact CD2-CE2 3.4Å; L44-F47 HydrophobicContact CD2-CZ 3.52Å
45	V	55.8	Low	56.7	Low	142 Å²	142	111.2 Å²	111.2	86%	0.861	58%	0.582	S	S	*	*			trans	-101.7	-33.5	-170.5	-176.7	0	0	0	0	113
46	C	56.2	Low	56.8	Low	75 Å²	75	107 Å²	107	51%	0.507	56%	0.562	S	S	.	*			trans	-160	167.1	176.3	56.5	0	0	0	0	110
47	F	66.5	Low	56.7	Low	99 Å²	99	107.1 Å²	107.1	43%	0.434	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.4	139.8	157.3	-77.1	-90.7	0	0	0	108.9	P28 V29 L31 F36 L44	P28-F47 WeakPolarHBondContact CA-O 3.43Å; V29-F47 HydrophobicContact CB-CB 4.34Å; V29-F47 PolarHBondContact N-O 3.28Å; L31-F47 HydrophobicContact CD1-CB 4.31Å; L31-F47 HydrophobicContact CD1-CD2 3.4Å; L31-F47 HydrophobicContact CD1-CE2 3.93Å; L31-F47 HydrophobicContact CD1-CG 4.12Å; F36-F47 HydrophobicContact CE1-CD2 4.43Å; F36-F47 AromaticContact CE1-CE2 3.85Å; F36-F47 HydrophobicContact CE1-CE2 3.85Å; F36-F47 HydrophobicContact CZ-CD2 4.17Å; F36-F47 AromaticContact CZ-CE2 3.92Å; F36-F47 HydrophobicContact CZ-CE2 3.92Å; L44-F47 HydrophobicContact CD2-CD2 3.98Å; L44-F47 HydrophobicContact CD2-CE1 4.19Å; L44-F47 HydrophobicContact CD2-CE2 3.4Å; L44-F47 HydrophobicContact CD2-CZ 3.52Å
48	E	72.9	Confident	56.7	Low	100 Å²	100	106.9 Å²	106.9	47%	0.467	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.6	131.4	172.4	-62.8	-174.1	167.1	0	0	109.6	W26 K27	W26-E48 HydrophobicContact CB-CB 4.26Å; W26-E48 WeakPolarHBondContact CB-OE2 3.45Å; W26-E48 HydrophobicContact CD2-CB 4.49Å; W26-E48 HydrophobicContact CE3-CB 3.78Å; W26-E48 WeakPolarHBondContact CZ3-O 3.45Å; K27-E48 CarbonylContact O-C 3.59Å; K27-E48 VanDerWaalsContact O-CA 3.28Å; K27-E48 WeakPolarHBondContact O-CA 3.43Å
49	E	68.9	Low	57.3	Low	111 Å²	111	105.2 Å²	105.2	52%	0.519	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	130.7	176.7	-171.8	-171.2	175.9	0	0	110.3	W26 K27 V29 T51	W26-E49 CarbonylContact C-O 3.56Å; W26-E49 WeakPolarHBondContact CA-O 3.46Å; K27-E49 PolarHBondContact N-O 2.97Å; K27-E49 PolarHBondContact O-N 3.25Å; V29-E49 HydrophobicContact CG2-CB 3.94Å; E49-T51 HydrophobicContact CG-CG2 4.24Å; E49-T51 PolarHBondContact O-N 3.18Å
50	L	67.6	Low	57.4	Low	41 Å²	41	102.8 Å²	102.8	22%	0.215	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	84.5	177.5	-174.4	59.9	0	0	0	111.5	I22 W26	I22-L50 HydrophobicContact CG2-CD2 3.73Å; W26-L50 HydrophobicContact CD2-CB 4.21Å; W26-L50 HydrophobicContact CD2-CD1 3.88Å; W26-L50 HydrophobicContact CE3-CB 3.85Å; W26-L50 HydrophobicContact CE3-CD1 4.39Å; W26-L50 HydrophobicContact CG-CD1 4.12Å; W26-L50 HydrophobicContact CH2-CB 3.97Å; W26-L50 HydrophobicContact CH2-CD2 4.28Å; W26-L50 HydrophobicContact CZ2-CB 4.3Å; W26-L50 HydrophobicContact CZ2-CD1 4.2Å; W26-L50 HydrophobicContact CZ2-CD2 4.06Å; W26-L50 HydrophobicContact CZ2-CG 4.41Å; W26-L50 HydrophobicContact CZ3-CB 3.74Å
51	T	62.3	Low	57.5	Low	47 Å²	47	100.3 Å²	100.3	29%	0.288	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	148.2	176.8	63.2	0	0	0	0	112.5	K25 E49 Y53	K25-T51 PolarHBondContact N-O 2.66Å; K25-T51 PolarHBondContact O-N 3.27Å; K25-T51 PolarHBondContact O-OG1 3.38Å; E49-T51 HydrophobicContact CG-CG2 4.24Å; E49-T51 PolarHBondContact O-N 3.18Å; T51-Y53 PolarHBondContact O-N 3.48Å
52	S	55.1	Low	57.7	Low	115 Å²	115	102.4 Å²	102.4	80%	0.804	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.5	52	173.7	-60.2	0	0	0	0	114.6
53	Y	59.8	Low	58.2	Low	152 Å²	152	101.3 Å²	101.3	60%	0.596	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	151.8	177.6	70.9	-92.9	0	0	0	113.3	K23 T51	K23-Y53 CarbonylContact O-C 3.5Å; K23-Y53 VanDerWaalsContact O-CA 3.23Å; K23-Y53 WeakPolarHBondContact O-CA 3.42Å; T51-Y53 PolarHBondContact O-N 3.48Å
54	R	48.7	Very low	58.6	Low	198 Å²	198	99.1 Å²	99.1	75%	0.747	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.7	127	169.1	-161	173.9	-167.9	163.9	6.5	110.5	K23	K23-R54 PolarHBondContact N-O 2.79Å; K23-R54 PolarHBondContact O-N 3.42Å
55	L	53.1	Low	58.9	Low	102 Å²	102	99.2 Å²	99.2	53%	0.534	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	137.3	172.8	-66.3	166.8	0	0	0	109.9	F20 I22	F20-L55 HydrophobicContact CB-CD2 3.97Å; I22-L55 HydrophobicContact CD1-CD2 4.46Å; I22-L55 HydrophobicContact CG1-CD2 4.01Å
56	V	58.6	Low	59.3	Low	37 Å²	37	101.7 Å²	101.7	22%	0.224	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	133.8	179.6	-173.3	0	0	0	0	110.5	N58 A61	V56-N58 PolarHBondContact O-N 3.26Å; V56-A61 HydrophobicContact CG1-CB 4.2Å
57	D	53.9	Low	59.6	Low	73 Å²	73	105.5 Å²	105.5	39%	0.39	50%	0.495	S	S	.	.			trans	-62.5	128.7	173.9	-52.9	-51.3	0	0	0	110.7	E59 K60 A61	D57-E59 VanDerWaalsContact C-N 3.27Å; D57-E59 PolarHBondContact O-N 3.43Å; D57-K60 HydrophobicContact CB-CB 4.46Å; D57-K60 HydrophobicContact CB-CD 4.08Å; D57-K60 HydrophobicContact CB-CG 4.24Å; D57-K60 WeakPolarHBondContact O-CA 3.28Å; D57-K60 WeakPolarHBondContact O-CB 3.44Å; D57-K60 PolarHBondContact O-N 2.92Å; D57-K60 WeakPolarHBondContact OD2-CD 3.42Å; D57-K60 VanDerWaalsContact OD2-CE 3.26Å; D57-K60 WeakPolarHBondContact OD2-CE 3.48Å; D57-K60 IonicContact OD2-NZ 2.85Å; D57-K60 PolarHBondContact OD2-NZ 3.24Å; D57-A61 PolarHBondContact O-N 3.01Å
58	N	53	Low	59.4	Low	75 Å²	75	106.6 Å²	106.6	40%	0.401	50%	0.501	S	S	.	.	H	α-helix	trans	-57.9	-37.9	-171.7	-155.4	-5	0	0	0	112.6	V56 K60 A61 E62	V56-N58 PolarHBondContact O-N 3.26Å; N58-K60 VanDerWaalsContact C-N 3.32Å; N58-K60 PolarHBondContact O-N 3.5Å; N58-A61 PolarHBondContact O-N 3.35Å; N58-E62 PolarHBondContact O-N 2.9Å
59	E	56.9	Low	58.8	Low	132 Å²	132	108.7 Å²	108.7	62%	0.617	51%	0.508	S	S	*	.	H	α-helix	trans	-59.5	-36.6	173.2	-78.2	-154	-162.3	0	0	114.4	D57 K63	D57-E59 VanDerWaalsContact C-N 3.27Å; D57-E59 PolarHBondContact O-N 3.43Å; E59-K63 WeakPolarHBondContact O-CB 3.41Å; E59-K63 VanDerWaalsContact O-CD 3.23Å; E59-K63 WeakPolarHBondContact O-CD 3.49Å; E59-K63 WeakPolarHBondContact O-CG 3.47Å; E59-K63 PolarHBondContact O-N 3.47Å; E59-K63 IonicContact OE2-NZ 3.07Å; E59-K63 PolarHBondContact OE2-NZ 3.36Å
60	K	55	Low	58.3	Low	124 Å²	124	111.6 Å²	111.6	54%	0.539	52%	0.52	S	S	.	.	H	α-helix	trans	-75.6	-38.4	178.9	-65.5	173.9	-173.1	158.7	0	109.7	D57 N58 K63 Q64	D57-K60 HydrophobicContact CB-CB 4.46Å; D57-K60 HydrophobicContact CB-CD 4.08Å; D57-K60 HydrophobicContact CB-CG 4.24Å; D57-K60 WeakPolarHBondContact O-CA 3.28Å; D57-K60 WeakPolarHBondContact O-CB 3.44Å; D57-K60 PolarHBondContact O-N 2.92Å; D57-K60 WeakPolarHBondContact OD2-CD 3.42Å; D57-K60 VanDerWaalsContact OD2-CE 3.26Å; D57-K60 WeakPolarHBondContact OD2-CE 3.48Å; D57-K60 IonicContact OD2-NZ 2.85Å; D57-K60 PolarHBondContact OD2-NZ 3.24Å; N58-K60 VanDerWaalsContact C-N 3.32Å; N58-K60 PolarHBondContact O-N 3.5Å; K60-K63 PolarHBondContact O-N 3.41Å; K60-Q64 WeakPolarHBondContact O-CG 3.39Å; K60-Q64 PolarHBondContact O-N 3.23Å
61	A	56	Low	58	Low	13 Å²	13	119.1 Å²	119.1	11%	0.107	55%	0.545	C	S	.	.	H	α-helix	trans	-61.3	-49.4	175.2	0	0	0	0	0	112.4	V56 D57 N58 K63 Q64 L65	V56-A61 HydrophobicContact CG1-CB 4.2Å; D57-A61 PolarHBondContact O-N 3.01Å; N58-A61 PolarHBondContact O-N 3.35Å; A61-K63 PolarHBondContact O-N 3.48Å; A61-Q64 PolarHBondContact O-N 3.06Å; A61-L65 WeakPolarHBondContact O-CB 3.3Å; A61-L65 PolarHBondContact O-N 3.41Å
62	E	57.4	Low	57.8	Low	125 Å²	125	119.2 Å²	119.2	58%	0.584	55%	0.551	S	S	*	*	H	α-helix	trans	-61.8	-41.6	176.6	-74.5	-152.4	140.8	0	0	112.8	N58 Q64 L65 R66	N58-E62 PolarHBondContact O-N 2.9Å; E62-Q64 VanDerWaalsContact C-N 3.32Å; E62-Q64 PolarHBondContact O-N 2.76Å; E62-L65 PolarHBondContact O-N 3.03Å; E62-R66 WeakPolarHBondContact O-CB 3.39Å; E62-R66 PolarHBondContact O-N 2.84Å
63	K	62.3	Low	57.7	Low	125 Å²	125	121.4 Å²	121.4	54%	0.543	55%	0.546	S	S	.	.	H	α-helix	trans	-64.5	-35.7	178	-72	166.9	-165.3	162.1	0	111.4	E59 K60 A61 K67	E59-K63 WeakPolarHBondContact O-CB 3.41Å; E59-K63 VanDerWaalsContact O-CD 3.23Å; E59-K63 WeakPolarHBondContact O-CD 3.49Å; E59-K63 WeakPolarHBondContact O-CG 3.47Å; E59-K63 PolarHBondContact O-N 3.47Å; E59-K63 IonicContact OE2-NZ 3.07Å; E59-K63 PolarHBondContact OE2-NZ 3.36Å; K60-K63 PolarHBondContact O-N 3.41Å; A61-K63 PolarHBondContact O-N 3.48Å; K63-K67 PolarHBondContact O-N 2.9Å
64	Q	58.7	Low	56.9	Low	117 Å²	117	120.3 Å²	120.3	55%	0.547	54%	0.544	S	S	.	.	H	α-helix	trans	-69.4	-49.1	171.4	-76.6	-179	-18.5	0	0	112.1	K60 A61 E62 R66 K67 E68	K60-Q64 WeakPolarHBondContact O-CG 3.39Å; K60-Q64 PolarHBondContact O-N 3.23Å; A61-Q64 PolarHBondContact O-N 3.06Å; E62-Q64 VanDerWaalsContact C-N 3.32Å; E62-Q64 PolarHBondContact O-N 2.76Å; Q64-R66 VanDerWaalsContact C-N 3.27Å; Q64-R66 PolarHBondContact O-N 2.76Å; Q64-K67 CarbonylContact O-C 3.53Å; Q64-K67 WeakPolarHBondContact O-CA 3.42Å; Q64-K67 WeakPolarHBondContact O-CB 3.37Å; Q64-K67 PolarHBondContact O-N 3.35Å; Q64-E68 PolarHBondContact O-N 2.75Å
65	L	58.4	Low	56.7	Low	81 Å²	81	119.5 Å²	119.5	42%	0.424	54%	0.541	S	S	.	.	H	α-helix	trans	-61	-35.1	-179	-159	78.6	0	0	0	112.2	A61 E62 K69	A61-L65 WeakPolarHBondContact O-CB 3.3Å; A61-L65 PolarHBondContact O-N 3.41Å; E62-L65 PolarHBondContact O-N 3.03Å; L65-K69 WeakPolarHBondContact O-CB 3.5Å; L65-K69 WeakPolarHBondContact O-CG 3.47Å; L65-K69 PolarHBondContact O-N 2.81Å
66	R	64	Low	56.3	Low	194 Å²	194	121.1 Å²	121.1	73%	0.732	55%	0.546	S	S	*	.	H	α-helix	trans	-67	-35	170.7	-83.5	-178.1	164.5	-172.4	-3.1	113.1	E62 Q64 K70	E62-R66 WeakPolarHBondContact O-CB 3.39Å; E62-R66 PolarHBondContact O-N 2.84Å; Q64-R66 VanDerWaalsContact C-N 3.27Å; Q64-R66 PolarHBondContact O-N 2.76Å; R66-K70 WeakPolarHBondContact O-CG 3.18Å; R66-K70 PolarHBondContact O-N 3.19Å
67	K	62.6	Low	55.6	Low	155 Å²	155	122.9 Å²	122.9	67%	0.674	56%	0.564	S	S	*	*	H	α-helix	trans	-70.4	-41.5	173.4	-80.6	-175.2	175	-176.9	0	111.8	K63 Q64 K70 R71	K63-K67 PolarHBondContact O-N 2.9Å; Q64-K67 CarbonylContact O-C 3.53Å; Q64-K67 WeakPolarHBondContact O-CA 3.42Å; Q64-K67 WeakPolarHBondContact O-CB 3.37Å; Q64-K67 PolarHBondContact O-N 3.35Å; K67-K70 PolarHBondContact O-N 3.24Å; K67-R71 PolarHBondContact O-N 3.49Å
68	E	63.2	Low	54.9	Low	121 Å²	121	125.3 Å²	125.3	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-64.6	-48.2	176.1	-72.4	-173.5	123.7	0	0	111.8	Q64 K70 R71 A72	Q64-E68 PolarHBondContact O-N 2.75Å; E68-K70 PolarHBondContact O-N 3.14Å; E68-R71 CarbonylContact O-C 3.58Å; E68-R71 WeakPolarHBondContact O-CA 3.42Å; E68-R71 PolarHBondContact O-N 3.07Å; E68-A72 PolarHBondContact O-N 3.39Å
69	K	60.2	Low	54.4	Low	144 Å²	144	129.7 Å²	129.7	63%	0.626	59%	0.591	S	S	*	*	H	α-helix	trans	-60.9	-32.3	176.1	-72.4	-178.2	179	-177	0	112.8	L65 K73	L65-K69 WeakPolarHBondContact O-CB 3.5Å; L65-K69 WeakPolarHBondContact O-CG 3.47Å; L65-K69 PolarHBondContact O-N 2.81Å; K69-K73 WeakPolarHBondContact O-CB 3.3Å; K69-K73 PolarHBondContact O-N 3.39Å; K69-K73 VanDerWaalsContact O-N 3.16Å
70	K	57.6	Low	53.3	Low	173 Å²	173	127.7 Å²	127.7	75%	0.752	59%	0.592	S	S	*	*	H	α-helix	trans	-70	-35.2	170.3	-80.8	-170.1	173	-167.7	0	113.4	R66 K67 E68 K74	R66-K70 WeakPolarHBondContact O-CG 3.18Å; R66-K70 PolarHBondContact O-N 3.19Å; K67-K70 PolarHBondContact O-N 3.24Å; E68-K70 PolarHBondContact O-N 3.14Å; K70-K74 PolarHBondContact O-N 3.17Å
71	R	60.9	Low	52.2	Low	198 Å²	198	129.4 Å²	129.4	75%	0.747	61%	0.606	S	S	*	*	H	α-helix	trans	-72.5	-43	175.5	-81.3	-178	164.1	-175.1	-7.1	112.5	K67 E68 K74 R75	K67-R71 PolarHBondContact O-N 3.49Å; E68-R71 CarbonylContact O-C 3.58Å; E68-R71 WeakPolarHBondContact O-CA 3.42Å; E68-R71 PolarHBondContact O-N 3.07Å; R71-K74 PolarHBondContact O-N 3.05Å; R71-R75 PolarHBondContact O-N 2.96Å; R71-R75 VanDerWaalsContact O-N 3.11Å
72	A	58.6	Low	51	Low	50 Å²	50	136.8 Å²	136.8	41%	0.413	64%	0.644	S	S	.	*	H	α-helix	trans	-58	-51.2	175	0	0	0	0	0	110.8	E68 K74 R75 E76	E68-A72 PolarHBondContact O-N 3.39Å; A72-K74 PolarHBondContact O-N 3.47Å; A72-K74 VanDerWaalsContact O-N 3.14Å; A72-R75 PolarHBondContact O-N 2.95Å; A72-E76 PolarHBondContact O-N 3.37Å
73	K	52.6	Low	49.5	Very low	160 Å²	160	138.4 Å²	138.4	70%	0.696	65%	0.651	S	S	*	*	H	α-helix	trans	-66.8	-15.5	179.8	-152.2	176.4	-173	-175.3	0	114.6	K69	K69-K73 WeakPolarHBondContact O-CB 3.3Å; K69-K73 PolarHBondContact O-N 3.39Å; K69-K73 VanDerWaalsContact O-N 3.16Å
74	K	42.4	Very low	48.2	Very low	129 Å²	129	138.2 Å²	138.2	56%	0.561	66%	0.663	S	S	*	*	H	α-helix	trans	-81	-41.5	168.2	-164.6	176.6	-170.1	-91.1	0	111.4	K70 R71 A72 A77 E78	K70-K74 PolarHBondContact O-N 3.17Å; R71-K74 PolarHBondContact O-N 3.05Å; A72-K74 PolarHBondContact O-N 3.47Å; A72-K74 VanDerWaalsContact O-N 3.14Å; K74-A77 PolarHBondContact O-N 2.94Å; K74-E78 WeakPolarHBondContact CE-OE1 3.31Å; K74-E78 IonicContact NZ-OE1 2.61Å; K74-E78 PolarHBondContact NZ-OE1 3.08Å; K74-E78 WeakPolarHBondContact O-CG 3.25Å; K74-E78 PolarHBondContact O-N 3Å
75	R	44.2	Very low	46.6	Very low	182 Å²	182	137.2 Å²	137.2	69%	0.687	67%	0.665	S	S	*	*	H	α-helix	trans	-64.2	-42.2	175.9	-74.1	-178.8	167.1	-178.1	-6.4	112.7	R71 A72 A77 E78 Q79	R71-R75 PolarHBondContact O-N 2.96Å; R71-R75 VanDerWaalsContact O-N 3.11Å; A72-R75 PolarHBondContact O-N 2.95Å; R75-A77 PolarHBondContact O-N 3.24Å; R75-E78 PolarHBondContact O-N 2.93Å; R75-Q79 PolarHBondContact O-N 3.36Å
76	E	45.1	Very low	45	Very low	136 Å²	136	142.8 Å²	142.8	64%	0.636	69%	0.686	S	S	*	*	H	α-helix	trans	-60.4	-32.6	175.4	-69.3	173.8	136.6	0	0	112.4	A72 E78	A72-E76 PolarHBondContact O-N 3.37Å; E76-E78 VanDerWaalsContact C-N 3.34Å
77	A	43.9	Very low	43	Very low	74 Å²	74	142.1 Å²	142.1	61%	0.612	69%	0.688	S	S	*	*	H	α-helix	trans	-80.1	-12.1	177.1	0	0	0	0	0	114	K74 R75	K74-A77 PolarHBondContact O-N 2.94Å; R75-A77 PolarHBondContact O-N 3.24Å
78	E	40.8	Very low	41.2	Very low	123 Å²	123	144.3 Å²	144.3	58%	0.575	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	1.3	179.8	-72.3	169.4	171.9	0	0	112.4	K74 R75 E76	K74-E78 WeakPolarHBondContact CE-OE1 3.31Å; K74-E78 IonicContact NZ-OE1 2.61Å; K74-E78 PolarHBondContact NZ-OE1 3.08Å; K74-E78 WeakPolarHBondContact O-CG 3.25Å; K74-E78 PolarHBondContact O-N 3Å; R75-E78 PolarHBondContact O-N 2.93Å; E76-E78 VanDerWaalsContact C-N 3.34Å
79	Q	40.5	Very low	39.3	Very low	167 Å²	167	147.9 Å²	147.9	78%	0.78	71%	0.711	S	S	*	*	S	Bend	trans	-123.2	13	-176.9	-66.4	-167.1	-68	0	0	114.7	R75	R75-Q79 PolarHBondContact O-N 3.36Å
80	S	35.1	Very low	37.7	Very low	91 Å²	91	147.7 Å²	147.7	64%	0.636	71%	0.712	S	S	*	*			trans	-106.8	32.3	-177.9	73.3	0	0	0	0	114.4
81	L	31.5	Very low	36.1	Very low	159 Å²	159	148.1 Å²	148.1	83%	0.832	71%	0.714	S	S	*	*	S	Bend	trans	-143.1	74.6	173.8	-73.6	177.6	0	0	0	110.5
82	D	30.6	Very low	34.3	Very low	168 Å²	168	147.7 Å²	147.7	90%	0.898	72%	0.718	S	S	*	*				177.3	142.6	128.1	-93	-19.1	0	0	0	111.9
83	E	26.4	Very low	32.7	Very low	159 Å²	159	154.9 Å²	154.9	74%	0.743	73%	0.734	S	S	*	*			trans	-122.2	165	170.5	-124.4	-151.1	-180	0	0	107.4
84	P	34.3	Very low	31.4	Very low	122 Å²	122	154 Å²	154	79%	0.792	73%	0.733	S	S	*	*				-150	-170.3	50.1	39.7	-16.5	0	0	0	116.8
85	V	25.8	Very low	30.5	Very low	95 Å²	95	156 Å²	156	58%	0.576	74%	0.741	S	S	*	*			trans	-109.3	140	-170	177.9	0	0	0	0	113.2
86	K	24.7	Very low	29.6	Very low	199 Å²	199	152.5 Å²	152.5	87%	0.865	74%	0.74	S	S	*	*			trans	178.3	101.9	136.8	-96.2	151.5	-168.5	171	0	118.5
87	K	22.8	Very low	28.7	Very low	179 Å²	179	150 Å²	150	78%	0.778	74%	0.742	S	S	*	*				39.4	123	125.5	-63.6	176.2	-178.9	172.5	0	123.7
88	K	24.6	Very low	27.6	Very low	202 Å²	202	154.1 Å²	154.1	88%	0.878	75%	0.749	S	S	*	*			trans	74.3	123.5	130.7	-72.3	-171.9	172.8	-173	0	123.4
89	K	23.2	Very low	26.8	Very low	195 Å²	195	156 Å²	156	85%	0.848	76%	0.763	S	S	*	*			trans	-171	161.5	141.9	-100.2	177.5	-176	175.7	0	108.3
90	Q	25.8	Very low	25.9	Very low	140 Å²	140	155.5 Å²	155.5	65%	0.654	77%	0.766	S	S	*	*			cis	-166.9	144.1	-35.3	-130.9	-167.8	20.1	0	0	110.8
91	K	24.3	Very low	26.5	Very low	182 Å²	182	156.5 Å²	156.5	79%	0.791	77%	0.77	S	S	*	*			trans	62.6	178.1	159.6	-62.2	167.9	178.8	169.8	0	118
92	K	24.1	Very low	26	Very low	190 Å²	190	157 Å²	157	83%	0.826	77%	0.768	S	S	*	*				-178.7	156.5	-53.5	-166.3	175.2	-177.4	-178.1	0	109
93	R	24.2	Very low	25.7	Very low	200 Å²	200	156.5 Å²	156.5	76%	0.755	76%	0.763	S	S	*	*			trans	90.7	124.5	169.3	-51.9	-166.1	83.3	168.8	2.9	114
94	Q	26.2	Very low	25.5	Very low	143 Å²	143	153.3 Å²	153.3	67%	0.668	76%	0.763	S	S	*	*				71	143.8	79.3	-66.9	175.7	-49.4	0	0	113
95	K	23.6	Very low	24.9	Very low	169 Å²	169	151.1 Å²	151.1	74%	0.735	76%	0.763	S	S	*	*			cis	-160.8	145.2	8.5	-127.3	-164.1	175	-161.8	0	108.5
96	V	23.8	Very low	24.7	Very low	110 Å²	110	152.5 Å²	152.5	67%	0.667	78%	0.775	S	S	*	*				73.3	159.2	106.1	164.8	0	0	0	0	117.3
97	A	25.7	Very low	24.7	Very low	82 Å²	82	148.2 Å²	148.2	68%	0.678	77%	0.77	S	S	*	*			trans	83	119.3	-173	0	0	0	0	0	114.7
98	E	22.3	Very low	24.7	Very low	161 Å²	161	145.2 Å²	145.2	75%	0.752	77%	0.767	S	S	*	*			cis	84.4	120.2	21.8	-52.7	163.3	112.9	0	0	115.8
99	N	23.2	Very low	24.6	Very low	164 Å²	164	141.3 Å²	141.3	88%	0.877	76%	0.756	S	S	*	*				-168.3	132.6	115.2	-88.2	-16.7	0	0	0	110.9
100	D	22.2	Very low	24.7	Very low	155 Å²	155	139.4 Å²	139.4	83%	0.829	75%	0.75	S	S	*	*			trans	-88.4	-175.4	165.3	-63.5	-69.2	0	0	0	110.4
101	P	47	Very low	24.8	Very low	113 Å²	113	139.3 Å²	139.3	73%	0.734	75%	0.754	S	S	*	*			cis	-114.2	-152	-21.7	26.3	-2.4	0	0	0	109.4
102	E	21.4	Very low	24.9	Very low	168 Å²	168	136.5 Å²	136.5	79%	0.785	75%	0.752	S	S	*	*			cis	-169.6	169.8	26	-151	-179.3	-135.9	0	0	112.6
103	M	23.6	Very low	25	Very low	159 Å²	159	135.8 Å²	135.8	78%	0.783	75%	0.749	S	S	*	*			trans	65.5	121.6	157.6	-80.3	-77.3	-93.4	0	0	122.9
104	A	23.6	Very low	25.2	Very low	92 Å²	92	131.8 Å²	131.8	76%	0.76	74%	0.739	S	S	*	*			trans	51.4	135.2	133.7	0	0	0	0	0	124.3
105	G	21.6	Very low	25.3	Very low	75 Å²	75	133.2 Å²	133.2	77%	0.773	75%	0.745	S	S	*	*				107.1	100.6	124.9	0	0	0	0	0	121.1
106	C	21	Very low	25.4	Very low	124 Å²	124	128.7 Å²	128.7	84%	0.838	75%	0.746	S	S	*	*			trans	39.6	150.4	135.4	-149.9	0	0	0	0	124.3
107	S	25.2	Very low	25.6	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	75%	0.749	S	S	*	*			trans	72.1	160.3	163.3	79.3	0	0	0	0	116.9
108	T	22.5	Very low	25.5	Very low	117 Å²	117	131.3 Å²	131.3	72%	0.718	75%	0.754	S	S	*	*			cis	-127.2	171.6	-0.8	53	0	0	0	0	109.7
109	N	23.2	Very low	25.7	Very low	119 Å²	119	128.3 Å²	128.3	64%	0.636	75%	0.751	S	S	*	*			cis	58.1	141.9	47.8	-66.8	42.9	0	0	0	113.7
110	E	25.3	Very low	25.9	Very low	155 Å²	155	124.1 Å²	124.1	72%	0.724	73%	0.734	S	S	*	*			cis	-165.2	162.9	-9.6	-116.9	160.7	169.8	0	0	111.9
111	D	26	Very low	26.2	Very low	138 Å²	138	125.5 Å²	125.5	74%	0.738	73%	0.733	S	S	*	*			trans	53.6	122.9	146.4	-73.4	-6	0	0	0	129.3
112	V	28.2	Very low	25.2	Very low	124 Å²	124	127.9 Å²	127.9	75%	0.752	73%	0.732	S	S	*	*				65.5	125.4	122.9	-177.1	0	0	0	0	123.6
113	K	24.3	Very low	25.4	Very low	175 Å²	175	125.6 Å²	125.6	76%	0.761	73%	0.725	S	S	*	*			trans	161.3	156.6	138.1	-94.9	-178.2	178.9	-128.3	0	113
114	Q	28.3	Very low	25.4	Very low	116 Å²	116	127.8 Å²	127.8	54%	0.542	73%	0.725	S	S	.	*			cis	-167.1	151.4	-20.4	-141.1	176.3	-38.6	0	0	111.2
115	E	28.9	Very low	25.4	Very low	172 Å²	172	130.6 Å²	130.6	80%	0.804	72%	0.722	S	S	*	*			trans	49.8	168.3	150.4	-83.7	145.7	-137.5	0	0	123.6
116	G	26.3	Very low	25.5	Very low	74 Å²	74	132.3 Å²	132.3	76%	0.763	72%	0.722	S	S	*	*			cis	-178.8	-172.5	1.2	0	0	0	0	0	109
117	E	28.4	Very low	25.6	Very low	152 Å²	152	135.3 Å²	135.3	71%	0.71	72%	0.724	S	S	*	*			cis	-160.8	154.3	-12	-175.7	-82	146.7	0	0	108.1	S119	E117-S119 WeakPolarHBondContact OE1-CB 3.42Å; E117-S119 PolarHBondContact OE1-N 3.18Å; E117-S119 PolarHBondContact OE1-OG 3.16Å
118	A	23.3	Very low	25.5	Very low	96 Å²	96	140 Å²	140	79%	0.793	73%	0.731	S	S	*	*			trans	-167.3	137.5	156.2	0	0	0	0	0	111.3
119	S	26.9	Very low	25.5	Very low	98 Å²	98	144.1 Å²	144.1	69%	0.685	74%	0.741	S	S	*	*			trans	-147.3	-177	-170.5	58.2	0	0	0	0	113	E117	E117-S119 WeakPolarHBondContact OE1-CB 3.42Å; E117-S119 PolarHBondContact OE1-N 3.18Å; E117-S119 PolarHBondContact OE1-OG 3.16Å
120	S	26.8	Very low	25.5	Very low	76 Å²	76	143.4 Å²	143.4	53%	0.531	75%	0.752	S	S	.	*			cis	-169.3	176.9	25.6	50.4	0	0	0	0	112.1
121	K	28.1	Very low	25.4	Very low	184 Å²	184	140.5 Å²	140.5	80%	0.8	75%	0.754	S	S	*	*			trans	78.7	161	163.2	-57.8	147.9	-168.6	166.6	0	116.3
122	K	26.8	Very low	25.2	Very low	162 Å²	162	138.5 Å²	138.5	70%	0.704	76%	0.757	S	S	*	*			cis	-176.1	161.6	-18.5	-98.1	-171.7	149.2	-69.2	0	106.4
123	D	25	Very low	25	Very low	120 Å²	120	139.1 Å²	139.1	64%	0.642	76%	0.761	S	S	*	*			cis	-152.9	-157.5	-11.5	-77.9	-40.9	0	0	0	105.9
124	R	23	Very low	24.9	Very low	206 Å²	206	135.2 Å²	135.2	78%	0.777	76%	0.756	S	S	*	*			cis	-161.1	128.4	-0.2	-157.1	-166.3	162.8	167.9	-2.6	113.8
125	E	23.9	Very low	24.6	Very low	150 Å²	150	138 Å²	138	70%	0.701	77%	0.769	S	S	*	*			trans	44.4	-169.3	150.4	-64.8	-178.9	122.1	0	0	122.4
126	S	24.3	Very low	24.3	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	77%	0.77	S	S	*	*			trans	-144	177.4	-137.6	-48.4	0	0	0	0	116.8
127	Q	23.2	Very low	24.2	Very low	188 Å²	188	140.1 Å²	140.1	88%	0.879	77%	0.766	S	S	*	*			trans	77.3	126	165.4	-62.2	-175.4	-19.4	0	0	120.6
128	K	23.1	Very low	23.9	Very low	208 Å²	208	141 Å²	141	90%	0.904	77%	0.77	S	S	*	*				-169.8	170.4	114.9	-109.1	-178.7	179	-175.6	0	114.4
129	E	22.8	Very low	23.9	Very low	202 Å²	202	140.8 Å²	140.8	94%	0.944	76%	0.762	S	S	*	*			trans	-102.3	-162.7	-168.9	-59.3	168.6	106.9	0	0	113.8
130	A	22.8	Very low	23.7	Very low	105 Å²	105	140.6 Å²	140.6	87%	0.868	76%	0.761	S	S	*	*			trans	-113.2	162.9	-162.4	0	0	0	0	0	116.8
131	A	22.5	Very low	23.5	Very low	93 Å²	93	144 Å²	144	77%	0.769	77%	0.773	S	S	*	*			trans	-156.8	145	159.9	0	0	0	0	0	107
132	A	23.2	Very low	23.3	Very low	96 Å²	96	141.5 Å²	141.5	79%	0.793	77%	0.774	S	S	*	*			cis	71.8	134.9	42.6	0	0	0	0	0	113
133	V	23.7	Very low	23.1	Very low	137 Å²	137	140 Å²	140	83%	0.83	77%	0.769	S	S	*	*			cis	-163.9	174.7	-6	108.5	0	0	0	0	110
134	S	21.6	Very low	22.9	Very low	93 Å²	93	144.6 Å²	144.6	65%	0.65	78%	0.783	S	S	*	*			trans	76.3	155.9	172.4	-125.4	0	0	0	0	116.5
135	E	21.5	Very low	22.8	Very low	176 Å²	176	142.3 Å²	142.3	82%	0.822	78%	0.779	S	S	*	*			cis	-147.5	168	12.6	-160.3	139	-80.3	0	0	113.9
136	H	22.9	Very low	22.7	Very low	180 Å²	180	144.7 Å²	144.7	83%	0.833	79%	0.787	S	S	*	*			trans	-76	168.7	173.1	-89.6	-45.4	0	0	0	112.2
137	V	23.8	Very low	22.6	Very low	110 Å²	110	148.1 Å²	148.1	67%	0.667	79%	0.788	S	S	*	*				-179.9	122.5	85.6	150.5	0	0	0	0	112
138	Q	23.9	Very low	22.4	Very low	171 Å²	171	148.1 Å²	148.1	80%	0.799	79%	0.785	S	S	*	*			trans	58.3	156.8	135.4	-62	-178.3	7.9	0	0	122.9
139	S	22.4	Very low	22.3	Very low	90 Å²	90	147.3 Å²	147.3	63%	0.629	78%	0.782	S	S	*	*			cis	-169.3	152.9	-21.4	57.7	0	0	0	0	115.8
140	S	21.7	Very low	22.2	Very low	95 Å²	95	146.5 Å²	146.5	66%	0.664	78%	0.778	S	S	*	*			trans	80.4	147.4	137.3	81.5	0	0	0	0	123.7
141	N	22.5	Very low	22.2	Very low	146 Å²	146	151.7 Å²	151.7	78%	0.781	78%	0.781	S	S	*	*			trans	73.5	142.5	152.3	-74.9	-39.3	0	0	0	119.7
142	T	24	Very low	22.2	Very low	133 Å²	133	156.8 Å²	156.8	82%	0.816	79%	0.786	S	S	*	*			cis	-129.9	156.1	13.3	47.4	0	0	0	0	114.8
143	E	23	Very low	22.1	Very low	130 Å²	130	162 Å²	162	61%	0.607	79%	0.79	S	S	*	*			trans	-73.3	165.7	167.8	-61.4	-171.2	105.5	0	0	113.9	K145	E143-K145 IonicContact OE1-NZ 2.82Å; E143-K145 PolarHBondContact OE1-NZ 3.01Å
144	K	22.2	Very low	21.9	Very low	216 Å²	216	164.6 Å²	164.6	94%	0.939	79%	0.79	S	S	*	*				-156.1	112.2	124.7	-112.2	153.5	-169	164.5	0	115.2
145	K	20.7	Very low	21.9	Very low	159 Å²	159	169 Å²	169	69%	0.691	80%	0.798	S	S	*	*			trans	-88.9	142.2	166.5	-66.2	166.6	-179.6	123.3	0	111.5	E143	E143-K145 IonicContact OE1-NZ 2.82Å; E143-K145 PolarHBondContact OE1-NZ 3.01Å
146	K	21.9	Very low	21.9	Very low	199 Å²	199	169.4 Å²	169.4	87%	0.865	80%	0.797	S	S	*	*			trans	-174.2	109.2	144.3	-101.9	156	-172.7	179.5	0	108.8
147	K	20.3	Very low	21.9	Very low	184 Å²	184	170 Å²	170	80%	0.8	80%	0.797	S	S	*	*				79.5	110.5	67.3	-83.3	-174.9	171.6	172	0	115.2
148	K	19.4	Very low	21.8	Very low	188 Å²	188	171 Å²	171	82%	0.817	81%	0.806	S	S	*	*			trans	68.4	156.3	154.7	-65.2	179.8	175.6	179.1	0	114.8
149	K	21.5	Very low	21.6	Very low	191 Å²	191	174.2 Å²	174.2	83%	0.83	81%	0.811	S	S	*	*			cis	-155.8	160.6	16.2	-143.4	166	-175.6	179.6	0	111.2
150	Q	21.1	Very low	21.7	Very low	185 Å²	185	177.8 Å²	177.8	86%	0.864	82%	0.818	S	S	*	*			trans	-61.9	150	171.3	-58.1	161.2	-21.9	0	0	112.9
151	K	22.6	Very low	21.8	Very low	213 Å²	213	180.4 Å²	180.4	93%	0.926	82%	0.819	S	S	*	*			trans	-154.3	117.1	146.1	-119.4	172.4	-174.4	179.4	0	115.3
152	K	21.5	Very low	21.7	Very low	200 Å²	200	179.1 Å²	179.1	87%	0.87	82%	0.817	S	S	*	*			trans	-16.3	133.1	170.8	-64.5	173.9	176	178.5	0	120.2
153	K	21.3	Very low	21.7	Very low	205 Å²	205	180.5 Å²	180.5	89%	0.891	81%	0.814	S	S	*	*			trans	-0.5	132	136.6	-64.9	174.9	174.9	175.9	0	117
154	K	20.3	Very low	21.6	Very low	192 Å²	192	182.1 Å²	182.1	84%	0.835	82%	0.822	S	S	*	*			trans	-165.3	112.8	143.1	-117.4	174.1	-173.3	178.2	0	115
155	K	20.6	Very low	21.7	Very low	185 Å²	185	176.1 Å²	176.1	80%	0.804	81%	0.813	S	S	*	*			trans	62.7	168.1	146.7	-71.6	179.8	175.4	-178.1	0	116.1
156	K	21.4	Very low	21.8	Very low	186 Å²	186	173.2 Å²	173.2	81%	0.809	82%	0.818	S	S	*	*			cis	-149.1	155.2	5.6	-143.1	171.1	-179.2	-170.9	0	110.3
157	K	23.6	Very low	21.9	Very low	193 Å²	193	170.3 Å²	170.3	84%	0.839	82%	0.816	S	S	*	*			trans	-73.5	147.2	157.8	-63.4	177.3	178.6	179.5	0	109.4
158	P	21.8	Very low	22.1	Very low	131 Å²	131	167.9 Å²	167.9	85%	0.851	82%	0.817	S	S	*	*			trans	-87.6	138.3	154	33.6	-29.7	0	0	0	111.3
159	R	20	Very low	22.5	Very low	237 Å²	237	167.3 Å²	167.3	89%	0.894	82%	0.818	S	S	*	*			trans	-163.8	158.4	163	-161	-176.9	-172.2	-157.8	2.2	107
160	Q	24.3	Very low	22.5	Very low	166 Å²	166	164.1 Å²	164.1	78%	0.776	81%	0.81	S	S	*	*			trans	76.9	156.5	-174.2	-53.6	178.8	-20.2	0	0	112.4
161	Q	23.4	Very low	22.6	Very low	149 Å²	149	164.8 Å²	164.8	70%	0.696	81%	0.813	S	S	*	*			cis	-123.5	144.4	11.7	-116.7	114.6	49.1	0	0	110.8
162	T	21.1	Very low	22.7	Very low	120 Å²	120	163 Å²	163	74%	0.736	81%	0.807	S	S	*	*				54.5	147	107.7	65.5	0	0	0	0	115
163	E	23.6	Very low	22.8	Very low	161 Å²	161	157.8 Å²	157.8	75%	0.752	80%	0.802	S	S	*	*			cis	-157.6	177.2	44.2	-74.2	-170.7	86.5	0	0	110
164	Q	21.7	Very low	23	Very low	165 Å²	165	155.6 Å²	155.6	77%	0.771	80%	0.798	S	S	*	*			cis	-160.1	-172.4	-21.3	-109.4	-156	76.5	0	0	108.6
165	A	23.6	Very low	23.1	Very low	90 Å²	90	155.7 Å²	155.7	74%	0.744	80%	0.799	S	S	*	*			trans	67.7	128.3	179	0	0	0	0	0	116.1
166	A	22.8	Very low	23.6	Very low	97 Å²	97	152.4 Å²	152.4	80%	0.802	80%	0.796	S	S	*	*			cis	73.5	131.9	43.9	0	0	0	0	0	112.4
167	V	23.3	Very low	24	Very low	138 Å²	138	149.5 Å²	149.5	84%	0.836	80%	0.796	S	S	*	*			cis	-137.7	152.9	33.6	173.1	0	0	0	0	112.6
168	T	25	Very low	23.9	Very low	133 Å²	133	149.2 Å²	149.2	82%	0.816	80%	0.798	S	S	*	*			trans	-148.7	129.6	164.8	-51	0	0	0	0	110.9
169	E	27.2	Very low	23.9	Very low	177 Å²	177	152 Å²	152	83%	0.827	80%	0.8	S	S	*	*			trans	-176.8	161.8	151.8	-105.2	155.2	-163.3	0	0	107.8
170	N	22.6	Very low	24	Very low	124 Å²	124	147.8 Å²	147.8	66%	0.663	79%	0.79	S	S	*	*			cis	-149.8	142.6	30.2	-137.8	-12.8	0	0	0	112.6
171	Q	23.7	Very low	24	Very low	198 Å²	198	148.3 Å²	148.3	93%	0.925	79%	0.79	S	S	*	*			trans	-154.9	127.8	150.3	-82.3	-155.6	-27.1	0	0	109
172	E	23.8	Very low	23.9	Very low	175 Å²	175	147.3 Å²	147.3	82%	0.818	80%	0.796	S	S	*	*			trans	-89.4	139.5	-173.4	-65.3	171.1	107.6	0	0	113
173	A	24	Very low	24	Very low	92 Å²	92	153.4 Å²	153.4	76%	0.76	81%	0.806	S	S	*	*				50.2	163.4	125.7	0	0	0	0	0	120.7
174	I	25	Very low	24.1	Very low	158 Å²	158	153.8 Å²	153.8	81%	0.81	81%	0.812	S	S	*	*			cis	-138.7	156.1	15.6	-63.5	168.6	0	0	0	110.7
175	K	23.3	Very low	24.2	Very low	195 Å²	195	155.7 Å²	155.7	85%	0.848	82%	0.818	S	S	*	*			trans	-134.3	159.8	157.3	-93.9	-167	175.3	-167	0	107.1
176	P	30.1	Very low	24.3	Very low	115 Å²	115	160.4 Å²	160.4	75%	0.747	82%	0.824	S	S	*	*			cis	-144.4	-147.6	44.5	44.6	-22.4	0	0	0	111.4
177	P	29.3	Very low	24.4	Very low	125 Å²	125	167.5 Å²	167.5	81%	0.812	83%	0.83	S	S	*	*			cis	-124.1	-149.6	-12.1	38.9	-18.6	0	0	0	114.1
178	E	22.8	Very low	24.5	Very low	187 Å²	187	170.5 Å²	170.5	87%	0.874	83%	0.832	S	S	*	*			trans	-124.8	163.2	-155.6	-57.4	177.7	112.7	0	0	115.2
179	E	20.7	Very low	24.5	Very low	191 Å²	191	169.6 Å²	169.6	89%	0.893	83%	0.828	S	S	*	*			trans	141.8	138.9	155	-80.8	-176.6	171.8	0	0	109.3
180	E	21.8	Very low	24.7	Very low	148 Å²	148	167.1 Å²	167.1	69%	0.692	83%	0.828	S	S	*	*			cis	-132.5	-170.1	16.7	-99.2	-137.4	95.3	0	0	114.4
181	K	25	Very low	25	Very low	177 Å²	177	169.4 Å²	169.4	77%	0.77	83%	0.832	S	S	*	*			trans	-80.9	145.9	-163.8	-48.9	151.4	-172.1	105.1	0	115.8
182	P	21.8	Very low	25.4	Very low	127 Å²	127	167.3 Å²	167.3	83%	0.825	82%	0.82	S	S	*	*			trans	-105.8	147.1	156.1	35.7	-29.8	0	0	0	113.7
183	R	22.5	Very low	25.8	Very low	249 Å²	249	167.4 Å²	167.4	94%	0.94	82%	0.82	S	S	*	*			trans	-79	160.8	176.1	-75	-179.9	172.1	179.3	-2.6	113.2
184	L	25.6	Very low	26.3	Very low	168 Å²	168	167 Å²	167	88%	0.88	81%	0.81	S	S	*	*			trans	-60.1	144.8	-178.3	-65.8	83.7	0	0	0	113.6
185	K	24.8	Very low	27.2	Very low	206 Å²	206	164.1 Å²	164.1	90%	0.896	79%	0.791	S	S	*	*			trans	-126.1	127.6	150.7	-81.2	-177.3	175	174.7	0	109.5
186	Q	24.5	Very low	28.1	Very low	188 Å²	188	156.8 Å²	156.8	88%	0.879	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-70.3	141.3	-176.9	-66.1	170.3	-13	0	0	111.3
187	R	24.8	Very low	29	Very low	247 Å²	247	153.5 Å²	153.5	93%	0.932	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-77.8	122.5	174.7	-76	174.2	137.9	-178.1	-4.9	110.3
188	K	25.6	Very low	29.8	Very low	200 Å²	200	148.4 Å²	148.4	87%	0.87	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-69.5	144.3	165.7	-67.2	-171.5	177.5	-174.7	0	110.1
189	P	26.6	Very low	30.9	Very low	114 Å²	114	142.9 Å²	142.9	74%	0.74	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-70.5	157	177.1	30.1	-35.4	0	0	0	112
190	P	29.6	Very low	32	Very low	126 Å²	126	136.3 Å²	136.3	82%	0.818	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-69.7	138.8	178.9	28.9	-34.5	0	0	0	112.1	K192	P190-K192 PolarHBondContact O-N 2.97Å
191	K	29.9	Very low	33	Very low	172 Å²	172	132.6 Å²	132.6	75%	0.748	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-61.8	131.2	174.7	-75.7	-165.8	170.5	-168.3	0	110.8	E206	K191-E206 IonicContact NZ-OE2 4Å; K191-E206 PolarHBondContact NZ-OE2 3.04Å
192	K	32.8	Very low	34.1	Very low	154 Å²	154	125 Å²	125	67%	0.67	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-62.7	144.5	165.5	-73.2	176.6	173.9	172.9	0	109.7	P190 E349	P190-K192 PolarHBondContact O-N 2.97Å; K192-E349 IonicContact NZ-OE1 2.53Å; K192-E349 PolarHBondContact NZ-OE1 3.45Å; K192-E349 IonicContact NZ-OE2 2.68Å; K192-E349 PolarHBondContact NZ-OE2 3.24Å
193	Q	31	Very low	34.9	Very low	176 Å²	176	122.1 Å²	122.1	82%	0.822	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-87.9	151.8	167.2	-72.7	-171.2	-7.2	0	0	110.9
194	P	35.7	Very low	35.8	Very low	85 Å²	85	112.3 Å²	112.3	55%	0.552	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-67.6	135	-178.5	27.3	-34.7	0	0	0	112.1
195	K	42.7	Very low	36.4	Very low	96 Å²	96	107.9 Å²	107.9	42%	0.417	56%	0.561	S	S	.	*	S	Bend	trans	-81.9	-16.4	-170.6	-70.9	170.4	171	167.3	0	115.7	D347 E349	K195-D347 HydrophobicContact CD-CB 4.41Å; K195-D347 IonicContact NZ-OD1 3.19Å; K195-D347 PolarHBondContact NZ-OD1 3.1Å; K195-E349 IonicContact NZ-OE2 2.79Å; K195-E349 PolarHBondContact NZ-OE2 3.48Å
196	N	43.2	Very low	37.2	Very low	42 Å²	42	105.1 Å²	105.1	23%	0.225	55%	0.551	C	S	.	*			trans	-118.8	131.9	-176.2	-65.5	7.8	0	0	0	111.2	T198 N199 A200 H381	N196-T198 VanDerWaalsContact C-N 3.31Å; N196-T198 PolarHBondContact O-N 2.96Å; N196-N199 HydrophobicContact CB-CB 4.24Å; N196-N199 WeakPolarHBondContact O-CB 3.47Å; N196-N199 PolarHBondContact O-N 3.44Å; N196-N199 VanDerWaalsContact O-N 3.13Å; N196-A200 PolarHBondContact O-N 3.06Å; N196-H381 PolarHBondContact ND2-NE2 3.3Å
197	W	47.7	Very low	38.2	Very low	46 Å²	46	105.6 Å²	105.6	17%	0.174	55%	0.553	C	S	.	*	H	α-helix	trans	-67.6	-27.5	179.2	73	-90.9	0	0	0	113.7	N199 A200 A201 L605 A609 D627	W197-N199 VanDerWaalsContact C-N 3.34Å; W197-A200 PolarHBondContact O-N 3.23Å; W197-A201 PolarHBondContact O-N 3.1Å; W197-L605 HydrophobicContact CZ2-CD2 4.24Å; W197-L605 HydrophobicContact CZ2-CG 4.42Å; W197-A609 HydrophobicContact CB-CB 4.12Å; W197-A609 HydrophobicContact CD2-CB 3.6Å; W197-A609 HydrophobicContact CE3-CB 3.92Å; W197-A609 HydrophobicContact CG-CB 3.69Å; W197-D627 WeakPolarHBondContact CH2-O 3.45Å; W197-D627 VanDerWaalsContact CZ3-O 3.23Å; W197-D627 WeakPolarHBondContact CZ3-O 3.4Å
198	T	46.7	Very low	39.5	Very low	18 Å²	18	101.2 Å²	101.2	11%	0.11	54%	0.541	C	S	.	.	H	α-helix	trans	-61.5	-43.8	170.5	44.8	0	0	0	0	110.8	N196 A200 A201 L202	N196-T198 VanDerWaalsContact C-N 3.31Å; N196-T198 PolarHBondContact O-N 2.96Å; T198-A200 VanDerWaalsContact C-N 3.34Å; T198-A201 PolarHBondContact O-N 3.37Å; T198-L202 WeakPolarHBondContact O-CG 3.42Å; T198-L202 PolarHBondContact O-N 3.38Å
199	N	46.5	Very low	41.2	Very low	70 Å²	70	98.8 Å²	98.8	37%	0.374	54%	0.537	S	S	.	.	H	α-helix	trans	-68.2	-35.5	174.2	-65	4.3	0	0	0	111	N196 W197 A201 L202 S203 H381	N196-N199 HydrophobicContact CB-CB 4.24Å; N196-N199 WeakPolarHBondContact O-CB 3.47Å; N196-N199 PolarHBondContact O-N 3.44Å; N196-N199 VanDerWaalsContact O-N 3.13Å; W197-N199 VanDerWaalsContact C-N 3.34Å; N199-A201 VanDerWaalsContact C-N 3.27Å; N199-A201 PolarHBondContact O-N 2.86Å; N199-L202 CarbonylContact O-C 3.58Å; N199-L202 PolarHBondContact O-N 3.36Å; N199-S203 VanDerWaalsContact O-CB 3.24Å; N199-S203 WeakPolarHBondContact O-CB 3.17Å; N199-S203 PolarHBondContact O-N 2.92Å; N199-S203 PolarHBondContact O-OG 3.2Å; N199-H381 PolarHBondContact OD1-CD2 3.41Å
200	A	42.4	Very low	43.5	Very low	54 Å²	54	94.4 Å²	94.4	45%	0.446	51%	0.509	S	S	.	.	H	α-helix	trans	-66.7	-25.2	174.9	0	0	0	0	0	113.8	N196 W197 T198 S203	N196-A200 PolarHBondContact O-N 3.06Å; W197-A200 PolarHBondContact O-N 3.23Å; T198-A200 VanDerWaalsContact C-N 3.34Å; A200-S203 WeakPolarHBondContact CA-OG 3.42Å; A200-S203 PolarHBondContact O-OG 3.34Å
201	A	43.8	Very low	46	Very low	69 Å²	69	93.4 Å²	93.4	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-81.8	-23.9	172.9	0	0	0	0	0	113.1	W197 T198 N199	W197-A201 PolarHBondContact O-N 3.1Å; T198-A201 PolarHBondContact O-N 3.37Å; N199-A201 VanDerWaalsContact C-N 3.27Å; N199-A201 PolarHBondContact O-N 2.86Å
202	L	47.1	Very low	48.6	Very low	19 Å²	19	86.2 Å²	86.2	10%	0.099	47%	0.467	C	S	.	.	H	α-helix	trans	-95.6	-18.3	176.7	-68.1	170.8	0	0	0	113	T198 N199 G204 L231 F233 A385	T198-L202 WeakPolarHBondContact O-CG 3.42Å; T198-L202 PolarHBondContact O-N 3.38Å; N199-L202 CarbonylContact O-C 3.58Å; N199-L202 PolarHBondContact O-N 3.36Å; L202-G204 VanDerWaalsContact C-N 3.31Å; L202-G204 PolarHBondContact O-N 3.42Å; L202-L231 HydrophobicContact CB-CD2 4.23Å; L202-F233 HydrophobicContact CD2-CE2 4.27Å; L202-F233 HydrophobicContact CD2-CZ 4.02Å; L202-A385 HydrophobicContact CD1-CB 4.25Å
203	S	40	Very low	51	Low	66 Å²	66	81.3 Å²	81.3	46%	0.462	45%	0.453	S	S	.	.			trans	-80.4	79.4	175.7	67.9	0	0	0	0	110.4	N199 A200	N199-S203 VanDerWaalsContact O-CB 3.24Å; N199-S203 WeakPolarHBondContact O-CB 3.17Å; N199-S203 PolarHBondContact O-N 2.92Å; N199-S203 PolarHBondContact O-OG 3.2Å; A200-S203 WeakPolarHBondContact CA-OG 3.42Å; A200-S203 PolarHBondContact O-OG 3.34Å
204	G	41	Very low	53.6	Low	43 Å²	43	75.1 Å²	75.1	44%	0.443	43%	0.432	S	S	.	.			trans	-49.6	150	146.3	0	0	0	0	0	109.7	L202 E206	L202-G204 VanDerWaalsContact C-N 3.31Å; L202-G204 PolarHBondContact O-N 3.42Å; G204-E206 PolarHBondContact O-N 3.38Å
205	S	38.4	Very low	56	Low	75 Å²	75	71.1 Å²	71.1	52%	0.524	41%	0.405	S	S	.	.			trans	-52	132.4	-177.7	53.5	0	0	0	0	111.5	E207	S205-E207 PolarHBondContact O-N 3.16Å
206	E	42.1	Very low	57.7	Low	148 Å²	148	73.3 Å²	73.3	69%	0.692	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.7	137.9	166.5	-60.1	-178.9	136.5	0	0	109.3	K191 G204	K191-E206 IonicContact NZ-OE2 4Å; K191-E206 PolarHBondContact NZ-OE2 3.04Å; G204-E206 PolarHBondContact O-N 3.38Å
207	E	45.2	Very low	59.6	Low	197 Å²	197	77.9 Å²	77.9	92%	0.921	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	41.7	178.5	-56	171.5	-168.6	0	0	116.6	S205	S205-E207 PolarHBondContact O-N 3.16Å
208	K	52.1	Low	61.5	Low	156 Å²	156	76.3 Å²	76.3	68%	0.678	44%	0.435	S	S	*	.			trans	-133.1	103.8	157.5	-69.6	-170.3	178.9	-177.3	0	112.9	S210	K208-S210 PolarHBondContact O-N 3.14Å
209	N	61	Low	63.4	Low	149 Å²	149	80.3 Å²	80.3	80%	0.797	45%	0.451	S	S	*	.			trans	-67.8	112.9	160.8	-78.6	-9.8	0	0	0	108.3
210	S	75.6	Confident	65.4	Low	22 Å²	22	77.6 Å²	77.6	15%	0.154	44%	0.436	C	S	.	.			trans	-80	145.1	168.5	68.5	0	0	0	0	110.3	K208 S229 G232	K208-S210 PolarHBondContact O-N 3.14Å; S210-S229 PolarHBondContact N-O 2.95Å; S210-S229 PolarHBondContact N-OG 3.13Å; S210-S229 PolarHBondContact O-OG 3.33Å; S210-S229 PolarHBondContact OG-O 3.07Å; S210-G232 WeakPolarHBondContact OG-CA 3.47Å
211	D	80.8	Confident	67.6	Low	105 Å²	105	75.9 Å²	75.9	56%	0.561	42%	0.421	S	S	*	.			trans	-59.3	141.8	167.4	-178.7	30	0	0	0	110	S213 T234	D211-S213 WeakPolarHBondContact OD1-CB 3.25Å; D211-S213 PolarHBondContact OD1-N 3.37Å; D211-S213 VanDerWaalsContact OD2-CB 3.26Å; D211-S213 WeakPolarHBondContact OD2-CB 3.14Å; D211-S213 PolarHBondContact OD2-OG 3.08Å; D211-T234 WeakPolarHBondContact O-CA 3.48Å
212	V	83.9	Confident	69.7	Low	20 Å²	20	77.6 Å²	77.6	12%	0.121	43%	0.428	C	S	.	.			trans	-131.1	20.5	178.9	-66.5	0	0	0	0	111.3	A214 W215 L228	V212-A214 PolarHBondContact O-N 3.02Å; V212-W215 WeakPolarHBondContact O-CB 3.42Å; V212-W215 PolarHBondContact O-N 3.16Å; V212-L228 HydrophobicContact CG1-CB 4.45Å
213	S	83.8	Confident	71.7	Confident	52 Å²	52	77.6 Å²	77.6	36%	0.364	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-42.8	-46.5	174	55.7	0	0	0	0	113.2	D211 W215 K216	D211-S213 WeakPolarHBondContact OD1-CB 3.25Å; D211-S213 PolarHBondContact OD1-N 3.37Å; D211-S213 VanDerWaalsContact OD2-CB 3.26Å; D211-S213 WeakPolarHBondContact OD2-CB 3.14Å; D211-S213 PolarHBondContact OD2-OG 3.08Å; S213-W215 PolarHBondContact O-N 3.04Å; S213-K216 WeakPolarHBondContact O-CG 3.45Å; S213-K216 PolarHBondContact O-N 3.07Å; S213-K216 VanDerWaalsContact O-N 3.1Å
214	A	85.1	Confident	74	Confident	46 Å²	46	74.4 Å²	74.4	38%	0.38	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-63.7	-3.2	179.7	0	0	0	0	0	115.9	V212 P236	V212-A214 PolarHBondContact O-N 3.02Å; A214-P236 WeakPolarHBondContact O-CD 3.35Å
215	W	86.5	Confident	76.3	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-104.2	-12.4	175.1	-65.2	88.9	0	0	0	114	V212 S213 D217 L218 V220 L225 L228 F233 P236 Q240 L244 I270	V212-W215 WeakPolarHBondContact O-CB 3.42Å; V212-W215 PolarHBondContact O-N 3.16Å; S213-W215 PolarHBondContact O-N 3.04Å; W215-D217 VanDerWaalsContact C-N 3.34Å; W215-D217 PolarHBondContact O-N 3.04Å; W215-L218 PolarHBondContact O-N 3.46Å; W215-V220 HydrophobicContact CE3-CG2 4.19Å; W215-L225 HydrophobicContact CB-CD2 3.5Å; W215-L225 VanDerWaalsContact CB-CD2 3.5Å; W215-L225 HydrophobicContact CG-CD2 4.38Å; W215-L228 HydrophobicContact CD2-CD1 3.83Å; W215-L228 HydrophobicContact CE3-CD1 3.83Å; W215-L228 HydrophobicContact CG-CD1 4.38Å; W215-L228 HydrophobicContact CH2-CD1 4.15Å; W215-L228 HydrophobicContact CH2-CD2 4.26Å; W215-L228 HydrophobicContact CZ2-CD1 4.17Å; W215-L228 HydrophobicContact CZ2-CD2 4.27Å; W215-L228 HydrophobicContact CZ3-CD1 3.98Å; W215-F233 HydrophobicContact CZ2-CB 4.15Å; W215-F233 PolarHBondContact NE1-O 3.43Å; W215-P236 HydrophobicContact CD2-CB 4.13Å; W215-P236 HydrophobicContact CD2-CG 4.46Å; W215-P236 HydrophobicContact CE3-CB 3.95Å; W215-P236 HydrophobicContact CH2-CB 4.02Å; W215-P236 HydrophobicContact CZ2-CB 4.16Å; W215-P236 HydrophobicContact CZ3-CB 3.91Å; W215-Q240 VanDerWaalsContact CH2-OE1 3.31Å; W215-L244 HydrophobicContact CE3-CD1 4.26Å; W215-L244 HydrophobicContact CZ3-CD1 3.98Å; W215-I270 HydrophobicContact CZ3-CD1 3.87Å
216	K	78.6	Confident	78.7	Confident	143 Å²	143	76.4 Å²	76.4	62%	0.622	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-62	-40.8	-171.9	-68.2	-178.7	178.6	-179.2	0	112.5	S213 L218	S213-K216 WeakPolarHBondContact O-CG 3.45Å; S213-K216 PolarHBondContact O-N 3.07Å; S213-K216 VanDerWaalsContact O-N 3.1Å; K216-L218 PolarHBondContact O-N 3.49Å
217	D	83.3	Confident	81	Confident	137 Å²	137	69.3 Å²	69.3	73%	0.733	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-77.7	2.2	-177.1	-48.7	-41	0	0	0	113.6	W215	W215-D217 VanDerWaalsContact C-N 3.34Å; W215-D217 PolarHBondContact O-N 3.04Å
218	L	86.6	Confident	83	Confident	14 Å²	14	60 Å²	60	7%	0.073	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-104.9	20.3	-178.3	-57.8	-176.4	0	0	0	113.3	W215 K216 V220 P236 T241 L244 P245	W215-L218 PolarHBondContact O-N 3.46Å; K216-L218 PolarHBondContact O-N 3.49Å; L218-V220 HydrophobicContact CB-CG2 4.02Å; L218-V220 PolarHBondContact O-N 2.87Å; L218-P236 HydrophobicContact CD1-CB 3.78Å; L218-P236 HydrophobicContact CD1-CG 3.65Å; L218-T241 HydrophobicContact CD2-CG2 4.29Å; L218-L244 HydrophobicContact CB-CB 4.24Å; L218-L244 HydrophobicContact CB-CD1 4.22Å; L218-L244 HydrophobicContact CD1-CD1 4.13Å; L218-P245 HydrophobicContact CD2-CG 3.75Å
219	F	87	Confident	84.7	Confident	102 Å²	102	53.2 Å²	53.2	45%	0.447	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	29.7	175.1	-54.7	-89.5	0	0	0	114.4	I248 R249	F219-I248 HydrophobicContact CB-CB 4.18Å; F219-I248 HydrophobicContact CB-CD1 4.35Å; F219-I248 HydrophobicContact CB-CG2 3.41Å; F219-I248 VanDerWaalsContact CB-CG2 3.41Å; F219-I248 HydrophobicContact CG-CG2 4.24Å; F219-R249 HydrophobicContact CD2-CB 4.5Å; F219-R249 HydrophobicContact CE2-CB 4.38Å; F219-R249 HydrophobicContact CZ-CG 4.47Å
220	V	88.4	Confident	85.9	Confident	12 Å²	12	47.9 Å²	47.9	7%	0.073	27%	0.267	C	S	.	.			trans	-79.8	129.5	-174.8	-177.2	0	0	0	0	111.2	W215 L218 V224 L225 L228 L244 I270	W215-V220 HydrophobicContact CE3-CG2 4.19Å; L218-V220 HydrophobicContact CB-CG2 4.02Å; L218-V220 PolarHBondContact O-N 2.87Å; V220-V224 HydrophobicContact CG1-CB 3.82Å; V220-V224 HydrophobicContact CG1-CG1 3.32Å; V220-L225 HydrophobicContact CB-CD2 3.83Å; V220-L225 HydrophobicContact CB-CG 4.07Å; V220-L225 HydrophobicContact CG1-CD2 3.76Å; V220-L225 HydrophobicContact CG1-CG 3.87Å; V220-L228 HydrophobicContact CG1-CD1 4.21Å; V220-L244 HydrophobicContact CG2-CD1 4.22Å; V220-I270 HydrophobicContact CG1-CG2 4.04Å; V220-I270 HydrophobicContact CG2-CG2 4.32Å
221	P	88.8	Confident	86.3	Confident	19 Å²	19	48.1 Å²	48.1	12%	0.123	27%	0.267	C	S	.	.			trans	-57.2	147.1	179.4	-26.5	33.9	0	0	0	114	A223 V224 L225 H274 L277	P221-A223 VanDerWaalsContact C-N 3.34Å; P221-A223 PolarHBondContact O-N 3.2Å; P221-V224 HydrophobicContact CB-CB 4.27Å; P221-V224 HydrophobicContact CB-CG2 4.13Å; P221-V224 HydrophobicContact CG-CG2 4.27Å; P221-V224 CarbonylContact O-C 3.45Å; P221-V224 WeakPolarHBondContact O-CA 3.31Å; P221-V224 WeakPolarHBondContact O-CB 3.33Å; P221-V224 PolarHBondContact O-N 3.17Å; P221-L225 PolarHBondContact O-N 3.49Å; P221-H274 HydrophobicContact CG-CB 3.67Å; P221-L277 HydrophobicContact CB-CD1 3.89Å; P221-L277 HydrophobicContact CG-CD1 4.12Å
222	S	88.5	Confident	86.4	Confident	104 Å²	104	45 Å²	45	73%	0.727	26%	0.26	S	S	*	.	H	α-helix	trans	-56.7	-42	-178.2	57.2	0	0	0	0	113.6	V224 L225 K226	S222-V224 VanDerWaalsContact C-N 3.31Å; S222-V224 PolarHBondContact O-N 3.06Å; S222-L225 PolarHBondContact O-N 3.3Å; S222-K226 PolarHBondContact O-N 3.3Å
223	A	89.4	Confident	86.4	Confident	19 Å²	19	47.2 Å²	47.2	16%	0.157	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-37	174.4	0	0	0	0	0	112.8	P221 A227 Y389 T390	P221-A223 VanDerWaalsContact C-N 3.34Å; P221-A223 PolarHBondContact O-N 3.2Å; A223-A227 PolarHBondContact O-N 3.44Å; A223-Y389 WeakPolarHBondContact CB-O 3.44Å; A223-T390 HydrophobicContact CB-CG2 3.6Å
224	V	88.8	Confident	86.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-71.3	-42.9	176.3	170	0	0	0	0	110.7	V220 P221 S222 K226 A227 L228 I270 I273 V386	V220-V224 HydrophobicContact CG1-CB 3.82Å; V220-V224 HydrophobicContact CG1-CG1 3.32Å; P221-V224 HydrophobicContact CB-CB 4.27Å; P221-V224 HydrophobicContact CB-CG2 4.13Å; P221-V224 HydrophobicContact CG-CG2 4.27Å; P221-V224 CarbonylContact O-C 3.45Å; P221-V224 WeakPolarHBondContact O-CA 3.31Å; P221-V224 WeakPolarHBondContact O-CB 3.33Å; P221-V224 PolarHBondContact O-N 3.17Å; S222-V224 VanDerWaalsContact C-N 3.31Å; S222-V224 PolarHBondContact O-N 3.06Å; V224-K226 VanDerWaalsContact C-N 3.29Å; V224-K226 PolarHBondContact O-N 3.11Å; V224-A227 WeakPolarHBondContact O-CA 3.45Å; V224-A227 WeakPolarHBondContact O-CB 3.41Å; V224-A227 PolarHBondContact O-N 3.43Å; V224-A227 VanDerWaalsContact O-N 3.08Å; V224-L228 HydrophobicContact CG1-CD1 3.98Å; V224-L228 HydrophobicContact CG1-CG 4.3Å; V224-L228 WeakPolarHBondContact O-CG 3.2Å; V224-L228 PolarHBondContact O-N 3.26Å; V224-I270 HydrophobicContact CG1-CD1 4.13Å; V224-I270 HydrophobicContact CG1-CG1 3.91Å; V224-I270 HydrophobicContact CG1-CG2 4.17Å; V224-I273 HydrophobicContact CG2-CG2 3.67Å; V224-V386 HydrophobicContact CB-CG1 4.34Å; V224-V386 HydrophobicContact CG1-CG1 3.67Å; V224-V386 HydrophobicContact CG2-CG1 4.12Å
225	L	89.4	Confident	86.4	Confident	32 Å²	32	49.5 Å²	49.5	17%	0.168	28%	0.278	C	S	.	.	H	α-helix	trans	-58.3	-41.5	173.5	-69.7	174.4	0	0	0	111.7	W215 V220 P221 S222 A227 L228 S229	W215-L225 HydrophobicContact CB-CD2 3.5Å; W215-L225 VanDerWaalsContact CB-CD2 3.5Å; W215-L225 HydrophobicContact CG-CD2 4.38Å; V220-L225 HydrophobicContact CB-CD2 3.83Å; V220-L225 HydrophobicContact CB-CG 4.07Å; V220-L225 HydrophobicContact CG1-CD2 3.76Å; V220-L225 HydrophobicContact CG1-CG 3.87Å; P221-L225 PolarHBondContact O-N 3.49Å; S222-L225 PolarHBondContact O-N 3.3Å; L225-A227 VanDerWaalsContact C-N 3.33Å; L225-A227 PolarHBondContact O-N 2.97Å; L225-L228 PolarHBondContact O-N 3.25Å; L225-S229 WeakPolarHBondContact O-CB 3.45Å; L225-S229 PolarHBondContact O-N 2.89Å
226	K	88.8	Confident	86.5	Confident	127 Å²	127	50.6 Å²	50.6	55%	0.552	29%	0.285	S	S	*	.	H	α-helix	trans	-62.1	-39.3	173.7	-168.1	-178.6	-178.7	176.8	0	112	S222 V224 S230 Y389	S222-K226 PolarHBondContact O-N 3.3Å; V224-K226 VanDerWaalsContact C-N 3.29Å; V224-K226 PolarHBondContact O-N 3.11Å; K226-S230 PolarHBondContact O-N 3.42Å; K226-S230 VanDerWaalsContact O-N 3.17Å; K226-S230 PolarHBondContact O-OG 3.33Å; K226-Y389 HydrophobicContact CB-CD2 3.94Å; K226-Y389 HydrophobicContact CB-CE2 4.25Å; K226-Y389 HydrophobicContact CD-CD1 4.18Å; K226-Y389 HydrophobicContact CD-CD2 3.98Å; K226-Y389 HydrophobicContact CD-CE1 4.37Å; K226-Y389 HydrophobicContact CD-CE2 4.19Å; K226-Y389 HydrophobicContact CD-CG 3.99Å; K226-Y389 HydrophobicContact CG-CD2 3.8Å; K226-Y389 HydrophobicContact CG-CE2 3.75Å; K226-Y389 HydrophobicContact CG-CG 4.33Å
227	A	88.8	Confident	86.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-50.8	174.3	0	0	0	0	0	111.7	A223 V224 L225 S229 S230 L231 V386 Y389	A223-A227 PolarHBondContact O-N 3.44Å; V224-A227 WeakPolarHBondContact O-CA 3.45Å; V224-A227 WeakPolarHBondContact O-CB 3.41Å; V224-A227 PolarHBondContact O-N 3.43Å; V224-A227 VanDerWaalsContact O-N 3.08Å; L225-A227 VanDerWaalsContact C-N 3.33Å; L225-A227 PolarHBondContact O-N 2.97Å; A227-S229 VanDerWaalsContact C-N 3.34Å; A227-S229 PolarHBondContact O-N 3.38Å; A227-S230 CarbonylContact O-C 3.53Å; A227-S230 PolarHBondContact O-N 3.13Å; A227-S230 PolarHBondContact O-OG 3.31Å; A227-L231 VanDerWaalsContact O-CG 3.29Å; A227-L231 WeakPolarHBondContact O-CG 3.44Å; A227-L231 PolarHBondContact O-N 3.06Å; A227-V386 VanDerWaalsContact CB-O 3.26Å; A227-V386 WeakPolarHBondContact CB-O 3.38Å; A227-Y389 HydrophobicContact CB-CD2 3.97Å; A227-Y389 HydrophobicContact CB-CE2 4.35Å
228	L	87.9	Confident	87.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.4	-42.6	179.1	-67.6	170.6	0	0	0	112.4	V212 W215 V220 V224 L225 L231 G232 F233 L266 I270 V386	V212-L228 HydrophobicContact CG1-CB 4.45Å; W215-L228 HydrophobicContact CD2-CD1 3.83Å; W215-L228 HydrophobicContact CE3-CD1 3.83Å; W215-L228 HydrophobicContact CG-CD1 4.38Å; W215-L228 HydrophobicContact CH2-CD1 4.15Å; W215-L228 HydrophobicContact CH2-CD2 4.26Å; W215-L228 HydrophobicContact CZ2-CD1 4.17Å; W215-L228 HydrophobicContact CZ2-CD2 4.27Å; W215-L228 HydrophobicContact CZ3-CD1 3.98Å; V220-L228 HydrophobicContact CG1-CD1 4.21Å; V224-L228 HydrophobicContact CG1-CD1 3.98Å; V224-L228 HydrophobicContact CG1-CG 4.3Å; V224-L228 WeakPolarHBondContact O-CG 3.2Å; V224-L228 PolarHBondContact O-N 3.26Å; L225-L228 PolarHBondContact O-N 3.25Å; L228-L231 CarbonylContact O-C 3.53Å; L228-L231 PolarHBondContact O-N 2.83Å; L228-G232 PolarHBondContact O-N 3.45Å; L228-G232 VanDerWaalsContact O-N 3.14Å; L228-F233 HydrophobicContact CB-CB 4.3Å; L228-F233 HydrophobicContact CD2-CB 4.06Å; L228-F233 HydrophobicContact CD2-CD2 3.77Å; L228-F233 HydrophobicContact CD2-CG 4.24Å; L228-F233 PolarHBondContact O-N 3.34Å; L228-L266 HydrophobicContact CD2-CD1 4.04Å; L228-I270 HydrophobicContact CD1-CD1 4.19Å; L228-V386 HydrophobicContact CD2-CG2 4.36Å
229	S	87.5	Confident	87.1	Confident	14 Å²	14	42.9 Å²	42.9	10%	0.098	26%	0.257	C	S	.	.	H	α-helix	trans	-63	-40.6	174.7	-176.4	0	0	0	0	112.2	S210 L225 A227 L231 G232	S210-S229 PolarHBondContact N-O 2.95Å; S210-S229 PolarHBondContact N-OG 3.13Å; S210-S229 PolarHBondContact O-OG 3.33Å; S210-S229 PolarHBondContact OG-O 3.07Å; L225-S229 WeakPolarHBondContact O-CB 3.45Å; L225-S229 PolarHBondContact O-N 2.89Å; A227-S229 VanDerWaalsContact C-N 3.34Å; A227-S229 PolarHBondContact O-N 3.38Å; S229-L231 PolarHBondContact O-N 3.11Å; S229-G232 PolarHBondContact O-N 3.09Å
230	S	85.9	Confident	87.3	Confident	37 Å²	37	38.3 Å²	38.3	26%	0.259	24%	0.237	S	C	.	.	H	α-helix	trans	-72.5	-14.4	176.2	74.4	0	0	0	0	114.6	K226 A227	K226-S230 PolarHBondContact O-N 3.42Å; K226-S230 VanDerWaalsContact O-N 3.17Å; K226-S230 PolarHBondContact O-OG 3.33Å; A227-S230 CarbonylContact O-C 3.53Å; A227-S230 PolarHBondContact O-N 3.13Å; A227-S230 PolarHBondContact O-OG 3.31Å
231	L	84.1	Confident	87.4	Confident	27 Å²	27	40.6 Å²	40.6	14%	0.141	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-3.7	175.9	-66.7	165.9	0	0	0	112.6	L202 A227 L228 S229 F233 A385 V386	L202-L231 HydrophobicContact CB-CD2 4.23Å; A227-L231 VanDerWaalsContact O-CG 3.29Å; A227-L231 WeakPolarHBondContact O-CG 3.44Å; A227-L231 PolarHBondContact O-N 3.06Å; L228-L231 CarbonylContact O-C 3.53Å; L228-L231 PolarHBondContact O-N 2.83Å; S229-L231 PolarHBondContact O-N 3.11Å; L231-F233 HydrophobicContact CB-CD2 3.57Å; L231-F233 HydrophobicContact CB-CE2 3.76Å; L231-F233 HydrophobicContact CD1-CD2 4.18Å; L231-F233 HydrophobicContact CD1-CE2 4.03Å; L231-F233 HydrophobicContact CG-CE2 4.46Å; L231-A385 HydrophobicContact CD1-CB 3.97Å; L231-A385 HydrophobicContact CD2-CB 4.1Å; L231-V386 HydrophobicContact CD1-CG2 4.04Å
232	G	83.3	Confident	87.3	Confident	41 Å²	41	43.7 Å²	43.7	42%	0.423	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	16.5	-179.4	0	0	0	0	0	115.1	S210 L228 S229 T234	S210-G232 WeakPolarHBondContact OG-CA 3.47Å; L228-G232 PolarHBondContact O-N 3.45Å; L228-G232 VanDerWaalsContact O-N 3.14Å; S229-G232 PolarHBondContact O-N 3.09Å; G232-T234 VanDerWaalsContact C-N 3.35Å; G232-T234 PolarHBondContact O-N 2.77Å
233	F	84	Confident	87.4	Confident	65 Å²	65	38.8 Å²	38.8	29%	0.285	23%	0.232	S	C	.	.			trans	-79.4	78.6	179.6	-72.3	-60.2	0	0	0	111.3	L202 W215 L228 L231 S235 L266	L202-F233 HydrophobicContact CD2-CE2 4.27Å; L202-F233 HydrophobicContact CD2-CZ 4.02Å; W215-F233 HydrophobicContact CZ2-CB 4.15Å; W215-F233 PolarHBondContact NE1-O 3.43Å; L228-F233 HydrophobicContact CB-CB 4.3Å; L228-F233 HydrophobicContact CD2-CB 4.06Å; L228-F233 HydrophobicContact CD2-CD2 3.77Å; L228-F233 HydrophobicContact CD2-CG 4.24Å; L228-F233 PolarHBondContact O-N 3.34Å; L231-F233 HydrophobicContact CB-CD2 3.57Å; L231-F233 HydrophobicContact CB-CE2 3.76Å; L231-F233 HydrophobicContact CD1-CD2 4.18Å; L231-F233 HydrophobicContact CD1-CE2 4.03Å; L231-F233 HydrophobicContact CG-CE2 4.46Å; F233-S235 VanDerWaalsContact C-N 3.31Å; F233-S235 PolarHBondContact O-N 2.81Å; F233-L266 HydrophobicContact CD2-CD1 4.43Å; F233-L266 HydrophobicContact CE2-CD1 4.22Å; F233-L266 HydrophobicContact CZ-CD1 4.46Å
234	T	83.7	Confident	87.5	Confident	78 Å²	78	37.9 Å²	37.9	48%	0.479	22%	0.224	S	C	.	.			trans	-59.6	-35	-175.8	49.6	0	0	0	0	114.9	D211 G232	D211-T234 WeakPolarHBondContact O-CA 3.48Å; G232-T234 VanDerWaalsContact C-N 3.35Å; G232-T234 PolarHBondContact O-N 2.77Å
235	S	85.3	Confident	87.6	Confident	69 Å²	69	39.1 Å²	39.1	48%	0.483	23%	0.232	S	C	.	.	S	Bend	trans	-144.7	146.2	-173.3	56.7	0	0	0	0	112.1	F233	F233-S235 VanDerWaalsContact C-N 3.31Å; F233-S235 PolarHBondContact O-N 2.81Å
236	P	88.8	Confident	87.7	Confident	22 Å²	22	38.1 Å²	38.1	14%	0.143	23%	0.228	C	C	.	.			trans	-67.1	147.6	174.6	29.5	-36.2	0	0	0	111.8	A214 W215 L218 Q240	A214-P236 WeakPolarHBondContact O-CD 3.35Å; W215-P236 HydrophobicContact CD2-CB 4.13Å; W215-P236 HydrophobicContact CD2-CG 4.46Å; W215-P236 HydrophobicContact CE3-CB 3.95Å; W215-P236 HydrophobicContact CH2-CB 4.02Å; W215-P236 HydrophobicContact CZ2-CB 4.16Å; W215-P236 HydrophobicContact CZ3-CB 3.91Å; L218-P236 HydrophobicContact CD1-CB 3.78Å; L218-P236 HydrophobicContact CD1-CG 3.65Å; P236-Q240 HydrophobicContact CB-CB 4.12Å
237	T	87.5	Confident	87.7	Confident	43 Å²	43	32 Å²	32	26%	0.264	20%	0.201	S	C	.	.			trans	-78.8	159.3	170	62.7	0	0	0	0	110.9	I239 Q240 T241 S262	T237-I239 VanDerWaalsContact C-N 3.26Å; T237-I239 PolarHBondContact O-N 3.09Å; T237-I239 VanDerWaalsContact O-N 3.11Å; T237-Q240 WeakPolarHBondContact O-CA 3.44Å; T237-Q240 WeakPolarHBondContact O-CB 3.47Å; T237-Q240 PolarHBondContact O-N 3.33Å; T237-Q240 WeakPolarHBondContact OG1-CG 3.5Å; T237-Q240 PolarHBondContact OG1-NE2 3.39Å; T237-Q240 PolarHBondContact OG1-OE1 2.83Å; T237-T241 PolarHBondContact O-N 2.83Å; T237-T241 PolarHBondContact O-OG1 3.31Å; T237-S262 WeakPolarHBondContact CB-O 3.34Å; T237-S262 PolarHBondContact OG1-O 2.91Å
238	P	86.7	Confident	87.8	Confident	88 Å²	88	32.4 Å²	32.4	57%	0.571	20%	0.203	S	C	*	.	H	α-helix	trans	-55	-34.4	-177.3	-29.1	36.6	0	0	0	115.1	L242 L528	P238-L242 WeakPolarHBondContact O-CB 3.5Å; P238-L242 VanDerWaalsContact O-CG 3.31Å; P238-L242 WeakPolarHBondContact O-CG 3.41Å; P238-L242 PolarHBondContact O-N 2.76Å; P238-L242 VanDerWaalsContact O-N 3.15Å; P238-L528 HydrophobicContact CB-CD1 4Å; P238-L528 HydrophobicContact CB-CD2 4.39Å
239	I	86.9	Confident	87.8	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-70.9	-32.3	176.2	-167.1	58.6	0	0	0	112	T237 A243 A258 S262 A267 F482 L526 L528	T237-I239 VanDerWaalsContact C-N 3.26Å; T237-I239 PolarHBondContact O-N 3.09Å; T237-I239 VanDerWaalsContact O-N 3.11Å; I239-A243 WeakPolarHBondContact O-CB 3.41Å; I239-A243 PolarHBondContact O-N 2.9Å; I239-A258 HydrophobicContact CD1-CB 4.31Å; I239-A258 HydrophobicContact CG1-CB 4.28Å; I239-S262 WeakPolarHBondContact CG2-O 3.11Å; I239-A267 HydrophobicContact CG1-CB 4.37Å; I239-A267 HydrophobicContact CG2-CB 4.35Å; I239-F482 HydrophobicContact CD1-CE1 4.14Å; I239-F482 HydrophobicContact CG1-CE1 3.95Å; I239-L526 HydrophobicContact CD1-CB 4.25Å; I239-L526 HydrophobicContact CD1-CD1 4.46Å; I239-L528 HydrophobicContact CB-CD1 3.68Å; I239-L528 HydrophobicContact CD1-CD1 3.91Å; I239-L528 HydrophobicContact CG1-CD1 4.35Å
240	Q	91.1	Very high	87.7	Confident	7 Å²	7	42.5 Å²	42.5	3%	0.033	25%	0.245	C	C	.	.	H	α-helix	trans	-72.3	-47.7	176.1	-66.9	154.6	-4.1	0	0	110.1	W215 P236 T237 L242 A243 L244 G263 A267	W215-Q240 VanDerWaalsContact CH2-OE1 3.31Å; P236-Q240 HydrophobicContact CB-CB 4.12Å; T237-Q240 WeakPolarHBondContact O-CA 3.44Å; T237-Q240 WeakPolarHBondContact O-CB 3.47Å; T237-Q240 PolarHBondContact O-N 3.33Å; T237-Q240 WeakPolarHBondContact OG1-CG 3.5Å; T237-Q240 PolarHBondContact OG1-NE2 3.39Å; T237-Q240 PolarHBondContact OG1-OE1 2.83Å; Q240-L242 PolarHBondContact O-N 3.39Å; Q240-A243 PolarHBondContact O-N 3.29Å; Q240-L244 HydrophobicContact CB-CD1 4.11Å; Q240-L244 HydrophobicContact CB-CG 4.47Å; Q240-L244 WeakPolarHBondContact O-CB 3.24Å; Q240-L244 WeakPolarHBondContact O-CG 3.46Å; Q240-L244 PolarHBondContact O-N 3.27Å; Q240-G263 PolarHBondContact NE2-O 2.84Å; Q240-A267 HydrophobicContact CG-CB 3.97Å
241	T	89.4	Confident	87.7	Confident	60 Å²	60	44.5 Å²	44.5	37%	0.368	25%	0.247	S	C	.	.	H	α-helix	trans	-57.8	-36.7	177.6	-44.6	0	0	0	0	112.6	L218 T237 P245	L218-T241 HydrophobicContact CD2-CG2 4.29Å; T237-T241 PolarHBondContact O-N 2.83Å; T237-T241 PolarHBondContact O-OG1 3.31Å; T241-P245 VanDerWaalsContact O-CD 3.27Å; T241-P245 WeakPolarHBondContact O-CD 3.34Å
242	L	88.2	Confident	87.9	Confident	84 Å²	84	46.3 Å²	46.3	44%	0.44	26%	0.255	S	S	.	.	H	α-helix	trans	-84.2	-27.9	179	-67	175.6	0	0	0	114.4	P238 Q240 P246 L526 L528	P238-L242 WeakPolarHBondContact O-CB 3.5Å; P238-L242 VanDerWaalsContact O-CG 3.31Å; P238-L242 WeakPolarHBondContact O-CG 3.41Å; P238-L242 PolarHBondContact O-N 2.76Å; P238-L242 VanDerWaalsContact O-N 3.15Å; Q240-L242 PolarHBondContact O-N 3.39Å; L242-P246 WeakPolarHBondContact O-CD 3.18Å; L242-P246 VanDerWaalsContact O-CG 3.31Å; L242-P246 WeakPolarHBondContact O-CG 3.34Å; L242-L526 HydrophobicContact CB-CD1 4.23Å; L242-L526 HydrophobicContact CB-CD2 4.11Å; L242-L528 HydrophobicContact CD1-CD1 4.48Å; L242-L528 HydrophobicContact CD1-CD2 3.89Å; L242-L528 HydrophobicContact CD1-CG 4.36Å
243	A	90.1	Very high	88.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-90.5	-37.1	-177.7	0	0	0	0	0	113.7	I239 Q240 P246 A247 A267 L526	I239-A243 WeakPolarHBondContact O-CB 3.41Å; I239-A243 PolarHBondContact O-N 2.9Å; Q240-A243 PolarHBondContact O-N 3.29Å; A243-P246 VanDerWaalsContact O-CD 3.3Å; A243-P246 WeakPolarHBondContact O-CD 3.43Å; A243-P246 WeakPolarHBondContact O-CG 3.46Å; A243-A247 WeakPolarHBondContact O-CB 3.31Å; A243-A247 PolarHBondContact O-N 3.07Å; A243-A267 HydrophobicContact CB-CB 4.08Å; A243-L526 HydrophobicContact CB-CD1 3.7Å
244	L	92	Very high	88.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.8	-48.4	-171.4	-66.3	174.6	0	0	0	113	W215 L218 V220 Q240 A247 I248 I270 P271	W215-L244 HydrophobicContact CE3-CD1 4.26Å; W215-L244 HydrophobicContact CZ3-CD1 3.98Å; L218-L244 HydrophobicContact CB-CB 4.24Å; L218-L244 HydrophobicContact CB-CD1 4.22Å; L218-L244 HydrophobicContact CD1-CD1 4.13Å; V220-L244 HydrophobicContact CG2-CD1 4.22Å; Q240-L244 HydrophobicContact CB-CD1 4.11Å; Q240-L244 HydrophobicContact CB-CG 4.47Å; Q240-L244 WeakPolarHBondContact O-CB 3.24Å; Q240-L244 WeakPolarHBondContact O-CG 3.46Å; Q240-L244 PolarHBondContact O-N 3.27Å; L244-A247 PolarHBondContact O-N 2.89Å; L244-I248 HydrophobicContact CB-CD1 4.31Å; L244-I248 HydrophobicContact CD2-CD1 4.23Å; L244-I248 VanDerWaalsContact O-CB 3.26Å; L244-I248 WeakPolarHBondContact O-CB 3.41Å; L244-I248 WeakPolarHBondContact O-CG1 3.33Å; L244-I248 PolarHBondContact O-N 3.39Å; L244-I270 HydrophobicContact CD1-CD1 4.38Å; L244-I270 HydrophobicContact CD2-CB 3.82Å; L244-I270 HydrophobicContact CD2-CG2 3.95Å; L244-P271 HydrophobicContact CD2-CG 3.74Å
245	P	91.3	Very high	88.6	Confident	26 Å²	26	38.9 Å²	38.9	17%	0.169	21%	0.206	C	C	.	.	H	α-helix	trans	-59.7	-51.7	179.1	-22.7	34.1	0	0	0	114.8	L218 T241 A247 I248 R249	L218-P245 HydrophobicContact CD2-CG 3.75Å; T241-P245 VanDerWaalsContact O-CD 3.27Å; T241-P245 WeakPolarHBondContact O-CD 3.34Å; P245-A247 VanDerWaalsContact C-N 3.32Å; P245-A247 PolarHBondContact O-N 3.28Å; P245-I248 PolarHBondContact O-N 2.9Å; P245-R249 WeakPolarHBondContact O-CB 3.41Å; P245-R249 PolarHBondContact O-N 3.37Å
246	P	89.7	Confident	88.6	Confident	11 Å²	11	35.6 Å²	35.6	7%	0.071	18%	0.183	C	C	.	.	H	α-helix	trans	-71.6	-24.2	179.1	28.9	-35.5	0	0	0	113.5	L242 A243 D250 R251 M252 I254 K524	L242-P246 WeakPolarHBondContact O-CD 3.18Å; L242-P246 VanDerWaalsContact O-CG 3.31Å; L242-P246 WeakPolarHBondContact O-CG 3.34Å; A243-P246 VanDerWaalsContact O-CD 3.3Å; A243-P246 WeakPolarHBondContact O-CD 3.43Å; A243-P246 WeakPolarHBondContact O-CG 3.46Å; P246-D250 CarbonylContact O-C 3.57Å; P246-R251 PolarHBondContact O-N 3.16Å; P246-M252 HydrophobicContact CB-SD 4.34Å; P246-M252 PolarHBondContact O-N 3.47Å; P246-I254 HydrophobicContact CB-CD1 4.33Å; P246-I254 HydrophobicContact CG-CD1 4.17Å; P246-K524 HydrophobicContact CB-CG 4.19Å; P246-K524 HydrophobicContact CG-CG 4.08Å
247	A	90	Very high	88.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-77.2	-37	175.7	0	0	0	0	0	112.7	A243 L244 P245 I254 P271 Q478 F480	A243-A247 WeakPolarHBondContact O-CB 3.31Å; A243-A247 PolarHBondContact O-N 3.07Å; L244-A247 PolarHBondContact O-N 2.89Å; P245-A247 VanDerWaalsContact C-N 3.32Å; P245-A247 PolarHBondContact O-N 3.28Å; A247-I254 HydrophobicContact CB-CD1 4.18Å; A247-I254 HydrophobicContact CB-CG1 4.05Å; A247-P271 HydrophobicContact CB-CB 3.94Å; A247-P271 HydrophobicContact CB-CG 3.64Å; A247-Q478 VanDerWaalsContact CA-NE2 3.33Å; A247-Q478 PolarHBondContact O-NE2 3.49Å; A247-F480 HydrophobicContact CB-CE1 3.72Å; A247-F480 HydrophobicContact CB-CZ 3.88Å
248	I	90	Very high	87.9	Confident	8 Å²	8	32.8 Å²	32.8	4%	0.041	17%	0.166	C	C	.	.	H	α-helix	trans	-86.9	-65	-176.6	-68	174.1	0	0	0	110.3	F219 L244 P245 R251 I270 P271 H274	F219-I248 HydrophobicContact CB-CB 4.18Å; F219-I248 HydrophobicContact CB-CD1 4.35Å; F219-I248 HydrophobicContact CB-CG2 3.41Å; F219-I248 VanDerWaalsContact CB-CG2 3.41Å; F219-I248 HydrophobicContact CG-CG2 4.24Å; L244-I248 HydrophobicContact CB-CD1 4.31Å; L244-I248 HydrophobicContact CD2-CD1 4.23Å; L244-I248 VanDerWaalsContact O-CB 3.26Å; L244-I248 WeakPolarHBondContact O-CB 3.41Å; L244-I248 WeakPolarHBondContact O-CG1 3.33Å; L244-I248 PolarHBondContact O-N 3.39Å; P245-I248 PolarHBondContact O-N 2.9Å; I248-R251 PolarHBondContact O-NE 3.36Å; I248-R251 PolarHBondContact O-NH1 3.39Å; I248-I270 HydrophobicContact CD1-CG2 4.3Å; I248-P271 HydrophobicContact CD1-CG 4.46Å; I248-P271 HydrophobicContact CG1-CB 4.14Å; I248-P271 HydrophobicContact CG1-CG 4.07Å; I248-H274 VanDerWaalsContact CG2-CD2 3.44Å; I248-H274 WeakPolarHBondContact CG2-CD2 3.45Å; I248-H274 WeakPolarHBondContact CG2-NE2 3.31Å
249	R	87.9	Confident	87.2	Confident	152 Å²	152	30.9 Å²	30.9	57%	0.574	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-45.3	-172.9	-172.7	-165.7	67.4	-158.9	-8.2	112.3	F219 P245	F219-R249 HydrophobicContact CD2-CB 4.5Å; F219-R249 HydrophobicContact CE2-CB 4.38Å; F219-R249 HydrophobicContact CZ-CG 4.47Å; P245-R249 WeakPolarHBondContact O-CB 3.41Å; P245-R249 PolarHBondContact O-N 3.37Å
250	D	85.6	Confident	86.3	Confident	73 Å²	73	32.1 Å²	32.1	39%	0.39	16%	0.157	S	C	.	.	S	Bend	trans	-94.4	-1.2	-172.2	-50.4	-33.3	0	0	0	113	P246 M252	P246-D250 CarbonylContact O-C 3.57Å; D250-M252 HydrophobicContact CB-CG 3.83Å; D250-M252 HydrophobicContact CB-SD 4.36Å; D250-M252 WeakPolarHBondContact O-CG 3.45Å; D250-M252 PolarHBondContact O-N 3.02Å
251	R	86.6	Confident	85.3	Confident	80 Å²	80	34 Å²	34	30%	0.302	18%	0.178	S	C	.	.			trans	47.8	25.6	-179.6	-66.4	-70.5	178.1	-140.1	0.9	115.4	P246 I248 H274 T275 E278	P246-R251 PolarHBondContact O-N 3.16Å; I248-R251 PolarHBondContact O-NE 3.36Å; I248-R251 PolarHBondContact O-NH1 3.39Å; R251-H274 PolarHBondContact NH2-CD2 3.41Å; R251-H274 PolarHBondContact NH2-NE2 3.33Å; R251-T275 PolarHBondContact NH1-OG1 3.4Å; R251-E278 IonicContact CZ-OE2 3.44Å; R251-E278 IonicContact NH2-OE1 2.87Å; R251-E278 PolarHBondContact NH2-OE1 2.84Å; R251-E278 IonicContact NH2-OE2 2.7Å; R251-E278 PolarHBondContact NH2-OE2 2.76Å
252	M	87	Confident	84.6	Confident	65 Å²	65	32.7 Å²	32.7	32%	0.32	17%	0.171	S	C	.	.			trans	-73.8	150.3	-173.6	-62.3	-169.5	76.9	0	0	113.2	P246 D250 I254 Q478 K524	P246-M252 HydrophobicContact CB-SD 4.34Å; P246-M252 PolarHBondContact O-N 3.47Å; D250-M252 HydrophobicContact CB-CG 3.83Å; D250-M252 HydrophobicContact CB-SD 4.36Å; D250-M252 WeakPolarHBondContact O-CG 3.45Å; D250-M252 PolarHBondContact O-N 3.02Å; M252-I254 HydrophobicContact CB-CD1 4.38Å; M252-Q478 PolarHBondContact O-NE2 2.95Å; M252-K524 HydrophobicContact CB-CB 4.47Å; M252-K524 HydrophobicContact CE-CB 4.37Å; M252-K524 HydrophobicContact SD-CB 4.25Å
253	D	89.3	Confident	84.3	Confident	19 Å²	19	29.7 Å²	29.7	10%	0.102	16%	0.16	C	C	.	.			trans	-62.4	137.6	161.3	-65.2	-53.5	0	0	0	110.2	T479 I519 S521 P523 K524	D253-T479 CarbonylContact C-O 3.45Å; D253-T479 VanDerWaalsContact CA-O 3.31Å; D253-T479 WeakPolarHBondContact CA-O 3.33Å; D253-T479 WeakPolarHBondContact OD1-CA 3.13Å; D253-T479 WeakPolarHBondContact OD1-CB 3.29Å; D253-T479 PolarHBondContact OD1-N 3.01Å; D253-T479 PolarHBondContact OD1-OG1 3.32Å; D253-I519 HydrophobicContact CB-CG2 4.21Å; D253-S521 PolarHBondContact OD2-OG 3.1Å; D253-P523 HydrophobicContact CB-CB 3.95Å; D253-P523 CarbonylContact O-C 3.58Å; D253-P523 WeakPolarHBondContact O-CA 3.32Å; D253-K524 PolarHBondContact O-N 3.16Å
254	I	89.3	Confident	84.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.8	-175.6	-51	-58.7	0	0	0	110.8	P246 A247 M252 T479 F480 V481 F482 K524 L526	P246-I254 HydrophobicContact CB-CD1 4.33Å; P246-I254 HydrophobicContact CG-CD1 4.17Å; A247-I254 HydrophobicContact CB-CD1 4.18Å; A247-I254 HydrophobicContact CB-CG1 4.05Å; M252-I254 HydrophobicContact CB-CD1 4.38Å; I254-T479 PolarHBondContact N-O 2.81Å; I254-F480 HydrophobicContact CB-CD1 3.78Å; I254-F480 HydrophobicContact CB-CE1 4.18Å; I254-F480 HydrophobicContact CG1-CD1 3.76Å; I254-F480 HydrophobicContact CG1-CE1 3.61Å; I254-F480 HydrophobicContact CG1-CZ 4.47Å; I254-F480 WeakPolarHBondContact O-CA 3.42Å; I254-V481 PolarHBondContact O-N 3.19Å; I254-F482 HydrophobicContact CG2-CZ 4.37Å; I254-K524 HydrophobicContact CD1-CB 3.85Å; I254-K524 HydrophobicContact CD1-CG 4.39Å; I254-L526 HydrophobicContact CG2-CD1 3.79Å; I254-L526 HydrophobicContact CG2-CG 4.4Å
255	L	87.9	Confident	84.1	Confident	8 Å²	8	30.9 Å²	30.9	4%	0.042	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	100.4	168.8	177	63.4	0	0	0	109.4	V481 L510 K524 V525 L526	L255-V481 CarbonylContact C-O 3.57Å; L255-V481 WeakPolarHBondContact CA-O 3.2Å; L255-V481 HydrophobicContact CD1-CB 3.68Å; L255-V481 HydrophobicContact CD1-CG1 3.54Å; L255-L510 HydrophobicContact CD2-CD1 3.59Å; L255-L510 HydrophobicContact CD2-CD2 4.1Å; L255-L510 HydrophobicContact CD2-CG 3.69Å; L255-K524 PolarHBondContact N-O 3.32Å; L255-V525 HydrophobicContact CB-CG2 4.48Å; L255-V525 HydrophobicContact CD2-CG1 4.39Å; L255-V525 HydrophobicContact CD2-CG2 4.23Å; L255-V525 WeakPolarHBondContact O-CA 3.46Å; L255-L526 PolarHBondContact O-N 2.73Å
256	G	85.6	Confident	84	Confident	1 Å²	1	30 Å²	30	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	113.1	-176.7	0	0	0	0	0	113.7	V481 F482 S483	G256-V481 PolarHBondContact N-O 2.93Å; G256-F482 WeakPolarHBondContact O-CA 3.4Å; G256-F482 WeakPolarHBondContact O-CD1 3.48Å; G256-S483 PolarHBondContact O-N 3.37Å; G256-S483 VanDerWaalsContact O-N 3.14Å
257	A	83.8	Confident	84.1	Confident	3 Å²	3	29.4 Å²	29.4	3%	0.025	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	101.8	169.4	0	0	0	0	0	109.8	S483 M487 L526 L528 T529	A257-S483 CarbonylContact C-O 3.54Å; A257-S483 WeakPolarHBondContact CA-O 3.44Å; A257-M487 HydrophobicContact CB-CB 4.34Å; A257-M487 HydrophobicContact CB-CG 3.96Å; A257-M487 HydrophobicContact CB-SD 3.59Å; A257-M487 VanDerWaalsContact CB-SD 3.59Å; A257-L526 PolarHBondContact N-O 3.43Å; A257-L528 PolarHBondContact O-N 2.86Å; A257-T529 HydrophobicContact CB-CG2 4.03Å
258	A	77.8	Confident	84.3	Confident	2 Å²	2	29.4 Å²	29.4	2%	0.017	16%	0.157	C	C	.	.			trans	-154.7	147.4	-178.8	0	0	0	0	0	112.6	I239 K264 S483 L528	I239-A258 HydrophobicContact CD1-CB 4.31Å; I239-A258 HydrophobicContact CG1-CB 4.28Å; A258-K264 HydrophobicContact CB-CD 4.25Å; A258-K264 HydrophobicContact CB-CG 4.32Å; A258-K264 PolarHBondContact O-NZ 2.9Å; A258-S483 PolarHBondContact N-O 2.72Å; A258-S483 VanDerWaalsContact O-O 3.1Å; A258-L528 HydrophobicContact CB-CB 4.45Å
259	E	72	Confident	84.4	Confident	49 Å²	49	29.1 Å²	29.1	23%	0.229	16%	0.156	C	C	.	.			trans	-66.3	171	-177.1	-63.3	-170.3	-149.5	0	0	114	S262 K264 V535	E259-S262 WeakPolarHBondContact O-CB 3.2Å; E259-S262 PolarHBondContact O-OG 2.96Å; E259-K264 PolarHBondContact O-NZ 3.36Å; E259-V535 WeakPolarHBondContact OE2-CG2 3.26Å
260	T	68.6	Low	84.7	Confident	27 Å²	27	21.9 Å²	21.9	17%	0.166	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	140.8	171.8	-40.4	0	0	0	0	110.3	S262 R652	T260-S262 VanDerWaalsContact C-N 3.29Å; T260-S262 PolarHBondContact O-N 3.12Å; T260-R652 PolarHBondContact OG1-NH2 2.9Å
261	G	68.6	Low	85	Confident	45 Å²	45	18.4 Å²	18.4	46%	0.464	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	-1.6	-177	0	0	0	0	0	114.7	G263	G261-G263 PolarHBondContact O-N 3.5Å
262	S	74.6	Confident	85.4	Confident	33 Å²	33	14.6 Å²	14.6	23%	0.231	10%	0.096	C	C	.	.	S	Bend	trans	-72.7	-3.3	175.9	59.2	0	0	0	0	115	T237 I239 E259 T260 K264	T237-S262 WeakPolarHBondContact CB-O 3.34Å; T237-S262 PolarHBondContact OG1-O 2.91Å; I239-S262 WeakPolarHBondContact CG2-O 3.11Å; E259-S262 WeakPolarHBondContact O-CB 3.2Å; E259-S262 PolarHBondContact O-OG 2.96Å; T260-S262 VanDerWaalsContact C-N 3.29Å; T260-S262 PolarHBondContact O-N 3.12Å; S262-K264 WeakPolarHBondContact OG-CG 3.37Å
263	G	81.9	Confident	85.6	Confident	21 Å²	21	11.6 Å²	11.6	22%	0.216	8%	0.081	C	C	.	.	S	Bend	trans	96.3	5.5	-178.7	0	0	0	0	0	116	Q240 G261 T265 L266	Q240-G263 PolarHBondContact NE2-O 2.84Å; G261-G263 PolarHBondContact O-N 3.5Å; G263-T265 VanDerWaalsContact C-N 3.25Å; G263-T265 PolarHBondContact O-N 3.19Å; G263-L266 PolarHBondContact O-N 3.41Å; G263-L266 VanDerWaalsContact O-N 3.1Å
264	K	87.7	Confident	85.8	Confident	10 Å²	10	11.9 Å²	11.9	4%	0.043	8%	0.082	C	C	.	.	H	α-helix	trans	-42.2	-44.9	-177.1	-61.1	-154.8	-72.4	-93.2	0	115.1	A258 E259 S262 L266 A267 F268 D447 F482	A258-K264 HydrophobicContact CB-CD 4.25Å; A258-K264 HydrophobicContact CB-CG 4.32Å; A258-K264 PolarHBondContact O-NZ 2.9Å; E259-K264 PolarHBondContact O-NZ 3.36Å; S262-K264 WeakPolarHBondContact OG-CG 3.37Å; K264-L266 PolarHBondContact O-N 3.02Å; K264-A267 WeakPolarHBondContact O-CA 3.34Å; K264-A267 VanDerWaalsContact O-CB 3.31Å; K264-A267 WeakPolarHBondContact O-CB 3.42Å; K264-A267 PolarHBondContact O-N 2.92Å; K264-F268 VanDerWaalsContact O-CD1 3.24Å; K264-F268 WeakPolarHBondContact O-CD1 3.18Å; K264-F268 PolarHBondContact O-N 3.04Å; K264-D447 WeakPolarHBondContact CE-OD1 3.36Å; K264-F482 HydrophobicContact CB-CD1 4.35Å; K264-F482 HydrophobicContact CD-CB 3.93Å; K264-F482 HydrophobicContact CD-CD1 3.55Å; K264-F482 HydrophobicContact CD-CE1 4.38Å; K264-F482 HydrophobicContact CD-CG 4.03Å; K264-F482 HydrophobicContact CG-CD1 4.15Å
265	T	90.3	Very high	85.8	Confident	16 Å²	16	12.4 Å²	12.4	10%	0.098	9%	0.085	C	C	.	.	H	α-helix	trans	-58.8	-32.6	-174.6	-45.9	0	0	0	0	113.7	G263 F268 G269 V379 H382	G263-T265 VanDerWaalsContact C-N 3.25Å; G263-T265 PolarHBondContact O-N 3.19Å; T265-F268 HydrophobicContact CG2-CE2 4.23Å; T265-F268 HydrophobicContact CG2-CZ 4.02Å; T265-G269 WeakPolarHBondContact O-CA 3.4Å; T265-G269 PolarHBondContact O-N 3.45Å; T265-V379 HydrophobicContact CG2-CB 4.25Å; T265-V379 HydrophobicContact CG2-CG1 4.07Å; T265-V379 HydrophobicContact CG2-CG2 4.04Å; T265-H382 HydrophobicContact CG2-CB 3.7Å
266	L	90.7	Very high	86	Confident	6 Å²	6	12.1 Å²	12.1	3%	0.031	8%	0.084	C	C	.	.	H	α-helix	trans	-85.1	-25	174.9	-52.3	-173.6	0	0	0	112.2	L228 F233 G263 K264 F268 G269 I270 H382 V386	L228-L266 HydrophobicContact CD2-CD1 4.04Å; F233-L266 HydrophobicContact CD2-CD1 4.43Å; F233-L266 HydrophobicContact CE2-CD1 4.22Å; F233-L266 HydrophobicContact CZ-CD1 4.46Å; G263-L266 PolarHBondContact O-N 3.41Å; G263-L266 VanDerWaalsContact O-N 3.1Å; K264-L266 PolarHBondContact O-N 3.02Å; L266-F268 VanDerWaalsContact C-N 3.28Å; L266-F268 PolarHBondContact O-N 3.29Å; L266-G269 PolarHBondContact O-N 3.47Å; L266-I270 HydrophobicContact CB-CD1 4.1Å; L266-I270 HydrophobicContact CB-CG1 4.37Å; L266-I270 WeakPolarHBondContact O-CB 3.45Å; L266-I270 WeakPolarHBondContact O-CG1 3.46Å; L266-I270 PolarHBondContact O-N 3.01Å; L266-H382 HydrophobicContact CD2-CB 4.49Å; L266-V386 HydrophobicContact CD2-CG2 3.74Å
267	A	91.4	Very high	86.2	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.1	-28.3	176.4	0	0	0	0	0	112.8	I239 Q240 A243 K264 P271 F482	I239-A267 HydrophobicContact CG1-CB 4.37Å; I239-A267 HydrophobicContact CG2-CB 4.35Å; Q240-A267 HydrophobicContact CG-CB 3.97Å; A243-A267 HydrophobicContact CB-CB 4.08Å; K264-A267 WeakPolarHBondContact O-CA 3.34Å; K264-A267 VanDerWaalsContact O-CB 3.31Å; K264-A267 WeakPolarHBondContact O-CB 3.42Å; K264-A267 PolarHBondContact O-N 2.92Å; A267-P271 WeakPolarHBondContact O-CD 3.45Å; A267-P271 WeakPolarHBondContact O-CG 3.22Å; A267-F482 HydrophobicContact CB-CZ 4.25Å
268	F	93	Very high	86.5	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-99.6	-30.9	166.7	61.8	-109.4	0	0	0	114	K264 T265 L266 P271 M272 V368 V379 I383 V445 D447 F480 F482	K264-F268 VanDerWaalsContact O-CD1 3.24Å; K264-F268 WeakPolarHBondContact O-CD1 3.18Å; K264-F268 PolarHBondContact O-N 3.04Å; T265-F268 HydrophobicContact CG2-CE2 4.23Å; T265-F268 HydrophobicContact CG2-CZ 4.02Å; L266-F268 VanDerWaalsContact C-N 3.28Å; L266-F268 PolarHBondContact O-N 3.29Å; F268-P271 WeakPolarHBondContact O-CD 3.27Å; F268-M272 WeakPolarHBondContact O-CB 3.36Å; F268-M272 PolarHBondContact O-N 3.34Å; F268-M272 VanDerWaalsContact O-N 3.11Å; F268-V368 HydrophobicContact CE2-CG1 4.07Å; F268-V368 HydrophobicContact CE2-CG2 4.25Å; F268-V368 HydrophobicContact CZ-CG1 4.25Å; F268-V379 HydrophobicContact CE2-CG1 4.1Å; F268-V379 HydrophobicContact CZ-CG1 4.2Å; F268-V379 HydrophobicContact CZ-CG2 4.35Å; F268-I383 HydrophobicContact CE2-CD1 4.36Å; F268-V445 HydrophobicContact CB-CG1 4.07Å; F268-V445 HydrophobicContact CB-CG2 3.97Å; F268-V445 HydrophobicContact CD1-CG1 3.69Å; F268-V445 HydrophobicContact CD2-CB 4.33Å; F268-V445 HydrophobicContact CD2-CG1 3.69Å; F268-V445 HydrophobicContact CD2-CG2 3.91Å; F268-V445 HydrophobicContact CE1-CG1 3.88Å; F268-V445 HydrophobicContact CE2-CG1 3.89Å; F268-V445 HydrophobicContact CG-CB 4.49Å; F268-V445 HydrophobicContact CG-CG1 3.58Å; F268-V445 HydrophobicContact CG-CG2 4.11Å; F268-V445 HydrophobicContact CZ-CG1 3.97Å; F268-D447 HydrophobicContact CE1-CB 4.2Å; F268-F480 HydrophobicContact CB-CB 4.26Å; F268-F480 HydrophobicContact CB-CD1 3.94Å; F268-F480 HydrophobicContact CB-CE1 4.47Å; F268-F480 HydrophobicContact CB-CG 4.05Å; F268-F482 HydrophobicContact CB-CE2 3.96Å; F268-F482 AromaticContact CD1-CD2 3.76Å; F268-F482 HydrophobicContact CD1-CD2 3.76Å; F268-F482 AromaticContact CD1-CE2 3.79Å; F268-F482 HydrophobicContact CD1-CE2 3.79Å; F268-F482 HydrophobicContact CE1-CD2 4.46Å; F268-F482 HydrophobicContact CG-CE2 4.38Å
269	G	92.8	Very high	87	Confident	2 Å²	2	20.6 Å²	20.6	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-66.7	-39	-177.8	0	0	0	0	0	113.6	T265 L266 I273	T265-G269 WeakPolarHBondContact O-CA 3.4Å; T265-G269 PolarHBondContact O-N 3.45Å; L266-G269 PolarHBondContact O-N 3.47Å; G269-I273 WeakPolarHBondContact O-CB 3.36Å; G269-I273 WeakPolarHBondContact O-CG1 3.39Å; G269-I273 PolarHBondContact O-N 2.97Å
270	I	93.7	Very high	87.6	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.8	-48.4	179.8	-64.8	172.1	0	0	0	111.5	W215 V220 V224 L228 L244 I248 L266 M272 I273 H274 V386	W215-I270 HydrophobicContact CZ3-CD1 3.87Å; V220-I270 HydrophobicContact CG1-CG2 4.04Å; V220-I270 HydrophobicContact CG2-CG2 4.32Å; V224-I270 HydrophobicContact CG1-CD1 4.13Å; V224-I270 HydrophobicContact CG1-CG1 3.91Å; V224-I270 HydrophobicContact CG1-CG2 4.17Å; L228-I270 HydrophobicContact CD1-CD1 4.19Å; L244-I270 HydrophobicContact CD1-CD1 4.38Å; L244-I270 HydrophobicContact CD2-CB 3.82Å; L244-I270 HydrophobicContact CD2-CG2 3.95Å; I248-I270 HydrophobicContact CD1-CG2 4.3Å; L266-I270 HydrophobicContact CB-CD1 4.1Å; L266-I270 HydrophobicContact CB-CG1 4.37Å; L266-I270 WeakPolarHBondContact O-CB 3.45Å; L266-I270 WeakPolarHBondContact O-CG1 3.46Å; L266-I270 PolarHBondContact O-N 3.01Å; I270-M272 VanDerWaalsContact C-N 3.34Å; I270-M272 PolarHBondContact O-N 2.97Å; I270-I273 PolarHBondContact O-N 3.43Å; I270-H274 WeakPolarHBondContact O-CB 3.3Å; I270-H274 PolarHBondContact O-N 3.09Å; I270-V386 HydrophobicContact CG1-CG1 4.44Å
271	P	93.4	Very high	88.5	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.3	-40.2	173.5	-25.4	35.7	0	0	0	112.9	L244 A247 I248 A267 F268 H274 T275 F480	L244-P271 HydrophobicContact CD2-CG 3.74Å; A247-P271 HydrophobicContact CB-CB 3.94Å; A247-P271 HydrophobicContact CB-CG 3.64Å; I248-P271 HydrophobicContact CD1-CG 4.46Å; I248-P271 HydrophobicContact CG1-CB 4.14Å; I248-P271 HydrophobicContact CG1-CG 4.07Å; A267-P271 WeakPolarHBondContact O-CD 3.45Å; A267-P271 WeakPolarHBondContact O-CG 3.22Å; F268-P271 WeakPolarHBondContact O-CD 3.27Å; P271-H274 PolarHBondContact O-N 3.46Å; P271-T275 WeakPolarHBondContact O-CB 3.48Å; P271-T275 PolarHBondContact O-N 3.38Å; P271-T275 PolarHBondContact O-OG1 3.09Å; P271-F480 HydrophobicContact CB-CE1 4.3Å; P271-F480 HydrophobicContact CB-CZ 3.72Å; P271-F480 HydrophobicContact CG-CE1 4.27Å; P271-F480 HydrophobicContact CG-CZ 4.19Å
272	M	93.6	Very high	89.1	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60	-48.6	175.8	179	179.3	-74.2	0	0	112.1	F268 I270 H274 T275 I276 V368 I416 C443 V445	F268-M272 WeakPolarHBondContact O-CB 3.36Å; F268-M272 PolarHBondContact O-N 3.34Å; F268-M272 VanDerWaalsContact O-N 3.11Å; I270-M272 VanDerWaalsContact C-N 3.34Å; I270-M272 PolarHBondContact O-N 2.97Å; M272-H274 VanDerWaalsContact C-N 3.34Å; M272-H274 PolarHBondContact O-N 2.65Å; M272-T275 PolarHBondContact O-N 2.84Å; M272-I276 HydrophobicContact CG-CD1 4.03Å; M272-I276 VanDerWaalsContact O-CG1 3.29Å; M272-I276 WeakPolarHBondContact O-CG1 3.32Å; M272-I276 PolarHBondContact O-N 2.87Å; M272-I276 VanDerWaalsContact O-N 3.16Å; M272-V368 HydrophobicContact CE-CG2 3.72Å; M272-V368 HydrophobicContact SD-CG2 4.15Å; M272-I416 HydrophobicContact CG-CD1 4.15Å; M272-I416 HydrophobicContact CG-CG1 4.45Å; M272-I416 HydrophobicContact SD-CD1 3.89Å; M272-I416 HydrophobicContact SD-CG1 4.01Å; M272-I416 HydrophobicContact SD-CG2 3.82Å; M272-C443 HydrophobicContact CE-CB 4.01Å; M272-C443 WeakPolarHBondContact CE-SG 3.43Å; M272-C443 HydrophobicContact CG-CB 4.23Å; M272-V445 HydrophobicContact CE-CG2 3.52Å
273	I	92.6	Very high	89.2	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-60	-46.2	176.6	-75.4	167.4	0	0	0	110.4	V224 G269 I270 I276 L277 I383 V386 A387 I392 I416	V224-I273 HydrophobicContact CG2-CG2 3.67Å; G269-I273 WeakPolarHBondContact O-CB 3.36Å; G269-I273 WeakPolarHBondContact O-CG1 3.39Å; G269-I273 PolarHBondContact O-N 2.97Å; I270-I273 PolarHBondContact O-N 3.43Å; I273-I276 PolarHBondContact O-N 3.2Å; I273-L277 HydrophobicContact CG2-CD1 4.05Å; I273-L277 HydrophobicContact CG2-CG 4.43Å; I273-L277 WeakPolarHBondContact O-CG 3.37Å; I273-L277 PolarHBondContact O-N 2.65Å; I273-I383 HydrophobicContact CD1-CG2 4.37Å; I273-V386 HydrophobicContact CD1-CB 4.37Å; I273-V386 HydrophobicContact CD1-CG1 3.97Å; I273-A387 HydrophobicContact CD1-CB 4.13Å; I273-I392 HydrophobicContact CB-CD1 4.37Å; I273-I392 HydrophobicContact CG1-CD1 4.37Å; I273-I392 HydrophobicContact CG2-CD1 3.92Å; I273-I416 HydrophobicContact CG1-CD1 4.45Å
274	H	92.3	Very high	88.5	Confident	26 Å²	26	26.3 Å²	26.3	12%	0.12	14%	0.139	C	C	.	.	H	α-helix	trans	-61.3	-46.6	179.9	167.6	47.1	0	0	0	113.1	P221 I248 R251 I270 P271 M272 I276 L277 E278	P221-H274 HydrophobicContact CG-CB 3.67Å; I248-H274 VanDerWaalsContact CG2-CD2 3.44Å; I248-H274 WeakPolarHBondContact CG2-CD2 3.45Å; I248-H274 WeakPolarHBondContact CG2-NE2 3.31Å; R251-H274 PolarHBondContact NH2-CD2 3.41Å; R251-H274 PolarHBondContact NH2-NE2 3.33Å; I270-H274 WeakPolarHBondContact O-CB 3.3Å; I270-H274 PolarHBondContact O-N 3.09Å; P271-H274 PolarHBondContact O-N 3.46Å; M272-H274 VanDerWaalsContact C-N 3.34Å; M272-H274 PolarHBondContact O-N 2.65Å; H274-I276 PolarHBondContact O-N 3.43Å; H274-L277 PolarHBondContact O-N 3.04Å; H274-L277 VanDerWaalsContact O-N 3.14Å; H274-E278 IonicContact CE1-OE1 2.71Å; H274-E278 PolarHBondContact CE1-OE1 3.05Å; H274-E278 IonicContact NE2-OE1 3.32Å; H274-E278 PolarHBondContact NE2-OE1 3.33Å; H274-E278 PolarHBondContact O-N 3.49Å
275	T	90.6	Very high	87.2	Confident	11 Å²	11	32.8 Å²	32.8	7%	0.067	17%	0.172	C	C	.	.	H	α-helix	trans	-64.1	-25.5	176.5	-57.6	0	0	0	0	112.9	R251 P271 M272 W279 K442	R251-T275 PolarHBondContact NH1-OG1 3.4Å; P271-T275 WeakPolarHBondContact O-CB 3.48Å; P271-T275 PolarHBondContact O-N 3.38Å; P271-T275 PolarHBondContact O-OG1 3.09Å; M272-T275 PolarHBondContact O-N 2.84Å; T275-W279 PolarHBondContact O-N 2.53Å; T275-K442 HydrophobicContact CG2-CB 4.04Å; T275-K442 HydrophobicContact CG2-CD 3.83Å
276	I	90.7	Very high	85.5	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-79.4	-37.9	173.6	-70	170.1	0	0	0	111.3	M272 I273 H274 W279 K280 L365 I392 E415 I416	M272-I276 HydrophobicContact CG-CD1 4.03Å; M272-I276 VanDerWaalsContact O-CG1 3.29Å; M272-I276 WeakPolarHBondContact O-CG1 3.32Å; M272-I276 PolarHBondContact O-N 2.87Å; M272-I276 VanDerWaalsContact O-N 3.16Å; I273-I276 PolarHBondContact O-N 3.2Å; H274-I276 PolarHBondContact O-N 3.43Å; I276-W279 PolarHBondContact O-N 2.99Å; I276-K280 WeakPolarHBondContact O-CG 3.39Å; I276-K280 PolarHBondContact O-N 2.87Å; I276-L365 HydrophobicContact CB-CD1 4.44Å; I276-L365 HydrophobicContact CD1-CB 4.05Å; I276-L365 HydrophobicContact CG1-CB 3.72Å; I276-L365 HydrophobicContact CG1-CD1 4.04Å; I276-L365 HydrophobicContact CG2-CD1 4.05Å; I276-I392 HydrophobicContact CB-CD1 4.12Å; I276-I392 HydrophobicContact CG2-CD1 3.7Å; I276-I392 HydrophobicContact CG2-CG1 3.88Å; I276-I392 HydrophobicContact CG2-CG2 4.43Å; I276-E415 HydrophobicContact CG2-CB 4.42Å; I276-I416 HydrophobicContact CD1-CD1 3.81Å; I276-I416 HydrophobicContact CD1-CG1 3.44Å; I276-I416 VanDerWaalsContact CD1-CG1 3.44Å
277	L	90.8	Very high	83.6	Confident	32 Å²	32	40.5 Å²	40.5	17%	0.168	22%	0.223	C	C	.	.	H	α-helix	trans	-62.4	-52.7	173.2	-68.2	171.6	0	0	0	110.5	P221 I273 H274 W279 K280 D281 T390 I392	P221-L277 HydrophobicContact CB-CD1 3.89Å; P221-L277 HydrophobicContact CG-CD1 4.12Å; I273-L277 HydrophobicContact CG2-CD1 4.05Å; I273-L277 HydrophobicContact CG2-CG 4.43Å; I273-L277 WeakPolarHBondContact O-CG 3.37Å; I273-L277 PolarHBondContact O-N 2.65Å; H274-L277 PolarHBondContact O-N 3.04Å; H274-L277 VanDerWaalsContact O-N 3.14Å; L277-W279 PolarHBondContact O-N 3.25Å; L277-W279 VanDerWaalsContact O-N 3.1Å; L277-K280 CarbonylContact O-C 3.6Å; L277-K280 WeakPolarHBondContact O-CA 3.46Å; L277-K280 WeakPolarHBondContact O-CB 3.46Å; L277-K280 PolarHBondContact O-N 2.72Å; L277-D281 PolarHBondContact O-N 3.33Å; L277-T390 HydrophobicContact CD1-CG2 4.25Å; L277-T390 HydrophobicContact CD2-CG2 4.06Å; L277-I392 HydrophobicContact CD2-CD1 4.27Å; L277-I392 HydrophobicContact CG-CD1 4.33Å
278	E	89.7	Confident	81.2	Confident	85 Å²	85	49.3 Å²	49.3	40%	0.397	26%	0.264	S	S	.	.	H	α-helix	trans	-54.6	-35.7	176.4	-76.6	-174.1	176.1	0	0	113.4	R251 H274 A282	R251-E278 IonicContact CZ-OE2 3.44Å; R251-E278 IonicContact NH2-OE1 2.87Å; R251-E278 PolarHBondContact NH2-OE1 2.84Å; R251-E278 IonicContact NH2-OE2 2.7Å; R251-E278 PolarHBondContact NH2-OE2 2.76Å; H274-E278 IonicContact CE1-OE1 2.71Å; H274-E278 PolarHBondContact CE1-OE1 3.05Å; H274-E278 IonicContact NE2-OE1 3.32Å; H274-E278 PolarHBondContact NE2-OE1 3.33Å; H274-E278 PolarHBondContact O-N 3.49Å; E278-A282 WeakPolarHBondContact O-CB 3.33Å; E278-A282 PolarHBondContact O-N 3.29Å
279	W	87.9	Confident	78.9	Confident	67 Å²	67	55 Å²	55	25%	0.254	30%	0.301	S	S	.	.	H	α-helix	trans	-71	-36.7	176.1	-178.8	80	0	0	0	112.4	T275 I276 L277 S283 P363 L365	T275-W279 PolarHBondContact O-N 2.53Å; I276-W279 PolarHBondContact O-N 2.99Å; L277-W279 PolarHBondContact O-N 3.25Å; L277-W279 VanDerWaalsContact O-N 3.1Å; W279-S283 WeakPolarHBondContact O-CB 3.48Å; W279-S283 PolarHBondContact O-N 2.77Å; W279-S283 PolarHBondContact O-OG 2.98Å; W279-P363 HydrophobicContact CH2-CG 3.57Å; W279-P363 HydrophobicContact CZ2-CG 3.71Å; W279-P363 HydrophobicContact CZ3-CG 4.17Å; W279-L365 HydrophobicContact CD2-CD1 3.82Å; W279-L365 HydrophobicContact CD2-CD2 4.13Å; W279-L365 HydrophobicContact CE3-CD1 3.47Å; W279-L365 VanDerWaalsContact CE3-CD1 3.47Å; W279-L365 HydrophobicContact CG-CD1 4.28Å; W279-L365 HydrophobicContact CG-CD2 4.28Å; W279-L365 HydrophobicContact CZ3-CD1 4.03Å
280	K	85.9	Confident	76	Confident	34 Å²	34	59.1 Å²	59.1	15%	0.148	34%	0.343	C	S	.	.	H	α-helix	trans	-64.5	-53.5	172.2	-73	-172.9	177.6	-168	0	110.5	I276 L277 A282 S283 E284 D391 E415	I276-K280 WeakPolarHBondContact O-CG 3.39Å; I276-K280 PolarHBondContact O-N 2.87Å; L277-K280 CarbonylContact O-C 3.6Å; L277-K280 WeakPolarHBondContact O-CA 3.46Å; L277-K280 WeakPolarHBondContact O-CB 3.46Å; L277-K280 PolarHBondContact O-N 2.72Å; K280-A282 VanDerWaalsContact C-N 3.31Å; K280-A282 PolarHBondContact O-N 3.01Å; K280-S283 WeakPolarHBondContact CA-OG 3.33Å; K280-S283 PolarHBondContact O-N 3.04Å; K280-S283 PolarHBondContact O-OG 3.29Å; K280-E284 PolarHBondContact O-N 2.92Å; K280-D391 PolarHBondContact NZ-O 2.89Å; K280-E415 VanDerWaalsContact CE-OE1 3.3Å; K280-E415 WeakPolarHBondContact CE-OE1 3.26Å; K280-E415 IonicContact NZ-OE1 3.71Å; K280-E415 PolarHBondContact NZ-OE1 3.16Å
281	D	85.9	Confident	73.3	Confident	86 Å²	86	66.2 Å²	66.2	46%	0.46	38%	0.381	S	S	.	.	H	α-helix	trans	-52.4	-48.9	178	-51.6	-23	0	0	0	111	L277 S283 E284 I285	L277-D281 PolarHBondContact O-N 3.33Å; D281-S283 PolarHBondContact O-N 2.68Å; D281-E284 PolarHBondContact O-N 2.61Å; D281-I285 WeakPolarHBondContact O-CD1 3.44Å; D281-I285 VanDerWaalsContact O-CG1 3.25Å; D281-I285 WeakPolarHBondContact O-CG1 3.37Å; D281-I285 PolarHBondContact O-N 2.99Å
282	A	82.9	Confident	70.3	Confident	56 Å²	56	72.9 Å²	72.9	46%	0.463	42%	0.422	S	S	.	.	H	α-helix	trans	-66.6	-29.7	177.5	0	0	0	0	0	114.2	E278 K280 T286	E278-A282 WeakPolarHBondContact O-CB 3.33Å; E278-A282 PolarHBondContact O-N 3.29Å; K280-A282 VanDerWaalsContact C-N 3.31Å; K280-A282 PolarHBondContact O-N 3.01Å; A282-T286 PolarHBondContact O-OG1 2.78Å
283	S	75.5	Confident	67.3	Low	32 Å²	32	80 Å²	80	22%	0.224	46%	0.46	C	S	.	.	H	α-helix	trans	-80.1	-33.5	177.1	57.6	0	0	0	0	113	W279 K280 D281 T286 S287	W279-S283 WeakPolarHBondContact O-CB 3.48Å; W279-S283 PolarHBondContact O-N 2.77Å; W279-S283 PolarHBondContact O-OG 2.98Å; K280-S283 WeakPolarHBondContact CA-OG 3.33Å; K280-S283 PolarHBondContact O-N 3.04Å; K280-S283 PolarHBondContact O-OG 3.29Å; D281-S283 PolarHBondContact O-N 2.68Å; S283-T286 WeakPolarHBondContact CA-OG1 3.32Å; S283-T286 CarbonylContact O-C 3.55Å; S283-T286 PolarHBondContact O-N 3.22Å; S283-T286 PolarHBondContact O-OG1 3.14Å; S283-S287 PolarHBondContact O-N 2.98Å; S283-S287 PolarHBondContact O-OG 2.93Å
284	E	66.6	Low	64.2	Low	87 Å²	87	88.6 Å²	88.6	41%	0.407	50%	0.5	S	S	.	.	H	α-helix	trans	-70.5	-36.4	174.5	-67.7	-172.2	143.8	0	0	111	K280 D281 T286 S287 R360	K280-E284 PolarHBondContact O-N 2.92Å; D281-E284 PolarHBondContact O-N 2.61Å; E284-T286 PolarHBondContact O-N 3.4Å; E284-S287 PolarHBondContact O-N 3.36Å; E284-R360 IonicContact OE1-CZ 2.81Å; E284-R360 IonicContact OE1-NH1 2.73Å; E284-R360 PolarHBondContact OE1-NH1 3.44Å; E284-R360 IonicContact OE1-NH2 3.1Å; E284-R360 PolarHBondContact OE1-NH2 3.07Å
285	I	60.5	Low	61	Low	145 Å²	145	92.3 Å²	92.3	74%	0.744	53%	0.529	S	S	*	.	H	α-helix	trans	-59.7	-27.3	169.4	-69.2	164.5	0	0	0	112.2	D281	D281-I285 WeakPolarHBondContact O-CD1 3.44Å; D281-I285 VanDerWaalsContact O-CG1 3.25Å; D281-I285 WeakPolarHBondContact O-CG1 3.37Å; D281-I285 PolarHBondContact O-N 2.99Å
286	T	55.8	Low	57.9	Low	116 Å²	116	101.7 Å²	101.7	71%	0.712	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	8.8	174.6	56.6	0	0	0	0	114.5	A282 S283 E284	A282-T286 PolarHBondContact O-OG1 2.78Å; S283-T286 WeakPolarHBondContact CA-OG1 3.32Å; S283-T286 CarbonylContact O-C 3.55Å; S283-T286 PolarHBondContact O-N 3.22Å; S283-T286 PolarHBondContact O-OG1 3.14Å; E284-T286 PolarHBondContact O-N 3.4Å
287	S	50	Low	54.7	Low	69 Å²	69	107.9 Å²	107.9	48%	0.483	61%	0.607	S	S	.	*	S	Bend	trans	-147.8	68	-175.2	53.9	0	0	0	0	115.3	S283 E284	S283-S287 PolarHBondContact O-N 2.98Å; S283-S287 PolarHBondContact O-OG 2.93Å; E284-S287 PolarHBondContact O-N 3.36Å
288	E	40.5	Very low	51.5	Low	185 Å²	185	117.9 Å²	117.9	86%	0.864	64%	0.642	S	S	*	*	S	Bend	trans	155.6	155.6	143.2	-89.7	172.8	-136.1	0	0	111.5
289	P	44.3	Very low	48.4	Very low	120 Å²	120	121.6 Å²	121.6	78%	0.779	66%	0.66	S	S	*	*			cis	-124.5	134.5	-39.3	34.6	-20.2	0	0	0	111.1
290	G	32	Very low	45.4	Very low	87 Å²	87	125.4 Å²	125.4	90%	0.897	68%	0.68	S	S	*	*			trans	-124.5	57.4	-175.5	0	0	0	0	0	112.9
291	D	38.7	Very low	42.4	Very low	150 Å²	150	133.1 Å²	133.1	80%	0.802	72%	0.717	S	S	*	*			trans	-141.6	81.1	175.1	-165.7	6.6	0	0	0	111.2
292	T	30.4	Very low	39.4	Very low	139 Å²	139	134.9 Å²	134.9	85%	0.853	73%	0.73	S	S	*	*	S	Bend	trans	-140.9	89.5	157.6	50.8	0	0	0	0	108.3
293	D	30.8	Very low	36.6	Very low	151 Å²	151	140.5 Å²	140.5	81%	0.807	75%	0.745	S	S	*	*			trans	42.5	90.6	145.3	-164	18.6	0	0	0	117.8
294	E	26.7	Very low	34.2	Very low	181 Å²	181	146.8 Å²	146.8	85%	0.846	78%	0.776	S	S	*	*			trans	-155.3	153.2	135.6	-130.1	177.8	-153.3	0	0	112.2
295	S	25.2	Very low	32.5	Very low	103 Å²	103	146.5 Å²	146.5	72%	0.72	80%	0.796	S	S	*	*			trans	63.2	79.5	173.1	67.9	0	0	0	0	117.9	T297	S295-T297 PolarHBondContact O-N 2.82Å
296	K	25.8	Very low	30.7	Very low	208 Å²	208	147.3 Å²	147.3	90%	0.904	80%	0.799	S	S	*	*			trans	-53.7	105.3	133.4	-75.1	179.8	178.4	178.3	0	108.7
297	T	23.1	Very low	29.3	Very low	133 Å²	133	149.4 Å²	149.4	82%	0.816	80%	0.8	S	S	*	*			trans	-177.9	144	140	15.7	0	0	0	0	113.3	S295	S295-T297 PolarHBondContact O-N 2.82Å
298	R	23.6	Very low	28.2	Very low	241 Å²	241	150.8 Å²	150.8	91%	0.909	82%	0.816	S	S	*	*			trans	76.8	54.6	151.8	-146.6	177.4	-157.1	162.2	6.1	118.9
299	E	23.8	Very low	27.5	Very low	163 Å²	163	147 Å²	147	76%	0.762	81%	0.81	S	S	*	*	S	Bend	trans	-66.1	158.6	130.3	-84.5	-154.6	133.5	0	0	110.7
300	Q	24.6	Very low	26.7	Very low	147 Å²	147	146.6 Å²	146.6	69%	0.687	81%	0.805	S	S	*	*			trans	9.7	121.7	172.2	-79.8	72.8	-57.9	0	0	118.9
301	Q	23.2	Very low	26.4	Very low	196 Å²	196	150.4 Å²	150.4	92%	0.916	80%	0.8	S	S	*	*			trans	-147.3	71.3	134.8	-129.9	-171.2	27.1	0	0	113.9
302	V	23.8	Very low	25.7	Very low	123 Å²	123	150.3 Å²	150.3	75%	0.745	80%	0.799	S	S	*	*	S	Bend	trans	-154.1	118	151.7	176.4	0	0	0	0	105.4
303	K	23.2	Very low	25.4	Very low	175 Å²	175	152.8 Å²	152.8	76%	0.761	80%	0.801	S	S	*	*			cis	-154.5	150.6	-11	-94	170	-179.6	-177.8	0	106.6
304	D	25.3	Very low	25.2	Very low	163 Å²	163	154.2 Å²	154.2	87%	0.872	80%	0.803	S	S	*	*				173.3	140.3	113.4	-89	-19.9	0	0	0	110.1
305	G	31	Very low	25.1	Very low	82 Å²	82	154.1 Å²	154.1	85%	0.845	81%	0.805	S	S	*	*			trans	120.6	122.8	-171.1	0	0	0	0	0	112.2
306	M	23.5	Very low	25.1	Very low	161 Å²	161	157.7 Å²	157.7	79%	0.793	81%	0.81	S	S	*	*			trans	-104.8	117.8	-179.9	-175.8	81.7	177.5	0	0	109.4
307	E	25	Very low	25.1	Very low	160 Å²	160	153.8 Å²	153.8	75%	0.748	80%	0.803	S	S	*	*			trans	52.7	117.3	157.9	-61.8	-178.4	152.4	0	0	121.4
308	A	27.6	Very low	25.2	Very low	98 Å²	98	154 Å²	154	81%	0.81	80%	0.799	S	S	*	*			trans	67.1	162.6	138.6	0	0	0	0	0	120.6
309	S	25.1	Very low	25.6	Very low	106 Å²	106	150.6 Å²	150.6	74%	0.741	79%	0.794	S	S	*	*			cis	177.8	158.2	-33.2	65.2	0	0	0	0	107.7
310	V	28.3	Very low	25.6	Very low	112 Å²	112	149.4 Å²	149.4	68%	0.679	80%	0.798	S	S	*	*			cis	-143.8	-166.2	5.3	-145.5	0	0	0	0	107.9
311	E	25.2	Very low	25.7	Very low	167 Å²	167	150.8 Å²	150.8	78%	0.78	81%	0.809	S	S	*	*			trans	68.9	115.6	160	-69	151.1	-135.6	0	0	116.4
312	D	23.9	Very low	25.8	Very low	147 Å²	147	145 Å²	145	79%	0.786	80%	0.802	S	S	*	*			cis	84.4	115.5	38.1	-60.7	-46.3	0	0	0	115
313	E	25.7	Very low	25.9	Very low	191 Å²	191	144.4 Å²	144.4	89%	0.893	80%	0.804	S	S	*	*			trans	-160.2	149.7	135.8	-83.9	-142.3	141.3	0	0	109.7
314	E	26.2	Very low	26	Very low	181 Å²	181	142.9 Å²	142.9	85%	0.846	80%	0.804	S	S	*	*			trans	-108.3	159.7	-179.5	-56.5	178.9	132.8	0	0	111.5
315	M	23.9	Very low	26.2	Very low	180 Å²	180	144.9 Å²	144.9	89%	0.887	81%	0.808	S	S	*	*			trans	-166	161.6	142.5	-115.3	169.2	-75.7	0	0	114.4
316	E	25.6	Very low	25.9	Very low	177 Å²	177	147.1 Å²	147.1	83%	0.827	80%	0.8	S	S	*	*			trans	-106.8	-176.9	-171.8	-57.8	-173.6	123.6	0	0	114.1
317	V	26.4	Very low	26.1	Very low	127 Å²	127	147.9 Å²	147.9	77%	0.77	80%	0.802	S	S	*	*			trans	69.4	148.4	162.2	-131	0	0	0	0	113.7
318	D	23.3	Very low	26.1	Very low	136 Å²	136	147.6 Å²	147.6	73%	0.727	80%	0.801	S	S	*	*			cis	-157.2	176.4	29.6	-165.2	12.3	0	0	0	114
319	Q	33.1	Very low	26	Very low	171 Å²	171	150.2 Å²	150.2	80%	0.799	80%	0.801	S	S	*	*			trans	-89.1	135.9	164.8	-54.9	173.5	8.8	0	0	110.4
320	T	23.4	Very low	26	Very low	138 Å²	138	149.4 Å²	149.4	85%	0.847	80%	0.796	S	S	*	*			trans	-158.8	168.2	148.2	-3.1	0	0	0	0	114.8
321	L	27.3	Very low	26.1	Very low	175 Å²	175	153.5 Å²	153.5	92%	0.916	81%	0.807	S	S	*	*			trans	-89.1	163.2	-167.3	-64	158.7	0	0	0	113.7
322	G	25.6	Very low	26.2	Very low	75 Å²	75	149.3 Å²	149.3	77%	0.773	81%	0.809	S	S	*	*			trans	117.3	145.4	160.1	0	0	0	0	0	114.5
323	S	25.8	Very low	26.5	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	81%	0.809	S	S	*	*			cis	-158.8	159.1	-12.5	54.4	0	0	0	0	111.3
324	D	25.2	Very low	26.5	Very low	143 Å²	143	149.1 Å²	149.1	77%	0.765	81%	0.809	S	S	*	*			trans	-36.9	140.6	172.3	-30.2	-47.7	0	0	0	116.4
325	E	28.6	Very low	26.5	Very low	205 Å²	205	147.7 Å²	147.7	96%	0.958	80%	0.802	S	S	*	*				-137.3	138.6	127.1	-76.1	-161.5	151.4	0	0	107.5
326	D	25.5	Very low	26.8	Very low	129 Å²	129	146.6 Å²	146.6	69%	0.69	80%	0.8	S	S	*	*			trans	-128.8	-168.3	-163.1	-142.4	-39.5	0	0	0	111.1
327	E	26.9	Very low	26.9	Very low	176 Å²	176	147.3 Å²	147.3	82%	0.822	80%	0.803	S	S	*	*			trans	86.8	111.9	178.4	-51.8	-172.5	166.3	0	0	114.5
328	Q	26.3	Very low	27	Very low	154 Å²	154	150 Å²	150	72%	0.72	81%	0.807	S	S	*	*				70.8	140.5	51	-53.1	176.2	41.4	0	0	111
329	D	24.3	Very low	27.2	Very low	154 Å²	154	151.3 Å²	151.3	82%	0.824	81%	0.813	S	S	*	*			cis	-102.8	153.2	36.4	-71.5	-52.4	0	0	0	116.5
330	S	25.6	Very low	27.2	Very low	89 Å²	89	147 Å²	147	62%	0.622	82%	0.815	S	S	*	*			cis	79.7	86.1	41.9	-160.9	0	0	0	0	112.6
331	E	30.9	Very low	27.3	Very low	197 Å²	197	146.3 Å²	146.3	92%	0.921	81%	0.814	S	S	*	*				87.4	152.2	87.8	-84.1	-160.7	-175.6	0	0	115.3
332	G	25.9	Very low	27.2	Very low	80 Å²	80	144.2 Å²	144.2	83%	0.825	81%	0.808	S	S	*	*			trans	158.8	86	-175.2	0	0	0	0	0	113.3
333	E	31.6	Very low	27.1	Very low	166 Å²	166	152 Å²	152	78%	0.776	82%	0.815	S	S	*	*			trans	-74.6	158.5	173.4	-55.1	-170.3	130	0	0	112.6
334	D	24.4	Very low	27.1	Very low	167 Å²	167	152.1 Å²	152.1	89%	0.893	81%	0.81	S	S	*	*			trans	-156.8	161.4	135.4	-131.5	-29.5	0	0	0	112.3
335	Q	27.4	Very low	27.3	Very low	152 Å²	152	151.8 Å²	151.8	71%	0.71	81%	0.807	S	S	*	*			trans	-110.7	156.2	-153.1	-60.9	177.2	5	0	0	116.8
336	D	30.4	Very low	27.4	Very low	157 Å²	157	148.8 Å²	148.8	84%	0.84	80%	0.798	S	S	*	*			trans	20.3	127.4	157.2	-83.1	-14.1	0	0	0	121.4
337	E	28	Very low	27.7	Very low	191 Å²	191	146.8 Å²	146.8	89%	0.893	79%	0.787	S	S	*	*				-142.9	139.9	129.3	-137.6	-174	-141.5	0	0	113.4
338	Q	28.4	Very low	28	Very low	184 Å²	184	141.9 Å²	141.9	86%	0.86	77%	0.769	S	S	*	*			trans	-110.2	105.6	-164.1	-177.3	-179.4	77	0	0	113.1
339	L	27.7	Very low	28.2	Very low	163 Å²	163	140 Å²	140	85%	0.853	76%	0.76	S	S	*	*			trans	-118.3	108	170.1	-74.3	173.7	0	0	0	112.1
340	G	31.4	Very low	29	Very low	80 Å²	80	138 Å²	138	83%	0.825	74%	0.744	S	S	*	*			trans	-81.4	126.9	-171.3	0	0	0	0	0	114.9
341	C	26.6	Very low	29.2	Very low	124 Å²	124	139.7 Å²	139.7	84%	0.838	75%	0.746	S	S	*	*			trans	-122.1	117	174.6	-100.5	0	0	0	0	112.9
342	V	23.9	Very low	29.4	Very low	131 Å²	131	137.5 Å²	137.5	79%	0.794	73%	0.734	S	S	*	*			trans	35.4	111.1	154.6	-169.6	0	0	0	0	117.9	V344	V342-V344 PolarHBondContact O-N 3.35Å
343	R	24.4	Very low	29.7	Very low	239 Å²	239	140.6 Å²	140.6	90%	0.902	73%	0.725	S	S	*	*			trans	-46.3	111	171.3	-68.3	-179	179.3	176.2	-1.1	112.6
344	V	26.2	Very low	29.9	Very low	114 Å²	114	140.6 Å²	140.6	69%	0.691	73%	0.725	S	S	*	*			trans	-67.3	129.1	164.6	-180	0	0	0	0	108.1	V342 D346	V342-V344 PolarHBondContact O-N 3.35Å; V344-D346 PolarHBondContact O-N 3.11Å
345	I	29.6	Very low	30.2	Very low	136 Å²	136	139.7 Å²	139.7	70%	0.697	72%	0.72	S	S	*	*			trans	-88.9	85.9	-179.9	-61.7	174.3	0	0	0	108.3	D347	I345-D347 HydrophobicContact CG2-CB 3.78Å; I345-D347 PolarHBondContact O-N 3.23Å; I345-D347 VanDerWaalsContact O-N 3.09Å
346	D	30.7	Very low	30.8	Very low	141 Å²	141	137.1 Å²	137.1	75%	0.754	71%	0.714	S	S	*	*			trans	-80.8	57.4	169.8	-79.4	-54.9	0	0	0	111.3	V344	V344-D346 PolarHBondContact O-N 3.11Å
347	D	30.5	Very low	31.1	Very low	88 Å²	88	134.6 Å²	134.6	47%	0.471	71%	0.706	S	S	.	*			trans	-105.4	55.2	178.7	-88	-55.5	0	0	0	112.5	K195 I345	K195-D347 HydrophobicContact CD-CB 4.41Å; K195-D347 IonicContact NZ-OD1 3.19Å; K195-D347 PolarHBondContact NZ-OD1 3.1Å; I345-D347 HydrophobicContact CG2-CB 3.78Å; I345-D347 PolarHBondContact O-N 3.23Å; I345-D347 VanDerWaalsContact O-N 3.09Å
348	V	33.1	Very low	31.5	Very low	72 Å²	72	134.9 Å²	134.9	44%	0.436	71%	0.708	S	S	.	*			trans	-115.9	96.8	144.6	-174.2	0	0	0	0	106.2	F350	V348-F350 VanDerWaalsContact C-N 3.29Å; V348-F350 HydrophobicContact CB-CD2 4.23Å; V348-F350 HydrophobicContact CB-CE2 3.86Å; V348-F350 HydrophobicContact CG1-CD2 3.85Å; V348-F350 HydrophobicContact CG1-CE2 3.38Å; V348-F350 HydrophobicContact CG1-CZ 3.82Å; V348-F350 WeakPolarHBondContact O-CD2 3.47Å; V348-F350 PolarHBondContact O-N 3.26Å
349	E	31.7	Very low	32	Very low	116 Å²	116	129.4 Å²	129.4	54%	0.542	70%	0.701	S	S	.	*			trans	-67.8	87.4	177.2	-72.9	170.6	117.5	0	0	109.1	K192 K195	K192-E349 IonicContact NZ-OE1 2.53Å; K192-E349 PolarHBondContact NZ-OE1 3.45Å; K192-E349 IonicContact NZ-OE2 2.68Å; K192-E349 PolarHBondContact NZ-OE2 3.24Å; K195-E349 IonicContact NZ-OE2 2.79Å; K195-E349 PolarHBondContact NZ-OE2 3.48Å
350	F	40.3	Very low	33.3	Very low	111 Å²	111	129.5 Å²	129.5	49%	0.487	69%	0.69	S	S	.	*			trans	-74.4	139.9	159.1	-69	-84.1	0	0	0	108.1	V348 F352	V348-F350 VanDerWaalsContact C-N 3.29Å; V348-F350 HydrophobicContact CB-CD2 4.23Å; V348-F350 HydrophobicContact CB-CE2 3.86Å; V348-F350 HydrophobicContact CG1-CD2 3.85Å; V348-F350 HydrophobicContact CG1-CE2 3.38Å; V348-F350 HydrophobicContact CG1-CZ 3.82Å; V348-F350 WeakPolarHBondContact O-CD2 3.47Å; V348-F350 PolarHBondContact O-N 3.26Å; F350-F352 HydrophobicContact CB-CD2 4.45Å; F350-F352 HydrophobicContact CB-CE2 4.07Å; F350-F352 HydrophobicContact CB-CZ 4.37Å; F350-F352 WeakPolarHBondContact O-CD2 3.08Å; F350-F352 PolarHBondContact O-N 2.74Å
351	D	29.6	Very low	34.7	Very low	124 Å²	124	134.5 Å²	134.5	66%	0.663	69%	0.689	S	S	*	*			trans	-73.3	90.1	-178.4	-164.6	17.7	0	0	0	109.8	K353	D351-K353 PolarHBondContact O-N 3.35Å; D351-K353 IonicContact OD1-NZ 3.84Å; D351-K353 VanDerWaalsContact OD2-CE 3.27Å; D351-K353 WeakPolarHBondContact OD2-CE 3.43Å; D351-K353 IonicContact OD2-NZ 3.16Å; D351-K353 PolarHBondContact OD2-NZ 3.11Å
352	F	34.7	Very low	37	Very low	152 Å²	152	131.7 Å²	131.7	67%	0.667	66%	0.66	S	S	*	*			trans	-76.8	68.7	-178.7	-73.8	-79.9	0	0	0	111.4	F350 E354	F350-F352 HydrophobicContact CB-CD2 4.45Å; F350-F352 HydrophobicContact CB-CE2 4.07Å; F350-F352 HydrophobicContact CB-CZ 4.37Å; F350-F352 WeakPolarHBondContact O-CD2 3.08Å; F350-F352 PolarHBondContact O-N 2.74Å; F352-E354 PolarHBondContact O-N 3.18Å
353	K	32.5	Very low	39.9	Very low	145 Å²	145	126.3 Å²	126.3	63%	0.63	63%	0.629	S	S	*	*			trans	-83.8	103.4	165.5	-72	172	-178.6	148.3	0	109.1	D351 N355	D351-K353 PolarHBondContact O-N 3.35Å; D351-K353 IonicContact OD1-NZ 3.84Å; D351-K353 VanDerWaalsContact OD2-CE 3.27Å; D351-K353 WeakPolarHBondContact OD2-CE 3.43Å; D351-K353 IonicContact OD2-NZ 3.16Å; D351-K353 PolarHBondContact OD2-NZ 3.11Å; K353-N355 PolarHBondContact O-N 2.95Å
354	E	36.8	Very low	43	Very low	165 Å²	165	115.2 Å²	115.2	77%	0.771	59%	0.587	S	S	*	*			trans	-79.1	97.9	166.2	-65.9	-167.6	137.8	0	0	108.4	F352	F352-E354 PolarHBondContact O-N 3.18Å
355	N	31.2	Very low	46	Very low	149 Å²	149	109.8 Å²	109.8	80%	0.797	55%	0.554	S	S	*	*			trans	-152.7	98.3	166.1	-94.9	-30.1	0	0	0	106.3	K353	K353-N355 PolarHBondContact O-N 2.95Å
356	V	39	Very low	49	Very low	98 Å²	98	103.3 Å²	103.3	59%	0.594	52%	0.521	S	S	*	.			trans	-123.2	109.5	176	-179.5	0	0	0	0	107.5	E358	V356-E358 PolarHBondContact O-N 2.96Å
357	P	37.3	Very low	52	Low	103 Å²	103	96.8 Å²	96.8	67%	0.669	49%	0.486	S	S	*	.			trans	-67.9	112.2	168.9	-17.9	31.6	0	0	0	109.2	G359	P357-G359 PolarHBondContact O-N 3.16Å
358	E	36.4	Very low	55.1	Low	198 Å²	198	92.6 Å²	92.6	93%	0.925	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	91.9	175.7	-63.3	-165	125.9	0	0	109.7	V356	V356-E358 PolarHBondContact O-N 2.96Å
359	G	39.3	Very low	57.9	Low	69 Å²	69	89.1 Å²	89.1	71%	0.711	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	178.7	-45.5	176.7	0	0	0	0	0	114.8	P357 K361	P357-G359 PolarHBondContact O-N 3.16Å; G359-K361 PolarHBondContact O-N 2.89Å; G359-K361 VanDerWaalsContact O-N 3.16Å
360	R	53.5	Low	60.8	Low	165 Å²	165	83.6 Å²	83.6	62%	0.623	42%	0.417	S	S	*	.			trans	-71.1	112.7	-175.8	-74.7	-177.3	167.4	-157.9	-8.2	112.5	E284 R362	E284-R360 IonicContact OE1-CZ 2.81Å; E284-R360 IonicContact OE1-NH1 2.73Å; E284-R360 PolarHBondContact OE1-NH1 3.44Å; E284-R360 IonicContact OE1-NH2 3.1Å; E284-R360 PolarHBondContact OE1-NH2 3.07Å; R360-R362 PolarHBondContact O-N 3.25Å
361	K	61	Low	62.9	Low	185 Å²	185	78.5 Å²	78.5	80%	0.804	40%	0.395	S	S	*	.			trans	-65.9	93.1	172.3	-66.5	174.3	-176.3	168.3	0	110.1	G359 P363	G359-K361 PolarHBondContact O-N 2.89Å; G359-K361 VanDerWaalsContact O-N 3.16Å; K361-P363 VanDerWaalsContact O-CD 3.27Å; K361-P363 WeakPolarHBondContact O-CD 3.44Å
362	R	75.3	Confident	65.5	Low	64 Å²	64	73 Å²	73	24%	0.242	37%	0.366	C	S	.	.			trans	-85.4	111.1	172.3	-64.4	179.4	-172.6	-121.3	4.7	110.7	R360 D391 R413 E415 H434	R360-R362 PolarHBondContact O-N 3.25Å; R362-D391 PolarHBondContact NH1-O 3.15Å; R362-R413 HydrophobicContact CB-CB 4.07Å; R362-R413 WeakPolarHBondContact CB-O 3.07Å; R362-E415 HydrophobicContact CB-CG 4.4Å; R362-E415 WeakPolarHBondContact CD-OE1 3.41Å; R362-E415 IonicContact CZ-OE1 3Å; R362-E415 IonicContact NE-OE1 2.64Å; R362-E415 IonicContact NH1-OE1 2.93Å; R362-E415 PolarHBondContact NH1-OE1 2.92Å; R362-E415 IonicContact NH1-OE2 3.22Å; R362-H434 PolarHBondContact O-CE1 3.02Å
363	P	85	Confident	67.8	Low	19 Å²	19	70.3 Å²	70.3	12%	0.123	35%	0.351	C	S	.	.			trans	-86.5	167.5	174.3	35.5	-34.8	0	0	0	112.2	W279 K361 L365 Q440	W279-P363 HydrophobicContact CH2-CG 3.57Å; W279-P363 HydrophobicContact CZ2-CG 3.71Å; W279-P363 HydrophobicContact CZ3-CG 4.17Å; K361-P363 VanDerWaalsContact O-CD 3.27Å; K361-P363 WeakPolarHBondContact O-CD 3.44Å; P363-L365 HydrophobicContact CG-CD1 4.44Å; P363-L365 HydrophobicContact CG-CD2 3.98Å; P363-L365 HydrophobicContact CG-CG 4.08Å; P363-L365 PolarHBondContact O-N 3.1Å; P363-Q440 HydrophobicContact CB-CB 4.36Å
364	L	88.6	Confident	70.1	Confident	5 Å²	5	64.2 Å²	64.2	3%	0.026	33%	0.325	C	S	.	.			trans	-80.1	114.7	170.3	-179.1	61.9	0	0	0	110	G366 I417 L435 L438 L441	L364-G366 WeakPolarHBondContact CD1-O 3.42Å; L364-I417 HydrophobicContact CD1-CB 3.93Å; L364-I417 HydrophobicContact CD1-CD1 3.7Å; L364-I417 HydrophobicContact CD1-CG1 3.61Å; L364-I417 HydrophobicContact CD2-CD1 4.02Å; L364-I417 HydrophobicContact CG-CD1 4.47Å; L364-L435 HydrophobicContact CD2-CD2 4.35Å; L364-L438 HydrophobicContact CD2-CD2 3.68Å; L364-L441 HydrophobicContact CG-CD1 4.4Å
365	L	90.3	Very high	72.4	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	29%	0.29	C	S	.	.			trans	-110.5	-31.5	-174.5	-65	168.1	0	0	0	112.8	I276 W279 P363 E415 K442 C443	I276-L365 HydrophobicContact CB-CD1 4.44Å; I276-L365 HydrophobicContact CD1-CB 4.05Å; I276-L365 HydrophobicContact CG1-CB 3.72Å; I276-L365 HydrophobicContact CG1-CD1 4.04Å; I276-L365 HydrophobicContact CG2-CD1 4.05Å; W279-L365 HydrophobicContact CD2-CD1 3.82Å; W279-L365 HydrophobicContact CD2-CD2 4.13Å; W279-L365 HydrophobicContact CE3-CD1 3.47Å; W279-L365 VanDerWaalsContact CE3-CD1 3.47Å; W279-L365 HydrophobicContact CG-CD1 4.28Å; W279-L365 HydrophobicContact CG-CD2 4.28Å; W279-L365 HydrophobicContact CZ3-CD1 4.03Å; P363-L365 HydrophobicContact CG-CD1 4.44Å; P363-L365 HydrophobicContact CG-CD2 3.98Å; P363-L365 HydrophobicContact CG-CG 4.08Å; P363-L365 PolarHBondContact O-N 3.1Å; L365-E415 PolarHBondContact N-O 3.05Å; L365-K442 HydrophobicContact CD2-CG 4.38Å; L365-K442 PolarHBondContact O-N 3.01Å; L365-C443 PolarHBondContact O-N 3.44Å
366	G	92.7	Very high	75.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131.7	179.3	0	0	0	0	0	113.3	L364 E415 I416 I417 C443	L364-G366 WeakPolarHBondContact CD1-O 3.42Å; G366-E415 PolarHBondContact N-O 2.74Å; G366-I416 WeakPolarHBondContact O-CA 3.38Å; G366-I417 PolarHBondContact O-N 2.97Å; G366-C443 WeakPolarHBondContact CA-O 3.2Å
367	L	94	Very high	77.4	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.016	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	124.6	176.3	177.6	59.4	0	0	0	110.4	L369 I417 L424 L441 C443 L444 V445 L468	L367-L369 HydrophobicContact CD1-CD2 4.09Å; L367-L369 HydrophobicContact CD2-CD2 4.2Å; L367-L369 HydrophobicContact CG-CD2 4.08Å; L367-L369 HydrophobicContact CG-CG 4.36Å; L367-I417 WeakPolarHBondContact CA-O 3.05Å; L367-I417 HydrophobicContact CD1-CB 4.3Å; L367-I417 HydrophobicContact CD1-CG2 4.16Å; L367-L424 HydrophobicContact CD1-CD2 3.71Å; L367-L424 HydrophobicContact CD2-CD2 4.04Å; L367-L424 HydrophobicContact CG-CD2 4.45Å; L367-L441 HydrophobicContact CB-CD1 3.6Å; L367-L441 HydrophobicContact CB-CD2 4.12Å; L367-L441 HydrophobicContact CD2-CD2 4.26Å; L367-C443 PolarHBondContact N-O 3.38Å; L367-L444 HydrophobicContact CB-CD1 4.31Å; L367-L444 HydrophobicContact CD2-CD1 4.03Å; L367-L444 HydrophobicContact CG-CD1 4.16Å; L367-L444 CarbonylContact O-C 3.35Å; L367-V445 PolarHBondContact O-N 2.96Å; L367-L468 HydrophobicContact CD2-CD1 4.46Å
368	V	94.9	Very high	79.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	116.4	174.3	-171.8	0	0	0	0	110.5	F268 M272 T370 V379 I383 I417 I418 A419 V445	F268-V368 HydrophobicContact CE2-CG1 4.07Å; F268-V368 HydrophobicContact CE2-CG2 4.25Å; F268-V368 HydrophobicContact CZ-CG1 4.25Å; M272-V368 HydrophobicContact CE-CG2 3.72Å; M272-V368 HydrophobicContact SD-CG2 4.15Å; V368-T370 HydrophobicContact CG1-CG2 4.08Å; V368-V379 HydrophobicContact CG1-CG1 4.1Å; V368-I383 HydrophobicContact CG2-CD1 4.31Å; V368-I417 PolarHBondContact N-O 3.19Å; V368-I418 HydrophobicContact CB-CB 4.44Å; V368-I418 HydrophobicContact CB-CG1 4.11Å; V368-I418 HydrophobicContact CB-CG2 4.29Å; V368-I418 HydrophobicContact CG2-CG1 4.18Å; V368-I418 CarbonylContact O-C 3.57Å; V368-I418 WeakPolarHBondContact O-CA 3.44Å; V368-A419 PolarHBondContact O-N 3.46Å; V368-V445 HydrophobicContact CB-CB 4.27Å; V368-V445 HydrophobicContact CG1-CB 3.99Å; V368-V445 HydrophobicContact CG1-CG1 3.98Å; V368-V445 HydrophobicContact CG2-CB 4.07Å; V368-V445 HydrophobicContact CG2-CG2 4.21Å
369	L	92.9	Very high	82.3	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	133	175.1	-57.6	-179.5	0	0	0	110.3	L367 L424 L444 V445 D447 L461 L464	L367-L369 HydrophobicContact CD1-CD2 4.09Å; L367-L369 HydrophobicContact CD2-CD2 4.2Å; L367-L369 HydrophobicContact CG-CD2 4.08Å; L367-L369 HydrophobicContact CG-CG 4.36Å; L369-L424 HydrophobicContact CD2-CD2 3.62Å; L369-L444 HydrophobicContact CD1-CD1 4.11Å; L369-L444 HydrophobicContact CG-CD1 4.33Å; L369-V445 PolarHBondContact N-O 3.01Å; L369-D447 PolarHBondContact O-N 2.72Å; L369-D447 VanDerWaalsContact O-N 3.11Å; L369-L461 HydrophobicContact CD1-CD1 3.66Å; L369-L464 HydrophobicContact CD1-CD2 3.83Å
370	T	91	Very high	84.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	14%	0.138	C	C	.	.			trans	-139.9	142.2	-177.9	60.9	0	0	0	0	111	V368 T372 L375 A376 V379 A419 T420 P421	V368-T370 HydrophobicContact CG1-CG2 4.08Å; T370-T372 VanDerWaalsContact C-N 3.28Å; T370-T372 PolarHBondContact O-N 2.76Å; T370-T372 PolarHBondContact OG1-O 2.89Å; T370-L375 HydrophobicContact CG2-CD2 4.07Å; T370-L375 HydrophobicContact CG2-CG 4Å; T370-A376 WeakPolarHBondContact OG1-CB 3.44Å; T370-V379 HydrophobicContact CG2-CG2 4.42Å; T370-A419 PolarHBondContact N-O 2.84Å; T370-A419 PolarHBondContact OG1-O 2.88Å; T370-T420 WeakPolarHBondContact O-CA 3.46Å; T370-T420 WeakPolarHBondContact O-CG2 3.43Å; T370-P421 WeakPolarHBondContact O-CD 3.44Å
371	P	85.4	Confident	86.5	Confident	4 Å²	4	25.8 Å²	25.8	3%	0.026	12%	0.117	C	C	.	.	S	Bend	trans	-79	-2.9	-178.4	28.7	-35.9	0	0	0	114.8	D447 E448 R451 M452 F458	P371-D447 WeakPolarHBondContact CD-O 3.47Å; P371-E448 HydrophobicContact CG-CB 3.69Å; P371-R451 HydrophobicContact CB-CB 4.23Å; P371-R451 HydrophobicContact CB-CG 3.83Å; P371-R451 HydrophobicContact CG-CB 4.2Å; P371-R451 HydrophobicContact CG-CG 4.25Å; P371-M452 HydrophobicContact CB-CG 3.83Å; P371-M452 HydrophobicContact CB-SD 4.39Å; P371-M452 HydrophobicContact CG-CG 4.38Å; P371-F458 HydrophobicContact CB-CE2 3.85Å; P371-F458 HydrophobicContact CB-CZ 4.34Å
372	T	83.6	Confident	87.9	Confident	9 Å²	9	18.6 Å²	18.6	6%	0.055	9%	0.086	C	C	.	.			trans	-138.8	145.9	179.1	62.9	0	0	0	0	112.7	T370 E374 L375 A376 R451	T370-T372 VanDerWaalsContact C-N 3.28Å; T370-T372 PolarHBondContact O-N 2.76Å; T370-T372 PolarHBondContact OG1-O 2.89Å; T372-E374 PolarHBondContact O-N 3.25Å; T372-L375 PolarHBondContact O-N 2.84Å; T372-L375 WeakPolarHBondContact OG1-CB 3.47Å; T372-L375 PolarHBondContact OG1-N 3.04Å; T372-L375 VanDerWaalsContact OG1-N 3.1Å; T372-A376 PolarHBondContact O-N 3.1Å; T372-R451 VanDerWaalsContact CG2-CZ 3.49Å
373	R	83.3	Confident	88.7	Confident	94 Å²	94	15.7 Å²	15.7	36%	0.355	8%	0.075	S	C	.	.	H	α-helix	trans	-63.4	-31.9	177.7	-50.7	-178.6	178.3	177.8	0.9	110.7	V377 V398 G399 T420 Q598	R373-V377 VanDerWaalsContact O-CG2 3.28Å; R373-V377 WeakPolarHBondContact O-CG2 3.38Å; R373-V377 PolarHBondContact O-N 3.26Å; R373-V377 VanDerWaalsContact O-N 3.07Å; R373-V398 HydrophobicContact CB-CB 4.11Å; R373-V398 HydrophobicContact CB-CG1 4.38Å; R373-V398 HydrophobicContact CB-CG2 4.37Å; R373-V398 HydrophobicContact CG-CB 4.08Å; R373-G399 WeakPolarHBondContact CD-O 3.13Å; R373-G399 PolarHBondContact NE-O 2.86Å; R373-G399 VanDerWaalsContact NH1-C 3.34Å; R373-G399 PolarHBondContact NH1-O 2.77Å; R373-G399 VanDerWaalsContact NH1-O 3.08Å; R373-T420 HydrophobicContact CG-CG2 4.22Å; R373-Q598 VanDerWaalsContact CD-OE1 3.27Å
374	E	81.1	Confident	89	Confident	18 Å²	18	17.3 Å²	17.3	8%	0.084	8%	0.083	C	C	.	.	H	α-helix	trans	-78.2	-38.3	-178.2	-57.3	74.2	-170.2	0	0	112.1	T372 V377 Q378 R601 L626	T372-E374 PolarHBondContact O-N 3.25Å; E374-V377 PolarHBondContact O-N 3.48Å; E374-Q378 PolarHBondContact O-N 2.86Å; E374-R601 VanDerWaalsContact CD-NH2 3.3Å; E374-R601 IonicContact OE1-CZ 2.74Å; E374-R601 IonicContact OE1-NH1 3.64Å; E374-R601 PolarHBondContact OE1-NH1 2.83Å; E374-R601 IonicContact OE1-NH2 3.52Å; E374-R601 PolarHBondContact OE1-NH2 3.44Å; E374-R601 IonicContact OE2-NH2 2.74Å; E374-L626 HydrophobicContact CB-CD2 3.53Å; E374-L626 HydrophobicContact CB-CG 4.49Å; E374-L626 HydrophobicContact CG-CD2 4.31Å
375	L	84.4	Confident	89.1	Confident	8 Å²	8	18 Å²	18	4%	0.042	9%	0.089	C	C	.	.	H	α-helix	trans	-64.5	-43.8	169	-179.9	59.3	0	0	0	110.9	T370 T372 V377 Q378 V379 E448 G625	T370-L375 HydrophobicContact CG2-CD2 4.07Å; T370-L375 HydrophobicContact CG2-CG 4Å; T372-L375 PolarHBondContact O-N 2.84Å; T372-L375 WeakPolarHBondContact OG1-CB 3.47Å; T372-L375 PolarHBondContact OG1-N 3.04Å; T372-L375 VanDerWaalsContact OG1-N 3.1Å; L375-V377 VanDerWaalsContact C-N 3.29Å; L375-V377 PolarHBondContact O-N 3.42Å; L375-Q378 PolarHBondContact O-N 3.4Å; L375-Q378 VanDerWaalsContact O-N 3.1Å; L375-V379 HydrophobicContact CD1-CG2 3.89Å; L375-V379 HydrophobicContact CG-CG2 4.15Å; L375-V379 WeakPolarHBondContact O-CB 3.17Å; L375-V379 WeakPolarHBondContact O-CG2 3.33Å; L375-V379 PolarHBondContact O-N 3.36Å; L375-E448 HydrophobicContact CD2-CB 4.36Å; L375-E448 HydrophobicContact CD2-CG 4.04Å; L375-G625 WeakPolarHBondContact CD1-O 3.31Å
376	A	89.1	Confident	89.1	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-55	-44.8	174.1	0	0	0	0	0	112.1	T370 T372 V379 K380 I396 V398 I418	T370-A376 WeakPolarHBondContact OG1-CB 3.44Å; T372-A376 PolarHBondContact O-N 3.1Å; A376-V379 PolarHBondContact O-N 3.18Å; A376-K380 WeakPolarHBondContact O-CB 3.42Å; A376-K380 PolarHBondContact O-N 3.41Å; A376-I396 HydrophobicContact CB-CD1 3.82Å; A376-I396 HydrophobicContact CB-CG1 4.22Å; A376-V398 HydrophobicContact CB-CG1 3.54Å; A376-I418 HydrophobicContact CB-CG2 4.05Å
377	V	86.9	Confident	89	Confident	49 Å²	49	18.4 Å²	18.4	30%	0.297	9%	0.092	S	C	.	.	H	α-helix	trans	-63.4	-42.6	175.5	168.1	0	0	0	0	111.3	R373 E374 L375 H381 I396	R373-V377 VanDerWaalsContact O-CG2 3.28Å; R373-V377 WeakPolarHBondContact O-CG2 3.38Å; R373-V377 PolarHBondContact O-N 3.26Å; R373-V377 VanDerWaalsContact O-N 3.07Å; E374-V377 PolarHBondContact O-N 3.48Å; L375-V377 VanDerWaalsContact C-N 3.29Å; L375-V377 PolarHBondContact O-N 3.42Å; V377-H381 PolarHBondContact O-N 3.39Å; V377-H381 PolarHBondContact O-ND1 2.96Å; V377-I396 HydrophobicContact CB-CD1 4.23Å; V377-I396 HydrophobicContact CG2-CD1 3.51Å
378	Q	85.5	Confident	88.8	Confident	18 Å²	18	24.6 Å²	24.6	8%	0.084	12%	0.119	C	C	.	.	H	α-helix	trans	-62.8	-52.5	175.8	-179	174.2	-16.8	0	0	111.1	E374 L375 K380 H381 H382 D627	E374-Q378 PolarHBondContact O-N 2.86Å; L375-Q378 PolarHBondContact O-N 3.4Å; L375-Q378 VanDerWaalsContact O-N 3.1Å; Q378-K380 PolarHBondContact O-N 2.93Å; Q378-H381 PolarHBondContact O-N 3.25Å; Q378-H382 PolarHBondContact NE2-NE2 3.27Å; Q378-H382 PolarHBondContact O-CD2 2.61Å; Q378-H382 VanDerWaalsContact O-CD2 3.31Å; Q378-H382 PolarHBondContact O-N 3.24Å; Q378-H382 VanDerWaalsContact O-N 3.08Å; Q378-D627 VanDerWaalsContact OE1-CB 3.31Å
379	V	90.7	Very high	88.5	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-54.2	-41.5	179.4	170.6	0	0	0	0	111	T265 F268 V368 T370 L375 A376 H382 I383 I418	T265-V379 HydrophobicContact CG2-CB 4.25Å; T265-V379 HydrophobicContact CG2-CG1 4.07Å; T265-V379 HydrophobicContact CG2-CG2 4.04Å; F268-V379 HydrophobicContact CE2-CG1 4.1Å; F268-V379 HydrophobicContact CZ-CG1 4.2Å; F268-V379 HydrophobicContact CZ-CG2 4.35Å; V368-V379 HydrophobicContact CG1-CG1 4.1Å; T370-V379 HydrophobicContact CG2-CG2 4.42Å; L375-V379 HydrophobicContact CD1-CG2 3.89Å; L375-V379 HydrophobicContact CG-CG2 4.15Å; L375-V379 WeakPolarHBondContact O-CB 3.17Å; L375-V379 WeakPolarHBondContact O-CG2 3.33Å; L375-V379 PolarHBondContact O-N 3.36Å; A376-V379 PolarHBondContact O-N 3.18Å; V379-H382 PolarHBondContact O-N 3.13Å; V379-I383 HydrophobicContact CG1-CD1 3.71Å; V379-I383 HydrophobicContact CG1-CG1 4.34Å; V379-I383 WeakPolarHBondContact O-CG1 3.24Å; V379-I383 PolarHBondContact O-N 3.21Å; V379-I418 HydrophobicContact CB-CG2 4.17Å; V379-I418 HydrophobicContact CG1-CD1 4.14Å; V379-I418 HydrophobicContact CG1-CG1 4.34Å; V379-I418 HydrophobicContact CG1-CG2 3.96Å
380	K	91.9	Very high	88.3	Confident	28 Å²	28	29.8 Å²	29.8	12%	0.122	14%	0.142	C	C	.	.	H	α-helix	trans	-58.2	-50.3	174.6	-160.3	-147.7	-173	-57.2	0	112.3	A376 Q378 H382 I383 D384 T394 I396 I418	A376-K380 WeakPolarHBondContact O-CB 3.42Å; A376-K380 PolarHBondContact O-N 3.41Å; Q378-K380 PolarHBondContact O-N 2.93Å; K380-H382 VanDerWaalsContact C-N 3.32Å; K380-H382 PolarHBondContact O-N 3.38Å; K380-I383 PolarHBondContact O-N 3.02Å; K380-D384 IonicContact NZ-OD1 3.72Å; K380-D384 PolarHBondContact NZ-OD1 3.14Å; K380-D384 IonicContact NZ-OD2 2.73Å; K380-D384 PolarHBondContact NZ-OD2 2.97Å; K380-D384 VanDerWaalsContact O-CB 3.28Å; K380-D384 WeakPolarHBondContact O-CB 3.47Å; K380-D384 PolarHBondContact O-N 3.37Å; K380-T394 PolarHBondContact NZ-O 3.19Å; K380-T394 PolarHBondContact NZ-OG1 2.74Å; K380-I396 HydrophobicContact CD-CB 4.3Å; K380-I396 HydrophobicContact CD-CG2 4.18Å; K380-I418 VanDerWaalsContact CA-CD1 3.48Å; K380-I418 HydrophobicContact CB-CD1 3.81Å; K380-I418 HydrophobicContact CG-CD1 3.93Å
381	H	89.5	Confident	88.2	Confident	37 Å²	37	36.2 Å²	36.2	17%	0.171	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-38.5	179.5	-72.6	92.7	0	0	0	112.7	N196 N199 V377 Q378 A385	N196-H381 PolarHBondContact ND2-NE2 3.3Å; N199-H381 PolarHBondContact OD1-CD2 3.41Å; V377-H381 PolarHBondContact O-N 3.39Å; V377-H381 PolarHBondContact O-ND1 2.96Å; Q378-H381 PolarHBondContact O-N 3.25Å; H381-A385 WeakPolarHBondContact O-CB 3.19Å; H381-A385 PolarHBondContact O-N 3.28Å
382	H	89.3	Confident	88.4	Confident	34 Å²	34	36.6 Å²	36.6	16%	0.157	18%	0.178	C	C	.	.	H	α-helix	trans	-69.7	-40.3	177.2	-78.9	-103.9	0	0	0	112.4	T265 L266 Q378 V379 K380 V386	T265-H382 HydrophobicContact CG2-CB 3.7Å; L266-H382 HydrophobicContact CD2-CB 4.49Å; Q378-H382 PolarHBondContact NE2-NE2 3.27Å; Q378-H382 PolarHBondContact O-CD2 2.61Å; Q378-H382 VanDerWaalsContact O-CD2 3.31Å; Q378-H382 PolarHBondContact O-N 3.24Å; Q378-H382 VanDerWaalsContact O-N 3.08Å; V379-H382 PolarHBondContact O-N 3.13Å; K380-H382 VanDerWaalsContact C-N 3.32Å; K380-H382 PolarHBondContact O-N 3.38Å; H382-V386 WeakPolarHBondContact O-CG2 3.44Å; H382-V386 PolarHBondContact O-N 2.88Å
383	I	92.6	Very high	88.8	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-70	-45.4	176.9	-65.7	176.8	0	0	0	110.2	F268 I273 V368 V379 K380 A385 V386 A387 T394 I416 I418	F268-I383 HydrophobicContact CE2-CD1 4.36Å; I273-I383 HydrophobicContact CD1-CG2 4.37Å; V368-I383 HydrophobicContact CG2-CD1 4.31Å; V379-I383 HydrophobicContact CG1-CD1 3.71Å; V379-I383 HydrophobicContact CG1-CG1 4.34Å; V379-I383 WeakPolarHBondContact O-CG1 3.24Å; V379-I383 PolarHBondContact O-N 3.21Å; K380-I383 PolarHBondContact O-N 3.02Å; I383-A385 VanDerWaalsContact C-N 3.32Å; I383-A385 PolarHBondContact O-N 2.99Å; I383-V386 PolarHBondContact O-N 3.13Å; I383-V386 VanDerWaalsContact O-N 3.15Å; I383-A387 VanDerWaalsContact O-CB 3.28Å; I383-A387 WeakPolarHBondContact O-CB 3.3Å; I383-A387 PolarHBondContact O-N 3.18Å; I383-T394 HydrophobicContact CG2-CG2 3.93Å; I383-I416 HydrophobicContact CG2-CD1 4.07Å; I383-I418 HydrophobicContact CD1-CD1 4.02Å; I383-I418 HydrophobicContact CD1-CG1 4.49Å
384	D	92.2	Very high	89.3	Confident	54 Å²	54	35.7 Å²	35.7	29%	0.289	18%	0.178	S	C	.	.	H	α-helix	trans	-56.1	-44	175.4	-69.6	-12.8	0	0	0	112	K380 V386 A387 K388 T394	K380-D384 IonicContact NZ-OD1 3.72Å; K380-D384 PolarHBondContact NZ-OD1 3.14Å; K380-D384 IonicContact NZ-OD2 2.73Å; K380-D384 PolarHBondContact NZ-OD2 2.97Å; K380-D384 VanDerWaalsContact O-CB 3.28Å; K380-D384 WeakPolarHBondContact O-CB 3.47Å; K380-D384 PolarHBondContact O-N 3.37Å; D384-V386 VanDerWaalsContact C-N 3.28Å; D384-V386 PolarHBondContact O-N 3.43Å; D384-A387 PolarHBondContact O-N 3.26Å; D384-K388 PolarHBondContact O-N 3.28Å; D384-K388 VanDerWaalsContact O-N 3.1Å; D384-T394 WeakPolarHBondContact OD1-CG2 3.28Å; D384-T394 PolarHBondContact OD1-OG1 3Å
385	A	89.6	Confident	89.8	Confident	19 Å²	19	35 Å²	35	16%	0.157	18%	0.176	C	C	.	.	H	α-helix	trans	-62.8	-34.2	179.3	0	0	0	0	0	112.8	L202 L231 H381 I383 K388	L202-A385 HydrophobicContact CD1-CB 4.25Å; L231-A385 HydrophobicContact CD1-CB 3.97Å; L231-A385 HydrophobicContact CD2-CB 4.1Å; H381-A385 WeakPolarHBondContact O-CB 3.19Å; H381-A385 PolarHBondContact O-N 3.28Å; I383-A385 VanDerWaalsContact C-N 3.32Å; I383-A385 PolarHBondContact O-N 2.99Å; A385-K388 WeakPolarHBondContact O-CB 3.23Å
386	V	90.4	Very high	90.2	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.018	18%	0.177	C	C	.	.	H	α-helix	trans	-87.7	-30.5	179.7	175.6	0	0	0	0	112.6	V224 A227 L228 L231 L266 I270 I273 H382 I383 D384 K388	V224-V386 HydrophobicContact CB-CG1 4.34Å; V224-V386 HydrophobicContact CG1-CG1 3.67Å; V224-V386 HydrophobicContact CG2-CG1 4.12Å; A227-V386 VanDerWaalsContact CB-O 3.26Å; A227-V386 WeakPolarHBondContact CB-O 3.38Å; L228-V386 HydrophobicContact CD2-CG2 4.36Å; L231-V386 HydrophobicContact CD1-CG2 4.04Å; L266-V386 HydrophobicContact CD2-CG2 3.74Å; I270-V386 HydrophobicContact CG1-CG1 4.44Å; I273-V386 HydrophobicContact CD1-CB 4.37Å; I273-V386 HydrophobicContact CD1-CG1 3.97Å; H382-V386 WeakPolarHBondContact O-CG2 3.44Å; H382-V386 PolarHBondContact O-N 2.88Å; I383-V386 PolarHBondContact O-N 3.13Å; I383-V386 VanDerWaalsContact O-N 3.15Å; D384-V386 VanDerWaalsContact C-N 3.28Å; D384-V386 PolarHBondContact O-N 3.43Å; V386-K388 PolarHBondContact O-N 2.97Å
387	A	90.6	Very high	90.4	Very high	7 Å²	7	35.3 Å²	35.3	6%	0.058	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-78	-0.9	171.9	0	0	0	0	0	113.5	I273 I383 D384 Y389 T390	I273-A387 HydrophobicContact CD1-CB 4.13Å; I383-A387 VanDerWaalsContact O-CB 3.28Å; I383-A387 WeakPolarHBondContact O-CB 3.3Å; I383-A387 PolarHBondContact O-N 3.18Å; D384-A387 PolarHBondContact O-N 3.26Å; A387-Y389 PolarHBondContact O-N 3.16Å; A387-T390 PolarHBondContact O-N 2.98Å; A387-T390 PolarHBondContact O-OG1 3.14Å; A387-T390 VanDerWaalsContact O-OG1 3.08Å
388	K	90.3	Very high	90.6	Very high	133 Å²	133	33 Å²	33	58%	0.578	16%	0.163	S	C	*	.	G	3₁₀ helix	trans	-51.2	-26	-176	-176.5	-176.6	175.5	-168	0	115.6	D384 A385 V386	D384-K388 PolarHBondContact O-N 3.28Å; D384-K388 VanDerWaalsContact O-N 3.1Å; A385-K388 WeakPolarHBondContact O-CB 3.23Å; V386-K388 PolarHBondContact O-N 2.97Å
389	Y	88.3	Confident	90.5	Very high	88 Å²	88	32.7 Å²	32.7	35%	0.345	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-110.6	26.3	177.9	-59	-66.3	0	0	0	113	A223 K226 A227 A387	A223-Y389 WeakPolarHBondContact CB-O 3.44Å; K226-Y389 HydrophobicContact CB-CD2 3.94Å; K226-Y389 HydrophobicContact CB-CE2 4.25Å; K226-Y389 HydrophobicContact CD-CD1 4.18Å; K226-Y389 HydrophobicContact CD-CD2 3.98Å; K226-Y389 HydrophobicContact CD-CE1 4.37Å; K226-Y389 HydrophobicContact CD-CE2 4.19Å; K226-Y389 HydrophobicContact CD-CG 3.99Å; K226-Y389 HydrophobicContact CG-CD2 3.8Å; K226-Y389 HydrophobicContact CG-CE2 3.75Å; K226-Y389 HydrophobicContact CG-CG 4.33Å; A227-Y389 HydrophobicContact CB-CD2 3.97Å; A227-Y389 HydrophobicContact CB-CE2 4.35Å; A387-Y389 PolarHBondContact O-N 3.16Å
390	T	88.8	Confident	90	Very high	21 Å²	21	35.8 Å²	35.8	13%	0.129	20%	0.196	C	C	.	.	S	Bend	trans	-137	152.5	176	68.9	0	0	0	0	111.5	A223 L277 A387 I392	A223-T390 HydrophobicContact CB-CG2 3.6Å; L277-T390 HydrophobicContact CD1-CG2 4.25Å; L277-T390 HydrophobicContact CD2-CG2 4.06Å; A387-T390 PolarHBondContact O-N 2.98Å; A387-T390 PolarHBondContact O-OG1 3.14Å; A387-T390 VanDerWaalsContact O-OG1 3.08Å; T390-I392 PolarHBondContact O-N 3.39Å
391	D	88.3	Confident	89.5	Confident	134 Å²	134	36.8 Å²	36.8	72%	0.717	20%	0.202	S	C	*	.			trans	-82	32.2	-179.7	-60.6	-51.9	0	0	0	113.9	K280 R362	K280-D391 PolarHBondContact NZ-O 2.89Å; R362-D391 PolarHBondContact NH1-O 3.15Å
392	I	90.5	Very high	89.3	Confident	13 Å²	13	38.2 Å²	38.2	7%	0.067	22%	0.22	C	C	.	.			trans	-91.8	119.4	-178.3	-59.8	175.9	0	0	0	109.1	I273 I276 L277 T390 E415 I416	I273-I392 HydrophobicContact CB-CD1 4.37Å; I273-I392 HydrophobicContact CG1-CD1 4.37Å; I273-I392 HydrophobicContact CG2-CD1 3.92Å; I276-I392 HydrophobicContact CB-CD1 4.12Å; I276-I392 HydrophobicContact CG2-CD1 3.7Å; I276-I392 HydrophobicContact CG2-CG1 3.88Å; I276-I392 HydrophobicContact CG2-CG2 4.43Å; L277-I392 HydrophobicContact CD2-CD1 4.27Å; L277-I392 HydrophobicContact CG-CD1 4.33Å; T390-I392 PolarHBondContact O-N 3.39Å; I392-E415 HydrophobicContact CG2-CB 4.39Å; I392-I416 HydrophobicContact CG2-CD1 3.68Å; I392-I416 HydrophobicContact CG2-CG1 3.94Å
393	Q	90.9	Very high	89.1	Confident	65 Å²	65	40.9 Å²	40.9	30%	0.304	23%	0.233	S	C	.	.			trans	-91.6	135.2	176.6	-60.6	-167.3	18.5	0	0	111	P414 E415 I416	Q393-P414 HydrophobicContact CB-CB 4.31Å; Q393-E415 WeakPolarHBondContact CB-OE2 3.47Å; Q393-E415 PolarHBondContact N-OE2 3.26Å; Q393-E415 PolarHBondContact O-N 2.89Å; Q393-I416 PolarHBondContact O-N 2.99Å
394	T	93.6	Very high	88.8	Confident	19 Å²	19	47.6 Å²	47.6	12%	0.117	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	140.9	174.6	91.2	0	0	0	0	111.9	K380 I383 D384 I416	K380-T394 PolarHBondContact NZ-O 3.19Å; K380-T394 PolarHBondContact NZ-OG1 2.74Å; I383-T394 HydrophobicContact CG2-CG2 3.93Å; D384-T394 WeakPolarHBondContact OD1-CG2 3.28Å; D384-T394 PolarHBondContact OD1-OG1 3Å; T394-I416 WeakPolarHBondContact CA-O 3.41Å; T394-I416 HydrophobicContact CG2-CB 4.16Å; T394-I416 HydrophobicContact CG2-CD1 4.4Å
395	A	93.3	Very high	88.5	Confident	3 Å²	3	50.2 Å²	50.2	3%	0.025	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	158.9	173	0	0	0	0	0	112	M409 P414 I416 I418	A395-M409 HydrophobicContact CB-CE 4.24Å; A395-P414 HydrophobicContact CB-CB 3.88Å; A395-P414 HydrophobicContact CB-CG 3.57Å; A395-I416 PolarHBondContact N-O 3.16Å; A395-I418 PolarHBondContact O-N 2.92Å
396	I	93.1	Very high	88.4	Confident	13 Å²	13	49.3 Å²	49.3	7%	0.067	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.8	-179.6	-175.7	170.7	0	0	0	111.1	A376 V377 K380 V398 M401 M409 I418	A376-I396 HydrophobicContact CB-CD1 3.82Å; A376-I396 HydrophobicContact CB-CG1 4.22Å; V377-I396 HydrophobicContact CB-CD1 4.23Å; V377-I396 HydrophobicContact CG2-CD1 3.51Å; K380-I396 HydrophobicContact CD-CB 4.3Å; K380-I396 HydrophobicContact CD-CG2 4.18Å; I396-V398 HydrophobicContact CD1-CG1 4.1Å; I396-V398 HydrophobicContact CD1-CG2 4.3Å; I396-V398 HydrophobicContact CG1-CG1 3.8Å; I396-V398 HydrophobicContact CG1-CG2 4.18Å; I396-M401 HydrophobicContact CG2-CE 4.31Å; I396-M401 HydrophobicContact CG2-SD 4.26Å; I396-M409 HydrophobicContact CG2-CE 4.07Å; I396-I418 CarbonylContact C-O 3.59Å; I396-I418 VanDerWaalsContact CA-O 3.27Å; I396-I418 WeakPolarHBondContact CA-O 3.42Å
397	V	92.9	Very high	88.2	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	88.9	-175.2	175.6	0	0	0	0	109.5	L410 I417 I418 A419 T420 R423 L424 L427	V397-L410 HydrophobicContact CG2-CD1 4.39Å; V397-L410 HydrophobicContact CG2-CD2 4.11Å; V397-I417 HydrophobicContact CB-CG2 4.3Å; V397-I417 HydrophobicContact CG2-CG2 3.87Å; V397-I418 PolarHBondContact N-O 2.88Å; V397-A419 HydrophobicContact CB-CB 3.95Å; V397-A419 HydrophobicContact CG1-CB 4.43Å; V397-A419 WeakPolarHBondContact O-CA 3.37Å; V397-A419 WeakPolarHBondContact O-CB 3.17Å; V397-T420 PolarHBondContact O-N 2.81Å; V397-T420 VanDerWaalsContact O-N 3.08Å; V397-R423 HydrophobicContact CG1-CG 4.26Å; V397-L424 HydrophobicContact CG1-CB 4.48Å; V397-L424 HydrophobicContact CG1-CD1 4.39Å; V397-L427 HydrophobicContact CG1-CD1 3.55Å
398	V	91	Very high	88.1	Confident	1 Å²	1	63 Å²	63	1%	0.006	32%	0.316	C	S	.	.			trans	-132.4	145.3	-177	-62.4	0	0	0	0	111.7	R373 A376 I396 M401 Q406 T420	R373-V398 HydrophobicContact CB-CB 4.11Å; R373-V398 HydrophobicContact CB-CG1 4.38Å; R373-V398 HydrophobicContact CB-CG2 4.37Å; R373-V398 HydrophobicContact CG-CB 4.08Å; A376-V398 HydrophobicContact CB-CG1 3.54Å; I396-V398 HydrophobicContact CD1-CG1 4.1Å; I396-V398 HydrophobicContact CD1-CG2 4.3Å; I396-V398 HydrophobicContact CG1-CG1 3.8Å; I396-V398 HydrophobicContact CG1-CG2 4.18Å; V398-M401 HydrophobicContact CG2-CG 4.03Å; V398-M401 HydrophobicContact CG2-SD 3.54Å; V398-M401 VanDerWaalsContact CG2-SD 3.54Å; V398-Q406 PolarHBondContact O-NE2 2.83Å; V398-T420 HydrophobicContact CG1-CG2 4.01Å
399	G	83.4	Confident	88	Confident	10 Å²	10	59 Å²	59	10%	0.103	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	157.2	177.6	0	0	0	0	0	112.6	R373 M401 Q598	R373-G399 WeakPolarHBondContact CD-O 3.13Å; R373-G399 PolarHBondContact NE-O 2.86Å; R373-G399 VanDerWaalsContact NH1-C 3.34Å; R373-G399 PolarHBondContact NH1-O 2.77Å; R373-G399 VanDerWaalsContact NH1-O 3.08Å; G399-M401 PolarHBondContact O-N 3.45Å; G399-Q598 PolarHBondContact O-OE1 3.08Å
400	G	79.1	Confident	88	Confident	65 Å²	65	54.9 Å²	54.9	67%	0.67	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	3.4	178.1	0	0	0	0	0	115.8
401	M	82.6	Confident	87.9	Confident	50 Å²	50	62.1 Å²	62.1	25%	0.246	31%	0.313	C	S	.	.	S	Bend	trans	-85.1	151.7	155.8	-71.4	173.8	67	0	0	109.6	I396 V398 G399 Q403 K405 Q406 M409	I396-M401 HydrophobicContact CG2-CE 4.31Å; I396-M401 HydrophobicContact CG2-SD 4.26Å; V398-M401 HydrophobicContact CG2-CG 4.03Å; V398-M401 HydrophobicContact CG2-SD 3.54Å; V398-M401 VanDerWaalsContact CG2-SD 3.54Å; G399-M401 PolarHBondContact O-N 3.45Å; M401-Q403 PolarHBondContact O-N 3.36Å; M401-K405 HydrophobicContact CE-CD 4.43Å; M401-K405 HydrophobicContact CE-CG 4.48Å; M401-Q406 HydrophobicContact CB-CG 4.19Å; M401-Q406 HydrophobicContact CE-CG 4.4Å; M401-M409 HydrophobicContact CE-SD 4.03Å
402	A	83.9	Confident	87.8	Confident	67 Å²	67	61.4 Å²	61.4	55%	0.554	30%	0.3	S	S	*	.			trans	-63.2	130	173.6	0	0	0	0	0	111.3	Q404 K405 Q406	A402-Q404 VanDerWaalsContact C-N 3.3Å; A402-Q404 PolarHBondContact O-N 3.07Å; A402-K405 HydrophobicContact CB-CB 4.4Å; A402-K405 WeakPolarHBondContact O-CA 3.44Å; A402-K405 WeakPolarHBondContact O-CB 3.34Å; A402-K405 PolarHBondContact O-N 2.86Å; A402-Q406 PolarHBondContact O-N 3.3Å
403	Q	85.1	Confident	87.6	Confident	90 Å²	90	67.1 Å²	67.1	42%	0.421	32%	0.321	S	S	.	.	H	α-helix	trans	-56.3	-41.4	-178.3	-174.4	179.4	27.1	0	0	112.4	M401 K405 Q406 R407 E430	M401-Q403 PolarHBondContact O-N 3.36Å; Q403-K405 VanDerWaalsContact C-N 3.3Å; Q403-K405 PolarHBondContact O-N 3.07Å; Q403-Q406 PolarHBondContact O-N 2.59Å; Q403-Q406 VanDerWaalsContact O-N 3.13Å; Q403-R407 WeakPolarHBondContact O-CG 3.42Å; Q403-R407 PolarHBondContact O-N 2.9Å; Q403-E430 PolarHBondContact NE2-OE1 3.17Å; Q403-E430 VanDerWaalsContact NE2-OE1 3.13Å; Q403-E430 PolarHBondContact NE2-OE2 2.85Å
404	Q	86.7	Confident	87.6	Confident	142 Å²	142	64.2 Å²	64.2	66%	0.664	31%	0.307	S	S	*	.	H	α-helix	trans	-57.8	-39.5	173.8	-68.3	-177.5	-7.7	0	0	112.7	A402 R407 R408	A402-Q404 VanDerWaalsContact C-N 3.3Å; A402-Q404 PolarHBondContact O-N 3.07Å; Q404-R407 PolarHBondContact O-N 3.5Å; Q404-R408 WeakPolarHBondContact O-CB 3.19Å; Q404-R408 WeakPolarHBondContact O-CG 3.42Å; Q404-R408 PolarHBondContact O-N 3.16Å
405	K	86.6	Confident	87.6	Confident	109 Å²	109	63.3 Å²	63.3	47%	0.474	30%	0.302	S	S	.	.	H	α-helix	trans	-66.7	-39.6	176.6	-174.5	168.2	-177	165.4	0	111	M401 A402 Q403 R408 M409	M401-K405 HydrophobicContact CE-CD 4.43Å; M401-K405 HydrophobicContact CE-CG 4.48Å; A402-K405 HydrophobicContact CB-CB 4.4Å; A402-K405 WeakPolarHBondContact O-CA 3.44Å; A402-K405 WeakPolarHBondContact O-CB 3.34Å; A402-K405 PolarHBondContact O-N 2.86Å; Q403-K405 VanDerWaalsContact C-N 3.3Å; Q403-K405 PolarHBondContact O-N 3.07Å; K405-R408 PolarHBondContact O-N 3.43Å; K405-M409 HydrophobicContact CG-SD 4.25Å; K405-M409 VanDerWaalsContact O-CG 3.28Å; K405-M409 WeakPolarHBondContact O-CG 3.48Å; K405-M409 PolarHBondContact O-N 3.35Å
406	Q	87.3	Confident	87.6	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-64.9	-47.2	175.3	-65	-174	-35.4	0	0	111.8	V398 M401 A402 Q403 R408 M409 L410 L427	V398-Q406 PolarHBondContact O-NE2 2.83Å; M401-Q406 HydrophobicContact CB-CG 4.19Å; M401-Q406 HydrophobicContact CE-CG 4.4Å; A402-Q406 PolarHBondContact O-N 3.3Å; Q403-Q406 PolarHBondContact O-N 2.59Å; Q403-Q406 VanDerWaalsContact O-N 3.13Å; Q406-R408 PolarHBondContact O-N 3.16Å; Q406-M409 PolarHBondContact O-N 3.17Å; Q406-M409 VanDerWaalsContact O-N 3.12Å; Q406-L410 WeakPolarHBondContact O-CG 3.3Å; Q406-L410 PolarHBondContact O-N 3.2Å; Q406-L427 HydrophobicContact CB-CD1 4.49Å
407	R	86.3	Confident	87.7	Confident	114 Å²	114	62.6 Å²	62.6	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-58.6	-43.6	175	-69.2	-179.8	178.3	-169.9	-2.1	111.6	Q403 Q404 M409 L410 K411 E430	Q403-R407 WeakPolarHBondContact O-CG 3.42Å; Q403-R407 PolarHBondContact O-N 2.9Å; Q404-R407 PolarHBondContact O-N 3.5Å; R407-M409 PolarHBondContact O-N 2.89Å; R407-L410 PolarHBondContact O-N 2.94Å; R407-K411 WeakPolarHBondContact O-CB 3.25Å; R407-K411 WeakPolarHBondContact O-CG 3.37Å; R407-K411 PolarHBondContact O-N 2.84Å; R407-E430 IonicContact CZ-OE2 3.89Å; R407-E430 IonicContact NE-OE2 2.84Å; R407-E430 PolarHBondContact NE-OE2 2.82Å; R407-E430 IonicContact NH2-OE2 2.66Å; R407-E430 PolarHBondContact NH2-OE2 2.94Å
408	R	87.4	Confident	87.8	Confident	184 Å²	184	62.5 Å²	62.5	69%	0.694	30%	0.297	S	S	*	.	H	α-helix	trans	-61.3	-37.9	173.6	-73.4	179.7	-171.9	-173.5	3.6	113.2	Q404 K405 Q406	Q404-R408 WeakPolarHBondContact O-CB 3.19Å; Q404-R408 WeakPolarHBondContact O-CG 3.42Å; Q404-R408 PolarHBondContact O-N 3.16Å; K405-R408 PolarHBondContact O-N 3.43Å; Q406-R408 PolarHBondContact O-N 3.16Å
409	M	88.3	Confident	88	Confident	48 Å²	48	62.4 Å²	62.4	24%	0.236	30%	0.297	C	S	.	.	H	α-helix	trans	-71.5	-39.2	176.8	-71.1	176.2	67.9	0	0	112.5	A395 I396 M401 K405 Q406 R407 R412	A395-M409 HydrophobicContact CB-CE 4.24Å; I396-M409 HydrophobicContact CG2-CE 4.07Å; M401-M409 HydrophobicContact CE-SD 4.03Å; K405-M409 HydrophobicContact CG-SD 4.25Å; K405-M409 VanDerWaalsContact O-CG 3.28Å; K405-M409 WeakPolarHBondContact O-CG 3.48Å; K405-M409 PolarHBondContact O-N 3.35Å; Q406-M409 PolarHBondContact O-N 3.17Å; Q406-M409 VanDerWaalsContact O-N 3.12Å; R407-M409 PolarHBondContact O-N 2.89Å; M409-R412 PolarHBondContact O-N 3.17Å
410	L	88.3	Confident	88.3	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-76.2	-26.7	178.7	-64.9	170.2	0	0	0	113	V397 Q406 R407 R412 R413 P414 I417 L427 H432 L435	V397-L410 HydrophobicContact CG2-CD1 4.39Å; V397-L410 HydrophobicContact CG2-CD2 4.11Å; Q406-L410 WeakPolarHBondContact O-CG 3.3Å; Q406-L410 PolarHBondContact O-N 3.2Å; R407-L410 PolarHBondContact O-N 2.94Å; L410-R412 PolarHBondContact O-N 2.98Å; L410-R413 PolarHBondContact O-N 2.82Å; L410-R413 VanDerWaalsContact O-N 3.08Å; L410-P414 HydrophobicContact CD2-CG 4.39Å; L410-I417 HydrophobicContact CD2-CD1 3.54Å; L410-I417 HydrophobicContact CD2-CG1 4.34Å; L410-L427 HydrophobicContact CD1-CD1 4.24Å; L410-H432 WeakPolarHBondContact CB-CE1 3.42Å; L410-L435 HydrophobicContact CD1-CD1 3.89Å; L410-L435 HydrophobicContact CD1-CG 4.44Å
411	K	86.9	Confident	88.9	Confident	173 Å²	173	59.4 Å²	59.4	75%	0.752	26%	0.263	S	S	*	.	H	α-helix	trans	-56.3	-28.2	169.8	-86.8	-165.9	173.1	-161.1	0	113	R407 R413	R407-K411 WeakPolarHBondContact O-CB 3.25Å; R407-K411 WeakPolarHBondContact O-CG 3.37Å; R407-K411 PolarHBondContact O-N 2.84Å; K411-R413 PolarHBondContact O-N 2.83Å
412	R	85.9	Confident	89.2	Confident	118 Å²	118	57.5 Å²	57.5	45%	0.445	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-0.3	177.3	-64.8	-175.4	173.3	-168	-6.3	114.5	M409 L410	M409-R412 PolarHBondContact O-N 3.17Å; L410-R412 PolarHBondContact O-N 2.98Å
413	R	87.9	Confident	89.4	Confident	134 Å²	134	56 Å²	56	51%	0.506	24%	0.237	S	C	.	.			trans	49.5	61.8	-178.2	-66.2	-169.4	166.8	141.5	-3.8	114	R362 L410 K411 H434	R362-R413 HydrophobicContact CB-CB 4.07Å; R362-R413 WeakPolarHBondContact CB-O 3.07Å; L410-R413 PolarHBondContact O-N 2.82Å; L410-R413 VanDerWaalsContact O-N 3.08Å; K411-R413 PolarHBondContact O-N 2.83Å; R413-H434 VanDerWaalsContact CA-CE1 3.48Å; R413-H434 WeakPolarHBondContact CA-CE1 3.38Å
414	P	90.6	Very high	89.7	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.019	22%	0.217	C	C	.	.			trans	-65.5	135.5	177.9	29.6	-37.2	0	0	0	112.1	Q393 A395 L410 I416 I417 H434	Q393-P414 HydrophobicContact CB-CB 4.31Å; A395-P414 HydrophobicContact CB-CB 3.88Å; A395-P414 HydrophobicContact CB-CG 3.57Å; L410-P414 HydrophobicContact CD2-CG 4.39Å; P414-I416 VanDerWaalsContact C-N 3.33Å; P414-I417 HydrophobicContact CG-CD1 4.29Å; P414-I417 HydrophobicContact CG-CG1 4.03Å; P414-H434 PolarHBondContact O-NE2 3.07Å
415	E	92.3	Very high	89.9	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	20%	0.195	C	C	.	.	S	Bend	trans	-74	-23.8	178.2	-58.1	94.5	146.7	0	0	113.1	I276 K280 R362 L365 G366 I392 Q393	I276-E415 HydrophobicContact CG2-CB 4.42Å; K280-E415 VanDerWaalsContact CE-OE1 3.3Å; K280-E415 WeakPolarHBondContact CE-OE1 3.26Å; K280-E415 IonicContact NZ-OE1 3.71Å; K280-E415 PolarHBondContact NZ-OE1 3.16Å; R362-E415 HydrophobicContact CB-CG 4.4Å; R362-E415 WeakPolarHBondContact CD-OE1 3.41Å; R362-E415 IonicContact CZ-OE1 3Å; R362-E415 IonicContact NE-OE1 2.64Å; R362-E415 IonicContact NH1-OE1 2.93Å; R362-E415 PolarHBondContact NH1-OE1 2.92Å; R362-E415 IonicContact NH1-OE2 3.22Å; L365-E415 PolarHBondContact N-O 3.05Å; G366-E415 PolarHBondContact N-O 2.74Å; I392-E415 HydrophobicContact CG2-CB 4.39Å; Q393-E415 WeakPolarHBondContact CB-OE2 3.47Å; Q393-E415 PolarHBondContact N-OE2 3.26Å; Q393-E415 PolarHBondContact O-N 2.89Å
416	I	94.1	Very high	90	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.7	175.1	-59.4	177.3	0	0	0	110.7	M272 I273 I276 G366 I383 I392 Q393 T394 A395 P414 I418	M272-I416 HydrophobicContact CG-CD1 4.15Å; M272-I416 HydrophobicContact CG-CG1 4.45Å; M272-I416 HydrophobicContact SD-CD1 3.89Å; M272-I416 HydrophobicContact SD-CG1 4.01Å; M272-I416 HydrophobicContact SD-CG2 3.82Å; I273-I416 HydrophobicContact CG1-CD1 4.45Å; I276-I416 HydrophobicContact CD1-CD1 3.81Å; I276-I416 HydrophobicContact CD1-CG1 3.44Å; I276-I416 VanDerWaalsContact CD1-CG1 3.44Å; G366-I416 WeakPolarHBondContact O-CA 3.38Å; I383-I416 HydrophobicContact CG2-CD1 4.07Å; I392-I416 HydrophobicContact CG2-CD1 3.68Å; I392-I416 HydrophobicContact CG2-CG1 3.94Å; Q393-I416 PolarHBondContact O-N 2.99Å; T394-I416 WeakPolarHBondContact CA-O 3.41Å; T394-I416 HydrophobicContact CG2-CB 4.16Å; T394-I416 HydrophobicContact CG2-CD1 4.4Å; A395-I416 PolarHBondContact N-O 3.16Å; P414-I416 VanDerWaalsContact C-N 3.33Å; I416-I418 HydrophobicContact CG2-CG1 4.18Å
417	I	94.8	Very high	90	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.3	171	-68.2	177.1	0	0	0	110.8	L364 G366 L367 V368 V397 L410 P414 A419 L435	L364-I417 HydrophobicContact CD1-CB 3.93Å; L364-I417 HydrophobicContact CD1-CD1 3.7Å; L364-I417 HydrophobicContact CD1-CG1 3.61Å; L364-I417 HydrophobicContact CD2-CD1 4.02Å; L364-I417 HydrophobicContact CG-CD1 4.47Å; G366-I417 PolarHBondContact O-N 2.97Å; L367-I417 WeakPolarHBondContact CA-O 3.05Å; L367-I417 HydrophobicContact CD1-CB 4.3Å; L367-I417 HydrophobicContact CD1-CG2 4.16Å; V368-I417 PolarHBondContact N-O 3.19Å; V397-I417 HydrophobicContact CB-CG2 4.3Å; V397-I417 HydrophobicContact CG2-CG2 3.87Å; L410-I417 HydrophobicContact CD2-CD1 3.54Å; L410-I417 HydrophobicContact CD2-CG1 4.34Å; P414-I417 HydrophobicContact CG-CD1 4.29Å; P414-I417 HydrophobicContact CG-CG1 4.03Å; I417-A419 HydrophobicContact CG2-CB 4.35Å; I417-L435 HydrophobicContact CD1-CD2 3.55Å
418	I	95.6	Very high	90.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121	179.4	-57.4	158.4	0	0	0	107.9	V368 A376 V379 K380 I383 A395 I396 V397 I416	V368-I418 HydrophobicContact CB-CB 4.44Å; V368-I418 HydrophobicContact CB-CG1 4.11Å; V368-I418 HydrophobicContact CB-CG2 4.29Å; V368-I418 HydrophobicContact CG2-CG1 4.18Å; V368-I418 CarbonylContact O-C 3.57Å; V368-I418 WeakPolarHBondContact O-CA 3.44Å; A376-I418 HydrophobicContact CB-CG2 4.05Å; V379-I418 HydrophobicContact CB-CG2 4.17Å; V379-I418 HydrophobicContact CG1-CD1 4.14Å; V379-I418 HydrophobicContact CG1-CG1 4.34Å; V379-I418 HydrophobicContact CG1-CG2 3.96Å; K380-I418 VanDerWaalsContact CA-CD1 3.48Å; K380-I418 HydrophobicContact CB-CD1 3.81Å; K380-I418 HydrophobicContact CG-CD1 3.93Å; I383-I418 HydrophobicContact CD1-CD1 4.02Å; I383-I418 HydrophobicContact CD1-CG1 4.49Å; A395-I418 PolarHBondContact O-N 2.92Å; I396-I418 CarbonylContact C-O 3.59Å; I396-I418 VanDerWaalsContact CA-O 3.27Å; I396-I418 WeakPolarHBondContact CA-O 3.42Å; V397-I418 PolarHBondContact N-O 2.88Å; I416-I418 HydrophobicContact CG2-CG1 4.18Å
419	A	94	Very high	90.1	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	163.2	-163.5	0	0	0	0	0	115.4	V368 T370 V397 I417 L424	V368-A419 PolarHBondContact O-N 3.46Å; T370-A419 PolarHBondContact N-O 2.84Å; T370-A419 PolarHBondContact OG1-O 2.88Å; V397-A419 HydrophobicContact CB-CB 3.95Å; V397-A419 HydrophobicContact CG1-CB 4.43Å; V397-A419 WeakPolarHBondContact O-CA 3.37Å; V397-A419 WeakPolarHBondContact O-CB 3.17Å; I417-A419 HydrophobicContact CG2-CB 4.35Å; A419-L424 HydrophobicContact CB-CB 4.01Å; A419-L424 HydrophobicContact CB-CD1 4.47Å; A419-L424 HydrophobicContact CB-CD2 4.01Å; A419-L424 HydrophobicContact CB-CG 4.41Å
420	T	91.4	Very high	90	Very high	11 Å²	11	37.7 Å²	37.7	7%	0.067	17%	0.169	C	C	.	.			trans	-100.1	130.7	160.6	50	0	0	0	0	109.7	T370 R373 V397 V398 G422 R423 L424	T370-T420 WeakPolarHBondContact O-CA 3.46Å; T370-T420 WeakPolarHBondContact O-CG2 3.43Å; R373-T420 HydrophobicContact CG-CG2 4.22Å; V397-T420 PolarHBondContact O-N 2.81Å; V397-T420 VanDerWaalsContact O-N 3.08Å; V398-T420 HydrophobicContact CG1-CG2 4.01Å; T420-G422 PolarHBondContact O-N 2.84Å; T420-R423 PolarHBondContact O-N 2.87Å; T420-L424 PolarHBondContact O-N 3.24Å
421	P	89.9	Confident	89.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-47.4	-55	-168.6	-32.1	35.2	0	0	0	115.7	T370 R423 L424 W425 M452 F458 L461	T370-P421 WeakPolarHBondContact O-CD 3.44Å; P421-R423 PolarHBondContact O-N 3.22Å; P421-L424 WeakPolarHBondContact O-CB 3.46Å; P421-L424 PolarHBondContact O-N 2.74Å; P421-L424 VanDerWaalsContact O-N 3.07Å; P421-W425 PolarHBondContact O-N 2.96Å; P421-M452 HydrophobicContact CG-SD 3.95Å; P421-F458 HydrophobicContact CB-CB 4.36Å; P421-F458 HydrophobicContact CB-CD1 4.18Å; P421-F458 HydrophobicContact CB-CG 4.4Å; P421-F458 HydrophobicContact CG-CD1 4.37Å; P421-F458 HydrophobicContact CG-CG 4.39Å; P421-L461 HydrophobicContact CB-CB 3.97Å; P421-L461 HydrophobicContact CB-CD1 4.21Å; P421-L461 HydrophobicContact CG-CB 4.33Å; P421-L461 HydrophobicContact CG-CD1 4.07Å
422	G	88.8	Confident	89.5	Confident	10 Å²	10	32.1 Å²	32.1	10%	0.103	16%	0.155	C	C	.	.	H	α-helix	trans	-54.7	-49.9	-179.5	0	0	0	0	0	113.5	T420 L424 W425 D426	T420-G422 PolarHBondContact O-N 2.84Å; G422-L424 PolarHBondContact O-N 3.2Å; G422-W425 WeakPolarHBondContact O-CB 3.44Å; G422-W425 PolarHBondContact O-N 2.83Å; G422-W425 VanDerWaalsContact O-N 3.14Å; G422-D426 VanDerWaalsContact O-CG 3.3Å; G422-D426 PolarHBondContact O-N 3.38Å
423	R	90.2	Very high	89.2	Confident	36 Å²	36	30.9 Å²	30.9	14%	0.136	16%	0.162	C	C	.	.	H	α-helix	trans	-69.7	-20.9	-180	-172.8	53.2	-170.2	153	12.8	113.8	V397 T420 P421 D426 E430	V397-R423 HydrophobicContact CG1-CG 4.26Å; T420-R423 PolarHBondContact O-N 2.87Å; P421-R423 PolarHBondContact O-N 3.22Å; R423-D426 WeakPolarHBondContact CD-OD2 3.37Å; R423-D426 IonicContact CZ-OD2 3.19Å; R423-D426 IonicContact NE-OD2 2.87Å; R423-D426 IonicContact NH1-OD2 2.66Å; R423-D426 PolarHBondContact NH1-OD2 3.01Å; R423-E430 IonicContact CZ-OE1 3.06Å; R423-E430 VanDerWaalsContact CZ-OE1 3.25Å; R423-E430 IonicContact NH1-OE1 2.62Å; R423-E430 PolarHBondContact NH1-OE1 3.38Å; R423-E430 IonicContact NH2-OE1 2.69Å; R423-E430 PolarHBondContact NH2-OE1 2.73Å
424	L	90.8	Very high	89	Confident	3 Å²	3	25.1 Å²	25.1	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-75	-45.1	171	-178.4	60.5	0	0	0	110.8	L367 L369 V397 A419 T420 P421 G422 L427 I428 L435 L464	L367-L424 HydrophobicContact CD1-CD2 3.71Å; L367-L424 HydrophobicContact CD2-CD2 4.04Å; L367-L424 HydrophobicContact CG-CD2 4.45Å; L369-L424 HydrophobicContact CD2-CD2 3.62Å; V397-L424 HydrophobicContact CG1-CB 4.48Å; V397-L424 HydrophobicContact CG1-CD1 4.39Å; A419-L424 HydrophobicContact CB-CB 4.01Å; A419-L424 HydrophobicContact CB-CD1 4.47Å; A419-L424 HydrophobicContact CB-CD2 4.01Å; A419-L424 HydrophobicContact CB-CG 4.41Å; T420-L424 PolarHBondContact O-N 3.24Å; P421-L424 WeakPolarHBondContact O-CB 3.46Å; P421-L424 PolarHBondContact O-N 2.74Å; P421-L424 VanDerWaalsContact O-N 3.07Å; G422-L424 PolarHBondContact O-N 3.2Å; L424-L427 PolarHBondContact O-N 3.5Å; L424-L427 VanDerWaalsContact O-N 3.16Å; L424-I428 HydrophobicContact CD1-CD1 4.22Å; L424-I428 HydrophobicContact CG-CD1 3.9Å; L424-I428 WeakPolarHBondContact O-CD1 3.3Å; L424-I428 WeakPolarHBondContact O-CG1 3.43Å; L424-I428 PolarHBondContact O-N 3.22Å; L424-L435 HydrophobicContact CD1-CD1 4.18Å; L424-L435 HydrophobicContact CD1-CD2 3.98Å; L424-L464 HydrophobicContact CB-CD1 4.36Å; L424-L464 HydrophobicContact CD2-CD1 3.69Å; L424-L464 HydrophobicContact CG-CD1 3.91Å
425	W	89.8	Confident	88.5	Confident	51 Å²	51	25 Å²	25	19%	0.193	14%	0.141	C	C	.	.	H	α-helix	trans	-58.3	-46.2	174.8	-173.7	-109.2	0	0	0	111.6	P421 G422 L427 I428 N429 E460 N463 L464 M467	P421-W425 PolarHBondContact O-N 2.96Å; G422-W425 WeakPolarHBondContact O-CB 3.44Å; G422-W425 PolarHBondContact O-N 2.83Å; G422-W425 VanDerWaalsContact O-N 3.14Å; W425-L427 VanDerWaalsContact C-N 3.28Å; W425-L427 PolarHBondContact O-N 3.02Å; W425-I428 PolarHBondContact O-N 2.68Å; W425-I428 VanDerWaalsContact O-N 3.17Å; W425-N429 PolarHBondContact NE1-ND2 3.42Å; W425-N429 VanDerWaalsContact O-CG 3.24Å; W425-N429 PolarHBondContact O-N 2.79Å; W425-N429 PolarHBondContact O-ND2 2.9Å; W425-E460 HydrophobicContact CB-CB 3.84Å; W425-E460 HydrophobicContact CG-CB 3.83Å; W425-E460 HydrophobicContact CG-CG 4.41Å; W425-N463 HydrophobicContact CD2-CB 4.42Å; W425-N463 HydrophobicContact CE3-CB 4.33Å; W425-N463 HydrophobicContact CH2-CB 3.48Å; W425-N463 VanDerWaalsContact CH2-CB 3.48Å; W425-N463 HydrophobicContact CZ2-CB 3.55Å; W425-N463 HydrophobicContact CZ3-CB 3.87Å; W425-L464 HydrophobicContact CE3-CB 3.88Å; W425-L464 HydrophobicContact CE3-CD1 4.49Å; W425-L464 HydrophobicContact CZ3-CB 4.26Å; W425-M467 HydrophobicContact CE3-CE 4.29Å; W425-M467 HydrophobicContact CZ3-CB 4.44Å; W425-M467 HydrophobicContact CZ3-CE 3.73Å
426	D	89.6	Confident	87.8	Confident	68 Å²	68	28.8 Å²	28.8	36%	0.364	16%	0.16	S	C	.	.	H	α-helix	trans	-49.5	-48.9	172.5	-60.7	-15.8	0	0	0	111.8	G422 R423 I428 N429 E430	G422-D426 VanDerWaalsContact O-CG 3.3Å; G422-D426 PolarHBondContact O-N 3.38Å; R423-D426 WeakPolarHBondContact CD-OD2 3.37Å; R423-D426 IonicContact CZ-OD2 3.19Å; R423-D426 IonicContact NE-OD2 2.87Å; R423-D426 IonicContact NH1-OD2 2.66Å; R423-D426 PolarHBondContact NH1-OD2 3.01Å; D426-I428 VanDerWaalsContact C-N 3.33Å; D426-I428 PolarHBondContact O-N 2.58Å; D426-N429 CarbonylContact O-C 3.59Å; D426-N429 PolarHBondContact O-N 3.01Å; D426-E430 WeakPolarHBondContact O-CG 3.12Å; D426-E430 PolarHBondContact O-N 2.76Å
427	L	87.9	Confident	86.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-76.8	-19.6	-173.7	-85.7	163.4	0	0	0	113.8	V397 Q406 L410 L424 W425 H432 L435	V397-L427 HydrophobicContact CG1-CD1 3.55Å; Q406-L427 HydrophobicContact CB-CD1 4.49Å; L410-L427 HydrophobicContact CD1-CD1 4.24Å; L424-L427 PolarHBondContact O-N 3.5Å; L424-L427 VanDerWaalsContact O-N 3.16Å; W425-L427 VanDerWaalsContact C-N 3.28Å; W425-L427 PolarHBondContact O-N 3.02Å; L427-H432 VanDerWaalsContact O-CB 3.29Å; L427-H432 WeakPolarHBondContact O-CB 3.43Å; L427-H432 PolarHBondContact O-N 3.26Å; L427-L435 HydrophobicContact CB-CD1 3.6Å
428	I	88.6	Confident	86.1	Confident	17 Å²	17	34.6 Å²	34.6	9%	0.087	19%	0.191	C	C	.	.	H	α-helix	trans	-76	-43.2	169.1	-68	158.4	0	0	0	109.1	L424 W425 D426 E430 G431 L435 L438 L464 M467	L424-I428 HydrophobicContact CD1-CD1 4.22Å; L424-I428 HydrophobicContact CG-CD1 3.9Å; L424-I428 WeakPolarHBondContact O-CD1 3.3Å; L424-I428 WeakPolarHBondContact O-CG1 3.43Å; L424-I428 PolarHBondContact O-N 3.22Å; W425-I428 PolarHBondContact O-N 2.68Å; W425-I428 VanDerWaalsContact O-N 3.17Å; D426-I428 VanDerWaalsContact C-N 3.33Å; D426-I428 PolarHBondContact O-N 2.58Å; I428-E430 VanDerWaalsContact C-N 3.35Å; I428-E430 PolarHBondContact O-N 3.09Å; I428-G431 WeakPolarHBondContact O-CA 3.41Å; I428-G431 PolarHBondContact O-N 3.22Å; I428-L435 HydrophobicContact CG1-CB 3.94Å; I428-L435 HydrophobicContact CG1-CD1 4.49Å; I428-L438 HydrophobicContact CD1-CD1 4.26Å; I428-L464 HydrophobicContact CD1-CD1 4.05Å; I428-M467 HydrophobicContact CD1-CE 4.1Å; I428-M467 HydrophobicContact CG2-CE 3.95Å
429	N	87.3	Confident	85.1	Confident	102 Å²	102	42.1 Å²	42.1	55%	0.545	22%	0.219	S	C	.	.	H	α-helix	trans	-68.4	-30.3	174.7	-59	-23.6	0	0	0	112.7	W425 D426 G431	W425-N429 PolarHBondContact NE1-ND2 3.42Å; W425-N429 VanDerWaalsContact O-CG 3.24Å; W425-N429 PolarHBondContact O-N 2.79Å; W425-N429 PolarHBondContact O-ND2 2.9Å; D426-N429 CarbonylContact O-C 3.59Å; D426-N429 PolarHBondContact O-N 3.01Å; N429-G431 PolarHBondContact O-N 3.5Å; N429-G431 VanDerWaalsContact O-N 3.13Å
430	E	86.2	Confident	84.5	Confident	63 Å²	63	47.2 Å²	47.2	29%	0.294	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-1.8	166.7	-74.8	-179.6	-132.2	0	0	113	Q403 R407 R423 D426 I428 H432	Q403-E430 PolarHBondContact NE2-OE1 3.17Å; Q403-E430 VanDerWaalsContact NE2-OE1 3.13Å; Q403-E430 PolarHBondContact NE2-OE2 2.85Å; R407-E430 IonicContact CZ-OE2 3.89Å; R407-E430 IonicContact NE-OE2 2.84Å; R407-E430 PolarHBondContact NE-OE2 2.82Å; R407-E430 IonicContact NH2-OE2 2.66Å; R407-E430 PolarHBondContact NH2-OE2 2.94Å; R423-E430 IonicContact CZ-OE1 3.06Å; R423-E430 VanDerWaalsContact CZ-OE1 3.25Å; R423-E430 IonicContact NH1-OE1 2.62Å; R423-E430 PolarHBondContact NH1-OE1 3.38Å; R423-E430 IonicContact NH2-OE1 2.69Å; R423-E430 PolarHBondContact NH2-OE1 2.73Å; D426-E430 WeakPolarHBondContact O-CG 3.12Å; D426-E430 PolarHBondContact O-N 2.76Å; I428-E430 VanDerWaalsContact C-N 3.35Å; I428-E430 PolarHBondContact O-N 3.09Å; E430-H432 PolarHBondContact O-N 2.99Å
431	G	81.4	Confident	84.3	Confident	37 Å²	37	46.8 Å²	46.8	38%	0.381	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	24.7	175.8	0	0	0	0	0	114.7	I428 N429 L436	I428-G431 WeakPolarHBondContact O-CA 3.41Å; I428-G431 PolarHBondContact O-N 3.22Å; N429-G431 PolarHBondContact O-N 3.5Å; N429-G431 VanDerWaalsContact O-N 3.13Å; G431-L436 WeakPolarHBondContact O-CD1 3.41Å
432	H	82.7	Confident	84.2	Confident	20 Å²	20	49.4 Å²	49.4	9%	0.093	25%	0.252	C	S	.	.			trans	-65.7	122.4	-172.2	-171.8	-79.3	0	0	0	112	L410 L427 E430 H434 L435 L436	L410-H432 WeakPolarHBondContact CB-CE1 3.42Å; L427-H432 VanDerWaalsContact O-CB 3.29Å; L427-H432 WeakPolarHBondContact O-CB 3.43Å; L427-H432 PolarHBondContact O-N 3.26Å; E430-H432 PolarHBondContact O-N 2.99Å; H432-H434 VanDerWaalsContact C-N 3.31Å; H432-H434 PolarHBondContact ND1-N 2.98Å; H432-H434 PolarHBondContact O-N 3.39Å; H432-H434 VanDerWaalsContact O-N 3.1Å; H432-L435 HydrophobicContact CB-CB 4.4Å; H432-L435 HydrophobicContact CB-CD1 4.21Å; H432-L435 HydrophobicContact CB-CG 4.47Å; H432-L435 WeakPolarHBondContact O-CA 3.26Å; H432-L435 PolarHBondContact O-N 3.4Å; H432-L436 PolarHBondContact O-N 3.22Å
433	P	79.3	Confident	84.3	Confident	92 Å²	92	49 Å²	49	60%	0.597	25%	0.248	S	C	*	.	H	α-helix	trans	-64.4	-27.6	-164.7	22	-34.1	0	0	0	115.1	L435	P433-L435 VanDerWaalsContact C-N 3.3Å
434	H	83	Confident	84.4	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.065	24%	0.241	C	C	.	.	H	α-helix	trans	-75.6	-15.6	173.5	-164.8	63.6	0	0	0	113.9	R362 R413 P414 H432	R362-H434 PolarHBondContact O-CE1 3.02Å; R413-H434 VanDerWaalsContact CA-CE1 3.48Å; R413-H434 WeakPolarHBondContact CA-CE1 3.38Å; P414-H434 PolarHBondContact O-NE2 3.07Å; H432-H434 VanDerWaalsContact C-N 3.31Å; H432-H434 PolarHBondContact ND1-N 2.98Å; H432-H434 PolarHBondContact O-N 3.39Å; H432-H434 VanDerWaalsContact O-N 3.1Å
435	L	81.6	Confident	84.5	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-105	-14	-178.2	-66.2	177.7	0	0	0	113.4	L364 L410 I417 L424 L427 I428 H432 P433 L438	L364-L435 HydrophobicContact CD2-CD2 4.35Å; L410-L435 HydrophobicContact CD1-CD1 3.89Å; L410-L435 HydrophobicContact CD1-CG 4.44Å; I417-L435 HydrophobicContact CD1-CD2 3.55Å; L424-L435 HydrophobicContact CD1-CD1 4.18Å; L424-L435 HydrophobicContact CD1-CD2 3.98Å; L427-L435 HydrophobicContact CB-CD1 3.6Å; I428-L435 HydrophobicContact CG1-CB 3.94Å; I428-L435 HydrophobicContact CG1-CD1 4.49Å; H432-L435 HydrophobicContact CB-CB 4.4Å; H432-L435 HydrophobicContact CB-CD1 4.21Å; H432-L435 HydrophobicContact CB-CG 4.47Å; H432-L435 WeakPolarHBondContact O-CA 3.26Å; H432-L435 PolarHBondContact O-N 3.4Å; P433-L435 VanDerWaalsContact C-N 3.3Å; L435-L438 VanDerWaalsContact O-CD2 3.24Å; L435-L438 WeakPolarHBondContact O-CD2 3.4Å; L435-L438 VanDerWaalsContact O-CG 3.23Å; L435-L438 WeakPolarHBondContact O-CG 3.48Å
436	L	77.1	Confident	84.5	Confident	80 Å²	80	45 Å²	45	42%	0.419	23%	0.233	S	C	.	.	H	α-helix	trans	-74.5	-26.2	174.4	-67.5	174.3	0	0	0	112.8	G431 H432 L438 H472	G431-L436 WeakPolarHBondContact O-CD1 3.41Å; H432-L436 PolarHBondContact O-N 3.22Å; L436-L438 PolarHBondContact O-N 2.87Å; L436-H472 PolarHBondContact O-CE1 3.24Å
437	N	73.1	Confident	84.6	Confident	117 Å²	117	42 Å²	42	63%	0.626	22%	0.217	S	C	*	.			trans	-92.5	49.7	-175	-88.4	-45	0	0	0	114.2	R439	N437-R439 PolarHBondContact O-N 3.37Å; N437-R439 VanDerWaalsContact O-N 3.1Å
438	L	79.3	Confident	84.4	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-69.8	-3.4	-179.1	-52.6	-177.6	0	0	0	114.7	L364 I428 L435 L436 Q440 L441 M467 L468 H472	L364-L438 HydrophobicContact CD2-CD2 3.68Å; I428-L438 HydrophobicContact CD1-CD1 4.26Å; L435-L438 VanDerWaalsContact O-CD2 3.24Å; L435-L438 WeakPolarHBondContact O-CD2 3.4Å; L435-L438 VanDerWaalsContact O-CG 3.23Å; L435-L438 WeakPolarHBondContact O-CG 3.48Å; L436-L438 PolarHBondContact O-N 2.87Å; L438-Q440 PolarHBondContact O-N 3.2Å; L438-L441 WeakPolarHBondContact O-CB 3.36Å; L438-L441 PolarHBondContact O-N 3.06Å; L438-M467 HydrophobicContact CD1-CE 4.02Å; L438-M467 HydrophobicContact CD1-SD 3.92Å; L438-L468 HydrophobicContact CB-CD2 3.93Å; L438-L468 HydrophobicContact CD1-CD2 3.83Å; L438-L468 HydrophobicContact CG-CD2 4.49Å; L438-H472 HydrophobicContact CB-CB 3.91Å
439	R	75.8	Confident	84.1	Confident	158 Å²	158	41.3 Å²	41.3	60%	0.596	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-62.5	-27.5	-179.2	-67.4	-162.5	169.9	162.3	-0.2	113.3	N437 L441 T471 H472	N437-R439 PolarHBondContact O-N 3.37Å; N437-R439 VanDerWaalsContact O-N 3.1Å; R439-L441 VanDerWaalsContact C-N 3.32Å; R439-T471 PolarHBondContact NE-O 2.69Å; R439-T471 VanDerWaalsContact NE-O 3.1Å; R439-T471 PolarHBondContact NH2-O 3.35Å; R439-H472 HydrophobicContact CG-CB 4.36Å; R439-H472 VanDerWaalsContact CG-ND1 3.32Å; R439-H472 WeakPolarHBondContact CG-ND1 3.33Å; R439-H472 PolarHBondContact N-ND1 2.85Å
440	Q	80.6	Confident	83.6	Confident	108 Å²	108	36.6 Å²	36.6	51%	0.505	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-90.1	4.2	-178	-61.1	-176	0.1	0	0	113	P363 L438 K442	P363-Q440 HydrophobicContact CB-CB 4.36Å; L438-Q440 PolarHBondContact O-N 3.2Å; Q440-K442 PolarHBondContact O-N 3.02Å; Q440-K442 VanDerWaalsContact O-N 3.1Å
441	L	86.9	Confident	83	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.182	C	C	.	.			trans	-63.1	111.6	178.4	-174.1	71.3	0	0	0	110.6	L364 L367 L438 R439 L444 L468 N474 R477	L364-L441 HydrophobicContact CG-CD1 4.4Å; L367-L441 HydrophobicContact CB-CD1 3.6Å; L367-L441 HydrophobicContact CB-CD2 4.12Å; L367-L441 HydrophobicContact CD2-CD2 4.26Å; L438-L441 WeakPolarHBondContact O-CB 3.36Å; L438-L441 PolarHBondContact O-N 3.06Å; R439-L441 VanDerWaalsContact C-N 3.32Å; L441-L444 HydrophobicContact CD2-CB 4.44Å; L441-L468 HydrophobicContact CD2-CD1 4.45Å; L441-L468 HydrophobicContact CD2-CD2 3.97Å; L441-N474 PolarHBondContact O-ND2 3.17Å; L441-R477 WeakPolarHBondContact O-CG 3.33Å
442	K	87.9	Confident	82.7	Confident	56 Å²	56	34.3 Å²	34.3	24%	0.243	17%	0.165	C	C	.	.			trans	-89.8	-28.7	177.9	-74.6	-165.7	172.3	-166.6	0	113.3	T275 L365 Q440 R477 Q478	T275-K442 HydrophobicContact CG2-CB 4.04Å; T275-K442 HydrophobicContact CG2-CD 3.83Å; L365-K442 HydrophobicContact CD2-CG 4.38Å; L365-K442 PolarHBondContact O-N 3.01Å; Q440-K442 PolarHBondContact O-N 3.02Å; Q440-K442 VanDerWaalsContact O-N 3.1Å; K442-R477 CarbonylContact O-C 3.58Å; K442-R477 WeakPolarHBondContact O-CA 3.44Å; K442-Q478 PolarHBondContact O-N 3.29Å
443	C	91	Very high	82.3	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.014	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	122.4	-175.3	-174	0	0	0	0	112.1	M272 L365 G366 L367 Q478 F480	M272-C443 HydrophobicContact CE-CB 4.01Å; M272-C443 WeakPolarHBondContact CE-SG 3.43Å; M272-C443 HydrophobicContact CG-CB 4.23Å; L365-C443 PolarHBondContact O-N 3.44Å; G366-C443 WeakPolarHBondContact CA-O 3.2Å; L367-C443 PolarHBondContact N-O 3.38Å; C443-Q478 WeakPolarHBondContact CA-O 3.34Å; C443-F480 VanDerWaalsContact SG-CE2 3.54Å
444	L	92.3	Very high	81.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.9	173	177.2	63.2	0	0	0	109.9	L367 L369 L441 I446 L465 L468 Q478 T479 F480	L367-L444 HydrophobicContact CB-CD1 4.31Å; L367-L444 HydrophobicContact CD2-CD1 4.03Å; L367-L444 HydrophobicContact CG-CD1 4.16Å; L367-L444 CarbonylContact O-C 3.35Å; L369-L444 HydrophobicContact CD1-CD1 4.11Å; L369-L444 HydrophobicContact CG-CD1 4.33Å; L441-L444 HydrophobicContact CD2-CB 4.44Å; L444-I446 HydrophobicContact CD2-CD1 4.39Å; L444-I446 HydrophobicContact CG-CG1 4.35Å; L444-L465 HydrophobicContact CD2-CD2 4.18Å; L444-L468 HydrophobicContact CD1-CD1 4.3Å; L444-L468 HydrophobicContact CD2-CD1 4.19Å; L444-Q478 PolarHBondContact N-O 3.37Å; L444-T479 HydrophobicContact CB-CG2 4.25Å; L444-T479 HydrophobicContact CD2-CG2 4.1Å; L444-T479 HydrophobicContact CG-CG2 4.24Å; L444-T479 CarbonylContact O-C 3.6Å; L444-T479 WeakPolarHBondContact O-CA 3.32Å; L444-F480 PolarHBondContact O-N 3.34Å
445	V	92.9	Very high	80.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	138.1	176.9	-176.8	0	0	0	0	110.2	F268 M272 L367 V368 L369 F480	F268-V445 HydrophobicContact CB-CG1 4.07Å; F268-V445 HydrophobicContact CB-CG2 3.97Å; F268-V445 HydrophobicContact CD1-CG1 3.69Å; F268-V445 HydrophobicContact CD2-CB 4.33Å; F268-V445 HydrophobicContact CD2-CG1 3.69Å; F268-V445 HydrophobicContact CD2-CG2 3.91Å; F268-V445 HydrophobicContact CE1-CG1 3.88Å; F268-V445 HydrophobicContact CE2-CG1 3.89Å; F268-V445 HydrophobicContact CG-CB 4.49Å; F268-V445 HydrophobicContact CG-CG1 3.58Å; F268-V445 HydrophobicContact CG-CG2 4.11Å; F268-V445 HydrophobicContact CZ-CG1 3.97Å; M272-V445 HydrophobicContact CE-CG2 3.52Å; L367-V445 PolarHBondContact O-N 2.96Å; V368-V445 HydrophobicContact CB-CB 4.27Å; V368-V445 HydrophobicContact CG1-CB 3.99Å; V368-V445 HydrophobicContact CG1-CG1 3.98Å; V368-V445 HydrophobicContact CG2-CB 4.07Å; V368-V445 HydrophobicContact CG2-CG2 4.21Å; L369-V445 PolarHBondContact N-O 3.01Å; V445-F480 CarbonylContact C-O 3.6Å; V445-F480 WeakPolarHBondContact CA-O 3.43Å; V445-F480 HydrophobicContact CB-CB 4.37Å; V445-F480 HydrophobicContact CG1-CB 4.21Å; V445-F480 HydrophobicContact CG2-CB 4.06Å; V445-F480 HydrophobicContact CG2-CD2 4.1Å; V445-F480 HydrophobicContact CG2-CG 4.33Å
446	I	91.1	Very high	79.6	Confident	5 Å²	5	48 Å²	48	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	96	-179.1	-56.2	-178.2	0	0	0	107.5	L444 A449 M452 L465 F480 F482 V517	L444-I446 HydrophobicContact CD2-CD1 4.39Å; L444-I446 HydrophobicContact CG-CG1 4.35Å; I446-A449 HydrophobicContact CG2-CB 3.76Å; I446-M452 HydrophobicContact CB-CE 4.46Å; I446-M452 HydrophobicContact CG2-CE 3.34Å; I446-L465 HydrophobicContact CD1-CD2 4.08Å; I446-F480 PolarHBondContact N-O 3.45Å; I446-F482 PolarHBondContact O-N 3.18Å; I446-V517 HydrophobicContact CD1-CB 4.37Å; I446-V517 HydrophobicContact CD1-CG1 3.79Å; I446-V517 HydrophobicContact CD1-CG2 3.58Å
447	D	89.8	Confident	78.8	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.027	24%	0.235	C	C	.	.	S	Bend	trans	-102.6	146.3	-177.4	-168.8	20.5	0	0	0	112.3	K264 F268 L369 P371 A449 M452 F482	K264-D447 WeakPolarHBondContact CE-OD1 3.36Å; F268-D447 HydrophobicContact CE1-CB 4.2Å; L369-D447 PolarHBondContact O-N 2.72Å; L369-D447 VanDerWaalsContact O-N 3.11Å; P371-D447 WeakPolarHBondContact CD-O 3.47Å; D447-A449 VanDerWaalsContact C-N 3.28Å; D447-M452 WeakPolarHBondContact O-CE 3.48Å; D447-F482 WeakPolarHBondContact OD1-CB 3.35Å
448	E	83.9	Confident	78.3	Confident	3 Å²	3	45.1 Å²	45.1	1%	0.014	22%	0.216	C	C	.	.	S	Bend	trans	50	46.1	-162.9	-67.2	-167	154.8	0	0	113.1	P371 L375 D450 R451 F482 R624 G625	P371-E448 HydrophobicContact CG-CB 3.69Å; L375-E448 HydrophobicContact CD2-CB 4.36Å; L375-E448 HydrophobicContact CD2-CG 4.04Å; E448-D450 PolarHBondContact O-N 3.45Å; E448-D450 VanDerWaalsContact O-N 3.17Å; E448-R451 PolarHBondContact O-N 2.86Å; E448-R451 VanDerWaalsContact O-N 3.07Å; E448-F482 PolarHBondContact N-O 3.08Å; E448-R624 WeakPolarHBondContact OE2-CB 3.47Å; E448-G625 PolarHBondContact OE1-N 2.98Å; E448-G625 WeakPolarHBondContact OE2-CA 3.36Å; E448-G625 PolarHBondContact OE2-N 2.79Å
449	A	82.8	Confident	78.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-23.9	-174.3	0	0	0	0	0	114.7	I446 D447 R451 M452 V453 V481 F482 L486 L513	I446-A449 HydrophobicContact CG2-CB 3.76Å; D447-A449 VanDerWaalsContact C-N 3.28Å; A449-R451 VanDerWaalsContact C-N 3.32Å; A449-R451 PolarHBondContact O-N 2.92Å; A449-M452 PolarHBondContact O-N 2.66Å; A449-V453 PolarHBondContact O-N 3.49Å; A449-V481 HydrophobicContact CB-CG1 3.72Å; A449-F482 WeakPolarHBondContact CB-O 3.43Å; A449-F482 PolarHBondContact N-O 3.44Å; A449-L486 HydrophobicContact CB-CD1 3.98Å; A449-L513 HydrophobicContact CB-CD1 3.96Å
450	D	76.9	Confident	78.3	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-57.8	-42.9	171.7	50.4	-75.6	0	0	0	112.5	E448 M452 V453 E454 S483 T485 L486 R624 H648	E448-D450 PolarHBondContact O-N 3.45Å; E448-D450 VanDerWaalsContact O-N 3.17Å; D450-M452 VanDerWaalsContact C-N 3.27Å; D450-M452 PolarHBondContact O-N 2.91Å; D450-V453 PolarHBondContact O-N 2.86Å; D450-E454 PolarHBondContact O-N 2.97Å; D450-E454 VanDerWaalsContact O-N 3.17Å; D450-S483 WeakPolarHBondContact CB-OG 3.41Å; D450-S483 VanDerWaalsContact CG-OG 3.29Å; D450-S483 WeakPolarHBondContact OD1-CB 3.24Å; D450-S483 PolarHBondContact OD1-OG 2.98Å; D450-T485 WeakPolarHBondContact CB-OG1 3.47Å; D450-L486 HydrophobicContact CB-CD2 4.49Å; D450-L486 HydrophobicContact CB-CG 4.36Å; D450-R624 IonicContact OD2-CZ 2.7Å; D450-R624 VanDerWaalsContact OD2-CZ 3.29Å; D450-R624 IonicContact OD2-NE 2.72Å; D450-R624 PolarHBondContact OD2-NE 3.12Å; D450-R624 IonicContact OD2-NH2 2.67Å; D450-R624 PolarHBondContact OD2-NH2 2.7Å; D450-H648 IonicContact OD2-CE1 3.72Å; D450-H648 PolarHBondContact OD2-CE1 2.86Å; D450-H648 IonicContact OD2-NE2 2.66Å
451	R	74.7	Confident	78.3	Confident	45 Å²	45	39.1 Å²	39.1	17%	0.17	21%	0.206	C	C	.	.	H	α-helix	trans	-71.1	-23.8	178.8	177.4	171.3	171.2	172.4	-0.5	112.9	P371 T372 E448 A449 V453	P371-R451 HydrophobicContact CB-CB 4.23Å; P371-R451 HydrophobicContact CB-CG 3.83Å; P371-R451 HydrophobicContact CG-CB 4.2Å; P371-R451 HydrophobicContact CG-CG 4.25Å; T372-R451 VanDerWaalsContact CG2-CZ 3.49Å; E448-R451 PolarHBondContact O-N 2.86Å; E448-R451 VanDerWaalsContact O-N 3.07Å; A449-R451 VanDerWaalsContact C-N 3.32Å; A449-R451 PolarHBondContact O-N 2.92Å; R451-V453 VanDerWaalsContact C-N 3.31Å
452	M	75.3	Confident	78	Confident	6 Å²	6	43.7 Å²	43.7	3%	0.03	23%	0.228	C	C	.	.	H	α-helix	trans	-84.2	-6.2	176.2	-72.4	-174.5	-68.7	0	0	113.4	P371 P421 I446 D447 A449 D450 F458 L461	P371-M452 HydrophobicContact CB-CG 3.83Å; P371-M452 HydrophobicContact CB-SD 4.39Å; P371-M452 HydrophobicContact CG-CG 4.38Å; P421-M452 HydrophobicContact CG-SD 3.95Å; I446-M452 HydrophobicContact CB-CE 4.46Å; I446-M452 HydrophobicContact CG2-CE 3.34Å; D447-M452 WeakPolarHBondContact O-CE 3.48Å; A449-M452 PolarHBondContact O-N 2.66Å; D450-M452 VanDerWaalsContact C-N 3.27Å; D450-M452 PolarHBondContact O-N 2.91Å; M452-F458 HydrophobicContact CG-CD2 4.02Å; M452-F458 HydrophobicContact CG-CE2 4.3Å; M452-L461 HydrophobicContact CB-CD2 3.6Å; M452-L461 HydrophobicContact CG-CD2 4.14Å; M452-L461 HydrophobicContact SD-CD2 4.04Å
453	V	72.9	Confident	77.8	Confident	49 Å²	49	44.3 Å²	44.3	30%	0.297	23%	0.233	S	C	.	.	S	Bend	trans	-115.8	3.5	172.8	-177.4	0	0	0	0	111.6	A449 D450 R451 R455 L513	A449-V453 PolarHBondContact O-N 3.49Å; D450-V453 PolarHBondContact O-N 2.86Å; R451-V453 VanDerWaalsContact C-N 3.31Å; V453-R455 PolarHBondContact O-N 2.97Å; V453-L513 HydrophobicContact CG2-CD1 3.96Å; V453-L513 HydrophobicContact CG2-CG 4.41Å
454	E	71.1	Confident	77.4	Confident	42 Å²	42	44.2 Å²	44.2	20%	0.196	23%	0.233	C	C	.	.	S	Bend	trans	-64.6	123.5	166.8	-82.6	173.8	172.8	0	0	109.8	D450 G456 H457 R624	D450-E454 PolarHBondContact O-N 2.97Å; D450-E454 VanDerWaalsContact O-N 3.17Å; E454-G456 PolarHBondContact O-N 3.17Å; E454-H457 WeakPolarHBondContact O-CB 3.29Å; E454-H457 PolarHBondContact O-N 3.29Å; E454-H457 VanDerWaalsContact O-N 3.11Å; E454-H457 IonicContact OE2-CD2 3.83Å; E454-R624 VanDerWaalsContact CD-NH1 3.27Å; E454-R624 IonicContact OE1-CZ 3.57Å; E454-R624 VanDerWaalsContact OE1-CZ 3.23Å; E454-R624 IonicContact OE1-NH1 2.72Å; E454-R624 PolarHBondContact OE1-NH1 3.34Å; E454-R624 IonicContact OE1-NH2 2.71Å; E454-R624 PolarHBondContact OE1-NH2 2.76Å; E454-R624 IonicContact OE2-CZ 2.7Å; E454-R624 IonicContact OE2-NH1 3.45Å; E454-R624 PolarHBondContact OE2-NH1 2.77Å; E454-R624 IonicContact OE2-NH2 3.89Å
455	R	57.4	Low	76.9	Confident	244 Å²	244	44.6 Å²	44.6	92%	0.921	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	127.3	-174.8	-67.3	-176.6	179.7	-170.7	-2.1	111.6	V453	V453-R455 PolarHBondContact O-N 2.97Å
456	G	59.4	Low	76.4	Confident	80 Å²	80	50.6 Å²	50.6	83%	0.825	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.2	13.8	-177	0	0	0	0	0	114.1	E454	E454-G456 PolarHBondContact O-N 3.17Å
457	H	59.6	Low	76	Confident	89 Å²	89	51.7 Å²	51.7	41%	0.412	27%	0.268	S	S	.	.	S	Bend	trans	-121.4	127.2	171.9	-66.8	-16	0	0	0	110.7	E454	E454-H457 WeakPolarHBondContact O-CB 3.29Å; E454-H457 PolarHBondContact O-N 3.29Å; E454-H457 VanDerWaalsContact O-N 3.11Å; E454-H457 IonicContact OE2-CD2 3.83Å
458	F	63.3	Low	75.5	Confident	48 Å²	48	51.5 Å²	51.5	21%	0.211	27%	0.267	C	S	.	.			trans	57.6	63.7	173.2	-50.1	-70.2	0	0	0	116.2	P371 P421 M452 E460 L461	P371-F458 HydrophobicContact CB-CE2 3.85Å; P371-F458 HydrophobicContact CB-CZ 4.34Å; P421-F458 HydrophobicContact CB-CB 4.36Å; P421-F458 HydrophobicContact CB-CD1 4.18Å; P421-F458 HydrophobicContact CB-CG 4.4Å; P421-F458 HydrophobicContact CG-CD1 4.37Å; P421-F458 HydrophobicContact CG-CG 4.39Å; M452-F458 HydrophobicContact CG-CD2 4.02Å; M452-F458 HydrophobicContact CG-CE2 4.3Å; F458-E460 VanDerWaalsContact C-OE2 3.28Å; F458-E460 WeakPolarHBondContact CA-OE2 3.47Å; F458-E460 PolarHBondContact O-N 2.82Å; F458-L461 HydrophobicContact CB-CB 3.9Å; F458-L461 VanDerWaalsContact O-CB 3.29Å; F458-L461 WeakPolarHBondContact O-CB 3.23Å; F458-L461 PolarHBondContact O-N 2.84Å
459	A	73.8	Confident	75.2	Confident	70 Å²	70	52.8 Å²	52.8	58%	0.579	27%	0.274	S	S	*	.	H	α-helix	trans	-59.1	-31.7	169.3	0	0	0	0	0	111.8	L461 E462	A459-L461 PolarHBondContact O-N 2.92Å; A459-E462 PolarHBondContact O-N 3.34Å
460	E	80.3	Confident	74.8	Confident	66 Å²	66	57 Å²	57	31%	0.308	30%	0.3	S	S	.	.	H	α-helix	trans	-62.6	-22.2	175.5	-45	92.1	142.9	0	0	112.8	W425 F458 L464	W425-E460 HydrophobicContact CB-CB 3.84Å; W425-E460 HydrophobicContact CG-CB 3.83Å; W425-E460 HydrophobicContact CG-CG 4.41Å; F458-E460 VanDerWaalsContact C-OE2 3.28Å; F458-E460 WeakPolarHBondContact CA-OE2 3.47Å; F458-E460 PolarHBondContact O-N 2.82Å; E460-L464 WeakPolarHBondContact O-CB 3.44Å; E460-L464 PolarHBondContact O-N 2.73Å
461	L	81.8	Confident	74.1	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-71.4	-35.2	174	179.4	62.7	0	0	0	111.7	L369 P421 M452 F458 A459 L464 L465	L369-L461 HydrophobicContact CD1-CD1 3.66Å; P421-L461 HydrophobicContact CB-CB 3.97Å; P421-L461 HydrophobicContact CB-CD1 4.21Å; P421-L461 HydrophobicContact CG-CB 4.33Å; P421-L461 HydrophobicContact CG-CD1 4.07Å; M452-L461 HydrophobicContact CB-CD2 3.6Å; M452-L461 HydrophobicContact CG-CD2 4.14Å; M452-L461 HydrophobicContact SD-CD2 4.04Å; F458-L461 HydrophobicContact CB-CB 3.9Å; F458-L461 VanDerWaalsContact O-CB 3.29Å; F458-L461 WeakPolarHBondContact O-CB 3.23Å; F458-L461 PolarHBondContact O-N 2.84Å; A459-L461 PolarHBondContact O-N 2.92Å; L461-L464 HydrophobicContact CD1-CD2 4.47Å; L461-L464 PolarHBondContact O-N 2.93Å; L461-L465 HydrophobicContact CD1-CD1 4.03Å; L461-L465 HydrophobicContact CD1-CD2 4.47Å; L461-L465 HydrophobicContact CD1-CG 3.93Å; L461-L465 HydrophobicContact CG-CD1 3.92Å; L461-L465 HydrophobicContact CG-CG 4.25Å; L461-L465 WeakPolarHBondContact O-CB 3.45Å; L461-L465 VanDerWaalsContact O-CG 3.29Å; L461-L465 WeakPolarHBondContact O-CG 3.46Å; L461-L465 PolarHBondContact O-N 3.3Å
462	E	80.1	Confident	73.7	Confident	96 Å²	96	59.6 Å²	59.6	45%	0.449	32%	0.319	S	S	.	.	H	α-helix	trans	-66.1	-48.7	-179.8	-49.8	-158.6	165.5	0	0	109.2	A459 L464 L465 E466 K516	A459-E462 PolarHBondContact O-N 3.34Å; E462-L464 VanDerWaalsContact C-N 3.33Å; E462-L464 PolarHBondContact O-N 3.1Å; E462-L465 PolarHBondContact O-N 3Å; E462-E466 WeakPolarHBondContact O-CB 3.37Å; E462-E466 PolarHBondContact O-N 3.27Å; E462-K516 IonicContact OE1-NZ 2.74Å; E462-K516 PolarHBondContact OE1-NZ 3.32Å; E462-K516 IonicContact OE2-NZ 3.68Å; E462-K516 PolarHBondContact OE2-NZ 3.36Å
463	N	83.1	Confident	73.4	Confident	69 Å²	69	63.2 Å²	63.2	37%	0.369	34%	0.335	S	S	.	.	H	α-helix	trans	-58.9	-40.8	173.8	-51.4	-3.1	0	0	0	112.5	W425 M467	W425-N463 HydrophobicContact CD2-CB 4.42Å; W425-N463 HydrophobicContact CE3-CB 4.33Å; W425-N463 HydrophobicContact CH2-CB 3.48Å; W425-N463 VanDerWaalsContact CH2-CB 3.48Å; W425-N463 HydrophobicContact CZ2-CB 3.55Å; W425-N463 HydrophobicContact CZ3-CB 3.87Å; N463-M467 VanDerWaalsContact O-CB 3.28Å; N463-M467 WeakPolarHBondContact O-CB 3.19Å; N463-M467 PolarHBondContact O-N 2.7Å
464	L	84	Confident	73.3	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-68.3	-40.2	179.4	-176.1	143.5	0	0	0	112.3	L369 L424 W425 I428 E460 L461 E462 L468	L369-L464 HydrophobicContact CD1-CD2 3.83Å; L424-L464 HydrophobicContact CB-CD1 4.36Å; L424-L464 HydrophobicContact CD2-CD1 3.69Å; L424-L464 HydrophobicContact CG-CD1 3.91Å; W425-L464 HydrophobicContact CE3-CB 3.88Å; W425-L464 HydrophobicContact CE3-CD1 4.49Å; W425-L464 HydrophobicContact CZ3-CB 4.26Å; I428-L464 HydrophobicContact CD1-CD1 4.05Å; E460-L464 WeakPolarHBondContact O-CB 3.44Å; E460-L464 PolarHBondContact O-N 2.73Å; L461-L464 HydrophobicContact CD1-CD2 4.47Å; L461-L464 PolarHBondContact O-N 2.93Å; E462-L464 VanDerWaalsContact C-N 3.33Å; E462-L464 PolarHBondContact O-N 3.1Å; L464-L468 HydrophobicContact CD2-CD1 3.71Å; L464-L468 HydrophobicContact CD2-CG 4.46Å; L464-L468 WeakPolarHBondContact O-CB 3.36Å; L464-L468 WeakPolarHBondContact O-CG 3.46Å; L464-L468 PolarHBondContact O-N 2.97Å
465	L	81.1	Confident	73.1	Confident	7 Å²	7	65.1 Å²	65.1	4%	0.037	35%	0.351	C	S	.	.	H	α-helix	trans	-70.4	-39.5	175.5	-69.4	173.2	0	0	0	111.5	L444 I446 L461 E462 L468 N469 K516 V517	L444-L465 HydrophobicContact CD2-CD2 4.18Å; I446-L465 HydrophobicContact CD1-CD2 4.08Å; L461-L465 HydrophobicContact CD1-CD1 4.03Å; L461-L465 HydrophobicContact CD1-CD2 4.47Å; L461-L465 HydrophobicContact CD1-CG 3.93Å; L461-L465 HydrophobicContact CG-CD1 3.92Å; L461-L465 HydrophobicContact CG-CG 4.25Å; L461-L465 WeakPolarHBondContact O-CB 3.45Å; L461-L465 VanDerWaalsContact O-CG 3.29Å; L461-L465 WeakPolarHBondContact O-CG 3.46Å; L461-L465 PolarHBondContact O-N 3.3Å; E462-L465 PolarHBondContact O-N 3Å; L465-L468 CarbonylContact O-C 3.53Å; L465-L468 PolarHBondContact O-N 2.83Å; L465-N469 VanDerWaalsContact O-CB 3.26Å; L465-N469 WeakPolarHBondContact O-CB 3.4Å; L465-N469 PolarHBondContact O-N 3.41Å; L465-N469 PolarHBondContact O-ND2 3.19Å; L465-N469 VanDerWaalsContact O-ND2 3.1Å; L465-K516 WeakPolarHBondContact CB-O 3.42Å; L465-V517 HydrophobicContact CD1-CG2 3.99Å
466	E	82.3	Confident	74	Confident	127 Å²	127	58.3 Å²	58.3	59%	0.593	34%	0.337	S	S	*	.	H	α-helix	trans	-58.7	-48.3	173.7	-178	169.7	-152.4	0	0	111.3	E462 L468 N469 T470	E462-E466 WeakPolarHBondContact O-CB 3.37Å; E462-E466 PolarHBondContact O-N 3.27Å; E466-L468 PolarHBondContact O-N 3.03Å; E466-N469 CarbonylContact O-C 3.54Å; E466-N469 PolarHBondContact O-N 3.43Å; E466-T470 WeakPolarHBondContact O-CB 3.36Å; E466-T470 PolarHBondContact O-N 3.2Å; E466-T470 PolarHBondContact O-OG1 2.83Å
467	M	81.8	Confident	75.3	Confident	27 Å²	27	55.6 Å²	55.6	13%	0.133	30%	0.302	C	S	.	.	H	α-helix	trans	-64.7	-35.1	177.6	-179.4	-98.2	-68.3	0	0	113.1	W425 I428 L438 N463 N469 T471 H472	W425-M467 HydrophobicContact CE3-CE 4.29Å; W425-M467 HydrophobicContact CZ3-CB 4.44Å; W425-M467 HydrophobicContact CZ3-CE 3.73Å; I428-M467 HydrophobicContact CD1-CE 4.1Å; I428-M467 HydrophobicContact CG2-CE 3.95Å; L438-M467 HydrophobicContact CD1-CE 4.02Å; L438-M467 HydrophobicContact CD1-SD 3.92Å; N463-M467 VanDerWaalsContact O-CB 3.28Å; N463-M467 WeakPolarHBondContact O-CB 3.19Å; N463-M467 PolarHBondContact O-N 2.7Å; M467-N469 VanDerWaalsContact C-N 3.31Å; M467-T471 PolarHBondContact O-N 3.33Å; M467-H472 PolarHBondContact O-N 3.39Å; M467-H472 PolarHBondContact SD-CD2 2.76Å
468	L	80.8	Confident	76.7	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-70.1	-22.3	169.5	-76.7	177.3	0	0	0	113.7	L367 L438 L441 L444 L464 L465 E466 H472 F473 R477	L367-L468 HydrophobicContact CD2-CD1 4.46Å; L438-L468 HydrophobicContact CB-CD2 3.93Å; L438-L468 HydrophobicContact CD1-CD2 3.83Å; L438-L468 HydrophobicContact CG-CD2 4.49Å; L441-L468 HydrophobicContact CD2-CD1 4.45Å; L441-L468 HydrophobicContact CD2-CD2 3.97Å; L444-L468 HydrophobicContact CD1-CD1 4.3Å; L444-L468 HydrophobicContact CD2-CD1 4.19Å; L464-L468 HydrophobicContact CD2-CD1 3.71Å; L464-L468 HydrophobicContact CD2-CG 4.46Å; L464-L468 WeakPolarHBondContact O-CB 3.36Å; L464-L468 WeakPolarHBondContact O-CG 3.46Å; L464-L468 PolarHBondContact O-N 2.97Å; L465-L468 CarbonylContact O-C 3.53Å; L465-L468 PolarHBondContact O-N 2.83Å; E466-L468 PolarHBondContact O-N 3.03Å; L468-H472 HydrophobicContact CD2-CB 4.35Å; L468-H472 CarbonylContact O-C 3.6Å; L468-F473 WeakPolarHBondContact O-CA 3.46Å; L468-F473 PolarHBondContact O-N 2.92Å; L468-R477 PolarHBondContact O-NH1 2.83Å
469	N	76.2	Confident	77.9	Confident	31 Å²	31	49.7 Å²	49.7	17%	0.166	28%	0.275	C	S	.	.	H	α-helix	trans	-98.8	-12.9	-178.2	-72.1	-27.8	0	0	0	113.7	L465 E466 M467 R477 K516 V517 G518	L465-N469 VanDerWaalsContact O-CB 3.26Å; L465-N469 WeakPolarHBondContact O-CB 3.4Å; L465-N469 PolarHBondContact O-N 3.41Å; L465-N469 PolarHBondContact O-ND2 3.19Å; L465-N469 VanDerWaalsContact O-ND2 3.1Å; E466-N469 CarbonylContact O-C 3.54Å; E466-N469 PolarHBondContact O-N 3.43Å; M467-N469 VanDerWaalsContact C-N 3.31Å; N469-R477 PolarHBondContact OD1-NH2 2.52Å; N469-K516 PolarHBondContact ND2-O 3.45Å; N469-V517 VanDerWaalsContact ND2-C 3.33Å; N469-V517 PolarHBondContact ND2-O 3.08Å; N469-V517 VanDerWaalsContact ND2-O 3.17Å; N469-V517 PolarHBondContact OD1-O 3.03Å; N469-G518 WeakPolarHBondContact ND2-CA 3.38Å; N469-G518 PolarHBondContact ND2-N 2.9Å
470	T	74.9	Confident	78.8	Confident	87 Å²	87	46.4 Å²	46.4	53%	0.534	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-88.2	177.4	54.1	0	0	0	0	110.6	E466 H472 F473	E466-T470 WeakPolarHBondContact O-CB 3.36Å; E466-T470 PolarHBondContact O-N 3.2Å; E466-T470 PolarHBondContact O-OG1 2.83Å; T470-H472 VanDerWaalsContact C-N 3.26Å; T470-H472 PolarHBondContact O-N 3.36Å; T470-F473 PolarHBondContact O-N 3.29Å
471	T	61.7	Low	79.2	Confident	77 Å²	77	43.2 Å²	43.2	47%	0.472	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-32	-173.2	-45.7	0	0	0	0	114.2	R439 M467	R439-T471 PolarHBondContact NE-O 2.69Å; R439-T471 VanDerWaalsContact NE-O 3.1Å; R439-T471 PolarHBondContact NH2-O 3.35Å; M467-T471 PolarHBondContact O-N 3.33Å
472	H	67.1	Low	79.5	Confident	26 Å²	26	42.9 Å²	42.9	12%	0.12	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.6	32.4	-179	-60.8	-85.7	0	0	0	113.5	L436 L438 R439 M467 L468 T470 N474	L436-H472 PolarHBondContact O-CE1 3.24Å; L438-H472 HydrophobicContact CB-CB 3.91Å; R439-H472 HydrophobicContact CG-CB 4.36Å; R439-H472 VanDerWaalsContact CG-ND1 3.32Å; R439-H472 WeakPolarHBondContact CG-ND1 3.33Å; R439-H472 PolarHBondContact N-ND1 2.85Å; M467-H472 PolarHBondContact O-N 3.39Å; M467-H472 PolarHBondContact SD-CD2 2.76Å; L468-H472 HydrophobicContact CD2-CB 4.35Å; L468-H472 CarbonylContact O-C 3.6Å; T470-H472 VanDerWaalsContact C-N 3.26Å; T470-H472 PolarHBondContact O-N 3.36Å; H472-N474 PolarHBondContact O-N 3.09Å
473	F	68.8	Low	79.7	Confident	82 Å²	82	38.4 Å²	38.4	36%	0.36	21%	0.21	S	C	.	.			trans	-60.9	128.9	173.3	-175.1	-106.2	0	0	0	111.7	L468 T470 P475 K520	L468-F473 WeakPolarHBondContact O-CA 3.46Å; L468-F473 PolarHBondContact O-N 2.92Å; T470-F473 PolarHBondContact O-N 3.29Å; F473-P475 HydrophobicContact CE1-CB 3.99Å; F473-P475 HydrophobicContact CZ-CB 4.3Å; F473-K520 HydrophobicContact CE2-CD 4.1Å; F473-K520 HydrophobicContact CZ-CD 4.12Å; F473-K520 VanDerWaalsContact CZ-NZ 3.32Å
474	N	70.5	Confident	79.3	Confident	22 Å²	22	35.6 Å²	35.6	12%	0.118	20%	0.197	C	C	.	.			trans	-127.5	117.6	171.2	170.9	12.7	0	0	0	108.3	L441 H472 T476 R477	L441-N474 PolarHBondContact O-ND2 3.17Å; H472-N474 PolarHBondContact O-N 3.09Å; N474-T476 PolarHBondContact ND2-OG1 2.7Å; N474-T476 PolarHBondContact O-N 2.92Å; N474-T476 PolarHBondContact OD1-N 2.9Å; N474-T476 PolarHBondContact OD1-OG1 2.67Å; N474-R477 HydrophobicContact CB-CB 4.09Å; N474-R477 WeakPolarHBondContact O-CB 3.4Å; N474-R477 PolarHBondContact O-N 2.82Å
475	P	66.9	Low	78.6	Confident	110 Å²	110	35.6 Å²	35.6	71%	0.714	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.6	-179.3	29.2	-35.6	0	0	0	113.8	F473	F473-P475 HydrophobicContact CE1-CB 3.99Å; F473-P475 HydrophobicContact CZ-CB 4.3Å
476	T	75.9	Confident	77.9	Confident	101 Å²	101	35.6 Å²	35.6	62%	0.62	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	5.9	177.4	67	0	0	0	0	113.4	N474 Q478	N474-T476 PolarHBondContact ND2-OG1 2.7Å; N474-T476 PolarHBondContact O-N 2.92Å; N474-T476 PolarHBondContact OD1-N 2.9Å; N474-T476 PolarHBondContact OD1-OG1 2.67Å; T476-Q478 PolarHBondContact O-N 2.71Å
477	R	86.9	Confident	76.9	Confident	23 Å²	23	32.5 Å²	32.5	9%	0.087	18%	0.183	C	C	.	.			trans	-78.3	111.9	-175.8	-175.4	-177.5	71.8	-143.7	4.8	111.6	L441 K442 L468 N469 N474	L441-R477 WeakPolarHBondContact O-CG 3.33Å; K442-R477 CarbonylContact O-C 3.58Å; K442-R477 WeakPolarHBondContact O-CA 3.44Å; L468-R477 PolarHBondContact O-NH1 2.83Å; N469-R477 PolarHBondContact OD1-NH2 2.52Å; N474-R477 HydrophobicContact CB-CB 4.09Å; N474-R477 WeakPolarHBondContact O-CB 3.4Å; N474-R477 PolarHBondContact O-N 2.82Å
478	Q	89.1	Confident	75.8	Confident	9 Å²	9	32.6 Å²	32.6	4%	0.042	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	133.9	171.9	-171.3	176.7	33.5	0	0	111.2	A247 M252 K442 C443 L444 T476 F480	A247-Q478 VanDerWaalsContact CA-NE2 3.33Å; A247-Q478 PolarHBondContact O-NE2 3.49Å; M252-Q478 PolarHBondContact O-NE2 2.95Å; K442-Q478 PolarHBondContact O-N 3.29Å; C443-Q478 WeakPolarHBondContact CA-O 3.34Å; L444-Q478 PolarHBondContact N-O 3.37Å; T476-Q478 PolarHBondContact O-N 2.71Å; Q478-F480 HydrophobicContact CB-CE2 4.35Å; Q478-F480 VanDerWaalsContact CD-CZ 3.45Å; Q478-F480 HydrophobicContact CG-CD2 4.34Å; Q478-F480 HydrophobicContact CG-CE2 3.6Å; Q478-F480 HydrophobicContact CG-CZ 3.99Å
479	T	90.1	Very high	74.5	Confident	4 Å²	4	39.1 Å²	39.1	3%	0.025	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131.7	-177.1	-47.3	0	0	0	0	112.5	D253 I254 L444 V517	D253-T479 CarbonylContact C-O 3.45Å; D253-T479 VanDerWaalsContact CA-O 3.31Å; D253-T479 WeakPolarHBondContact CA-O 3.33Å; D253-T479 WeakPolarHBondContact OD1-CA 3.13Å; D253-T479 WeakPolarHBondContact OD1-CB 3.29Å; D253-T479 PolarHBondContact OD1-N 3.01Å; D253-T479 PolarHBondContact OD1-OG1 3.32Å; I254-T479 PolarHBondContact N-O 2.81Å; L444-T479 HydrophobicContact CB-CG2 4.25Å; L444-T479 HydrophobicContact CD2-CG2 4.1Å; L444-T479 HydrophobicContact CG-CG2 4.24Å; L444-T479 CarbonylContact O-C 3.6Å; L444-T479 WeakPolarHBondContact O-CA 3.32Å; T479-V517 HydrophobicContact CG2-CG1 3.53Å
480	F	91.4	Very high	73.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120	179.4	-64.1	-99.3	0	0	0	110	A247 I254 F268 P271 C443 L444 V445 I446 Q478 F482	A247-F480 HydrophobicContact CB-CE1 3.72Å; A247-F480 HydrophobicContact CB-CZ 3.88Å; I254-F480 HydrophobicContact CB-CD1 3.78Å; I254-F480 HydrophobicContact CB-CE1 4.18Å; I254-F480 HydrophobicContact CG1-CD1 3.76Å; I254-F480 HydrophobicContact CG1-CE1 3.61Å; I254-F480 HydrophobicContact CG1-CZ 4.47Å; I254-F480 WeakPolarHBondContact O-CA 3.42Å; F268-F480 HydrophobicContact CB-CB 4.26Å; F268-F480 HydrophobicContact CB-CD1 3.94Å; F268-F480 HydrophobicContact CB-CE1 4.47Å; F268-F480 HydrophobicContact CB-CG 4.05Å; P271-F480 HydrophobicContact CB-CE1 4.3Å; P271-F480 HydrophobicContact CB-CZ 3.72Å; P271-F480 HydrophobicContact CG-CE1 4.27Å; P271-F480 HydrophobicContact CG-CZ 4.19Å; C443-F480 VanDerWaalsContact SG-CE2 3.54Å; L444-F480 PolarHBondContact O-N 3.34Å; V445-F480 CarbonylContact C-O 3.6Å; V445-F480 WeakPolarHBondContact CA-O 3.43Å; V445-F480 HydrophobicContact CB-CB 4.37Å; V445-F480 HydrophobicContact CG1-CB 4.21Å; V445-F480 HydrophobicContact CG2-CB 4.06Å; V445-F480 HydrophobicContact CG2-CD2 4.1Å; V445-F480 HydrophobicContact CG2-CG 4.33Å; I446-F480 PolarHBondContact N-O 3.45Å; Q478-F480 HydrophobicContact CB-CE2 4.35Å; Q478-F480 VanDerWaalsContact CD-CZ 3.45Å; Q478-F480 HydrophobicContact CG-CD2 4.34Å; Q478-F480 HydrophobicContact CG-CE2 3.6Å; Q478-F480 HydrophobicContact CG-CZ 3.99Å; F480-F482 HydrophobicContact CB-CD2 4.29Å; F480-F482 HydrophobicContact CB-CE2 4Å; F480-F482 HydrophobicContact CD1-CE2 4.09Å
481	V	89.6	Confident	71.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.4	174.7	179.2	0	0	0	0	108.9	I254 L255 G256 A449 L486 L513 V517 I519	I254-V481 PolarHBondContact O-N 3.19Å; L255-V481 CarbonylContact C-O 3.57Å; L255-V481 WeakPolarHBondContact CA-O 3.2Å; L255-V481 HydrophobicContact CD1-CB 3.68Å; L255-V481 HydrophobicContact CD1-CG1 3.54Å; G256-V481 PolarHBondContact N-O 2.93Å; A449-V481 HydrophobicContact CB-CG1 3.72Å; V481-L486 HydrophobicContact CG1-CD1 4.15Å; V481-L513 HydrophobicContact CB-CD2 4.34Å; V481-L513 HydrophobicContact CG1-CD1 4.12Å; V481-L513 HydrophobicContact CG1-CD2 3.64Å; V481-L513 HydrophobicContact CG2-CD2 3.86Å; V481-V517 HydrophobicContact CG2-CG1 4.29Å; V481-I519 HydrophobicContact CG2-CD1 4.09Å
482	F	88.1	Confident	70.6	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.4	-179.7	-79.2	-79.9	0	0	0	112.4	I239 I254 G256 K264 A267 F268 I446 D447 E448 A449 F480	I239-F482 HydrophobicContact CD1-CE1 4.14Å; I239-F482 HydrophobicContact CG1-CE1 3.95Å; I254-F482 HydrophobicContact CG2-CZ 4.37Å; G256-F482 WeakPolarHBondContact O-CA 3.4Å; G256-F482 WeakPolarHBondContact O-CD1 3.48Å; K264-F482 HydrophobicContact CB-CD1 4.35Å; K264-F482 HydrophobicContact CD-CB 3.93Å; K264-F482 HydrophobicContact CD-CD1 3.55Å; K264-F482 HydrophobicContact CD-CE1 4.38Å; K264-F482 HydrophobicContact CD-CG 4.03Å; K264-F482 HydrophobicContact CG-CD1 4.15Å; A267-F482 HydrophobicContact CB-CZ 4.25Å; F268-F482 HydrophobicContact CB-CE2 3.96Å; F268-F482 AromaticContact CD1-CD2 3.76Å; F268-F482 HydrophobicContact CD1-CD2 3.76Å; F268-F482 AromaticContact CD1-CE2 3.79Å; F268-F482 HydrophobicContact CD1-CE2 3.79Å; F268-F482 HydrophobicContact CE1-CD2 4.46Å; F268-F482 HydrophobicContact CG-CE2 4.38Å; I446-F482 PolarHBondContact O-N 3.18Å; D447-F482 WeakPolarHBondContact OD1-CB 3.35Å; E448-F482 PolarHBondContact N-O 3.08Å; A449-F482 WeakPolarHBondContact CB-O 3.43Å; A449-F482 PolarHBondContact N-O 3.44Å; F480-F482 HydrophobicContact CB-CD2 4.29Å; F480-F482 HydrophobicContact CB-CE2 4Å; F480-F482 HydrophobicContact CD1-CE2 4.09Å
483	S	83.4	Confident	69.1	Low	2 Å²	2	44.8 Å²	44.8	1%	0.014	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	165.5	178.1	173.4	0	0	0	0	110.2	G256 A257 A258 D450 T485 L486	G256-S483 PolarHBondContact O-N 3.37Å; G256-S483 VanDerWaalsContact O-N 3.14Å; A257-S483 CarbonylContact C-O 3.54Å; A257-S483 WeakPolarHBondContact CA-O 3.44Å; A258-S483 PolarHBondContact N-O 2.72Å; A258-S483 VanDerWaalsContact O-O 3.1Å; D450-S483 WeakPolarHBondContact CB-OG 3.41Å; D450-S483 VanDerWaalsContact CG-OG 3.29Å; D450-S483 WeakPolarHBondContact OD1-CB 3.24Å; D450-S483 PolarHBondContact OD1-OG 2.98Å; S483-T485 PolarHBondContact OG-N 2.92Å; S483-L486 PolarHBondContact OG-N 3.31Å
484	A	74.9	Confident	67.5	Low	10 Å²	10	45.7 Å²	45.7	8%	0.083	28%	0.284	C	S	.	.	S	Bend	trans	-98	-11	166.3	0	0	0	0	0	113.8
485	T	69.1	Low	66.2	Low	1 Å²	1	55.8 Å²	55.8	1%	0.006	32%	0.321	C	S	.	.	S	Bend	trans	-133.6	-12.7	-165.5	63.2	0	0	0	0	116.2	D450 S483 M487 M488 E644 H648	D450-T485 WeakPolarHBondContact CB-OG1 3.47Å; S483-T485 PolarHBondContact OG-N 2.92Å; T485-M487 PolarHBondContact O-N 2.72Å; T485-M487 VanDerWaalsContact O-N 3.08Å; T485-M488 HydrophobicContact CG2-CE 3.59Å; T485-M488 PolarHBondContact O-N 2.86Å; T485-E644 HydrophobicContact CG2-CB 4.06Å; T485-E644 HydrophobicContact CG2-CG 4.07Å; T485-E644 PolarHBondContact OG1-OE2 2.81Å; T485-E644 VanDerWaalsContact OG1-OE2 3.06Å; T485-H648 VanDerWaalsContact CG2-CE1 3.48Å; T485-H648 WeakPolarHBondContact CG2-CE1 3.33Å
486	L	66.9	Low	65.2	Low	8 Å²	8	56.5 Å²	56.5	4%	0.042	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-26.2	-174.4	-79.2	172.9	0	0	0	115.6	A449 D450 V481 S483 K509 L513	A449-L486 HydrophobicContact CB-CD1 3.98Å; D450-L486 HydrophobicContact CB-CD2 4.49Å; D450-L486 HydrophobicContact CB-CG 4.36Å; V481-L486 HydrophobicContact CG1-CD1 4.15Å; S483-L486 PolarHBondContact OG-N 3.31Å; L486-K509 HydrophobicContact CD2-CB 4.3Å; L486-L513 HydrophobicContact CD1-CD1 3.56Å; L486-L513 HydrophobicContact CD2-CD1 4.05Å; L486-L513 HydrophobicContact CG-CD1 4.48Å
487	M	61.2	Low	63.5	Low	62 Å²	62	58.5 Å²	58.5	31%	0.305	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-4.5	179.5	-67.1	-174.1	63.9	0	0	114.1	A257 T485 L510 V525 D527	A257-M487 HydrophobicContact CB-CB 4.34Å; A257-M487 HydrophobicContact CB-CG 3.96Å; A257-M487 HydrophobicContact CB-SD 3.59Å; A257-M487 VanDerWaalsContact CB-SD 3.59Å; T485-M487 PolarHBondContact O-N 2.72Å; T485-M487 VanDerWaalsContact O-N 3.08Å; M487-L510 HydrophobicContact CG-CD1 4.12Å; M487-V525 HydrophobicContact CE-CG1 3.64Å; M487-V525 HydrophobicContact SD-CG1 3.53Å; M487-V525 VanDerWaalsContact SD-CG1 3.53Å; M487-D527 HydrophobicContact CE-CB 3.75Å; M487-D527 WeakPolarHBondContact CE-OD2 3.37Å; M487-D527 HydrophobicContact SD-CB 3.82Å
488	M	59.5	Low	61.4	Low	29 Å²	29	65.8 Å²	65.8	14%	0.143	36%	0.364	C	S	.	.	S	Bend	trans	-71.9	136.4	174	-71.9	-163.4	-68.4	0	0	111.6	T485 H490 A533 E644	T485-M488 HydrophobicContact CG2-CE 3.59Å; T485-M488 PolarHBondContact O-N 2.86Å; M488-H490 PolarHBondContact O-CD2 3.13Å; M488-H490 PolarHBondContact O-N 3.13Å; M488-A533 HydrophobicContact SD-CB 3.52Å; M488-A533 VanDerWaalsContact SD-CB 3.52Å; M488-E644 HydrophobicContact CE-CG 4.3Å
489	V	52.2	Low	59.3	Low	137 Å²	137	74.5 Å²	74.5	83%	0.83	40%	0.401	S	S	*	.			trans	-72.9	95.1	-177.5	-177.1	0	0	0	0	110.9	G491	V489-G491 PolarHBondContact O-N 2.89Å; V489-G491 VanDerWaalsContact O-N 3.07Å
490	H	54	Low	56.8	Low	56 Å²	56	84 Å²	84	26%	0.259	44%	0.443	S	S	.	.			trans	-78	89.5	178.8	-77.1	-76.1	0	0	0	112.9	M488 L492 K509 E644	M488-H490 PolarHBondContact O-CD2 3.13Å; M488-H490 PolarHBondContact O-N 3.13Å; H490-L492 PolarHBondContact O-N 3.39Å; H490-L492 VanDerWaalsContact O-N 3.09Å; H490-K509 VanDerWaalsContact CD2-CE 3.45Å; H490-K509 WeakPolarHBondContact CD2-CE 3.33Å; H490-K509 PolarHBondContact CD2-NZ 2.78Å; H490-K509 VanDerWaalsContact CD2-NZ 3.26Å; H490-K509 PolarHBondContact CE1-NZ 3Å; H490-K509 VanDerWaalsContact CE1-NZ 3.34Å; H490-K509 PolarHBondContact NE2-NZ 3.15Å; H490-E644 IonicContact CE1-OE1 2.71Å; H490-E644 PolarHBondContact CE1-OE1 3.42Å; H490-E644 IonicContact CE1-OE2 2.74Å; H490-E644 IonicContact ND1-OE1 3.73Å; H490-E644 IonicContact NE2-OE1 3.94Å; H490-E644 IonicContact NE2-OE2 3.89Å
491	G	41.8	Very low	54	Low	71 Å²	71	94.4 Å²	94.4	73%	0.732	49%	0.488	S	S	*	.			trans	-59.1	110.3	162.1	0	0	0	0	0	111.1	V489	V489-G491 PolarHBondContact O-N 2.89Å; V489-G491 VanDerWaalsContact O-N 3.07Å
492	L	35.3	Very low	51.4	Low	117 Å²	117	105.4 Å²	105.4	61%	0.613	53%	0.529	S	S	*	.			trans	-57.8	141.2	177.5	-83.3	151.8	0	0	0	111.5	H490 S494	H490-L492 PolarHBondContact O-N 3.39Å; H490-L492 VanDerWaalsContact O-N 3.09Å; L492-S494 PolarHBondContact O-N 2.94Å; L492-S494 VanDerWaalsContact O-N 3.08Å
493	P	35.8	Very low	48.7	Very low	97 Å²	97	114.7 Å²	114.7	63%	0.63	57%	0.573	S	S	*	*			trans	-58.8	115.6	-179.5	-25.5	34.8	0	0	0	112.5	R495 V496	P493-R495 PolarHBondContact O-N 3.41Å; P493-V496 PolarHBondContact O-N 3.21Å
494	S	35.1	Very low	46.4	Very low	101 Å²	101	122.5 Å²	122.5	71%	0.706	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	20.7	-169.1	-34.4	0	0	0	0	115.9	L492	L492-S494 PolarHBondContact O-N 2.94Å; L492-S494 VanDerWaalsContact O-N 3.08Å
495	R	44.1	Very low	44.6	Very low	234 Å²	234	127.7 Å²	127.7	88%	0.883	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-9.5	177	-72.1	-174.8	173.8	175	-2.2	114.3	P493	P493-R495 PolarHBondContact O-N 3.41Å
496	V	44.3	Very low	43.3	Very low	124 Å²	124	132.9 Å²	132.9	75%	0.752	68%	0.676	S	S	*	*	S	Bend	trans	-88.6	-25.3	175.7	-174.7	0	0	0	0	111.9	P493 Q498	P493-V496 PolarHBondContact O-N 3.21Å; V496-Q498 VanDerWaalsContact C-N 3.29Å; V496-Q498 PolarHBondContact O-N 2.72Å; V496-Q498 VanDerWaalsContact O-N 3.17Å
497	L	40.3	Very low	42.6	Very low	143 Å²	143	138.3 Å²	138.3	75%	0.749	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	4.5	-171	-84.5	155.2	0	0	0	116.4
498	Q	44.2	Very low	42.6	Very low	176 Å²	176	137.4 Å²	137.4	82%	0.822	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	2.1	-173.4	-77.6	-167.6	-25.9	0	0	116.1	V496	V496-Q498 VanDerWaalsContact C-N 3.29Å; V496-Q498 PolarHBondContact O-N 2.72Å; V496-Q498 VanDerWaalsContact O-N 3.17Å
499	K	44.6	Very low	42.9	Very low	192 Å²	192	139 Å²	139	84%	0.835	70%	0.702	S	S	*	*	S	Bend	trans	-136.3	132.7	168.3	-72	-169	176.9	-177.6	0	111.9
500	K	36.4	Very low	43.6	Very low	205 Å²	205	134.3 Å²	134.3	89%	0.891	67%	0.672	S	S	*	*			trans	69.5	107.6	-172.4	-60	-175.2	176.9	-178.6	0	114.9	R502	K500-R502 PolarHBondContact O-N 3.21Å; K500-R502 VanDerWaalsContact O-N 3.07Å
501	K	33.9	Very low	44.4	Very low	218 Å²	218	136 Å²	136	95%	0.948	68%	0.68	S	S	*	*			trans	-66.1	98	157.7	-81.7	-176	172.8	-177.3	0	109.1
502	R	33.5	Very low	45.7	Very low	230 Å²	230	135.3 Å²	135.3	87%	0.868	66%	0.659	S	S	*	*			trans	-121	135.8	140.3	-84.5	-175.1	167.5	175.8	-5.2	105.9	K500 L504	K500-R502 PolarHBondContact O-N 3.21Å; K500-R502 VanDerWaalsContact O-N 3.07Å; R502-L504 PolarHBondContact O-N 3.03Å; R502-L504 VanDerWaalsContact O-N 3.1Å
503	Q	31.8	Very low	47.5	Very low	196 Å²	196	130.1 Å²	130.1	92%	0.916	63%	0.631	S	S	*	*			trans	-65.6	109.7	160.1	-79.2	168.4	-59.9	0	0	105.8
504	L	35.9	Very low	49.3	Very low	166 Å²	166	127.7 Å²	127.7	87%	0.869	61%	0.612	S	S	*	*			trans	-106.5	113.9	162.2	-170.6	76.3	0	0	0	104	R502 S506	R502-L504 PolarHBondContact O-N 3.03Å; R502-L504 VanDerWaalsContact O-N 3.1Å; L504-S506 PolarHBondContact O-N 3.07Å
505	D	36.7	Very low	51.1	Low	119 Å²	119	128.3 Å²	128.3	64%	0.636	60%	0.604	S	S	*	*			trans	-55.6	135.9	-173.7	-63.2	-46.1	0	0	0	110.1	R507	D505-R507 HydrophobicContact CB-CG 4.16Å; D505-R507 PolarHBondContact O-N 3.1Å
506	S	41.1	Very low	52.4	Low	110 Å²	110	120.8 Å²	120.8	77%	0.769	58%	0.578	S	S	*	*			trans	-77.8	55.2	174.7	57.9	0	0	0	0	110.3	L504 S508	L504-S506 PolarHBondContact O-N 3.07Å; S506-S508 PolarHBondContact O-N 3.44Å
507	R	52.2	Low	53.7	Low	122 Å²	122	115 Å²	115	46%	0.46	54%	0.543	S	S	.	.			trans	-51.4	132.9	173.3	-68.7	-172.2	-177.3	-171.8	-2.4	108.8	D505 E511 I512 E515	D505-R507 HydrophobicContact CB-CG 4.16Å; D505-R507 PolarHBondContact O-N 3.1Å; R507-E511 WeakPolarHBondContact CA-OE2 3.27Å; R507-E511 WeakPolarHBondContact CB-OE2 3.34Å; R507-I512 HydrophobicContact CB-CD1 4.23Å; R507-I512 HydrophobicContact CB-CG1 3.99Å; R507-E515 IonicContact CZ-OE1 3.83Å; R507-E515 IonicContact CZ-OE2 3.93Å; R507-E515 IonicContact NH1-OE1 2.7Å; R507-E515 PolarHBondContact NH1-OE1 3.08Å; R507-E515 IonicContact NH1-OE2 2.72Å; R507-E515 PolarHBondContact NH1-OE2 3.06Å
508	S	62.8	Low	55	Low	42 Å²	42	109.1 Å²	109.1	29%	0.294	52%	0.517	S	S	.	.			trans	-65.8	155	178.1	71.5	0	0	0	0	110.7	S506 L510 E511 I512	S506-S508 PolarHBondContact O-N 3.44Å; S508-L510 PolarHBondContact O-N 3.14Å; S508-L510 VanDerWaalsContact O-N 3.1Å; S508-L510 PolarHBondContact OG-N 3.37Å; S508-E511 WeakPolarHBondContact CB-OE1 3.39Å; S508-E511 VanDerWaalsContact N-CD 3.29Å; S508-E511 PolarHBondContact N-OE1 2.94Å; S508-E511 PolarHBondContact N-OE2 2.86Å; S508-E511 PolarHBondContact O-N 3.14Å; S508-E511 WeakPolarHBondContact OG-CG 3.47Å; S508-E511 PolarHBondContact OG-N 3.37Å; S508-E511 VanDerWaalsContact OG-N 3.07Å; S508-E511 PolarHBondContact OG-OE1 3.01Å; S508-I512 WeakPolarHBondContact O-CG1 3.27Å; S508-I512 PolarHBondContact O-N 3Å; S508-I512 VanDerWaalsContact O-N 3.13Å
509	K	65	Low	56.2	Low	63 Å²	63	101.6 Å²	101.6	27%	0.274	48%	0.482	S	S	.	.	H	α-helix	trans	-53.2	-31.4	170.7	-75.7	-173.2	176.7	176.2	0	111.8	L486 H490 L513 E644	L486-K509 HydrophobicContact CD2-CB 4.3Å; H490-K509 VanDerWaalsContact CD2-CE 3.45Å; H490-K509 WeakPolarHBondContact CD2-CE 3.33Å; H490-K509 PolarHBondContact CD2-NZ 2.78Å; H490-K509 VanDerWaalsContact CD2-NZ 3.26Å; H490-K509 PolarHBondContact CE1-NZ 3Å; H490-K509 VanDerWaalsContact CE1-NZ 3.34Å; H490-K509 PolarHBondContact NE2-NZ 3.15Å; K509-L513 WeakPolarHBondContact O-CB 3.4Å; K509-L513 PolarHBondContact O-N 3.37Å; K509-L513 VanDerWaalsContact O-N 3.1Å; K509-E644 IonicContact NZ-OE1 3.9Å; K509-E644 PolarHBondContact NZ-OE1 3.25Å; K509-E644 IonicContact NZ-OE2 2.71Å; K509-E644 PolarHBondContact NZ-OE2 3.05Å
510	L	67.4	Low	56.9	Low	38 Å²	38	99.9 Å²	99.9	20%	0.199	47%	0.474	C	S	.	.	H	α-helix	trans	-70.5	-46.3	-179.4	-172.9	160.2	0	0	0	111.2	L255 M487 S508 L513 M514	L255-L510 HydrophobicContact CD2-CD1 3.59Å; L255-L510 HydrophobicContact CD2-CD2 4.1Å; L255-L510 HydrophobicContact CD2-CG 3.69Å; M487-L510 HydrophobicContact CG-CD1 4.12Å; S508-L510 PolarHBondContact O-N 3.14Å; S508-L510 VanDerWaalsContact O-N 3.1Å; S508-L510 PolarHBondContact OG-N 3.37Å; L510-L513 PolarHBondContact O-N 2.89Å; L510-M514 HydrophobicContact CD2-CG 4.2Å; L510-M514 HydrophobicContact CD2-SD 3.55Å; L510-M514 VanDerWaalsContact CD2-SD 3.55Å; L510-M514 WeakPolarHBondContact O-CG 3.49Å; L510-M514 PolarHBondContact O-N 3.36Å
511	E	70.2	Confident	58.2	Low	91 Å²	91	92.8 Å²	92.8	43%	0.425	45%	0.451	S	S	.	.	H	α-helix	trans	-59.2	-49.7	173	-73.6	141	-120.8	0	0	111.8	R507 S508 L513 M514 E515	R507-E511 WeakPolarHBondContact CA-OE2 3.27Å; R507-E511 WeakPolarHBondContact CB-OE2 3.34Å; S508-E511 WeakPolarHBondContact CB-OE1 3.39Å; S508-E511 VanDerWaalsContact N-CD 3.29Å; S508-E511 PolarHBondContact N-OE1 2.94Å; S508-E511 PolarHBondContact N-OE2 2.86Å; S508-E511 PolarHBondContact O-N 3.14Å; S508-E511 WeakPolarHBondContact OG-CG 3.47Å; S508-E511 PolarHBondContact OG-N 3.37Å; S508-E511 VanDerWaalsContact OG-N 3.07Å; S508-E511 PolarHBondContact OG-OE1 3.01Å; E511-L513 PolarHBondContact O-N 3.39Å; E511-M514 PolarHBondContact O-N 2.88Å; E511-M514 VanDerWaalsContact O-N 3.13Å; E511-E515 VanDerWaalsContact O-CB 3.3Å; E511-E515 WeakPolarHBondContact O-CB 3.5Å; E511-E515 PolarHBondContact O-N 3.38Å
512	I	70.2	Confident	60.1	Low	58 Å²	58	91.3 Å²	91.3	30%	0.297	44%	0.444	S	S	.	.	H	α-helix	trans	-58.7	-35.1	179.7	-63.8	168.5	0	0	0	110.8	R507 S508 K516	R507-I512 HydrophobicContact CB-CD1 4.23Å; R507-I512 HydrophobicContact CB-CG1 3.99Å; S508-I512 WeakPolarHBondContact O-CG1 3.27Å; S508-I512 PolarHBondContact O-N 3Å; S508-I512 VanDerWaalsContact O-N 3.13Å; I512-K516 HydrophobicContact CG2-CD 4.36Å; I512-K516 WeakPolarHBondContact O-CB 3.15Å; I512-K516 VanDerWaalsContact O-CG 3.3Å; I512-K516 WeakPolarHBondContact O-CG 3.12Å; I512-K516 PolarHBondContact O-N 3.15Å; I512-K516 VanDerWaalsContact O-N 3.17Å
513	L	71.9	Confident	62.4	Low	7 Å²	7	81 Å²	81	4%	0.037	41%	0.407	C	S	.	.	H	α-helix	trans	-74.8	-44.9	175.7	-172	156.1	0	0	0	112	A449 V453 V481 L486 K509 L510 E511 E515 K516 V517	A449-L513 HydrophobicContact CB-CD1 3.96Å; V453-L513 HydrophobicContact CG2-CD1 3.96Å; V453-L513 HydrophobicContact CG2-CG 4.41Å; V481-L513 HydrophobicContact CB-CD2 4.34Å; V481-L513 HydrophobicContact CG1-CD1 4.12Å; V481-L513 HydrophobicContact CG1-CD2 3.64Å; V481-L513 HydrophobicContact CG2-CD2 3.86Å; L486-L513 HydrophobicContact CD1-CD1 3.56Å; L486-L513 HydrophobicContact CD2-CD1 4.05Å; L486-L513 HydrophobicContact CG-CD1 4.48Å; K509-L513 WeakPolarHBondContact O-CB 3.4Å; K509-L513 PolarHBondContact O-N 3.37Å; K509-L513 VanDerWaalsContact O-N 3.1Å; L510-L513 PolarHBondContact O-N 2.89Å; E511-L513 PolarHBondContact O-N 3.39Å; L513-E515 VanDerWaalsContact C-N 3.29Å; L513-E515 PolarHBondContact O-N 3.39Å; L513-K516 PolarHBondContact O-N 3.49Å; L513-V517 HydrophobicContact CD2-CB 4.37Å; L513-V517 HydrophobicContact CD2-CG2 3.66Å; L513-V517 HydrophobicContact CG-CG2 4.07Å; L513-V517 VanDerWaalsContact O-CB 3.3Å; L513-V517 WeakPolarHBondContact O-CB 3.48Å; L513-V517 VanDerWaalsContact O-CG2 3.25Å; L513-V517 WeakPolarHBondContact O-CG2 3.46Å; L513-V517 PolarHBondContact O-N 3.33Å
514	M	74.3	Confident	65	Low	46 Å²	46	76 Å²	76	23%	0.227	38%	0.382	C	S	.	.	H	α-helix	trans	-59	-42	176.9	-76.8	-177.9	57.9	0	0	112	L510 E511 G518 I519 P523	L510-M514 HydrophobicContact CD2-CG 4.2Å; L510-M514 HydrophobicContact CD2-SD 3.55Å; L510-M514 VanDerWaalsContact CD2-SD 3.55Å; L510-M514 WeakPolarHBondContact O-CG 3.49Å; L510-M514 PolarHBondContact O-N 3.36Å; E511-M514 PolarHBondContact O-N 2.88Å; E511-M514 VanDerWaalsContact O-N 3.13Å; M514-G518 PolarHBondContact O-N 3.45Å; M514-I519 HydrophobicContact CE-CG2 4.19Å; M514-I519 HydrophobicContact CG-CD1 4.44Å; M514-I519 PolarHBondContact O-N 2.86Å; M514-I519 VanDerWaalsContact O-N 3.11Å; M514-P523 VanDerWaalsContact CE-CD 3.49Å; M514-P523 HydrophobicContact CE-CG 3.76Å; M514-P523 HydrophobicContact SD-CG 3.99Å
515	E	72.7	Confident	67.2	Low	115 Å²	115	71.2 Å²	71.2	54%	0.537	36%	0.36	S	S	.	.	H	α-helix	trans	-58.9	-52.8	174.4	-175.1	172.8	-149.5	0	0	111	R507 E511 L513 G518	R507-E515 IonicContact CZ-OE1 3.83Å; R507-E515 IonicContact CZ-OE2 3.93Å; R507-E515 IonicContact NH1-OE1 2.7Å; R507-E515 PolarHBondContact NH1-OE1 3.08Å; R507-E515 IonicContact NH1-OE2 2.72Å; R507-E515 PolarHBondContact NH1-OE2 3.06Å; E511-E515 VanDerWaalsContact O-CB 3.3Å; E511-E515 WeakPolarHBondContact O-CB 3.5Å; E511-E515 PolarHBondContact O-N 3.38Å; L513-E515 VanDerWaalsContact C-N 3.29Å; L513-E515 PolarHBondContact O-N 3.39Å; E515-G518 PolarHBondContact O-N 3.23Å
516	K	70.8	Confident	69.4	Low	75 Å²	75	66 Å²	66	33%	0.326	33%	0.332	S	S	.	.	H	α-helix	trans	-65.5	-39.5	178.8	-75.7	-178.4	171.9	-169.6	0	114.1	E462 L465 N469 I512 L513 G518	E462-K516 IonicContact OE1-NZ 2.74Å; E462-K516 PolarHBondContact OE1-NZ 3.32Å; E462-K516 IonicContact OE2-NZ 3.68Å; E462-K516 PolarHBondContact OE2-NZ 3.36Å; L465-K516 WeakPolarHBondContact CB-O 3.42Å; N469-K516 PolarHBondContact ND2-O 3.45Å; I512-K516 HydrophobicContact CG2-CD 4.36Å; I512-K516 WeakPolarHBondContact O-CB 3.15Å; I512-K516 VanDerWaalsContact O-CG 3.3Å; I512-K516 WeakPolarHBondContact O-CG 3.12Å; I512-K516 PolarHBondContact O-N 3.15Å; I512-K516 VanDerWaalsContact O-N 3.17Å; L513-K516 PolarHBondContact O-N 3.49Å; K516-G518 VanDerWaalsContact C-N 3.25Å; K516-G518 PolarHBondContact O-N 3.31Å
517	V	72.7	Confident	71.3	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.024	31%	0.313	C	S	.	.	H	α-helix	trans	-76.3	-16.2	-179.3	176.6	0	0	0	0	111.7	I446 L465 N469 T479 V481 L513 I519	I446-V517 HydrophobicContact CD1-CB 4.37Å; I446-V517 HydrophobicContact CD1-CG1 3.79Å; I446-V517 HydrophobicContact CD1-CG2 3.58Å; L465-V517 HydrophobicContact CD1-CG2 3.99Å; N469-V517 VanDerWaalsContact ND2-C 3.33Å; N469-V517 PolarHBondContact ND2-O 3.08Å; N469-V517 VanDerWaalsContact ND2-O 3.17Å; N469-V517 PolarHBondContact OD1-O 3.03Å; T479-V517 HydrophobicContact CG2-CG1 3.53Å; V481-V517 HydrophobicContact CG2-CG1 4.29Å; L513-V517 HydrophobicContact CD2-CB 4.37Å; L513-V517 HydrophobicContact CD2-CG2 3.66Å; L513-V517 HydrophobicContact CG-CG2 4.07Å; L513-V517 VanDerWaalsContact O-CB 3.3Å; L513-V517 WeakPolarHBondContact O-CB 3.48Å; L513-V517 VanDerWaalsContact O-CG2 3.25Å; L513-V517 WeakPolarHBondContact O-CG2 3.46Å; L513-V517 PolarHBondContact O-N 3.33Å; V517-I519 HydrophobicContact CB-CD1 4.43Å; V517-I519 HydrophobicContact CB-CG1 4.29Å; V517-I519 HydrophobicContact CG1-CD1 4.02Å; V517-I519 HydrophobicContact CG1-CG1 3.87Å
518	G	66.6	Low	72.3	Confident	19 Å²	19	61.5 Å²	61.5	20%	0.196	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	28.2	175.9	0	0	0	0	0	113.6	N469 M514 E515 K516 K520	N469-G518 WeakPolarHBondContact ND2-CA 3.38Å; N469-G518 PolarHBondContact ND2-N 2.9Å; M514-G518 PolarHBondContact O-N 3.45Å; E515-G518 PolarHBondContact O-N 3.23Å; K516-G518 VanDerWaalsContact C-N 3.25Å; K516-G518 PolarHBondContact O-N 3.31Å; G518-K520 PolarHBondContact O-N 2.95Å
519	I	70.5	Confident	72.3	Confident	17 Å²	17	61 Å²	61	9%	0.087	30%	0.303	C	S	.	.			trans	-74.2	92.6	179.2	-61	176.6	0	0	0	108.3	D253 V481 M514 V517 P523	D253-I519 HydrophobicContact CB-CG2 4.21Å; V481-I519 HydrophobicContact CG2-CD1 4.09Å; M514-I519 HydrophobicContact CE-CG2 4.19Å; M514-I519 HydrophobicContact CG-CD1 4.44Å; M514-I519 PolarHBondContact O-N 2.86Å; M514-I519 VanDerWaalsContact O-N 3.11Å; V517-I519 HydrophobicContact CB-CD1 4.43Å; V517-I519 HydrophobicContact CB-CG1 4.29Å; V517-I519 HydrophobicContact CG1-CD1 4.02Å; V517-I519 HydrophobicContact CG1-CG1 3.87Å; I519-P523 HydrophobicContact CG2-CB 4.16Å; I519-P523 HydrophobicContact CG2-CG 4.09Å
520	K	58	Low	72.2	Confident	156 Å²	156	64.9 Å²	64.9	68%	0.678	32%	0.316	S	S	*	.			trans	-79.1	-19.2	179.5	-65.5	175.1	-175.8	175.8	0	113.1	F473 G518	F473-K520 HydrophobicContact CE2-CD 4.1Å; F473-K520 HydrophobicContact CZ-CD 4.12Å; F473-K520 VanDerWaalsContact CZ-NZ 3.32Å; G518-K520 PolarHBondContact O-N 2.95Å
521	S	63.8	Low	71.4	Confident	57 Å²	57	73.7 Å²	73.7	40%	0.399	35%	0.353	S	S	.	.	S	Bend	trans	-86	172.9	175.4	87.9	0	0	0	0	111.3	D253 P523	D253-S521 PolarHBondContact OD2-OG 3.1Å; S521-P523 VanDerWaalsContact O-CD 3.28Å; S521-P523 WeakPolarHBondContact O-CD 3.09Å
522	K	74.6	Confident	70.6	Confident	187 Å²	187	74.9 Å²	74.9	81%	0.813	36%	0.358	S	S	*	.			trans	-87.8	105.5	166.5	-176.6	177	179.9	177.4	0	108.7
523	P	82.2	Confident	69.8	Low	12 Å²	12	72.8 Å²	72.8	8%	0.078	35%	0.35	C	S	.	.			trans	-69.1	153.2	-174.2	29.2	-35.8	0	0	0	111.7	D253 M514 I519 S521 V525	D253-P523 HydrophobicContact CB-CB 3.95Å; D253-P523 CarbonylContact O-C 3.58Å; D253-P523 WeakPolarHBondContact O-CA 3.32Å; M514-P523 VanDerWaalsContact CE-CD 3.49Å; M514-P523 HydrophobicContact CE-CG 3.76Å; M514-P523 HydrophobicContact SD-CG 3.99Å; I519-P523 HydrophobicContact CG2-CB 4.16Å; I519-P523 HydrophobicContact CG2-CG 4.09Å; S521-P523 VanDerWaalsContact O-CD 3.28Å; S521-P523 WeakPolarHBondContact O-CD 3.09Å; P523-V525 PolarHBondContact O-N 3.38Å; P523-V525 VanDerWaalsContact O-N 3.08Å
524	K	84.6	Confident	69.2	Low	93 Å²	93	73 Å²	73	40%	0.404	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	98.2	168	-174.1	71.6	176.5	-171.2	0	108.8	P246 M252 D253 I254 L255 L526	P246-K524 HydrophobicContact CB-CG 4.19Å; P246-K524 HydrophobicContact CG-CG 4.08Å; M252-K524 HydrophobicContact CB-CB 4.47Å; M252-K524 HydrophobicContact CE-CB 4.37Å; M252-K524 HydrophobicContact SD-CB 4.25Å; D253-K524 PolarHBondContact O-N 3.16Å; I254-K524 HydrophobicContact CD1-CB 3.85Å; I254-K524 HydrophobicContact CD1-CG 4.39Å; L255-K524 PolarHBondContact N-O 3.32Å; K524-L526 HydrophobicContact CD-CD2 4.37Å; K524-L526 HydrophobicContact CG-CD2 3.77Å; K524-L526 HydrophobicContact CG-CG 4.08Å
525	V	83.2	Confident	68.5	Low	65 Å²	65	72.4 Å²	72.4	39%	0.394	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	124.7	171.7	-171.4	0	0	0	0	109.3	L255 M487 P523	L255-V525 HydrophobicContact CB-CG2 4.48Å; L255-V525 HydrophobicContact CD2-CG1 4.39Å; L255-V525 HydrophobicContact CD2-CG2 4.23Å; L255-V525 WeakPolarHBondContact O-CA 3.46Å; M487-V525 HydrophobicContact CE-CG1 3.64Å; M487-V525 HydrophobicContact SD-CG1 3.53Å; M487-V525 VanDerWaalsContact SD-CG1 3.53Å; P523-V525 PolarHBondContact O-N 3.38Å; P523-V525 VanDerWaalsContact O-N 3.08Å
526	L	83.1	Confident	68	Low	9 Å²	9	74 Å²	74	5%	0.047	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	96.5	-179.7	-61.7	-179.7	0	0	0	108.8	I239 L242 A243 I254 L255 A257 K524	I239-L526 HydrophobicContact CD1-CB 4.25Å; I239-L526 HydrophobicContact CD1-CD1 4.46Å; L242-L526 HydrophobicContact CB-CD1 4.23Å; L242-L526 HydrophobicContact CB-CD2 4.11Å; A243-L526 HydrophobicContact CB-CD1 3.7Å; I254-L526 HydrophobicContact CG2-CD1 3.79Å; I254-L526 HydrophobicContact CG2-CG 4.4Å; L255-L526 PolarHBondContact O-N 2.73Å; A257-L526 PolarHBondContact N-O 3.43Å; K524-L526 HydrophobicContact CD-CD2 4.37Å; K524-L526 HydrophobicContact CG-CD2 3.77Å; K524-L526 HydrophobicContact CG-CG 4.08Å
527	D	79.7	Confident	67.9	Low	72 Å²	72	72.5 Å²	72.5	39%	0.385	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	120.5	177.6	-160.9	-4.7	0	0	0	111.1	M487 T529	M487-D527 HydrophobicContact CE-CB 3.75Å; M487-D527 WeakPolarHBondContact CE-OD2 3.37Å; M487-D527 HydrophobicContact SD-CB 3.82Å; D527-T529 WeakPolarHBondContact OD1-CB 3.49Å; D527-T529 PolarHBondContact OD1-N 3.45Å; D527-T529 PolarHBondContact OD1-OG1 3.08Å
528	L	74.1	Confident	68.2	Low	65 Å²	65	73.2 Å²	73.2	34%	0.34	36%	0.358	S	S	.	.			trans	-119.9	9.1	170	-69.7	175.7	0	0	0	111.8	P238 I239 L242 A257 A258	P238-L528 HydrophobicContact CB-CD1 4Å; P238-L528 HydrophobicContact CB-CD2 4.39Å; I239-L528 HydrophobicContact CB-CD1 3.68Å; I239-L528 HydrophobicContact CD1-CD1 3.91Å; I239-L528 HydrophobicContact CG1-CD1 4.35Å; L242-L528 HydrophobicContact CD1-CD1 4.48Å; L242-L528 HydrophobicContact CD1-CD2 3.89Å; L242-L528 HydrophobicContact CD1-CG 4.36Å; A257-L528 PolarHBondContact O-N 2.86Å; A258-L528 HydrophobicContact CB-CB 4.45Å
529	T	63.8	Low	68.9	Low	33 Å²	33	74.1 Å²	74.1	20%	0.202	36%	0.36	C	S	.	.			trans	-72.8	137.2	168.5	70.1	0	0	0	0	109.1	A257 D527	A257-T529 HydrophobicContact CB-CG2 4.03Å; D527-T529 WeakPolarHBondContact OD1-CB 3.49Å; D527-T529 PolarHBondContact OD1-N 3.45Å; D527-T529 PolarHBondContact OD1-OG1 3.08Å
530	R	61.1	Low	69.6	Low	143 Å²	143	74.3 Å²	74.3	54%	0.54	36%	0.361	S	S	.	.			trans	-87.1	162.5	-179.3	-61	-171.2	-170.6	-141.6	6.6	110.1	E532 E536	R530-E532 CarbonylContact C-O 3.58Å; R530-E532 WeakPolarHBondContact CB-O 3.47Å; R530-E532 CarbonylContact O-C 3.58Å; R530-E532 VanDerWaalsContact O-C 3.24Å; R530-E532 PolarHBondContact O-N 3.36Å; R530-E532 VanDerWaalsContact O-N 3.12Å; R530-E536 WeakPolarHBondContact CD-OE1 3.47Å; R530-E536 IonicContact CZ-OE1 2.69Å; R530-E536 IonicContact CZ-OE2 2.76Å; R530-E536 IonicContact NE-OE1 3.07Å; R530-E536 IonicContact NH1-OE1 3.53Å; R530-E536 PolarHBondContact NH1-OE1 3.46Å; R530-E536 IonicContact NH1-OE2 2.98Å; R530-E536 PolarHBondContact NH1-OE2 3.03Å
531	K	50.4	Low	71	Confident	224 Å²	224	67 Å²	67	97%	0.974	33%	0.329	S	S	*	.	S	Bend	trans	-54.5	-30.8	176.4	-67.7	-174.6	178.8	-178.8	0	112.8
532	E	53.5	Low	72.1	Confident	115 Å²	115	64.3 Å²	64.3	54%	0.537	31%	0.31	S	S	.	.	S	Bend	trans	-95.4	121.1	159.2	-65.9	-175.1	-135.2	0	0	108.7	R530 T534 K683	R530-E532 CarbonylContact C-O 3.58Å; R530-E532 WeakPolarHBondContact CB-O 3.47Å; R530-E532 CarbonylContact O-C 3.58Å; R530-E532 VanDerWaalsContact O-C 3.24Å; R530-E532 PolarHBondContact O-N 3.36Å; R530-E532 VanDerWaalsContact O-N 3.12Å; E532-T534 PolarHBondContact O-N 3.24Å; E532-K683 WeakPolarHBondContact OE2-CE 3.34Å; E532-K683 IonicContact OE2-NZ 3.41Å; E532-K683 PolarHBondContact OE2-NZ 2.89Å
533	A	55.3	Low	72.8	Confident	14 Å²	14	55.9 Å²	55.9	12%	0.116	27%	0.274	C	S	.	.	S	Bend	trans	-76.8	40.1	-176.4	0	0	0	0	0	113.9	M488 V647 L681	M488-A533 HydrophobicContact SD-CB 3.52Å; M488-A533 VanDerWaalsContact SD-CB 3.52Å; A533-V647 HydrophobicContact CB-CG2 4.3Å; A533-V647 WeakPolarHBondContact O-CG1 3.5Å; A533-V647 WeakPolarHBondContact O-CG2 3.39Å; A533-L681 HydrophobicContact CB-CD2 3.96Å
534	T	58.7	Low	73.1	Confident	11 Å²	11	60 Å²	60	7%	0.067	29%	0.292	C	S	.	.	S	Bend	trans	-151.8	135.6	-179.3	54.9	0	0	0	0	110	E532 L538 Y646 K683	E532-T534 PolarHBondContact O-N 3.24Å; T534-L538 HydrophobicContact CG2-CD2 4.41Å; T534-Y646 HydrophobicContact CG2-CE1 4.5Å; T534-K683 PolarHBondContact OG1-NZ 2.93Å
535	V	59.8	Low	73.3	Confident	34 Å²	34	56.1 Å²	56.1	21%	0.206	28%	0.276	C	S	.	.			trans	-50.9	136.6	178.6	-160.7	0	0	0	0	113	E259 T537 L538 A654	E259-V535 WeakPolarHBondContact OE2-CG2 3.26Å; V535-T537 VanDerWaalsContact CG1-OG1 3.3Å; V535-T537 WeakPolarHBondContact CG1-OG1 3.5Å; V535-T537 PolarHBondContact O-N 3.44Å; V535-L538 HydrophobicContact CB-CB 4.48Å; V535-L538 WeakPolarHBondContact O-CB 3.4Å; V535-L538 PolarHBondContact O-N 3.38Å; V535-A654 HydrophobicContact CB-CB 4.41Å
536	E	61.8	Low	73.6	Confident	148 Å²	148	59.4 Å²	59.4	69%	0.692	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.2	179.1	-70.6	163.5	-178.3	0	0	114.1	R530 L538	R530-E536 WeakPolarHBondContact CD-OE1 3.47Å; R530-E536 IonicContact CZ-OE1 2.69Å; R530-E536 IonicContact CZ-OE2 2.76Å; R530-E536 IonicContact NE-OE1 3.07Å; R530-E536 IonicContact NH1-OE1 3.53Å; R530-E536 PolarHBondContact NH1-OE1 3.46Å; R530-E536 IonicContact NH1-OE2 2.98Å; R530-E536 PolarHBondContact NH1-OE2 3.03Å; E536-L538 VanDerWaalsContact C-N 3.27Å
537	T	68.4	Low	73.7	Confident	44 Å²	44	66 Å²	66	27%	0.27	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-3.1	174.2	58.2	0	0	0	0	113.1	V535 K658 E659 G660	V535-T537 VanDerWaalsContact CG1-OG1 3.3Å; V535-T537 WeakPolarHBondContact CG1-OG1 3.5Å; V535-T537 PolarHBondContact O-N 3.44Å; T537-K658 WeakPolarHBondContact CB-O 3.44Å; T537-K658 PolarHBondContact OG1-O 3.38Å; T537-E659 WeakPolarHBondContact O-CA 3.35Å; T537-G660 PolarHBondContact O-N 3.43Å
538	L	78.6	Confident	73.9	Confident	19 Å²	19	67.5 Å²	67.5	10%	0.099	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	113.6	173.8	-172.9	68.7	0	0	0	110.4	T534 V535 E536 E540 T653 A654	T534-L538 HydrophobicContact CG2-CD2 4.41Å; V535-L538 HydrophobicContact CB-CB 4.48Å; V535-L538 WeakPolarHBondContact O-CB 3.4Å; V535-L538 PolarHBondContact O-N 3.38Å; E536-L538 VanDerWaalsContact C-N 3.27Å; L538-E540 HydrophobicContact CD2-CG 3.75Å; L538-E540 HydrophobicContact CG-CG 3.94Å; L538-T653 HydrophobicContact CD1-CG2 3.52Å; L538-A654 HydrophobicContact CB-CB 3.87Å; L538-A654 HydrophobicContact CD1-CB 3.83Å; L538-A654 HydrophobicContact CG-CB 4.49Å
539	T	81.9	Confident	74.6	Confident	38 Å²	38	66.3 Å²	66.3	23%	0.233	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	122.3	164.3	61.2	0	0	0	0	109.7	G660 L661 S662 L805	T539-G660 PolarHBondContact N-O 3.02Å; T539-G660 PolarHBondContact OG1-O 2.84Å; T539-L661 WeakPolarHBondContact O-CA 3.26Å; T539-L661 WeakPolarHBondContact OG1-CD1 3.06Å; T539-S662 PolarHBondContact O-N 3.14Å; T539-L805 HydrophobicContact CG2-CD2 3.84Å; T539-L805 WeakPolarHBondContact OG1-CD2 3.43Å
540	E	84.4	Confident	75.9	Confident	22 Å²	22	65.1 Å²	65.1	10%	0.103	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.5	177.6	-60.3	-170	122.5	0	0	110.7	L538 Y646 K683 L687	L538-E540 HydrophobicContact CD2-CG 3.75Å; L538-E540 HydrophobicContact CG-CG 3.94Å; E540-Y646 VanDerWaalsContact CD-OH 3.32Å; E540-Y646 VanDerWaalsContact OE1-CE1 3.24Å; E540-Y646 WeakPolarHBondContact OE1-CE1 3.28Å; E540-Y646 VanDerWaalsContact OE1-CZ 3.28Å; E540-Y646 PolarHBondContact OE1-OH 2.87Å; E540-K683 IonicContact OE2-NZ 3.85Å; E540-K683 PolarHBondContact OE2-NZ 3.2Å; E540-L687 HydrophobicContact CB-CD1 4.37Å; E540-L687 HydrophobicContact CB-CD2 3.9Å
541	T	87.4	Confident	77.4	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.006	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	155.4	-178.5	58.6	0	0	0	0	112.6	L661 S662 L663 L664 A688 F690 I808	T541-L661 HydrophobicContact CG2-CD1 4.07Å; T541-S662 PolarHBondContact N-O 2.9Å; T541-S662 PolarHBondContact OG1-O 2.58Å; T541-L663 CarbonylContact O-C 3.58Å; T541-L663 WeakPolarHBondContact O-CA 3.4Å; T541-L663 WeakPolarHBondContact OG1-CD1 3.07Å; T541-L664 WeakPolarHBondContact O-CD1 3.17Å; T541-L664 PolarHBondContact O-N 2.82Å; T541-A688 CarbonylContact C-O 3.6Å; T541-A688 WeakPolarHBondContact CA-O 3.26Å; T541-A688 WeakPolarHBondContact CB-O 3.49Å; T541-F690 HydrophobicContact CG2-CD2 4.21Å; T541-I808 HydrophobicContact CG2-CD1 3.66Å; T541-I808 HydrophobicContact CG2-CG1 4.13Å
542	Q	88.6	Confident	79.4	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	148.5	-179	56.3	174.9	-3.6	0	0	113.3	L664 I666 L687 A688 T689 F690	Q542-L664 WeakPolarHBondContact CA-O 3.33Å; Q542-L664 HydrophobicContact CB-CB 4.43Å; Q542-I666 HydrophobicContact CB-CD1 3.9Å; Q542-L687 HydrophobicContact CB-CB 4.36Å; Q542-L687 HydrophobicContact CG-CB 3.86Å; Q542-L687 WeakPolarHBondContact CG-O 3.48Å; Q542-L687 PolarHBondContact NE2-O 2.87Å; Q542-A688 PolarHBondContact N-O 2.95Å; Q542-T689 CarbonylContact O-C 3.58Å; Q542-T689 WeakPolarHBondContact O-CA 3.49Å; Q542-F690 PolarHBondContact O-N 3.1Å
543	I	88.9	Confident	81.2	Confident	9 Å²	9	44.4 Å²	44.4	5%	0.046	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	116.2	167.2	-64.5	171.2	0	0	0	108	C545 Y553 L663 L664 L665 I666 F690 V692	I543-C545 HydrophobicContact CG2-CB 4.14Å; I543-C545 PolarHBondContact O-SG 3.33Å; I543-C545 VanDerWaalsContact O-SG 3.38Å; I543-Y553 HydrophobicContact CD1-CD1 4.2Å; I543-Y553 HydrophobicContact CD1-CG 4.47Å; I543-Y553 HydrophobicContact CG2-CD1 3.89Å; I543-Y553 HydrophobicContact CG2-CD2 4.02Å; I543-Y553 HydrophobicContact CG2-CE1 4.01Å; I543-Y553 HydrophobicContact CG2-CE2 4.15Å; I543-Y553 HydrophobicContact CG2-CG 3.9Å; I543-L663 HydrophobicContact CD1-CD1 3.94Å; I543-L663 HydrophobicContact CD1-CD2 4.32Å; I543-L663 HydrophobicContact CG1-CD1 3.99Å; I543-L664 PolarHBondContact N-O 3.27Å; I543-L665 HydrophobicContact CB-CD2 3.97Å; I543-L665 HydrophobicContact CD1-CD2 4.08Å; I543-L665 HydrophobicContact CG1-CD2 4.49Å; I543-L665 HydrophobicContact CG2-CD2 4.48Å; I543-I666 PolarHBondContact O-N 2.88Å; I543-F690 HydrophobicContact CD1-CB 4.04Å; I543-F690 HydrophobicContact CD1-CD1 4.14Å; I543-F690 HydrophobicContact CD1-CG 4.37Å; I543-F690 HydrophobicContact CG1-CB 3.7Å; I543-V692 HydrophobicContact CD1-CG2 3.87Å; I543-V692 HydrophobicContact CG1-CG2 4.4Å
544	H	88.8	Confident	83	Confident	99 Å²	99	43.9 Å²	43.9	46%	0.458	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	124.6	167.1	-70.3	101.5	0	0	0	109.2
545	C	88.2	Confident	84.6	Confident	11 Å²	11	43.4 Å²	43.4	7%	0.074	21%	0.212	C	C	.	.			trans	-153.9	149.2	-170.8	47.9	0	0	0	0	112	I543 E549 Y553 I666 G667	I543-C545 HydrophobicContact CG2-CB 4.14Å; I543-C545 PolarHBondContact O-SG 3.33Å; I543-C545 VanDerWaalsContact O-SG 3.38Å; C545-E549 HydrophobicContact CB-CB 4.33Å; C545-Y553 HydrophobicContact CB-CD2 3.51Å; C545-Y553 HydrophobicContact CB-CE2 3.37Å; C545-I666 PolarHBondContact N-O 2.73Å; C545-G667 WeakPolarHBondContact O-CA 3.2Å
546	Q	88.7	Confident	86	Confident	135 Å²	135	41.9 Å²	41.9	63%	0.631	20%	0.203	S	C	*	.			trans	-73.8	160	171	-67.3	-171.3	-9.5	0	0	111.2	D548 E549 K550	Q546-D548 VanDerWaalsContact C-N 3.29Å; Q546-D548 PolarHBondContact O-N 3.06Å; Q546-E549 HydrophobicContact CB-CG 4.24Å; Q546-E549 WeakPolarHBondContact O-CA 3.15Å; Q546-E549 WeakPolarHBondContact O-CB 3.45Å; Q546-E549 PolarHBondContact O-N 3.36Å; Q546-K550 PolarHBondContact O-N 2.75Å
547	K	85	Confident	87.3	Confident	148 Å²	148	34.9 Å²	34.9	64%	0.643	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-52.8	-44.2	-177	-172.4	174.8	-178	173.8	0	112.9	E549	K547-E549 VanDerWaalsContact C-N 3.27Å; K547-E549 PolarHBondContact O-N 2.95Å
548	D	83.9	Confident	88.3	Confident	102 Å²	102	33.7 Å²	33.7	55%	0.545	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-75.9	-12.3	177.9	-62.6	-44	0	0	0	113.8	Q546 F552 R708	Q546-D548 VanDerWaalsContact C-N 3.29Å; Q546-D548 PolarHBondContact O-N 3.06Å; D548-F552 WeakPolarHBondContact O-CE2 3.37Å; D548-R708 PolarHBondContact O-NH2 2.96Å
549	E	89.4	Confident	88.6	Confident	40 Å²	40	35.8 Å²	35.8	19%	0.187	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-91.1	-17.7	176.6	-61.1	-162	122.6	0	0	114.1	C545 Q546 K547 D551 F552 Y553 K701	C545-E549 HydrophobicContact CB-CB 4.33Å; Q546-E549 HydrophobicContact CB-CG 4.24Å; Q546-E549 WeakPolarHBondContact O-CA 3.15Å; Q546-E549 WeakPolarHBondContact O-CB 3.45Å; Q546-E549 PolarHBondContact O-N 3.36Å; K547-E549 VanDerWaalsContact C-N 3.27Å; K547-E549 PolarHBondContact O-N 2.95Å; E549-D551 PolarHBondContact O-N 3.09Å; E549-F552 VanDerWaalsContact CA-CD2 3.44Å; E549-F552 HydrophobicContact CB-CD2 3.86Å; E549-F552 HydrophobicContact CB-CE2 4.36Å; E549-F552 HydrophobicContact CG-CD2 3.93Å; E549-F552 HydrophobicContact CG-CE2 4.05Å; E549-F552 WeakPolarHBondContact O-CA 3.34Å; E549-F552 WeakPolarHBondContact O-CB 3.26Å; E549-F552 PolarHBondContact O-N 2.9Å; E549-Y553 HydrophobicContact CB-CD2 4.03Å; E549-Y553 HydrophobicContact CB-CE2 3.67Å; E549-Y553 WeakPolarHBondContact O-CD2 3.45Å; E549-Y553 PolarHBondContact O-N 3.06Å; E549-Y553 VanDerWaalsContact O-N 3.1Å; E549-K701 WeakPolarHBondContact OE1-CE 3.33Å; E549-K701 IonicContact OE1-NZ 2.75Å; E549-K701 PolarHBondContact OE1-NZ 3.37Å
550	K	91.5	Very high	88.6	Confident	9 Å²	9	35.7 Å²	35.7	4%	0.039	17%	0.17	C	C	.	.	H	α-helix	trans	-56.2	-39.4	179.2	-62.5	-155.8	-178.1	-164	0	112.5	Q546 F552 Y553 L554 Y637 L665 D670	Q546-K550 PolarHBondContact O-N 2.75Å; K550-F552 VanDerWaalsContact C-N 3.28Å; K550-F552 PolarHBondContact O-N 2.92Å; K550-Y553 PolarHBondContact O-N 2.77Å; K550-L554 WeakPolarHBondContact O-CB 3.35Å; K550-L554 PolarHBondContact O-N 3.14Å; K550-Y637 HydrophobicContact CB-CD2 4.2Å; K550-Y637 HydrophobicContact CB-CE2 3.45Å; K550-Y637 VanDerWaalsContact CB-CE2 3.45Å; K550-Y637 HydrophobicContact CD-CE1 4.47Å; K550-Y637 VanDerWaalsContact CD-O 3.26Å; K550-Y637 WeakPolarHBondContact CD-O 3.45Å; K550-Y637 PolarHBondContact NZ-O 2.97Å; K550-L665 HydrophobicContact CB-CD1 4.18Å; K550-L665 HydrophobicContact CD-CB 4.04Å; K550-L665 WeakPolarHBondContact CE-O 3.4Å; K550-L665 HydrophobicContact CG-CB 4.4Å; K550-L665 PolarHBondContact NZ-O 3.08Å; K550-D670 IonicContact NZ-OD2 3.79Å; K550-D670 PolarHBondContact NZ-OD2 3.36Å
551	D	92.9	Very high	88.6	Confident	6 Å²	6	35 Å²	35	3%	0.032	17%	0.166	C	C	.	.	H	α-helix	trans	-59.6	-36.8	173.8	-66.4	-28.2	0	0	0	112	E549 Y555 R577 L581 Y637 V704 R708	E549-D551 PolarHBondContact O-N 3.09Å; D551-Y555 WeakPolarHBondContact O-CB 3.41Å; D551-Y555 PolarHBondContact O-N 3.12Å; D551-Y555 VanDerWaalsContact O-N 3.1Å; D551-R577 IonicContact OD1-CZ 2.72Å; D551-R577 IonicContact OD1-NH1 3.48Å; D551-R577 PolarHBondContact OD1-NH1 2.9Å; D551-R577 VanDerWaalsContact OD1-NH1 3.16Å; D551-R577 IonicContact OD1-NH2 3.36Å; D551-R577 PolarHBondContact OD1-NH2 3.34Å; D551-R577 IonicContact OD2-CZ 2.61Å; D551-R577 IonicContact OD2-NH1 3.53Å; D551-R577 PolarHBondContact OD2-NH1 3.13Å; D551-R577 IonicContact OD2-NH2 2.61Å; D551-L581 HydrophobicContact CB-CD2 4.02Å; D551-Y637 PolarHBondContact OD1-OH 2.99Å; D551-Y637 VanDerWaalsContact OD1-OH 3.05Å; D551-V704 HydrophobicContact CB-CG1 3.77Å; D551-R708 IonicContact OD2-CZ 2.65Å; D551-R708 IonicContact OD2-NE 3.62Å; D551-R708 PolarHBondContact OD2-NE 2.99Å; D551-R708 IonicContact OD2-NH2 2.65Å; D551-R708 PolarHBondContact OD2-NH2 3.23Å
552	F	92.2	Very high	88.4	Confident	11 Å²	11	38.1 Å²	38.1	5%	0.048	19%	0.186	C	C	.	.	H	α-helix	trans	-70.3	-47.1	179.1	-50.3	-40.8	0	0	0	111.9	D548 E549 K550 L554 Y555 Y556 M697 I700 K701 V704 N705	D548-F552 WeakPolarHBondContact O-CE2 3.37Å; E549-F552 VanDerWaalsContact CA-CD2 3.44Å; E549-F552 HydrophobicContact CB-CD2 3.86Å; E549-F552 HydrophobicContact CB-CE2 4.36Å; E549-F552 HydrophobicContact CG-CD2 3.93Å; E549-F552 HydrophobicContact CG-CE2 4.05Å; E549-F552 WeakPolarHBondContact O-CA 3.34Å; E549-F552 WeakPolarHBondContact O-CB 3.26Å; E549-F552 PolarHBondContact O-N 2.9Å; K550-F552 VanDerWaalsContact C-N 3.28Å; K550-F552 PolarHBondContact O-N 2.92Å; F552-L554 VanDerWaalsContact C-N 3.35Å; F552-Y555 PolarHBondContact O-N 3.49Å; F552-Y556 WeakPolarHBondContact O-CB 3.39Å; F552-Y556 PolarHBondContact O-N 2.93Å; F552-M697 HydrophobicContact CB-CE 3.94Å; F552-I700 HydrophobicContact CB-CG2 4.32Å; F552-K701 HydrophobicContact CB-CG 4.41Å; F552-K701 HydrophobicContact CD1-CB 4.5Å; F552-K701 HydrophobicContact CD1-CG 3.99Å; F552-K701 HydrophobicContact CD2-CD 4.08Å; F552-K701 VanDerWaalsContact CD2-CE 3.48Å; F552-K701 HydrophobicContact CD2-CG 3.59Å; F552-K701 HydrophobicContact CE1-CB 4.38Å; F552-K701 HydrophobicContact CE1-CG 4.13Å; F552-K701 HydrophobicContact CE2-CD 4.1Å; F552-K701 HydrophobicContact CE2-CG 3.75Å; F552-K701 HydrophobicContact CG-CG 3.74Å; F552-K701 HydrophobicContact CZ-CB 4.46Å; F552-K701 HydrophobicContact CZ-CG 4.02Å; F552-V704 HydrophobicContact CD1-CB 3.6Å; F552-V704 HydrophobicContact CD1-CG1 3.62Å; F552-V704 HydrophobicContact CD1-CG2 4.14Å; F552-V704 HydrophobicContact CE1-CB 3.78Å; F552-V704 HydrophobicContact CE1-CG1 3.71Å; F552-N705 WeakPolarHBondContact CZ-OD1 3.42Å
553	Y	91.8	Very high	88.2	Confident	30 Å²	30	38.2 Å²	38.2	12%	0.118	19%	0.188	C	C	.	.	H	α-helix	trans	-67.9	-35.6	-179.4	-67.9	-70	0	0	0	112	I543 C545 E549 K550 F557 V692 M697	I543-Y553 HydrophobicContact CD1-CD1 4.2Å; I543-Y553 HydrophobicContact CD1-CG 4.47Å; I543-Y553 HydrophobicContact CG2-CD1 3.89Å; I543-Y553 HydrophobicContact CG2-CD2 4.02Å; I543-Y553 HydrophobicContact CG2-CE1 4.01Å; I543-Y553 HydrophobicContact CG2-CE2 4.15Å; I543-Y553 HydrophobicContact CG2-CG 3.9Å; C545-Y553 HydrophobicContact CB-CD2 3.51Å; C545-Y553 HydrophobicContact CB-CE2 3.37Å; E549-Y553 HydrophobicContact CB-CD2 4.03Å; E549-Y553 HydrophobicContact CB-CE2 3.67Å; E549-Y553 WeakPolarHBondContact O-CD2 3.45Å; E549-Y553 PolarHBondContact O-N 3.06Å; E549-Y553 VanDerWaalsContact O-N 3.1Å; K550-Y553 PolarHBondContact O-N 2.77Å; Y553-F557 WeakPolarHBondContact O-CB 3.4Å; Y553-F557 PolarHBondContact O-N 3.31Å; Y553-V692 HydrophobicContact CD1-CG1 4.24Å; Y553-V692 HydrophobicContact CD1-CG2 3.99Å; Y553-V692 HydrophobicContact CE1-CB 4.45Å; Y553-V692 HydrophobicContact CE1-CG1 4.02Å; Y553-V692 HydrophobicContact CE1-CG2 4.04Å; Y553-M697 HydrophobicContact CD1-CE 3.77Å; Y553-M697 HydrophobicContact CE1-CE 3.63Å; Y553-M697 HydrophobicContact CG-CE 4.37Å
554	L	92.5	Very high	88.2	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-50	172.6	-178.8	67.3	0	0	0	111.5	K550 F552 Y556 F557 L558 V567 L578 L582 I635 Y637 L665	K550-L554 WeakPolarHBondContact O-CB 3.35Å; K550-L554 PolarHBondContact O-N 3.14Å; F552-L554 VanDerWaalsContact C-N 3.35Å; L554-Y556 VanDerWaalsContact C-N 3.34Å; L554-Y556 PolarHBondContact O-N 3.15Å; L554-F557 PolarHBondContact O-N 3.18Å; L554-L558 HydrophobicContact CD1-CD1 4.12Å; L554-L558 HydrophobicContact CD1-CG 4.2Å; L554-L558 HydrophobicContact CG-CD1 3.96Å; L554-L558 HydrophobicContact CG-CG 4.37Å; L554-L558 WeakPolarHBondContact O-CG 3.45Å; L554-L558 PolarHBondContact O-N 3.11Å; L554-V567 HydrophobicContact CD1-CG1 3.99Å; L554-V567 HydrophobicContact CD1-CG2 4.02Å; L554-V567 HydrophobicContact CD2-CG1 4.24Å; L554-L578 HydrophobicContact CD2-CD1 3.77Å; L554-L578 HydrophobicContact CD2-CD2 3.75Å; L554-L578 HydrophobicContact CD2-CG 4.25Å; L554-L582 HydrophobicContact CD2-CD1 4.21Å; L554-I635 HydrophobicContact CD1-CB 4.48Å; L554-I635 HydrophobicContact CD1-CD1 3.64Å; L554-I635 HydrophobicContact CD1-CG2 4.04Å; L554-Y637 HydrophobicContact CB-CD2 4.47Å; L554-Y637 HydrophobicContact CD2-CD2 3.97Å; L554-Y637 HydrophobicContact CD2-CE2 4.35Å; L554-L665 HydrophobicContact CB-CD1 4.42Å
555	Y	91.3	Very high	88.3	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.008	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-37.1	179.8	-174.9	-127.3	0	0	0	112.4	D551 F552 L559 L582 L585 I700 R703 V704	D551-Y555 WeakPolarHBondContact O-CB 3.41Å; D551-Y555 PolarHBondContact O-N 3.12Å; D551-Y555 VanDerWaalsContact O-N 3.1Å; F552-Y555 PolarHBondContact O-N 3.49Å; Y555-L559 HydrophobicContact CD1-CD1 4.15Å; Y555-L559 HydrophobicContact CD2-CD1 4.25Å; Y555-L559 HydrophobicContact CD2-CG 4.1Å; Y555-L559 HydrophobicContact CE1-CD1 3.72Å; Y555-L559 HydrophobicContact CE2-CD1 3.81Å; Y555-L559 HydrophobicContact CE2-CD2 3.92Å; Y555-L559 HydrophobicContact CE2-CG 3.79Å; Y555-L559 HydrophobicContact CG-CD1 4.42Å; Y555-L559 WeakPolarHBondContact O-CG 3.36Å; Y555-L559 PolarHBondContact O-N 3.03Å; Y555-L559 VanDerWaalsContact O-N 3.12Å; Y555-L582 HydrophobicContact CD2-CD2 4.4Å; Y555-L585 HydrophobicContact CD1-CD1 4.38Å; Y555-L585 HydrophobicContact CD2-CB 4.24Å; Y555-L585 HydrophobicContact CD2-CD1 4.03Å; Y555-L585 HydrophobicContact CE1-CD2 3.96Å; Y555-L585 HydrophobicContact CE2-CB 3.71Å; Y555-L585 HydrophobicContact CE2-CD1 4.22Å; Y555-L585 HydrophobicContact CE2-CD2 4.28Å; Y555-L585 HydrophobicContact CE2-CG 4.3Å; Y555-L585 HydrophobicContact CG-CD1 4.12Å; Y555-I700 HydrophobicContact CD1-CG2 4.11Å; Y555-R703 HydrophobicContact CE1-CB 4.15Å; Y555-V704 HydrophobicContact CD1-CG2 3.38Å; Y555-V704 HydrophobicContact CE1-CG2 4.13Å; Y555-V704 HydrophobicContact CG-CG2 3.93Å
556	Y	89.9	Confident	88.6	Confident	1 Å²	1	33.1 Å²	33.1	0%	0.004	16%	0.163	C	C	.	.	H	α-helix	trans	-54.7	-51.3	169.1	166.1	-110	0	0	0	112	F552 L554 L559 Q560 F690 P691 V692 E693 M697 I700 F776	F552-Y556 WeakPolarHBondContact O-CB 3.39Å; F552-Y556 PolarHBondContact O-N 2.93Å; L554-Y556 VanDerWaalsContact C-N 3.34Å; L554-Y556 PolarHBondContact O-N 3.15Å; Y556-L559 PolarHBondContact O-N 2.89Å; Y556-Q560 VanDerWaalsContact O-CB 3.3Å; Y556-Q560 WeakPolarHBondContact O-CB 3.32Å; Y556-Q560 PolarHBondContact O-N 2.67Å; Y556-F690 HydrophobicContact CE1-CE1 4.24Å; Y556-P691 PolarHBondContact OH-O 3.18Å; Y556-V692 HydrophobicContact CD1-CG1 4.09Å; Y556-V692 HydrophobicContact CD1-CG2 4.44Å; Y556-V692 HydrophobicContact CE1-CB 4.15Å; Y556-V692 HydrophobicContact CE1-CG1 3.81Å; Y556-V692 HydrophobicContact CE1-CG2 4.01Å; Y556-E693 HydrophobicContact CE2-CB 4.36Å; Y556-E693 PolarHBondContact OH-N 3.44Å; Y556-E693 VanDerWaalsContact OH-N 3.08Å; Y556-M697 HydrophobicContact CD2-SD 4.3Å; Y556-M697 HydrophobicContact CG-SD 4.09Å; Y556-I700 HydrophobicContact CD2-CD1 3.67Å; Y556-I700 HydrophobicContact CG-CD1 4.22Å; Y556-F776 HydrophobicContact CD2-CE1 4.38Å; Y556-F776 HydrophobicContact CD2-CZ 4.2Å; Y556-F776 HydrophobicContact CE2-CE1 4.17Å; Y556-F776 HydrophobicContact CE2-CZ 4.35Å
557	F	89.5	Confident	88.9	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.009	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-47.5	-178.1	-173.3	-80.6	0	0	0	111.8	Y553 L554 L559 Q560 Y561 H633 I635 L661 L663 F690	Y553-F557 WeakPolarHBondContact O-CB 3.4Å; Y553-F557 PolarHBondContact O-N 3.31Å; L554-F557 PolarHBondContact O-N 3.18Å; F557-L559 VanDerWaalsContact C-N 3.31Å; F557-L559 PolarHBondContact O-N 2.97Å; F557-Q560 PolarHBondContact O-N 3.5Å; F557-Y561 HydrophobicContact CD1-CD2 4.41Å; F557-Y561 AromaticContact CD2-CD2 3.65Å; F557-Y561 HydrophobicContact CD2-CD2 3.65Å; F557-Y561 HydrophobicContact CD2-CE2 4.1Å; F557-Y561 HydrophobicContact CE1-CD2 4.44Å; F557-Y561 AromaticContact CE2-CD2 3.68Å; F557-Y561 HydrophobicContact CE2-CD2 3.68Å; F557-Y561 HydrophobicContact CE2-CE2 4.24Å; F557-Y561 HydrophobicContact CE2-CG 4.42Å; F557-Y561 HydrophobicContact CG-CD2 4.04Å; F557-Y561 HydrophobicContact CZ-CD2 4.09Å; F557-Y561 HydrophobicContact CZ-CG 4.44Å; F557-Y561 PolarHBondContact O-N 2.98Å; F557-H633 HydrophobicContact CE1-CB 3.87Å; F557-H633 AromaticContact CE1-CG 3.7Å; F557-H633 AromaticContact CE1-ND1 3.7Å; F557-H633 HydrophobicContact CZ-CB 4.05Å; F557-H633 AromaticContact CZ-CD2 3.94Å; F557-H633 AromaticContact CZ-CG 3.77Å; F557-I635 HydrophobicContact CD1-CD1 3.48Å; F557-I635 VanDerWaalsContact CD1-CD1 3.48Å; F557-I635 HydrophobicContact CD1-CG1 4.46Å; F557-I635 HydrophobicContact CE1-CD1 3.85Å; F557-I635 HydrophobicContact CE1-CG1 4.44Å; F557-I635 HydrophobicContact CG-CD1 4.07Å; F557-L661 HydrophobicContact CE2-CD2 3.84Å; F557-L661 HydrophobicContact CZ-CD2 3.89Å; F557-L663 HydrophobicContact CD2-CD2 3.49Å; F557-L663 VanDerWaalsContact CD2-CD2 3.49Å; F557-L663 HydrophobicContact CE2-CD2 3.87Å; F557-L663 HydrophobicContact CG-CD2 4.06Å; F557-F690 HydrophobicContact CD2-CE1 4.33Å; F557-F690 HydrophobicContact CD2-CZ 4.04Å; F557-F690 HydrophobicContact CE2-CE2 4.11Å; F557-F690 AromaticContact CE2-CZ 3.91Å; F557-F690 HydrophobicContact CE2-CZ 3.91Å
558	L	89.1	Confident	89.4	Confident	19 Å²	19	19.8 Å²	19.8	10%	0.099	10%	0.103	C	C	.	.	H	α-helix	trans	-63.5	-32.8	-177.8	-67.6	177.9	0	0	0	113.2	L554 T565 L582 V615 I635	L554-L558 HydrophobicContact CD1-CD1 4.12Å; L554-L558 HydrophobicContact CD1-CG 4.2Å; L554-L558 HydrophobicContact CG-CD1 3.96Å; L554-L558 HydrophobicContact CG-CG 4.37Å; L554-L558 WeakPolarHBondContact O-CG 3.45Å; L554-L558 PolarHBondContact O-N 3.11Å; L558-T565 HydrophobicContact CD2-CG2 3.75Å; L558-L582 HydrophobicContact CD1-CD1 4.02Å; L558-L582 HydrophobicContact CD1-CD2 4.08Å; L558-V615 HydrophobicContact CD1-CG1 4.25Å; L558-V615 HydrophobicContact CD1-CG2 4.36Å; L558-V615 HydrophobicContact CD2-CG1 4.1Å; L558-V615 HydrophobicContact CD2-CG2 3.76Å; L558-I635 HydrophobicContact CD2-CD1 4.44Å
559	L	85.3	Confident	89.8	Confident	62 Å²	62	15 Å²	15	33%	0.325	8%	0.078	S	C	.	.	H	α-helix	trans	-78.6	-35.3	174.6	-68.3	179.1	0	0	0	113.2	Y555 Y556 F557 I775 F776	Y555-L559 HydrophobicContact CD1-CD1 4.15Å; Y555-L559 HydrophobicContact CD2-CD1 4.25Å; Y555-L559 HydrophobicContact CD2-CG 4.1Å; Y555-L559 HydrophobicContact CE1-CD1 3.72Å; Y555-L559 HydrophobicContact CE2-CD1 3.81Å; Y555-L559 HydrophobicContact CE2-CD2 3.92Å; Y555-L559 HydrophobicContact CE2-CG 3.79Å; Y555-L559 HydrophobicContact CG-CD1 4.42Å; Y555-L559 WeakPolarHBondContact O-CG 3.36Å; Y555-L559 PolarHBondContact O-N 3.03Å; Y555-L559 VanDerWaalsContact O-N 3.12Å; Y556-L559 PolarHBondContact O-N 2.89Å; F557-L559 VanDerWaalsContact C-N 3.31Å; F557-L559 PolarHBondContact O-N 2.97Å; L559-I775 HydrophobicContact CD1-CD1 3.7Å; L559-F776 HydrophobicContact CB-CE2 3.82Å; L559-F776 HydrophobicContact CB-CZ 4.45Å
560	Q	82.3	Confident	89.9	Confident	36 Å²	36	15.4 Å²	15.4	17%	0.168	8%	0.082	C	C	.	.	H	α-helix	trans	-82.2	-31.2	-174.8	-177.8	62.9	6	0	0	113	Y556 F557 P562 F776 R807	Y556-Q560 VanDerWaalsContact O-CB 3.3Å; Y556-Q560 WeakPolarHBondContact O-CB 3.32Å; Y556-Q560 PolarHBondContact O-N 2.67Å; F557-Q560 PolarHBondContact O-N 3.5Å; Q560-P562 WeakPolarHBondContact O-CD 3.21Å; Q560-F776 HydrophobicContact CB-CE1 4.43Å; Q560-F776 HydrophobicContact CB-CE2 4.13Å; Q560-F776 HydrophobicContact CB-CZ 3.81Å; Q560-F776 HydrophobicContact CG-CZ 4.43Å; Q560-F776 VanDerWaalsContact OE1-CD1 3.22Å; Q560-F776 VanDerWaalsContact OE1-CG 3.31Å; Q560-F776 VanDerWaalsContact OE1-CZ 3.3Å; Q560-R807 VanDerWaalsContact NE2-NH1 3.14Å
561	Y	84.1	Confident	89.9	Confident	8 Å²	8	16.9 Å²	16.9	3%	0.031	9%	0.093	C	C	.	.	S	Bend	trans	-125.6	73.8	-174.4	-52.7	-68.4	0	0	0	111	F557 G563 H633 F690 A804 R807	F557-Y561 HydrophobicContact CD1-CD2 4.41Å; F557-Y561 AromaticContact CD2-CD2 3.65Å; F557-Y561 HydrophobicContact CD2-CD2 3.65Å; F557-Y561 HydrophobicContact CD2-CE2 4.1Å; F557-Y561 HydrophobicContact CE1-CD2 4.44Å; F557-Y561 AromaticContact CE2-CD2 3.68Å; F557-Y561 HydrophobicContact CE2-CD2 3.68Å; F557-Y561 HydrophobicContact CE2-CE2 4.24Å; F557-Y561 HydrophobicContact CE2-CG 4.42Å; F557-Y561 HydrophobicContact CG-CD2 4.04Å; F557-Y561 HydrophobicContact CZ-CD2 4.09Å; F557-Y561 HydrophobicContact CZ-CG 4.44Å; F557-Y561 PolarHBondContact O-N 2.98Å; Y561-G563 PolarHBondContact O-N 3.38Å; Y561-H633 PolarHBondContact O-CE1 2.84Å; Y561-H633 VanDerWaalsContact O-CE1 3.32Å; Y561-F690 HydrophobicContact CD2-CZ 4.33Å; Y561-F690 AromaticContact CE2-CE1 3.91Å; Y561-F690 HydrophobicContact CE2-CE1 3.91Å; Y561-F690 AromaticContact CE2-CZ 3.53Å; Y561-F690 HydrophobicContact CE2-CZ 3.53Å; Y561-F690 AromaticContact CZ-CZ 3.93Å; Y561-A804 HydrophobicContact CD1-CB 3.69Å; Y561-A804 HydrophobicContact CD2-CB 4.33Å; Y561-A804 HydrophobicContact CE1-CB 3.85Å; Y561-A804 HydrophobicContact CE2-CB 4.48Å; Y561-A804 HydrophobicContact CG-CB 3.94Å; Y561-R807 WeakPolarHBondContact OH-CD 3.49Å; Y561-R807 PolarHBondContact OH-NH1 3.3Å; Y561-R807 VanDerWaalsContact OH-NH1 3.13Å
562	P	82.3	Confident	89.8	Confident	66 Å²	66	18.7 Å²	18.7	43%	0.429	10%	0.102	S	C	.	.			trans	-62.4	130.2	176.7	27.1	-34.5	0	0	0	110.6	Q560 M801	Q560-P562 WeakPolarHBondContact O-CD 3.21Å; P562-M801 HydrophobicContact CG-CE 3.89Å
563	G	84.5	Confident	89.7	Confident	5 Å²	5	23.2 Å²	23.2	5%	0.052	13%	0.127	C	C	.	.	S	Bend	trans	168.2	177	-176.8	0	0	0	0	0	112.9	Y561 T565 Q612	Y561-G563 PolarHBondContact O-N 3.38Å; G563-T565 PolarHBondContact O-N 2.76Å; G563-T565 VanDerWaalsContact O-N 3.11Å; G563-T565 PolarHBondContact O-OG1 3.24Å; G563-Q612 CarbonylContact C-O 3.51Å
564	R	89.5	Confident	89.7	Confident	10 Å²	10	22.5 Å²	22.5	4%	0.038	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	106.8	-178.9	-173.4	169.6	-70.9	-178.1	-5.7	109.8	F608 A609 K611 Q612 P629 N630 V631 Q632 H633	R564-F608 HydrophobicContact CG-CD2 4.48Å; R564-F608 HydrophobicContact CG-CE1 3.91Å; R564-F608 HydrophobicContact CG-CE2 3.72Å; R564-F608 HydrophobicContact CG-CZ 3.39Å; R564-F608 PolarHBondContact NE-O 3.05Å; R564-F608 VanDerWaalsContact NE-O 3.14Å; R564-F608 PolarHBondContact NH2-O 2.87Å; R564-A609 PolarHBondContact NH1-O 3.18Å; R564-A609 VanDerWaalsContact NH1-O 3.16Å; R564-A609 VanDerWaalsContact NH2-C 3.25Å; R564-A609 PolarHBondContact NH2-O 3.01Å; R564-K611 PolarHBondContact NE-O 2.93Å; R564-K611 PolarHBondContact NH2-O 2.84Å; R564-Q612 WeakPolarHBondContact CA-O 3.41Å; R564-Q612 WeakPolarHBondContact CB-O 3.38Å; R564-Q612 PolarHBondContact N-O 3.37Å; R564-P629 PolarHBondContact NH1-O 2.69Å; R564-N630 WeakPolarHBondContact CB-O 3.47Å; R564-V631 HydrophobicContact CG-CG2 4.25Å; R564-Q632 PolarHBondContact O-N 2.98Å; R564-H633 PolarHBondContact O-N 3.32Å
565	T	91.6	Very high	89.7	Confident	2 Å²	2	22.4 Å²	22.4	1%	0.012	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122.8	-167.1	-56.3	0	0	0	0	111.6	L558 G563 V567 C614 V615 L616 H633 I635	L558-T565 HydrophobicContact CD2-CG2 3.75Å; G563-T565 PolarHBondContact O-N 2.76Å; G563-T565 VanDerWaalsContact O-N 3.11Å; G563-T565 PolarHBondContact O-OG1 3.24Å; T565-V567 HydrophobicContact CG2-CG2 4.17Å; T565-C614 PolarHBondContact N-O 3.1Å; T565-V615 WeakPolarHBondContact O-CA 3.35Å; T565-L616 PolarHBondContact O-N 3.18Å; T565-H633 WeakPolarHBondContact CA-O 3.45Å; T565-H633 HydrophobicContact CG2-CB 3.93Å; T565-H633 PolarHBondContact OG1-ND1 2.92Å; T565-H633 VanDerWaalsContact OG1-ND1 3.16Å; T565-I635 HydrophobicContact CG2-CD1 3.71Å; T565-I635 HydrophobicContact CG2-CG1 4.11Å
566	M	92.8	Very high	89.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.2	170.4	-68.1	-175	66.5	0	0	110.3	F568 F608 L616 T618 A622 I628 V631 H633 V634 I635 R652	M566-F568 HydrophobicContact CB-CE2 4.25Å; M566-F568 HydrophobicContact CE-CE1 4.42Å; M566-F568 HydrophobicContact CE-CE2 4.01Å; M566-F568 HydrophobicContact CE-CZ 3.57Å; M566-F608 HydrophobicContact CG-CE1 3.73Å; M566-F608 HydrophobicContact CG-CZ 3.55Å; M566-F608 HydrophobicContact SD-CE1 4.19Å; M566-L616 HydrophobicContact CE-CD2 4.04Å; M566-L616 HydrophobicContact CG-CB 4.44Å; M566-L616 HydrophobicContact CG-CD2 4.32Å; M566-T618 HydrophobicContact CE-CG2 4.05Å; M566-A622 HydrophobicContact CE-CB 4.35Å; M566-I628 HydrophobicContact CE-CD1 4.32Å; M566-I628 HydrophobicContact SD-CD1 4.07Å; M566-V631 HydrophobicContact CB-CG1 4.44Å; M566-V631 HydrophobicContact CG-CG1 3.93Å; M566-V631 HydrophobicContact CG-CG2 4.37Å; M566-V631 HydrophobicContact SD-CG1 4.19Å; M566-V631 HydrophobicContact SD-CG2 3.99Å; M566-H633 PolarHBondContact N-O 3.43Å; M566-V634 CarbonylContact O-C 3.57Å; M566-V634 WeakPolarHBondContact O-CA 3.37Å; M566-I635 PolarHBondContact O-N 3.01Å; M566-R652 HydrophobicContact CE-CB 4.44Å; M566-R652 HydrophobicContact CE-CG 4.08Å; M566-R652 HydrophobicContact SD-CB 3.76Å; M566-R652 HydrophobicContact SD-CG 4.06Å
567	V	94.9	Very high	89.8	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.012	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.9	179.2	-171.1	0	0	0	0	109.2	L554 T565 L578 V615 L616 L617 T618 I635	L554-V567 HydrophobicContact CD1-CG1 3.99Å; L554-V567 HydrophobicContact CD1-CG2 4.02Å; L554-V567 HydrophobicContact CD2-CG1 4.24Å; T565-V567 HydrophobicContact CG2-CG2 4.17Å; V567-L578 HydrophobicContact CG1-CD2 4.43Å; V567-V615 HydrophobicContact CG2-CG1 3.85Å; V567-L616 PolarHBondContact N-O 2.93Å; V567-L617 HydrophobicContact CB-CD2 3.66Å; V567-L617 HydrophobicContact CG1-CD2 4.14Å; V567-L617 HydrophobicContact CG2-CD2 3.88Å; V567-T618 PolarHBondContact O-N 3.11Å; V567-I635 CarbonylContact C-O 3.57Å; V567-I635 WeakPolarHBondContact CA-O 3.36Å; V567-I635 HydrophobicContact CG1-CB 4.37Å; V567-I635 HydrophobicContact CG2-CB 4.4Å; V567-I635 HydrophobicContact CG2-CD1 4.37Å
568	F	95.4	Very high	90	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.7	-176.7	-78	-76.4	0	0	0	113	M566 T618 A623 V634 I635 Y637 Q638 R649 R652	M566-F568 HydrophobicContact CB-CE2 4.25Å; M566-F568 HydrophobicContact CE-CE1 4.42Å; M566-F568 HydrophobicContact CE-CE2 4.01Å; M566-F568 HydrophobicContact CE-CZ 3.57Å; F568-T618 WeakPolarHBondContact CA-O 3.46Å; F568-T618 HydrophobicContact CD1-CG2 3.73Å; F568-T618 HydrophobicContact CE1-CG2 3.46Å; F568-T618 VanDerWaalsContact CE1-CG2 3.46Å; F568-T618 HydrophobicContact CG-CG2 4.46Å; F568-T618 HydrophobicContact CZ-CG2 4Å; F568-A623 HydrophobicContact CD1-CB 4.44Å; F568-A623 HydrophobicContact CE1-CB 3.65Å; F568-A623 HydrophobicContact CZ-CB 4Å; F568-V634 HydrophobicContact CD2-CG1 4.03Å; F568-V634 HydrophobicContact CE2-CG1 4.2Å; F568-I635 PolarHBondContact N-O 2.81Å; F568-Y637 WeakPolarHBondContact O-CB 3.06Å; F568-Y637 PolarHBondContact O-N 3.29Å; F568-Q638 PolarHBondContact O-N 3.06Å; F568-R649 HydrophobicContact CB-CG 4.34Å; F568-R649 HydrophobicContact CD1-CG 3.75Å; F568-R649 HydrophobicContact CD2-CB 3.87Å; F568-R649 HydrophobicContact CD2-CG 3.74Å; F568-R649 HydrophobicContact CE1-CG 3.89Å; F568-R649 HydrophobicContact CE2-CB 3.86Å; F568-R649 HydrophobicContact CE2-CG 3.88Å; F568-R649 HydrophobicContact CG-CB 4.3Å; F568-R649 HydrophobicContact CG-CG 3.67Å; F568-R649 HydrophobicContact CZ-CB 4.3Å; F568-R649 HydrophobicContact CZ-CG 3.95Å; F568-R652 HydrophobicContact CE2-CG 3.96Å; F568-R652 HydrophobicContact CZ-CG 3.87Å
569	A	93.7	Very high	90.2	Very high	2 Å²	2	30.5 Å²	30.5	2%	0.017	16%	0.161	C	C	.	.			trans	-129.4	150.8	171.2	0	0	0	0	0	111.2	C574 I575 T618 T619	A569-C574 HydrophobicContact CB-CB 4.3Å; A569-I575 HydrophobicContact CB-CD1 4.49Å; A569-I575 HydrophobicContact CB-CG1 3.95Å; A569-T618 PolarHBondContact N-O 2.9Å; A569-T619 WeakPolarHBondContact O-CA 3.28Å
570	N	91	Very high	90.5	Very high	49 Å²	49	29.5 Å²	29.5	26%	0.262	16%	0.161	S	C	.	.	S	Bend	trans	-85.7	-17	-177.5	-57.9	-5	0	0	0	112.5	Q638 V639 R649	N570-Q638 HydrophobicContact CB-CB 4.26Å; N570-V639 PolarHBondContact ND2-O 3.35Å; N570-R649 PolarHBondContact OD1-NH1 2.94Å; N570-R649 PolarHBondContact OD1-NH2 2.93Å
571	S	90.7	Very high	91	Very high	39 Å²	39	27.9 Å²	27.9	27%	0.273	15%	0.154	S	C	.	.			trans	-119.7	140.2	-179.4	148.9	0	0	0	0	111.1	D573 C574 I575	S571-D573 VanDerWaalsContact C-N 3.35Å; S571-D573 PolarHBondContact OG-N 3.1Å; S571-D573 PolarHBondContact OG-OD2 3.24Å; S571-C574 WeakPolarHBondContact O-CB 3.27Å; S571-C574 PolarHBondContact O-N 3.33Å; S571-C574 PolarHBondContact OG-N 2.83Å; S571-I575 PolarHBondContact O-N 3.12Å
572	I	91.3	Very high	91.4	Very high	44 Å²	44	27.6 Å²	27.6	23%	0.226	15%	0.153	C	C	.	.	H	α-helix	trans	-65.6	-39.1	175.8	-62.5	-176.3	0	0	0	110.9	C574 I575 K576 H593 A594 N595 T619	I572-C574 VanDerWaalsContact C-N 3.29Å; I572-C574 PolarHBondContact O-N 2.93Å; I572-I575 WeakPolarHBondContact O-CA 3.44Å; I572-I575 WeakPolarHBondContact O-CB 3.42Å; I572-I575 PolarHBondContact O-N 3.36Å; I572-K576 PolarHBondContact O-N 3.19Å; I572-H593 HydrophobicContact CD1-CB 4.39Å; I572-H593 HydrophobicContact CG1-CB 4.11Å; I572-H593 HydrophobicContact CG2-CB 4.12Å; I572-A594 HydrophobicContact CD1-CB 4.34Å; I572-N595 HydrophobicContact CD1-CB 4.42Å; I572-T619 HydrophobicContact CG1-CG2 4.05Å
573	D	90.9	Very high	91.8	Very high	106 Å²	106	28 Å²	28	57%	0.567	15%	0.154	S	C	*	.	H	α-helix	trans	-68.3	-33.7	-178.6	-38.3	-72.9	0	0	0	111.1	S571 I575 K576 R577	S571-D573 VanDerWaalsContact C-N 3.35Å; S571-D573 PolarHBondContact OG-N 3.1Å; S571-D573 PolarHBondContact OG-OD2 3.24Å; D573-I575 VanDerWaalsContact C-N 3.28Å; D573-I575 PolarHBondContact O-N 3.48Å; D573-K576 PolarHBondContact O-N 3.45Å; D573-R577 WeakPolarHBondContact O-CB 2.98Å; D573-R577 PolarHBondContact O-N 3.44Å
574	C	91.7	Very high	92.1	Very high	15 Å²	15	29 Å²	29	10%	0.101	16%	0.158	C	C	.	.	H	α-helix	trans	-60.1	-39.3	170.1	-162	0	0	0	0	111.4	A569 S571 I572 L578 Y637	A569-C574 HydrophobicContact CB-CB 4.3Å; S571-C574 WeakPolarHBondContact O-CB 3.27Å; S571-C574 PolarHBondContact O-N 3.33Å; S571-C574 PolarHBondContact OG-N 2.83Å; I572-C574 VanDerWaalsContact C-N 3.29Å; I572-C574 PolarHBondContact O-N 2.93Å; C574-L578 WeakPolarHBondContact O-CB 3.45Å; C574-L578 PolarHBondContact O-N 3.31Å; C574-Y637 VanDerWaalsContact SG-CE1 3.57Å
575	I	93.1	Very high	92	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-70.2	-43.5	174.2	-63.8	168.9	0	0	0	111.6	A569 S571 I572 D573 L578 S579 P591 H593 L617 T619	A569-I575 HydrophobicContact CB-CD1 4.49Å; A569-I575 HydrophobicContact CB-CG1 3.95Å; S571-I575 PolarHBondContact O-N 3.12Å; I572-I575 WeakPolarHBondContact O-CA 3.44Å; I572-I575 WeakPolarHBondContact O-CB 3.42Å; I572-I575 PolarHBondContact O-N 3.36Å; D573-I575 VanDerWaalsContact C-N 3.28Å; D573-I575 PolarHBondContact O-N 3.48Å; I575-L578 PolarHBondContact O-N 2.93Å; I575-S579 WeakPolarHBondContact O-CB 3.45Å; I575-S579 PolarHBondContact O-N 3.28Å; I575-P591 HydrophobicContact CG2-CB 4.05Å; I575-H593 HydrophobicContact CD1-CB 4.4Å; I575-L617 HydrophobicContact CG2-CB 3.89Å; I575-T619 HydrophobicContact CD1-CG2 3.41Å; I575-T619 VanDerWaalsContact CD1-CG2 3.41Å
576	K	91.4	Very high	91.9	Very high	106 Å²	106	33.8 Å²	33.8	46%	0.461	18%	0.184	S	C	.	.	H	α-helix	trans	-57.4	-53.1	177.1	-70.1	177.6	177.5	176.3	0	111.1	I572 D573 L578 S579 A580	I572-K576 PolarHBondContact O-N 3.19Å; D573-K576 PolarHBondContact O-N 3.45Å; K576-L578 PolarHBondContact O-N 3.08Å; K576-S579 PolarHBondContact O-N 3.18Å; K576-A580 PolarHBondContact O-N 3.39Å
577	R	91.9	Very high	91.4	Very high	64 Å²	64	35.1 Å²	35.1	24%	0.242	19%	0.193	C	C	.	.	H	α-helix	trans	-56.4	-49.5	174.7	-174.8	-157	67.7	100	1.7	111.9	D551 D573 S579 A580 L581 Y637 E711	D551-R577 IonicContact OD1-CZ 2.72Å; D551-R577 IonicContact OD1-NH1 3.48Å; D551-R577 PolarHBondContact OD1-NH1 2.9Å; D551-R577 VanDerWaalsContact OD1-NH1 3.16Å; D551-R577 IonicContact OD1-NH2 3.36Å; D551-R577 PolarHBondContact OD1-NH2 3.34Å; D551-R577 IonicContact OD2-CZ 2.61Å; D551-R577 IonicContact OD2-NH1 3.53Å; D551-R577 PolarHBondContact OD2-NH1 3.13Å; D551-R577 IonicContact OD2-NH2 2.61Å; D573-R577 WeakPolarHBondContact O-CB 2.98Å; D573-R577 PolarHBondContact O-N 3.44Å; R577-S579 VanDerWaalsContact C-N 3.34Å; R577-S579 PolarHBondContact O-N 2.96Å; R577-A580 PolarHBondContact O-N 3Å; R577-L581 WeakPolarHBondContact O-CB 3.31Å; R577-L581 PolarHBondContact O-N 3.32Å; R577-Y637 PolarHBondContact NH2-OH 3.45Å; R577-E711 VanDerWaalsContact CG-OE1 3.25Å; R577-E711 WeakPolarHBondContact CG-OE1 3.2Å
578	L	93	Very high	91	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-68.5	-33.4	-176.7	-176.2	61	0	0	0	112.4	L554 V567 C574 I575 K576 L581 L582 L617 Y637	L554-L578 HydrophobicContact CD2-CD1 3.77Å; L554-L578 HydrophobicContact CD2-CD2 3.75Å; L554-L578 HydrophobicContact CD2-CG 4.25Å; V567-L578 HydrophobicContact CG1-CD2 4.43Å; C574-L578 WeakPolarHBondContact O-CB 3.45Å; C574-L578 PolarHBondContact O-N 3.31Å; I575-L578 PolarHBondContact O-N 2.93Å; K576-L578 PolarHBondContact O-N 3.08Å; L578-L581 HydrophobicContact CD1-CD2 4.46Å; L578-L582 HydrophobicContact CD1-CD1 3.96Å; L578-L582 HydrophobicContact CD1-CG 4.05Å; L578-L582 HydrophobicContact CG-CD1 3.96Å; L578-L582 HydrophobicContact CG-CG 4.43Å; L578-L582 VanDerWaalsContact O-CB 3.3Å; L578-L582 WeakPolarHBondContact O-CB 3.32Å; L578-L582 WeakPolarHBondContact O-CG 3.47Å; L578-L582 PolarHBondContact O-N 3.37Å; L578-L617 HydrophobicContact CB-CD1 4.29Å; L578-L617 HydrophobicContact CD2-CD1 4.33Å; L578-L617 HydrophobicContact CD2-CD2 3.94Å; L578-L617 HydrophobicContact CG-CD1 4.01Å; L578-L617 HydrophobicContact CG-CD2 4.35Å; L578-Y637 HydrophobicContact CD2-CD2 4.42Å
579	S	93.6	Very high	90.9	Very high	19 Å²	19	39.9 Å²	39.9	13%	0.133	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-45	173.4	-165.9	0	0	0	0	111	I575 K576 R577 V583	I575-S579 WeakPolarHBondContact O-CB 3.45Å; I575-S579 PolarHBondContact O-N 3.28Å; K576-S579 PolarHBondContact O-N 3.18Å; R577-S579 VanDerWaalsContact C-N 3.34Å; R577-S579 PolarHBondContact O-N 2.96Å; S579-V583 WeakPolarHBondContact O-CB 3.46Å; S579-V583 VanDerWaalsContact O-CG2 3.27Å; S579-V583 WeakPolarHBondContact O-CG2 3.47Å; S579-V583 PolarHBondContact O-N 3.05Å
580	A	91.6	Very high	90.9	Very high	41 Å²	41	40.9 Å²	40.9	34%	0.339	22%	0.224	S	C	.	.	H	α-helix	trans	-61	-49.4	174.5	0	0	0	0	0	111.4	K576 R577 L582 V583 I584 E711	K576-A580 PolarHBondContact O-N 3.39Å; R577-A580 PolarHBondContact O-N 3Å; A580-L582 PolarHBondContact O-N 2.94Å; A580-V583 PolarHBondContact O-N 2.99Å; A580-I584 WeakPolarHBondContact O-CD1 3.31Å; A580-I584 VanDerWaalsContact O-CG1 3.31Å; A580-I584 WeakPolarHBondContact O-CG1 3.47Å; A580-I584 PolarHBondContact O-N 3.42Å; A580-E711 HydrophobicContact CB-CG 3.96Å
581	L	92.6	Very high	91	Very high	2 Å²	2	40 Å²	40	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-58.5	-44.4	179	-174.9	66.8	0	0	0	112.7	D551 R577 L578 I584 L585 A707 R708 E711	D551-L581 HydrophobicContact CB-CD2 4.02Å; R577-L581 WeakPolarHBondContact O-CB 3.31Å; R577-L581 PolarHBondContact O-N 3.32Å; L578-L581 HydrophobicContact CD1-CD2 4.46Å; L581-I584 PolarHBondContact O-N 3.25Å; L581-L585 HydrophobicContact CD1-CD1 4.47Å; L581-L585 HydrophobicContact CG-CD1 4.14Å; L581-L585 VanDerWaalsContact O-CG 3.32Å; L581-L585 WeakPolarHBondContact O-CG 3.32Å; L581-L585 PolarHBondContact O-N 2.91Å; L581-L585 VanDerWaalsContact O-N 3.07Å; L581-A707 HydrophobicContact CD1-CB 3.73Å; L581-R708 HydrophobicContact CD1-CB 4.28Å; L581-E711 HydrophobicContact CB-CG 4.46Å; L581-E711 HydrophobicContact CD1-CB 4.42Å
582	L	92	Very high	90.9	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-77.8	-23.3	-179.5	-74.3	176.3	0	0	0	113.8	L554 Y555 L558 L578 A580 L585 D586 C587 P589 L617	L554-L582 HydrophobicContact CD2-CD1 4.21Å; Y555-L582 HydrophobicContact CD2-CD2 4.4Å; L558-L582 HydrophobicContact CD1-CD1 4.02Å; L558-L582 HydrophobicContact CD1-CD2 4.08Å; L578-L582 HydrophobicContact CD1-CD1 3.96Å; L578-L582 HydrophobicContact CD1-CG 4.05Å; L578-L582 HydrophobicContact CG-CD1 3.96Å; L578-L582 HydrophobicContact CG-CG 4.43Å; L578-L582 VanDerWaalsContact O-CB 3.3Å; L578-L582 WeakPolarHBondContact O-CB 3.32Å; L578-L582 WeakPolarHBondContact O-CG 3.47Å; L578-L582 PolarHBondContact O-N 3.37Å; A580-L582 PolarHBondContact O-N 2.94Å; L582-L585 HydrophobicContact CD2-CD1 4.33Å; L582-L585 CarbonylContact O-C 3.24Å; L582-L585 PolarHBondContact O-N 3.04Å; L582-D586 PolarHBondContact O-N 3.34Å; L582-C587 HydrophobicContact CB-CB 4.19Å; L582-C587 HydrophobicContact CD2-CB 4.13Å; L582-C587 PolarHBondContact O-N 3.26Å; L582-P589 HydrophobicContact CB-CG 3.8Å; L582-L617 HydrophobicContact CD1-CD1 4.26Å; L582-L617 HydrophobicContact CD1-CD2 4.05Å
583	V	91.6	Very high	90.9	Very high	73 Å²	73	37 Å²	37	44%	0.442	20%	0.202	S	C	.	.	H	α-helix	trans	-69.2	-41.4	165.8	167.3	0	0	0	0	110.5	S579 A580 L585 D586 P589	S579-V583 WeakPolarHBondContact O-CB 3.46Å; S579-V583 VanDerWaalsContact O-CG2 3.27Å; S579-V583 WeakPolarHBondContact O-CG2 3.47Å; S579-V583 PolarHBondContact O-N 3.05Å; A580-V583 PolarHBondContact O-N 2.99Å; V583-L585 PolarHBondContact O-N 3.23Å; V583-D586 PolarHBondContact O-N 2.96Å; V583-D586 VanDerWaalsContact O-N 3.09Å; V583-P589 HydrophobicContact CG2-CG 4.38Å
584	I	89.8	Confident	90.4	Very high	28 Å²	28	34.9 Å²	34.9	14%	0.144	20%	0.199	C	C	.	.	H	α-helix	trans	-63.9	-26.7	175	-68.2	160.9	0	0	0	111.7	A580 L581 A707 I710 E711 L767	A580-I584 WeakPolarHBondContact O-CD1 3.31Å; A580-I584 VanDerWaalsContact O-CG1 3.31Å; A580-I584 WeakPolarHBondContact O-CG1 3.47Å; A580-I584 PolarHBondContact O-N 3.42Å; L581-I584 PolarHBondContact O-N 3.25Å; I584-A707 HydrophobicContact CG2-CB 3.72Å; I584-I710 HydrophobicContact CD1-CG2 3.93Å; I584-I710 HydrophobicContact CG1-CG2 4.37Å; I584-I710 HydrophobicContact CG2-CB 4.33Å; I584-I710 HydrophobicContact CG2-CD1 4.23Å; I584-I710 HydrophobicContact CG2-CG2 4.2Å; I584-E711 HydrophobicContact CD1-CB 3.73Å; I584-E711 HydrophobicContact CD1-CG 4.31Å; I584-L767 HydrophobicContact CG2-CD2 3.49Å; I584-L767 VanDerWaalsContact CG2-CD2 3.49Å; I584-L767 WeakPolarHBondContact O-CD2 3.26Å
585	L	88.5	Confident	90.1	Very high	3 Å²	3	40 Å²	40	2%	0.016	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	9.5	175.1	-67.5	166.8	0	0	0	114.5	Y555 L581 L582 V583 C587 R703 V704 A707 L767	Y555-L585 HydrophobicContact CD1-CD1 4.38Å; Y555-L585 HydrophobicContact CD2-CB 4.24Å; Y555-L585 HydrophobicContact CD2-CD1 4.03Å; Y555-L585 HydrophobicContact CE1-CD2 3.96Å; Y555-L585 HydrophobicContact CE2-CB 3.71Å; Y555-L585 HydrophobicContact CE2-CD1 4.22Å; Y555-L585 HydrophobicContact CE2-CD2 4.28Å; Y555-L585 HydrophobicContact CE2-CG 4.3Å; Y555-L585 HydrophobicContact CG-CD1 4.12Å; L581-L585 HydrophobicContact CD1-CD1 4.47Å; L581-L585 HydrophobicContact CG-CD1 4.14Å; L581-L585 VanDerWaalsContact O-CG 3.32Å; L581-L585 WeakPolarHBondContact O-CG 3.32Å; L581-L585 PolarHBondContact O-N 2.91Å; L581-L585 VanDerWaalsContact O-N 3.07Å; L582-L585 HydrophobicContact CD2-CD1 4.33Å; L582-L585 CarbonylContact O-C 3.24Å; L582-L585 PolarHBondContact O-N 3.04Å; V583-L585 PolarHBondContact O-N 3.23Å; L585-C587 VanDerWaalsContact C-N 3.26Å; L585-C587 PolarHBondContact O-N 2.94Å; L585-R703 HydrophobicContact CD2-CB 4.33Å; L585-V704 HydrophobicContact CD1-CG2 3.97Å; L585-V704 HydrophobicContact CD2-CG2 4.5Å; L585-A707 HydrophobicContact CD1-CB 4.22Å; L585-A707 HydrophobicContact CD2-CB 3.59Å; L585-A707 HydrophobicContact CG-CB 3.71Å; L585-L767 HydrophobicContact CD2-CD1 4.34Å
586	D	87.4	Confident	89.6	Confident	108 Å²	108	41.7 Å²	41.7	58%	0.578	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	21.3	178	-150.3	15.9	0	0	0	116.1	L582 V583 N588	L582-D586 PolarHBondContact O-N 3.34Å; V583-D586 PolarHBondContact O-N 2.96Å; V583-D586 VanDerWaalsContact O-N 3.09Å; D586-N588 PolarHBondContact O-ND2 3.43Å; D586-N588 PolarHBondContact OD1-ND2 3.04Å
587	C	83.6	Confident	89.1	Confident	28 Å²	28	44.2 Å²	44.2	19%	0.189	25%	0.247	C	C	.	.			trans	-84.9	-8.6	174	-68.2	0	0	0	0	113.7	L582 L585	L582-C587 HydrophobicContact CB-CB 4.19Å; L582-C587 HydrophobicContact CD2-CB 4.13Å; L582-C587 PolarHBondContact O-N 3.26Å; L585-C587 VanDerWaalsContact C-N 3.26Å; L585-C587 PolarHBondContact O-N 2.94Å
588	N	86.8	Confident	88.4	Confident	93 Å²	93	43 Å²	43	50%	0.497	24%	0.244	S	C	.	.			trans	40.4	57	172.8	-64.3	-56.4	0	0	0	115.5	D586	D586-N588 PolarHBondContact O-ND2 3.43Å; D586-N588 PolarHBondContact OD1-ND2 3.04Å
589	P	92.6	Very high	87.8	Confident	10 Å²	10	51.1 Å²	51.1	7%	0.065	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-66.2	155.4	-178.6	30.1	-39.1	0	0	0	113.6	L582 V583 L617	L582-P589 HydrophobicContact CB-CG 3.8Å; V583-P589 HydrophobicContact CG2-CG 4.38Å; P589-L617 HydrophobicContact CB-CD1 3.68Å; P589-L617 HydrophobicContact CB-CD2 4.46Å; P589-L617 HydrophobicContact CB-CG 3.73Å; P589-L617 HydrophobicContact CG-CD1 3.9Å; P589-L617 HydrophobicContact CG-CG 4.49Å
590	L	93.5	Very high	87.4	Confident	23 Å²	23	55.6 Å²	55.6	12%	0.12	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.5	166.5	-59.6	177.9	0	0	0	109.1	N604 R607 F608 C614 V615 L616 L617	L590-N604 HydrophobicContact CB-CB 4.36Å; L590-N604 WeakPolarHBondContact CD1-O 3.37Å; L590-R607 HydrophobicContact CD1-CB 3.78Å; L590-F608 HydrophobicContact CD1-CB 4.11Å; L590-C614 VanDerWaalsContact CD1-SG 3.57Å; L590-V615 PolarHBondContact N-O 3.43Å; L590-L616 HydrophobicContact CB-CD1 4.05Å; L590-L616 CarbonylContact O-C 3.43Å; L590-L616 WeakPolarHBondContact O-CA 3.38Å; L590-L617 PolarHBondContact O-N 3.41Å
591	P	93.1	Very high	87	Confident	31 Å²	31	55 Å²	55	20%	0.201	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	148.2	172.8	31.6	-34.4	0	0	0	111.6	I575 M596 N604 L617	I575-P591 HydrophobicContact CG2-CB 4.05Å; P591-M596 HydrophobicContact CG-CE 4.45Å; P591-M596 WeakPolarHBondContact O-CE 3.49Å; P591-N604 PolarHBondContact O-ND2 2.79Å; P591-L617 CarbonylContact C-O 3.6Å; P591-L617 WeakPolarHBondContact CA-O 3.33Å
592	L	89.9	Confident	86.4	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	99.2	177.2	-176.1	66.7	0	0	0	111.3	R601 L616 L617 T618 T619 A622	L592-R601 HydrophobicContact CD1-CB 3.63Å; L592-R601 HydrophobicContact CD1-CG 3.86Å; L592-L616 HydrophobicContact CB-CD1 3.88Å; L592-L616 HydrophobicContact CD2-CD1 4.16Å; L592-L616 HydrophobicContact CD2-CD2 4.15Å; L592-L617 PolarHBondContact N-O 3.25Å; L592-T618 VanDerWaalsContact O-CA 3.26Å; L592-T618 WeakPolarHBondContact O-CA 3.38Å; L592-T618 WeakPolarHBondContact O-CB 3.46Å; L592-T618 PolarHBondContact O-OG1 3.24Å; L592-T619 PolarHBondContact O-N 3.44Å; L592-A622 HydrophobicContact CD2-CB 3.66Å
593	H	89.3	Confident	86.2	Confident	14 Å²	14	62.3 Å²	62.3	7%	0.065	32%	0.321	C	S	.	.			trans	-138	169.2	179	59.1	76	0	0	0	112.7	I572 I575 N595 M596 R601 T619	I572-H593 HydrophobicContact CD1-CB 4.39Å; I572-H593 HydrophobicContact CG1-CB 4.11Å; I572-H593 HydrophobicContact CG2-CB 4.12Å; I575-H593 HydrophobicContact CD1-CB 4.4Å; H593-N595 PolarHBondContact CE1-O 3.3Å; H593-N595 PolarHBondContact ND1-N 3.01Å; H593-N595 PolarHBondContact ND1-O 2.82Å; H593-N595 PolarHBondContact O-N 3.4Å; H593-M596 VanDerWaalsContact CE1-CG 3.45Å; H593-M596 WeakPolarHBondContact CE1-CG 3.48Å; H593-M596 PolarHBondContact N-SD 2.94Å; H593-M596 PolarHBondContact O-N 2.8Å; H593-R601 WeakPolarHBondContact O-CD 3.34Å; H593-T619 HydrophobicContact CB-CG2 4.37Å
594	A	81.9	Confident	86	Confident	63 Å²	63	59.6 Å²	59.6	52%	0.521	30%	0.304	S	S	.	.	S	Bend	trans	-58.7	-46.7	-175.3	0	0	0	0	0	113.1	I572 M596 V621	I572-A594 HydrophobicContact CD1-CB 4.34Å; A594-M596 PolarHBondContact O-N 2.87Å; A594-V621 HydrophobicContact CB-CG2 4Å
595	N	84.8	Confident	85.8	Confident	122 Å²	122	58.7 Å²	58.7	65%	0.652	30%	0.299	S	S	*	.	S	Bend	trans	-75.9	48.5	177.1	-166.9	1.8	0	0	0	113	I572 H593	I572-N595 HydrophobicContact CD1-CB 4.42Å; H593-N595 PolarHBondContact CE1-O 3.3Å; H593-N595 PolarHBondContact ND1-N 3.01Å; H593-N595 PolarHBondContact ND1-O 2.82Å; H593-N595 PolarHBondContact O-N 3.4Å
596	M	83.3	Confident	85.6	Confident	36 Å²	36	62 Å²	62	18%	0.177	31%	0.314	C	S	.	.	S	Bend	trans	-130.7	136.2	170	-70.9	177.9	70.5	0	0	108.6	P591 H593 A594 Q598 H600 R601	P591-M596 HydrophobicContact CG-CE 4.45Å; P591-M596 WeakPolarHBondContact O-CE 3.49Å; H593-M596 VanDerWaalsContact CE1-CG 3.45Å; H593-M596 WeakPolarHBondContact CE1-CG 3.48Å; H593-M596 PolarHBondContact N-SD 2.94Å; H593-M596 PolarHBondContact O-N 2.8Å; A594-M596 PolarHBondContact O-N 2.87Å; M596-Q598 PolarHBondContact O-N 3.4Å; M596-H600 HydrophobicContact CE-CB 4.25Å; M596-R601 HydrophobicContact CB-CG 3.53Å; M596-R601 WeakPolarHBondContact O-CD 3.44Å; M596-R601 HydrophobicContact SD-CG 4.47Å
597	H	81	Confident	85.6	Confident	160 Å²	160	62 Å²	62	74%	0.741	31%	0.306	S	S	*	.			trans	-55	135.5	174.2	-60.5	-68.8	0	0	0	111.4	K599 H600 R601	H597-K599 VanDerWaalsContact C-N 3.26Å; H597-K599 PolarHBondContact O-N 2.66Å; H597-K599 VanDerWaalsContact O-N 3.14Å; H597-H600 WeakPolarHBondContact O-CB 3.4Å; H597-H600 PolarHBondContact O-N 2.6Å; H597-R601 PolarHBondContact O-N 2.78Å; H597-R601 VanDerWaalsContact O-N 3.14Å
598	Q	75.6	Confident	85.9	Confident	39 Å²	39	60.6 Å²	60.6	18%	0.182	30%	0.297	C	S	.	.	H	α-helix	trans	-55.9	-36.9	-170.8	-171.1	167.2	-30.9	0	0	113.3	R373 G399 M596 H600 R601 L602	R373-Q598 VanDerWaalsContact CD-OE1 3.27Å; G399-Q598 PolarHBondContact O-OE1 3.08Å; M596-Q598 PolarHBondContact O-N 3.4Å; Q598-H600 VanDerWaalsContact C-N 3.32Å; Q598-H600 PolarHBondContact O-N 2.85Å; Q598-R601 PolarHBondContact O-N 3.33Å; Q598-R601 VanDerWaalsContact O-N 3.15Å; Q598-L602 HydrophobicContact CG-CD1 4.46Å; Q598-L602 WeakPolarHBondContact O-CG 3.24Å; Q598-L602 PolarHBondContact O-N 3.3Å
599	K	81.1	Confident	85.9	Confident	174 Å²	174	56.9 Å²	56.9	76%	0.757	28%	0.279	S	S	*	.	H	α-helix	trans	-60.9	-34.5	174.8	-168.3	170.1	-175.6	171.2	0	113.2	H597 K603	H597-K599 VanDerWaalsContact C-N 3.26Å; H597-K599 PolarHBondContact O-N 2.66Å; H597-K599 VanDerWaalsContact O-N 3.14Å; K599-K603 WeakPolarHBondContact O-CB 3.46Å; K599-K603 PolarHBondContact O-N 2.95Å
600	H	84.7	Confident	85.6	Confident	113 Å²	113	62.5 Å²	62.5	52%	0.523	30%	0.304	S	S	.	.	H	α-helix	trans	-78.1	-33.5	173.8	-81.7	-102.7	0	0	0	112.6	M596 H597 Q598 K603 N604	M596-H600 HydrophobicContact CE-CB 4.25Å; H597-H600 WeakPolarHBondContact O-CB 3.4Å; H597-H600 PolarHBondContact O-N 2.6Å; Q598-H600 VanDerWaalsContact C-N 3.32Å; Q598-H600 PolarHBondContact O-N 2.85Å; H600-K603 PolarHBondContact O-N 3.24Å; H600-N604 WeakPolarHBondContact O-CB 3.42Å; H600-N604 PolarHBondContact O-N 2.82Å
601	R	83.8	Confident	85.2	Confident	28 Å²	28	66.9 Å²	66.9	11%	0.106	32%	0.322	C	S	.	.	H	α-helix	trans	-63.3	-47.2	176.4	-67.1	-180	56.8	-122.7	-14.9	111.3	E374 L592 H593 M596 H597 Q598 N604 L605	E374-R601 VanDerWaalsContact CD-NH2 3.3Å; E374-R601 IonicContact OE1-CZ 2.74Å; E374-R601 IonicContact OE1-NH1 3.64Å; E374-R601 PolarHBondContact OE1-NH1 2.83Å; E374-R601 IonicContact OE1-NH2 3.52Å; E374-R601 PolarHBondContact OE1-NH2 3.44Å; E374-R601 IonicContact OE2-NH2 2.74Å; L592-R601 HydrophobicContact CD1-CB 3.63Å; L592-R601 HydrophobicContact CD1-CG 3.86Å; H593-R601 WeakPolarHBondContact O-CD 3.34Å; M596-R601 HydrophobicContact CB-CG 3.53Å; M596-R601 WeakPolarHBondContact O-CD 3.44Å; M596-R601 HydrophobicContact SD-CG 4.47Å; H597-R601 PolarHBondContact O-N 2.78Å; H597-R601 VanDerWaalsContact O-N 3.14Å; Q598-R601 PolarHBondContact O-N 3.33Å; Q598-R601 VanDerWaalsContact O-N 3.15Å; R601-N604 PolarHBondContact O-N 3.5Å; R601-L605 PolarHBondContact O-N 3.07Å; R601-L605 VanDerWaalsContact O-N 3.08Å
602	L	80.8	Confident	84.6	Confident	56 Å²	56	72.9 Å²	72.9	29%	0.293	35%	0.348	S	S	.	.	H	α-helix	trans	-61.5	-49.6	174.5	-67.2	171.3	0	0	0	111.5	Q598 N604 L605 E606	Q598-L602 HydrophobicContact CG-CD1 4.46Å; Q598-L602 WeakPolarHBondContact O-CG 3.24Å; Q598-L602 PolarHBondContact O-N 3.3Å; L602-N604 VanDerWaalsContact C-N 3.29Å; L602-N604 PolarHBondContact O-N 2.97Å; L602-L605 CarbonylContact O-C 3.6Å; L602-L605 WeakPolarHBondContact O-CA 3.1Å; L602-L605 WeakPolarHBondContact O-CB 3.21Å; L602-L605 PolarHBondContact O-N 2.8Å; L602-E606 WeakPolarHBondContact O-CG 3.28Å; L602-E606 PolarHBondContact O-N 3.27Å
603	K	85.9	Confident	84.4	Confident	103 Å²	103	78 Å²	78	45%	0.448	38%	0.375	S	S	.	.	H	α-helix	trans	-59.4	-32.9	178.4	-171.3	165.4	-174.5	166.9	0	114.6	K599 H600 E606 R607	K599-K603 WeakPolarHBondContact O-CB 3.46Å; K599-K603 PolarHBondContact O-N 2.95Å; H600-K603 PolarHBondContact O-N 3.24Å; K603-E606 WeakPolarHBondContact CA-OE2 3.49Å; K603-R607 WeakPolarHBondContact O-CB 3.29Å; K603-R607 VanDerWaalsContact O-CD 3.28Å; K603-R607 WeakPolarHBondContact O-CD 3.48Å; K603-R607 WeakPolarHBondContact O-CG 3.28Å; K603-R607 PolarHBondContact O-N 2.97Å
604	N	88.9	Confident	84.4	Confident	15 Å²	15	78 Å²	78	8%	0.08	38%	0.377	C	S	.	.	H	α-helix	trans	-76.5	-32.7	173.2	-81	3.1	0	0	0	112.3	L590 P591 H600 R601 L602 F608	L590-N604 HydrophobicContact CB-CB 4.36Å; L590-N604 WeakPolarHBondContact CD1-O 3.37Å; P591-N604 PolarHBondContact O-ND2 2.79Å; H600-N604 WeakPolarHBondContact O-CB 3.42Å; H600-N604 PolarHBondContact O-N 2.82Å; R601-N604 PolarHBondContact O-N 3.5Å; L602-N604 VanDerWaalsContact C-N 3.29Å; L602-N604 PolarHBondContact O-N 2.97Å; N604-F608 WeakPolarHBondContact O-CB 3.47Å; N604-F608 PolarHBondContact O-N 3.34Å; N604-F608 VanDerWaalsContact O-N 3.14Å
605	L	84.8	Confident	84.9	Confident	9 Å²	9	75.8 Å²	75.8	5%	0.047	36%	0.357	C	S	.	.	H	α-helix	trans	-68.1	-45.3	174.5	-176.7	65.7	0	0	0	111.8	W197 R601 L602 F608 A609 L626 I628	W197-L605 HydrophobicContact CZ2-CD2 4.24Å; W197-L605 HydrophobicContact CZ2-CG 4.42Å; R601-L605 PolarHBondContact O-N 3.07Å; R601-L605 VanDerWaalsContact O-N 3.08Å; L602-L605 CarbonylContact O-C 3.6Å; L602-L605 WeakPolarHBondContact O-CA 3.1Å; L602-L605 WeakPolarHBondContact O-CB 3.21Å; L602-L605 PolarHBondContact O-N 2.8Å; L605-F608 PolarHBondContact O-N 3.03Å; L605-A609 WeakPolarHBondContact O-CB 3.28Å; L605-A609 PolarHBondContact O-N 3.31Å; L605-L626 HydrophobicContact CD1-CD1 3.97Å; L605-L626 HydrophobicContact CD2-CD1 4.14Å; L605-L626 HydrophobicContact CD2-CD2 3.63Å; L605-I628 HydrophobicContact CD1-CD1 3.51Å; L605-I628 HydrophobicContact CD1-CG1 3.78Å
606	E	84.6	Confident	85.3	Confident	72 Å²	72	70 Å²	70	34%	0.336	33%	0.326	S	S	.	.	H	α-helix	trans	-53.4	-55.7	172.6	-72.8	145.7	-149.1	0	0	110.9	L602 K603 F608 A609 E610	L602-E606 WeakPolarHBondContact O-CG 3.28Å; L602-E606 PolarHBondContact O-N 3.27Å; K603-E606 WeakPolarHBondContact CA-OE2 3.49Å; E606-F608 PolarHBondContact O-N 2.74Å; E606-F608 VanDerWaalsContact O-N 3.13Å; E606-A609 CarbonylContact O-C 3.56Å; E606-A609 PolarHBondContact O-N 3.45Å; E606-E610 WeakPolarHBondContact O-CG 3.42Å; E606-E610 PolarHBondContact O-N 3.19Å
607	R	88.4	Confident	85.9	Confident	108 Å²	108	68.3 Å²	68.3	41%	0.408	32%	0.318	S	S	.	.	H	α-helix	trans	-57.9	-28.7	177.7	-74.6	169.6	164.8	-167.5	-9.9	114.3	L590 K603 K611	L590-R607 HydrophobicContact CD1-CB 3.78Å; K603-R607 WeakPolarHBondContact O-CB 3.29Å; K603-R607 VanDerWaalsContact O-CD 3.28Å; K603-R607 WeakPolarHBondContact O-CD 3.48Å; K603-R607 WeakPolarHBondContact O-CG 3.28Å; K603-R607 PolarHBondContact O-N 2.97Å; R607-K611 WeakPolarHBondContact O-CB 3.36Å; R607-K611 WeakPolarHBondContact O-CG 3.43Å; R607-K611 PolarHBondContact O-N 3.1Å
608	F	89.3	Confident	86.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-80.4	-37.3	175	-175.7	-110.8	0	0	0	112	R564 M566 L590 N604 L605 E606 C614 L616 I628 V631	R564-F608 HydrophobicContact CG-CD2 4.48Å; R564-F608 HydrophobicContact CG-CE1 3.91Å; R564-F608 HydrophobicContact CG-CE2 3.72Å; R564-F608 HydrophobicContact CG-CZ 3.39Å; R564-F608 PolarHBondContact NE-O 3.05Å; R564-F608 VanDerWaalsContact NE-O 3.14Å; R564-F608 PolarHBondContact NH2-O 2.87Å; M566-F608 HydrophobicContact CG-CE1 3.73Å; M566-F608 HydrophobicContact CG-CZ 3.55Å; M566-F608 HydrophobicContact SD-CE1 4.19Å; L590-F608 HydrophobicContact CD1-CB 4.11Å; N604-F608 WeakPolarHBondContact O-CB 3.47Å; N604-F608 PolarHBondContact O-N 3.34Å; N604-F608 VanDerWaalsContact O-N 3.14Å; L605-F608 PolarHBondContact O-N 3.03Å; E606-F608 PolarHBondContact O-N 2.74Å; E606-F608 VanDerWaalsContact O-N 3.13Å; F608-C614 HydrophobicContact CD2-CB 3.85Å; F608-C614 HydrophobicContact CE2-CB 4.28Å; F608-L616 HydrophobicContact CD1-CB 4.21Å; F608-L616 HydrophobicContact CD1-CD2 3.7Å; F608-L616 HydrophobicContact CD1-CG 4.5Å; F608-L616 HydrophobicContact CD2-CB 3.63Å; F608-L616 HydrophobicContact CE1-CB 4.1Å; F608-L616 HydrophobicContact CE1-CD2 3.82Å; F608-L616 HydrophobicContact CE2-CB 3.52Å; F608-L616 HydrophobicContact CG-CB 3.98Å; F608-L616 HydrophobicContact CG-CD2 4.09Å; F608-L616 HydrophobicContact CG-CG 4.46Å; F608-L616 HydrophobicContact CZ-CB 3.76Å; F608-L616 HydrophobicContact CZ-CD2 4.32Å; F608-I628 HydrophobicContact CD1-CD1 4.02Å; F608-I628 HydrophobicContact CD1-CG2 3.84Å; F608-I628 HydrophobicContact CE1-CD1 4.04Å; F608-I628 HydrophobicContact CE1-CG2 3.9Å; F608-V631 HydrophobicContact CE1-CG2 4.11Å; F608-V631 HydrophobicContact CZ-CG2 4.49Å
609	A	85.6	Confident	87.2	Confident	14 Å²	14	59.5 Å²	59.5	12%	0.116	28%	0.277	C	S	.	.	H	α-helix	trans	-69.6	-31.7	175.2	0	0	0	0	0	112.9	W197 R564 L605 E606	W197-A609 HydrophobicContact CB-CB 4.12Å; W197-A609 HydrophobicContact CD2-CB 3.6Å; W197-A609 HydrophobicContact CE3-CB 3.92Å; W197-A609 HydrophobicContact CG-CB 3.69Å; R564-A609 PolarHBondContact NH1-O 3.18Å; R564-A609 VanDerWaalsContact NH1-O 3.16Å; R564-A609 VanDerWaalsContact NH2-C 3.25Å; R564-A609 PolarHBondContact NH2-O 3.01Å; L605-A609 WeakPolarHBondContact O-CB 3.28Å; L605-A609 PolarHBondContact O-N 3.31Å; E606-A609 CarbonylContact O-C 3.56Å; E606-A609 PolarHBondContact O-N 3.45Å
610	E	86.3	Confident	87.3	Confident	128 Å²	128	53.6 Å²	53.6	60%	0.598	25%	0.254	S	S	*	.	H	α-helix	trans	-69.5	-53.7	172.3	-70.7	163.7	-174.7	0	0	112.6	E606	E606-E610 WeakPolarHBondContact O-CG 3.42Å; E606-E610 PolarHBondContact O-N 3.19Å
611	K	86.1	Confident	87	Confident	115 Å²	115	49.7 Å²	49.7	50%	0.5	24%	0.238	S	C	.	.			trans	-83.5	125.8	-167.8	-68.2	-179.1	177.9	-170.8	0	112.7	R564 R607 C614	R564-K611 PolarHBondContact NE-O 2.93Å; R564-K611 PolarHBondContact NH2-O 2.84Å; R607-K611 WeakPolarHBondContact O-CB 3.36Å; R607-K611 WeakPolarHBondContact O-CG 3.43Å; R607-K611 PolarHBondContact O-N 3.1Å; K611-C614 HydrophobicContact CB-CB 3.9Å
612	Q	80.9	Confident	86.6	Confident	158 Å²	158	48.3 Å²	48.3	74%	0.738	23%	0.233	S	C	*	.	S	Bend	trans	-67.3	-46.4	176.4	-65.1	-173	5.2	0	0	111.9	G563 R564	G563-Q612 CarbonylContact C-O 3.51Å; R564-Q612 WeakPolarHBondContact CA-O 3.41Å; R564-Q612 WeakPolarHBondContact CB-O 3.38Å; R564-Q612 PolarHBondContact N-O 3.37Å
613	N	85.6	Confident	85.7	Confident	110 Å²	110	45.8 Å²	45.8	59%	0.588	22%	0.22	S	C	*	.	S	Bend	trans	-98.4	100.7	175.1	-67.7	-6	0	0	0	109.5
614	C	89.4	Confident	85.1	Confident	15 Å²	15	41.4 Å²	41.4	10%	0.101	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	152.3	179.5	-162.9	0	0	0	0	111.3	T565 L590 F608 K611	T565-C614 PolarHBondContact N-O 3.1Å; L590-C614 VanDerWaalsContact CD1-SG 3.57Å; F608-C614 HydrophobicContact CD2-CB 3.85Å; F608-C614 HydrophobicContact CE2-CB 4.28Å; K611-C614 HydrophobicContact CB-CB 3.9Å
615	V	92.4	Very high	83.8	Confident	16 Å²	16	40.7 Å²	40.7	10%	0.097	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	124	177.9	-171.6	0	0	0	0	109.7	L558 T565 V567 L590 L617	L558-V615 HydrophobicContact CD1-CG1 4.25Å; L558-V615 HydrophobicContact CD1-CG2 4.36Å; L558-V615 HydrophobicContact CD2-CG1 4.1Å; L558-V615 HydrophobicContact CD2-CG2 3.76Å; T565-V615 WeakPolarHBondContact O-CA 3.35Å; V567-V615 HydrophobicContact CG2-CG1 3.85Å; L590-V615 PolarHBondContact N-O 3.43Å; V615-L617 HydrophobicContact CG1-CD2 4.05Å
616	L	93.1	Very high	83.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	114.6	175.3	-176.8	69	0	0	0	109.5	T565 M566 V567 L590 L592 F608 I628	T565-L616 PolarHBondContact O-N 3.18Å; M566-L616 HydrophobicContact CE-CD2 4.04Å; M566-L616 HydrophobicContact CG-CB 4.44Å; M566-L616 HydrophobicContact CG-CD2 4.32Å; V567-L616 PolarHBondContact N-O 2.93Å; L590-L616 HydrophobicContact CB-CD1 4.05Å; L590-L616 CarbonylContact O-C 3.43Å; L590-L616 WeakPolarHBondContact O-CA 3.38Å; L592-L616 HydrophobicContact CB-CD1 3.88Å; L592-L616 HydrophobicContact CD2-CD1 4.16Å; L592-L616 HydrophobicContact CD2-CD2 4.15Å; F608-L616 HydrophobicContact CD1-CB 4.21Å; F608-L616 HydrophobicContact CD1-CD2 3.7Å; F608-L616 HydrophobicContact CD1-CG 4.5Å; F608-L616 HydrophobicContact CD2-CB 3.63Å; F608-L616 HydrophobicContact CE1-CB 4.1Å; F608-L616 HydrophobicContact CE1-CD2 3.82Å; F608-L616 HydrophobicContact CE2-CB 3.52Å; F608-L616 HydrophobicContact CG-CB 3.98Å; F608-L616 HydrophobicContact CG-CD2 4.09Å; F608-L616 HydrophobicContact CG-CG 4.46Å; F608-L616 HydrophobicContact CZ-CB 3.76Å; F608-L616 HydrophobicContact CZ-CD2 4.32Å; L616-I628 HydrophobicContact CD2-CD1 4.35Å
617	L	94.6	Very high	82.6	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.7	175.1	-54.4	-179.9	0	0	0	109.1	V567 I575 L578 L582 P589 L590 P591 L592 V615	V567-L617 HydrophobicContact CB-CD2 3.66Å; V567-L617 HydrophobicContact CG1-CD2 4.14Å; V567-L617 HydrophobicContact CG2-CD2 3.88Å; I575-L617 HydrophobicContact CG2-CB 3.89Å; L578-L617 HydrophobicContact CB-CD1 4.29Å; L578-L617 HydrophobicContact CD2-CD1 4.33Å; L578-L617 HydrophobicContact CD2-CD2 3.94Å; L578-L617 HydrophobicContact CG-CD1 4.01Å; L578-L617 HydrophobicContact CG-CD2 4.35Å; L582-L617 HydrophobicContact CD1-CD1 4.26Å; L582-L617 HydrophobicContact CD1-CD2 4.05Å; P589-L617 HydrophobicContact CB-CD1 3.68Å; P589-L617 HydrophobicContact CB-CD2 4.46Å; P589-L617 HydrophobicContact CB-CG 3.73Å; P589-L617 HydrophobicContact CG-CD1 3.9Å; P589-L617 HydrophobicContact CG-CG 4.49Å; L590-L617 PolarHBondContact O-N 3.41Å; P591-L617 CarbonylContact C-O 3.6Å; P591-L617 WeakPolarHBondContact CA-O 3.33Å; L592-L617 PolarHBondContact N-O 3.25Å; V615-L617 HydrophobicContact CG1-CD2 4.05Å
618	T	92.9	Very high	81.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	156	-170.3	-165.1	0	0	0	0	114.8	M566 V567 F568 A569 L592 A622	M566-T618 HydrophobicContact CE-CG2 4.05Å; V567-T618 PolarHBondContact O-N 3.11Å; F568-T618 WeakPolarHBondContact CA-O 3.46Å; F568-T618 HydrophobicContact CD1-CG2 3.73Å; F568-T618 HydrophobicContact CE1-CG2 3.46Å; F568-T618 VanDerWaalsContact CE1-CG2 3.46Å; F568-T618 HydrophobicContact CG-CG2 4.46Å; F568-T618 HydrophobicContact CZ-CG2 4Å; A569-T618 PolarHBondContact N-O 2.9Å; L592-T618 VanDerWaalsContact O-CA 3.26Å; L592-T618 WeakPolarHBondContact O-CA 3.38Å; L592-T618 WeakPolarHBondContact O-CB 3.46Å; L592-T618 PolarHBondContact O-OG1 3.24Å; T618-A622 HydrophobicContact CG2-CB 3.98Å; T618-A622 WeakPolarHBondContact OG1-CB 3.1Å
619	T	91.1	Very high	81	Confident	13 Å²	13	36.6 Å²	36.6	8%	0.08	19%	0.188	C	C	.	.			trans	-90	-176	166.6	62.5	0	0	0	0	110.4	A569 I572 I575 L592 H593 V621 A622	A569-T619 WeakPolarHBondContact O-CA 3.28Å; I572-T619 HydrophobicContact CG1-CG2 4.05Å; I575-T619 HydrophobicContact CD1-CG2 3.41Å; I575-T619 VanDerWaalsContact CD1-CG2 3.41Å; L592-T619 PolarHBondContact O-N 3.44Å; H593-T619 HydrophobicContact CB-CG2 4.37Å; T619-V621 PolarHBondContact O-N 3.23Å; T619-V621 VanDerWaalsContact OG1-CG2 3.28Å; T619-V621 WeakPolarHBondContact OG1-CG2 3.2Å; T619-A622 PolarHBondContact O-N 3Å; T619-A622 VanDerWaalsContact O-N 3.12Å
620	D	84.6	Confident	80.6	Confident	51 Å²	51	40.1 Å²	40.1	27%	0.273	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-59	-9.9	176.2	-60.5	-56.7	0	0	0	115	A622 A623 T645 R649	D620-A622 PolarHBondContact O-N 2.86Å; D620-A622 VanDerWaalsContact O-N 3.14Å; D620-A623 HydrophobicContact CB-CB 4.24Å; D620-A623 PolarHBondContact O-N 2.75Å; D620-T645 HydrophobicContact CB-CG2 4.43Å; D620-T645 VanDerWaalsContact CG-CG2 3.49Å; D620-T645 WeakPolarHBondContact OD1-CG2 3.39Å; D620-R649 IonicContact OD1-CZ 2.77Å; D620-R649 IonicContact OD1-NE 2.68Å; D620-R649 PolarHBondContact OD1-NE 3.33Å; D620-R649 IonicContact OD1-NH2 2.63Å; D620-R649 PolarHBondContact OD1-NH2 3.15Å; D620-R649 IonicContact OD2-CZ 2.58Å; D620-R649 IonicContact OD2-NH2 2.92Å; D620-R649 PolarHBondContact OD2-NH2 3.2Å
621	V	78.4	Confident	80.6	Confident	30 Å²	30	34.4 Å²	34.4	18%	0.182	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-49.6	-32.4	166.8	170.6	0	0	0	0	112.9	A594 T619	A594-V621 HydrophobicContact CB-CG2 4Å; T619-V621 PolarHBondContact O-N 3.23Å; T619-V621 VanDerWaalsContact OG1-CG2 3.28Å; T619-V621 WeakPolarHBondContact OG1-CG2 3.2Å
622	A	74.1	Confident	80.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-113.9	5.4	175.9	0	0	0	0	0	114.2	M566 L592 T618 T619 D620 R624 L626 R652	M566-A622 HydrophobicContact CE-CB 4.35Å; L592-A622 HydrophobicContact CD2-CB 3.66Å; T618-A622 HydrophobicContact CG2-CB 3.98Å; T618-A622 WeakPolarHBondContact OG1-CB 3.1Å; T619-A622 PolarHBondContact O-N 3Å; T619-A622 VanDerWaalsContact O-N 3.12Å; D620-A622 PolarHBondContact O-N 2.86Å; D620-A622 VanDerWaalsContact O-N 3.14Å; A622-R624 PolarHBondContact O-N 3.39Å; A622-L626 HydrophobicContact CB-CD1 3.8Å; A622-R652 WeakPolarHBondContact O-CD 3.44Å; A622-R652 PolarHBondContact O-NH1 2.97Å
623	A	62.3	Low	81.1	Confident	2 Å²	2	26.4 Å²	26.4	2%	0.017	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-17.2	172.2	0	0	0	0	0	112.3	F568 D620 H648 R649 R652	F568-A623 HydrophobicContact CD1-CB 4.44Å; F568-A623 HydrophobicContact CE1-CB 3.65Å; F568-A623 HydrophobicContact CZ-CB 4Å; D620-A623 HydrophobicContact CB-CB 4.24Å; D620-A623 PolarHBondContact O-N 2.75Å; A623-H648 CarbonylContact O-C 3.56Å; A623-H648 VanDerWaalsContact O-C 3.27Å; A623-H648 WeakPolarHBondContact O-CB 3.43Å; A623-R649 HydrophobicContact CB-CG 3.61Å; A623-R652 PolarHBondContact O-NE 3.11Å; A623-R652 PolarHBondContact O-NH2 3.33Å
624	R	72.9	Confident	81.4	Confident	12 Å²	12	21.1 Å²	21.1	5%	0.045	12%	0.115	C	C	.	.	S	Bend	trans	-129.2	162.5	-177	-85.9	177.8	174.5	139.3	-12.7	110.1	E448 D450 E454 A622 L626 H648	E448-R624 WeakPolarHBondContact OE2-CB 3.47Å; D450-R624 IonicContact OD2-CZ 2.7Å; D450-R624 VanDerWaalsContact OD2-CZ 3.29Å; D450-R624 IonicContact OD2-NE 2.72Å; D450-R624 PolarHBondContact OD2-NE 3.12Å; D450-R624 IonicContact OD2-NH2 2.67Å; D450-R624 PolarHBondContact OD2-NH2 2.7Å; E454-R624 VanDerWaalsContact CD-NH1 3.27Å; E454-R624 IonicContact OE1-CZ 3.57Å; E454-R624 VanDerWaalsContact OE1-CZ 3.23Å; E454-R624 IonicContact OE1-NH1 2.72Å; E454-R624 PolarHBondContact OE1-NH1 3.34Å; E454-R624 IonicContact OE1-NH2 2.71Å; E454-R624 PolarHBondContact OE1-NH2 2.76Å; E454-R624 IonicContact OE2-CZ 2.7Å; E454-R624 IonicContact OE2-NH1 3.45Å; E454-R624 PolarHBondContact OE2-NH1 2.77Å; E454-R624 IonicContact OE2-NH2 3.89Å; A622-R624 PolarHBondContact O-N 3.39Å; R624-L626 PolarHBondContact O-N 3.19Å; R624-H648 HydrophobicContact CG-CB 3.96Å; R624-H648 PolarHBondContact NE-CE1 2.77Å; R624-H648 PolarHBondContact NE-ND1 2.94Å
625	G	63	Low	81.6	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.11	C	C	.	.	S	Bend	trans	74	-24.1	168.2	0	0	0	0	0	118.5	L375 E448	L375-G625 WeakPolarHBondContact CD1-O 3.31Å; E448-G625 PolarHBondContact OE1-N 2.98Å; E448-G625 WeakPolarHBondContact OE2-CA 3.36Å; E448-G625 PolarHBondContact OE2-N 2.79Å
626	L	71.9	Confident	81.7	Confident	9 Å²	9	19.7 Å²	19.7	5%	0.047	11%	0.105	C	C	.	.			trans	-95.6	144.8	-175.9	-64.3	173.8	0	0	0	113.6	E374 L605 A622 R624 I628 R652 R655	E374-L626 HydrophobicContact CB-CD2 3.53Å; E374-L626 HydrophobicContact CB-CG 4.49Å; E374-L626 HydrophobicContact CG-CD2 4.31Å; L605-L626 HydrophobicContact CD1-CD1 3.97Å; L605-L626 HydrophobicContact CD2-CD1 4.14Å; L605-L626 HydrophobicContact CD2-CD2 3.63Å; A622-L626 HydrophobicContact CB-CD1 3.8Å; R624-L626 PolarHBondContact O-N 3.19Å; L626-I628 HydrophobicContact CB-CG1 4.29Å; L626-I628 HydrophobicContact CD1-CD1 4.49Å; L626-R652 PolarHBondContact O-NH1 2.92Å; L626-R655 PolarHBondContact O-NH1 2.85Å
627	D	70.8	Confident	81.8	Confident	43 Å²	43	20.2 Å²	20.2	23%	0.23	11%	0.107	C	C	.	.			trans	-115.9	76.4	168.8	-156.3	11.1	0	0	0	114.3	W197 Q378 P629 R655	W197-D627 WeakPolarHBondContact CH2-O 3.45Å; W197-D627 VanDerWaalsContact CZ3-O 3.23Å; W197-D627 WeakPolarHBondContact CZ3-O 3.4Å; Q378-D627 VanDerWaalsContact OE1-CB 3.31Å; D627-P629 WeakPolarHBondContact O-CD 3.24Å; D627-R655 IonicContact OD1-CZ 3.64Å; D627-R655 IonicContact OD1-NH1 3.95Å; D627-R655 PolarHBondContact OD1-NH1 2.88Å
628	I	75.3	Confident	81.7	Confident	4 Å²	4	22.4 Å²	22.4	2%	0.021	12%	0.118	C	C	.	.			trans	-83.2	116.2	178.5	-49.9	168.4	0	0	0	108.7	M566 L605 F608 L616 L626 V631	M566-I628 HydrophobicContact CE-CD1 4.32Å; M566-I628 HydrophobicContact SD-CD1 4.07Å; L605-I628 HydrophobicContact CD1-CD1 3.51Å; L605-I628 HydrophobicContact CD1-CG1 3.78Å; F608-I628 HydrophobicContact CD1-CD1 4.02Å; F608-I628 HydrophobicContact CD1-CG2 3.84Å; F608-I628 HydrophobicContact CE1-CD1 4.04Å; F608-I628 HydrophobicContact CE1-CG2 3.9Å; L616-I628 HydrophobicContact CD2-CD1 4.35Å; L626-I628 HydrophobicContact CB-CG1 4.29Å; L626-I628 HydrophobicContact CD1-CD1 4.49Å; I628-V631 HydrophobicContact CB-CG2 4.11Å; I628-V631 HydrophobicContact CG2-CG2 3.96Å
629	P	70.4	Confident	81.7	Confident	46 Å²	46	22.4 Å²	22.4	30%	0.299	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	156.4	178.7	28.5	-35.3	0	0	0	111.9	R564 D627 V631	R564-P629 PolarHBondContact NH1-O 2.69Å; D627-P629 WeakPolarHBondContact O-CD 3.24Å; P629-V631 VanDerWaalsContact C-N 3.28Å; P629-V631 PolarHBondContact O-N 3.06Å; P629-V631 VanDerWaalsContact O-N 3.16Å
630	N	76.6	Confident	81.6	Confident	88 Å²	88	21.8 Å²	21.8	47%	0.471	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	26.2	166.7	-52.6	-39.3	0	0	0	116.2	R564 Q632 K658	R564-N630 WeakPolarHBondContact CB-O 3.47Å; N630-Q632 PolarHBondContact O-N 2.98Å; N630-K658 PolarHBondContact OD1-NZ 3.1Å
631	V	86.8	Confident	81.7	Confident	9 Å²	9	28.9 Å²	28.9	6%	0.055	14%	0.137	C	C	.	.			trans	-65.3	124.4	165.3	-177.1	0	0	0	0	107.9	R564 M566 F608 I628 P629 V634 R652 T653	R564-V631 HydrophobicContact CG-CG2 4.25Å; M566-V631 HydrophobicContact CB-CG1 4.44Å; M566-V631 HydrophobicContact CG-CG1 3.93Å; M566-V631 HydrophobicContact CG-CG2 4.37Å; M566-V631 HydrophobicContact SD-CG1 4.19Å; M566-V631 HydrophobicContact SD-CG2 3.99Å; F608-V631 HydrophobicContact CE1-CG2 4.11Å; F608-V631 HydrophobicContact CZ-CG2 4.49Å; I628-V631 HydrophobicContact CB-CG2 4.11Å; I628-V631 HydrophobicContact CG2-CG2 3.96Å; P629-V631 VanDerWaalsContact C-N 3.28Å; P629-V631 PolarHBondContact O-N 3.06Å; P629-V631 VanDerWaalsContact O-N 3.16Å; V631-V634 HydrophobicContact CG1-CG2 4.35Å; V631-R652 WeakPolarHBondContact CB-O 3.41Å; V631-T653 WeakPolarHBondContact O-CB 3.34Å; V631-T653 PolarHBondContact O-OG1 2.88Å
632	Q	86.6	Confident	81.9	Confident	91 Å²	91	29.9 Å²	29.9	43%	0.425	14%	0.143	S	C	.	.			trans	-95.4	-42.1	-178.3	-69.3	163.8	-47.9	0	0	110.8	R564 N630 T653 L661	R564-Q632 PolarHBondContact O-N 2.98Å; N630-Q632 PolarHBondContact O-N 2.98Å; Q632-T653 PolarHBondContact O-OG1 3.17Å; Q632-L661 PolarHBondContact O-N 2.65Å
633	H	90.6	Very high	82.4	Confident	13 Å²	13	30.3 Å²	30.3	6%	0.06	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.8	-172.7	-46.6	135.1	0	0	0	111.5	F557 Y561 R564 T565 M566 L661	F557-H633 HydrophobicContact CE1-CB 3.87Å; F557-H633 AromaticContact CE1-CG 3.7Å; F557-H633 AromaticContact CE1-ND1 3.7Å; F557-H633 HydrophobicContact CZ-CB 4.05Å; F557-H633 AromaticContact CZ-CD2 3.94Å; F557-H633 AromaticContact CZ-CG 3.77Å; Y561-H633 PolarHBondContact O-CE1 2.84Å; Y561-H633 VanDerWaalsContact O-CE1 3.32Å; R564-H633 PolarHBondContact O-N 3.32Å; T565-H633 WeakPolarHBondContact CA-O 3.45Å; T565-H633 HydrophobicContact CG2-CB 3.93Å; T565-H633 PolarHBondContact OG1-ND1 2.92Å; T565-H633 VanDerWaalsContact OG1-ND1 3.16Å; M566-H633 PolarHBondContact N-O 3.43Å; H633-L661 WeakPolarHBondContact CA-O 3.16Å
634	V	92.3	Very high	83.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128	167.4	169.3	0	0	0	0	108.3	M566 F568 V631 R649 R652 T653 L661 S662 L663	M566-V634 CarbonylContact O-C 3.57Å; M566-V634 WeakPolarHBondContact O-CA 3.37Å; F568-V634 HydrophobicContact CD2-CG1 4.03Å; F568-V634 HydrophobicContact CE2-CG1 4.2Å; V631-V634 HydrophobicContact CG1-CG2 4.35Å; V634-R649 WeakPolarHBondContact CG1-O 3.37Å; V634-R652 HydrophobicContact CG2-CB 3.85Å; V634-T653 HydrophobicContact CB-CG2 4.09Å; V634-T653 HydrophobicContact CG2-CG2 3.62Å; V634-L661 PolarHBondContact N-O 2.8Å; V634-S662 CarbonylContact O-C 3.58Å; V634-S662 WeakPolarHBondContact O-CA 3.35Å; V634-L663 PolarHBondContact O-N 3.17Å
635	I	93.9	Very high	83.7	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	113.4	179.8	-50	177.8	0	0	0	109.3	L554 F557 L558 T565 M566 V567 F568 Y637 L663 L665	L554-I635 HydrophobicContact CD1-CB 4.48Å; L554-I635 HydrophobicContact CD1-CD1 3.64Å; L554-I635 HydrophobicContact CD1-CG2 4.04Å; F557-I635 HydrophobicContact CD1-CD1 3.48Å; F557-I635 VanDerWaalsContact CD1-CD1 3.48Å; F557-I635 HydrophobicContact CD1-CG1 4.46Å; F557-I635 HydrophobicContact CE1-CD1 3.85Å; F557-I635 HydrophobicContact CE1-CG1 4.44Å; F557-I635 HydrophobicContact CG-CD1 4.07Å; L558-I635 HydrophobicContact CD2-CD1 4.44Å; T565-I635 HydrophobicContact CG2-CD1 3.71Å; T565-I635 HydrophobicContact CG2-CG1 4.11Å; M566-I635 PolarHBondContact O-N 3.01Å; V567-I635 CarbonylContact C-O 3.57Å; V567-I635 WeakPolarHBondContact CA-O 3.36Å; V567-I635 HydrophobicContact CG1-CB 4.37Å; V567-I635 HydrophobicContact CG2-CB 4.4Å; V567-I635 HydrophobicContact CG2-CD1 4.37Å; F568-I635 PolarHBondContact N-O 2.81Å; I635-Y637 PolarHBondContact O-N 3.33Å; I635-Y637 VanDerWaalsContact O-N 3.17Å; I635-L663 CarbonylContact C-O 3.55Å; I635-L663 WeakPolarHBondContact CA-O 3.27Å; I635-L663 HydrophobicContact CG1-CB 4.49Å; I635-L663 HydrophobicContact CG2-CD2 4.42Å; I635-L665 HydrophobicContact CG2-CD1 4.43Å; I635-L665 HydrophobicContact CG2-CG 4.34Å
636	H	94.3	Very high	84.9	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	87.9	171.7	-58.1	-109	0	0	0	108.6	Q638 Y646 R649 S650 S662 L663 L664 L665	H636-Q638 VanDerWaalsContact C-N 3.29Å; H636-Y646 AromaticContact CE1-CD2 3.43Å; H636-Y646 VanDerWaalsContact CE1-CD2 3.43Å; H636-Y646 WeakPolarHBondContact CE1-CD2 3.46Å; H636-Y646 AromaticContact CE1-CE2 3.55Å; H636-Y646 AromaticContact ND1-CD2 3.97Å; H636-Y646 AromaticContact NE2-CD2 3.91Å; H636-Y646 AromaticContact NE2-CE2 3.52Å; H636-R649 VanDerWaalsContact CE1-CB 3.43Å; H636-R649 WeakPolarHBondContact CE1-CB 3.27Å; H636-R649 WeakPolarHBondContact ND1-CD 3.32Å; H636-S650 PolarHBondContact NE2-OG 3.08Å; H636-S650 VanDerWaalsContact NE2-OG 3.09Å; H636-S662 PolarHBondContact CD2-OG 3.41Å; H636-S662 PolarHBondContact NE2-OG 3.19Å; H636-L663 PolarHBondContact N-O 3.24Å; H636-L664 HydrophobicContact CB-CG 4.38Å; H636-L665 PolarHBondContact O-N 3.02Å
637	Y	94.6	Very high	85.4	Confident	11 Å²	11	31.2 Å²	31.2	4%	0.043	15%	0.152	C	C	.	.	S	Bend	trans	-66.9	-33.1	177.6	-180	-86.6	0	0	0	111.6	K550 D551 L554 F568 C574 R577 L578 I635 L665	K550-Y637 HydrophobicContact CB-CD2 4.2Å; K550-Y637 HydrophobicContact CB-CE2 3.45Å; K550-Y637 VanDerWaalsContact CB-CE2 3.45Å; K550-Y637 HydrophobicContact CD-CE1 4.47Å; K550-Y637 VanDerWaalsContact CD-O 3.26Å; K550-Y637 WeakPolarHBondContact CD-O 3.45Å; K550-Y637 PolarHBondContact NZ-O 2.97Å; D551-Y637 PolarHBondContact OD1-OH 2.99Å; D551-Y637 VanDerWaalsContact OD1-OH 3.05Å; L554-Y637 HydrophobicContact CB-CD2 4.47Å; L554-Y637 HydrophobicContact CD2-CD2 3.97Å; L554-Y637 HydrophobicContact CD2-CE2 4.35Å; F568-Y637 WeakPolarHBondContact O-CB 3.06Å; F568-Y637 PolarHBondContact O-N 3.29Å; C574-Y637 VanDerWaalsContact SG-CE1 3.57Å; R577-Y637 PolarHBondContact NH2-OH 3.45Å; L578-Y637 HydrophobicContact CD2-CD2 4.42Å; I635-Y637 PolarHBondContact O-N 3.33Å; I635-Y637 VanDerWaalsContact O-N 3.17Å; Y637-L665 HydrophobicContact CD2-CD1 3.89Å; Y637-L665 HydrophobicContact CE2-CD1 4.48Å
638	Q	92.9	Very high	86	Confident	49 Å²	49	29.4 Å²	29.4	23%	0.229	14%	0.142	C	C	.	.	S	Bend	trans	-120.1	135.9	162.9	-74.4	170.3	-37	0	0	108.9	F568 N570 H636 R649	F568-Q638 PolarHBondContact O-N 3.06Å; N570-Q638 HydrophobicContact CB-CB 4.26Å; H636-Q638 VanDerWaalsContact C-N 3.29Å; Q638-R649 PolarHBondContact O-NH1 3.49Å
639	V	91.4	Very high	86.6	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.141	C	C	.	.			trans	-68.3	139.1	-178.6	178.3	0	0	0	0	109	N570 I666 D670 F674 I677	N570-V639 PolarHBondContact ND2-O 3.35Å; V639-I666 HydrophobicContact CG2-CG1 4.04Å; V639-D670 HydrophobicContact CB-CB 3.88Å; V639-D670 HydrophobicContact CG2-CB 3.61Å; V639-F674 HydrophobicContact CG1-CB 4.28Å; V639-I677 HydrophobicContact CG1-CD1 4.01Å
640	P	90.4	Very high	87.3	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.127	C	C	.	.			trans	-56.3	158.9	176.6	-28.5	37.8	0	0	0	113.8	T645 Y646 I677	P640-T645 HydrophobicContact CB-CG2 4.08Å; P640-Y646 HydrophobicContact CG-CD2 4Å; P640-Y646 HydrophobicContact CG-CG 4.46Å; P640-I677 HydrophobicContact CB-CD1 4.07Å; P640-I677 WeakPolarHBondContact O-CD1 3.36Å
641	R	85.6	Confident	87.5	Confident	199 Å²	199	23.4 Å²	23.4	75%	0.751	11%	0.11	S	C	*	.	S	Bend	trans	-82.3	-24.2	174.6	-68.2	-179	175	176.3	-1.3	113.1
642	T	83.9	Confident	87.3	Confident	52 Å²	52	23.2 Å²	23.2	32%	0.319	11%	0.109	S	C	.	.	S	Bend	trans	-134.1	158.8	-176.9	63.9	0	0	0	0	111	E644 T645 Y646	T642-E644 VanDerWaalsContact C-N 3.29Å; T642-T645 WeakPolarHBondContact OG1-CB 3.34Å; T642-T645 PolarHBondContact OG1-N 3Å; T642-T645 VanDerWaalsContact OG1-N 3.17Å; T642-T645 PolarHBondContact OG1-OG1 3.36Å; T642-Y646 PolarHBondContact O-N 2.81Å
643	S	83.1	Confident	87.1	Confident	8 Å²	8	19 Å²	19	6%	0.056	9%	0.089	C	C	.	.	H	α-helix	trans	-63.6	-36.1	171.6	46.5	0	0	0	0	111.9	Y646 V647 T680	S643-Y646 WeakPolarHBondContact O-CA 3.48Å; S643-Y646 WeakPolarHBondContact O-CB 3.42Å; S643-Y646 PolarHBondContact O-N 2.96Å; S643-Y646 VanDerWaalsContact O-N 3.1Å; S643-V647 WeakPolarHBondContact O-CG2 3.26Å; S643-V647 PolarHBondContact O-N 3.17Å; S643-T680 WeakPolarHBondContact OG-CG2 3.34Å
644	E	78.9	Confident	86.1	Confident	13 Å²	13	18.5 Å²	18.5	6%	0.061	9%	0.087	C	C	.	.	H	α-helix	trans	-62.5	-49.3	-179.7	-58.6	173.3	-100.9	0	0	111.2	T485 M488 H490 K509 T642 Y646 V647 H648	T485-E644 HydrophobicContact CG2-CB 4.06Å; T485-E644 HydrophobicContact CG2-CG 4.07Å; T485-E644 PolarHBondContact OG1-OE2 2.81Å; T485-E644 VanDerWaalsContact OG1-OE2 3.06Å; M488-E644 HydrophobicContact CE-CG 4.3Å; H490-E644 IonicContact CE1-OE1 2.71Å; H490-E644 PolarHBondContact CE1-OE1 3.42Å; H490-E644 IonicContact CE1-OE2 2.74Å; H490-E644 IonicContact ND1-OE1 3.73Å; H490-E644 IonicContact NE2-OE1 3.94Å; H490-E644 IonicContact NE2-OE2 3.89Å; K509-E644 IonicContact NZ-OE1 3.9Å; K509-E644 PolarHBondContact NZ-OE1 3.25Å; K509-E644 IonicContact NZ-OE2 2.71Å; K509-E644 PolarHBondContact NZ-OE2 3.05Å; T642-E644 VanDerWaalsContact C-N 3.29Å; E644-Y646 PolarHBondContact O-N 2.9Å; E644-V647 PolarHBondContact O-N 3.41Å; E644-H648 WeakPolarHBondContact O-CB 3.47Å; E644-H648 PolarHBondContact O-N 3.21Å; E644-H648 PolarHBondContact O-ND1 2.98Å
645	T	84.9	Confident	85.1	Confident	17 Å²	17	20.3 Å²	20.3	10%	0.104	9%	0.094	C	C	.	.	H	α-helix	trans	-62.5	-32.4	174.2	-56.6	0	0	0	0	111.7	D620 P640 T642 R649	D620-T645 HydrophobicContact CB-CG2 4.43Å; D620-T645 VanDerWaalsContact CG-CG2 3.49Å; D620-T645 WeakPolarHBondContact OD1-CG2 3.39Å; P640-T645 HydrophobicContact CB-CG2 4.08Å; T642-T645 WeakPolarHBondContact OG1-CB 3.34Å; T642-T645 PolarHBondContact OG1-N 3Å; T642-T645 VanDerWaalsContact OG1-N 3.17Å; T642-T645 PolarHBondContact OG1-OG1 3.36Å; T645-R649 HydrophobicContact CG2-CG 4.46Å; T645-R649 WeakPolarHBondContact O-CB 3.19Å; T645-R649 VanDerWaalsContact O-CG 3.27Å; T645-R649 WeakPolarHBondContact O-CG 3.41Å; T645-R649 PolarHBondContact O-N 3.28Å
646	Y	87.4	Confident	83.6	Confident	3 Å²	3	24.4 Å²	24.4	1%	0.012	13%	0.128	C	C	.	.	H	α-helix	trans	-64.8	-51.1	174.9	178.4	-93	0	0	0	112.8	T534 E540 H636 P640 T642 S643 E644 H648 R649 S650 L664 I677 L681	T534-Y646 HydrophobicContact CG2-CE1 4.5Å; E540-Y646 VanDerWaalsContact CD-OH 3.32Å; E540-Y646 VanDerWaalsContact OE1-CE1 3.24Å; E540-Y646 WeakPolarHBondContact OE1-CE1 3.28Å; E540-Y646 VanDerWaalsContact OE1-CZ 3.28Å; E540-Y646 PolarHBondContact OE1-OH 2.87Å; H636-Y646 AromaticContact CE1-CD2 3.43Å; H636-Y646 VanDerWaalsContact CE1-CD2 3.43Å; H636-Y646 WeakPolarHBondContact CE1-CD2 3.46Å; H636-Y646 AromaticContact CE1-CE2 3.55Å; H636-Y646 AromaticContact ND1-CD2 3.97Å; H636-Y646 AromaticContact NE2-CD2 3.91Å; H636-Y646 AromaticContact NE2-CE2 3.52Å; P640-Y646 HydrophobicContact CG-CD2 4Å; P640-Y646 HydrophobicContact CG-CG 4.46Å; T642-Y646 PolarHBondContact O-N 2.81Å; S643-Y646 WeakPolarHBondContact O-CA 3.48Å; S643-Y646 WeakPolarHBondContact O-CB 3.42Å; S643-Y646 PolarHBondContact O-N 2.96Å; S643-Y646 VanDerWaalsContact O-N 3.1Å; E644-Y646 PolarHBondContact O-N 2.9Å; Y646-H648 VanDerWaalsContact C-N 3.33Å; Y646-H648 PolarHBondContact O-N 3.18Å; Y646-R649 PolarHBondContact O-N 3.08Å; Y646-S650 VanDerWaalsContact CZ-OG 3.27Å; Y646-S650 WeakPolarHBondContact O-CB 3.45Å; Y646-S650 PolarHBondContact O-N 2.97Å; Y646-S650 PolarHBondContact O-OG 2.81Å; Y646-S650 PolarHBondContact OH-OG 3.4Å; Y646-L664 HydrophobicContact CE2-CD1 3.92Å; Y646-L664 HydrophobicContact CE2-CD2 3.8Å; Y646-L664 HydrophobicContact CE2-CG 4.02Å; Y646-I677 HydrophobicContact CD1-CG2 4Å; Y646-I677 HydrophobicContact CD2-CG2 4.4Å; Y646-I677 HydrophobicContact CG-CG2 3.83Å; Y646-L681 HydrophobicContact CD1-CD1 3.69Å; Y646-L681 HydrophobicContact CE1-CD1 3.86Å
647	V	83.2	Confident	82.1	Confident	9 Å²	9	30.9 Å²	30.9	6%	0.055	17%	0.168	C	C	.	.	H	α-helix	trans	-56.5	-49	176.5	174	0	0	0	0	110.3	A533 S643 E644 R649 S650 G651 L681	A533-V647 HydrophobicContact CB-CG2 4.3Å; A533-V647 WeakPolarHBondContact O-CG1 3.5Å; A533-V647 WeakPolarHBondContact O-CG2 3.39Å; S643-V647 WeakPolarHBondContact O-CG2 3.26Å; S643-V647 PolarHBondContact O-N 3.17Å; E644-V647 PolarHBondContact O-N 3.41Å; V647-R649 PolarHBondContact O-N 3.17Å; V647-S650 PolarHBondContact O-N 3.34Å; V647-G651 PolarHBondContact O-N 2.98Å; V647-L681 HydrophobicContact CG2-CD2 3.77Å
648	H	83	Confident	81	Confident	5 Å²	5	35.8 Å²	35.8	2%	0.023	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-38.8	-179.3	-77.1	109.9	0	0	0	114.2	D450 T485 A623 R624 E644 Y646 R652	D450-H648 IonicContact OD2-CE1 3.72Å; D450-H648 PolarHBondContact OD2-CE1 2.86Å; D450-H648 IonicContact OD2-NE2 2.66Å; T485-H648 VanDerWaalsContact CG2-CE1 3.48Å; T485-H648 WeakPolarHBondContact CG2-CE1 3.33Å; A623-H648 CarbonylContact O-C 3.56Å; A623-H648 VanDerWaalsContact O-C 3.27Å; A623-H648 WeakPolarHBondContact O-CB 3.43Å; R624-H648 HydrophobicContact CG-CB 3.96Å; R624-H648 PolarHBondContact NE-CE1 2.77Å; R624-H648 PolarHBondContact NE-ND1 2.94Å; E644-H648 WeakPolarHBondContact O-CB 3.47Å; E644-H648 PolarHBondContact O-N 3.21Å; E644-H648 PolarHBondContact O-ND1 2.98Å; Y646-H648 VanDerWaalsContact C-N 3.33Å; Y646-H648 PolarHBondContact O-N 3.18Å; H648-R652 PolarHBondContact O-NE 3.45Å; H648-R652 VanDerWaalsContact O-NE 3.09Å
649	R	88.2	Confident	80.3	Confident	1 Å²	1	39.8 Å²	39.8	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-69.5	-48.2	172.7	-75.6	179.9	-173	-173.5	3.9	112.6	F568 N570 D620 A623 V634 H636 Q638 T645 Y646 V647 R652	F568-R649 HydrophobicContact CB-CG 4.34Å; F568-R649 HydrophobicContact CD1-CG 3.75Å; F568-R649 HydrophobicContact CD2-CB 3.87Å; F568-R649 HydrophobicContact CD2-CG 3.74Å; F568-R649 HydrophobicContact CE1-CG 3.89Å; F568-R649 HydrophobicContact CE2-CB 3.86Å; F568-R649 HydrophobicContact CE2-CG 3.88Å; F568-R649 HydrophobicContact CG-CB 4.3Å; F568-R649 HydrophobicContact CG-CG 3.67Å; F568-R649 HydrophobicContact CZ-CB 4.3Å; F568-R649 HydrophobicContact CZ-CG 3.95Å; N570-R649 PolarHBondContact OD1-NH1 2.94Å; N570-R649 PolarHBondContact OD1-NH2 2.93Å; D620-R649 IonicContact OD1-CZ 2.77Å; D620-R649 IonicContact OD1-NE 2.68Å; D620-R649 PolarHBondContact OD1-NE 3.33Å; D620-R649 IonicContact OD1-NH2 2.63Å; D620-R649 PolarHBondContact OD1-NH2 3.15Å; D620-R649 IonicContact OD2-CZ 2.58Å; D620-R649 IonicContact OD2-NH2 2.92Å; D620-R649 PolarHBondContact OD2-NH2 3.2Å; A623-R649 HydrophobicContact CB-CG 3.61Å; V634-R649 WeakPolarHBondContact CG1-O 3.37Å; H636-R649 VanDerWaalsContact CE1-CB 3.43Å; H636-R649 WeakPolarHBondContact CE1-CB 3.27Å; H636-R649 WeakPolarHBondContact ND1-CD 3.32Å; Q638-R649 PolarHBondContact O-NH1 3.49Å; T645-R649 HydrophobicContact CG2-CG 4.46Å; T645-R649 WeakPolarHBondContact O-CB 3.19Å; T645-R649 VanDerWaalsContact O-CG 3.27Å; T645-R649 WeakPolarHBondContact O-CG 3.41Å; T645-R649 PolarHBondContact O-N 3.28Å; Y646-R649 PolarHBondContact O-N 3.08Å; V647-R649 PolarHBondContact O-N 3.17Å; R649-R652 VanDerWaalsContact O-CB 3.29Å; R649-R652 WeakPolarHBondContact O-CB 3.43Å; R649-R652 WeakPolarHBondContact O-CG 3.5Å; R649-R652 PolarHBondContact O-N 2.91Å
650	S	85.8	Confident	79.9	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-43.2	-178.3	-76	0	0	0	0	111.3	H636 Y646 V647 R652 T653 S662	H636-S650 PolarHBondContact NE2-OG 3.08Å; H636-S650 VanDerWaalsContact NE2-OG 3.09Å; Y646-S650 VanDerWaalsContact CZ-OG 3.27Å; Y646-S650 WeakPolarHBondContact O-CB 3.45Å; Y646-S650 PolarHBondContact O-N 2.97Å; Y646-S650 PolarHBondContact O-OG 2.81Å; Y646-S650 PolarHBondContact OH-OG 3.4Å; V647-S650 PolarHBondContact O-N 3.34Å; S650-R652 PolarHBondContact O-N 3.43Å; S650-T653 WeakPolarHBondContact O-CG2 3.46Å; S650-T653 PolarHBondContact O-N 3.11Å; S650-S662 PolarHBondContact OG-OG 3.43Å
651	G	79.8	Confident	79.8	Confident	11 Å²	11	39.9 Å²	39.9	11%	0.113	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	19.1	172.2	0	0	0	0	0	115.2	V647 R655	V647-G651 PolarHBondContact O-N 2.98Å; G651-R655 VanDerWaalsContact O-CZ 3.22Å; G651-R655 PolarHBondContact O-NE 3.36Å; G651-R655 PolarHBondContact O-NH2 3.17Å
652	R	82.9	Confident	80	Confident	5 Å²	5	30.4 Å²	30.4	2%	0.019	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-29.6	162.8	-61.9	-69.5	124.4	-173.7	-16.3	111.9	T260 M566 F568 A622 A623 L626 V631 V634 H648 R649 S650 R655	T260-R652 PolarHBondContact OG1-NH2 2.9Å; M566-R652 HydrophobicContact CE-CB 4.44Å; M566-R652 HydrophobicContact CE-CG 4.08Å; M566-R652 HydrophobicContact SD-CB 3.76Å; M566-R652 HydrophobicContact SD-CG 4.06Å; F568-R652 HydrophobicContact CE2-CG 3.96Å; F568-R652 HydrophobicContact CZ-CG 3.87Å; A622-R652 WeakPolarHBondContact O-CD 3.44Å; A622-R652 PolarHBondContact O-NH1 2.97Å; A623-R652 PolarHBondContact O-NE 3.11Å; A623-R652 PolarHBondContact O-NH2 3.33Å; L626-R652 PolarHBondContact O-NH1 2.92Å; V631-R652 WeakPolarHBondContact CB-O 3.41Å; V634-R652 HydrophobicContact CG2-CB 3.85Å; H648-R652 PolarHBondContact O-NE 3.45Å; H648-R652 VanDerWaalsContact O-NE 3.09Å; R649-R652 VanDerWaalsContact O-CB 3.29Å; R649-R652 WeakPolarHBondContact O-CB 3.43Å; R649-R652 WeakPolarHBondContact O-CG 3.5Å; R649-R652 PolarHBondContact O-N 2.91Å; S650-R652 PolarHBondContact O-N 3.43Å; R652-R655 VanDerWaalsContact NH2-NH2 3.17Å
653	T	81.6	Confident	80.3	Confident	1 Å²	1	28 Å²	28	1%	0.006	16%	0.158	C	C	.	.	S	Bend	trans	-99.8	-175.5	167.9	-174.6	0	0	0	0	109.7	L538 V631 Q632 V634 S650 R655 G660	L538-T653 HydrophobicContact CD1-CG2 3.52Å; V631-T653 WeakPolarHBondContact O-CB 3.34Å; V631-T653 PolarHBondContact O-OG1 2.88Å; Q632-T653 PolarHBondContact O-OG1 3.17Å; V634-T653 HydrophobicContact CB-CG2 4.09Å; V634-T653 HydrophobicContact CG2-CG2 3.62Å; S650-T653 WeakPolarHBondContact O-CG2 3.46Å; S650-T653 PolarHBondContact O-N 3.11Å; T653-R655 PolarHBondContact O-N 3.47Å; T653-R655 VanDerWaalsContact O-N 3.17Å; T653-G660 WeakPolarHBondContact OG1-CA 3.34Å
654	A	71.1	Confident	80.7	Confident	3 Å²	3	27.6 Å²	27.6	3%	0.025	16%	0.155	C	C	.	.	S	Bend	trans	56.3	28.4	178.3	0	0	0	0	0	115.3	V535 L538 K658	V535-A654 HydrophobicContact CB-CB 4.41Å; L538-A654 HydrophobicContact CB-CB 3.87Å; L538-A654 HydrophobicContact CD1-CB 3.83Å; L538-A654 HydrophobicContact CG-CB 4.49Å; A654-K658 CarbonylContact C-O 3.5Å; A654-K658 WeakPolarHBondContact CA-O 3.38Å
655	R	69.6	Low	81.4	Confident	38 Å²	38	27 Å²	27	14%	0.143	15%	0.152	C	C	.	.			trans	-79	142	-179.3	-66.1	-169.5	175.4	-161.6	-2.4	112.3	L626 D627 G651 R652 T653 K658	L626-R655 PolarHBondContact O-NH1 2.85Å; D627-R655 IonicContact OD1-CZ 3.64Å; D627-R655 IonicContact OD1-NH1 3.95Å; D627-R655 PolarHBondContact OD1-NH1 2.88Å; G651-R655 VanDerWaalsContact O-CZ 3.22Å; G651-R655 PolarHBondContact O-NE 3.36Å; G651-R655 PolarHBondContact O-NH2 3.17Å; R652-R655 VanDerWaalsContact NH2-NH2 3.17Å; T653-R655 PolarHBondContact O-N 3.47Å; T653-R655 VanDerWaalsContact O-N 3.17Å; R655-K658 PolarHBondContact O-N 3.07Å
656	A	62.9	Low	81.7	Confident	87 Å²	87	26.2 Å²	26.2	72%	0.719	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	-137.6	-172.1	0	0	0	0	0	111.5	K658	A656-K658 PolarHBondContact O-N 3.06Å
657	T	63.6	Low	81.8	Confident	136 Å²	136	26.2 Å²	26.2	83%	0.834	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	11.3	-175.8	51.2	0	0	0	0	114.7
658	K	69.9	Low	82	Confident	114 Å²	114	30 Å²	30	50%	0.496	17%	0.173	S	C	.	.			trans	-97.3	142.3	-173.5	-59	-169.1	-177	-172.6	0	111.9	T537 N630 A654 R655 A656	T537-K658 WeakPolarHBondContact CB-O 3.44Å; T537-K658 PolarHBondContact OG1-O 3.38Å; N630-K658 PolarHBondContact OD1-NZ 3.1Å; A654-K658 CarbonylContact C-O 3.5Å; A654-K658 WeakPolarHBondContact CA-O 3.38Å; R655-K658 PolarHBondContact O-N 3.07Å; A656-K658 PolarHBondContact O-N 3.06Å
659	E	79.3	Confident	82.2	Confident	133 Å²	133	35.2 Å²	35.2	62%	0.621	20%	0.201	S	C	*	.			trans	-70.4	148.4	171.1	-60.6	-173.2	160.5	0	0	111.3	T537 L805	T537-E659 WeakPolarHBondContact O-CA 3.35Å; E659-L805 HydrophobicContact CB-CD1 3.69Å
660	G	83.3	Confident	82.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	160.6	177.7	0	0	0	0	0	113.2	T537 T539 T653	T537-G660 PolarHBondContact O-N 3.43Å; T539-G660 PolarHBondContact N-O 3.02Å; T539-G660 PolarHBondContact OG1-O 2.84Å; T653-G660 WeakPolarHBondContact OG1-CA 3.34Å
661	L	87.1	Confident	82.1	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	120.5	176.4	174.8	57.5	0	0	0	111.4	T539 T541 F557 Q632 H633 V634 F690 A804 L805 I808	T539-L661 WeakPolarHBondContact O-CA 3.26Å; T539-L661 WeakPolarHBondContact OG1-CD1 3.06Å; T541-L661 HydrophobicContact CG2-CD1 4.07Å; F557-L661 HydrophobicContact CE2-CD2 3.84Å; F557-L661 HydrophobicContact CZ-CD2 3.89Å; Q632-L661 PolarHBondContact O-N 2.65Å; H633-L661 WeakPolarHBondContact CA-O 3.16Å; V634-L661 PolarHBondContact N-O 2.8Å; L661-F690 HydrophobicContact CD2-CE2 4.01Å; L661-A804 HydrophobicContact CD2-CB 3.43Å; L661-A804 VanDerWaalsContact CD2-CB 3.43Å; L661-L805 HydrophobicContact CB-CD2 4.1Å; L661-I808 HydrophobicContact CD1-CD1 3.54Å; L661-I808 HydrophobicContact CD2-CD1 4.12Å; L661-I808 HydrophobicContact CG-CD1 4.48Å
662	S	90.3	Very high	82.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.2	166.2	-169.5	0	0	0	0	110	T539 T541 V634 H636 S650	T539-S662 PolarHBondContact O-N 3.14Å; T541-S662 PolarHBondContact N-O 2.9Å; T541-S662 PolarHBondContact OG1-O 2.58Å; V634-S662 CarbonylContact O-C 3.58Å; V634-S662 WeakPolarHBondContact O-CA 3.35Å; H636-S662 PolarHBondContact CD2-OG 3.41Å; H636-S662 PolarHBondContact NE2-OG 3.19Å; S650-S662 PolarHBondContact OG-OG 3.43Å
663	L	90.7	Very high	82.6	Confident	1 Å²	1	45 Å²	45	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.3	-179.1	176.4	62.5	0	0	0	110.5	T541 I543 F557 V634 I635 H636 L665 F690	T541-L663 CarbonylContact O-C 3.58Å; T541-L663 WeakPolarHBondContact O-CA 3.4Å; T541-L663 WeakPolarHBondContact OG1-CD1 3.07Å; I543-L663 HydrophobicContact CD1-CD1 3.94Å; I543-L663 HydrophobicContact CD1-CD2 4.32Å; I543-L663 HydrophobicContact CG1-CD1 3.99Å; F557-L663 HydrophobicContact CD2-CD2 3.49Å; F557-L663 VanDerWaalsContact CD2-CD2 3.49Å; F557-L663 HydrophobicContact CE2-CD2 3.87Å; F557-L663 HydrophobicContact CG-CD2 4.06Å; V634-L663 PolarHBondContact O-N 3.17Å; I635-L663 CarbonylContact C-O 3.55Å; I635-L663 WeakPolarHBondContact CA-O 3.27Å; I635-L663 HydrophobicContact CG1-CB 4.49Å; I635-L663 HydrophobicContact CG2-CD2 4.42Å; H636-L663 PolarHBondContact N-O 3.24Å; L663-L665 HydrophobicContact CG-CD2 4.49Å; L663-F690 HydrophobicContact CD1-CB 3.9Å; L663-F690 HydrophobicContact CD1-CD2 4.17Å; L663-F690 HydrophobicContact CD1-CG 4.06Å
664	L	91.9	Very high	82.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.8	177.7	-66.6	74.4	0	0	0	110.9	T541 Q542 I543 H636 Y646 I666 F674 L687	T541-L664 WeakPolarHBondContact O-CD1 3.17Å; T541-L664 PolarHBondContact O-N 2.82Å; Q542-L664 WeakPolarHBondContact CA-O 3.33Å; Q542-L664 HydrophobicContact CB-CB 4.43Å; I543-L664 PolarHBondContact N-O 3.27Å; H636-L664 HydrophobicContact CB-CG 4.38Å; Y646-L664 HydrophobicContact CE2-CD1 3.92Å; Y646-L664 HydrophobicContact CE2-CD2 3.8Å; Y646-L664 HydrophobicContact CE2-CG 4.02Å; L664-I666 HydrophobicContact CB-CD1 4.43Å; L664-I666 HydrophobicContact CB-CG1 4.14Å; L664-F674 HydrophobicContact CD2-CD2 3.72Å; L664-F674 HydrophobicContact CD2-CE2 3.63Å; L664-L687 HydrophobicContact CD1-CD1 4.02Å; L664-L687 HydrophobicContact CD2-CD1 4.18Å
665	L	92.6	Very high	83.5	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	99.3	168.5	-58	-172.5	0	0	0	108.8	I543 K550 L554 I635 H636 Y637 L663	I543-L665 HydrophobicContact CB-CD2 3.97Å; I543-L665 HydrophobicContact CD1-CD2 4.08Å; I543-L665 HydrophobicContact CG1-CD2 4.49Å; I543-L665 HydrophobicContact CG2-CD2 4.48Å; K550-L665 HydrophobicContact CB-CD1 4.18Å; K550-L665 HydrophobicContact CD-CB 4.04Å; K550-L665 WeakPolarHBondContact CE-O 3.4Å; K550-L665 HydrophobicContact CG-CB 4.4Å; K550-L665 PolarHBondContact NZ-O 3.08Å; L554-L665 HydrophobicContact CB-CD1 4.42Å; I635-L665 HydrophobicContact CG2-CD1 4.43Å; I635-L665 HydrophobicContact CG2-CG 4.34Å; H636-L665 PolarHBondContact O-N 3.02Å; Y637-L665 HydrophobicContact CD2-CD1 3.89Å; Y637-L665 HydrophobicContact CE2-CD1 4.48Å; L663-L665 HydrophobicContact CG-CD2 4.49Å
666	I	91.1	Very high	84.2	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	112.8	-174.4	-61.7	168.5	0	0	0	109.7	Q542 I543 C545 V639 L664 D670 V671 F674	Q542-I666 HydrophobicContact CB-CD1 3.9Å; I543-I666 PolarHBondContact O-N 2.88Å; C545-I666 PolarHBondContact N-O 2.73Å; V639-I666 HydrophobicContact CG2-CG1 4.04Å; L664-I666 HydrophobicContact CB-CD1 4.43Å; L664-I666 HydrophobicContact CB-CG1 4.14Å; I666-D670 HydrophobicContact CG2-CB 4.32Å; I666-V671 HydrophobicContact CG2-CG2 3.87Å; I666-F674 HydrophobicContact CD1-CB 4.45Å; I666-F674 HydrophobicContact CD1-CD1 3.69Å; I666-F674 HydrophobicContact CD1-CD2 3.96Å; I666-F674 HydrophobicContact CD1-CE1 3.82Å; I666-F674 HydrophobicContact CD1-CE2 4.11Å; I666-F674 HydrophobicContact CD1-CG 3.75Å; I666-F674 HydrophobicContact CD1-CZ 4.03Å; I666-F674 HydrophobicContact CG1-CG 4.47Å
667	G	89.5	Confident	85.2	Confident	3 Å²	3	51.7 Å²	51.7	3%	0.031	27%	0.265	C	S	.	.			trans	-86.6	167.8	167.7	0	0	0	0	0	112.7	C545 D669 D670 V671	C545-G667 WeakPolarHBondContact O-CA 3.2Å; G667-D669 VanDerWaalsContact C-N 3.29Å; G667-D669 PolarHBondContact O-N 2.69Å; G667-D670 WeakPolarHBondContact CA-OD2 3.46Å; G667-D670 PolarHBondContact N-OD2 2.95Å; G667-D670 WeakPolarHBondContact O-CB 3.35Å; G667-D670 PolarHBondContact O-N 3.07Å; G667-V671 WeakPolarHBondContact O-CG2 3.3Å; G667-V671 PolarHBondContact O-N 2.95Å
668	P	87.9	Confident	86.1	Confident	87 Å²	87	46.1 Å²	46.1	57%	0.565	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-57.8	-41.6	178.8	23.5	-33.3	0	0	0	112.3	D670 V671	P668-D670 PolarHBondContact O-N 3.34Å; P668-V671 PolarHBondContact O-N 3.09Å
669	D	87.1	Confident	86.7	Confident	115 Å²	115	48.6 Å²	48.6	62%	0.615	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-63.7	-29.5	176.6	-45.2	-35.8	0	0	0	112.4	G667	G667-D669 VanDerWaalsContact C-N 3.29Å; G667-D669 PolarHBondContact O-N 2.69Å
670	D	86.2	Confident	86.5	Confident	21 Å²	21	45.1 Å²	45.1	11%	0.112	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-81.2	-23.8	-175.4	-63.8	-62.1	0	0	0	113	K550 V639 I666 G667 P668 I672 N673 F674	K550-D670 IonicContact NZ-OD2 3.79Å; K550-D670 PolarHBondContact NZ-OD2 3.36Å; V639-D670 HydrophobicContact CB-CB 3.88Å; V639-D670 HydrophobicContact CG2-CB 3.61Å; I666-D670 HydrophobicContact CG2-CB 4.32Å; G667-D670 WeakPolarHBondContact CA-OD2 3.46Å; G667-D670 PolarHBondContact N-OD2 2.95Å; G667-D670 WeakPolarHBondContact O-CB 3.35Å; G667-D670 PolarHBondContact O-N 3.07Å; P668-D670 PolarHBondContact O-N 3.34Å; D670-I672 PolarHBondContact O-N 3.26Å; D670-I672 VanDerWaalsContact O-N 3.13Å; D670-N673 PolarHBondContact O-N 3.07Å; D670-F674 PolarHBondContact O-N 3.41Å
671	V	86.6	Confident	86.1	Confident	47 Å²	47	45.6 Å²	45.6	29%	0.285	23%	0.233	S	C	.	.	H	α-helix	trans	-54.6	-37.9	-173.1	179.8	0	0	0	0	112.2	I666 G667 P668 N673 F674 K675	I666-V671 HydrophobicContact CG2-CG2 3.87Å; G667-V671 WeakPolarHBondContact O-CG2 3.3Å; G667-V671 PolarHBondContact O-N 2.95Å; P668-V671 PolarHBondContact O-N 3.09Å; V671-N673 VanDerWaalsContact C-N 3.31Å; V671-N673 PolarHBondContact O-N 3.02Å; V671-F674 PolarHBondContact O-N 2.9Å; V671-K675 HydrophobicContact CG1-CD 4.28Å; V671-K675 HydrophobicContact CG1-CG 4.42Å; V671-K675 WeakPolarHBondContact O-CG 3.31Å; V671-K675 PolarHBondContact O-N 3.12Å
672	I	86.4	Confident	85	Confident	115 Å²	115	48.3 Å²	48.3	59%	0.59	26%	0.261	S	S	*	.	H	α-helix	trans	-66.7	-33.2	179.5	-62.7	175.9	0	0	0	111.5	D670 K676	D670-I672 PolarHBondContact O-N 3.26Å; D670-I672 VanDerWaalsContact O-N 3.13Å; I672-K676 WeakPolarHBondContact O-CE 3.42Å; I672-K676 WeakPolarHBondContact O-CG 3.46Å
673	N	86.3	Confident	84	Confident	41 Å²	41	49.9 Å²	49.9	22%	0.219	27%	0.268	C	S	.	.	H	α-helix	trans	-82.1	-40	178	-64.6	-32.1	0	0	0	110.9	D670 V671 K675 K676 I677	D670-N673 PolarHBondContact O-N 3.07Å; V671-N673 VanDerWaalsContact C-N 3.31Å; V671-N673 PolarHBondContact O-N 3.02Å; N673-K675 PolarHBondContact O-N 3.19Å; N673-K676 WeakPolarHBondContact O-CB 3.41Å; N673-K676 PolarHBondContact O-N 2.77Å; N673-K676 PolarHBondContact OD1-NZ 2.93Å; N673-I677 WeakPolarHBondContact O-CG1 3.15Å; N673-I677 PolarHBondContact O-N 3.22Å; N673-I677 VanDerWaalsContact O-N 3.08Å
674	F	86.1	Confident	82.2	Confident	15 Å²	15	57 Å²	57	7%	0.066	31%	0.306	C	S	.	.	H	α-helix	trans	-55.8	-49.5	172.5	179.4	-117.3	0	0	0	111.9	V639 L664 I666 D670 V671 K676 I677 S678 L687	V639-F674 HydrophobicContact CG1-CB 4.28Å; L664-F674 HydrophobicContact CD2-CD2 3.72Å; L664-F674 HydrophobicContact CD2-CE2 3.63Å; I666-F674 HydrophobicContact CD1-CB 4.45Å; I666-F674 HydrophobicContact CD1-CD1 3.69Å; I666-F674 HydrophobicContact CD1-CD2 3.96Å; I666-F674 HydrophobicContact CD1-CE1 3.82Å; I666-F674 HydrophobicContact CD1-CE2 4.11Å; I666-F674 HydrophobicContact CD1-CG 3.75Å; I666-F674 HydrophobicContact CD1-CZ 4.03Å; I666-F674 HydrophobicContact CG1-CG 4.47Å; D670-F674 PolarHBondContact O-N 3.41Å; V671-F674 PolarHBondContact O-N 2.9Å; F674-K676 VanDerWaalsContact C-N 3.27Å; F674-K676 PolarHBondContact O-N 3.44Å; F674-I677 WeakPolarHBondContact O-CA 3.36Å; F674-I677 WeakPolarHBondContact O-CB 3.37Å; F674-I677 PolarHBondContact O-N 3.43Å; F674-S678 WeakPolarHBondContact CZ-OG 3.46Å; F674-S678 PolarHBondContact O-N 3.48Å; F674-S678 PolarHBondContact O-OG 2.73Å; F674-L687 HydrophobicContact CE2-CD1 3.74Å; F674-L687 HydrophobicContact CE2-CG 4.34Å; F674-L687 HydrophobicContact CZ-CB 4.46Å; F674-L687 HydrophobicContact CZ-CD1 3.89Å; F674-L687 HydrophobicContact CZ-CG 4.04Å
675	K	85.4	Confident	80.6	Confident	137 Å²	137	65.6 Å²	65.6	60%	0.596	35%	0.346	S	S	*	.	H	α-helix	trans	-61.5	-29	178.5	-73.6	-171.1	174.7	-166.6	0	114.3	V671 N673 K679	V671-K675 HydrophobicContact CG1-CD 4.28Å; V671-K675 HydrophobicContact CG1-CG 4.42Å; V671-K675 WeakPolarHBondContact O-CG 3.31Å; V671-K675 PolarHBondContact O-N 3.12Å; N673-K675 PolarHBondContact O-N 3.19Å; K675-K679 WeakPolarHBondContact O-CB 3.44Å; K675-K679 PolarHBondContact O-N 2.71Å
676	K	84.6	Confident	79.3	Confident	113 Å²	113	73 Å²	73	49%	0.491	38%	0.381	S	S	.	.	H	α-helix	trans	-69.6	-43.6	171	-64.7	164.7	-163.6	162.6	0	111.3	I672 N673 F674 T680	I672-K676 WeakPolarHBondContact O-CE 3.42Å; I672-K676 WeakPolarHBondContact O-CG 3.46Å; N673-K676 WeakPolarHBondContact O-CB 3.41Å; N673-K676 PolarHBondContact O-N 2.77Å; N673-K676 PolarHBondContact OD1-NZ 2.93Å; F674-K676 VanDerWaalsContact C-N 3.27Å; F674-K676 PolarHBondContact O-N 3.44Å; K676-T680 WeakPolarHBondContact O-CB 3.45Å; K676-T680 PolarHBondContact O-N 2.89Å; K676-T680 PolarHBondContact O-OG1 2.89Å
677	I	84.4	Confident	78.4	Confident	4 Å²	4	74 Å²	74	2%	0.021	39%	0.386	C	S	.	.	H	α-helix	trans	-62.9	-54	-178.4	-69.4	166.2	0	0	0	109.6	V639 P640 Y646 N673 F674 K679 T680 L681	V639-I677 HydrophobicContact CG1-CD1 4.01Å; P640-I677 HydrophobicContact CB-CD1 4.07Å; P640-I677 WeakPolarHBondContact O-CD1 3.36Å; Y646-I677 HydrophobicContact CD1-CG2 4Å; Y646-I677 HydrophobicContact CD2-CG2 4.4Å; Y646-I677 HydrophobicContact CG-CG2 3.83Å; N673-I677 WeakPolarHBondContact O-CG1 3.15Å; N673-I677 PolarHBondContact O-N 3.22Å; N673-I677 VanDerWaalsContact O-N 3.08Å; F674-I677 WeakPolarHBondContact O-CA 3.36Å; F674-I677 WeakPolarHBondContact O-CB 3.37Å; F674-I677 PolarHBondContact O-N 3.43Å; I677-K679 VanDerWaalsContact C-N 3.33Å; I677-K679 PolarHBondContact O-N 3.08Å; I677-T680 PolarHBondContact O-N 3.36Å; I677-L681 HydrophobicContact CG2-CD1 3.58Å; I677-L681 HydrophobicContact CG2-CG 4.29Å; I677-L681 VanDerWaalsContact O-CG 3.31Å; I677-L681 WeakPolarHBondContact O-CG 3.48Å; I677-L681 PolarHBondContact O-N 3.13Å
678	S	82	Confident	77.9	Confident	20 Å²	20	75.9 Å²	75.9	14%	0.14	40%	0.401	C	S	.	.	H	α-helix	trans	-56.6	-45.2	179.5	-45.9	0	0	0	0	112.2	F674 T680 L681 G682 K683	F674-S678 WeakPolarHBondContact CZ-OG 3.46Å; F674-S678 PolarHBondContact O-N 3.48Å; F674-S678 PolarHBondContact O-OG 2.73Å; S678-T680 VanDerWaalsContact C-N 3.33Å; S678-T680 PolarHBondContact O-N 3.31Å; S678-L681 PolarHBondContact O-N 2.74Å; S678-G682 PolarHBondContact O-N 3.05Å; S678-K683 PolarHBondContact O-N 2.63Å
679	K	81.6	Confident	77.6	Confident	166 Å²	166	75.9 Å²	75.9	72%	0.722	40%	0.399	S	S	*	.	H	α-helix	trans	-62.1	-37.2	176.6	-173.7	173.2	-173.4	179.5	0	113.1	K675 I677 L681	K675-K679 WeakPolarHBondContact O-CB 3.44Å; K675-K679 PolarHBondContact O-N 2.71Å; I677-K679 VanDerWaalsContact C-N 3.33Å; I677-K679 PolarHBondContact O-N 3.08Å; K679-L681 VanDerWaalsContact C-N 3.34Å
680	T	75.5	Confident	77.4	Confident	59 Å²	59	70.8 Å²	70.8	36%	0.362	37%	0.372	S	S	.	.	H	α-helix	trans	-76.1	-24.6	178.6	-51.6	0	0	0	0	112.2	S643 K676 I677 S678 G682	S643-T680 WeakPolarHBondContact OG-CG2 3.34Å; K676-T680 WeakPolarHBondContact O-CB 3.45Å; K676-T680 PolarHBondContact O-N 2.89Å; K676-T680 PolarHBondContact O-OG1 2.89Å; I677-T680 PolarHBondContact O-N 3.36Å; S678-T680 VanDerWaalsContact C-N 3.33Å; S678-T680 PolarHBondContact O-N 3.31Å; T680-G682 VanDerWaalsContact C-N 3.33Å
681	L	73.8	Confident	76.9	Confident	10 Å²	10	71.2 Å²	71.2	5%	0.052	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	2.2	176.4	-64.5	172.3	0	0	0	113.5	A533 Y646 V647 I677 S678 K679 K683	A533-L681 HydrophobicContact CB-CD2 3.96Å; Y646-L681 HydrophobicContact CD1-CD1 3.69Å; Y646-L681 HydrophobicContact CE1-CD1 3.86Å; V647-L681 HydrophobicContact CG2-CD2 3.77Å; I677-L681 HydrophobicContact CG2-CD1 3.58Å; I677-L681 HydrophobicContact CG2-CG 4.29Å; I677-L681 VanDerWaalsContact O-CG 3.31Å; I677-L681 WeakPolarHBondContact O-CG 3.48Å; I677-L681 PolarHBondContact O-N 3.13Å; S678-L681 PolarHBondContact O-N 2.74Å; K679-L681 VanDerWaalsContact C-N 3.34Å; L681-K683 HydrophobicContact CB-CG 4.27Å; L681-K683 PolarHBondContact O-N 2.85Å
682	G	66	Low	76.4	Confident	58 Å²	58	70.6 Å²	70.6	60%	0.598	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	14.7	-175.5	0	0	0	0	0	114.6	S678 T680 D684	S678-G682 PolarHBondContact O-N 3.05Å; T680-G682 VanDerWaalsContact C-N 3.33Å; G682-D684 PolarHBondContact O-N 2.99Å
683	K	68.4	Low	75.8	Confident	33 Å²	33	68.6 Å²	68.6	14%	0.143	36%	0.36	C	S	.	.			trans	-96.5	84.4	-175.7	-65.8	-172.2	-176.4	-168.1	0	110.4	E532 T534 E540 S678 L681	E532-K683 WeakPolarHBondContact OE2-CE 3.34Å; E532-K683 IonicContact OE2-NZ 3.41Å; E532-K683 PolarHBondContact OE2-NZ 2.89Å; T534-K683 PolarHBondContact OG1-NZ 2.93Å; E540-K683 IonicContact OE2-NZ 3.85Å; E540-K683 PolarHBondContact OE2-NZ 3.2Å; S678-K683 PolarHBondContact O-N 2.63Å; L681-K683 HydrophobicContact CB-CG 4.27Å; L681-K683 PolarHBondContact O-N 2.85Å
684	D	53	Low	75.4	Confident	152 Å²	152	72.6 Å²	72.6	81%	0.813	38%	0.382	S	S	*	.			trans	-78.2	-18.7	175.1	-72.8	-37.6	0	0	0	113.1	G682	G682-D684 PolarHBondContact O-N 2.99Å
685	E	58.1	Low	74.9	Confident	179 Å²	179	81.1 Å²	81.1	84%	0.836	42%	0.419	S	S	*	.	S	Bend	trans	-77.5	132.9	166	-69.3	-158.9	155.8	0	0	111.2	L687	E685-L687 PolarHBondContact O-N 3.01Å
686	E	64.6	Low	74.6	Confident	156 Å²	156	75.2 Å²	75.2	73%	0.729	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-66.7	133	175.8	-64.8	-166.7	149.3	0	0	111.8
687	L	73.5	Confident	74.5	Confident	24 Å²	24	70.3 Å²	70.3	13%	0.126	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-53.2	146.4	179.8	-67	-176.8	0	0	0	112.5	E540 Q542 L664 F674 E685 T689	E540-L687 HydrophobicContact CB-CD1 4.37Å; E540-L687 HydrophobicContact CB-CD2 3.9Å; Q542-L687 HydrophobicContact CB-CB 4.36Å; Q542-L687 HydrophobicContact CG-CB 3.86Å; Q542-L687 WeakPolarHBondContact CG-O 3.48Å; Q542-L687 PolarHBondContact NE2-O 2.87Å; L664-L687 HydrophobicContact CD1-CD1 4.02Å; L664-L687 HydrophobicContact CD2-CD1 4.18Å; F674-L687 HydrophobicContact CE2-CD1 3.74Å; F674-L687 HydrophobicContact CE2-CG 4.34Å; F674-L687 HydrophobicContact CZ-CB 4.46Å; F674-L687 HydrophobicContact CZ-CD1 3.89Å; F674-L687 HydrophobicContact CZ-CG 4.04Å; E685-L687 PolarHBondContact O-N 3.01Å; L687-T689 PolarHBondContact O-N 2.97Å
688	A	78.9	Confident	74.5	Confident	41 Å²	41	78.5 Å²	78.5	34%	0.339	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	125.3	-177.4	0	0	0	0	0	111.8	T541 Q542 F690	T541-A688 CarbonylContact C-O 3.6Å; T541-A688 WeakPolarHBondContact CA-O 3.26Å; T541-A688 WeakPolarHBondContact CB-O 3.49Å; Q542-A688 PolarHBondContact N-O 2.95Å; A688-F690 PolarHBondContact O-N 3.14Å
689	T	80.9	Confident	74.6	Confident	87 Å²	87	79.1 Å²	79.1	53%	0.534	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	129.5	175	-38.4	0	0	0	0	110.7	Q542 L687	Q542-T689 CarbonylContact O-C 3.58Å; Q542-T689 WeakPolarHBondContact O-CA 3.49Å; L687-T689 PolarHBondContact O-N 2.97Å
690	F	82.5	Confident	74.9	Confident	9 Å²	9	71.2 Å²	71.2	4%	0.039	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-71.9	136.4	-178.6	-169.9	-91.6	0	0	0	112.1	T541 Q542 I543 Y556 F557 Y561 L661 L663 A688 V692 I808	T541-F690 HydrophobicContact CG2-CD2 4.21Å; Q542-F690 PolarHBondContact O-N 3.1Å; I543-F690 HydrophobicContact CD1-CB 4.04Å; I543-F690 HydrophobicContact CD1-CD1 4.14Å; I543-F690 HydrophobicContact CD1-CG 4.37Å; I543-F690 HydrophobicContact CG1-CB 3.7Å; Y556-F690 HydrophobicContact CE1-CE1 4.24Å; F557-F690 HydrophobicContact CD2-CE1 4.33Å; F557-F690 HydrophobicContact CD2-CZ 4.04Å; F557-F690 HydrophobicContact CE2-CE2 4.11Å; F557-F690 AromaticContact CE2-CZ 3.91Å; F557-F690 HydrophobicContact CE2-CZ 3.91Å; Y561-F690 HydrophobicContact CD2-CZ 4.33Å; Y561-F690 AromaticContact CE2-CE1 3.91Å; Y561-F690 HydrophobicContact CE2-CE1 3.91Å; Y561-F690 AromaticContact CE2-CZ 3.53Å; Y561-F690 HydrophobicContact CE2-CZ 3.53Å; Y561-F690 AromaticContact CZ-CZ 3.93Å; L661-F690 HydrophobicContact CD2-CE2 4.01Å; L663-F690 HydrophobicContact CD1-CB 3.9Å; L663-F690 HydrophobicContact CD1-CD2 4.17Å; L663-F690 HydrophobicContact CD1-CG 4.06Å; A688-F690 PolarHBondContact O-N 3.14Å; F690-V692 HydrophobicContact CD1-CG2 4.23Å; F690-V692 PolarHBondContact O-N 3.41Å; F690-I808 HydrophobicContact CD2-CD1 4.31Å; F690-I808 HydrophobicContact CE2-CD1 4.1Å; F690-I808 HydrophobicContact CE2-CG1 4.39Å
691	P	76.6	Confident	75.6	Confident	30 Å²	30	71.7 Å²	71.7	20%	0.195	38%	0.378	C	S	.	.			trans	-72	108.5	177.6	26.9	-33.1	0	0	0	112.8	Y556	Y556-P691 PolarHBondContact OH-O 3.18Å
692	V	76.3	Confident	76.3	Confident	34 Å²	34	76.5 Å²	76.5	21%	0.206	40%	0.4	C	S	.	.			trans	-102.1	129.6	173.8	-178.2	0	0	0	0	111.2	I543 Y553 Y556 F690 N694 M697	I543-V692 HydrophobicContact CD1-CG2 3.87Å; I543-V692 HydrophobicContact CG1-CG2 4.4Å; Y553-V692 HydrophobicContact CD1-CG1 4.24Å; Y553-V692 HydrophobicContact CD1-CG2 3.99Å; Y553-V692 HydrophobicContact CE1-CB 4.45Å; Y553-V692 HydrophobicContact CE1-CG1 4.02Å; Y553-V692 HydrophobicContact CE1-CG2 4.04Å; Y556-V692 HydrophobicContact CD1-CG1 4.09Å; Y556-V692 HydrophobicContact CD1-CG2 4.44Å; Y556-V692 HydrophobicContact CE1-CB 4.15Å; Y556-V692 HydrophobicContact CE1-CG1 3.81Å; Y556-V692 HydrophobicContact CE1-CG2 4.01Å; F690-V692 HydrophobicContact CD1-CG2 4.23Å; F690-V692 PolarHBondContact O-N 3.41Å; V692-N694 PolarHBondContact O-N 3.28Å; V692-N694 VanDerWaalsContact O-N 3.17Å; V692-M697 HydrophobicContact CG1-CG 3.8Å; V692-M697 HydrophobicContact CG1-SD 3.8Å
693	E	73.4	Confident	77.4	Confident	73 Å²	73	74.3 Å²	74.3	34%	0.341	37%	0.374	S	S	.	.			trans	-80.2	92.3	175.6	-70.7	-174	-132.3	0	0	111.4	Y556 K695 C696 R807	Y556-E693 HydrophobicContact CE2-CB 4.36Å; Y556-E693 PolarHBondContact OH-N 3.44Å; Y556-E693 VanDerWaalsContact OH-N 3.08Å; E693-K695 PolarHBondContact O-N 3.39Å; E693-C696 PolarHBondContact O-N 3.5Å; E693-C696 PolarHBondContact O-SG 2.86Å; E693-R807 IonicContact OE1-CZ 3.23Å; E693-R807 VanDerWaalsContact OE1-CZ 3.22Å; E693-R807 IonicContact OE1-NH1 2.7Å; E693-R807 PolarHBondContact OE1-NH1 3.16Å; E693-R807 IonicContact OE1-NH2 3.5Å; E693-R807 PolarHBondContact OE1-NH2 2.96Å
694	N	76.9	Confident	78.4	Confident	124 Å²	124	72.7 Å²	72.7	66%	0.663	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-15.8	-179.2	-73.4	-12.8	0	0	0	115.1	V692	V692-N694 PolarHBondContact O-N 3.28Å; V692-N694 VanDerWaalsContact O-N 3.17Å
695	K	76.6	Confident	80.3	Confident	194 Å²	194	68.6 Å²	68.6	84%	0.843	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-46	176.5	-67.7	179	179.4	176.4	0	112.4	E693	E693-K695 PolarHBondContact O-N 3.39Å
696	C	78.3	Confident	81.8	Confident	13 Å²	13	61.4 Å²	61.4	9%	0.088	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-20.3	179.2	48.2	0	0	0	0	113.5	E693 K698 A699 I700 I775 F776	E693-C696 PolarHBondContact O-N 3.5Å; E693-C696 PolarHBondContact O-SG 2.86Å; C696-K698 PolarHBondContact O-N 2.95Å; C696-A699 PolarHBondContact O-N 2.92Å; C696-A699 VanDerWaalsContact O-N 3.16Å; C696-I700 HydrophobicContact CB-CD1 4.14Å; C696-I700 WeakPolarHBondContact O-CG1 3.3Å; C696-I700 PolarHBondContact O-N 3.2Å; C696-I775 HydrophobicContact CB-CG2 3.44Å; C696-I775 VanDerWaalsContact CB-CG2 3.44Å; C696-F776 HydrophobicContact CB-CD1 4.44Å; C696-F776 HydrophobicContact CB-CE1 4.04Å
697	M	83.4	Confident	83	Confident	11 Å²	11	54 Å²	54	5%	0.054	28%	0.277	C	S	.	.	H	α-helix	trans	-57.2	-24.4	-177.9	-70.4	-60.7	-72.9	0	0	114.2	F552 Y553 Y556 V692 I700 K701	F552-M697 HydrophobicContact CB-CE 3.94Å; Y553-M697 HydrophobicContact CD1-CE 3.77Å; Y553-M697 HydrophobicContact CE1-CE 3.63Å; Y553-M697 HydrophobicContact CG-CE 4.37Å; Y556-M697 HydrophobicContact CD2-SD 4.3Å; Y556-M697 HydrophobicContact CG-SD 4.09Å; V692-M697 HydrophobicContact CG1-CG 3.8Å; V692-M697 HydrophobicContact CG1-SD 3.8Å; M697-I700 HydrophobicContact SD-CD1 4.23Å; M697-I700 HydrophobicContact SD-CG2 4.47Å; M697-K701 VanDerWaalsContact O-CB 3.31Å; M697-K701 WeakPolarHBondContact O-CB 3.44Å; M697-K701 VanDerWaalsContact O-CG 3.25Å; M697-K701 WeakPolarHBondContact O-CG 3.47Å; M697-K701 PolarHBondContact O-N 3.07Å
698	K	84.4	Confident	83.8	Confident	176 Å²	176	55.3 Å²	55.3	77%	0.765	28%	0.28	S	S	*	.	H	α-helix	trans	-63.5	-54.4	173.8	-70	-173.5	176.6	-174.3	0	112.4	C696 I700 K701 E702	C696-K698 PolarHBondContact O-N 2.95Å; K698-I700 VanDerWaalsContact C-N 3.28Å; K698-I700 PolarHBondContact O-N 3.24Å; K698-K701 PolarHBondContact O-N 3.17Å; K698-E702 PolarHBondContact O-N 3.26Å
699	A	84.9	Confident	84.3	Confident	32 Å²	32	60 Å²	60	26%	0.264	29%	0.293	S	S	.	.	H	α-helix	trans	-66.5	-30.3	179.2	0	0	0	0	0	112.6	C696 R703	C696-A699 PolarHBondContact O-N 2.92Å; C696-A699 VanDerWaalsContact O-N 3.16Å; A699-R703 WeakPolarHBondContact O-CG 3.27Å; A699-R703 PolarHBondContact O-N 2.93Å; A699-R703 VanDerWaalsContact O-N 3.1Å
700	I	86.9	Confident	84.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-68.1	-48.1	174.6	-68	171.1	0	0	0	110.4	F552 Y555 Y556 C696 M697 K698 E702 R703 V704 I775	F552-I700 HydrophobicContact CB-CG2 4.32Å; Y555-I700 HydrophobicContact CD1-CG2 4.11Å; Y556-I700 HydrophobicContact CD2-CD1 3.67Å; Y556-I700 HydrophobicContact CG-CD1 4.22Å; C696-I700 HydrophobicContact CB-CD1 4.14Å; C696-I700 WeakPolarHBondContact O-CG1 3.3Å; C696-I700 PolarHBondContact O-N 3.2Å; M697-I700 HydrophobicContact SD-CD1 4.23Å; M697-I700 HydrophobicContact SD-CG2 4.47Å; K698-I700 VanDerWaalsContact C-N 3.28Å; K698-I700 PolarHBondContact O-N 3.24Å; I700-E702 VanDerWaalsContact C-N 3.29Å; I700-E702 PolarHBondContact O-N 2.71Å; I700-R703 PolarHBondContact O-N 2.92Å; I700-V704 WeakPolarHBondContact O-CG2 3.44Å; I700-V704 PolarHBondContact O-N 2.83Å; I700-I775 HydrophobicContact CD1-CD1 4.48Å; I700-I775 HydrophobicContact CD1-CG2 4.41Å; I700-I775 HydrophobicContact CG1-CD1 3.66Å; I700-I775 HydrophobicContact CG1-CG2 4.28Å
701	K	89.2	Confident	85	Confident	70 Å²	70	56.4 Å²	56.4	30%	0.304	27%	0.271	S	S	.	.	H	α-helix	trans	-58.2	-40.4	174.4	-78.6	-177.7	172.9	-170.2	0	111.9	E549 F552 M697 K698 N705	E549-K701 WeakPolarHBondContact OE1-CE 3.33Å; E549-K701 IonicContact OE1-NZ 2.75Å; E549-K701 PolarHBondContact OE1-NZ 3.37Å; F552-K701 HydrophobicContact CB-CG 4.41Å; F552-K701 HydrophobicContact CD1-CB 4.5Å; F552-K701 HydrophobicContact CD1-CG 3.99Å; F552-K701 HydrophobicContact CD2-CD 4.08Å; F552-K701 VanDerWaalsContact CD2-CE 3.48Å; F552-K701 HydrophobicContact CD2-CG 3.59Å; F552-K701 HydrophobicContact CE1-CB 4.38Å; F552-K701 HydrophobicContact CE1-CG 4.13Å; F552-K701 HydrophobicContact CE2-CD 4.1Å; F552-K701 HydrophobicContact CE2-CG 3.75Å; F552-K701 HydrophobicContact CG-CG 3.74Å; F552-K701 HydrophobicContact CZ-CB 4.46Å; F552-K701 HydrophobicContact CZ-CG 4.02Å; M697-K701 VanDerWaalsContact O-CB 3.31Å; M697-K701 WeakPolarHBondContact O-CB 3.44Å; M697-K701 VanDerWaalsContact O-CG 3.25Å; M697-K701 WeakPolarHBondContact O-CG 3.47Å; M697-K701 PolarHBondContact O-N 3.07Å; K698-K701 PolarHBondContact O-N 3.17Å; K701-N705 WeakPolarHBondContact O-CB 3.4Å; K701-N705 PolarHBondContact O-N 2.79Å; K701-N705 PolarHBondContact O-ND2 3.47Å
702	E	88.9	Confident	85.6	Confident	111 Å²	111	60.9 Å²	60.9	52%	0.519	29%	0.287	S	S	.	.	H	α-helix	trans	-61	-55.3	175.7	-173.6	178.3	-173.5	0	0	112.5	K698 I700 V704 N705 L706 L770	K698-E702 PolarHBondContact O-N 3.26Å; I700-E702 VanDerWaalsContact C-N 3.29Å; I700-E702 PolarHBondContact O-N 2.71Å; E702-V704 PolarHBondContact O-N 3.22Å; E702-N705 PolarHBondContact O-N 3Å; E702-L706 WeakPolarHBondContact O-CB 3.37Å; E702-L706 PolarHBondContact O-N 2.85Å; E702-L770 HydrophobicContact CG-CD1 4.23Å
703	R	89.9	Confident	86	Confident	11 Å²	11	61.3 Å²	61.3	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-57.7	-47.6	179.9	-71	175.2	-157.9	-154.8	-0.7	112.3	Y555 L585 A699 I700 L706 A707 L767 L770 I771 Q773	Y555-R703 HydrophobicContact CE1-CB 4.15Å; L585-R703 HydrophobicContact CD2-CB 4.33Å; A699-R703 WeakPolarHBondContact O-CG 3.27Å; A699-R703 PolarHBondContact O-N 2.93Å; A699-R703 VanDerWaalsContact O-N 3.1Å; I700-R703 PolarHBondContact O-N 2.92Å; R703-L706 PolarHBondContact O-N 2.98Å; R703-A707 WeakPolarHBondContact O-CB 3.29Å; R703-A707 PolarHBondContact O-N 3.38Å; R703-L767 HydrophobicContact CB-CD1 4.11Å; R703-L767 HydrophobicContact CG-CD1 4.37Å; R703-L770 HydrophobicContact CG-CB 3.95Å; R703-L770 HydrophobicContact CG-CD1 4.41Å; R703-L770 PolarHBondContact NE-O 3.24Å; R703-L770 PolarHBondContact NH1-O 3.33Å; R703-L770 PolarHBondContact NH2-O 3.38Å; R703-I771 PolarHBondContact NH1-O 2.92Å; R703-Q773 PolarHBondContact NH1-O 2.97Å; R703-Q773 PolarHBondContact NH2-O 3.37Å
704	V	89.7	Confident	86.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-70.5	-37.1	-177.9	177.9	0	0	0	0	111.7	D551 F552 Y555 L585 I700 E702 L706 A707 R708	D551-V704 HydrophobicContact CB-CG1 3.77Å; F552-V704 HydrophobicContact CD1-CB 3.6Å; F552-V704 HydrophobicContact CD1-CG1 3.62Å; F552-V704 HydrophobicContact CD1-CG2 4.14Å; F552-V704 HydrophobicContact CE1-CB 3.78Å; F552-V704 HydrophobicContact CE1-CG1 3.71Å; Y555-V704 HydrophobicContact CD1-CG2 3.38Å; Y555-V704 HydrophobicContact CE1-CG2 4.13Å; Y555-V704 HydrophobicContact CG-CG2 3.93Å; L585-V704 HydrophobicContact CD1-CG2 3.97Å; L585-V704 HydrophobicContact CD2-CG2 4.5Å; I700-V704 WeakPolarHBondContact O-CG2 3.44Å; I700-V704 PolarHBondContact O-N 2.83Å; E702-V704 PolarHBondContact O-N 3.22Å; V704-L706 VanDerWaalsContact C-N 3.32Å; V704-L706 PolarHBondContact O-N 2.82Å; V704-A707 PolarHBondContact O-N 2.64Å; V704-R708 VanDerWaalsContact O-CB 3.24Å; V704-R708 WeakPolarHBondContact O-CB 3.4Å; V704-R708 PolarHBondContact O-N 2.98Å
705	N	91.9	Very high	86.8	Confident	65 Å²	65	61.8 Å²	61.8	35%	0.348	28%	0.281	S	S	.	.	H	α-helix	trans	-65.7	-35.5	174.7	-78.3	-34	0	0	0	112.1	F552 K701 E702 R708 K709	F552-N705 WeakPolarHBondContact CZ-OD1 3.42Å; K701-N705 WeakPolarHBondContact O-CB 3.4Å; K701-N705 PolarHBondContact O-N 2.79Å; K701-N705 PolarHBondContact O-ND2 3.47Å; E702-N705 PolarHBondContact O-N 3Å; N705-R708 PolarHBondContact OD1-NH1 2.8Å; N705-K709 WeakPolarHBondContact O-CG 3.48Å; N705-K709 PolarHBondContact O-N 2.95Å; N705-K709 VanDerWaalsContact O-N 3.16Å
706	L	89.4	Confident	87.1	Confident	29 Å²	29	57.7 Å²	57.7	15%	0.152	26%	0.261	C	S	.	.	H	α-helix	trans	-68.2	-47.1	173.7	-154.2	179.4	0	0	0	110.4	E702 R703 V704 R708 K709 I710 M763 N766 L767 L770	E702-L706 WeakPolarHBondContact O-CB 3.37Å; E702-L706 PolarHBondContact O-N 2.85Å; R703-L706 PolarHBondContact O-N 2.98Å; V704-L706 VanDerWaalsContact C-N 3.32Å; V704-L706 PolarHBondContact O-N 2.82Å; L706-R708 VanDerWaalsContact C-N 3.34Å; L706-R708 PolarHBondContact O-N 2.82Å; L706-K709 WeakPolarHBondContact O-CB 3.06Å; L706-K709 PolarHBondContact O-N 3.11Å; L706-K709 VanDerWaalsContact O-N 3.16Å; L706-I710 HydrophobicContact CD2-CD1 3.53Å; L706-I710 HydrophobicContact CD2-CG1 4.07Å; L706-I710 PolarHBondContact O-N 2.8Å; L706-I710 VanDerWaalsContact O-N 3.1Å; L706-M763 HydrophobicContact CD2-CB 3.82Å; L706-M763 HydrophobicContact CD2-CG 4.29Å; L706-N766 HydrophobicContact CD1-CB 4.24Å; L706-L767 HydrophobicContact CB-CD1 4.47Å; L706-L767 HydrophobicContact CD1-CB 4.21Å; L706-L767 HydrophobicContact CD2-CB 4.1Å; L706-L770 HydrophobicContact CD1-CD1 3.87Å
707	A	90.2	Very high	87.3	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.1	-40.5	175	0	0	0	0	0	113	L581 I584 L585 R703 V704 K709 I710 E711 L767	L581-A707 HydrophobicContact CD1-CB 3.73Å; I584-A707 HydrophobicContact CG2-CB 3.72Å; L585-A707 HydrophobicContact CD1-CB 4.22Å; L585-A707 HydrophobicContact CD2-CB 3.59Å; L585-A707 HydrophobicContact CG-CB 3.71Å; R703-A707 WeakPolarHBondContact O-CB 3.29Å; R703-A707 PolarHBondContact O-N 3.38Å; V704-A707 PolarHBondContact O-N 2.64Å; A707-K709 VanDerWaalsContact C-N 3.35Å; A707-K709 PolarHBondContact O-N 2.82Å; A707-I710 WeakPolarHBondContact O-CB 3.43Å; A707-I710 PolarHBondContact O-N 2.85Å; A707-E711 WeakPolarHBondContact O-CB 3.45Å; A707-E711 PolarHBondContact O-N 3.37Å; A707-L767 HydrophobicContact CB-CD2 3.83Å
708	R	90.6	Very high	87.1	Confident	51 Å²	51	61.9 Å²	61.9	19%	0.192	28%	0.283	C	S	.	.	H	α-helix	trans	-65	-33.9	175.8	-174.4	-174.9	-70.5	160	-7.1	112.6	D548 D551 L581 V704 N705 L706 K712	D548-R708 PolarHBondContact O-NH2 2.96Å; D551-R708 IonicContact OD2-CZ 2.65Å; D551-R708 IonicContact OD2-NE 3.62Å; D551-R708 PolarHBondContact OD2-NE 2.99Å; D551-R708 IonicContact OD2-NH2 2.65Å; D551-R708 PolarHBondContact OD2-NH2 3.23Å; L581-R708 HydrophobicContact CD1-CB 4.28Å; V704-R708 VanDerWaalsContact O-CB 3.24Å; V704-R708 WeakPolarHBondContact O-CB 3.4Å; V704-R708 PolarHBondContact O-N 2.98Å; N705-R708 PolarHBondContact OD1-NH1 2.8Å; L706-R708 VanDerWaalsContact C-N 3.34Å; L706-R708 PolarHBondContact O-N 2.82Å; R708-K712 WeakPolarHBondContact O-CB 3.46Å; R708-K712 PolarHBondContact O-N 2.7Å
709	K	89.7	Confident	86.8	Confident	139 Å²	139	60.5 Å²	60.5	60%	0.604	27%	0.273	S	S	*	.	H	α-helix	trans	-66.9	-43	171.9	-74	176.2	179.9	-175.3	0	111.5	N705 L706 A707 I713	N705-K709 WeakPolarHBondContact O-CG 3.48Å; N705-K709 PolarHBondContact O-N 2.95Å; N705-K709 VanDerWaalsContact O-N 3.16Å; L706-K709 WeakPolarHBondContact O-CB 3.06Å; L706-K709 PolarHBondContact O-N 3.11Å; L706-K709 VanDerWaalsContact O-N 3.16Å; A707-K709 VanDerWaalsContact C-N 3.35Å; A707-K709 PolarHBondContact O-N 2.82Å; K709-I713 WeakPolarHBondContact O-CD1 3.37Å; K709-I713 WeakPolarHBondContact O-CG1 3.42Å; K709-I713 PolarHBondContact O-N 2.93Å
710	I	88.3	Confident	86.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.5	-52.8	175.5	-66.1	163.1	0	0	0	110.2	I584 L706 A707 K712 I713 E714 V760 M763 K764 L767	I584-I710 HydrophobicContact CD1-CG2 3.93Å; I584-I710 HydrophobicContact CG1-CG2 4.37Å; I584-I710 HydrophobicContact CG2-CB 4.33Å; I584-I710 HydrophobicContact CG2-CD1 4.23Å; I584-I710 HydrophobicContact CG2-CG2 4.2Å; L706-I710 HydrophobicContact CD2-CD1 3.53Å; L706-I710 HydrophobicContact CD2-CG1 4.07Å; L706-I710 PolarHBondContact O-N 2.8Å; L706-I710 VanDerWaalsContact O-N 3.1Å; A707-I710 WeakPolarHBondContact O-CB 3.43Å; A707-I710 PolarHBondContact O-N 2.85Å; I710-K712 VanDerWaalsContact C-N 3.33Å; I710-K712 PolarHBondContact O-N 2.99Å; I710-I713 PolarHBondContact O-N 3.3Å; I710-I713 VanDerWaalsContact O-N 3.11Å; I710-E714 HydrophobicContact CG2-CG 4.23Å; I710-E714 WeakPolarHBondContact CG2-OE2 3.42Å; I710-E714 WeakPolarHBondContact O-CG 3.45Å; I710-E714 PolarHBondContact O-N 3.1Å; I710-V760 HydrophobicContact CG2-CG1 4.35Å; I710-M763 HydrophobicContact CD1-CB 4.07Å; I710-M763 HydrophobicContact CG1-CB 3.91Å; I710-K764 HydrophobicContact CD1-CG 3.86Å; I710-K764 HydrophobicContact CG1-CG 4.45Å; I710-K764 HydrophobicContact CG2-CD 4.4Å; I710-K764 HydrophobicContact CG2-CG 4.14Å; I710-L767 HydrophobicContact CD1-CB 4.32Å; I710-L767 HydrophobicContact CD1-CD2 3.86Å
711	E	90.2	Very high	86.1	Confident	22 Å²	22	66.9 Å²	66.9	10%	0.103	30%	0.295	C	S	.	.	H	α-helix	trans	-56.3	-44.8	-178.8	-173.9	-92.6	157.7	0	0	111.9	R577 A580 L581 I584 A707 I713 E714 Y715	R577-E711 VanDerWaalsContact CG-OE1 3.25Å; R577-E711 WeakPolarHBondContact CG-OE1 3.2Å; A580-E711 HydrophobicContact CB-CG 3.96Å; L581-E711 HydrophobicContact CB-CG 4.46Å; L581-E711 HydrophobicContact CD1-CB 4.42Å; I584-E711 HydrophobicContact CD1-CB 3.73Å; I584-E711 HydrophobicContact CD1-CG 4.31Å; A707-E711 WeakPolarHBondContact O-CB 3.45Å; A707-E711 PolarHBondContact O-N 3.37Å; E711-I713 PolarHBondContact O-N 3.29Å; E711-E714 PolarHBondContact O-N 2.55Å; E711-Y715 VanDerWaalsContact O-CB 3.3Å; E711-Y715 WeakPolarHBondContact O-CB 3.37Å; E711-Y715 PolarHBondContact O-N 3.09Å
712	K	87.9	Confident	85.5	Confident	124 Å²	124	69.7 Å²	69.7	54%	0.539	31%	0.309	S	S	.	.	H	α-helix	trans	-61	-41.4	176.4	-176.1	170.1	-179.4	177.9	0	112.9	R708 I710 Y716	R708-K712 WeakPolarHBondContact O-CB 3.46Å; R708-K712 PolarHBondContact O-N 2.7Å; I710-K712 VanDerWaalsContact C-N 3.33Å; I710-K712 PolarHBondContact O-N 2.99Å; K712-Y716 HydrophobicContact CD-CE2 4.36Å; K712-Y716 HydrophobicContact CG-CD2 4.17Å; K712-Y716 HydrophobicContact CG-CE2 3.72Å; K712-Y716 WeakPolarHBondContact O-CD2 3.37Å; K712-Y716 PolarHBondContact O-N 3.08Å
713	I	85.2	Confident	85	Confident	43 Å²	43	67.4 Å²	67.4	22%	0.221	30%	0.299	C	S	.	.	H	α-helix	trans	-70	-48.2	177.9	-62.5	162.8	0	0	0	109.8	K709 I710 E711 Y715 Y716 N717 V760 M763	K709-I713 WeakPolarHBondContact O-CD1 3.37Å; K709-I713 WeakPolarHBondContact O-CG1 3.42Å; K709-I713 PolarHBondContact O-N 2.93Å; I710-I713 PolarHBondContact O-N 3.3Å; I710-I713 VanDerWaalsContact O-N 3.11Å; E711-I713 PolarHBondContact O-N 3.29Å; I713-Y715 PolarHBondContact O-N 3.08Å; I713-Y716 PolarHBondContact O-N 3.1Å; I713-Y716 VanDerWaalsContact O-N 3.15Å; I713-N717 WeakPolarHBondContact CG2-OD1 3.47Å; I713-N717 PolarHBondContact O-N 3.45Å; I713-N717 PolarHBondContact O-OD1 3.48Å; I713-V760 HydrophobicContact CB-CG2 4.09Å; I713-V760 HydrophobicContact CD1-CG2 3.94Å; I713-V760 HydrophobicContact CG2-CG2 3.63Å; I713-M763 HydrophobicContact CD1-CE 3.68Å
714	E	84.1	Confident	84.7	Confident	74 Å²	74	68.5 Å²	68.5	35%	0.346	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-31.7	179.6	-65.3	-163.1	122.7	0	0	112.6	I710 E711 N718 V760 K764	I710-E714 HydrophobicContact CG2-CG 4.23Å; I710-E714 WeakPolarHBondContact CG2-OE2 3.42Å; I710-E714 WeakPolarHBondContact O-CG 3.45Å; I710-E714 PolarHBondContact O-N 3.1Å; E711-E714 PolarHBondContact O-N 2.55Å; E714-N718 WeakPolarHBondContact O-CB 3.38Å; E714-N718 PolarHBondContact O-N 3.07Å; E714-V760 HydrophobicContact CG-CG1 4.38Å; E714-K764 WeakPolarHBondContact OE1-CE 3.36Å; E714-K764 IonicContact OE1-NZ 2.76Å; E714-K764 PolarHBondContact OE1-NZ 3.22Å; E714-K764 WeakPolarHBondContact OE2-CE 3.33Å; E714-K764 IonicContact OE2-NZ 3.22Å; E714-K764 PolarHBondContact OE2-NZ 3.17Å
715	Y	83.9	Confident	84.4	Confident	133 Å²	133	71.6 Å²	71.6	52%	0.522	33%	0.327	S	S	.	.	H	α-helix	trans	-62.1	-48.7	172.1	179.3	-97.4	0	0	0	112.6	E711 I713 R719	E711-Y715 VanDerWaalsContact O-CB 3.3Å; E711-Y715 WeakPolarHBondContact O-CB 3.37Å; E711-Y715 PolarHBondContact O-N 3.09Å; I713-Y715 PolarHBondContact O-N 3.08Å; Y715-R719 WeakPolarHBondContact O-CB 3.36Å; Y715-R719 PolarHBondContact O-N 3.16Å
716	Y	81.9	Confident	83.9	Confident	107 Å²	107	75.9 Å²	75.9	42%	0.42	34%	0.339	S	S	.	.	H	α-helix	trans	-66.6	-51.1	177.8	-71	-66.4	0	0	0	111.6	K712 I713 N718 R719 E720	K712-Y716 HydrophobicContact CD-CE2 4.36Å; K712-Y716 HydrophobicContact CG-CD2 4.17Å; K712-Y716 HydrophobicContact CG-CE2 3.72Å; K712-Y716 WeakPolarHBondContact O-CD2 3.37Å; K712-Y716 PolarHBondContact O-N 3.08Å; I713-Y716 PolarHBondContact O-N 3.1Å; I713-Y716 VanDerWaalsContact O-N 3.15Å; Y716-N718 PolarHBondContact O-N 2.75Å; Y716-N718 VanDerWaalsContact O-N 3.16Å; Y716-R719 PolarHBondContact O-N 2.98Å; Y716-E720 WeakPolarHBondContact O-CG 3.45Å; Y716-E720 PolarHBondContact O-N 3.25Å
717	N	81.8	Confident	83.5	Confident	27 Å²	27	77.2 Å²	77.2	14%	0.144	34%	0.343	C	S	.	.	H	α-helix	trans	-65.3	-20.8	-178.6	-62.6	58.2	0	0	0	112.8	I713 K721 D753	I713-N717 WeakPolarHBondContact CG2-OD1 3.47Å; I713-N717 PolarHBondContact O-N 3.45Å; I713-N717 PolarHBondContact O-OD1 3.48Å; N717-K721 VanDerWaalsContact O-CD 3.3Å; N717-K721 WeakPolarHBondContact O-CD 3.5Å; N717-K721 VanDerWaalsContact O-CG 3.23Å; N717-K721 WeakPolarHBondContact O-CG 3.49Å; N717-D753 PolarHBondContact ND2-OD1 2.63Å
718	N	79.6	Confident	83.2	Confident	86 Å²	86	81.6 Å²	81.6	46%	0.46	36%	0.362	S	S	.	.	H	α-helix	trans	-83.7	-33.4	170	-164.7	86.2	0	0	0	112.5	E714 Y716 Q722	E714-N718 WeakPolarHBondContact O-CB 3.38Å; E714-N718 PolarHBondContact O-N 3.07Å; Y716-N718 PolarHBondContact O-N 2.75Å; Y716-N718 VanDerWaalsContact O-N 3.16Å; N718-Q722 PolarHBondContact ND2-OE1 3.45Å; N718-Q722 WeakPolarHBondContact O-CB 3.31Å; N718-Q722 WeakPolarHBondContact O-CG 3.48Å; N718-Q722 PolarHBondContact O-N 2.75Å
719	R	79.6	Confident	82.9	Confident	147 Å²	147	84.8 Å²	84.8	56%	0.555	38%	0.379	S	S	*	.	H	α-helix	trans	-72	-38.4	176.7	-161	-175.1	79.4	140	6.9	112.3	Y715 Y716 Q722 H723	Y715-R719 WeakPolarHBondContact O-CB 3.36Å; Y715-R719 PolarHBondContact O-N 3.16Å; Y716-R719 PolarHBondContact O-N 2.98Å; R719-Q722 PolarHBondContact O-N 3.45Å; R719-H723 WeakPolarHBondContact O-CB 3.29Å; R719-H723 PolarHBondContact O-N 3.4Å
720	E	77.1	Confident	82.8	Confident	44 Å²	44	79.7 Å²	79.7	21%	0.206	36%	0.363	C	S	.	.	H	α-helix	trans	-59.6	-54.5	172.8	-69.2	177.9	162.7	0	0	109.3	Y716 Q722 H723 D724 I744 K748	Y716-E720 WeakPolarHBondContact O-CG 3.45Å; Y716-E720 PolarHBondContact O-N 3.25Å; E720-Q722 VanDerWaalsContact C-N 3.32Å; E720-Q722 PolarHBondContact O-N 3.17Å; E720-H723 WeakPolarHBondContact O-CA 3.46Å; E720-H723 WeakPolarHBondContact O-CB 3.11Å; E720-H723 PolarHBondContact O-N 3.32Å; E720-D724 VanDerWaalsContact O-CG 3.26Å; E720-D724 PolarHBondContact O-N 2.98Å; E720-I744 HydrophobicContact CG-CG2 4.2Å; E720-K748 IonicContact OE1-NZ 2.73Å; E720-K748 PolarHBondContact OE1-NZ 3.21Å; E720-K748 IonicContact OE2-NZ 3.93Å; E720-K748 PolarHBondContact OE2-NZ 2.88Å
721	K	78.1	Confident	82.7	Confident	122 Å²	122	80.1 Å²	80.1	53%	0.53	37%	0.367	S	S	.	.	H	α-helix	trans	-56.3	-37.9	174.1	-71.3	173.6	-174.2	178.3	0	115.3	N717 S725	N717-K721 VanDerWaalsContact O-CD 3.3Å; N717-K721 WeakPolarHBondContact O-CD 3.5Å; N717-K721 VanDerWaalsContact O-CG 3.23Å; N717-K721 WeakPolarHBondContact O-CG 3.49Å; K721-S725 WeakPolarHBondContact O-CB 3.35Å; K721-S725 PolarHBondContact O-N 3.13Å
722	Q	77.1	Confident	82.5	Confident	128 Å²	128	86.3 Å²	86.3	60%	0.598	40%	0.396	S	S	*	.	H	α-helix	trans	-71.6	-33.6	177.3	-80.6	-174.2	-39.6	0	0	112	N718 R719 E720 W726	N718-Q722 PolarHBondContact ND2-OE1 3.45Å; N718-Q722 WeakPolarHBondContact O-CB 3.31Å; N718-Q722 WeakPolarHBondContact O-CG 3.48Å; N718-Q722 PolarHBondContact O-N 2.75Å; R719-Q722 PolarHBondContact O-N 3.45Å; E720-Q722 VanDerWaalsContact C-N 3.32Å; E720-Q722 PolarHBondContact O-N 3.17Å; Q722-W726 VanDerWaalsContact O-CB 3.26Å; Q722-W726 WeakPolarHBondContact O-CB 3.27Å; Q722-W726 PolarHBondContact O-N 3.44Å; Q722-W726 VanDerWaalsContact O-N 3.13Å
723	H	79.8	Confident	82.5	Confident	63 Å²	63	84.3 Å²	84.3	29%	0.292	40%	0.403	S	S	.	.	H	α-helix	trans	-64.7	-53.4	170.1	-176.1	-80.9	0	0	0	110.5	R719 E720 S725 W726 F727 I744	R719-H723 WeakPolarHBondContact O-CB 3.29Å; R719-H723 PolarHBondContact O-N 3.4Å; E720-H723 WeakPolarHBondContact O-CA 3.46Å; E720-H723 WeakPolarHBondContact O-CB 3.11Å; E720-H723 PolarHBondContact O-N 3.32Å; H723-S725 PolarHBondContact O-N 3.07Å; H723-W726 PolarHBondContact O-N 3.41Å; H723-W726 VanDerWaalsContact O-N 3.13Å; H723-F727 WeakPolarHBondContact O-CB 3.39Å; H723-F727 PolarHBondContact O-N 2.88Å; H723-I744 HydrophobicContact CB-CD1 4.48Å; H723-I744 VanDerWaalsContact CE1-CD1 3.42Å; H723-I744 WeakPolarHBondContact CE1-CD1 3.25Å; H723-I744 WeakPolarHBondContact ND1-CD1 3.41Å; H723-I744 WeakPolarHBondContact ND1-CG1 3.35Å
724	D	82.1	Confident	82.6	Confident	34 Å²	34	88.4 Å²	88.4	18%	0.182	42%	0.424	C	S	.	.	H	α-helix	trans	-63.8	-39.5	-176.7	-56.4	-27.1	0	0	0	112	E720 W726 F727 K728 L743 I744	E720-D724 VanDerWaalsContact O-CG 3.26Å; E720-D724 PolarHBondContact O-N 2.98Å; D724-W726 VanDerWaalsContact C-N 3.35Å; D724-F727 PolarHBondContact O-N 2.71Å; D724-K728 WeakPolarHBondContact O-CB 3.45Å; D724-K728 WeakPolarHBondContact O-CG 3.18Å; D724-K728 PolarHBondContact O-N 2.81Å; D724-L743 HydrophobicContact CB-CD2 4.24Å; D724-I744 PolarHBondContact OD1-N 2.87Å
725	S	83.4	Confident	82.5	Confident	66 Å²	66	93.9 Å²	93.9	46%	0.462	45%	0.45	S	S	.	.	H	α-helix	trans	-65.9	-35.6	174.8	-175.5	0	0	0	0	112.7	K721 H723 Q729	K721-S725 WeakPolarHBondContact O-CB 3.35Å; K721-S725 PolarHBondContact O-N 3.13Å; H723-S725 PolarHBondContact O-N 3.07Å; S725-Q729 WeakPolarHBondContact O-CB 3.21Å; S725-Q729 VanDerWaalsContact O-CG 3.27Å; S725-Q729 WeakPolarHBondContact O-CG 3.37Å; S725-Q729 PolarHBondContact O-N 2.95Å
726	W	82.4	Confident	82.6	Confident	154 Å²	154	91.7 Å²	91.7	58%	0.583	45%	0.45	S	S	*	.	H	α-helix	trans	-73.8	-40.2	175.2	172.1	73.1	0	0	0	111.3	Q722 H723 D724 Q729 A730	Q722-W726 VanDerWaalsContact O-CB 3.26Å; Q722-W726 WeakPolarHBondContact O-CB 3.27Å; Q722-W726 PolarHBondContact O-N 3.44Å; Q722-W726 VanDerWaalsContact O-N 3.13Å; H723-W726 PolarHBondContact O-N 3.41Å; H723-W726 VanDerWaalsContact O-N 3.13Å; D724-W726 VanDerWaalsContact C-N 3.35Å; W726-Q729 PolarHBondContact O-N 2.95Å; W726-A730 VanDerWaalsContact O-CB 3.29Å; W726-A730 WeakPolarHBondContact O-CB 3.41Å; W726-A730 PolarHBondContact O-N 3.47Å
727	F	80.3	Confident	82.1	Confident	58 Å²	58	94.4 Å²	94.4	25%	0.254	47%	0.472	S	S	.	.	H	α-helix	trans	-64.9	-43.4	179.5	-153.1	-105.3	0	0	0	111.3	H723 D724 A730 A731 L738 L742 L743	H723-F727 WeakPolarHBondContact O-CB 3.39Å; H723-F727 PolarHBondContact O-N 2.88Å; D724-F727 PolarHBondContact O-N 2.71Å; F727-A730 PolarHBondContact O-N 3.28Å; F727-A731 PolarHBondContact O-N 2.97Å; F727-L738 HydrophobicContact CD1-CD1 4.05Å; F727-L738 HydrophobicContact CD1-CD2 3.8Å; F727-L738 HydrophobicContact CE1-CD2 3.52Å; F727-L742 HydrophobicContact CE1-CB 3.84Å; F727-L742 HydrophobicContact CE1-CD1 4.45Å; F727-L742 HydrophobicContact CZ-CB 4.46Å; F727-L743 HydrophobicContact CD1-CD2 4.24Å
728	K	84.1	Confident	81.6	Confident	91 Å²	91	95.4 Å²	95.4	40%	0.396	48%	0.477	S	S	.	.	H	α-helix	trans	-63.2	-44	173.7	-67.7	-163.1	-179.8	-136	0	112.1	D724 A730 A731 E732 L738 D740 L743	D724-K728 WeakPolarHBondContact O-CB 3.45Å; D724-K728 WeakPolarHBondContact O-CG 3.18Å; D724-K728 PolarHBondContact O-N 2.81Å; K728-A730 VanDerWaalsContact C-N 3.34Å; K728-A730 PolarHBondContact O-N 2.87Å; K728-A731 PolarHBondContact O-N 3.48Å; K728-E732 WeakPolarHBondContact O-CB 3.4Å; K728-E732 PolarHBondContact O-N 3.07Å; K728-L738 HydrophobicContact CB-CD1 4.34Å; K728-L738 HydrophobicContact CG-CD1 3.85Å; K728-D740 IonicContact NZ-OD1 3.1Å; K728-D740 PolarHBondContact NZ-OD1 3.22Å; K728-L743 HydrophobicContact CG-CD2 4.19Å
729	Q	85.3	Confident	81.4	Confident	118 Å²	118	97 Å²	97	55%	0.551	49%	0.486	S	S	*	.	H	α-helix	trans	-64	-35.3	174.2	-76	176.6	-21.6	0	0	113.5	S725 W726 A733	S725-Q729 WeakPolarHBondContact O-CB 3.21Å; S725-Q729 VanDerWaalsContact O-CG 3.27Å; S725-Q729 WeakPolarHBondContact O-CG 3.37Å; S725-Q729 PolarHBondContact O-N 2.95Å; W726-Q729 PolarHBondContact O-N 2.95Å; Q729-A733 VanDerWaalsContact O-CB 3.24Å; Q729-A733 WeakPolarHBondContact O-CB 3.45Å; Q729-A733 PolarHBondContact O-N 3Å
730	A	85.9	Confident	80.7	Confident	32 Å²	32	94.6 Å²	94.6	26%	0.264	48%	0.483	S	S	.	.	H	α-helix	trans	-70.7	-37.8	179.3	0	0	0	0	0	112.3	W726 F727 K728 L734	W726-A730 VanDerWaalsContact O-CB 3.29Å; W726-A730 WeakPolarHBondContact O-CB 3.41Å; W726-A730 PolarHBondContact O-N 3.47Å; F727-A730 PolarHBondContact O-N 3.28Å; K728-A730 VanDerWaalsContact C-N 3.34Å; K728-A730 PolarHBondContact O-N 2.87Å; A730-L734 WeakPolarHBondContact O-CD1 3.44Å; A730-L734 VanDerWaalsContact O-CG 3.26Å; A730-L734 WeakPolarHBondContact O-CG 3.48Å; A730-L734 PolarHBondContact O-N 3.16Å
731	A	86.6	Confident	80.2	Confident	9 Å²	9	99.3 Å²	99.3	7%	0.074	51%	0.51	C	S	.	.	H	α-helix	trans	-77.8	-37.4	176.6	0	0	0	0	0	112.7	F727 K728 A733 L734 E735 V736 L738	F727-A731 PolarHBondContact O-N 2.97Å; K728-A731 PolarHBondContact O-N 3.48Å; A731-A733 VanDerWaalsContact C-N 3.29Å; A731-A733 PolarHBondContact O-N 3.25Å; A731-L734 CarbonylContact O-C 3.57Å; A731-L734 PolarHBondContact O-N 2.8Å; A731-E735 PolarHBondContact O-N 3.28Å; A731-V736 HydrophobicContact CB-CB 4.47Å; A731-V736 PolarHBondContact O-N 3.07Å; A731-L738 HydrophobicContact CB-CD1 3.52Å; A731-L738 HydrophobicContact CB-CD2 3.76Å; A731-L738 HydrophobicContact CB-CG 3.39Å
732	E	85.6	Confident	79.7	Confident	152 Å²	152	98.2 Å²	98.2	71%	0.71	51%	0.51	S	S	*	.	H	α-helix	trans	-56.3	-43.4	169.8	-177.4	178.4	-166.6	0	0	110.9	K728 L734 E735	K728-E732 WeakPolarHBondContact O-CB 3.4Å; K728-E732 PolarHBondContact O-N 3.07Å; E732-L734 PolarHBondContact O-N 3.17Å; E732-E735 PolarHBondContact O-N 3.48Å
733	A	88.4	Confident	79.1	Confident	83 Å²	83	93.2 Å²	93.2	69%	0.686	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-1.8	175.3	0	0	0	0	0	115.2	Q729 A731	Q729-A733 VanDerWaalsContact O-CB 3.24Å; Q729-A733 WeakPolarHBondContact O-CB 3.45Å; Q729-A733 PolarHBondContact O-N 3Å; A731-A733 VanDerWaalsContact C-N 3.29Å; A731-A733 PolarHBondContact O-N 3.25Å
734	L	87.1	Confident	78.3	Confident	129 Å²	129	93.8 Å²	93.8	68%	0.675	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	1.2	174.1	-70.4	171.6	0	0	0	112.4	A730 A731 E732 V736	A730-L734 WeakPolarHBondContact O-CD1 3.44Å; A730-L734 VanDerWaalsContact O-CG 3.26Å; A730-L734 WeakPolarHBondContact O-CG 3.48Å; A730-L734 PolarHBondContact O-N 3.16Å; A731-L734 CarbonylContact O-C 3.57Å; A731-L734 PolarHBondContact O-N 2.8Å; E732-L734 PolarHBondContact O-N 3.17Å; L734-V736 HydrophobicContact CB-CG2 3.95Å; L734-V736 PolarHBondContact O-N 2.98Å
735	E	82.7	Confident	77.1	Confident	189 Å²	189	93.5 Å²	93.5	88%	0.883	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	33.6	-173.3	-57.8	-175.8	172.2	0	0	113.4	A731 E732	A731-E735 PolarHBondContact O-N 3.28Å; E732-E735 PolarHBondContact O-N 3.48Å
736	V	85.1	Confident	75.6	Confident	87 Å²	87	93 Å²	93	53%	0.527	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-100	123	179.1	176	0	0	0	0	110.5	A731 L734 L738	A731-V736 HydrophobicContact CB-CB 4.47Å; A731-V736 PolarHBondContact O-N 3.07Å; L734-V736 HydrophobicContact CB-CG2 3.95Å; L734-V736 PolarHBondContact O-N 2.98Å; V736-L738 PolarHBondContact O-N 2.97Å
737	D	72.9	Confident	74	Confident	164 Å²	164	90.4 Å²	90.4	88%	0.877	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-60.2	128.3	169.4	-77.1	-45.5	0	0	0	111
738	L	70.9	Confident	72.7	Confident	47 Å²	47	91.5 Å²	91.5	25%	0.246	51%	0.509	C	S	.	.	P	Polyproline II helix	trans	-98.2	116.2	177.1	-80.1	177.8	0	0	0	111.9	F727 K728 A731 V736 D740 L742	F727-L738 HydrophobicContact CD1-CD1 4.05Å; F727-L738 HydrophobicContact CD1-CD2 3.8Å; F727-L738 HydrophobicContact CE1-CD2 3.52Å; K728-L738 HydrophobicContact CB-CD1 4.34Å; K728-L738 HydrophobicContact CG-CD1 3.85Å; A731-L738 HydrophobicContact CB-CD1 3.52Å; A731-L738 HydrophobicContact CB-CD2 3.76Å; A731-L738 HydrophobicContact CB-CG 3.39Å; V736-L738 PolarHBondContact O-N 2.97Å; L738-D740 PolarHBondContact O-N 2.88Å; L738-L742 HydrophobicContact CD2-CD1 4.27Å
739	D	74.8	Confident	71.4	Confident	121 Å²	121	92.7 Å²	92.7	65%	0.647	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-58.8	122.7	156.6	-67.3	-43.7	0	0	0	109.5	D741 L742	D739-D741 PolarHBondContact O-N 3.27Å; D739-L742 HydrophobicContact CB-CD1 4.38Å; D739-L742 HydrophobicContact CB-CG 4.4Å; D739-L742 WeakPolarHBondContact O-CB 3.21Å; D739-L742 PolarHBondContact O-N 3.14Å
740	D	65.7	Low	70.2	Confident	95 Å²	95	95.3 Å²	95.3	51%	0.508	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-60.6	-19.3	178.5	-87.5	-41.3	0	0	0	112.3	K728 L738 L742 L743 S746	K728-D740 IonicContact NZ-OD1 3.1Å; K728-D740 PolarHBondContact NZ-OD1 3.22Å; L738-D740 PolarHBondContact O-N 2.88Å; D740-L742 PolarHBondContact O-N 2.92Å; D740-L743 HydrophobicContact CB-CD1 4.28Å; D740-L743 WeakPolarHBondContact O-CB 3.46Å; D740-L743 WeakPolarHBondContact O-CG 3.29Å; D740-L743 PolarHBondContact O-N 2.9Å; D740-L743 WeakPolarHBondContact OD1-CD1 3.32Å; D740-S746 WeakPolarHBondContact O-CB 3.19Å; D740-S746 PolarHBondContact O-OG 2.91Å
741	D	66.8	Low	69	Low	144 Å²	144	100.8 Å²	100.8	77%	0.77	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-62.3	-17	173	-79.5	-12.9	0	0	0	113.9	D739	D739-D741 PolarHBondContact O-N 3.27Å
742	L	66.3	Low	68.1	Low	99 Å²	99	102.3 Å²	102.3	52%	0.518	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-83.1	-7.6	177.1	-64.7	171.6	0	0	0	114	F727 L738 D739 D740	F727-L742 HydrophobicContact CE1-CB 3.84Å; F727-L742 HydrophobicContact CE1-CD1 4.45Å; F727-L742 HydrophobicContact CZ-CB 4.46Å; L738-L742 HydrophobicContact CD2-CD1 4.27Å; D739-L742 HydrophobicContact CB-CD1 4.38Å; D739-L742 HydrophobicContact CB-CG 4.4Å; D739-L742 WeakPolarHBondContact O-CB 3.21Å; D739-L742 PolarHBondContact O-N 3.14Å; D740-L742 PolarHBondContact O-N 2.92Å
743	L	64.8	Low	67.3	Low	22 Å²	22	97.4 Å²	97.4	12%	0.115	54%	0.539	C	S	.	.	S	Bend	trans	-83.1	148.4	-176.6	-57.8	171	0	0	0	112.6	D724 F727 K728 D740 G745 S746	D724-L743 HydrophobicContact CB-CD2 4.24Å; F727-L743 HydrophobicContact CD1-CD2 4.24Å; K728-L743 HydrophobicContact CG-CD2 4.19Å; D740-L743 HydrophobicContact CB-CD1 4.28Å; D740-L743 WeakPolarHBondContact O-CB 3.46Å; D740-L743 WeakPolarHBondContact O-CG 3.29Å; D740-L743 PolarHBondContact O-N 2.9Å; D740-L743 WeakPolarHBondContact OD1-CD1 3.32Å; L743-G745 VanDerWaalsContact C-N 3.25Å; L743-G745 PolarHBondContact O-N 3.03Å; L743-S746 PolarHBondContact O-OG 3.28Å
744	I	62.8	Low	66.7	Low	75 Å²	75	96.2 Å²	96.2	39%	0.385	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	72.9	-176.5	-57.5	-172.3	0	0	0	110.3	E720 H723 D724	E720-I744 HydrophobicContact CG-CG2 4.2Å; H723-I744 HydrophobicContact CB-CD1 4.48Å; H723-I744 VanDerWaalsContact CE1-CD1 3.42Å; H723-I744 WeakPolarHBondContact CE1-CD1 3.25Å; H723-I744 WeakPolarHBondContact ND1-CD1 3.41Å; H723-I744 WeakPolarHBondContact ND1-CG1 3.35Å; D724-I744 PolarHBondContact OD1-N 2.87Å
745	G	57.3	Low	66.2	Low	29 Å²	29	95.7 Å²	95.7	30%	0.299	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	148.9	-5.3	172.8	0	0	0	0	0	115.7	L743 A747 K748	L743-G745 VanDerWaalsContact C-N 3.25Å; L743-G745 PolarHBondContact O-N 3.03Å; G745-A747 VanDerWaalsContact C-N 3.27Å; G745-A747 PolarHBondContact O-N 3.05Å; G745-K748 PolarHBondContact O-N 3.33Å
746	S	52.2	Low	65.9	Low	54 Å²	54	90.2 Å²	90.2	38%	0.378	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-39.3	176.9	45.5	0	0	0	0	112.4	D740 L743 K748	D740-S746 WeakPolarHBondContact O-CB 3.19Å; D740-S746 PolarHBondContact O-OG 2.91Å; L743-S746 PolarHBondContact O-OG 3.28Å; S746-K748 PolarHBondContact O-N 3.49Å
747	A	49.2	Very low	65.6	Low	100 Å²	100	90.3 Å²	90.3	83%	0.826	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	21.5	173.4	0	0	0	0	0	115.1	G745	G745-A747 VanDerWaalsContact C-N 3.27Å; G745-A747 PolarHBondContact O-N 3.05Å
748	K	52.4	Low	66.1	Low	82 Å²	82	88.6 Å²	88.6	36%	0.357	47%	0.47	S	S	.	.	S	Bend	trans	-110.5	130.9	161.5	-60.4	175	-165.1	157.3	0	107.6	E720 G745 S746 Q750	E720-K748 IonicContact OE1-NZ 2.73Å; E720-K748 PolarHBondContact OE1-NZ 3.21Å; E720-K748 IonicContact OE2-NZ 3.93Å; E720-K748 PolarHBondContact OE2-NZ 2.88Å; G745-K748 PolarHBondContact O-N 3.33Å; S746-K748 PolarHBondContact O-N 3.49Å; K748-Q750 PolarHBondContact O-N 3.49Å
749	D	57.1	Low	66.7	Low	116 Å²	116	92 Å²	92	62%	0.62	49%	0.486	S	S	*	.			trans	-55.8	134.9	-175.7	-38.1	-84.1	0	0	0	110.6	E751 T752	D749-E751 PolarHBondContact O-N 3.17Å; D749-T752 HydrophobicContact CB-CG2 4.16Å; D749-T752 PolarHBondContact O-N 2.91Å; D749-T752 PolarHBondContact O-OG1 2.79Å
750	Q	59.8	Low	67.2	Low	173 Å²	173	86.9 Å²	86.9	81%	0.808	46%	0.459	S	S	*	.	H	α-helix	trans	-55.7	-30.3	-180	-63.6	-173.3	9.1	0	0	111.5	K748 D753 T754	K748-Q750 PolarHBondContact O-N 3.49Å; Q750-D753 PolarHBondContact O-N 3.07Å; Q750-T754 WeakPolarHBondContact O-CG2 3.26Å; Q750-T754 PolarHBondContact O-N 2.83Å
751	E	60.9	Low	68.2	Low	147 Å²	147	89.5 Å²	89.5	69%	0.687	47%	0.466	S	S	*	.	H	α-helix	trans	-53.6	-52.8	169.7	-67.2	-157.1	106.1	0	0	111.9	D749 D753 T754 E755	D749-E751 PolarHBondContact O-N 3.17Å; E751-D753 VanDerWaalsContact C-N 3.31Å; E751-D753 PolarHBondContact O-N 3.49Å; E751-T754 CarbonylContact O-C 3.27Å; E751-T754 WeakPolarHBondContact O-CA 3.29Å; E751-T754 PolarHBondContact O-N 3.02Å; E751-T754 PolarHBondContact O-OG1 3.4Å; E751-E755 WeakPolarHBondContact O-CG 3.44Å; E751-E755 PolarHBondContact O-N 3.28Å
752	T	67.9	Low	69.3	Low	41 Å²	41	87.3 Å²	87.3	25%	0.252	45%	0.451	S	S	.	.	H	α-helix	trans	-59.7	-35.5	-175.5	68.4	0	0	0	0	113.5	D749 Q756	D749-T752 HydrophobicContact CB-CG2 4.16Å; D749-T752 PolarHBondContact O-N 2.91Å; D749-T752 PolarHBondContact O-OG1 2.79Å; T752-Q756 WeakPolarHBondContact O-CB 3.25Å; T752-Q756 VanDerWaalsContact O-CG 3.22Å; T752-Q756 WeakPolarHBondContact O-CG 3.43Å; T752-Q756 PolarHBondContact O-N 3.06Å; T752-Q756 PolarHBondContact O-NE2 2.94Å
753	D	69.1	Low	70.2	Confident	48 Å²	48	83.9 Å²	83.9	26%	0.257	43%	0.433	S	S	.	.	H	α-helix	trans	-77	-35.6	174.4	176.6	40.9	0	0	0	111.3	N717 Q750 E751 E755 Q756 K757	N717-D753 PolarHBondContact ND2-OD1 2.63Å; Q750-D753 PolarHBondContact O-N 3.07Å; E751-D753 VanDerWaalsContact C-N 3.31Å; E751-D753 PolarHBondContact O-N 3.49Å; D753-E755 VanDerWaalsContact C-N 3.29Å; D753-E755 PolarHBondContact O-N 2.62Å; D753-Q756 PolarHBondContact O-N 3.39Å; D753-K757 VanDerWaalsContact CG-CE 3.48Å; D753-K757 VanDerWaalsContact O-CB 3.31Å; D753-K757 WeakPolarHBondContact O-CB 3.36Å; D753-K757 WeakPolarHBondContact O-CD 3.23Å; D753-K757 WeakPolarHBondContact O-CG 3.5Å; D753-K757 PolarHBondContact O-N 2.66Å; D753-K757 WeakPolarHBondContact OD1-CE 3.16Å; D753-K757 IonicContact OD1-NZ 3.41Å; D753-K757 WeakPolarHBondContact OD2-CE 3.42Å; D753-K757 IonicContact OD2-NZ 2.81Å; D753-K757 PolarHBondContact OD2-NZ 3.06Å
754	T	74.6	Confident	71.3	Confident	58 Å²	58	86.2 Å²	86.2	36%	0.356	44%	0.442	S	S	.	.	H	α-helix	trans	-63.3	-36.4	168.9	75.9	0	0	0	0	112.1	Q750 E751 K757 K758	Q750-T754 WeakPolarHBondContact O-CG2 3.26Å; Q750-T754 PolarHBondContact O-N 2.83Å; E751-T754 CarbonylContact O-C 3.27Å; E751-T754 WeakPolarHBondContact O-CA 3.29Å; E751-T754 PolarHBondContact O-N 3.02Å; E751-T754 PolarHBondContact O-OG1 3.4Å; T754-K757 PolarHBondContact O-N 3.11Å; T754-K758 WeakPolarHBondContact O-CB 3.28Å; T754-K758 WeakPolarHBondContact O-CD 3.4Å; T754-K758 WeakPolarHBondContact O-CG 3.3Å; T754-K758 PolarHBondContact O-N 3.34Å; T754-K758 PolarHBondContact OG1-NZ 3.17Å; T754-K758 VanDerWaalsContact OG1-NZ 3.09Å
755	E	76.9	Confident	72.5	Confident	119 Å²	119	89.3 Å²	89.3	56%	0.556	45%	0.453	S	S	*	.	H	α-helix	trans	-66.1	-47.8	174.6	-71.9	-161.9	140	0	0	111.8	E751 D753 K757 K758 M759	E751-E755 WeakPolarHBondContact O-CG 3.44Å; E751-E755 PolarHBondContact O-N 3.28Å; D753-E755 VanDerWaalsContact C-N 3.29Å; D753-E755 PolarHBondContact O-N 2.62Å; E755-K757 VanDerWaalsContact C-N 3.3Å; E755-K757 PolarHBondContact O-N 3.04Å; E755-K758 CarbonylContact O-C 3.5Å; E755-K758 WeakPolarHBondContact O-CB 3.46Å; E755-K758 PolarHBondContact O-N 2.88Å; E755-K758 VanDerWaalsContact O-N 3.11Å; E755-M759 WeakPolarHBondContact O-CB 3.46Å; E755-M759 PolarHBondContact O-N 2.95Å
756	Q	76.1	Confident	73.9	Confident	73 Å²	73	91.7 Å²	91.7	34%	0.341	46%	0.459	S	S	.	.	H	α-helix	trans	-59.4	-42	173.7	-73	169.4	53.6	0	0	111.2	T752 D753 M759 V760	T752-Q756 WeakPolarHBondContact O-CB 3.25Å; T752-Q756 VanDerWaalsContact O-CG 3.22Å; T752-Q756 WeakPolarHBondContact O-CG 3.43Å; T752-Q756 PolarHBondContact O-N 3.06Å; T752-Q756 PolarHBondContact O-NE2 2.94Å; D753-Q756 PolarHBondContact O-N 3.39Å; Q756-M759 PolarHBondContact O-N 2.87Å; Q756-V760 WeakPolarHBondContact O-CB 3.16Å; Q756-V760 WeakPolarHBondContact O-CG2 3.3Å; Q756-V760 PolarHBondContact O-N 3.28Å
757	K	79.6	Confident	75.6	Confident	89 Å²	89	89.3 Å²	89.3	39%	0.387	44%	0.442	S	S	.	.	H	α-helix	trans	-62.4	-40.7	172.7	-72.2	163.2	180	163.5	0	112.6	D753 T754 E755 K761	D753-K757 VanDerWaalsContact CG-CE 3.48Å; D753-K757 VanDerWaalsContact O-CB 3.31Å; D753-K757 WeakPolarHBondContact O-CB 3.36Å; D753-K757 WeakPolarHBondContact O-CD 3.23Å; D753-K757 WeakPolarHBondContact O-CG 3.5Å; D753-K757 PolarHBondContact O-N 2.66Å; D753-K757 WeakPolarHBondContact OD1-CE 3.16Å; D753-K757 IonicContact OD1-NZ 3.41Å; D753-K757 WeakPolarHBondContact OD2-CE 3.42Å; D753-K757 IonicContact OD2-NZ 2.81Å; D753-K757 PolarHBondContact OD2-NZ 3.06Å; T754-K757 PolarHBondContact O-N 3.11Å; E755-K757 VanDerWaalsContact C-N 3.3Å; E755-K757 PolarHBondContact O-N 3.04Å; K757-K761 WeakPolarHBondContact O-CB 3.46Å; K757-K761 VanDerWaalsContact O-CG 3.25Å; K757-K761 WeakPolarHBondContact O-CG 3.46Å; K757-K761 PolarHBondContact O-N 3.24Å
758	K	83.3	Confident	77.4	Confident	129 Å²	129	92.1 Å²	92.1	56%	0.561	44%	0.435	S	S	*	.	H	α-helix	trans	-63.6	-45.7	173.6	-71.4	155.8	-172.8	157.3	0	110.4	T754 E755 K761 Q762	T754-K758 WeakPolarHBondContact O-CB 3.28Å; T754-K758 WeakPolarHBondContact O-CD 3.4Å; T754-K758 WeakPolarHBondContact O-CG 3.3Å; T754-K758 PolarHBondContact O-N 3.34Å; T754-K758 PolarHBondContact OG1-NZ 3.17Å; T754-K758 VanDerWaalsContact OG1-NZ 3.09Å; E755-K758 CarbonylContact O-C 3.5Å; E755-K758 WeakPolarHBondContact O-CB 3.46Å; E755-K758 PolarHBondContact O-N 2.88Å; E755-K758 VanDerWaalsContact O-N 3.11Å; K758-K761 WeakPolarHBondContact O-CB 3.48Å; K758-K761 PolarHBondContact O-N 3.3Å; K758-Q762 PolarHBondContact O-N 3.43Å
759	M	83.6	Confident	79.1	Confident	118 Å²	118	93.7 Å²	93.7	58%	0.581	44%	0.444	S	S	*	.	H	α-helix	trans	-65	-44.5	-179.6	-161.2	-159.4	-167	0	0	112.1	E755 Q756 Q762 M763	E755-M759 WeakPolarHBondContact O-CB 3.46Å; E755-M759 PolarHBondContact O-N 2.95Å; Q756-M759 PolarHBondContact O-N 2.87Å; M759-Q762 PolarHBondContact O-N 2.93Å; M759-M763 HydrophobicContact CG-CE 3.99Å; M759-M763 WeakPolarHBondContact O-CB 3.44Å; M759-M763 WeakPolarHBondContact O-CG 3.47Å; M759-M763 PolarHBondContact O-N 3.13Å; M759-M763 HydrophobicContact SD-CE 3.96Å
760	V	84.9	Confident	80.4	Confident	14 Å²	14	89.3 Å²	89.3	9%	0.085	42%	0.42	C	S	.	.	H	α-helix	trans	-63.7	-40.8	174.2	170.5	0	0	0	0	111.1	I710 I713 E714 Q756 Q762 M763 K764	I710-V760 HydrophobicContact CG2-CG1 4.35Å; I713-V760 HydrophobicContact CB-CG2 4.09Å; I713-V760 HydrophobicContact CD1-CG2 3.94Å; I713-V760 HydrophobicContact CG2-CG2 3.63Å; E714-V760 HydrophobicContact CG-CG1 4.38Å; Q756-V760 WeakPolarHBondContact O-CB 3.16Å; Q756-V760 WeakPolarHBondContact O-CG2 3.3Å; Q756-V760 PolarHBondContact O-N 3.28Å; V760-Q762 VanDerWaalsContact C-N 3.34Å; V760-Q762 PolarHBondContact O-N 3.35Å; V760-M763 HydrophobicContact CG2-CE 4.19Å; V760-M763 PolarHBondContact O-N 3.22Å; V760-K764 HydrophobicContact CG1-CD 4.27Å; V760-K764 HydrophobicContact CG1-CG 4.48Å; V760-K764 WeakPolarHBondContact O-CB 3.24Å; V760-K764 WeakPolarHBondContact O-CG 3.23Å; V760-K764 PolarHBondContact O-N 3.13Å
761	K	86.6	Confident	81.5	Confident	149 Å²	149	83 Å²	83	65%	0.648	39%	0.391	S	S	*	.	H	α-helix	trans	-59.6	-42.8	172.9	-77.4	171.9	-179.7	179.3	0	111.7	K757 K758 K764 K765	K757-K761 WeakPolarHBondContact O-CB 3.46Å; K757-K761 VanDerWaalsContact O-CG 3.25Å; K757-K761 WeakPolarHBondContact O-CG 3.46Å; K757-K761 PolarHBondContact O-N 3.24Å; K758-K761 WeakPolarHBondContact O-CB 3.48Å; K758-K761 PolarHBondContact O-N 3.3Å; K761-K764 PolarHBondContact O-N 2.89Å; K761-K765 WeakPolarHBondContact O-CG 3.42Å; K761-K765 PolarHBondContact O-N 3.4Å
762	Q	89.3	Confident	82.5	Confident	99 Å²	99	80.1 Å²	80.1	46%	0.463	39%	0.388	S	S	.	.	H	α-helix	trans	-69.2	-42.4	177.5	-170	66.1	1.3	0	0	112.2	K758 M759 V760 K764 K765 N766	K758-Q762 PolarHBondContact O-N 3.43Å; M759-Q762 PolarHBondContact O-N 2.93Å; V760-Q762 VanDerWaalsContact C-N 3.34Å; V760-Q762 PolarHBondContact O-N 3.35Å; Q762-K764 VanDerWaalsContact C-N 3.32Å; Q762-K764 PolarHBondContact O-N 3.46Å; Q762-K765 WeakPolarHBondContact O-CB 3.5Å; Q762-K765 PolarHBondContact O-N 2.82Å; Q762-K765 VanDerWaalsContact O-N 3.16Å; Q762-N766 PolarHBondContact O-N 3.1Å; Q762-N766 PolarHBondContact O-OD1 2.82Å
763	M	86.8	Confident	83	Confident	26 Å²	26	82.3 Å²	82.3	13%	0.128	40%	0.395	C	S	.	.	H	α-helix	trans	-60	-40.6	173	-76.6	-169.7	-72.4	0	0	111.8	L706 I710 I713 M759 V760 N766 L767	L706-M763 HydrophobicContact CD2-CB 3.82Å; L706-M763 HydrophobicContact CD2-CG 4.29Å; I710-M763 HydrophobicContact CD1-CB 4.07Å; I710-M763 HydrophobicContact CG1-CB 3.91Å; I713-M763 HydrophobicContact CD1-CE 3.68Å; M759-M763 HydrophobicContact CG-CE 3.99Å; M759-M763 WeakPolarHBondContact O-CB 3.44Å; M759-M763 WeakPolarHBondContact O-CG 3.47Å; M759-M763 PolarHBondContact O-N 3.13Å; M759-M763 HydrophobicContact SD-CE 3.96Å; V760-M763 HydrophobicContact CG2-CE 4.19Å; V760-M763 PolarHBondContact O-N 3.22Å; M763-N766 PolarHBondContact O-N 3.2Å; M763-L767 WeakPolarHBondContact O-CB 3.42Å; M763-L767 PolarHBondContact O-N 3.28Å
764	K	86.8	Confident	83.2	Confident	72 Å²	72	85.3 Å²	85.3	31%	0.313	42%	0.417	S	S	.	.	H	α-helix	trans	-64.9	-37	173.6	-78.3	-175.1	171	-172	0	113	I710 E714 V760 K761 Q762 K768	I710-K764 HydrophobicContact CD1-CG 3.86Å; I710-K764 HydrophobicContact CG1-CG 4.45Å; I710-K764 HydrophobicContact CG2-CD 4.4Å; I710-K764 HydrophobicContact CG2-CG 4.14Å; E714-K764 WeakPolarHBondContact OE1-CE 3.36Å; E714-K764 IonicContact OE1-NZ 2.76Å; E714-K764 PolarHBondContact OE1-NZ 3.22Å; E714-K764 WeakPolarHBondContact OE2-CE 3.33Å; E714-K764 IonicContact OE2-NZ 3.22Å; E714-K764 PolarHBondContact OE2-NZ 3.17Å; V760-K764 HydrophobicContact CG1-CD 4.27Å; V760-K764 HydrophobicContact CG1-CG 4.48Å; V760-K764 WeakPolarHBondContact O-CB 3.24Å; V760-K764 WeakPolarHBondContact O-CG 3.23Å; V760-K764 PolarHBondContact O-N 3.13Å; K761-K764 PolarHBondContact O-N 2.89Å; Q762-K764 VanDerWaalsContact C-N 3.32Å; Q762-K764 PolarHBondContact O-N 3.46Å; K764-K768 WeakPolarHBondContact O-CB 3.45Å; K764-K768 WeakPolarHBondContact O-CG 3.4Å; K764-K768 PolarHBondContact O-N 3.04Å
765	K	87.6	Confident	83	Confident	140 Å²	140	83.9 Å²	83.9	61%	0.609	41%	0.407	S	S	*	.	H	α-helix	trans	-62.7	-49.7	171.2	-74.6	176.8	178.5	-179.6	0	111.3	K761 Q762 L767 K768 H769	K761-K765 WeakPolarHBondContact O-CG 3.42Å; K761-K765 PolarHBondContact O-N 3.4Å; Q762-K765 WeakPolarHBondContact O-CB 3.5Å; Q762-K765 PolarHBondContact O-N 2.82Å; Q762-K765 VanDerWaalsContact O-N 3.16Å; K765-L767 VanDerWaalsContact C-N 3.32Å; K765-L767 PolarHBondContact O-N 3.38Å; K765-K768 PolarHBondContact O-N 3.17Å; K765-H769 PolarHBondContact O-N 3.44Å
766	N	87.8	Confident	82.6	Confident	79 Å²	79	80.8 Å²	80.8	42%	0.422	39%	0.392	S	S	.	.	H	α-helix	trans	-60.3	-42.2	179	-67.7	9.2	0	0	0	111.4	L706 Q762 M763 H769 L770	L706-N766 HydrophobicContact CD1-CB 4.24Å; Q762-N766 PolarHBondContact O-N 3.1Å; Q762-N766 PolarHBondContact O-OD1 2.82Å; M763-N766 PolarHBondContact O-N 3.2Å; N766-H769 PolarHBondContact O-N 3.13Å; N766-L770 WeakPolarHBondContact O-CG 3.28Å; N766-L770 PolarHBondContact O-N 3.1Å
767	L	87.1	Confident	81.5	Confident	3 Å²	3	87 Å²	87	2%	0.016	42%	0.418	C	S	.	.	H	α-helix	trans	-65.7	-42.5	176.1	-176.4	59.3	0	0	0	112.3	I584 L585 R703 L706 A707 I710 M763 K765 H769 L770 I771	I584-L767 HydrophobicContact CG2-CD2 3.49Å; I584-L767 VanDerWaalsContact CG2-CD2 3.49Å; I584-L767 WeakPolarHBondContact O-CD2 3.26Å; L585-L767 HydrophobicContact CD2-CD1 4.34Å; R703-L767 HydrophobicContact CB-CD1 4.11Å; R703-L767 HydrophobicContact CG-CD1 4.37Å; L706-L767 HydrophobicContact CB-CD1 4.47Å; L706-L767 HydrophobicContact CD1-CB 4.21Å; L706-L767 HydrophobicContact CD2-CB 4.1Å; A707-L767 HydrophobicContact CB-CD2 3.83Å; I710-L767 HydrophobicContact CD1-CB 4.32Å; I710-L767 HydrophobicContact CD1-CD2 3.86Å; M763-L767 WeakPolarHBondContact O-CB 3.42Å; M763-L767 PolarHBondContact O-N 3.28Å; K765-L767 VanDerWaalsContact C-N 3.32Å; K765-L767 PolarHBondContact O-N 3.38Å; L767-H769 VanDerWaalsContact C-N 3.33Å; L767-H769 PolarHBondContact O-N 2.95Å; L767-L770 PolarHBondContact O-N 3.17Å; L767-I771 HydrophobicContact CD1-CD1 4.12Å; L767-I771 HydrophobicContact CD1-CG1 4.17Å; L767-I771 HydrophobicContact CD2-CD1 4.41Å; L767-I771 HydrophobicContact CG-CD1 3.81Å; L767-I771 HydrophobicContact CG-CG1 4.31Å; L767-I771 WeakPolarHBondContact O-CB 3.42Å; L767-I771 VanDerWaalsContact O-CG1 3.28Å; L767-I771 WeakPolarHBondContact O-CG1 3.48Å; L767-I771 PolarHBondContact O-N 3.07Å
768	K	87.9	Confident	79.9	Confident	159 Å²	159	89.4 Å²	89.4	69%	0.691	44%	0.435	S	S	*	.	H	α-helix	trans	-61.5	-40.7	174	-78.7	-172.3	172.3	-165.1	0	112.1	K764 K765 I771 S772	K764-K768 WeakPolarHBondContact O-CB 3.45Å; K764-K768 WeakPolarHBondContact O-CG 3.4Å; K764-K768 PolarHBondContact O-N 3.04Å; K765-K768 PolarHBondContact O-N 3.17Å; K768-I771 PolarHBondContact O-N 2.73Å; K768-S772 WeakPolarHBondContact O-CB 3.3Å; K768-S772 PolarHBondContact O-N 3.37Å
769	H	87.1	Confident	78	Confident	116 Å²	116	90.4 Å²	90.4	54%	0.537	45%	0.445	S	S	.	.	H	α-helix	trans	-61	-49	173.2	-179	72.3	0	0	0	111.3	K765 N766 L767 I771 S772 Q773	K765-H769 PolarHBondContact O-N 3.44Å; N766-H769 PolarHBondContact O-N 3.13Å; L767-H769 VanDerWaalsContact C-N 3.33Å; L767-H769 PolarHBondContact O-N 2.95Å; H769-I771 PolarHBondContact O-N 3.21Å; H769-S772 PolarHBondContact O-N 3.42Å; H769-S772 PolarHBondContact O-OG 3.32Å; H769-Q773 PolarHBondContact CD2-NE2 3.49Å; H769-Q773 PolarHBondContact NE2-NE2 2.96Å; H769-Q773 PolarHBondContact O-N 3.1Å
770	L	84.4	Confident	75.7	Confident	24 Å²	24	90 Å²	90	13%	0.126	45%	0.449	C	S	.	.	H	α-helix	trans	-57.4	-50.1	174.7	-72.6	172.7	0	0	0	111.6	E702 R703 L706 N766 L767 S772 Q773	E702-L770 HydrophobicContact CG-CD1 4.23Å; R703-L770 HydrophobicContact CG-CB 3.95Å; R703-L770 HydrophobicContact CG-CD1 4.41Å; R703-L770 PolarHBondContact NE-O 3.24Å; R703-L770 PolarHBondContact NH1-O 3.33Å; R703-L770 PolarHBondContact NH2-O 3.38Å; L706-L770 HydrophobicContact CD1-CD1 3.87Å; N766-L770 WeakPolarHBondContact O-CG 3.28Å; N766-L770 PolarHBondContact O-N 3.1Å; L767-L770 PolarHBondContact O-N 3.17Å; L770-S772 VanDerWaalsContact C-N 3.26Å; L770-S772 PolarHBondContact O-N 3.44Å; L770-Q773 WeakPolarHBondContact O-CB 3.45Å; L770-Q773 PolarHBondContact O-N 3.02Å
771	I	84.1	Confident	73.7	Confident	40 Å²	40	98 Å²	98	21%	0.205	48%	0.483	C	S	.	.	H	α-helix	trans	-54.4	-43	178.5	-71.6	169.7	0	0	0	111.1	R703 L767 K768 H769 Q773	R703-I771 PolarHBondContact NH1-O 2.92Å; L767-I771 HydrophobicContact CD1-CD1 4.12Å; L767-I771 HydrophobicContact CD1-CG1 4.17Å; L767-I771 HydrophobicContact CD2-CD1 4.41Å; L767-I771 HydrophobicContact CG-CD1 3.81Å; L767-I771 HydrophobicContact CG-CG1 4.31Å; L767-I771 WeakPolarHBondContact O-CB 3.42Å; L767-I771 VanDerWaalsContact O-CG1 3.28Å; L767-I771 WeakPolarHBondContact O-CG1 3.48Å; L767-I771 PolarHBondContact O-N 3.07Å; K768-I771 PolarHBondContact O-N 2.73Å; H769-I771 PolarHBondContact O-N 3.21Å; I771-Q773 PolarHBondContact O-N 2.75Å
772	S	81.5	Confident	71.4	Confident	87 Å²	87	96.7 Å²	96.7	61%	0.608	49%	0.488	S	S	*	.	H	α-helix	trans	-62.9	-20.4	179.1	76.1	0	0	0	0	114.7	K768 H769 L770	K768-S772 WeakPolarHBondContact O-CB 3.3Å; K768-S772 PolarHBondContact O-N 3.37Å; H769-S772 PolarHBondContact O-N 3.42Å; H769-S772 PolarHBondContact O-OG 3.32Å; L770-S772 VanDerWaalsContact C-N 3.26Å; L770-S772 PolarHBondContact O-N 3.44Å
773	Q	78.9	Confident	68.8	Low	86 Å²	86	100.9 Å²	100.9	40%	0.402	50%	0.504	S	S	.	.	S	Bend	trans	-80.1	127.3	173.1	-59.2	177	7.8	0	0	110.2	R703 H769 L770 I771 I775	R703-Q773 PolarHBondContact NH1-O 2.97Å; R703-Q773 PolarHBondContact NH2-O 3.37Å; H769-Q773 PolarHBondContact CD2-NE2 3.49Å; H769-Q773 PolarHBondContact NE2-NE2 2.96Å; H769-Q773 PolarHBondContact O-N 3.1Å; L770-Q773 WeakPolarHBondContact O-CB 3.45Å; L770-Q773 PolarHBondContact O-N 3.02Å; I771-Q773 PolarHBondContact O-N 2.75Å; Q773-I775 PolarHBondContact O-N 3.36Å
774	P	72.3	Confident	66.3	Low	112 Å²	112	109.5 Å²	109.5	73%	0.727	54%	0.537	S	S	*	.			trans	-69.5	124	177.1	27.6	-33.5	0	0	0	111.2
775	I	69.9	Low	64.3	Low	28 Å²	28	112.1 Å²	112.1	14%	0.144	56%	0.561	C	S	.	*	S	Bend	trans	-70.4	-41.6	177.2	-58.1	-176.2	0	0	0	110.8	L559 C696 I700 Q773	L559-I775 HydrophobicContact CD1-CD1 3.7Å; C696-I775 HydrophobicContact CB-CG2 3.44Å; C696-I775 VanDerWaalsContact CB-CG2 3.44Å; I700-I775 HydrophobicContact CD1-CD1 4.48Å; I700-I775 HydrophobicContact CD1-CG2 4.41Å; I700-I775 HydrophobicContact CG1-CD1 3.66Å; I700-I775 HydrophobicContact CG1-CG2 4.28Å; Q773-I775 PolarHBondContact O-N 3.36Å
776	F	68.4	Low	62	Low	53 Å²	53	111.9 Å²	111.9	23%	0.232	57%	0.572	C	S	.	*	S	Bend	trans	-92.6	112.3	-174.4	-55	-66.5	0	0	0	110.4	Y556 L559 Q560 C696 N778	Y556-F776 HydrophobicContact CD2-CE1 4.38Å; Y556-F776 HydrophobicContact CD2-CZ 4.2Å; Y556-F776 HydrophobicContact CE2-CE1 4.17Å; Y556-F776 HydrophobicContact CE2-CZ 4.35Å; L559-F776 HydrophobicContact CB-CE2 3.82Å; L559-F776 HydrophobicContact CB-CZ 4.45Å; Q560-F776 HydrophobicContact CB-CE1 4.43Å; Q560-F776 HydrophobicContact CB-CE2 4.13Å; Q560-F776 HydrophobicContact CB-CZ 3.81Å; Q560-F776 HydrophobicContact CG-CZ 4.43Å; Q560-F776 VanDerWaalsContact OE1-CD1 3.22Å; Q560-F776 VanDerWaalsContact OE1-CG 3.31Å; Q560-F776 VanDerWaalsContact OE1-CZ 3.3Å; C696-F776 HydrophobicContact CB-CD1 4.44Å; C696-F776 HydrophobicContact CB-CE1 4.04Å; F776-N778 PolarHBondContact O-N 3.46Å
777	K	54.4	Low	59.7	Low	203 Å²	203	118 Å²	118	88%	0.883	60%	0.595	S	S	*	*			trans	-77.7	59.5	178.1	-66.2	-169.8	176.7	-172	0	112.1
778	N	45.4	Very low	57.2	Low	140 Å²	140	126.5 Å²	126.5	75%	0.749	64%	0.636	S	S	*	*			trans	-140.2	59.7	173.8	-97.6	-19.5	0	0	0	112	F776	F776-N778 PolarHBondContact O-N 3.46Å
779	L	43.5	Very low	54.9	Low	150 Å²	150	123.1 Å²	123.1	79%	0.785	65%	0.647	S	S	*	*			trans	-129	76.9	158.3	-107	168.3	0	0	0	107.4	K781	L779-K781 PolarHBondContact O-N 3.25Å
780	V	34.1	Very low	52.3	Low	109 Å²	109	127.4 Å²	127.4	66%	0.661	66%	0.664	S	S	*	*			trans	-76.3	74.1	-176.5	-172.2	0	0	0	0	109.9	T782	V780-T782 HydrophobicContact CG1-CG2 3.9Å; V780-T782 PolarHBondContact O-N 3.26Å; V780-T782 VanDerWaalsContact O-N 3.13Å
781	K	44.3	Very low	49.9	Very low	184 Å²	184	134.1 Å²	134.1	80%	0.8	70%	0.699	S	S	*	*			trans	-79.1	70	161.7	-73.6	-171.4	174.8	-176.5	0	109.3	L779 K783	L779-K781 PolarHBondContact O-N 3.25Å; K781-K783 PolarHBondContact O-N 3.27Å
782	T	37.4	Very low	47.3	Very low	121 Å²	121	137 Å²	137	74%	0.742	73%	0.729	S	S	*	*			trans	-66.4	125.5	164.1	32.4	0	0	0	0	108.6	V780	V780-T782 HydrophobicContact CG1-CG2 3.9Å; V780-T782 PolarHBondContact O-N 3.26Å; V780-T782 VanDerWaalsContact O-N 3.13Å
783	K	35.5	Very low	45.3	Very low	187 Å²	187	140.5 Å²	140.5	81%	0.813	74%	0.74	S	S	*	*			trans	-115	32.3	-160.7	-156	-170.6	177.5	-168.7	0	112.5	K781	K781-K783 PolarHBondContact O-N 3.27Å
784	Y	34.6	Very low	42.8	Very low	207 Å²	207	140.4 Å²	140.4	81%	0.812	75%	0.753	S	S	*	*			trans	-135.3	127.1	-171.5	-66.3	-67.7	0	0	0	111.9
785	P	45.1	Very low	41	Very low	127 Å²	127	143.4 Å²	143.4	83%	0.825	76%	0.763	S	S	*	*			trans	-88.4	117.3	171.6	33.1	-29.7	0	0	0	110.6
786	T	38.3	Very low	38.9	Very low	134 Å²	134	150 Å²	150	82%	0.822	80%	0.795	S	S	*	*			trans	-94.6	133	175.1	39.1	0	0	0	0	112	M788	T786-M788 PolarHBondContact O-N 2.77Å
787	K	39.3	Very low	37	Very low	209 Å²	209	152.8 Å²	152.8	91%	0.909	82%	0.819	S	S	*	*	S	Bend	trans	-78	75.6	-173.6	-62.9	177.5	177.7	179.4	0	113.2
788	M	34.6	Very low	35.9	Very low	181 Å²	181	150 Å²	150	89%	0.892	82%	0.819	S	S	*	*			trans	-157.2	104.9	150	-78.9	-145.1	89.6	0	0	110.1	T786 K790	T786-M788 PolarHBondContact O-N 2.77Å; M788-K790 PolarHBondContact O-N 3.41Å
789	G	40.9	Very low	35.8	Very low	88 Å²	88	148.7 Å²	148.7	91%	0.907	83%	0.827	S	S	*	*			trans	-81.5	96.6	179.4	0	0	0	0	0	112.8
790	K	30.7	Very low	35.3	Very low	206 Å²	206	144.1 Å²	144.1	90%	0.896	82%	0.816	S	S	*	*			trans	-155.3	113.7	157.1	-113.1	167.2	-174.5	177.7	0	111	M788 A792	M788-K790 PolarHBondContact O-N 3.41Å; K790-A792 PolarHBondContact O-N 3.26Å
791	L	35.4	Very low	35.7	Very low	164 Å²	164	146.6 Å²	146.6	86%	0.859	82%	0.823	S	S	*	*			trans	-80.6	111.2	175.3	-90.3	158	0	0	0	110.1
792	A	28	Very low	35.8	Very low	101 Å²	101	143 Å²	143	84%	0.835	81%	0.809	S	S	*	*			trans	-94.2	89.8	162.4	0	0	0	0	0	108.9	K790 A794	K790-A792 PolarHBondContact O-N 3.26Å; A792-A794 PolarHBondContact O-N 3.1Å
793	L	39.4	Very low	36.8	Very low	161 Å²	161	139.6 Å²	139.6	84%	0.843	79%	0.79	S	S	*	*			trans	-79	109.9	173.9	-89.4	168.5	0	0	0	110.3
794	A	28.1	Very low	38.1	Very low	83 Å²	83	130.8 Å²	130.8	69%	0.686	75%	0.752	S	S	*	*			trans	-138.5	103.3	168.3	0	0	0	0	0	110	A792 M796	A792-A794 PolarHBondContact O-N 3.1Å; A794-M796 PolarHBondContact O-N 2.99Å
795	N	33.3	Very low	39.1	Very low	175 Å²	175	122.3 Å²	122.3	94%	0.936	72%	0.721	S	S	*	*			trans	27.1	70.5	164.3	-67.1	-11.9	0	0	0	117.7
796	M	26.2	Very low	39.6	Very low	166 Å²	166	119.6 Å²	119.6	82%	0.818	70%	0.702	S	S	*	*			trans	-110.7	125.5	159.8	-82.3	-73.3	-77.4	0	0	109.4	A794	A794-M796 PolarHBondContact O-N 2.99Å
797	P	28.8	Very low	40.5	Very low	112 Å²	112	115.6 Å²	115.6	73%	0.727	67%	0.672	S	S	*	*			trans	-66.2	137.4	175.3	28.2	-33.5	0	0	0	110	A799	P797-A799 PolarHBondContact O-N 2.92Å
798	V	30.4	Very low	41.4	Very low	145 Å²	145	106.3 Å²	106.3	88%	0.879	63%	0.632	S	S	*	*			trans	-62.7	109.6	-178.6	178.7	0	0	0	0	109.8	G800	V798-G800 VanDerWaalsContact C-N 3.27Å; V798-G800 PolarHBondContact O-N 2.89Å
799	A	43	Very low	42.4	Very low	112 Å²	112	100.4 Å²	100.4	93%	0.926	61%	0.608	S	S	*	*			trans	-77.5	71.3	-176.7	0	0	0	0	0	112.1	P797	P797-A799 PolarHBondContact O-N 2.92Å
800	G	34.8	Very low	42.8	Very low	54 Å²	54	97.6 Å²	97.6	56%	0.557	58%	0.579	S	S	*	*	S	Bend	trans	-135	114.3	176.3	0	0	0	0	0	111.9	V798	V798-G800 VanDerWaalsContact C-N 3.27Å; V798-G800 PolarHBondContact O-N 2.89Å
801	M	41.7	Very low	43.7	Very low	161 Å²	161	91.6 Å²	91.6	79%	0.793	55%	0.554	S	S	*	*			trans	44.6	76.6	171.9	-58.2	-174.6	91.1	0	0	115.4	P562 S803	P562-M801 HydrophobicContact CG-CE 3.89Å; M801-S803 PolarHBondContact O-N 3.28Å
802	E	47.4	Very low	44.3	Very low	108 Å²	108	90.4 Å²	90.4	51%	0.505	54%	0.542	S	S	.	.			trans	-56.5	128.8	167.7	-60.7	177.3	118.5	0	0	111.1	R807	E802-R807 HydrophobicContact CB-CG 3.99Å; E802-R807 WeakPolarHBondContact OE2-CG 3.48Å; E802-R807 IonicContact OE2-CZ 3.12Å; E802-R807 IonicContact OE2-NE 3.29Å; E802-R807 PolarHBondContact OE2-NE 3.49Å; E802-R807 IonicContact OE2-NH2 3.84Å; E802-R807 PolarHBondContact OE2-NH2 3.41Å
803	S	58	Low	45	Very low	51 Å²	51	92.9 Å²	92.9	36%	0.357	53%	0.534	S	S	.	.			trans	-61.7	150.9	167.7	173.9	0	0	0	0	110.3	M801 L805 T806 R807	M801-S803 PolarHBondContact O-N 3.28Å; S803-L805 PolarHBondContact O-N 2.97Å; S803-L805 VanDerWaalsContact O-N 3.16Å; S803-L805 PolarHBondContact OG-N 3.17Å; S803-T806 WeakPolarHBondContact CB-OG1 3.46Å; S803-T806 WeakPolarHBondContact O-CA 3.41Å; S803-T806 VanDerWaalsContact O-CB 3.3Å; S803-T806 WeakPolarHBondContact O-CB 3.32Å; S803-T806 PolarHBondContact O-N 3.32Å; S803-R807 PolarHBondContact O-N 3.46Å; S803-R807 VanDerWaalsContact O-N 3.14Å
804	A	62.4	Low	45	Very low	1 Å²	1	90.4 Å²	90.4	1%	0.008	52%	0.521	C	S	.	.	H	α-helix	trans	-54.2	-35.2	173.7	0	0	0	0	0	111.6	Y561 L661 R807 I808	Y561-A804 HydrophobicContact CD1-CB 3.69Å; Y561-A804 HydrophobicContact CD2-CB 4.33Å; Y561-A804 HydrophobicContact CE1-CB 3.85Å; Y561-A804 HydrophobicContact CE2-CB 4.48Å; Y561-A804 HydrophobicContact CG-CB 3.94Å; L661-A804 HydrophobicContact CD2-CB 3.43Å; L661-A804 VanDerWaalsContact CD2-CB 3.43Å; A804-R807 PolarHBondContact O-N 2.98Å; A804-I808 WeakPolarHBondContact O-CD1 3.39Å; A804-I808 VanDerWaalsContact O-CG1 3.31Å; A804-I808 WeakPolarHBondContact O-CG1 3.4Å; A804-I808 PolarHBondContact O-N 3.44Å; A804-I808 VanDerWaalsContact O-N 3.09Å
805	L	55.5	Low	45.7	Very low	30 Å²	30	93.6 Å²	93.6	16%	0.157	52%	0.52	C	S	.	.	H	α-helix	trans	-64.2	-40.4	175.2	-57.9	169.4	0	0	0	112.2	T539 E659 L661 S803 R807 I808 S809	T539-L805 HydrophobicContact CG2-CD2 3.84Å; T539-L805 WeakPolarHBondContact OG1-CD2 3.43Å; E659-L805 HydrophobicContact CB-CD1 3.69Å; L661-L805 HydrophobicContact CB-CD2 4.1Å; S803-L805 PolarHBondContact O-N 2.97Å; S803-L805 VanDerWaalsContact O-N 3.16Å; S803-L805 PolarHBondContact OG-N 3.17Å; L805-R807 VanDerWaalsContact C-N 3.34Å; L805-R807 PolarHBondContact O-N 2.87Å; L805-I808 PolarHBondContact O-N 2.72Å; L805-S809 WeakPolarHBondContact O-CB 3.28Å; L805-S809 PolarHBondContact O-N 2.7Å; L805-S809 PolarHBondContact O-OG 3.01Å
806	T	56.3	Low	46.1	Very low	70 Å²	70	95.2 Å²	95.2	43%	0.429	51%	0.513	S	S	.	.	H	α-helix	trans	-63.4	-39.7	175.8	-46.3	0	0	0	0	111.3	S803 S809 G810	S803-T806 WeakPolarHBondContact CB-OG1 3.46Å; S803-T806 WeakPolarHBondContact O-CA 3.41Å; S803-T806 VanDerWaalsContact O-CB 3.3Å; S803-T806 WeakPolarHBondContact O-CB 3.32Å; S803-T806 PolarHBondContact O-N 3.32Å; T806-S809 WeakPolarHBondContact CA-OG 3.46Å; T806-S809 PolarHBondContact O-OG 3.26Å; T806-S809 VanDerWaalsContact O-OG 3.04Å; T806-G810 PolarHBondContact O-N 2.87Å
807	R	57.3	Low	46.6	Very low	50 Å²	50	94.8 Å²	94.8	19%	0.189	50%	0.503	C	S	.	.	H	α-helix	trans	-69.4	-40.7	177.4	-74.7	177.1	157.7	-147.6	-15.1	113.1	Q560 Y561 E693 E802 S803 A804 L805 G810 Q811	Q560-R807 VanDerWaalsContact NE2-NH1 3.14Å; Y561-R807 WeakPolarHBondContact OH-CD 3.49Å; Y561-R807 PolarHBondContact OH-NH1 3.3Å; Y561-R807 VanDerWaalsContact OH-NH1 3.13Å; E693-R807 IonicContact OE1-CZ 3.23Å; E693-R807 VanDerWaalsContact OE1-CZ 3.22Å; E693-R807 IonicContact OE1-NH1 2.7Å; E693-R807 PolarHBondContact OE1-NH1 3.16Å; E693-R807 IonicContact OE1-NH2 3.5Å; E693-R807 PolarHBondContact OE1-NH2 2.96Å; E802-R807 HydrophobicContact CB-CG 3.99Å; E802-R807 WeakPolarHBondContact OE2-CG 3.48Å; E802-R807 IonicContact OE2-CZ 3.12Å; E802-R807 IonicContact OE2-NE 3.29Å; E802-R807 PolarHBondContact OE2-NE 3.49Å; E802-R807 IonicContact OE2-NH2 3.84Å; E802-R807 PolarHBondContact OE2-NH2 3.41Å; S803-R807 PolarHBondContact O-N 3.46Å; S803-R807 VanDerWaalsContact O-N 3.14Å; A804-R807 PolarHBondContact O-N 2.98Å; L805-R807 VanDerWaalsContact C-N 3.34Å; L805-R807 PolarHBondContact O-N 2.87Å; R807-G810 PolarHBondContact O-N 2.9Å; R807-Q811 PolarHBondContact O-N 3.25Å
808	I	57.4	Low	47.1	Very low	14 Å²	14	95.3 Å²	95.3	7%	0.072	49%	0.494	C	S	.	.	H	α-helix	trans	-64.7	-45.2	175.9	-66.3	160.8	0	0	0	110.8	T541 L661 F690 A804 L805 Q811 K812	T541-I808 HydrophobicContact CG2-CD1 3.66Å; T541-I808 HydrophobicContact CG2-CG1 4.13Å; L661-I808 HydrophobicContact CD1-CD1 3.54Å; L661-I808 HydrophobicContact CD2-CD1 4.12Å; L661-I808 HydrophobicContact CG-CD1 4.48Å; F690-I808 HydrophobicContact CD2-CD1 4.31Å; F690-I808 HydrophobicContact CE2-CD1 4.1Å; F690-I808 HydrophobicContact CE2-CG1 4.39Å; A804-I808 WeakPolarHBondContact O-CD1 3.39Å; A804-I808 VanDerWaalsContact O-CG1 3.31Å; A804-I808 WeakPolarHBondContact O-CG1 3.4Å; A804-I808 PolarHBondContact O-N 3.44Å; A804-I808 VanDerWaalsContact O-N 3.09Å; L805-I808 PolarHBondContact O-N 2.72Å; I808-Q811 PolarHBondContact O-N 3.25Å; I808-K812 PolarHBondContact O-N 3.19Å; I808-K812 VanDerWaalsContact O-N 3.09Å
809	S	55.8	Low	47.6	Very low	57 Å²	57	91.8 Å²	91.8	40%	0.399	47%	0.474	S	S	.	.	H	α-helix	trans	-68.9	-34.7	177.4	55.8	0	0	0	0	112.9	L805 T806 Q811 K812 K813	L805-S809 WeakPolarHBondContact O-CB 3.28Å; L805-S809 PolarHBondContact O-N 2.7Å; L805-S809 PolarHBondContact O-OG 3.01Å; T806-S809 WeakPolarHBondContact CA-OG 3.46Å; T806-S809 PolarHBondContact O-OG 3.26Å; T806-S809 VanDerWaalsContact O-OG 3.04Å; S809-Q811 PolarHBondContact O-N 3.2Å; S809-K812 PolarHBondContact O-N 3.1Å; S809-K813 PolarHBondContact O-N 3.07Å
810	G	48.8	Very low	47.7	Very low	29 Å²	29	92.3 Å²	92.3	30%	0.299	46%	0.458	S	S	.	.	H	α-helix	trans	-57.4	-44.1	169	0	0	0	0	0	112.8	T806 R807 K813 L814	T806-G810 PolarHBondContact O-N 2.87Å; R807-G810 PolarHBondContact O-N 2.9Å; G810-K813 PolarHBondContact O-N 3.21Å; G810-L814 PolarHBondContact O-N 3.1Å
811	Q	50.8	Low	48.1	Very low	79 Å²	79	95.2 Å²	95.2	37%	0.369	46%	0.457	S	S	.	.	H	α-helix	trans	-65.7	-36.7	173.3	-81.7	-160.2	-31.3	0	0	113.6	R807 I808 S809 K813 L814 K815	R807-Q811 PolarHBondContact O-N 3.25Å; I808-Q811 PolarHBondContact O-N 3.25Å; S809-Q811 PolarHBondContact O-N 3.2Å; Q811-K813 VanDerWaalsContact C-N 3.29Å; Q811-K813 PolarHBondContact O-N 2.99Å; Q811-L814 PolarHBondContact O-N 3.11Å; Q811-K815 PolarHBondContact O-N 2.94Å
812	K	47.8	Very low	48.2	Very low	140 Å²	140	93.1 Å²	93.1	61%	0.609	45%	0.445	S	S	*	.	H	α-helix	trans	-61.1	-37.3	172.9	-72.4	-171.2	177.9	-176	0	111.7	I808 S809 R816	I808-K812 PolarHBondContact O-N 3.19Å; I808-K812 VanDerWaalsContact O-N 3.09Å; S809-K812 PolarHBondContact O-N 3.1Å; K812-R816 PolarHBondContact O-N 2.81Å
813	K	42.3	Very low	48.1	Very low	153 Å²	153	95.2 Å²	95.2	67%	0.665	45%	0.452	S	S	*	.	H	α-helix	trans	-66.9	-48.4	172.8	-69.4	-179.6	179.2	179.1	0	112	S809 G810 Q811 K815 R816 Y817	S809-K813 PolarHBondContact O-N 3.07Å; G810-K813 PolarHBondContact O-N 3.21Å; Q811-K813 VanDerWaalsContact C-N 3.29Å; Q811-K813 PolarHBondContact O-N 2.99Å; K813-K815 PolarHBondContact O-N 3.25Å; K813-R816 PolarHBondContact O-N 2.7Å; K813-R816 VanDerWaalsContact O-N 3.11Å; K813-Y817 PolarHBondContact O-N 3.44Å
814	L	40	Very low	47.7	Very low	108 Å²	108	99 Å²	99	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-57.9	-46	176.8	-88.8	154.4	0	0	0	112.8	G810 Q811 R816 Y817 F818	G810-L814 PolarHBondContact O-N 3.1Å; Q811-L814 PolarHBondContact O-N 3.11Å; L814-R816 PolarHBondContact O-N 3.23Å; L814-Y817 PolarHBondContact O-N 2.89Å; L814-Y817 VanDerWaalsContact O-N 3.07Å; L814-F818 WeakPolarHBondContact O-CD2 3.33Å; L814-F818 PolarHBondContact O-N 2.98Å
815	K	42.5	Very low	46.9	Very low	151 Å²	151	105.2 Å²	105.2	66%	0.657	49%	0.493	S	S	*	.	H	α-helix	trans	-60.3	-29.9	176.1	-78	-170.6	176.5	-175	0	113.1	Q811 K813 P819	Q811-K815 PolarHBondContact O-N 2.94Å; K813-K815 PolarHBondContact O-N 3.25Å; K815-P819 WeakPolarHBondContact O-CD 3.49Å
816	R	40.4	Very low	46.6	Very low	208 Å²	208	110.9 Å²	110.9	79%	0.785	52%	0.517	S	S	*	.	H	α-helix	trans	-74	-25.6	174.2	-79.7	-176.3	170	-177.8	-2.8	114	K812 K813 L814 P819	K812-R816 PolarHBondContact O-N 2.81Å; K813-R816 PolarHBondContact O-N 2.7Å; K813-R816 VanDerWaalsContact O-N 3.11Å; L814-R816 PolarHBondContact O-N 3.23Å; R816-P819 WeakPolarHBondContact O-CD 3.47Å; R816-P819 WeakPolarHBondContact O-CG 3.23Å
817	Y	36.6	Very low	46.3	Very low	157 Å²	157	113.6 Å²	113.6	62%	0.616	53%	0.525	S	S	*	.	H	α-helix	trans	-79.9	-35.4	178.4	-94.4	-91.1	0	0	0	114.1	K813 L814 Q820 Q821	K813-Y817 PolarHBondContact O-N 3.44Å; L814-Y817 PolarHBondContact O-N 2.89Å; L814-Y817 VanDerWaalsContact O-N 3.07Å; Y817-Q820 PolarHBondContact O-N 2.92Å; Y817-Q820 VanDerWaalsContact O-N 3.13Å; Y817-Q821 PolarHBondContact O-N 2.91Å
818	F	40.8	Very low	45.9	Very low	123 Å²	123	120.7 Å²	120.7	54%	0.539	55%	0.551	S	S	.	*	H	α-helix	trans	-52.5	-44.5	179.1	-91.7	-80.6	0	0	0	115.7	L814 Q820 Q821 Q822	L814-F818 WeakPolarHBondContact O-CD2 3.33Å; L814-F818 PolarHBondContact O-N 2.98Å; F818-Q820 VanDerWaalsContact C-N 3.29Å; F818-Q820 PolarHBondContact O-N 3.43Å; F818-Q821 PolarHBondContact O-N 2.97Å; F818-Q822 PolarHBondContact O-N 3.16Å
819	P	40.2	Very low	45.6	Very low	72 Å²	72	127.7 Å²	127.7	47%	0.468	58%	0.581	S	S	.	*	H	α-helix	trans	-67.1	-22.8	178.6	24.2	-33.8	0	0	0	114.3	K815 R816 K823	K815-P819 WeakPolarHBondContact O-CD 3.49Å; R816-P819 WeakPolarHBondContact O-CD 3.47Å; R816-P819 WeakPolarHBondContact O-CG 3.23Å; P819-K823 PolarHBondContact O-N 2.96Å
820	Q	45.4	Very low	45.3	Very low	123 Å²	123	134.2 Å²	134.2	58%	0.575	60%	0.597	S	S	*	*	H	α-helix	trans	-73.7	-44.3	174.1	-88.8	179.7	-28.6	0	0	112	Y817 F818 Q822 K823 Q824	Y817-Q820 PolarHBondContact O-N 2.92Å; Y817-Q820 VanDerWaalsContact O-N 3.13Å; F818-Q820 VanDerWaalsContact C-N 3.29Å; F818-Q820 PolarHBondContact O-N 3.43Å; Q820-Q822 VanDerWaalsContact C-N 3.31Å; Q820-Q822 PolarHBondContact O-N 2.93Å; Q820-K823 PolarHBondContact O-N 2.84Å; Q820-K823 VanDerWaalsContact O-N 3.14Å; Q820-Q824 PolarHBondContact O-N 2.81Å; Q820-Q824 VanDerWaalsContact O-N 3.07Å
821	Q	42.6	Very low	45.7	Very low	114 Å²	114	137.7 Å²	137.7	53%	0.533	61%	0.608	S	S	.	*	H	α-helix	trans	-63.3	-36.9	177.2	-70.2	-172.9	-9.1	0	0	112.2	Y817 F818 K823 Q824 Q825	Y817-Q821 PolarHBondContact O-N 2.91Å; F818-Q821 PolarHBondContact O-N 2.97Å; Q821-K823 PolarHBondContact O-N 3.26Å; Q821-Q824 PolarHBondContact O-N 2.98Å; Q821-Q825 PolarHBondContact O-N 3.37Å
822	Q	43.3	Very low	45.6	Very low	118 Å²	118	141.7 Å²	141.7	55%	0.551	62%	0.624	S	S	*	*	H	α-helix	trans	-66.3	-33.6	174.2	-70.3	-168.1	4.7	0	0	113.2	F818 Q820 K826	F818-Q822 PolarHBondContact O-N 3.16Å; Q820-Q822 VanDerWaalsContact C-N 3.31Å; Q820-Q822 PolarHBondContact O-N 2.93Å; Q822-K826 WeakPolarHBondContact O-CB 3.38Å; Q822-K826 WeakPolarHBondContact O-CG 3.42Å; Q822-K826 PolarHBondContact O-N 2.94Å
823	K	46.4	Very low	45.7	Very low	152 Å²	152	143.5 Å²	143.5	66%	0.661	63%	0.632	S	S	*	*	H	α-helix	trans	-65.7	-46.1	172.2	-78.8	-175.4	174.8	-174.9	0	111.5	P819 Q820 Q821 Q825 K826 Q827	P819-K823 PolarHBondContact O-N 2.96Å; Q820-K823 PolarHBondContact O-N 2.84Å; Q820-K823 VanDerWaalsContact O-N 3.14Å; Q821-K823 PolarHBondContact O-N 3.26Å; K823-Q825 PolarHBondContact O-N 3.3Å; K823-K826 PolarHBondContact O-N 2.99Å; K823-K826 VanDerWaalsContact O-N 3.17Å; K823-Q827 PolarHBondContact O-N 3.32Å
824	Q	48.7	Very low	46	Very low	130 Å²	130	144.5 Å²	144.5	61%	0.607	64%	0.639	S	S	*	*	H	α-helix	trans	-63.5	-39.5	177.2	-72.6	-178.3	-17.4	0	0	112.9	Q820 Q821 Q827 R828	Q820-Q824 PolarHBondContact O-N 2.81Å; Q820-Q824 VanDerWaalsContact O-N 3.07Å; Q821-Q824 PolarHBondContact O-N 2.98Å; Q824-Q827 PolarHBondContact O-N 3.23Å; Q824-R828 PolarHBondContact O-N 3.14Å
825	Q	45.9	Very low	46	Very low	131 Å²	131	149 Å²	149	61%	0.612	66%	0.657	S	S	*	*	H	α-helix	trans	-65	-37.1	172.8	-76.3	-168.6	-4.9	0	0	112.7	Q821 K823 K829	Q821-Q825 PolarHBondContact O-N 3.37Å; K823-Q825 PolarHBondContact O-N 3.3Å; Q825-K829 WeakPolarHBondContact O-CB 3.43Å; Q825-K829 WeakPolarHBondContact O-CG 3.12Å; Q825-K829 PolarHBondContact O-N 3.3Å
826	K	48.8	Very low	46.2	Very low	150 Å²	150	148.9 Å²	148.9	65%	0.652	66%	0.657	S	S	*	*	H	α-helix	trans	-68.2	-34.7	174.5	-78	-178.5	176	-178.3	0	112.7	Q822 K823 R830	Q822-K826 WeakPolarHBondContact O-CB 3.38Å; Q822-K826 WeakPolarHBondContact O-CG 3.42Å; Q822-K826 PolarHBondContact O-N 2.94Å; K823-K826 PolarHBondContact O-N 2.99Å; K823-K826 VanDerWaalsContact O-N 3.17Å; K826-R830 PolarHBondContact O-N 3.11Å
827	Q	50.5	Low	46.5	Very low	127 Å²	127	145.8 Å²	145.8	59%	0.593	65%	0.65	S	S	*	*	H	α-helix	trans	-67.3	-48.6	171.4	-79.1	174.1	-57.4	0	0	111.9	K823 Q824 K829 R830 I831	K823-Q827 PolarHBondContact O-N 3.32Å; Q824-Q827 PolarHBondContact O-N 3.23Å; Q827-K829 PolarHBondContact O-N 3.26Å; Q827-R830 PolarHBondContact O-N 2.61Å; Q827-I831 PolarHBondContact O-N 3.07Å; Q827-I831 VanDerWaalsContact O-N 3.08Å
828	R	49.9	Very low	47	Very low	198 Å²	198	145.2 Å²	145.2	75%	0.747	65%	0.652	S	S	*	*	H	α-helix	trans	-59.5	-32.3	176	-78.9	-176	164.4	-172.7	-5.7	113.2	Q824 K832	Q824-R828 PolarHBondContact O-N 3.14Å; R828-K832 PolarHBondContact O-N 3.27Å
829	K	50.5	Low	47.4	Very low	161 Å²	161	146.5 Å²	146.5	70%	0.7	66%	0.659	S	S	*	*	H	α-helix	trans	-79.3	-9.6	172.7	-76	-173.6	173.7	-172.7	0	115.2	Q825 Q827	Q825-K829 WeakPolarHBondContact O-CB 3.43Å; Q825-K829 WeakPolarHBondContact O-CG 3.12Å; Q825-K829 PolarHBondContact O-N 3.3Å; Q827-K829 PolarHBondContact O-N 3.26Å
830	R	49.3	Very low	47.8	Very low	194 Å²	194	151.1 Å²	151.1	73%	0.732	67%	0.671	S	S	*	*	H	α-helix	trans	-88.2	-41.4	168.8	-91.3	-174.5	163.3	-174	-6.6	111.7	K826 Q827 K833	K826-R830 PolarHBondContact O-N 3.11Å; Q827-R830 PolarHBondContact O-N 2.61Å; R830-K833 PolarHBondContact O-N 3.19Å; R830-K833 VanDerWaalsContact O-N 3.14Å
831	I	56.8	Low	48	Very low	102 Å²	102	153 Å²	153	52%	0.523	68%	0.677	S	S	.	*	H	α-helix	trans	-62.2	-47.9	178	-62	167.9	0	0	0	110.1	Q827 K833 Q834 E835	Q827-I831 PolarHBondContact O-N 3.07Å; Q827-I831 VanDerWaalsContact O-N 3.08Å; I831-K833 PolarHBondContact O-N 3.35Å; I831-Q834 PolarHBondContact O-N 3.05Å; I831-E835 PolarHBondContact O-N 2.66Å
832	K	49.7	Very low	48.4	Very low	164 Å²	164	155.8 Å²	155.8	71%	0.713	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	34.3	170.3	-69	-158.1	164.6	-149.1	0	115	R828	R828-K832 PolarHBondContact O-N 3.27Å
833	K	48.4	Very low	48.8	Very low	178 Å²	178	158.7 Å²	158.7	77%	0.774	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.1	8.6	170.7	-99.9	-157.2	169.3	-153.8	0	112.4	R830 I831	R830-K833 PolarHBondContact O-N 3.19Å; R830-K833 VanDerWaalsContact O-N 3.14Å; I831-K833 PolarHBondContact O-N 3.35Å
834	Q	48.3	Very low	49	Very low	174 Å²	174	159.3 Å²	159.3	81%	0.813	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.8	-1.6	171.3	-58.6	-173.8	-92.7	0	0	111.4	I831	I831-Q834 PolarHBondContact O-N 3.05Å
835	E	40.6	Very low	49	Very low	202 Å²	202	161.9 Å²	161.9	94%	0.944	71%	0.709	S	S	*	*			trans	-101.5	0	148	-59.9	169.4	155.3	0	0	106.9	I831	I831-E835 PolarHBondContact O-N 2.66Å

Retrieved 835 of 835 residues in 473.1 ms (Link to these results)

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