A0A087XAB5_POEFO Loading...

Glutamate receptor

Receptor for glutamate that functions as a ligand-gated ion channel in the central nervous system and plays an important role in excitatory synaptic transmission. L-glutamate acts as an excitatory neurotransmitter at many synapses in the central nervous system.

AlphaFold DB , UniProt , Accession A0A087XAB5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 947 aa.

						>A0A087XAB5_POEFO|A0A087XAB5
MRLFLLAVLLSCSCARAGCEPKIVNIGAVLSQKRYEQVFKDAVNQANQVYGRDKFKLNAISVTHKANAIQMALSVCEDLIHSQVYAILVSHPPQSSDHLTPTPVSYTAGFYRIPVVGLTTRMSIYSDKSIHLSFLRTVPPYSHQAHVWFDLMREFNWNHIILIVSDDHEGRAAQKRLETLLEERETKNKKRNYENLDQLSYDNKRGPKAEKVLQFSQETNLTALLLEAKELEARVIILSASEDDAAAVYKAARFLNMTGSGYVWLVGEREMSGKALSEAPDGLIALQLINGKNESAHITDAVAVVAQSIQELFEKENITEPPKGCVGNTNIWKTGPLFKRVLMSSKYPEGLTGRVEFNDDGDRKYAHYTILNYQKSRLVQVGIYNGTQVVMNNQRKIIWPGGETEKPQGFQMSTRLKIVTIHQEPFVYVKPTMQDGTCNEEKALNGVIIKKVICTGPNETIPGRPIVPQCCYGFCVDLLIKLAMTMNFTYEVHLVADGKFGTQERVNNSNKKEWNGMMGELLGGLADMIVAPLTINNERAQYIEFSKPFKYQGLTILVKKEIPRSTLDSFMQPFQSTLWLLVGLSVHVVAVMLYLLDRFSPFGRFKVNSEEEEEDALTLSSAMWFSWGVLLNSGIGEGAPRSFSARILGMVWAGFAMIIVASYTANLAAFLVLDRPEERITGINDPRLRNPSDKFIYATVKQSSVDIYFRRQVELSTMYRHMEKHNYESAAEAIQAVRDNKLHAFIWDSAVLEFEASQKCDLVTTGELFFRSGFGIGMRKDSPWKQNVSLAILSSHENGFMEDLDKTWVRYQECDSRSNAPATLTFENMAGVFMLVAGGIAAGIFLIFIEIAYKRHKDARRKQMQLAFAAVNVWRKNLQPSSSVETQDDRKSGRAEPDPKKKASFRSISTTLASSIKRRRSSKDTQYPPTDATGQLNLSDPSVSTVV
					

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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	52.4	Low	49.4	Very low	225 Å²	225	135.5 Å²	135.5	100%	1.108	70%	0.697	S	S	*	*				0	44.4	0	-166.7	170.9	158.1	0	0	113.1
2	R	48.5	Very low	48.4	Very low	225 Å²	225	131.8 Å²	131.8	85%	0.849	69%	0.69	S	S	*	*			trans	-139.3	-32.8	171.3	-84.2	-168.5	174.4	176.6	-1.9	115.4
3	L	47.9	Very low	47.5	Very low	155 Å²	155	128.9 Å²	128.9	81%	0.812	69%	0.688	S	S	*	*	H	α-helix	trans	-71.3	-40.2	175.6	-82.8	83.5	0	0	0	113.7	L5 L6	L3-L5 PolarHBondContact O-N 3.18Å; L3-L6 PolarHBondContact O-N 3.48Å; L3-L6 VanDerWaalsContact O-N 3.12Å
4	F	50.4	Low	46.7	Very low	183 Å²	183	127.5 Å²	127.5	80%	0.803	69%	0.691	S	S	*	*	H	α-helix	trans	-62.5	-27	-174	-120.6	-87.8	0	0	0	114.2
5	L	51.7	Low	46.1	Very low	113 Å²	113	124.6 Å²	124.6	59%	0.592	69%	0.691	S	S	*	*	H	α-helix	trans	-75.6	-30.1	177.3	-95.5	145.5	0	0	0	113.1	L3 L9	L3-L5 PolarHBondContact O-N 3.18Å; L5-L9 WeakPolarHBondContact O-CG 3.46Å; L5-L9 PolarHBondContact O-N 3.39Å
6	L	51.8	Low	45.7	Very low	116 Å²	116	131.7 Å²	131.7	61%	0.607	70%	0.704	S	S	*	*	H	α-helix	trans	-70	-40.8	177	-114.1	85	0	0	0	111.8	L3 V8 L9 L10	L3-L6 PolarHBondContact O-N 3.48Å; L3-L6 VanDerWaalsContact O-N 3.12Å; L6-V8 PolarHBondContact O-N 3.31Å; L6-L9 PolarHBondContact O-N 3.02Å; L6-L10 PolarHBondContact O-N 3.37Å
7	A	52.4	Low	45.1	Very low	62 Å²	62	129.4 Å²	129.4	51%	0.512	71%	0.708	S	S	.	*	H	α-helix	trans	-61	-44.9	-179.9	0	0	0	0	0	112	L10 S11	A7-L10 PolarHBondContact O-N 3.12Å; A7-S11 PolarHBondContact O-N 3.44Å; A7-S11 PolarHBondContact O-OG 3.17Å
8	V	53.5	Low	44.8	Very low	90 Å²	90	125.9 Å²	125.9	55%	0.545	71%	0.707	S	S	.	*	H	α-helix	trans	-64.9	-42.9	178.9	177.4	0	0	0	0	111.3	L6 S11 C12	L6-V8 PolarHBondContact O-N 3.31Å; V8-S11 WeakPolarHBondContact CA-OG 3.49Å; V8-S11 PolarHBondContact O-N 2.76Å; V8-S11 PolarHBondContact O-OG 3.35Å; V8-C12 PolarHBondContact O-N 3.16Å; V8-C12 VanDerWaalsContact O-N 3.16Å
9	L	48.6	Very low	45.3	Very low	114 Å²	114	125.5 Å²	125.5	60%	0.597	71%	0.711	S	S	*	*	H	α-helix	trans	-63.1	-43.9	177.3	-75.6	167.8	0	0	0	112.5	L5 L6 S11 C12 S13	L5-L9 WeakPolarHBondContact O-CG 3.46Å; L5-L9 PolarHBondContact O-N 3.39Å; L6-L9 PolarHBondContact O-N 3.02Å; L9-S11 PolarHBondContact O-N 3.33Å; L9-C12 PolarHBondContact O-N 3.02Å; L9-S13 PolarHBondContact O-N 3.49Å; L9-S13 PolarHBondContact O-OG 3.37Å
10	L	43.5	Very low	46.3	Very low	120 Å²	120	128.4 Å²	128.4	63%	0.628	72%	0.719	S	S	*	*	H	α-helix	trans	-62.9	-40.4	175.9	-90.4	149.8	0	0	0	112.5	L6 A7 C12 S13	L6-L10 PolarHBondContact O-N 3.37Å; A7-L10 PolarHBondContact O-N 3.12Å; L10-C12 PolarHBondContact O-N 3.31Å; L10-S13 PolarHBondContact O-N 3.44Å
11	S	43.3	Very low	47.7	Very low	87 Å²	87	125.1 Å²	125.1	61%	0.608	70%	0.703	S	S	*	*	H	α-helix	trans	-65.1	-25	175.6	66.6	0	0	0	0	113.8	A7 V8 L9	A7-S11 PolarHBondContact O-N 3.44Å; A7-S11 PolarHBondContact O-OG 3.17Å; V8-S11 WeakPolarHBondContact CA-OG 3.49Å; V8-S11 PolarHBondContact O-N 2.76Å; V8-S11 PolarHBondContact O-OG 3.35Å; L9-S11 PolarHBondContact O-N 3.33Å
12	C	36.3	Very low	49.2	Very low	91 Å²	91	118.2 Å²	118.2	62%	0.615	67%	0.667	S	S	*	*	H	α-helix	trans	-84.8	-20.9	-179.5	-158.1	0	0	0	0	113.5	V8 L9 L10	V8-C12 PolarHBondContact O-N 3.16Å; V8-C12 VanDerWaalsContact O-N 3.16Å; L9-C12 PolarHBondContact O-N 3.02Å; L10-C12 PolarHBondContact O-N 3.31Å
13	S	36.8	Very low	51.1	Low	95 Å²	95	112.9 Å²	112.9	66%	0.664	65%	0.654	S	S	*	*	H	α-helix	trans	-76.7	-21.4	-178.5	-67.1	0	0	0	0	114.5	L9 L10 A15	L9-S13 PolarHBondContact O-N 3.49Å; L9-S13 PolarHBondContact O-OG 3.37Å; L10-S13 PolarHBondContact O-N 3.44Å; S13-A15 VanDerWaalsContact C-N 3.28Å; S13-A15 PolarHBondContact O-N 3.21Å
14	C	36.6	Very low	53.2	Low	109 Å²	109	105.5 Å²	105.5	74%	0.736	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-75.9	-12.6	177.6	-66.5	0	0	0	0	113.9	R16	C14-R16 PolarHBondContact O-N 3.42Å
15	A	38.4	Very low	55.3	Low	84 Å²	84	98.1 Å²	98.1	69%	0.694	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-81.3	12.3	-174.6	0	0	0	0	0	115.2	S13	S13-A15 VanDerWaalsContact C-N 3.28Å; S13-A15 PolarHBondContact O-N 3.21Å
16	R	39.1	Very low	57.4	Low	238 Å²	238	92.7 Å²	92.7	90%	0.898	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-133.3	21	179.9	-76.3	-168.9	174.2	-179.4	-1.3	115.2	C14 G18	C14-R16 PolarHBondContact O-N 3.42Å; R16-G18 PolarHBondContact O-N 2.97Å
17	A	36.1	Very low	59.4	Low	92 Å²	92	87.2 Å²	87.2	76%	0.76	53%	0.527	S	S	*	.			trans	-74.5	76	158	0	0	0	0	0	109.1	C19	A17-C19 PolarHBondContact O-N 3.45Å
18	G	39.6	Very low	61.5	Low	67 Å²	67	84.2 Å²	84.2	69%	0.691	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-64.5	129.5	175.2	0	0	0	0	0	110.3	R16 E20	R16-G18 PolarHBondContact O-N 2.97Å; G18-E20 PolarHBondContact O-N 3.28Å
19	C	53.5	Low	63.4	Low	118 Å²	118	80 Å²	80	80%	0.797	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-63.8	122.7	171.1	-65.6	0	0	0	0	109.2	A17	A17-C19 PolarHBondContact O-N 3.45Å
20	E	65.4	Low	65.4	Low	183 Å²	183	74.5 Å²	74.5	86%	0.855	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-63.6	130.7	170	-65.5	-168	140.4	0	0	109.3	G18 K22	G18-E20 PolarHBondContact O-N 3.28Å; E20-K22 PolarHBondContact O-N 2.94Å
21	P	75.1	Confident	67.5	Low	61 Å²	61	69.5 Å²	69.5	40%	0.396	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-67.4	125.4	-175.1	26.2	-33.9	0	0	0	110.1	I23	P21-I23 PolarHBondContact O-N 2.82Å
22	K	83.9	Confident	69.6	Low	80 Å²	80	68.8 Å²	68.8	35%	0.348	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	125.8	-175.3	-179	162.1	-174.1	150.1	0	111.3	E20 K54 F55 K56 F313 E320	E20-K22 PolarHBondContact O-N 2.94Å; K22-K54 PolarHBondContact N-O 2.81Å; K22-F55 CarbonylContact O-C 3.49Å; K22-F55 WeakPolarHBondContact O-CA 3.42Å; K22-F55 WeakPolarHBondContact O-CB 3.45Å; K22-K56 PolarHBondContact O-N 3.37Å; K22-F313 HydrophobicContact CD-CE1 4.34Å; K22-F313 HydrophobicContact CD-CZ 4.4Å; K22-E320 WeakPolarHBondContact CE-OE1 3.47Å; K22-E320 IonicContact NZ-OE1 3.58Å; K22-E320 PolarHBondContact NZ-OE1 2.84Å
23	I	88.9	Confident	72.1	Confident	112 Å²	112	71.7 Å²	71.7	57%	0.574	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	130.8	176.6	-56.6	177.5	0	0	0	109.3	P21 K56 N58	P21-I23 PolarHBondContact O-N 2.82Å; I23-K56 WeakPolarHBondContact CA-O 3.18Å; I23-N58 HydrophobicContact CG2-CB 4.01Å
24	V	91.9	Very high	74.7	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	111.3	-177.1	177.1	0	0	0	0	108.8	F55 K56 L57 N58 Y85 I309 F313	V24-F55 HydrophobicContact CG2-CB 4.02Å; V24-K56 PolarHBondContact N-O 2.9Å; V24-L57 HydrophobicContact CB-CD2 4.09Å; V24-L57 HydrophobicContact CG1-CD2 4.07Å; V24-L57 CarbonylContact O-C 3.58Å; V24-L57 WeakPolarHBondContact O-CA 3.46Å; V24-N58 PolarHBondContact O-N 3.22Å; V24-Y85 HydrophobicContact CG1-CD1 4.28Å; V24-Y85 HydrophobicContact CG1-CD2 3.79Å; V24-Y85 HydrophobicContact CG1-CE2 4.18Å; V24-Y85 HydrophobicContact CG1-CG 3.85Å; V24-I309 HydrophobicContact CG1-CD1 4.02Å; V24-I309 HydrophobicContact CG1-CG2 4.31Å; V24-F313 HydrophobicContact CG2-CE2 3.71Å; V24-F313 HydrophobicContact CG2-CZ 3.96Å
25	N	94.5	Very high	77.4	Confident	28 Å²	28	69.8 Å²	69.8	15%	0.15	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	132.8	-176.6	-63.3	-44.8	0	0	0	111.2	N58 I60 S82 V84 Y85	N25-N58 WeakPolarHBondContact OD1-CB 3.5Å; N25-N58 PolarHBondContact OD1-ND2 3.27Å; N25-I60 HydrophobicContact CB-CD1 3.87Å; N25-S82 WeakPolarHBondContact CB-O 3.34Å; N25-S82 PolarHBondContact ND2-O 3.44Å; N25-V84 HydrophobicContact CB-CG1 4.17Å; N25-V84 WeakPolarHBondContact O-CA 3.37Å; N25-Y85 PolarHBondContact O-N 3.44Å
26	I	95.3	Very high	79.9	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128.5	169.9	-56.4	175.1	0	0	0	107.7	F39 L57 N58 I60 L88 V305 I309	I26-F39 HydrophobicContact CB-CZ 4.18Å; I26-F39 HydrophobicContact CG2-CE2 4.07Å; I26-F39 HydrophobicContact CG2-CZ 3.87Å; I26-L57 HydrophobicContact CD1-CB 4.4Å; I26-L57 HydrophobicContact CD1-CD1 4.07Å; I26-L57 HydrophobicContact CD1-CD2 4.05Å; I26-L57 HydrophobicContact CD1-CG 4.41Å; I26-N58 PolarHBondContact N-O 3.45Å; I26-I60 PolarHBondContact O-N 3.02Å; I26-L88 HydrophobicContact CG2-CD1 3.74Å; I26-V305 HydrophobicContact CD1-CG1 3.76Å; I26-V305 HydrophobicContact CG1-CG1 4.32Å; I26-I309 HydrophobicContact CD1-CD1 4.18Å; I26-I309 HydrophobicContact CG1-CD1 4.35Å
27	G	95.4	Very high	82.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	149.9	175.3	0	0	0	0	0	112.2	I60 A86 I87 L88	G27-I60 CarbonylContact C-O 3.56Å; G27-I60 VanDerWaalsContact CA-O 3.29Å; G27-I60 WeakPolarHBondContact CA-O 3.38Å; G27-A86 PolarHBondContact N-O 3.3Å; G27-I87 CarbonylContact O-C 3.55Å; G27-I87 WeakPolarHBondContact O-CA 3.3Å; G27-L88 PolarHBondContact O-N 3.44Å
28	A	95	Very high	85.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	135.4	168	0	0	0	0	0	112.2	L30 F39 I60 S61 V62 L88	A28-L30 HydrophobicContact CB-CD1 4.01Å; A28-L30 HydrophobicContact CB-CD2 4.2Å; A28-L30 HydrophobicContact CB-CG 3.92Å; A28-F39 HydrophobicContact CB-CD1 3.73Å; A28-F39 HydrophobicContact CB-CD2 4.09Å; A28-F39 HydrophobicContact CB-CE1 3.56Å; A28-F39 HydrophobicContact CB-CE2 3.95Å; A28-F39 HydrophobicContact CB-CG 3.99Å; A28-F39 HydrophobicContact CB-CZ 3.68Å; A28-I60 PolarHBondContact N-O 2.72Å; A28-S61 CarbonylContact O-C 3.5Å; A28-S61 WeakPolarHBondContact O-CA 3.38Å; A28-V62 PolarHBondContact O-N 3.28Å; A28-L88 CarbonylContact C-O 3.57Å; A28-L88 VanDerWaalsContact CA-O 3.31Å; A28-L88 WeakPolarHBondContact CA-O 3.02Å; A28-L88 HydrophobicContact CB-CB 4.18Å
29	V	93.1	Very high	87.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.2	170.1	-179.1	0	0	0	0	108.4	V62 M71 V75 L79 I87 L88 V89 S90 V104	V29-V62 WeakPolarHBondContact CA-O 3.45Å; V29-M71 HydrophobicContact CB-CE 4.41Å; V29-M71 HydrophobicContact CG1-CE 3.58Å; V29-M71 HydrophobicContact CG1-SD 3.67Å; V29-M71 HydrophobicContact CG2-CE 3.87Å; V29-V75 HydrophobicContact CG2-CG2 4.21Å; V29-L79 HydrophobicContact CG2-CD1 3.75Å; V29-I87 HydrophobicContact CG2-CG2 4.32Å; V29-L88 PolarHBondContact N-O 3.45Å; V29-V89 HydrophobicContact CB-CB 4.47Å; V29-V89 HydrophobicContact CB-CG2 4.01Å; V29-V89 HydrophobicContact CG1-CG2 4.34Å; V29-V89 WeakPolarHBondContact O-CA 3.34Å; V29-S90 PolarHBondContact O-N 3.29Å; V29-V104 HydrophobicContact CG1-CG2 4.49Å; V29-V104 HydrophobicContact CG2-CG1 4.34Å; V29-V104 HydrophobicContact CG2-CG2 4.34Å
30	L	91.4	Very high	89.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	153.2	-164	-60	176.3	0	0	0	112.9	A28 Q32 Y35 E36 F39 V62 T63 H64 L118 I298	A28-L30 HydrophobicContact CB-CD1 4.01Å; A28-L30 HydrophobicContact CB-CD2 4.2Å; A28-L30 HydrophobicContact CB-CG 3.92Å; L30-Q32 PolarHBondContact O-N 3.26Å; L30-Y35 WeakPolarHBondContact CD1-O 3.41Å; L30-E36 HydrophobicContact CD1-CG 4.33Å; L30-F39 HydrophobicContact CD1-CB 3.95Å; L30-F39 HydrophobicContact CD1-CG 4.44Å; L30-V62 PolarHBondContact N-O 3.21Å; L30-T63 WeakPolarHBondContact O-CA 3.48Å; L30-H64 PolarHBondContact O-N 3.02Å; L30-L118 HydrophobicContact CD2-CD1 3.96Å; L30-I298 HydrophobicContact CD2-CD1 4.08Å; L30-I298 HydrophobicContact CD2-CG1 4.42Å
31	S	87.4	Confident	91.2	Very high	14 Å²	14	51 Å²	51	10%	0.098	24%	0.243	C	C	.	.	S	Bend	trans	-67.1	-34.1	-174.7	68.4	0	0	0	0	114.1	Y35 S90 H91 P93 E294	S31-Y35 VanDerWaalsContact OG-CD2 3.26Å; S31-Y35 WeakPolarHBondContact OG-CD2 3.38Å; S31-Y35 VanDerWaalsContact OG-CE2 3.27Å; S31-Y35 WeakPolarHBondContact OG-CE2 3.35Å; S31-S90 WeakPolarHBondContact CB-OG 3.4Å; S31-S90 PolarHBondContact N-OG 3.15Å; S31-H91 VanDerWaalsContact CB-O 3.3Å; S31-H91 WeakPolarHBondContact CB-O 3.4Å; S31-P93 WeakPolarHBondContact O-CG 3.45Å; S31-E294 VanDerWaalsContact CB-OE2 3.27Å; S31-E294 WeakPolarHBondContact CB-OE2 3.44Å; S31-E294 PolarHBondContact OG-OE2 3.07Å
32	Q	88.3	Confident	92.2	Very high	72 Å²	72	48.5 Å²	48.5	34%	0.336	23%	0.227	S	C	.	.	S	Bend	trans	-151.1	146.5	-173	-59.4	-178.2	2.4	0	0	111.1	L30 R34 Y35 P93	L30-Q32 PolarHBondContact O-N 3.26Å; Q32-R34 HydrophobicContact CB-CG 4.17Å; Q32-R34 PolarHBondContact O-N 3.3Å; Q32-R34 VanDerWaalsContact O-N 3.07Å; Q32-Y35 HydrophobicContact CB-CD2 3.92Å; Q32-Y35 HydrophobicContact CB-CE2 4.24Å; Q32-Y35 HydrophobicContact CG-CE2 4.43Å; Q32-Y35 WeakPolarHBondContact O-CB 3.44Å; Q32-Y35 PolarHBondContact O-N 2.85Å; Q32-P93 HydrophobicContact CG-CG 4.06Å
33	K	88.4	Confident	92.7	Very high	153 Å²	153	44.7 Å²	44.7	67%	0.665	21%	0.211	S	C	*	.	H	α-helix	trans	-54.7	-30	-179.7	-69.2	-169.7	174.6	-173.8	0	114.7	Y35 E36 T63	K33-Y35 PolarHBondContact O-N 3.34Å; K33-E36 VanDerWaalsContact O-CB 3.31Å; K33-E36 WeakPolarHBondContact O-CB 3.45Å; K33-E36 PolarHBondContact O-N 3.47Å; K33-T63 HydrophobicContact CD-CG2 4.46Å; K33-T63 HydrophobicContact CG-CG2 3.5Å; K33-T63 VanDerWaalsContact CG-CG2 3.5Å
34	R	91.3	Very high	92.9	Very high	139 Å²	139	43.6 Å²	43.6	53%	0.525	21%	0.206	S	C	.	.	H	α-helix	trans	-57.7	-32.7	175.6	74	-178.2	-174.1	-168.9	-2.1	112.8	Q32 E36 Q37 V38	Q32-R34 HydrophobicContact CB-CG 4.17Å; Q32-R34 PolarHBondContact O-N 3.3Å; Q32-R34 VanDerWaalsContact O-N 3.07Å; R34-E36 VanDerWaalsContact C-N 3.34Å; R34-Q37 PolarHBondContact O-N 3Å; R34-V38 PolarHBondContact O-N 2.85Å
35	Y	92.5	Very high	92.9	Very high	25 Å²	25	48.9 Å²	48.9	10%	0.098	23%	0.231	C	C	.	.	H	α-helix	trans	-78.9	-18.5	179.7	-63.8	-63.2	0	0	0	112.7	L30 S31 Q32 K33 Q37 V38 F39 E294 I298	L30-Y35 WeakPolarHBondContact CD1-O 3.41Å; S31-Y35 VanDerWaalsContact OG-CD2 3.26Å; S31-Y35 WeakPolarHBondContact OG-CD2 3.38Å; S31-Y35 VanDerWaalsContact OG-CE2 3.27Å; S31-Y35 WeakPolarHBondContact OG-CE2 3.35Å; Q32-Y35 HydrophobicContact CB-CD2 3.92Å; Q32-Y35 HydrophobicContact CB-CE2 4.24Å; Q32-Y35 HydrophobicContact CG-CE2 4.43Å; Q32-Y35 WeakPolarHBondContact O-CB 3.44Å; Q32-Y35 PolarHBondContact O-N 2.85Å; K33-Y35 PolarHBondContact O-N 3.34Å; Y35-Q37 VanDerWaalsContact C-N 3.3Å; Y35-V38 PolarHBondContact O-N 3.2Å; Y35-F39 VanDerWaalsContact O-CB 3.29Å; Y35-F39 WeakPolarHBondContact O-CB 3.29Å; Y35-F39 PolarHBondContact O-N 2.88Å; Y35-E294 HydrophobicContact CD1-CB 4.3Å; Y35-E294 HydrophobicContact CE1-CB 3.85Å; Y35-E294 HydrophobicContact CE2-CB 4.37Å; Y35-E294 HydrophobicContact CE2-CG 4.42Å; Y35-E294 WeakPolarHBondContact CE2-OE2 3.41Å; Y35-I298 HydrophobicContact CD1-CD1 4.06Å; Y35-I298 HydrophobicContact CG-CD1 4.24Å
36	E	91.8	Very high	92.7	Very high	32 Å²	32	47.9 Å²	47.9	15%	0.15	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-34	171.2	-57.9	-178.7	-170.5	0	0	111.7	L30 K33 R34 K40 S61 T63	L30-E36 HydrophobicContact CD1-CG 4.33Å; K33-E36 VanDerWaalsContact O-CB 3.31Å; K33-E36 WeakPolarHBondContact O-CB 3.45Å; K33-E36 PolarHBondContact O-N 3.47Å; R34-E36 VanDerWaalsContact C-N 3.34Å; E36-K40 WeakPolarHBondContact O-CB 3.38Å; E36-K40 WeakPolarHBondContact O-CD 3.42Å; E36-K40 VanDerWaalsContact O-CG 3.28Å; E36-K40 WeakPolarHBondContact O-CG 3.31Å; E36-K40 PolarHBondContact O-N 2.85Å; E36-S61 PolarHBondContact OE2-OG 3.28Å; E36-T63 WeakPolarHBondContact OE1-CG2 3.36Å
37	Q	92.3	Very high	92.5	Very high	130 Å²	130	49.6 Å²	49.6	61%	0.607	24%	0.235	S	C	*	.	H	α-helix	trans	-67.2	-52.8	172.5	-65.8	176.1	-57.2	0	0	109.8	R34 Y35 F39 K40 D41	R34-Q37 PolarHBondContact O-N 3Å; Y35-Q37 VanDerWaalsContact C-N 3.3Å; Q37-F39 PolarHBondContact O-N 3.38Å; Q37-K40 WeakPolarHBondContact O-CB 3.42Å; Q37-K40 PolarHBondContact O-N 3.27Å; Q37-D41 VanDerWaalsContact O-CG 3.26Å; Q37-D41 PolarHBondContact O-N 2.86Å
38	V	94.6	Very high	92.2	Very high	44 Å²	44	56.3 Å²	56.3	27%	0.267	27%	0.267	S	S	.	.	H	α-helix	trans	-53.2	-40.7	175.3	178.7	0	0	0	0	112.4	R34 Y35 D41 A42 I298	R34-V38 PolarHBondContact O-N 2.85Å; Y35-V38 PolarHBondContact O-N 3.2Å; V38-D41 PolarHBondContact O-N 3.48Å; V38-A42 VanDerWaalsContact O-CB 3.3Å; V38-A42 WeakPolarHBondContact O-CB 3.32Å; V38-A42 PolarHBondContact O-N 3.39Å; V38-I298 HydrophobicContact CG1-CG2 4.22Å
39	F	95.8	Very high	91.8	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.1	-43	176.2	171.6	-115.7	0	0	0	112.7	I26 A28 L30 Y35 Q37 D41 A42 V43 A59 L88 I298 V302	I26-F39 HydrophobicContact CB-CZ 4.18Å; I26-F39 HydrophobicContact CG2-CE2 4.07Å; I26-F39 HydrophobicContact CG2-CZ 3.87Å; A28-F39 HydrophobicContact CB-CD1 3.73Å; A28-F39 HydrophobicContact CB-CD2 4.09Å; A28-F39 HydrophobicContact CB-CE1 3.56Å; A28-F39 HydrophobicContact CB-CE2 3.95Å; A28-F39 HydrophobicContact CB-CG 3.99Å; A28-F39 HydrophobicContact CB-CZ 3.68Å; L30-F39 HydrophobicContact CD1-CB 3.95Å; L30-F39 HydrophobicContact CD1-CG 4.44Å; Y35-F39 VanDerWaalsContact O-CB 3.29Å; Y35-F39 WeakPolarHBondContact O-CB 3.29Å; Y35-F39 PolarHBondContact O-N 2.88Å; Q37-F39 PolarHBondContact O-N 3.38Å; F39-D41 VanDerWaalsContact C-N 3.35Å; F39-A42 PolarHBondContact O-N 3.42Å; F39-V43 HydrophobicContact CD2-CG2 4.23Å; F39-V43 HydrophobicContact CE2-CG2 3.85Å; F39-V43 HydrophobicContact CZ-CG2 4.15Å; F39-V43 WeakPolarHBondContact O-CG2 3.39Å; F39-V43 PolarHBondContact O-N 2.89Å; F39-A59 HydrophobicContact CD1-CB 4.07Å; F39-A59 HydrophobicContact CE1-CB 3.68Å; F39-A59 HydrophobicContact CZ-CB 4.22Å; F39-L88 HydrophobicContact CD2-CD2 4.24Å; F39-L88 HydrophobicContact CE2-CD2 4.08Å; F39-I298 HydrophobicContact CB-CG2 3.97Å; F39-I298 HydrophobicContact CD2-CG2 4.24Å; F39-V302 HydrophobicContact CD2-CG2 3.73Å; F39-V302 HydrophobicContact CE2-CG2 3.76Å
40	K	94.8	Very high	91.3	Very high	85 Å²	85	62.1 Å²	62.1	37%	0.37	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-41.9	174.2	-75.4	163.2	-176.6	166.9	0	111.4	E36 Q37 V43 N44 A59	E36-K40 WeakPolarHBondContact O-CB 3.38Å; E36-K40 WeakPolarHBondContact O-CD 3.42Å; E36-K40 VanDerWaalsContact O-CG 3.28Å; E36-K40 WeakPolarHBondContact O-CG 3.31Å; E36-K40 PolarHBondContact O-N 2.85Å; Q37-K40 WeakPolarHBondContact O-CB 3.42Å; Q37-K40 PolarHBondContact O-N 3.27Å; K40-V43 PolarHBondContact O-N 2.89Å; K40-N44 WeakPolarHBondContact O-CB 3.32Å; K40-N44 PolarHBondContact O-N 3.27Å; K40-N44 PolarHBondContact O-ND2 3.43Å; K40-N44 VanDerWaalsContact O-ND2 3.15Å; K40-A59 HydrophobicContact CB-CB 4.48Å; K40-A59 HydrophobicContact CG-CB 3.78Å
41	D	94.5	Very high	90.3	Very high	97 Å²	97	62.4 Å²	62.4	52%	0.519	30%	0.301	S	S	.	.	H	α-helix	trans	-67.1	-41.8	178.4	-62.9	-29.9	0	0	0	111.6	Q37 V38 F39 V43 N44 Q45	Q37-D41 VanDerWaalsContact O-CG 3.26Å; Q37-D41 PolarHBondContact O-N 2.86Å; V38-D41 PolarHBondContact O-N 3.48Å; F39-D41 VanDerWaalsContact C-N 3.35Å; D41-V43 PolarHBondContact O-N 3.15Å; D41-N44 PolarHBondContact O-N 3.19Å; D41-Q45 WeakPolarHBondContact O-CB 3.45Å; D41-Q45 PolarHBondContact O-N 3.03Å
42	A	94.6	Very high	89.1	Confident	7 Å²	7	71.3 Å²	71.3	6%	0.058	33%	0.332	C	S	.	.	H	α-helix	trans	-62.3	-39.7	173	0	0	0	0	0	112.6	V38 F39 Q45 A46 I298 V302	V38-A42 VanDerWaalsContact O-CB 3.3Å; V38-A42 WeakPolarHBondContact O-CB 3.32Å; V38-A42 PolarHBondContact O-N 3.39Å; F39-A42 PolarHBondContact O-N 3.42Å; A42-Q45 PolarHBondContact O-N 2.85Å; A42-A46 WeakPolarHBondContact O-CB 3.44Å; A42-A46 PolarHBondContact O-N 2.96Å; A42-I298 HydrophobicContact CB-CG2 4.35Å; A42-V302 HydrophobicContact CB-CB 4.15Å; A42-V302 HydrophobicContact CB-CG1 4.23Å; A42-V302 HydrophobicContact CB-CG2 4.2Å
43	V	94.6	Very high	88.1	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.006	35%	0.353	C	S	.	.	H	α-helix	trans	-69.7	-36.8	175.2	171.4	0	0	0	0	111.4	F39 K40 D41 A46 N47 L57 A59 V302	F39-V43 HydrophobicContact CD2-CG2 4.23Å; F39-V43 HydrophobicContact CE2-CG2 3.85Å; F39-V43 HydrophobicContact CZ-CG2 4.15Å; F39-V43 WeakPolarHBondContact O-CG2 3.39Å; F39-V43 PolarHBondContact O-N 2.89Å; K40-V43 PolarHBondContact O-N 2.89Å; D41-V43 PolarHBondContact O-N 3.15Å; V43-A46 PolarHBondContact O-N 2.93Å; V43-N47 PolarHBondContact O-N 3.07Å; V43-N47 PolarHBondContact O-ND2 3.28Å; V43-L57 HydrophobicContact CG1-CB 3.7Å; V43-A59 HydrophobicContact CB-CB 3.99Å; V43-A59 HydrophobicContact CG1-CB 4.07Å; V43-A59 HydrophobicContact CG2-CB 4.02Å; V43-V302 HydrophobicContact CB-CG1 4.42Å; V43-V302 HydrophobicContact CG2-CG1 3.69Å; V43-V302 HydrophobicContact CG2-CG2 4.11Å
44	N	92.7	Very high	87.5	Confident	89 Å²	89	72.7 Å²	72.7	48%	0.476	34%	0.344	S	S	.	.	H	α-helix	trans	-64.3	-40	172.8	-73	-31.1	0	0	0	112	K40 D41 N47	K40-N44 WeakPolarHBondContact O-CB 3.32Å; K40-N44 PolarHBondContact O-N 3.27Å; K40-N44 PolarHBondContact O-ND2 3.43Å; K40-N44 VanDerWaalsContact O-ND2 3.15Å; D41-N44 PolarHBondContact O-N 3.19Å; N44-N47 PolarHBondContact O-N 3.4Å
45	Q	91.8	Very high	87.3	Confident	111 Å²	111	66.3 Å²	66.3	52%	0.519	32%	0.32	S	S	.	.	H	α-helix	trans	-65.8	-44.4	173.6	-172.5	179.5	8	0	0	111.2	D41 A42 N47 Q48 V49	D41-Q45 WeakPolarHBondContact O-CB 3.45Å; D41-Q45 PolarHBondContact O-N 3.03Å; A42-Q45 PolarHBondContact O-N 2.85Å; Q45-N47 VanDerWaalsContact C-N 3.29Å; Q45-N47 PolarHBondContact O-N 2.96Å; Q45-Q48 WeakPolarHBondContact O-CB 3.22Å; Q45-Q48 PolarHBondContact O-N 3.01Å; Q45-V49 PolarHBondContact O-N 2.95Å
46	A	91.4	Very high	87.2	Confident	7 Å²	7	71 Å²	71	6%	0.058	34%	0.341	C	S	.	.	H	α-helix	trans	-59.9	-37.4	176.6	0	0	0	0	0	112.6	A42 V43 Q48 V49 Y50 L57 V302 A306	A42-A46 WeakPolarHBondContact O-CB 3.44Å; A42-A46 PolarHBondContact O-N 2.96Å; V43-A46 PolarHBondContact O-N 2.93Å; A46-Q48 PolarHBondContact O-N 3.2Å; A46-V49 PolarHBondContact O-N 3.07Å; A46-Y50 HydrophobicContact CB-CD2 4.43Å; A46-Y50 PolarHBondContact O-N 3.06Å; A46-L57 HydrophobicContact CB-CD1 4.08Å; A46-V302 HydrophobicContact CB-CG1 3.94Å; A46-A306 HydrophobicContact CB-CB 3.88Å
47	N	91.1	Very high	87.2	Confident	35 Å²	35	69.8 Å²	69.8	19%	0.187	34%	0.335	C	S	.	.	H	α-helix	trans	-65.4	-15.6	173.7	-81.3	-40.6	0	0	0	114.9	V43 N44 Q45 L57	V43-N47 PolarHBondContact O-N 3.07Å; V43-N47 PolarHBondContact O-ND2 3.28Å; N44-N47 PolarHBondContact O-N 3.4Å; Q45-N47 VanDerWaalsContact C-N 3.29Å; Q45-N47 PolarHBondContact O-N 2.96Å; N47-L57 PolarHBondContact ND2-O 2.85Å; N47-L57 WeakPolarHBondContact OD1-CB 3.36Å; N47-L57 PolarHBondContact OD1-N 2.93Å
48	Q	88.3	Confident	87.3	Confident	141 Å²	141	67.2 Å²	67.2	66%	0.659	33%	0.326	S	S	*	.	H	α-helix	trans	-88	-28.2	174.8	-63.1	171.9	14.5	0	0	111.8	Q45 A46	Q45-Q48 WeakPolarHBondContact O-CB 3.22Å; Q45-Q48 PolarHBondContact O-N 3.01Å; A46-Q48 PolarHBondContact O-N 3.2Å
49	V	87	Confident	87.3	Confident	84 Å²	84	65.9 Å²	65.9	51%	0.509	32%	0.319	S	S	.	.	H	α-helix	trans	-89	-50.1	-178.8	-179.4	0	0	0	0	110.9	Q45 A46	Q45-V49 PolarHBondContact O-N 2.95Å; A46-V49 PolarHBondContact O-N 3.07Å
50	Y	83.1	Confident	87.3	Confident	39 Å²	39	67.5 Å²	67.5	15%	0.153	33%	0.328	C	S	.	.	S	Bend	trans	-108.9	160.5	-172.8	-56	-78.6	0	0	0	112	A46 R52 A306 Q307	A46-Y50 HydrophobicContact CB-CD2 4.43Å; A46-Y50 PolarHBondContact O-N 3.06Å; Y50-R52 PolarHBondContact O-N 3.31Å; Y50-A306 HydrophobicContact CD2-CB 3.6Å; Y50-A306 HydrophobicContact CE2-CB 4.09Å; Y50-A306 HydrophobicContact CG-CB 4.1Å; Y50-Q307 HydrophobicContact CE1-CB 4Å
51	G	69.6	Low	87.3	Confident	6 Å²	6	64.5 Å²	64.5	6%	0.062	32%	0.318	C	S	.	.			trans	80.8	2.3	167.3	0	0	0	0	0	117.5	D53 K54 F55 Q310	G51-D53 VanDerWaalsContact C-N 3.26Å; G51-D53 PolarHBondContact O-N 2.86Å; G51-K54 PolarHBondContact O-N 3.29Å; G51-F55 PolarHBondContact O-N 2.88Å; G51-Q310 VanDerWaalsContact N-OE1 3.16Å
52	R	61.8	Low	87.2	Confident	201 Å²	201	60.5 Å²	60.5	76%	0.758	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-32.6	-41.7	-166.2	-69.5	-174	174.5	178.8	-2.2	118.3	Y50	Y50-R52 PolarHBondContact O-N 3.31Å
53	D	68.1	Low	86.9	Confident	143 Å²	143	62 Å²	62	77%	0.765	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	-1.2	176.2	-56.2	-86.2	0	0	0	114.5	G51	G51-D53 VanDerWaalsContact C-N 3.26Å; G51-D53 PolarHBondContact O-N 2.86Å
54	K	75.9	Confident	86.4	Confident	110 Å²	110	63.6 Å²	63.6	48%	0.478	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-44.4	-170.8	-73.4	-175.4	-179.4	179.1	0	113.8	K22 G51 E314	K22-K54 PolarHBondContact N-O 2.81Å; G51-K54 PolarHBondContact O-N 3.29Å; K54-E314 IonicContact NZ-OE1 3.03Å
55	F	87.6	Confident	86.1	Confident	5 Å²	5	63.6 Å²	63.6	2%	0.022	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	156.4	-172.3	65.8	-93.9	0	0	0	111.2	K22 V24 G51 L57 I309 Q310 F313	K22-F55 CarbonylContact O-C 3.49Å; K22-F55 WeakPolarHBondContact O-CA 3.42Å; K22-F55 WeakPolarHBondContact O-CB 3.45Å; V24-F55 HydrophobicContact CG2-CB 4.02Å; G51-F55 PolarHBondContact O-N 2.88Å; F55-L57 HydrophobicContact CD2-CD2 3.82Å; F55-L57 HydrophobicContact CD2-CG 4.21Å; F55-L57 HydrophobicContact CE2-CD2 3.67Å; F55-L57 HydrophobicContact CE2-CG 3.93Å; F55-I309 HydrophobicContact CD1-CG2 4.45Å; F55-I309 HydrophobicContact CD2-CG2 3.99Å; F55-I309 HydrophobicContact CE1-CG2 4.19Å; F55-I309 HydrophobicContact CE2-CG2 3.7Å; F55-I309 HydrophobicContact CG-CG2 4.37Å; F55-I309 HydrophobicContact CZ-CB 4.47Å; F55-I309 HydrophobicContact CZ-CG2 3.81Å; F55-Q310 HydrophobicContact CE1-CB 3.95Å; F55-Q310 HydrophobicContact CE1-CG 4.21Å; F55-Q310 HydrophobicContact CZ-CB 3.98Å; F55-F313 AromaticContact CD1-CD2 3.93Å; F55-F313 HydrophobicContact CD1-CD2 3.93Å; F55-F313 HydrophobicContact CD1-CG 4.5Å; F55-F313 HydrophobicContact CE1-CD2 4.43Å; F55-F313 HydrophobicContact CG-CD2 4.29Å
56	K	90.4	Very high	85.5	Confident	125 Å²	125	63.9 Å²	63.9	54%	0.543	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	122.2	175.3	-171.8	174.9	-178.5	178.3	0	110.1	K22 I23 V24	K22-K56 PolarHBondContact O-N 3.37Å; I23-K56 WeakPolarHBondContact CA-O 3.18Å; V24-K56 PolarHBondContact N-O 2.9Å
57	L	91.9	Very high	85.1	Confident	5 Å²	5	67 Å²	67	3%	0.026	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	139.7	176.8	-56.1	178.6	0	0	0	110.2	V24 I26 V43 A46 N47 F55 A306 I309	V24-L57 HydrophobicContact CB-CD2 4.09Å; V24-L57 HydrophobicContact CG1-CD2 4.07Å; V24-L57 CarbonylContact O-C 3.58Å; V24-L57 WeakPolarHBondContact O-CA 3.46Å; I26-L57 HydrophobicContact CD1-CB 4.4Å; I26-L57 HydrophobicContact CD1-CD1 4.07Å; I26-L57 HydrophobicContact CD1-CD2 4.05Å; I26-L57 HydrophobicContact CD1-CG 4.41Å; V43-L57 HydrophobicContact CG1-CB 3.7Å; A46-L57 HydrophobicContact CB-CD1 4.08Å; N47-L57 PolarHBondContact ND2-O 2.85Å; N47-L57 WeakPolarHBondContact OD1-CB 3.36Å; N47-L57 PolarHBondContact OD1-N 2.93Å; F55-L57 HydrophobicContact CD2-CD2 3.82Å; F55-L57 HydrophobicContact CD2-CG 4.21Å; F55-L57 HydrophobicContact CE2-CD2 3.67Å; F55-L57 HydrophobicContact CE2-CG 3.93Å; L57-A306 HydrophobicContact CD1-CB 3.63Å; L57-I309 HydrophobicContact CD2-CD1 3.76Å; L57-I309 HydrophobicContact CD2-CG2 4.27Å
58	N	94.4	Very high	84.9	Confident	76 Å²	76	66.4 Å²	66.4	41%	0.406	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	141.3	175.4	177.9	43.4	0	0	0	110.4	I23 V24 N25 I26	I23-N58 HydrophobicContact CG2-CB 4.01Å; V24-N58 PolarHBondContact O-N 3.22Å; N25-N58 WeakPolarHBondContact OD1-CB 3.5Å; N25-N58 PolarHBondContact OD1-ND2 3.27Å; I26-N58 PolarHBondContact N-O 3.45Å
59	A	94.8	Very high	84.9	Confident	16 Å²	16	65.2 Å²	65.2	13%	0.132	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	112.8	-167.1	0	0	0	0	0	111.8	F39 K40 V43	F39-A59 HydrophobicContact CD1-CB 4.07Å; F39-A59 HydrophobicContact CE1-CB 3.68Å; F39-A59 HydrophobicContact CZ-CB 4.22Å; K40-A59 HydrophobicContact CB-CB 4.48Å; K40-A59 HydrophobicContact CG-CB 3.78Å; V43-A59 HydrophobicContact CB-CB 3.99Å; V43-A59 HydrophobicContact CG1-CB 4.07Å; V43-A59 HydrophobicContact CG2-CB 4.02Å
60	I	94.9	Very high	85	Confident	35 Å²	35	66.6 Å²	66.6	18%	0.179	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.9	179	-50.9	-175.5	0	0	0	108.5	N25 I26 G27 A28 L79	N25-I60 HydrophobicContact CB-CD1 3.87Å; I26-I60 PolarHBondContact O-N 3.02Å; G27-I60 CarbonylContact C-O 3.56Å; G27-I60 VanDerWaalsContact CA-O 3.29Å; G27-I60 WeakPolarHBondContact CA-O 3.38Å; A28-I60 PolarHBondContact N-O 2.72Å; I60-L79 HydrophobicContact CB-CD2 4.33Å; I60-L79 HydrophobicContact CG2-CD2 3.78Å
61	S	93.9	Very high	85.3	Confident	22 Å²	22	64.9 Å²	64.9	15%	0.154	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	141.5	-167.3	60.1	0	0	0	0	113	A28 E36	A28-S61 CarbonylContact O-C 3.5Å; A28-S61 WeakPolarHBondContact O-CA 3.38Å; E36-S61 PolarHBondContact OE2-OG 3.28Å
62	V	92.6	Very high	86.3	Confident	13 Å²	13	65.7 Å²	65.7	8%	0.079	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.7	-179.1	173.2	0	0	0	0	110	A28 V29 L30 M71 S74 D78 L79	A28-V62 PolarHBondContact O-N 3.28Å; V29-V62 WeakPolarHBondContact CA-O 3.45Å; L30-V62 PolarHBondContact N-O 3.21Å; V62-M71 HydrophobicContact CG1-CE 3.93Å; V62-S74 WeakPolarHBondContact CG1-OG 3.26Å; V62-D78 HydrophobicContact CG2-CB 3.73Å; V62-L79 HydrophobicContact CG2-CD2 3.98Å; V62-L79 HydrophobicContact CG2-CG 4.24Å
63	T	88.5	Confident	87.7	Confident	37 Å²	37	60.4 Å²	60.4	23%	0.227	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	137.6	167.4	58.6	0	0	0	0	111.6	L30 K33 E36	L30-T63 WeakPolarHBondContact O-CA 3.48Å; K33-T63 HydrophobicContact CD-CG2 4.46Å; K33-T63 HydrophobicContact CG-CG2 3.5Å; K33-T63 VanDerWaalsContact CG-CG2 3.5Å; E36-T63 WeakPolarHBondContact OE1-CG2 3.36Å
64	H	85.6	Confident	88.8	Confident	36 Å²	36	54 Å²	54	17%	0.167	30%	0.295	C	S	.	.			trans	-44.4	142.9	170.3	-96.7	-67.3	0	0	0	113.9	L30 S90 P92	L30-H64 PolarHBondContact O-N 3.02Å; H64-S90 PolarHBondContact NE2-O 2.93Å; H64-P92 HydrophobicContact CB-CB 4.41Å
65	K	85.3	Confident	89.6	Confident	88 Å²	88	48.7 Å²	48.7	38%	0.383	27%	0.272	S	S	.	.			trans	-110.2	142.8	175.1	-47.5	-63.8	-179.2	171.7	0	109.4	N67 Q70 M71	K65-N67 VanDerWaalsContact C-N 3.3Å; K65-N67 PolarHBondContact O-N 3.24Å; K65-Q70 HydrophobicContact CB-CB 4.24Å; K65-M71 HydrophobicContact CB-CB 4.34Å; K65-M71 HydrophobicContact CB-SD 4.25Å; K65-M71 HydrophobicContact CG-SD 3.96Å
66	A	78.8	Confident	89.8	Confident	117 Å²	117	49.8 Å²	49.8	97%	0.967	28%	0.28	S	S	*	.	S	Bend	trans	-67.8	-25.9	-178.1	0	0	0	0	0	114
67	N	84.5	Confident	89.9	Confident	72 Å²	72	50 Å²	50	39%	0.385	28%	0.283	S	S	.	.	S	Bend	trans	-100.6	122.6	176	-178.3	-20.8	0	0	0	110.3	K65 I69 Q70 M71	K65-N67 VanDerWaalsContact C-N 3.3Å; K65-N67 PolarHBondContact O-N 3.24Å; N67-I69 PolarHBondContact O-N 2.84Å; N67-I69 WeakPolarHBondContact OD1-CB 3.28Å; N67-I69 PolarHBondContact OD1-N 3.02Å; N67-Q70 HydrophobicContact CB-CB 4.23Å; N67-Q70 HydrophobicContact CB-CG 4.04Å; N67-Q70 WeakPolarHBondContact O-CB 3.26Å; N67-Q70 PolarHBondContact O-N 3.44Å; N67-M71 PolarHBondContact O-N 2.94Å
68	A	85.8	Confident	89.8	Confident	23 Å²	23	53.3 Å²	53.3	19%	0.19	30%	0.3	C	S	.	.	H	α-helix	trans	-56.7	-31.7	179.4	0	0	0	0	0	113.9	M71 A72 L99 P103	A68-M71 PolarHBondContact O-N 3.4Å; A68-A72 PolarHBondContact O-N 3.38Å; A68-L99 HydrophobicContact CB-CD1 4.36Å; A68-P103 HydrophobicContact CB-CB 4.39Å; A68-P103 HydrophobicContact CB-CG 4.01Å; A68-P103 WeakPolarHBondContact O-CB 3.33Å
69	I	87.7	Confident	89.8	Confident	117 Å²	117	49.7 Å²	49.7	60%	0.6	28%	0.281	S	S	*	.	H	α-helix	trans	-69.1	-44.5	176.5	-56.8	175	0	0	0	110.3	N67 M71 A72 L73	N67-I69 PolarHBondContact O-N 2.84Å; N67-I69 WeakPolarHBondContact OD1-CB 3.28Å; N67-I69 PolarHBondContact OD1-N 3.02Å; I69-M71 VanDerWaalsContact C-N 3.27Å; I69-M71 PolarHBondContact O-N 2.97Å; I69-A72 PolarHBondContact O-N 2.93Å; I69-L73 HydrophobicContact CG2-CD1 4.35Å; I69-L73 WeakPolarHBondContact O-CG 3.29Å; I69-L73 PolarHBondContact O-N 2.98Å
70	Q	89.1	Confident	89.6	Confident	112 Å²	112	49 Å²	49	52%	0.523	28%	0.275	S	S	.	.	H	α-helix	trans	-64.5	-33.9	175.1	-66.9	176.6	-18.2	0	0	111.5	K65 N67 S74	K65-Q70 HydrophobicContact CB-CB 4.24Å; N67-Q70 HydrophobicContact CB-CB 4.23Å; N67-Q70 HydrophobicContact CB-CG 4.04Å; N67-Q70 WeakPolarHBondContact O-CB 3.26Å; N67-Q70 PolarHBondContact O-N 3.44Å; Q70-S74 VanDerWaalsContact O-CB 3.23Å; Q70-S74 WeakPolarHBondContact O-CB 3.43Å; Q70-S74 PolarHBondContact O-N 3.08Å
71	M	90.3	Very high	89.5	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.02	29%	0.294	C	S	.	.	H	α-helix	trans	-66.5	-42.5	173.4	-164.8	66.1	-105.1	0	0	111.7	V29 V62 K65 N67 A68 I69 S74 V75 P103 V104	V29-M71 HydrophobicContact CB-CE 4.41Å; V29-M71 HydrophobicContact CG1-CE 3.58Å; V29-M71 HydrophobicContact CG1-SD 3.67Å; V29-M71 HydrophobicContact CG2-CE 3.87Å; V62-M71 HydrophobicContact CG1-CE 3.93Å; K65-M71 HydrophobicContact CB-CB 4.34Å; K65-M71 HydrophobicContact CB-SD 4.25Å; K65-M71 HydrophobicContact CG-SD 3.96Å; N67-M71 PolarHBondContact O-N 2.94Å; A68-M71 PolarHBondContact O-N 3.4Å; I69-M71 VanDerWaalsContact C-N 3.27Å; I69-M71 PolarHBondContact O-N 2.97Å; M71-S74 PolarHBondContact O-N 3.38Å; M71-V75 HydrophobicContact CE-CG2 3.94Å; M71-V75 VanDerWaalsContact O-CG2 3.29Å; M71-V75 WeakPolarHBondContact O-CG2 3.29Å; M71-V75 PolarHBondContact O-N 3Å; M71-P103 HydrophobicContact CB-CG 4.32Å; M71-P103 HydrophobicContact CG-CG 4.42Å; M71-V104 HydrophobicContact CG-CG2 4.04Å
72	A	90.8	Very high	89.4	Confident	23 Å²	23	54 Å²	54	19%	0.19	30%	0.299	C	S	.	.	H	α-helix	trans	-63.9	-41.7	175.9	0	0	0	0	0	112.8	A68 I69 V75 C76 P103	A68-A72 PolarHBondContact O-N 3.38Å; I69-A72 PolarHBondContact O-N 2.93Å; A72-V75 PolarHBondContact O-N 3.33Å; A72-C76 PolarHBondContact O-N 3.44Å; A72-C76 VanDerWaalsContact O-N 3.12Å; A72-P103 HydrophobicContact CB-CB 4.12Å
73	L	91.1	Very high	89.4	Confident	90 Å²	90	55.2 Å²	55.2	47%	0.471	30%	0.304	S	S	.	.	H	α-helix	trans	-62.2	-49.8	174.6	-70.9	169.7	0	0	0	111.4	I69 V75 C76 E77	I69-L73 HydrophobicContact CG2-CD1 4.35Å; I69-L73 WeakPolarHBondContact O-CG 3.29Å; I69-L73 PolarHBondContact O-N 2.98Å; L73-V75 VanDerWaalsContact C-N 3.3Å; L73-V75 PolarHBondContact O-N 3.46Å; L73-C76 CarbonylContact O-C 3.4Å; L73-C76 WeakPolarHBondContact O-CA 3.44Å; L73-C76 WeakPolarHBondContact O-CB 3.34Å; L73-C76 PolarHBondContact O-N 2.89Å; L73-E77 PolarHBondContact O-N 3.4Å
74	S	91.5	Very high	89.7	Confident	7 Å²	7	53.4 Å²	53.4	5%	0.049	29%	0.293	C	S	.	.	H	α-helix	trans	-61.3	-34.3	177.4	-178.9	0	0	0	0	112.6	V62 Q70 M71 C76 D78	V62-S74 WeakPolarHBondContact CG1-OG 3.26Å; Q70-S74 VanDerWaalsContact O-CB 3.23Å; Q70-S74 WeakPolarHBondContact O-CB 3.43Å; Q70-S74 PolarHBondContact O-N 3.08Å; M71-S74 PolarHBondContact O-N 3.38Å; S74-C76 PolarHBondContact O-N 2.71Å; S74-D78 WeakPolarHBondContact CA-OD2 3.28Å; S74-D78 WeakPolarHBondContact CB-OD2 3.5Å; S74-D78 VanDerWaalsContact O-CB 3.24Å; S74-D78 WeakPolarHBondContact O-CB 3.4Å; S74-D78 PolarHBondContact O-N 2.81Å; S74-D78 PolarHBondContact OG-OD2 3.11Å
75	V	92.3	Very high	90	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.286	C	S	.	.	I	π-helix	trans	-63.9	-38.8	169.3	169.9	0	0	0	0	111.9	V29 M71 A72 L73 L79 I80 I87 V104 T107	V29-V75 HydrophobicContact CG2-CG2 4.21Å; M71-V75 HydrophobicContact CE-CG2 3.94Å; M71-V75 VanDerWaalsContact O-CG2 3.29Å; M71-V75 WeakPolarHBondContact O-CG2 3.29Å; M71-V75 PolarHBondContact O-N 3Å; A72-V75 PolarHBondContact O-N 3.33Å; L73-V75 VanDerWaalsContact C-N 3.3Å; L73-V75 PolarHBondContact O-N 3.46Å; V75-L79 HydrophobicContact CG2-CD1 4.37Å; V75-L79 WeakPolarHBondContact O-CB 3.47Å; V75-L79 PolarHBondContact O-N 2.9Å; V75-I80 HydrophobicContact CG1-CD1 3.95Å; V75-I80 HydrophobicContact CG1-CG1 4.3Å; V75-I80 WeakPolarHBondContact O-CG1 3.3Å; V75-I80 PolarHBondContact O-N 3.15Å; V75-I87 HydrophobicContact CG1-CD1 4.09Å; V75-V104 HydrophobicContact CG2-CB 4.36Å; V75-V104 HydrophobicContact CG2-CG1 4.03Å; V75-V104 HydrophobicContact CG2-CG2 4.02Å; V75-T107 HydrophobicContact CB-CG2 4.33Å; V75-T107 HydrophobicContact CG1-CG2 3.79Å
76	C	91.9	Very high	90.5	Very high	27 Å²	27	47.9 Å²	47.9	18%	0.182	27%	0.268	C	S	.	.	I	π-helix	trans	-70.9	-42.8	176.9	-92.5	0	0	0	0	113.6	A72 L73 S74 H81 T107 C325	A72-C76 PolarHBondContact O-N 3.44Å; A72-C76 VanDerWaalsContact O-N 3.12Å; L73-C76 CarbonylContact O-C 3.4Å; L73-C76 WeakPolarHBondContact O-CA 3.44Å; L73-C76 WeakPolarHBondContact O-CB 3.34Å; L73-C76 PolarHBondContact O-N 2.89Å; S74-C76 PolarHBondContact O-N 2.71Å; C76-H81 PolarHBondContact O-N 3.12Å; C76-H81 VanDerWaalsContact O-N 3.16Å; C76-T107 VanDerWaalsContact SG-CG2 3.56Å; C76-C325 WeakPolarHBondContact CA-SG 3.3Å; C76-C325 HydrophobicContact CB-CB 3.73Å; C76-C325 WeakPolarHBondContact CB-SG 3.16Å; C76-C325 WeakPolarHBondContact SG-CB 3.23Å; C76-C325 CovalentContact SG-SG 2.04Å; C76-C325 PolarHBondContact SG-SG 3.31Å
77	E	91.6	Very high	91.3	Very high	129 Å²	129	42.3 Å²	42.3	60%	0.603	22%	0.222	S	C	*	.	I	π-helix	trans	-86.7	-43.5	-171.7	-68	174.9	172.8	0	0	112.8	L73 H81	L73-E77 PolarHBondContact O-N 3.4Å; E77-H81 WeakPolarHBondContact O-CB 3.26Å
78	D	91.5	Very high	91.8	Very high	75 Å²	75	38.9 Å²	38.9	40%	0.401	20%	0.204	S	C	.	.	I	π-helix	trans	-88.5	-39.7	-177.2	-55.6	-62.5	0	0	0	112.5	V62 S74 S82	V62-D78 HydrophobicContact CG2-CB 3.73Å; S74-D78 WeakPolarHBondContact CA-OD2 3.28Å; S74-D78 WeakPolarHBondContact CB-OD2 3.5Å; S74-D78 VanDerWaalsContact O-CB 3.24Å; S74-D78 WeakPolarHBondContact O-CB 3.4Å; S74-D78 PolarHBondContact O-N 2.81Å; S74-D78 PolarHBondContact OG-OD2 3.11Å; D78-S82 PolarHBondContact O-OG 3Å
79	L	92.8	Very high	92.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.195	C	C	.	.	I	π-helix	trans	-97.9	-56.7	-173	-57.1	-176.8	0	0	0	113.3	V29 I60 V62 V75 H81 S82 V84 I87	V29-L79 HydrophobicContact CG2-CD1 3.75Å; I60-L79 HydrophobicContact CB-CD2 4.33Å; I60-L79 HydrophobicContact CG2-CD2 3.78Å; V62-L79 HydrophobicContact CG2-CD2 3.98Å; V62-L79 HydrophobicContact CG2-CG 4.24Å; V75-L79 HydrophobicContact CG2-CD1 4.37Å; V75-L79 WeakPolarHBondContact O-CB 3.47Å; V75-L79 PolarHBondContact O-N 2.9Å; L79-H81 PolarHBondContact O-N 3.45Å; L79-S82 CarbonylContact O-C 3.6Å; L79-S82 WeakPolarHBondContact O-CA 3.39Å; L79-S82 WeakPolarHBondContact O-CB 3.24Å; L79-S82 PolarHBondContact O-N 3.49Å; L79-S82 VanDerWaalsContact O-N 3.11Å; L79-V84 HydrophobicContact CB-CG1 4.37Å; L79-V84 HydrophobicContact CB-CG2 4.13Å; L79-V84 WeakPolarHBondContact O-CG1 3.28Å; L79-I87 HydrophobicContact CD1-CD1 4.25Å; L79-I87 HydrophobicContact CD1-CG1 4.4Å; L79-I87 HydrophobicContact CD1-CG2 4.1Å
80	I	92.2	Very high	92.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.166	C	C	.	.	I	π-helix	trans	-71.5	-32.2	-174.8	-63.5	171.7	0	0	0	111.4	V75 S82 Q83 T107 Y111 I113 P322 G324	V75-I80 HydrophobicContact CG1-CD1 3.95Å; V75-I80 HydrophobicContact CG1-CG1 4.3Å; V75-I80 WeakPolarHBondContact O-CG1 3.3Å; V75-I80 PolarHBondContact O-N 3.15Å; I80-S82 PolarHBondContact O-N 2.84Å; I80-Q83 PolarHBondContact O-N 3.04Å; I80-Q83 VanDerWaalsContact O-N 3.11Å; I80-T107 HydrophobicContact CD1-CG2 3.82Å; I80-Y111 HydrophobicContact CD1-CD2 4.12Å; I80-Y111 HydrophobicContact CD1-CE2 4.38Å; I80-I113 HydrophobicContact CG1-CD1 4.27Å; I80-P322 HydrophobicContact CG2-CG 4.29Å; I80-G324 PolarHBondContact O-N 3.04Å
81	H	91.4	Very high	91.9	Very high	127 Å²	127	29 Å²	29	59%	0.588	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-39.1	169.1	-169.7	79.3	0	0	0	112	C76 E77 L79 Q83	C76-H81 PolarHBondContact O-N 3.12Å; C76-H81 VanDerWaalsContact O-N 3.16Å; E77-H81 WeakPolarHBondContact O-CB 3.26Å; L79-H81 PolarHBondContact O-N 3.45Å; H81-Q83 VanDerWaalsContact C-N 3.27Å; H81-Q83 PolarHBondContact O-N 2.85Å
82	S	91.6	Very high	91.4	Very high	36 Å²	36	30.4 Å²	30.4	25%	0.252	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	16.2	-179.6	-52.4	0	0	0	0	114.6	N25 D78 L79 I80 V84	N25-S82 WeakPolarHBondContact CB-O 3.34Å; N25-S82 PolarHBondContact ND2-O 3.44Å; D78-S82 PolarHBondContact O-OG 3Å; L79-S82 CarbonylContact O-C 3.6Å; L79-S82 WeakPolarHBondContact O-CA 3.39Å; L79-S82 WeakPolarHBondContact O-CB 3.24Å; L79-S82 PolarHBondContact O-N 3.49Å; L79-S82 VanDerWaalsContact O-N 3.11Å; I80-S82 PolarHBondContact O-N 2.84Å; S82-V84 PolarHBondContact O-N 3.18Å
83	Q	92.4	Very high	90.2	Very high	38 Å²	38	33.2 Å²	33.2	18%	0.178	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	46.9	175.4	-62.7	-172.2	-87.2	0	0	114.5	I80 H81 Y85 E320 P321 K323	I80-Q83 PolarHBondContact O-N 3.04Å; I80-Q83 VanDerWaalsContact O-N 3.11Å; H81-Q83 VanDerWaalsContact C-N 3.27Å; H81-Q83 PolarHBondContact O-N 2.85Å; Q83-Y85 WeakPolarHBondContact O-CD2 3.41Å; Q83-E320 PolarHBondContact NE2-OE2 2.7Å; Q83-P321 HydrophobicContact CB-CG 4.04Å; Q83-P321 PolarHBondContact NE2-O 2.88Å; Q83-P321 VanDerWaalsContact O-CG 3.31Å; Q83-P321 WeakPolarHBondContact O-CG 3.45Å; Q83-K323 VanDerWaalsContact CD-CG 3.43Å; Q83-K323 HydrophobicContact CG-CB 4.48Å; Q83-K323 HydrophobicContact CG-CG 3.53Å
84	V	94.6	Very high	88.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	134.2	177.8	-67.6	0	0	0	0	112.7	N25 L79 S82 I87	N25-V84 HydrophobicContact CB-CG1 4.17Å; N25-V84 WeakPolarHBondContact O-CA 3.37Å; L79-V84 HydrophobicContact CB-CG1 4.37Å; L79-V84 HydrophobicContact CB-CG2 4.13Å; L79-V84 WeakPolarHBondContact O-CG1 3.28Å; S82-V84 PolarHBondContact O-N 3.18Å; V84-I87 HydrophobicContact CG2-CD1 3.93Å; V84-I87 HydrophobicContact CG2-CG1 3.73Å
85	Y	93.6	Very high	87.1	Confident	7 Å²	7	41.1 Å²	41.1	3%	0.027	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-31.5	179.9	-83	-116.2	0	0	0	112.6	V24 N25 Q83 F313 P321 W332 F338	V24-Y85 HydrophobicContact CG1-CD1 4.28Å; V24-Y85 HydrophobicContact CG1-CD2 3.79Å; V24-Y85 HydrophobicContact CG1-CE2 4.18Å; V24-Y85 HydrophobicContact CG1-CG 3.85Å; N25-Y85 PolarHBondContact O-N 3.44Å; Q83-Y85 WeakPolarHBondContact O-CD2 3.41Å; Y85-F313 HydrophobicContact CE1-CZ 4.26Å; Y85-P321 HydrophobicContact CD2-CG 3.8Å; Y85-P321 HydrophobicContact CE2-CG 3.83Å; Y85-P321 HydrophobicContact CG-CG 4.39Å; Y85-W332 AromaticContact CD1-CH2 3.82Å; Y85-W332 HydrophobicContact CD1-CH2 3.82Å; Y85-W332 AromaticContact CD1-CZ2 3.89Å; Y85-W332 HydrophobicContact CD1-CZ2 3.89Å; Y85-W332 HydrophobicContact CE1-CH2 4.45Å; Y85-W332 HydrophobicContact CE1-CZ2 4.05Å; Y85-W332 HydrophobicContact CG-CH2 4.23Å; Y85-F338 WeakPolarHBondContact O-CE1 3.26Å
86	A	95.4	Very high	85.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	156.2	172.8	0	0	0	0	0	109.7	G27 P114 V305 F338	G27-A86 PolarHBondContact N-O 3.3Å; A86-P114 WeakPolarHBondContact CA-O 3.36Å; A86-V305 HydrophobicContact CB-CG1 4.29Å; A86-F338 HydrophobicContact CB-CE1 4.05Å
87	I	95.8	Very high	83.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	116.2	174.6	-61.3	172.3	0	0	0	109.8	G27 V29 V75 L79 V84 V104 A108 I113 P114 V115 V116	G27-I87 CarbonylContact O-C 3.55Å; G27-I87 WeakPolarHBondContact O-CA 3.3Å; V29-I87 HydrophobicContact CG2-CG2 4.32Å; V75-I87 HydrophobicContact CG1-CD1 4.09Å; L79-I87 HydrophobicContact CD1-CD1 4.25Å; L79-I87 HydrophobicContact CD1-CG1 4.4Å; L79-I87 HydrophobicContact CD1-CG2 4.1Å; V84-I87 HydrophobicContact CG2-CD1 3.93Å; V84-I87 HydrophobicContact CG2-CG1 3.73Å; I87-V104 HydrophobicContact CG2-CG1 3.82Å; I87-A108 HydrophobicContact CD1-CB 4.15Å; I87-I113 HydrophobicContact CG1-CG2 4.42Å; I87-P114 PolarHBondContact N-O 3.04Å; I87-V115 CarbonylContact O-C 3.58Å; I87-V115 VanDerWaalsContact O-CA 3.28Å; I87-V115 WeakPolarHBondContact O-CA 3.29Å; I87-V116 PolarHBondContact O-N 2.88Å
88	L	95.5	Very high	81.4	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	142.9	167.8	-78.5	67.4	0	0	0	109.1	I26 G27 A28 V29 F39 V116 L118 A301 V302 V305	I26-L88 HydrophobicContact CG2-CD1 3.74Å; G27-L88 PolarHBondContact O-N 3.44Å; A28-L88 CarbonylContact C-O 3.57Å; A28-L88 VanDerWaalsContact CA-O 3.31Å; A28-L88 WeakPolarHBondContact CA-O 3.02Å; A28-L88 HydrophobicContact CB-CB 4.18Å; V29-L88 PolarHBondContact N-O 3.45Å; F39-L88 HydrophobicContact CD2-CD2 4.24Å; F39-L88 HydrophobicContact CE2-CD2 4.08Å; L88-V116 CarbonylContact C-O 3.51Å; L88-V116 WeakPolarHBondContact CA-O 3.39Å; L88-V116 HydrophobicContact CG-CB 4.49Å; L88-L118 HydrophobicContact CB-CD1 4.26Å; L88-L118 HydrophobicContact CD2-CD2 4.23Å; L88-L118 HydrophobicContact CG-CD2 4.42Å; L88-A301 HydrophobicContact CD2-CB 3.78Å; L88-A301 HydrophobicContact CG-CB 4.25Å; L88-V302 HydrophobicContact CD2-CG2 3.79Å; L88-V305 HydrophobicContact CD1-CG2 4.42Å
89	V	92.8	Very high	79.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	125.4	177.3	64.7	0	0	0	0	113.3	V29 P101 V104 V115 V116 G117 L118 F134	V29-V89 HydrophobicContact CB-CB 4.47Å; V29-V89 HydrophobicContact CB-CG2 4.01Å; V29-V89 HydrophobicContact CG1-CG2 4.34Å; V29-V89 WeakPolarHBondContact O-CA 3.34Å; V89-P101 HydrophobicContact CB-CB 4.38Å; V89-P101 HydrophobicContact CG1-CB 4.12Å; V89-P101 HydrophobicContact CG1-CG 4.2Å; V89-P101 HydrophobicContact CG2-CB 3.35Å; V89-P101 HydrophobicContact CG2-CG 3.96Å; V89-V104 HydrophobicContact CG2-CG2 4.27Å; V89-V115 HydrophobicContact CB-CG1 4.5Å; V89-V115 HydrophobicContact CG1-CG1 3.57Å; V89-V116 PolarHBondContact N-O 3.1Å; V89-G117 CarbonylContact O-C 3.51Å; V89-G117 WeakPolarHBondContact O-CA 3.38Å; V89-L118 PolarHBondContact O-N 2.83Å; V89-F134 HydrophobicContact CG1-CE2 4.12Å; V89-F134 HydrophobicContact CG1-CZ 4.47Å
90	S	89	Confident	78.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-93.7	171.6	172.8	95.7	0	0	0	0	111.5	V29 S31 H64 E294	V29-S90 PolarHBondContact O-N 3.29Å; S31-S90 WeakPolarHBondContact CB-OG 3.4Å; S31-S90 PolarHBondContact N-OG 3.15Å; H64-S90 PolarHBondContact NE2-O 2.93Å; S90-E294 VanDerWaalsContact CB-OE1 3.29Å; S90-E294 WeakPolarHBondContact CB-OE1 3.08Å; S90-E294 PolarHBondContact OG-OE1 3.15Å
91	H	82.4	Confident	77.7	Confident	45 Å²	45	51.4 Å²	51.4	21%	0.208	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-82.8	147.2	168.7	-174.6	91.4	0	0	0	109.9	S31 T119	S31-H91 VanDerWaalsContact CB-O 3.3Å; S31-H91 WeakPolarHBondContact CB-O 3.4Å; H91-T119 PolarHBondContact N-OG1 2.74Å
92	P	78.5	Confident	77.5	Confident	32 Å²	32	46.7 Å²	46.7	21%	0.208	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-67.4	162.9	177.7	28.1	-36.6	0	0	0	113	H64 Q94	H64-P92 HydrophobicContact CB-CB 4.41Å; P92-Q94 VanDerWaalsContact C-N 3.3Å; P92-Q94 PolarHBondContact O-N 2.82Å
93	P	66.3	Low	77.4	Confident	83 Å²	83	45.7 Å²	45.7	54%	0.539	25%	0.253	S	S	.	.	S	Bend	trans	-71.8	-14.4	-178.1	-17.9	31	0	0	0	116	S31 Q32	S31-P93 WeakPolarHBondContact O-CG 3.45Å; Q32-P93 HydrophobicContact CG-CG 4.06Å
94	Q	63.3	Low	77.3	Confident	154 Å²	154	43.9 Å²	43.9	72%	0.72	25%	0.245	S	C	*	.	S	Bend	trans	-106.9	124.8	-176.7	-73.6	-179.5	-27.4	0	0	110	P92 S96	P92-Q94 VanDerWaalsContact C-N 3.3Å; P92-Q94 PolarHBondContact O-N 2.82Å; Q94-S96 PolarHBondContact O-N 2.95Å
95	S	53.8	Low	77.1	Confident	109 Å²	109	44 Å²	44	76%	0.762	25%	0.245	S	C	*	.			trans	-82.2	49.6	-172.6	59.6	0	0	0	0	113.6	D97	S95-D97 PolarHBondContact O-N 2.91Å
96	S	55.1	Low	77	Confident	76 Å²	76	49.5 Å²	49.5	53%	0.531	27%	0.267	S	S	.	.			trans	-80.8	103.4	160.5	55.3	0	0	0	0	107.7	Q94 H98	Q94-S96 PolarHBondContact O-N 2.95Å; S96-H98 PolarHBondContact O-N 3.17Å
97	D	52	Low	76.9	Confident	72 Å²	72	50.8 Å²	50.8	39%	0.385	28%	0.275	S	S	.	.			trans	-62.6	-7.7	-172.1	-94.1	-14.3	0	0	0	114.6	S95 R269	S95-D97 PolarHBondContact O-N 2.91Å; D97-R269 IonicContact OD2-CZ 2.98Å; D97-R269 IonicContact OD2-NH2 3.94Å; D97-R269 PolarHBondContact OD2-NH2 3.32Å
98	H	50.3	Low	76.7	Confident	162 Å²	162	50.8 Å²	50.8	75%	0.75	28%	0.275	S	S	*	.	S	Bend	trans	-95.6	130.8	176.2	-49.2	-53.2	0	0	0	111.3	S96	S96-H98 PolarHBondContact O-N 3.17Å
99	L	56.8	Low	76.5	Confident	130 Å²	130	51.2 Å²	51.2	68%	0.681	28%	0.279	S	S	*	.	S	Bend	trans	70.3	45.7	177.6	-52.9	174.3	0	0	0	116	A68	A68-L99 HydrophobicContact CB-CD1 4.36Å
100	T	63.7	Low	76.5	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.031	30%	0.303	C	S	.	.			trans	-58	-175.7	153.5	79.6	0	0	0	0	111.4	T102 M122 Y125	T100-T102 PolarHBondContact O-N 2.56Å; T100-T102 PolarHBondContact O-OG1 2.78Å; T100-M122 HydrophobicContact CG2-CE 3.64Å; T100-M122 WeakPolarHBondContact OG1-CE 3.41Å; T100-Y125 PolarHBondContact OG1-OH 2.88Å
101	P	77.1	Confident	76.7	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.013	31%	0.305	C	S	.	.	S	Bend	trans	-70.8	29.5	-158.8	31.6	-38.2	0	0	0	118.9	V89 P103 V104 S105 T120 Y125	V89-P101 HydrophobicContact CB-CB 4.38Å; V89-P101 HydrophobicContact CG1-CB 4.12Å; V89-P101 HydrophobicContact CG1-CG 4.2Å; V89-P101 HydrophobicContact CG2-CB 3.35Å; V89-P101 HydrophobicContact CG2-CG 3.96Å; P101-P103 VanDerWaalsContact C-CD 3.45Å; P101-V104 HydrophobicContact CB-CG2 4.34Å; P101-V104 PolarHBondContact O-N 2.81Å; P101-S105 PolarHBondContact O-N 3.38Å; P101-S105 VanDerWaalsContact O-N 3.1Å; P101-T120 HydrophobicContact CG-CG2 4.06Å; P101-Y125 WeakPolarHBondContact CD-OH 3.39Å; P101-Y125 VanDerWaalsContact N-OH 3.17Å
102	T	86.5	Confident	77.2	Confident	28 Å²	28	59.1 Å²	59.1	17%	0.172	31%	0.311	C	S	.	.	H	α-helix	trans	-49.7	-43.5	167.9	57.6	0	0	0	0	114.4	T100 V104 S105 Y106 Y125	T100-T102 PolarHBondContact O-N 2.56Å; T100-T102 PolarHBondContact O-OG1 2.78Å; T102-V104 PolarHBondContact O-N 3.36Å; T102-S105 PolarHBondContact O-N 3.24Å; T102-Y106 WeakPolarHBondContact O-CD2 3.39Å; T102-Y106 PolarHBondContact O-N 3.23Å; T102-Y125 HydrophobicContact CG2-CE1 3.98Å; T102-Y125 VanDerWaalsContact CG2-OH 3.3Å; T102-Y125 WeakPolarHBondContact CG2-OH 3.29Å; T102-Y125 PolarHBondContact N-OH 2.93Å
103	P	89.6	Confident	78	Confident	16 Å²	16	57.7 Å²	57.7	10%	0.104	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-43.3	178.6	23.3	-34.9	0	0	0	112	A68 M71 A72 P101 S105 Y106 T107	A68-P103 HydrophobicContact CB-CB 4.39Å; A68-P103 HydrophobicContact CB-CG 4.01Å; A68-P103 WeakPolarHBondContact O-CB 3.33Å; M71-P103 HydrophobicContact CB-CG 4.32Å; M71-P103 HydrophobicContact CG-CG 4.42Å; A72-P103 HydrophobicContact CB-CB 4.12Å; P101-P103 VanDerWaalsContact C-CD 3.45Å; P103-S105 VanDerWaalsContact C-N 3.32Å; P103-S105 PolarHBondContact O-N 2.97Å; P103-Y106 PolarHBondContact O-N 3.06Å; P103-T107 WeakPolarHBondContact O-CB 3.49Å; P103-T107 PolarHBondContact O-N 3.16Å; P103-T107 PolarHBondContact O-OG1 3.04Å; P103-T107 VanDerWaalsContact O-OG1 3.09Å
104	V	90.6	Very high	79.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-43.8	177.1	-170.5	0	0	0	0	110.3	V29 M71 V75 I87 V89 P101 T102 A108	V29-V104 HydrophobicContact CG1-CG2 4.49Å; V29-V104 HydrophobicContact CG2-CG1 4.34Å; V29-V104 HydrophobicContact CG2-CG2 4.34Å; M71-V104 HydrophobicContact CG-CG2 4.04Å; V75-V104 HydrophobicContact CG2-CB 4.36Å; V75-V104 HydrophobicContact CG2-CG1 4.03Å; V75-V104 HydrophobicContact CG2-CG2 4.02Å; I87-V104 HydrophobicContact CG2-CG1 3.82Å; V89-V104 HydrophobicContact CG2-CG2 4.27Å; P101-V104 HydrophobicContact CB-CG2 4.34Å; P101-V104 PolarHBondContact O-N 2.81Å; T102-V104 PolarHBondContact O-N 3.36Å; V104-A108 VanDerWaalsContact O-CB 3.27Å; V104-A108 WeakPolarHBondContact O-CB 3.43Å; V104-A108 PolarHBondContact O-N 2.79Å; V104-A108 VanDerWaalsContact O-N 3.07Å
105	S	91.8	Very high	80.9	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.014	24%	0.241	C	C	.	.	H	α-helix	trans	-66.1	-37.7	178.4	-175.5	0	0	0	0	113.6	P101 T102 P103 G109 H131	P101-S105 PolarHBondContact O-N 3.38Å; P101-S105 VanDerWaalsContact O-N 3.1Å; T102-S105 PolarHBondContact O-N 3.24Å; P103-S105 VanDerWaalsContact C-N 3.32Å; P103-S105 PolarHBondContact O-N 2.97Å; S105-G109 VanDerWaalsContact O-CA 3.3Å; S105-G109 WeakPolarHBondContact O-CA 3.36Å; S105-G109 PolarHBondContact O-N 3.32Å; S105-H131 WeakPolarHBondContact CB-ND1 3.31Å; S105-H131 PolarHBondContact OG-ND1 2.85Å
106	Y	91.7	Very high	82.9	Confident	122 Å²	122	41.3 Å²	41.3	48%	0.478	21%	0.206	S	C	.	.	H	α-helix	trans	-72.7	-47.7	177.9	-75.3	-60.9	0	0	0	111.6	T102 P103 A108 G109 F110 I130 H131	T102-Y106 WeakPolarHBondContact O-CD2 3.39Å; T102-Y106 PolarHBondContact O-N 3.23Å; P103-Y106 PolarHBondContact O-N 3.06Å; Y106-A108 PolarHBondContact O-N 2.79Å; Y106-G109 PolarHBondContact O-N 2.94Å; Y106-G109 VanDerWaalsContact O-N 3.15Å; Y106-F110 PolarHBondContact O-N 2.94Å; Y106-I130 HydrophobicContact CE1-CG2 3.88Å; Y106-I130 WeakPolarHBondContact OH-CG2 3.5Å; Y106-H131 AromaticContact CE2-CE1 3.86Å; Y106-H131 AromaticContact CZ-CE1 3.77Å
107	T	91.4	Very high	84.7	Confident	27 Å²	27	37.7 Å²	37.7	17%	0.166	18%	0.181	C	C	.	.	H	α-helix	trans	-61.6	-44.9	-179.4	-59.8	0	0	0	0	112	V75 C76 I80 P103	V75-T107 HydrophobicContact CB-CG2 4.33Å; V75-T107 HydrophobicContact CG1-CG2 3.79Å; C76-T107 VanDerWaalsContact SG-CG2 3.56Å; I80-T107 HydrophobicContact CD1-CG2 3.82Å; P103-T107 WeakPolarHBondContact O-CB 3.49Å; P103-T107 PolarHBondContact O-N 3.16Å; P103-T107 PolarHBondContact O-OG1 3.04Å; P103-T107 VanDerWaalsContact O-OG1 3.09Å
108	A	92.1	Very high	86.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71.2	-35	173.4	0	0	0	0	0	112.5	I87 V104 Y106 F110 Y111 R112 I113 V115	I87-A108 HydrophobicContact CD1-CB 4.15Å; V104-A108 VanDerWaalsContact O-CB 3.27Å; V104-A108 WeakPolarHBondContact O-CB 3.43Å; V104-A108 PolarHBondContact O-N 2.79Å; V104-A108 VanDerWaalsContact O-N 3.07Å; Y106-A108 PolarHBondContact O-N 2.79Å; A108-F110 VanDerWaalsContact C-N 3.31Å; A108-F110 PolarHBondContact O-N 2.89Å; A108-Y111 PolarHBondContact O-N 2.85Å; A108-R112 PolarHBondContact O-N 2.86Å; A108-R112 VanDerWaalsContact O-N 3.07Å; A108-I113 HydrophobicContact CB-CB 4.21Å; A108-I113 PolarHBondContact O-N 3.18Å; A108-V115 HydrophobicContact CB-CG2 3.41Å; A108-V115 VanDerWaalsContact CB-CG2 3.41Å
109	G	92.3	Very high	88.1	Confident	10 Å²	10	27.5 Å²	27.5	10%	0.103	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-28.9	179.8	0	0	0	0	0	114.2	S105 Y106 R112 S133	S105-G109 VanDerWaalsContact O-CA 3.3Å; S105-G109 WeakPolarHBondContact O-CA 3.36Å; S105-G109 PolarHBondContact O-N 3.32Å; Y106-G109 PolarHBondContact O-N 2.94Å; Y106-G109 VanDerWaalsContact O-N 3.15Å; G109-R112 WeakPolarHBondContact O-CD 3.31Å; G109-R112 PolarHBondContact O-N 3.47Å; G109-R112 PolarHBondContact O-NH1 2.66Å; G109-S133 WeakPolarHBondContact CA-OG 3.47Å
110	F	91.9	Very high	89.5	Confident	113 Å²	113	21.4 Å²	21.4	50%	0.496	10%	0.1	S	C	.	.	H	α-helix	trans	-58.8	-55	170.8	-178.4	-96	0	0	0	111	Y106 A108 R112	Y106-F110 PolarHBondContact O-N 2.94Å; A108-F110 VanDerWaalsContact C-N 3.31Å; A108-F110 PolarHBondContact O-N 2.89Å; F110-R112 PolarHBondContact O-N 3.5Å
111	Y	92.8	Very high	90.8	Very high	13 Å²	13	21.6 Å²	21.6	5%	0.051	10%	0.101	C	C	.	.	H	α-helix	trans	-76	-4.9	178.9	-63.8	-68.9	0	0	0	114.5	I80 A108 I113 P322 C325 N328 W332	I80-Y111 HydrophobicContact CD1-CD2 4.12Å; I80-Y111 HydrophobicContact CD1-CE2 4.38Å; A108-Y111 PolarHBondContact O-N 2.85Å; Y111-I113 VanDerWaalsContact C-N 3.31Å; Y111-P322 HydrophobicContact CD1-CB 4.44Å; Y111-P322 HydrophobicContact CD1-CG 3.68Å; Y111-P322 HydrophobicContact CE1-CG 4.15Å; Y111-P322 HydrophobicContact CG-CG 3.9Å; Y111-C325 HydrophobicContact CE2-CB 4.5Å; Y111-C325 WeakPolarHBondContact OH-CA 3.14Å; Y111-C325 PolarHBondContact OH-O 2.85Å; Y111-N328 PolarHBondContact OH-O 3.42Å; Y111-W332 VanDerWaalsContact O-CB 3.24Å; Y111-W332 WeakPolarHBondContact O-CB 3.46Å; Y111-W332 PolarHBondContact O-N 2.98Å
112	R	93.5	Very high	91.3	Very high	86 Å²	86	23.8 Å²	23.8	33%	0.325	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	25.9	-173.4	-50	-60.5	-173.7	-146.6	11.6	114.3	A108 G109 F110 I331 G335 P336	A108-R112 PolarHBondContact O-N 2.86Å; A108-R112 VanDerWaalsContact O-N 3.07Å; G109-R112 WeakPolarHBondContact O-CD 3.31Å; G109-R112 PolarHBondContact O-N 3.47Å; G109-R112 PolarHBondContact O-NH1 2.66Å; F110-R112 PolarHBondContact O-N 3.5Å; R112-I331 HydrophobicContact CG-CB 4.17Å; R112-I331 HydrophobicContact CG-CG2 4.29Å; R112-G335 CarbonylContact O-C 3.6Å; R112-G335 WeakPolarHBondContact O-CA 3.37Å; R112-P336 HydrophobicContact CB-CG 4.06Å; R112-P336 HydrophobicContact CG-CG 4.25Å
113	I	94.9	Very high	91.5	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	10%	0.104	C	C	.	.			trans	-73.3	126.5	172.1	-64.2	166.5	0	0	0	108.6	I80 I87 A108 Y111 S133 W332	I80-I113 HydrophobicContact CG1-CD1 4.27Å; I87-I113 HydrophobicContact CG1-CG2 4.42Å; A108-I113 HydrophobicContact CB-CB 4.21Å; A108-I113 PolarHBondContact O-N 3.18Å; Y111-I113 VanDerWaalsContact C-N 3.31Å; I113-S133 WeakPolarHBondContact O-CB 3.48Å; I113-S133 PolarHBondContact O-OG 3.48Å; I113-W332 HydrophobicContact CG1-CE3 3.9Å; I113-W332 HydrophobicContact CG1-CZ3 4.3Å
114	P	95.7	Very high	91.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.111	C	C	.	.			trans	-61.2	138	176.3	-26	36.5	0	0	0	113.5	A86 I87 S133 F338 K339 L342	A86-P114 WeakPolarHBondContact CA-O 3.36Å; I87-P114 PolarHBondContact N-O 3.04Å; P114-S133 WeakPolarHBondContact CA-O 3.24Å; P114-F338 HydrophobicContact CG-CD1 3.79Å; P114-F338 HydrophobicContact CG-CE1 4.31Å; P114-F338 HydrophobicContact CG-CG 4.45Å; P114-K339 HydrophobicContact CG-CB 4.17Å; P114-L342 HydrophobicContact CB-CD2 4.01Å
115	V	95	Very high	91.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	131.9	175.6	-178.7	0	0	0	0	109.4	I87 V89 A108 S133 F134 L135	I87-V115 CarbonylContact O-C 3.58Å; I87-V115 VanDerWaalsContact O-CA 3.28Å; I87-V115 WeakPolarHBondContact O-CA 3.29Å; V89-V115 HydrophobicContact CB-CG1 4.5Å; V89-V115 HydrophobicContact CG1-CG1 3.57Å; A108-V115 HydrophobicContact CB-CG2 3.41Å; A108-V115 VanDerWaalsContact CB-CG2 3.41Å; V115-S133 PolarHBondContact N-O 3.31Å; V115-F134 HydrophobicContact CB-CD2 3.93Å; V115-F134 HydrophobicContact CB-CE2 4.35Å; V115-F134 HydrophobicContact CG1-CD2 3.73Å; V115-F134 HydrophobicContact CG1-CE2 3.65Å; V115-L135 PolarHBondContact O-N 3.22Å
116	V	95.1	Very high	91.5	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.018	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	104.6	-179.5	-176.3	0	0	0	0	110	I87 L88 V89 L135 T137 A301 V305 L342	I87-V116 PolarHBondContact O-N 2.88Å; L88-V116 CarbonylContact C-O 3.51Å; L88-V116 WeakPolarHBondContact CA-O 3.39Å; L88-V116 HydrophobicContact CG-CB 4.49Å; V89-V116 PolarHBondContact N-O 3.1Å; V116-L135 CarbonylContact C-O 3.45Å; V116-L135 WeakPolarHBondContact CA-O 3.38Å; V116-T137 HydrophobicContact CG1-CG2 4.09Å; V116-A301 HydrophobicContact CG1-CB 4.13Å; V116-V305 HydrophobicContact CG2-CG2 4.32Å; V116-L342 HydrophobicContact CG2-CD2 3.98Å
117	G	93	Very high	91.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	126.1	174.7	0	0	0	0	0	112.4	V89 L135 R136 T137	V89-G117 CarbonylContact O-C 3.51Å; V89-G117 WeakPolarHBondContact O-CA 3.38Å; G117-L135 PolarHBondContact N-O 2.95Å; G117-R136 CarbonylContact O-C 3.6Å; G117-R136 WeakPolarHBondContact O-CA 3.24Å; G117-R136 WeakPolarHBondContact O-CB 2.98Å; G117-T137 PolarHBondContact O-N 2.66Å; G117-T137 PolarHBondContact O-OG1 3.13Å
118	L	90.6	Very high	91.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	-92.5	-41.1	-176.5	-58.1	172.3	0	0	0	112.6	L30 L88 V89 V138 H297 I298 A301	L30-L118 HydrophobicContact CD2-CD1 3.96Å; L88-L118 HydrophobicContact CB-CD1 4.26Å; L88-L118 HydrophobicContact CD2-CD2 4.23Å; L88-L118 HydrophobicContact CG-CD2 4.42Å; V89-L118 PolarHBondContact O-N 2.83Å; L118-V138 WeakPolarHBondContact O-CG1 3.46Å; L118-H297 HydrophobicContact CB-CB 4.23Å; L118-H297 HydrophobicContact CD2-CB 4.24Å; L118-I298 HydrophobicContact CD1-CG1 3.67Å; L118-A301 HydrophobicContact CD2-CB 3.54Å
119	T	85	Confident	91.3	Very high	20 Å²	20	27.7 Å²	27.7	12%	0.123	15%	0.145	C	C	.	.	S	Bend	trans	-132.2	0.8	-174.5	38.6	0	0	0	0	114.5	H91 E294	H91-T119 PolarHBondContact N-OG1 2.74Å; T119-E294 WeakPolarHBondContact CB-OE1 3.42Å; T119-E294 HydrophobicContact CG2-CG 3.83Å; T119-E294 VanDerWaalsContact CG2-OE1 3.29Å; T119-E294 WeakPolarHBondContact CG2-OE1 3.33Å; T119-E294 PolarHBondContact OG1-OE1 3.47Å
120	T	86.3	Confident	91.1	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.012	16%	0.156	C	C	.	.			trans	-84.9	122	178.3	179.7	0	0	0	0	113.1	P101 Y125 F134 R136	P101-T120 HydrophobicContact CG-CG2 4.06Å; T120-Y125 HydrophobicContact CG2-CD2 4.41Å; T120-Y125 HydrophobicContact CG2-CE2 4.36Å; T120-Y125 WeakPolarHBondContact OG1-CE2 3.21Å; T120-F134 HydrophobicContact CG2-CE1 4.13Å; T120-F134 HydrophobicContact CG2-CZ 3.57Å; T120-R136 WeakPolarHBondContact O-CD 3.38Å
121	R	89.1	Confident	91.1	Very high	9 Å²	9	25 Å²	25	3%	0.034	13%	0.133	C	C	.	.			trans	-118.4	6.7	-171.2	-65.4	-174.1	62	-154.2	-9.8	115.2	V138 P139 P140 Y141 E268	R121-V138 HydrophobicContact CG-CB 3.96Å; R121-V138 HydrophobicContact CG-CG2 3.64Å; R121-P139 WeakPolarHBondContact CG-O 3.5Å; R121-P139 PolarHBondContact NE-O 3.04Å; R121-P140 CarbonylContact O-C 3.58Å; R121-P140 WeakPolarHBondContact O-CA 3.3Å; R121-Y141 HydrophobicContact CB-CD1 4.43Å; R121-Y141 HydrophobicContact CB-CD2 4.03Å; R121-Y141 HydrophobicContact CB-CE1 4.1Å; R121-Y141 HydrophobicContact CB-CE2 3.68Å; R121-Y141 HydrophobicContact CB-CG 4.39Å; R121-Y141 VanDerWaalsContact O-CD2 3.24Å; R121-Y141 WeakPolarHBondContact O-CD2 3.46Å; R121-Y141 PolarHBondContact O-N 2.89Å; R121-E268 IonicContact CZ-OE2 3.21Å; R121-E268 IonicContact NH1-OE1 2.66Å; R121-E268 PolarHBondContact NH1-OE1 3.1Å; R121-E268 IonicContact NH1-OE2 2.9Å; R121-E268 PolarHBondContact NH1-OE2 3.06Å; R121-E268 IonicContact NH2-OE2 2.71Å
122	M	88.6	Confident	91	Very high	47 Å²	47	27.8 Å²	27.8	23%	0.232	15%	0.148	C	C	.	.			trans	-72.4	138.7	176.1	-63.3	-169.2	-56.9	0	0	111.9	T100 I124 Y125 R136 E169	T100-M122 HydrophobicContact CG2-CE 3.64Å; T100-M122 WeakPolarHBondContact OG1-CE 3.41Å; M122-I124 VanDerWaalsContact C-N 3.27Å; M122-I124 HydrophobicContact CB-CG2 4.23Å; M122-I124 PolarHBondContact O-N 2.69Å; M122-Y125 HydrophobicContact CB-CD2 4.4Å; M122-Y125 HydrophobicContact CB-CE2 4.44Å; M122-Y125 HydrophobicContact CE-CE2 4.14Å; M122-Y125 WeakPolarHBondContact O-CD2 3.49Å; M122-Y125 PolarHBondContact O-N 3.43Å; M122-R136 PolarHBondContact O-NH1 3.07Å; M122-E169 VanDerWaalsContact CA-OE2 3.26Å; M122-E169 WeakPolarHBondContact CA-OE2 3.28Å
123	S	90.8	Very high	90.8	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.014	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-71	-15.6	-173.9	-70.8	0	0	0	0	114.9	Y125 S126 P140 S142 E169	S123-Y125 PolarHBondContact O-N 3.36Å; S123-Y125 VanDerWaalsContact O-N 3.12Å; S123-S126 VanDerWaalsContact O-CB 3.28Å; S123-S126 WeakPolarHBondContact O-CB 3.41Å; S123-S126 PolarHBondContact O-N 3.41Å; S123-S126 PolarHBondContact O-OG 2.79Å; S123-P140 WeakPolarHBondContact OG-CB 3.41Å; S123-S142 WeakPolarHBondContact OG-CB 3.4Å; S123-S142 PolarHBondContact OG-OG 3.02Å; S123-E169 VanDerWaalsContact CB-OE1 3.29Å; S123-E169 WeakPolarHBondContact CB-OE1 3.08Å; S123-E169 PolarHBondContact N-OE2 3.03Å; S123-E169 PolarHBondContact OG-OE1 2.95Å
124	I	89.9	Confident	90.7	Very high	52 Å²	52	23.9 Å²	23.9	27%	0.267	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-55.2	-30.6	174.9	-166.7	167.3	0	0	0	112.9	M122 S126 D127 H131	M122-I124 VanDerWaalsContact C-N 3.27Å; M122-I124 HydrophobicContact CB-CG2 4.23Å; M122-I124 PolarHBondContact O-N 2.69Å; I124-S126 VanDerWaalsContact C-N 3.28Å; I124-S126 PolarHBondContact O-N 2.97Å; I124-D127 PolarHBondContact O-N 3.46Å; I124-H131 PolarHBondContact O-CD2 3.16Å
125	Y	90.7	Very high	90.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-74.6	-11.3	177.5	-62.9	-72.2	0	0	0	114.6	T100 P101 T102 T120 M122 S123 K128 H131 F134	T100-Y125 PolarHBondContact OG1-OH 2.88Å; P101-Y125 WeakPolarHBondContact CD-OH 3.39Å; P101-Y125 VanDerWaalsContact N-OH 3.17Å; T102-Y125 HydrophobicContact CG2-CE1 3.98Å; T102-Y125 VanDerWaalsContact CG2-OH 3.3Å; T102-Y125 WeakPolarHBondContact CG2-OH 3.29Å; T102-Y125 PolarHBondContact N-OH 2.93Å; T120-Y125 HydrophobicContact CG2-CD2 4.41Å; T120-Y125 HydrophobicContact CG2-CE2 4.36Å; T120-Y125 WeakPolarHBondContact OG1-CE2 3.21Å; M122-Y125 HydrophobicContact CB-CD2 4.4Å; M122-Y125 HydrophobicContact CB-CE2 4.44Å; M122-Y125 HydrophobicContact CE-CE2 4.14Å; M122-Y125 WeakPolarHBondContact O-CD2 3.49Å; M122-Y125 PolarHBondContact O-N 3.43Å; S123-Y125 PolarHBondContact O-N 3.36Å; S123-Y125 VanDerWaalsContact O-N 3.12Å; Y125-K128 PolarHBondContact O-NZ 3.42Å; Y125-H131 AromaticContact CD1-CD2 3.9Å; Y125-H131 AromaticContact CD1-CG 3.98Å; Y125-F134 HydrophobicContact CD1-CD1 4.18Å; Y125-F134 HydrophobicContact CD1-CD2 4.09Å; Y125-F134 HydrophobicContact CD1-CE1 4.14Å; Y125-F134 HydrophobicContact CD1-CE2 4.06Å; Y125-F134 HydrophobicContact CD1-CG 4.16Å; Y125-F134 HydrophobicContact CD1-CZ 4.09Å; Y125-F134 HydrophobicContact CE1-CE2 4.31Å; Y125-F134 HydrophobicContact CG-CD1 4.2Å; Y125-F134 AromaticContact CG-CE1 4Å; Y125-F134 HydrophobicContact CG-CE1 4Å; Y125-F134 HydrophobicContact CG-CZ 4.26Å
126	S	91.1	Very high	90.5	Very high	21 Å²	21	23.9 Å²	23.9	15%	0.147	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-69.8	-34.9	171.5	-56.5	0	0	0	0	111	S123 I124 K128 R136 D362	S123-S126 VanDerWaalsContact O-CB 3.28Å; S123-S126 WeakPolarHBondContact O-CB 3.41Å; S123-S126 PolarHBondContact O-N 3.41Å; S123-S126 PolarHBondContact O-OG 2.79Å; I124-S126 VanDerWaalsContact C-N 3.28Å; I124-S126 PolarHBondContact O-N 2.97Å; S126-K128 WeakPolarHBondContact O-CD 3.31Å; S126-K128 WeakPolarHBondContact O-CE 3.33Å; S126-K128 PolarHBondContact O-N 2.84Å; S126-K128 PolarHBondContact O-NZ 3.49Å; S126-R136 PolarHBondContact OG-NH2 2.86Å; S126-D362 WeakPolarHBondContact CB-OD2 3.32Å; S126-D362 PolarHBondContact OG-OD2 3.12Å
127	D	90.4	Very high	90.3	Very high	62 Å²	62	23.8 Å²	23.8	33%	0.332	13%	0.133	S	C	.	.			trans	-68.6	117.8	-174.8	-167	-33.1	0	0	0	111.8	I124 S129 I130 H131	I124-D127 PolarHBondContact O-N 3.46Å; D127-S129 VanDerWaalsContact CG-OG 3.3Å; D127-S129 WeakPolarHBondContact OD1-CA 3.49Å; D127-S129 VanDerWaalsContact OD1-CB 3.28Å; D127-S129 WeakPolarHBondContact OD1-CB 3.26Å; D127-S129 PolarHBondContact OD1-N 2.96Å; D127-S129 PolarHBondContact OD1-OG 2.89Å; D127-S129 PolarHBondContact OD2-OG 3.36Å; D127-I130 HydrophobicContact CB-CD1 4.4Å; D127-I130 HydrophobicContact CB-CG1 4.41Å; D127-H131 PolarHBondContact O-N 3.04Å
128	K	89.6	Confident	90.3	Very high	38 Å²	38	23.8 Å²	23.8	17%	0.165	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-3.6	-178.5	-54.3	-46.9	172.7	-163.7	0	114.7	Y125 S126 H131 L132 F134 D360	Y125-K128 PolarHBondContact O-NZ 3.42Å; S126-K128 WeakPolarHBondContact O-CD 3.31Å; S126-K128 WeakPolarHBondContact O-CE 3.33Å; S126-K128 PolarHBondContact O-N 2.84Å; S126-K128 PolarHBondContact O-NZ 3.49Å; K128-H131 WeakPolarHBondContact CD-O 2.94Å; K128-L132 HydrophobicContact CB-CD1 4.22Å; K128-L132 WeakPolarHBondContact O-CD1 3.33Å; K128-F134 PolarHBondContact NZ-O 3.21Å; K128-D360 WeakPolarHBondContact CE-O 3.28Å; K128-D360 PolarHBondContact NZ-O 3.43Å
129	S	90.5	Very high	90.4	Very high	103 Å²	103	23.9 Å²	23.9	72%	0.72	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-37.3	162.1	72.9	0	0	0	0	110.8	D127	D127-S129 VanDerWaalsContact CG-OG 3.3Å; D127-S129 WeakPolarHBondContact OD1-CA 3.49Å; D127-S129 VanDerWaalsContact OD1-CB 3.28Å; D127-S129 WeakPolarHBondContact OD1-CB 3.26Å; D127-S129 PolarHBondContact OD1-N 2.96Å; D127-S129 PolarHBondContact OD1-OG 2.89Å; D127-S129 PolarHBondContact OD2-OG 3.36Å
130	I	89.8	Confident	90.8	Very high	65 Å²	65	23 Å²	23	33%	0.333	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-59.3	179.3	-50.5	178.7	0	0	0	111	Y106 D127	Y106-I130 HydrophobicContact CE1-CG2 3.88Å; Y106-I130 WeakPolarHBondContact OH-CG2 3.5Å; D127-I130 HydrophobicContact CB-CD1 4.4Å; D127-I130 HydrophobicContact CB-CG1 4.41Å
131	H	91.6	Very high	91.1	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.009	14%	0.137	C	C	.	.			trans	-109.2	54.3	-168.2	-70.1	-64.8	0	0	0	112.2	S105 Y106 I124 Y125 D127 K128 S133 F134	S105-H131 WeakPolarHBondContact CB-ND1 3.31Å; S105-H131 PolarHBondContact OG-ND1 2.85Å; Y106-H131 AromaticContact CE2-CE1 3.86Å; Y106-H131 AromaticContact CZ-CE1 3.77Å; I124-H131 PolarHBondContact O-CD2 3.16Å; Y125-H131 AromaticContact CD1-CD2 3.9Å; Y125-H131 AromaticContact CD1-CG 3.98Å; D127-H131 PolarHBondContact O-N 3.04Å; K128-H131 WeakPolarHBondContact CD-O 2.94Å; H131-S133 VanDerWaalsContact C-N 3.31Å; H131-S133 PolarHBondContact O-N 2.98Å; H131-S133 VanDerWaalsContact O-N 3.13Å; H131-F134 HydrophobicContact CB-CB 3.97Å; H131-F134 WeakPolarHBondContact O-CB 3.45Å; H131-F134 PolarHBondContact O-N 3.33Å
132	L	89.9	Confident	91.3	Very high	70 Å²	70	25.2 Å²	25.2	37%	0.366	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-38.2	-170.6	-175.6	66.5	0	0	0	115.1	K128 K339	K128-L132 HydrophobicContact CB-CD1 4.22Å; K128-L132 WeakPolarHBondContact O-CD1 3.33Å; L132-K339 VanDerWaalsContact O-CE 3.25Å; L132-K339 WeakPolarHBondContact O-CE 3.06Å; L132-K339 PolarHBondContact O-NZ 3.27Å
133	S	89	Confident	91.4	Very high	5 Å²	5	24.4 Å²	24.4	4%	0.035	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	2.6	-177.8	70.1	0	0	0	0	114.7	G109 I113 P114 V115 H131	G109-S133 WeakPolarHBondContact CA-OG 3.47Å; I113-S133 WeakPolarHBondContact O-CB 3.48Å; I113-S133 PolarHBondContact O-OG 3.48Å; P114-S133 WeakPolarHBondContact CA-O 3.24Å; V115-S133 PolarHBondContact N-O 3.31Å; H131-S133 VanDerWaalsContact C-N 3.31Å; H131-S133 PolarHBondContact O-N 2.98Å; H131-S133 VanDerWaalsContact O-N 3.13Å
134	F	93.9	Very high	91.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	135.2	-173.4	-158.2	-87.6	0	0	0	113.1	V89 V115 T120 Y125 K128 H131 R136	V89-F134 HydrophobicContact CG1-CE2 4.12Å; V89-F134 HydrophobicContact CG1-CZ 4.47Å; V115-F134 HydrophobicContact CB-CD2 3.93Å; V115-F134 HydrophobicContact CB-CE2 4.35Å; V115-F134 HydrophobicContact CG1-CD2 3.73Å; V115-F134 HydrophobicContact CG1-CE2 3.65Å; T120-F134 HydrophobicContact CG2-CE1 4.13Å; T120-F134 HydrophobicContact CG2-CZ 3.57Å; Y125-F134 HydrophobicContact CD1-CD1 4.18Å; Y125-F134 HydrophobicContact CD1-CD2 4.09Å; Y125-F134 HydrophobicContact CD1-CE1 4.14Å; Y125-F134 HydrophobicContact CD1-CE2 4.06Å; Y125-F134 HydrophobicContact CD1-CG 4.16Å; Y125-F134 HydrophobicContact CD1-CZ 4.09Å; Y125-F134 HydrophobicContact CE1-CE2 4.31Å; Y125-F134 HydrophobicContact CG-CD1 4.2Å; Y125-F134 AromaticContact CG-CE1 4Å; Y125-F134 HydrophobicContact CG-CE1 4Å; Y125-F134 HydrophobicContact CG-CZ 4.26Å; K128-F134 PolarHBondContact NZ-O 3.21Å; H131-F134 HydrophobicContact CB-CB 3.97Å; H131-F134 WeakPolarHBondContact O-CB 3.45Å; H131-F134 PolarHBondContact O-N 3.33Å; F134-R136 HydrophobicContact CE1-CB 4.08Å; F134-R136 HydrophobicContact CE1-CG 4.32Å
135	L	93.8	Very high	91.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	169.1	168.8	-61.6	83.4	0	0	0	109.3	V115 V116 G117 K339 L342 M343 F357 G361	V115-L135 PolarHBondContact O-N 3.22Å; V116-L135 CarbonylContact C-O 3.45Å; V116-L135 WeakPolarHBondContact CA-O 3.38Å; G117-L135 PolarHBondContact N-O 2.95Å; L135-K339 HydrophobicContact CD1-CD 4.47Å; L135-K339 HydrophobicContact CD1-CG 3.83Å; L135-L342 HydrophobicContact CD1-CD2 4.06Å; L135-L342 HydrophobicContact CD2-CB 4.33Å; L135-L342 HydrophobicContact CD2-CD2 3.86Å; L135-L342 HydrophobicContact CD2-CG 3.85Å; L135-M343 HydrophobicContact CD2-CG 3.64Å; L135-M343 HydrophobicContact CG-CG 4.3Å; L135-F357 HydrophobicContact CB-CD1 4.4Å; L135-F357 HydrophobicContact CB-CE1 4.12Å; L135-F357 HydrophobicContact CD2-CD1 4.15Å; L135-F357 HydrophobicContact CD2-CD2 4.11Å; L135-F357 HydrophobicContact CD2-CE1 4.16Å; L135-F357 HydrophobicContact CD2-CE2 4.13Å; L135-F357 HydrophobicContact CD2-CG 4.11Å; L135-F357 HydrophobicContact CD2-CZ 4.15Å; L135-G361 CarbonylContact C-O 3.4Å; L135-G361 WeakPolarHBondContact CA-O 3.21Å; L135-G361 WeakPolarHBondContact CB-O 3.45Å
136	R	92.3	Very high	91.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	148	175.3	47.6	179.8	165.6	-165.5	-11.1	115.9	G117 T120 M122 S126 F134 V138 F357 G361 D362	G117-R136 CarbonylContact O-C 3.6Å; G117-R136 WeakPolarHBondContact O-CA 3.24Å; G117-R136 WeakPolarHBondContact O-CB 2.98Å; T120-R136 WeakPolarHBondContact O-CD 3.38Å; M122-R136 PolarHBondContact O-NH1 3.07Å; S126-R136 PolarHBondContact OG-NH2 2.86Å; F134-R136 HydrophobicContact CE1-CB 4.08Å; F134-R136 HydrophobicContact CE1-CG 4.32Å; R136-V138 VanDerWaalsContact C-N 3.31Å; R136-V138 WeakPolarHBondContact CD-O 3.31Å; R136-V138 VanDerWaalsContact CG-O 3.24Å; R136-V138 WeakPolarHBondContact CG-O 3.41Å; R136-F357 WeakPolarHBondContact O-CE1 3.36Å; R136-G361 PolarHBondContact N-O 3.01Å; R136-G361 VanDerWaalsContact N-O 3.09Å; R136-D362 IonicContact CZ-OD1 2.99Å; R136-D362 IonicContact CZ-OD2 3.48Å; R136-D362 IonicContact NE-OD1 2.74Å; R136-D362 PolarHBondContact NE-OD1 2.55Å; R136-D362 IonicContact NE-OD2 3.77Å; R136-D362 VanDerWaalsContact NH2-CG 3.26Å; R136-D362 IonicContact NH2-OD1 3.7Å; R136-D362 PolarHBondContact NH2-OD1 3.18Å; R136-D362 IonicContact NH2-OD2 2.72Å; R136-D362 PolarHBondContact NH2-OD2 2.71Å
137	T	91.2	Very high	91.8	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.006	12%	0.122	C	C	.	.	S	Bend	trans	-83.6	-2.4	177.1	59.4	0	0	0	0	114	V116 G117 H297 A301 R363	V116-T137 HydrophobicContact CG1-CG2 4.09Å; G117-T137 PolarHBondContact O-N 2.66Å; G117-T137 PolarHBondContact O-OG1 3.13Å; T137-H297 WeakPolarHBondContact CB-ND1 3.34Å; T137-H297 PolarHBondContact OG1-ND1 3.02Å; T137-A301 HydrophobicContact CG2-CB 3.92Å; T137-R363 WeakPolarHBondContact O-CD 3.23Å; T137-R363 PolarHBondContact O-NH1 3.08Å
138	V	91.9	Very high	91.9	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.006	11%	0.106	C	C	.	.	S	Bend	trans	-118.2	141.5	171.5	-72.9	0	0	0	0	110.5	L118 R121 R136 L288 H297	L118-V138 WeakPolarHBondContact O-CG1 3.46Å; R121-V138 HydrophobicContact CG-CB 3.96Å; R121-V138 HydrophobicContact CG-CG2 3.64Å; R136-V138 VanDerWaalsContact C-N 3.31Å; R136-V138 WeakPolarHBondContact CD-O 3.31Å; R136-V138 VanDerWaalsContact CG-O 3.24Å; R136-V138 WeakPolarHBondContact CG-O 3.41Å; V138-L288 HydrophobicContact CB-CD2 4.11Å; V138-L288 HydrophobicContact CG1-CD2 3.95Å; V138-H297 WeakPolarHBondContact CG1-CE1 3.36Å
139	P	93.6	Very high	92	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.006	10%	0.102	C	C	.	.			trans	-73	152	173.3	33.6	-39.7	0	0	0	111.7	R121 H143 L288 A366 Y368	R121-P139 WeakPolarHBondContact CG-O 3.5Å; R121-P139 PolarHBondContact NE-O 3.04Å; P139-H143 HydrophobicContact CB-CB 3.9Å; P139-L288 HydrophobicContact CG-CD1 3.77Å; P139-L288 HydrophobicContact CG-CD2 4.15Å; P139-A366 HydrophobicContact CB-CB 4.25Å; P139-A366 HydrophobicContact CG-CB 3.57Å; P139-Y368 HydrophobicContact CG-CE2 4.42Å; P139-Y368 WeakPolarHBondContact CG-OH 3.48Å
140	P	92.9	Very high	92	Very high	3 Å²	3	14.6 Å²	14.6	2%	0.019	7%	0.072	C	C	.	.			trans	-64.3	169.4	172.8	22.8	-29.5	0	0	0	113.3	R121 S123 H143	R121-P140 CarbonylContact O-C 3.58Å; R121-P140 WeakPolarHBondContact O-CA 3.3Å; S123-P140 WeakPolarHBondContact OG-CB 3.41Å; P140-H143 HydrophobicContact CG-CB 4.04Å; P140-H143 WeakPolarHBondContact O-CB 3.29Å; P140-H143 PolarHBondContact O-N 3.43Å
141	Y	92.4	Very high	92	Very high	47 Å²	47	11.6 Å²	11.6	18%	0.184	6%	0.057	C	C	.	.	S	Bend	trans	-65.8	-42.2	171.2	-59.4	-68.1	0	0	0	111.4	R121 H143 Q144 E169 E268 R269	R121-Y141 HydrophobicContact CB-CD1 4.43Å; R121-Y141 HydrophobicContact CB-CD2 4.03Å; R121-Y141 HydrophobicContact CB-CE1 4.1Å; R121-Y141 HydrophobicContact CB-CE2 3.68Å; R121-Y141 HydrophobicContact CB-CG 4.39Å; R121-Y141 VanDerWaalsContact O-CD2 3.24Å; R121-Y141 WeakPolarHBondContact O-CD2 3.46Å; R121-Y141 PolarHBondContact O-N 2.89Å; Y141-H143 PolarHBondContact O-N 3.31Å; Y141-Q144 WeakPolarHBondContact O-CB 3.47Å; Y141-Q144 WeakPolarHBondContact O-CG 3.44Å; Y141-Q144 PolarHBondContact O-N 2.99Å; Y141-E169 WeakPolarHBondContact CB-OE1 3.46Å; Y141-E268 HydrophobicContact CE1-CB 4.47Å; Y141-R269 HydrophobicContact CD1-CG 4.45Å; Y141-R269 HydrophobicContact CE1-CG 4Å; Y141-R269 HydrophobicContact CE2-CG 4.29Å
142	S	92.8	Very high	91.8	Very high	10 Å²	10	11.6 Å²	11.6	7%	0.07	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-22.4	171.5	64	0	0	0	0	115.6	S123 Q144 A145 E169	S123-S142 WeakPolarHBondContact OG-CB 3.4Å; S123-S142 PolarHBondContact OG-OG 3.02Å; S142-Q144 PolarHBondContact O-N 3.15Å; S142-A145 VanDerWaalsContact O-CB 3.31Å; S142-A145 WeakPolarHBondContact O-CB 3.19Å; S142-A145 PolarHBondContact O-N 2.8Å; S142-E169 PolarHBondContact N-OE1 3.1Å
143	H	91.8	Very high	91.6	Very high	30 Å²	30	13.8 Å²	13.8	14%	0.139	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-18.4	173.5	-164.8	-73.7	0	0	0	112.8	P139 P140 Y141 A145 H146	P139-H143 HydrophobicContact CB-CB 3.9Å; P140-H143 HydrophobicContact CG-CB 4.04Å; P140-H143 WeakPolarHBondContact O-CB 3.29Å; P140-H143 PolarHBondContact O-N 3.43Å; Y141-H143 PolarHBondContact O-N 3.31Å; H143-A145 PolarHBondContact O-N 3.38Å; H143-H146 AromaticContact CD2-CD2 3.86Å; H143-H146 AromaticContact CE1-CD2 3.56Å; H143-H146 AromaticContact CG-CD2 3.94Å; H143-H146 AromaticContact ND1-CD2 3.77Å; H143-H146 AromaticContact NE2-CD2 3.61Å; H143-H146 AromaticContact NE2-NE2 3.87Å; H143-H146 PolarHBondContact O-N 3.27Å; H143-H146 VanDerWaalsContact O-N 3.13Å
144	Q	92.6	Very high	91.5	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-62.1	-20.4	173.8	-68	178.5	-35.6	0	0	112.3	Y141 S142 H146 V147 W148 L286 Y368	Y141-Q144 WeakPolarHBondContact O-CB 3.47Å; Y141-Q144 WeakPolarHBondContact O-CG 3.44Å; Y141-Q144 PolarHBondContact O-N 2.99Å; S142-Q144 PolarHBondContact O-N 3.15Å; Q144-H146 PolarHBondContact O-N 3.33Å; Q144-V147 WeakPolarHBondContact O-CA 3.42Å; Q144-V147 PolarHBondContact O-N 3.2Å; Q144-W148 HydrophobicContact CB-CH2 4.48Å; Q144-W148 HydrophobicContact CB-CZ2 4.18Å; Q144-W148 PolarHBondContact O-N 2.9Å; Q144-L286 HydrophobicContact CB-CD1 3.87Å; Q144-L286 HydrophobicContact CG-CD1 4.28Å; Q144-Y368 HydrophobicContact CG-CD1 4.45Å; Q144-Y368 HydrophobicContact CG-CE1 3.63Å
145	A	93.1	Very high	91.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-56.4	-29.8	171	0	0	0	0	0	114	S142 H143 W148 F149 R176 L177	S142-A145 VanDerWaalsContact O-CB 3.31Å; S142-A145 WeakPolarHBondContact O-CB 3.19Å; S142-A145 PolarHBondContact O-N 2.8Å; H143-A145 PolarHBondContact O-N 3.38Å; A145-W148 HydrophobicContact CB-CE3 4.05Å; A145-W148 HydrophobicContact CB-CZ3 4.28Å; A145-F149 VanDerWaalsContact O-CB 3.24Å; A145-F149 WeakPolarHBondContact O-CB 3.36Å; A145-F149 PolarHBondContact O-N 2.81Å; A145-R176 HydrophobicContact CB-CB 4.32Å; A145-R176 HydrophobicContact CB-CG 4.3Å; A145-L177 HydrophobicContact CB-CB 4.1Å; A145-L177 HydrophobicContact CB-CD1 4.28Å
146	H	91.3	Very high	90.8	Very high	36 Å²	36	25.3 Å²	25.3	17%	0.167	12%	0.117	C	C	.	.	H	α-helix	trans	-64.2	-40.7	171.2	-74.7	-83	0	0	0	112.1	H143 Q144 F149 D150 R176	H143-H146 AromaticContact CD2-CD2 3.86Å; H143-H146 AromaticContact CE1-CD2 3.56Å; H143-H146 AromaticContact CG-CD2 3.94Å; H143-H146 AromaticContact ND1-CD2 3.77Å; H143-H146 AromaticContact NE2-CD2 3.61Å; H143-H146 AromaticContact NE2-NE2 3.87Å; H143-H146 PolarHBondContact O-N 3.27Å; H143-H146 VanDerWaalsContact O-N 3.13Å; Q144-H146 PolarHBondContact O-N 3.33Å; H146-F149 PolarHBondContact O-N 3.32Å; H146-D150 PolarHBondContact O-N 3.04Å; H146-R176 PolarHBondContact NE2-NH2 3.24Å
147	V	93.6	Very high	90.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-74.4	-38.8	-178.6	-167	0	0	0	0	110.4	Q144 F149 D150 L151 L286 Y368 Y384	Q144-V147 WeakPolarHBondContact O-CA 3.42Å; Q144-V147 PolarHBondContact O-N 3.2Å; V147-F149 VanDerWaalsContact C-N 3.32Å; V147-F149 PolarHBondContact O-N 2.83Å; V147-D150 PolarHBondContact O-N 3.3Å; V147-L151 HydrophobicContact CG1-CD1 4.38Å; V147-L151 VanDerWaalsContact O-CB 3.32Å; V147-L151 WeakPolarHBondContact O-CB 3.28Å; V147-L151 VanDerWaalsContact O-CG 3.22Å; V147-L151 WeakPolarHBondContact O-CG 3.31Å; V147-L151 PolarHBondContact O-N 2.85Å; V147-L286 HydrophobicContact CB-CD1 3.79Å; V147-L286 HydrophobicContact CB-CD2 4.3Å; V147-L286 HydrophobicContact CG1-CD1 4.08Å; V147-L286 HydrophobicContact CG1-CD2 3.63Å; V147-Y368 HydrophobicContact CG2-CD2 3.73Å; V147-Y368 HydrophobicContact CG2-CE2 3.97Å; V147-Y368 HydrophobicContact CG2-CG 4.15Å; V147-Y384 HydrophobicContact CG1-CD2 4.07Å; V147-Y384 HydrophobicContact CG1-CG 4.01Å; V147-Y384 HydrophobicContact CG2-CD1 3.79Å; V147-Y384 HydrophobicContact CG2-CD2 4.34Å; V147-Y384 HydrophobicContact CG2-CE1 4.06Å; V147-Y384 HydrophobicContact CG2-CG 3.93Å
148	W	93.1	Very high	90.2	Very high	1 Å²	1	28.5 Å²	28.5	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-60.3	-41.1	168.9	-59.6	-36.2	0	0	0	111.7	Q144 A145 L151 M152 A173 I237 V266 L286	Q144-W148 HydrophobicContact CB-CH2 4.48Å; Q144-W148 HydrophobicContact CB-CZ2 4.18Å; Q144-W148 PolarHBondContact O-N 2.9Å; A145-W148 HydrophobicContact CB-CE3 4.05Å; A145-W148 HydrophobicContact CB-CZ3 4.28Å; W148-L151 PolarHBondContact O-N 3.43Å; W148-M152 WeakPolarHBondContact O-CG 3.43Å; W148-M152 PolarHBondContact O-N 2.88Å; W148-A173 HydrophobicContact CZ3-CB 4.47Å; W148-I237 HydrophobicContact CB-CD1 4.12Å; W148-I237 HydrophobicContact CD2-CG2 3.7Å; W148-I237 HydrophobicContact CE3-CG2 3.63Å; W148-I237 HydrophobicContact CG-CD1 4.48Å; W148-I237 HydrophobicContact CG-CG2 4.26Å; W148-I237 HydrophobicContact CH2-CG2 4.35Å; W148-I237 HydrophobicContact CZ2-CG2 4.35Å; W148-I237 HydrophobicContact CZ3-CG2 3.98Å; W148-V266 PolarHBondContact NE1-O 3.25Å; W148-V266 VanDerWaalsContact NE1-O 3.08Å; W148-L286 HydrophobicContact CG-CD1 4.41Å
149	F	90.9	Very high	89.8	Confident	17 Å²	17	31.4 Å²	31.4	8%	0.075	15%	0.147	C	C	.	.	H	α-helix	trans	-63.5	-44.4	177.4	-179.1	-98.6	0	0	0	113	A145 H146 V147 M152 R153 L177 L180 L181 R184 P207	A145-F149 VanDerWaalsContact O-CB 3.24Å; A145-F149 WeakPolarHBondContact O-CB 3.36Å; A145-F149 PolarHBondContact O-N 2.81Å; H146-F149 PolarHBondContact O-N 3.32Å; V147-F149 VanDerWaalsContact C-N 3.32Å; V147-F149 PolarHBondContact O-N 2.83Å; F149-M152 HydrophobicContact CB-CE 4.34Å; F149-M152 HydrophobicContact CD2-CE 4.18Å; F149-M152 PolarHBondContact O-N 2.85Å; F149-R153 WeakPolarHBondContact O-CG 3.24Å; F149-R153 PolarHBondContact O-N 2.94Å; F149-L177 HydrophobicContact CB-CD1 4.4Å; F149-L180 HydrophobicContact CB-CD1 4.2Å; F149-L180 HydrophobicContact CD2-CB 3.99Å; F149-L180 HydrophobicContact CE2-CB 4.15Å; F149-L180 WeakPolarHBondContact CE2-O 3.19Å; F149-L180 HydrophobicContact CG-CB 4.21Å; F149-L180 HydrophobicContact CG-CD1 4.47Å; F149-L180 WeakPolarHBondContact CZ-O 3.36Å; F149-L181 HydrophobicContact CD2-CD2 3.85Å; F149-L181 HydrophobicContact CE2-CD2 3.85Å; F149-R184 HydrophobicContact CZ-CB 4.43Å; F149-P207 HydrophobicContact CD2-CG 4.05Å; F149-P207 HydrophobicContact CE2-CG 3.79Å
150	D	89.9	Confident	89.7	Confident	17 Å²	17	31.3 Å²	31.3	9%	0.091	15%	0.147	C	C	.	.	H	α-helix	trans	-74.1	-27.1	176.3	-72.7	-28.3	0	0	0	112.9	H146 V147 R153 E154 Y384 V389	H146-D150 PolarHBondContact O-N 3.04Å; V147-D150 PolarHBondContact O-N 3.3Å; D150-R153 WeakPolarHBondContact O-CB 3.37Å; D150-R153 PolarHBondContact O-N 3.09Å; D150-R153 WeakPolarHBondContact OD1-CD 3.18Å; D150-R153 IonicContact OD1-CZ 3.73Å; D150-R153 IonicContact OD1-NE 3.87Å; D150-R153 IonicContact OD1-NH1 3.08Å; D150-R153 PolarHBondContact OD1-NH1 3.05Å; D150-E154 PolarHBondContact O-N 3.41Å; D150-Y384 HydrophobicContact CB-CE2 4.02Å; D150-Y384 VanDerWaalsContact OD2-CE2 3.31Å; D150-Y384 WeakPolarHBondContact OD2-CE2 3.42Å; D150-Y384 PolarHBondContact OD2-OH 3.45Å; D150-Y384 VanDerWaalsContact OD2-OH 3.13Å; D150-V389 HydrophobicContact CB-CG2 3.9Å
151	L	90	Very high	89.7	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-64.6	-45.9	167.9	-78.8	168.7	0	0	0	112.1	V147 W148 R153 E154 F155 L286 I370 V389 M391	V147-L151 HydrophobicContact CG1-CD1 4.38Å; V147-L151 VanDerWaalsContact O-CB 3.32Å; V147-L151 WeakPolarHBondContact O-CB 3.28Å; V147-L151 VanDerWaalsContact O-CG 3.22Å; V147-L151 WeakPolarHBondContact O-CG 3.31Å; V147-L151 PolarHBondContact O-N 2.85Å; W148-L151 PolarHBondContact O-N 3.43Å; L151-R153 PolarHBondContact O-N 2.84Å; L151-E154 PolarHBondContact O-N 3.01Å; L151-F155 HydrophobicContact CD2-CE2 3.98Å; L151-F155 VanDerWaalsContact O-CD2 3.25Å; L151-F155 WeakPolarHBondContact O-CD2 3.14Å; L151-F155 PolarHBondContact O-N 3.19Å; L151-L286 HydrophobicContact CD1-CD2 4.12Å; L151-I370 HydrophobicContact CD2-CD1 4.03Å; L151-I370 HydrophobicContact CD2-CG2 4.39Å; L151-V389 HydrophobicContact CD2-CG1 4.27Å; L151-V389 HydrophobicContact CD2-CG2 4.27Å; L151-V389 HydrophobicContact CG-CG2 4.2Å; L151-M391 HydrophobicContact CD2-CE 3.48Å; L151-M391 VanDerWaalsContact CD2-CE 3.48Å
152	M	88.8	Confident	89.8	Confident	2 Å²	2	29 Å²	29	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-57.6	-36.3	174.8	-73.9	-172.4	-72.3	0	0	112	W148 F149 N156 W157 I160 L177 P207 I237	W148-M152 WeakPolarHBondContact O-CG 3.43Å; W148-M152 PolarHBondContact O-N 2.88Å; F149-M152 HydrophobicContact CB-CE 4.34Å; F149-M152 HydrophobicContact CD2-CE 4.18Å; F149-M152 PolarHBondContact O-N 2.85Å; M152-N156 WeakPolarHBondContact O-CA 3.15Å; M152-N156 PolarHBondContact O-N 2.83Å; M152-W157 PolarHBondContact O-N 3.15Å; M152-I160 HydrophobicContact CE-CD1 4.22Å; M152-I160 HydrophobicContact CG-CG2 4.23Å; M152-I160 HydrophobicContact SD-CB 4.4Å; M152-I160 HydrophobicContact SD-CD1 3.81Å; M152-I160 HydrophobicContact SD-CG1 4.26Å; M152-I160 HydrophobicContact SD-CG2 3.35Å; M152-I160 WeakPolarHBondContact SD-CG2 3.47Å; M152-L177 HydrophobicContact CE-CD1 4.04Å; M152-P207 HydrophobicContact CB-CB 4.27Å; M152-P207 HydrophobicContact CB-CG 4.48Å; M152-P207 HydrophobicContact CE-CB 4.05Å; M152-P207 HydrophobicContact CE-CG 4.18Å; M152-P207 HydrophobicContact SD-CB 3.78Å; M152-P207 HydrophobicContact SD-CG 4.48Å; M152-I237 HydrophobicContact SD-CD1 4.43Å
153	R	84.9	Confident	89.9	Confident	116 Å²	116	28.7 Å²	28.7	44%	0.438	14%	0.135	S	C	.	.	H	α-helix	trans	-68.2	-47.8	175.8	-70.4	171.1	55.4	-166.5	-3.3	112.7	F149 D150 L151 F155 N156 R184	F149-R153 WeakPolarHBondContact O-CG 3.24Å; F149-R153 PolarHBondContact O-N 2.94Å; D150-R153 WeakPolarHBondContact O-CB 3.37Å; D150-R153 PolarHBondContact O-N 3.09Å; D150-R153 WeakPolarHBondContact OD1-CD 3.18Å; D150-R153 IonicContact OD1-CZ 3.73Å; D150-R153 IonicContact OD1-NE 3.87Å; D150-R153 IonicContact OD1-NH1 3.08Å; D150-R153 PolarHBondContact OD1-NH1 3.05Å; L151-R153 PolarHBondContact O-N 2.84Å; R153-F155 PolarHBondContact O-N 3.34Å; R153-N156 PolarHBondContact O-N 2.87Å; R153-N156 PolarHBondContact O-OD1 3.05Å; R153-R184 VanDerWaalsContact CD-NH1 3.33Å
154	E	86.9	Confident	90	Very high	107 Å²	107	27.2 Å²	27.2	50%	0.5	13%	0.128	S	C	.	.	H	α-helix	trans	-59.3	-36.4	178.8	-171.5	65.1	-174	0	0	111.3	D150 L151 M391	D150-E154 PolarHBondContact O-N 3.41Å; L151-E154 PolarHBondContact O-N 3.01Å; E154-M391 HydrophobicContact CG-CE 4.42Å; E154-M391 HydrophobicContact CG-CG 4.31Å
155	F	87.4	Confident	90.1	Very high	18 Å²	18	27.6 Å²	27.6	8%	0.079	13%	0.131	C	C	.	.	H	α-helix	trans	-92.5	-3.8	179.5	-66.2	-53.3	0	0	0	115.2	L151 R153 W157 I284 M391 I397 W399 K406	L151-F155 HydrophobicContact CD2-CE2 3.98Å; L151-F155 VanDerWaalsContact O-CD2 3.25Å; L151-F155 WeakPolarHBondContact O-CD2 3.14Å; L151-F155 PolarHBondContact O-N 3.19Å; R153-F155 PolarHBondContact O-N 3.34Å; F155-W157 VanDerWaalsContact C-N 3.29Å; F155-W157 HydrophobicContact CB-CD2 3.56Å; F155-W157 HydrophobicContact CB-CE3 3.75Å; F155-W157 HydrophobicContact CB-CG 4.15Å; F155-W157 HydrophobicContact CB-CH2 3.89Å; F155-W157 HydrophobicContact CB-CZ2 3.74Å; F155-W157 HydrophobicContact CB-CZ3 3.91Å; F155-W157 HydrophobicContact CD1-CH2 4.48Å; F155-W157 HydrophobicContact CD1-CZ2 4.44Å; F155-W157 AromaticContact CD2-CE3 3.97Å; F155-W157 HydrophobicContact CD2-CE3 3.97Å; F155-W157 AromaticContact CD2-CH2 3.19Å; F155-W157 HydrophobicContact CD2-CH2 3.19Å; F155-W157 AromaticContact CD2-CZ2 3.86Å; F155-W157 HydrophobicContact CD2-CZ2 3.86Å; F155-W157 AromaticContact CD2-CZ3 3.27Å; F155-W157 HydrophobicContact CD2-CZ3 3.27Å; F155-W157 AromaticContact CE2-CH2 3.7Å; F155-W157 HydrophobicContact CE2-CH2 3.7Å; F155-W157 HydrophobicContact CE2-CZ3 4.01Å; F155-W157 HydrophobicContact CG-CD2 4.39Å; F155-W157 HydrophobicContact CG-CE3 4.27Å; F155-W157 AromaticContact CG-CH2 3.62Å; F155-W157 HydrophobicContact CG-CH2 3.62Å; F155-W157 AromaticContact CG-CZ2 3.78Å; F155-W157 HydrophobicContact CG-CZ2 3.78Å; F155-W157 AromaticContact CG-CZ3 3.91Å; F155-W157 HydrophobicContact CG-CZ3 3.91Å; F155-W157 PolarHBondContact O-N 2.85Å; F155-I284 HydrophobicContact CE2-CD1 4.37Å; F155-M391 HydrophobicContact CE1-CE 4.2Å; F155-M391 HydrophobicContact CE2-CE 3.7Å; F155-M391 HydrophobicContact CZ-CE 3.39Å; F155-I397 HydrophobicContact CE1-CD1 4.18Å; F155-I397 HydrophobicContact CZ-CD1 3.7Å; F155-W399 HydrophobicContact CD1-CH2 4.34Å; F155-W399 HydrophobicContact CD2-CH2 4.48Å; F155-W399 AromaticContact CE1-CH2 3.87Å; F155-W399 HydrophobicContact CE1-CH2 3.87Å; F155-W399 HydrophobicContact CE1-CZ2 4.02Å; F155-W399 HydrophobicContact CE2-CH2 4.01Å; F155-W399 AromaticContact CZ-CH2 3.67Å; F155-W399 HydrophobicContact CZ-CH2 3.67Å; F155-W399 HydrophobicContact CZ-CZ2 4.16Å; F155-K406 HydrophobicContact CB-CD 4.01Å; F155-K406 HydrophobicContact CD1-CD 3.6Å; F155-K406 HydrophobicContact CD1-CG 3.99Å; F155-K406 HydrophobicContact CE1-CD 4.48Å; F155-K406 HydrophobicContact CG-CD 4.19Å; F155-K406 PolarHBondContact O-NZ 3.47Å
156	N	86.3	Confident	90	Very high	123 Å²	123	31.3 Å²	31.3	66%	0.658	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	39	-173.6	-65.4	-45.8	0	0	0	114.2	M152 R153	M152-N156 WeakPolarHBondContact O-CA 3.15Å; M152-N156 PolarHBondContact O-N 2.83Å; R153-N156 PolarHBondContact O-N 2.87Å; R153-N156 PolarHBondContact O-OD1 3.05Å
157	W	87.9	Confident	89.9	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.008	16%	0.157	C	C	.	.			trans	-86.2	114.4	173.8	-63.1	-41.1	0	0	0	110.4	M152 F155 V235 V263 L265 W399 K406 P407	M152-W157 PolarHBondContact O-N 3.15Å; F155-W157 VanDerWaalsContact C-N 3.29Å; F155-W157 HydrophobicContact CB-CD2 3.56Å; F155-W157 HydrophobicContact CB-CE3 3.75Å; F155-W157 HydrophobicContact CB-CG 4.15Å; F155-W157 HydrophobicContact CB-CH2 3.89Å; F155-W157 HydrophobicContact CB-CZ2 3.74Å; F155-W157 HydrophobicContact CB-CZ3 3.91Å; F155-W157 HydrophobicContact CD1-CH2 4.48Å; F155-W157 HydrophobicContact CD1-CZ2 4.44Å; F155-W157 AromaticContact CD2-CE3 3.97Å; F155-W157 HydrophobicContact CD2-CE3 3.97Å; F155-W157 AromaticContact CD2-CH2 3.19Å; F155-W157 HydrophobicContact CD2-CH2 3.19Å; F155-W157 AromaticContact CD2-CZ2 3.86Å; F155-W157 HydrophobicContact CD2-CZ2 3.86Å; F155-W157 AromaticContact CD2-CZ3 3.27Å; F155-W157 HydrophobicContact CD2-CZ3 3.27Å; F155-W157 AromaticContact CE2-CH2 3.7Å; F155-W157 HydrophobicContact CE2-CH2 3.7Å; F155-W157 HydrophobicContact CE2-CZ3 4.01Å; F155-W157 HydrophobicContact CG-CD2 4.39Å; F155-W157 HydrophobicContact CG-CE3 4.27Å; F155-W157 AromaticContact CG-CH2 3.62Å; F155-W157 HydrophobicContact CG-CH2 3.62Å; F155-W157 AromaticContact CG-CZ2 3.78Å; F155-W157 HydrophobicContact CG-CZ2 3.78Å; F155-W157 AromaticContact CG-CZ3 3.91Å; F155-W157 HydrophobicContact CG-CZ3 3.91Å; F155-W157 PolarHBondContact O-N 2.85Å; W157-V235 HydrophobicContact CB-CG2 4.07Å; W157-V235 HydrophobicContact CD2-CG2 3.61Å; W157-V235 HydrophobicContact CE3-CG1 4.04Å; W157-V235 HydrophobicContact CE3-CG2 3.98Å; W157-V235 HydrophobicContact CG-CG2 3.66Å; W157-V235 HydrophobicContact CZ3-CG1 4.46Å; W157-V263 HydrophobicContact CH2-CG1 3.69Å; W157-V263 HydrophobicContact CH2-CG2 4.35Å; W157-V263 HydrophobicContact CZ2-CG1 4.16Å; W157-V263 HydrophobicContact CZ2-CG2 3.96Å; W157-V263 HydrophobicContact CZ3-CG1 4.12Å; W157-L265 HydrophobicContact CZ3-CD1 4.13Å; W157-L265 HydrophobicContact CZ3-CD2 4.12Å; W157-W399 AromaticContact CH2-CH2 3.59Å; W157-W399 HydrophobicContact CH2-CH2 3.59Å; W157-W399 AromaticContact CH2-CZ3 3.57Å; W157-W399 HydrophobicContact CH2-CZ3 3.57Å; W157-W399 AromaticContact CZ2-CH2 3.61Å; W157-W399 HydrophobicContact CZ2-CH2 3.61Å; W157-W399 AromaticContact CZ2-CZ3 3.7Å; W157-W399 HydrophobicContact CZ2-CZ3 3.7Å; W157-K406 HydrophobicContact CZ2-CG 4.29Å; W157-P407 PolarHBondContact NE1-O 3.28Å
158	N	82.3	Confident	89.6	Confident	66 Å²	66	35.9 Å²	35.9	35%	0.353	17%	0.174	S	C	.	.			trans	-93.6	-17.6	-174.4	-69.3	-24.2	0	0	0	114.4	K208	N158-K208 PolarHBondContact O-N 3.36Å
159	H	84.4	Confident	89.4	Confident	61 Å²	61	36.4 Å²	36.4	28%	0.282	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	128.5	-176.3	-57	-100.8	0	0	0	109.5	K208 A233	H159-K208 WeakPolarHBondContact CA-O 3.25Å; H159-A233 HydrophobicContact CB-CB 3.98Å
160	I	90.7	Very high	89.4	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	155.7	176.4	63.4	165.3	0	0	0	112.7	M152 L177 K208 A209 E210 V235 I237	M152-I160 HydrophobicContact CE-CD1 4.22Å; M152-I160 HydrophobicContact CG-CG2 4.23Å; M152-I160 HydrophobicContact SD-CB 4.4Å; M152-I160 HydrophobicContact SD-CD1 3.81Å; M152-I160 HydrophobicContact SD-CG1 4.26Å; M152-I160 HydrophobicContact SD-CG2 3.35Å; M152-I160 WeakPolarHBondContact SD-CG2 3.47Å; I160-L177 HydrophobicContact CD1-CD2 3.81Å; I160-K208 PolarHBondContact N-O 2.88Å; I160-K208 VanDerWaalsContact N-O 3.09Å; I160-A209 HydrophobicContact CG1-CB 4.18Å; I160-E210 PolarHBondContact O-N 2.93Å; I160-V235 WeakPolarHBondContact CA-O 3.41Å; I160-V235 HydrophobicContact CG2-CB 3.99Å; I160-V235 HydrophobicContact CG2-CG1 3.76Å; I160-I237 HydrophobicContact CD1-CD1 3.52Å; I160-I237 HydrophobicContact CD1-CG1 4.17Å
161	I	92.8	Very high	89.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	127.6	162.8	-50.5	175.6	0	0	0	107.3	I163 L213 A228 L231 A233 V235 I236 I237	I161-I163 HydrophobicContact CG2-CG1 4.16Å; I161-L213 HydrophobicContact CG2-CD1 3.95Å; I161-L213 HydrophobicContact CG2-CG 4.48Å; I161-A228 HydrophobicContact CD1-CB 4.35Å; I161-A228 VanDerWaalsContact CD1-O 3.27Å; I161-A228 WeakPolarHBondContact CD1-O 3.39Å; I161-L231 HydrophobicContact CD1-CB 4.15Å; I161-L231 HydrophobicContact CD1-CD1 3.92Å; I161-L231 HydrophobicContact CG1-CD1 3.94Å; I161-L231 HydrophobicContact CG2-CD1 4.3Å; I161-A233 HydrophobicContact CD1-CB 4.45Å; I161-A233 HydrophobicContact CG1-CB 3.84Å; I161-V235 PolarHBondContact N-O 3.4Å; I161-I236 HydrophobicContact CB-CG1 4.33Å; I161-I236 HydrophobicContact CD1-CG1 4.23Å; I161-I236 WeakPolarHBondContact O-CA 3.27Å; I161-I237 PolarHBondContact O-N 2.89Å
162	L	94.2	Very high	89.5	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.1	172.6	177	65.6	0	0	0	109.6	V164 Q174 L177 K211 V212 L213 I237	L162-V164 HydrophobicContact CD1-CG1 3.84Å; L162-V164 HydrophobicContact CD2-CG1 4.2Å; L162-V164 HydrophobicContact CG-CG1 3.89Å; L162-Q174 HydrophobicContact CD2-CB 3.98Å; L162-Q174 HydrophobicContact CD2-CG 4.06Å; L162-L177 HydrophobicContact CD1-CD2 4.28Å; L162-L177 HydrophobicContact CD2-CD2 4.29Å; L162-K211 PolarHBondContact N-O 3.4Å; L162-K211 VanDerWaalsContact N-O 3.1Å; L162-V212 HydrophobicContact CB-CG1 4.32Å; L162-V212 HydrophobicContact CB-CG2 4.28Å; L162-V212 HydrophobicContact CD2-CG1 3.94Å; L162-V212 HydrophobicContact CD2-CG2 4.14Å; L162-V212 HydrophobicContact CG-CG1 4.16Å; L162-V212 CarbonylContact O-C 3.54Å; L162-V212 WeakPolarHBondContact O-CA 3.4Å; L162-L213 PolarHBondContact O-N 3.38Å; L162-I237 HydrophobicContact CD1-CB 3.94Å; L162-I237 HydrophobicContact CD1-CG2 3.95Å
163	I	94.7	Very high	89.7	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.7	175.5	-54	-178	0	0	0	108.2	I161 L213 F215 L225 I236 I237 L238 S239	I161-I163 HydrophobicContact CG2-CG1 4.16Å; I163-L213 WeakPolarHBondContact CA-O 3.21Å; I163-L213 HydrophobicContact CG1-CB 4.41Å; I163-F215 HydrophobicContact CG2-CD1 3.77Å; I163-F215 HydrophobicContact CG2-CE1 3.89Å; I163-L225 HydrophobicContact CD1-CD2 3.83Å; I163-I236 HydrophobicContact CD1-CG2 3.64Å; I163-I236 HydrophobicContact CG1-CG2 4.06Å; I163-I237 PolarHBondContact N-O 3.44Å; I163-L238 HydrophobicContact CB-CD1 4.01Å; I163-L238 HydrophobicContact CG2-CD1 3.79Å; I163-L238 WeakPolarHBondContact O-CA 3.39Å; I163-S239 PolarHBondContact O-N 2.88Å
164	V	94.7	Very high	90.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	144.5	-176.8	-70.7	0	0	0	0	112.4	L162 Q174 V212 L213 Q214 F215 S239	L162-V164 HydrophobicContact CD1-CG1 3.84Å; L162-V164 HydrophobicContact CD2-CG1 4.2Å; L162-V164 HydrophobicContact CG-CG1 3.89Å; V164-Q174 HydrophobicContact CG2-CB 4.49Å; V164-V212 HydrophobicContact CG2-CG1 4.07Å; V164-L213 PolarHBondContact N-O 2.91Å; V164-Q214 HydrophobicContact CG2-CG 3.96Å; V164-Q214 WeakPolarHBondContact O-CA 3.17Å; V164-F215 VanDerWaalsContact C-CD1 3.48Å; V164-F215 VanDerWaalsContact C-CE1 3.47Å; V164-F215 WeakPolarHBondContact O-CD1 3.47Å; V164-F215 PolarHBondContact O-N 3.33Å; V164-S239 WeakPolarHBondContact CA-O 3.36Å
165	S	93.3	Very high	90.3	Very high	9 Å²	9	39 Å²	39	6%	0.063	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	140.8	166.2	43.3	0	0	0	0	111.4	D167 G170 F215 S239	S165-D167 WeakPolarHBondContact CB-OD1 3.42Å; S165-D167 PolarHBondContact O-N 3.11Å; S165-D167 PolarHBondContact OG-OD1 3.28Å; S165-G170 WeakPolarHBondContact O-CA 3.45Å; S165-F215 CarbonylContact C-O 3.57Å; S165-F215 WeakPolarHBondContact CA-O 3.4Å; S165-S239 PolarHBondContact N-O 3.5Å
166	D	91.3	Very high	90.5	Very high	78 Å²	78	41.4 Å²	41.4	42%	0.417	20%	0.198	S	C	.	.	S	Bend	trans	-77.6	51.8	171.2	-172.7	31.8	0	0	0	112.1	R171 F215	D166-R171 VanDerWaalsContact OD1-CD 3.24Å; D166-R171 WeakPolarHBondContact OD1-CD 3.39Å; D166-R171 IonicContact OD1-CZ 3.22Å; D166-R171 IonicContact OD1-NE 3.76Å; D166-R171 PolarHBondContact OD1-NE 3.02Å; D166-R171 IonicContact OD1-NH1 3.75Å; D166-R171 PolarHBondContact OD1-NH1 3.39Å; D166-R171 IonicContact OD1-NH2 2.87Å; D166-R171 IonicContact OD2-NH1 2.69Å; D166-F215 PolarHBondContact N-O 3.16Å
167	D	89.6	Confident	90.7	Very high	57 Å²	57	35.7 Å²	35.7	31%	0.305	17%	0.167	S	C	.	.	S	Bend	trans	-110	-166.9	174	86.3	-64.3	0	0	0	110.2	S165 E169 G170 R171	S165-D167 WeakPolarHBondContact CB-OD1 3.42Å; S165-D167 PolarHBondContact O-N 3.11Å; S165-D167 PolarHBondContact OG-OD1 3.28Å; D167-E169 VanDerWaalsContact CG-N 3.31Å; D167-E169 PolarHBondContact OD1-N 3Å; D167-E169 VanDerWaalsContact OD2-CB 3.24Å; D167-E169 WeakPolarHBondContact OD2-CB 3.25Å; D167-E169 PolarHBondContact OD2-N 3.24Å; D167-G170 PolarHBondContact OD1-N 2.99Å; D167-R171 PolarHBondContact O-NE 2.88Å; D167-R171 PolarHBondContact O-NH2 3.09Å
168	H	88.4	Confident	90.7	Very high	75 Å²	75	39 Å²	39	35%	0.347	18%	0.183	S	C	.	.	H	α-helix	trans	-77.1	-32.8	174.5	-169.2	-50.7	0	0	0	111.5	A172	H168-A172 WeakPolarHBondContact O-CB 3.16Å; H168-A172 PolarHBondContact O-N 3.33Å
169	E	88.9	Confident	91	Very high	11 Å²	11	37.9 Å²	37.9	5%	0.051	18%	0.178	C	C	.	.	H	α-helix	trans	-71.3	-51.3	-178.2	-162.4	62.9	-122	0	0	111.6	M122 S123 Y141 S142 D167 R171 A172 A173	M122-E169 VanDerWaalsContact CA-OE2 3.26Å; M122-E169 WeakPolarHBondContact CA-OE2 3.28Å; S123-E169 VanDerWaalsContact CB-OE1 3.29Å; S123-E169 WeakPolarHBondContact CB-OE1 3.08Å; S123-E169 PolarHBondContact N-OE2 3.03Å; S123-E169 PolarHBondContact OG-OE1 2.95Å; Y141-E169 WeakPolarHBondContact CB-OE1 3.46Å; S142-E169 PolarHBondContact N-OE1 3.1Å; D167-E169 VanDerWaalsContact CG-N 3.31Å; D167-E169 PolarHBondContact OD1-N 3Å; D167-E169 VanDerWaalsContact OD2-CB 3.24Å; D167-E169 WeakPolarHBondContact OD2-CB 3.25Å; D167-E169 PolarHBondContact OD2-N 3.24Å; E169-R171 PolarHBondContact O-N 3.11Å; E169-A172 PolarHBondContact O-N 2.8Å; E169-A172 VanDerWaalsContact O-N 3.13Å; E169-A173 WeakPolarHBondContact O-CB 3.46Å; E169-A173 PolarHBondContact O-N 2.84Å
170	G	90	Very high	91	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.7	-44.3	179.5	0	0	0	0	0	112.9	S165 D167 A173 Q174	S165-G170 WeakPolarHBondContact O-CA 3.45Å; D167-G170 PolarHBondContact OD1-N 2.99Å; G170-A173 PolarHBondContact O-N 2.87Å; G170-Q174 WeakPolarHBondContact O-CB 3.34Å; G170-Q174 PolarHBondContact O-N 2.85Å
171	R	90.9	Very high	90.6	Very high	122 Å²	122	37 Å²	37	46%	0.46	18%	0.176	S	C	.	.	H	α-helix	trans	-68.3	-32.2	174.7	-71.5	-178.3	-68.1	-154.8	0.5	113.5	D166 D167 E169 K175	D166-R171 VanDerWaalsContact OD1-CD 3.24Å; D166-R171 WeakPolarHBondContact OD1-CD 3.39Å; D166-R171 IonicContact OD1-CZ 3.22Å; D166-R171 IonicContact OD1-NE 3.76Å; D166-R171 PolarHBondContact OD1-NE 3.02Å; D166-R171 IonicContact OD1-NH1 3.75Å; D166-R171 PolarHBondContact OD1-NH1 3.39Å; D166-R171 IonicContact OD1-NH2 2.87Å; D166-R171 IonicContact OD2-NH1 2.69Å; D167-R171 PolarHBondContact O-NE 2.88Å; D167-R171 PolarHBondContact O-NH2 3.09Å; E169-R171 PolarHBondContact O-N 3.11Å; R171-K175 VanDerWaalsContact O-CB 3.31Å; R171-K175 WeakPolarHBondContact O-CB 3.29Å; R171-K175 PolarHBondContact O-N 2.86Å
172	A	91.8	Very high	89.8	Confident	20 Å²	20	43.3 Å²	43.3	17%	0.165	21%	0.205	C	C	.	.	H	α-helix	trans	-69.6	-40.2	172.2	0	0	0	0	0	111.7	H168 E169 R176	H168-A172 WeakPolarHBondContact O-CB 3.16Å; H168-A172 PolarHBondContact O-N 3.33Å; E169-A172 PolarHBondContact O-N 2.8Å; E169-A172 VanDerWaalsContact O-N 3.13Å; A172-R176 WeakPolarHBondContact O-CB 3.49Å; A172-R176 PolarHBondContact O-N 2.87Å
173	A	92.2	Very high	88.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.9	-44.6	175.1	0	0	0	0	0	111.9	W148 E169 G170 R176 L177	W148-A173 HydrophobicContact CZ3-CB 4.47Å; E169-A173 WeakPolarHBondContact O-CB 3.46Å; E169-A173 PolarHBondContact O-N 2.84Å; G170-A173 PolarHBondContact O-N 2.87Å; A173-R176 PolarHBondContact O-N 3.22Å; A173-L177 WeakPolarHBondContact O-CB 3.29Å; A173-L177 PolarHBondContact O-N 3.27Å
174	Q	92.5	Very high	87	Confident	26 Å²	26	51 Å²	51	12%	0.121	24%	0.237	C	C	.	.	H	α-helix	trans	-55	-60.9	172	173.5	-176.6	-6.1	0	0	111.1	L162 V164 G170 R176 L177 E178 V212	L162-Q174 HydrophobicContact CD2-CB 3.98Å; L162-Q174 HydrophobicContact CD2-CG 4.06Å; V164-Q174 HydrophobicContact CG2-CB 4.49Å; G170-Q174 WeakPolarHBondContact O-CB 3.34Å; G170-Q174 PolarHBondContact O-N 2.85Å; Q174-R176 PolarHBondContact O-N 3.5Å; Q174-R176 VanDerWaalsContact O-N 3.16Å; Q174-L177 PolarHBondContact O-N 3.18Å; Q174-E178 HydrophobicContact CG-CG 4.3Å; Q174-E178 VanDerWaalsContact CG-OE1 3.23Å; Q174-E178 WeakPolarHBondContact CG-OE1 3.45Å; Q174-E178 PolarHBondContact NE2-OE1 3.35Å; Q174-E178 WeakPolarHBondContact O-CG 3.43Å; Q174-E178 PolarHBondContact O-N 3.33Å; Q174-V212 HydrophobicContact CG-CG1 4.2Å
175	K	91.6	Very high	85.3	Confident	147 Å²	147	54.5 Å²	54.5	64%	0.639	25%	0.254	S	S	*	.	H	α-helix	trans	-55.4	-37.7	179.8	-178.8	179.9	178.1	-177.8	0	111.5	R171 T179	R171-K175 VanDerWaalsContact O-CB 3.31Å; R171-K175 WeakPolarHBondContact O-CB 3.29Å; R171-K175 PolarHBondContact O-N 2.86Å; K175-T179 WeakPolarHBondContact O-CG2 3.27Å; K175-T179 PolarHBondContact O-N 2.59Å; K175-T179 VanDerWaalsContact O-N 3.11Å; K175-T179 PolarHBondContact O-OG1 3.28Å
176	R	91	Very high	83.4	Confident	68 Å²	68	57.7 Å²	57.7	26%	0.257	27%	0.273	S	S	.	.	H	α-helix	trans	-70.3	-39.5	179.5	-166	48.2	163.6	148.2	-11.3	112.1	A145 H146 A172 A173 Q174 T179 L180	A145-R176 HydrophobicContact CB-CB 4.32Å; A145-R176 HydrophobicContact CB-CG 4.3Å; H146-R176 PolarHBondContact NE2-NH2 3.24Å; A172-R176 WeakPolarHBondContact O-CB 3.49Å; A172-R176 PolarHBondContact O-N 2.87Å; A173-R176 PolarHBondContact O-N 3.22Å; Q174-R176 PolarHBondContact O-N 3.5Å; Q174-R176 VanDerWaalsContact O-N 3.16Å; R176-T179 PolarHBondContact NH1-OG1 3.09Å; R176-T179 PolarHBondContact O-OG1 2.8Å; R176-L180 WeakPolarHBondContact O-CG 3.48Å
177	L	90.8	Very high	81.6	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-48.5	174.3	-170.5	60.4	0	0	0	111.1	A145 F149 M152 I160 L162 A173 Q174 T179 L180 L181 I237	A145-L177 HydrophobicContact CB-CB 4.1Å; A145-L177 HydrophobicContact CB-CD1 4.28Å; F149-L177 HydrophobicContact CB-CD1 4.4Å; M152-L177 HydrophobicContact CE-CD1 4.04Å; I160-L177 HydrophobicContact CD1-CD2 3.81Å; L162-L177 HydrophobicContact CD1-CD2 4.28Å; L162-L177 HydrophobicContact CD2-CD2 4.29Å; A173-L177 WeakPolarHBondContact O-CB 3.29Å; A173-L177 PolarHBondContact O-N 3.27Å; Q174-L177 PolarHBondContact O-N 3.18Å; L177-T179 PolarHBondContact O-N 2.74Å; L177-L180 WeakPolarHBondContact O-CB 3.3Å; L177-L180 PolarHBondContact O-N 2.94Å; L177-L181 WeakPolarHBondContact O-CG 3.27Å; L177-L181 PolarHBondContact O-N 2.83Å; L177-I237 HydrophobicContact CD2-CD1 4.12Å
178	E	88.3	Confident	79.7	Confident	72 Å²	72	59.6 Å²	59.6	34%	0.336	28%	0.277	S	S	.	.	H	α-helix	trans	-52.4	-48.4	178.5	-72.1	168	165.8	0	0	112	Q174 L180 L181 E182	Q174-E178 HydrophobicContact CG-CG 4.3Å; Q174-E178 VanDerWaalsContact CG-OE1 3.23Å; Q174-E178 WeakPolarHBondContact CG-OE1 3.45Å; Q174-E178 PolarHBondContact NE2-OE1 3.35Å; Q174-E178 WeakPolarHBondContact O-CG 3.43Å; Q174-E178 PolarHBondContact O-N 3.33Å; E178-L180 PolarHBondContact O-N 2.81Å; E178-L181 PolarHBondContact O-N 3.03Å; E178-E182 PolarHBondContact O-N 2.88Å
179	T	88.3	Confident	77.9	Confident	43 Å²	43	62.1 Å²	62.1	26%	0.264	29%	0.287	S	S	.	.	H	α-helix	trans	-59.4	-30.9	178	55.6	0	0	0	0	113.5	K175 R176 L177 E183	K175-T179 WeakPolarHBondContact O-CG2 3.27Å; K175-T179 PolarHBondContact O-N 2.59Å; K175-T179 VanDerWaalsContact O-N 3.11Å; K175-T179 PolarHBondContact O-OG1 3.28Å; R176-T179 PolarHBondContact NH1-OG1 3.09Å; R176-T179 PolarHBondContact O-OG1 2.8Å; L177-T179 PolarHBondContact O-N 2.74Å; T179-E183 VanDerWaalsContact O-CB 3.28Å; T179-E183 WeakPolarHBondContact O-CB 3.24Å; T179-E183 WeakPolarHBondContact O-CG 3.36Å; T179-E183 PolarHBondContact O-N 2.97Å
180	L	86	Confident	75.9	Confident	15 Å²	15	69.8 Å²	69.8	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-75.7	-28.9	177.3	-61.8	171.5	0	0	0	112.7	F149 R176 L177 E178	F149-L180 HydrophobicContact CB-CD1 4.2Å; F149-L180 HydrophobicContact CD2-CB 3.99Å; F149-L180 HydrophobicContact CE2-CB 4.15Å; F149-L180 WeakPolarHBondContact CE2-O 3.19Å; F149-L180 HydrophobicContact CG-CB 4.21Å; F149-L180 HydrophobicContact CG-CD1 4.47Å; F149-L180 WeakPolarHBondContact CZ-O 3.36Å; R176-L180 WeakPolarHBondContact O-CG 3.48Å; L177-L180 WeakPolarHBondContact O-CB 3.3Å; L177-L180 PolarHBondContact O-N 2.94Å; E178-L180 PolarHBondContact O-N 2.81Å
181	L	82.4	Confident	73.8	Confident	28 Å²	28	78.8 Å²	78.8	15%	0.147	35%	0.354	C	S	.	.	H	α-helix	trans	-70.9	-48.1	172.1	-44.6	-173.6	0	0	0	109.8	F149 L177 E178 R184 E185 P207 A209	F149-L181 HydrophobicContact CD2-CD2 3.85Å; F149-L181 HydrophobicContact CE2-CD2 3.85Å; L177-L181 WeakPolarHBondContact O-CG 3.27Å; L177-L181 PolarHBondContact O-N 2.83Å; E178-L181 PolarHBondContact O-N 3.03Å; L181-R184 PolarHBondContact O-N 2.94Å; L181-E185 PolarHBondContact O-N 3.29Å; L181-E185 VanDerWaalsContact O-N 3.17Å; L181-P207 HydrophobicContact CD2-CG 4.25Å; L181-A209 HydrophobicContact CD1-CB 4.44Å
182	E	75.1	Confident	71.5	Confident	132 Å²	132	78 Å²	78	62%	0.617	36%	0.359	S	S	*	.	H	α-helix	trans	-65.3	-44.9	-179.4	-68.2	-171.5	153.5	0	0	113.8	E178 R184 E185 T186	E178-E182 PolarHBondContact O-N 2.88Å; E182-R184 PolarHBondContact O-N 3.36Å; E182-R184 VanDerWaalsContact O-N 3.14Å; E182-E185 PolarHBondContact O-N 3.01Å; E182-T186 PolarHBondContact O-N 3.48Å; E182-T186 PolarHBondContact O-OG1 3.45Å; E182-T186 VanDerWaalsContact O-OG1 3.05Å
183	E	67.9	Low	69.3	Low	84 Å²	84	87.5 Å²	87.5	39%	0.393	39%	0.392	S	S	.	.	H	α-helix	trans	-56.6	-31	178	-91	-161	-126.8	0	0	111.9	T179 T186 K187	T179-E183 VanDerWaalsContact O-CB 3.28Å; T179-E183 WeakPolarHBondContact O-CB 3.24Å; T179-E183 WeakPolarHBondContact O-CG 3.36Å; T179-E183 PolarHBondContact O-N 2.97Å; E183-T186 PolarHBondContact O-OG1 3.26Å; E183-T186 VanDerWaalsContact O-OG1 3.09Å; E183-K187 WeakPolarHBondContact O-CB 3.35Å; E183-K187 VanDerWaalsContact O-CD 3.25Å; E183-K187 WeakPolarHBondContact O-CD 3.22Å; E183-K187 WeakPolarHBondContact O-CG 3.4Å; E183-K187 PolarHBondContact O-N 3.42Å; E183-K187 IonicContact OE2-NZ 3.74Å; E183-K187 PolarHBondContact OE2-NZ 2.99Å
184	R	62.6	Low	67.1	Low	80 Å²	80	95 Å²	95	30%	0.302	43%	0.428	S	S	.	.	H	α-helix	trans	-86.4	-37.3	-179.1	-166.9	167.4	179	-164.6	-3.9	112.9	F149 R153 L181 E182 T186 K187 N188	F149-R184 HydrophobicContact CZ-CB 4.43Å; R153-R184 VanDerWaalsContact CD-NH1 3.33Å; L181-R184 PolarHBondContact O-N 2.94Å; E182-R184 PolarHBondContact O-N 3.36Å; E182-R184 VanDerWaalsContact O-N 3.14Å; R184-T186 VanDerWaalsContact C-N 3.28Å; R184-T186 PolarHBondContact O-N 3.32Å; R184-K187 PolarHBondContact O-N 3.46Å; R184-N188 WeakPolarHBondContact O-CB 3.32Å; R184-N188 PolarHBondContact O-N 2.66Å
185	E	58.7	Low	64.5	Low	74 Å²	74	99.4 Å²	99.4	35%	0.346	45%	0.452	S	S	.	.	H	α-helix	trans	-56.5	-44.8	169.9	-82.3	-143.2	171.9	0	0	111.1	L181 E182 N188 K189 K208	L181-E185 PolarHBondContact O-N 3.29Å; L181-E185 VanDerWaalsContact O-N 3.17Å; E182-E185 PolarHBondContact O-N 3.01Å; E185-N188 PolarHBondContact O-N 3.46Å; E185-K189 WeakPolarHBondContact O-CB 3.5Å; E185-K189 WeakPolarHBondContact O-CD 3.24Å; E185-K189 VanDerWaalsContact O-CG 3.23Å; E185-K189 WeakPolarHBondContact O-CG 3.46Å; E185-K189 PolarHBondContact O-N 2.56Å; E185-K189 WeakPolarHBondContact OE2-CE 3.32Å; E185-K189 IonicContact OE2-NZ 2.59Å; E185-K189 PolarHBondContact OE2-NZ 3.02Å; E185-K208 WeakPolarHBondContact OE1-CE 3.47Å; E185-K208 IonicContact OE1-NZ 3.68Å; E185-K208 PolarHBondContact OE1-NZ 3.45Å
186	T	53.1	Low	62.1	Low	76 Å²	76	100.5 Å²	100.5	47%	0.466	46%	0.464	S	S	.	.	H	α-helix	trans	-70.2	-39	-178.3	53.4	0	0	0	0	113.1	E182 E183 R184 K189 K190	E182-T186 PolarHBondContact O-N 3.48Å; E182-T186 PolarHBondContact O-OG1 3.45Å; E182-T186 VanDerWaalsContact O-OG1 3.05Å; E183-T186 PolarHBondContact O-OG1 3.26Å; E183-T186 VanDerWaalsContact O-OG1 3.09Å; R184-T186 VanDerWaalsContact C-N 3.28Å; R184-T186 PolarHBondContact O-N 3.32Å; T186-K189 PolarHBondContact O-N 2.97Å; T186-K190 PolarHBondContact O-N 3.49Å
187	K	54.3	Low	59.6	Low	120 Å²	120	104.6 Å²	104.6	52%	0.522	49%	0.491	S	S	.	.	H	α-helix	trans	-65.3	-40.5	173.6	-73.1	166.4	-166.6	164.7	0	112.2	E183 R184 R191	E183-K187 WeakPolarHBondContact O-CB 3.35Å; E183-K187 VanDerWaalsContact O-CD 3.25Å; E183-K187 WeakPolarHBondContact O-CD 3.22Å; E183-K187 WeakPolarHBondContact O-CG 3.4Å; E183-K187 PolarHBondContact O-N 3.42Å; E183-K187 IonicContact OE2-NZ 3.74Å; E183-K187 PolarHBondContact OE2-NZ 2.99Å; R184-K187 PolarHBondContact O-N 3.46Å; K187-R191 PolarHBondContact O-N 2.95Å
188	N	49.8	Very low	57.3	Low	56 Å²	56	112.6 Å²	112.6	30%	0.299	53%	0.528	S	S	.	.	H	α-helix	trans	-63.6	-47.3	172.7	-78.5	4	0	0	0	111.3	R184 E185 K190 R191 N192 K204	R184-N188 WeakPolarHBondContact O-CB 3.32Å; R184-N188 PolarHBondContact O-N 2.66Å; E185-N188 PolarHBondContact O-N 3.46Å; N188-K190 VanDerWaalsContact C-N 3.33Å; N188-K190 PolarHBondContact O-N 3.06Å; N188-R191 PolarHBondContact O-N 3.33Å; N188-N192 WeakPolarHBondContact O-CB 3.41Å; N188-N192 VanDerWaalsContact O-CG 3.25Å; N188-N192 PolarHBondContact O-N 2.92Å; N188-N192 PolarHBondContact O-OD1 3.13Å; N188-K204 PolarHBondContact ND2-O 2.9Å
189	K	50.1	Low	54.9	Low	127 Å²	127	117.5 Å²	117.5	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-57.8	-40.7	178.4	-76.2	164.8	-173.8	165.4	0	112.7	E185 T186	E185-K189 WeakPolarHBondContact O-CB 3.5Å; E185-K189 WeakPolarHBondContact O-CD 3.24Å; E185-K189 VanDerWaalsContact O-CG 3.23Å; E185-K189 WeakPolarHBondContact O-CG 3.46Å; E185-K189 PolarHBondContact O-N 2.56Å; E185-K189 WeakPolarHBondContact OE2-CE 3.32Å; E185-K189 IonicContact OE2-NZ 2.59Å; E185-K189 PolarHBondContact OE2-NZ 3.02Å; T186-K189 PolarHBondContact O-N 2.97Å
190	K	47.4	Very low	52.4	Low	172 Å²	172	119.9 Å²	119.9	75%	0.748	57%	0.574	S	S	*	*	H	α-helix	trans	-65.8	-48.8	175.6	-76	-172.9	175.1	-174.5	0	112.6	T186 N188 N192 Y193	T186-K190 PolarHBondContact O-N 3.49Å; N188-K190 VanDerWaalsContact C-N 3.33Å; N188-K190 PolarHBondContact O-N 3.06Å; K190-N192 VanDerWaalsContact C-N 3.26Å; K190-N192 PolarHBondContact O-N 3.39Å; K190-Y193 PolarHBondContact O-N 3.21Å
191	R	45.7	Very low	50.3	Low	189 Å²	189	127.9 Å²	127.9	71%	0.713	61%	0.605	S	S	*	*	H	α-helix	trans	-66.7	-27.6	-177.6	-164.2	174.7	-174	172.6	2.9	113.2	K187 N188 Y193	K187-R191 PolarHBondContact O-N 2.95Å; N188-R191 PolarHBondContact O-N 3.33Å; R191-Y193 VanDerWaalsContact C-N 3.31Å; R191-Y193 PolarHBondContact O-N 3.19Å
192	N	42	Very low	48.2	Very low	106 Å²	106	131.4 Å²	131.4	57%	0.567	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-5.2	178.7	-69.1	11.7	0	0	0	113.8	N188 K190 E194	N188-N192 WeakPolarHBondContact O-CB 3.41Å; N188-N192 VanDerWaalsContact O-CG 3.25Å; N188-N192 PolarHBondContact O-N 2.92Å; N188-N192 PolarHBondContact O-OD1 3.13Å; K190-N192 VanDerWaalsContact C-N 3.26Å; K190-N192 PolarHBondContact O-N 3.39Å; N192-E194 VanDerWaalsContact C-N 3.29Å
193	Y	46.8	Very low	46.5	Very low	219 Å²	219	131.9 Å²	131.9	86%	0.859	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-10.5	173.7	-146.8	-93.7	0	0	0	112.8	K190 R191	K190-Y193 PolarHBondContact O-N 3.21Å; R191-Y193 VanDerWaalsContact C-N 3.31Å; R191-Y193 PolarHBondContact O-N 3.19Å
194	E	44.7	Very low	45.5	Very low	158 Å²	158	136.2 Å²	136.2	74%	0.738	65%	0.648	S	S	*	*	S	Bend	trans	-101	-7.8	-177.3	-62.8	177.4	148.5	0	0	113.7	N192	N192-E194 VanDerWaalsContact C-N 3.29Å
195	N	38.9	Very low	45.2	Very low	118 Å²	118	138 Å²	138	63%	0.631	66%	0.655	S	S	*	*			trans	-136.7	108.1	-179	-72.3	-95.7	0	0	0	110.2	D197	N195-D197 VanDerWaalsContact C-N 3.33Å; N195-D197 PolarHBondContact O-N 2.69Å
196	L	41.3	Very low	45.3	Very low	171 Å²	171	135.4 Å²	135.4	90%	0.895	65%	0.648	S	S	*	*			trans	-90.4	26.7	-169.8	-154.9	78.5	0	0	0	114.2	Q198	L196-Q198 PolarHBondContact O-N 3.29Å
197	D	37.3	Very low	46.2	Very low	154 Å²	154	132.2 Å²	132.2	82%	0.824	63%	0.629	S	S	*	*			trans	-87.5	101.8	-179.6	-89.6	-42.6	0	0	0	112.2	N195 L199	N195-D197 VanDerWaalsContact C-N 3.33Å; N195-D197 PolarHBondContact O-N 2.69Å; D197-L199 VanDerWaalsContact C-N 3.29Å; D197-L199 PolarHBondContact O-N 3.01Å
198	Q	43.5	Very low	47.2	Very low	171 Å²	171	129.6 Å²	129.6	80%	0.799	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	39.7	-160.8	-154.6	166.8	10.9	0	0	114.3	L196	L196-Q198 PolarHBondContact O-N 3.29Å
199	L	38	Very low	48.5	Very low	174 Å²	174	128.6 Å²	128.6	91%	0.911	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.5	8	-168.7	-108.7	143.6	0	0	0	116.5	D197	D197-L199 VanDerWaalsContact C-N 3.29Å; D197-L199 PolarHBondContact O-N 3.01Å
200	S	34.7	Very low	49.8	Very low	94 Å²	94	125 Å²	125	66%	0.657	60%	0.602	S	S	*	*			trans	-130	53.7	176	-153	0	0	0	0	113
201	Y	42.2	Very low	51.5	Low	183 Å²	183	120.1 Å²	120.1	72%	0.718	58%	0.581	S	S	*	*			trans	-81.5	-21.5	-168	-134.5	-92.3	0	0	0	115.2
202	D	38.5	Very low	53.6	Low	101 Å²	101	113.2 Å²	113.2	54%	0.54	56%	0.559	S	S	.	*	S	Bend	trans	-92.6	-32.4	-170.3	-68.7	-51.6	0	0	0	115	K204 R205	D202-K204 PolarHBondContact O-N 3.2Å; D202-R205 IonicContact OD1-CZ 3.46Å; D202-R205 IonicContact OD1-NE 2.66Å; D202-R205 IonicContact OD1-NH2 3.72Å; D202-R205 PolarHBondContact OD1-NH2 3.44Å
203	N	38.9	Very low	55.9	Low	143 Å²	143	108.4 Å²	108.4	77%	0.765	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	2.4	-167.1	-76.8	-20.3	0	0	0	116.2
204	K	46.4	Very low	58	Low	174 Å²	174	102.5 Å²	102.5	76%	0.757	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.1	32.3	-179.8	-68.4	-174.6	-178.6	162	0	114.9	N188 D202	N188-K204 PolarHBondContact ND2-O 2.9Å; D202-K204 PolarHBondContact O-N 3.2Å
205	R	57.1	Low	60.2	Low	117 Å²	117	95.2 Å²	95.2	44%	0.442	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-61	142.3	160.4	-60.1	-166.9	-163.6	-170.8	17.2	109.1	D202 D781	D202-R205 IonicContact OD1-CZ 3.46Å; D202-R205 IonicContact OD1-NE 2.66Å; D202-R205 IonicContact OD1-NH2 3.72Å; D202-R205 PolarHBondContact OD1-NH2 3.44Å; R205-D781 IonicContact NH1-OD1 3.88Å; R205-D781 PolarHBondContact NH1-OD1 3.28Å; R205-D781 VanDerWaalsContact NH1-OD1 3.14Å
206	G	60.1	Low	62.6	Low	20 Å²	20	92 Å²	92	21%	0.206	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-86.8	166	172.7	0	0	0	0	0	111.1
207	P	72.4	Confident	64.5	Low	9 Å²	9	92.2 Å²	92.2	6%	0.058	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-59.6	144.5	170.1	26.7	-34.1	0	0	0	111.1	F149 M152 L181	F149-P207 HydrophobicContact CD2-CG 4.05Å; F149-P207 HydrophobicContact CE2-CG 3.79Å; M152-P207 HydrophobicContact CB-CB 4.27Å; M152-P207 HydrophobicContact CB-CG 4.48Å; M152-P207 HydrophobicContact CE-CB 4.05Å; M152-P207 HydrophobicContact CE-CG 4.18Å; M152-P207 HydrophobicContact SD-CB 3.78Å; M152-P207 HydrophobicContact SD-CG 4.48Å; L181-P207 HydrophobicContact CD2-CG 4.25Å
208	K	74.8	Confident	66.5	Low	65 Å²	65	94 Å²	94	28%	0.283	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	145.2	174.7	-62.8	-166.2	178.2	-160.4	0	110.2	N158 H159 I160 E185 D781	N158-K208 PolarHBondContact O-N 3.36Å; H159-K208 WeakPolarHBondContact CA-O 3.25Å; I160-K208 PolarHBondContact N-O 2.88Å; I160-K208 VanDerWaalsContact N-O 3.09Å; E185-K208 WeakPolarHBondContact OE1-CE 3.47Å; E185-K208 IonicContact OE1-NZ 3.68Å; E185-K208 PolarHBondContact OE1-NZ 3.45Å; K208-D781 IonicContact NZ-OD1 2.69Å; K208-D781 IonicContact NZ-OD2 3.79Å; K208-D781 PolarHBondContact NZ-OD2 3.48Å
209	A	77.1	Confident	68.3	Low	36 Å²	36	88.5 Å²	88.5	30%	0.298	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	127	162.9	0	0	0	0	0	109.1	I160 L181	I160-A209 HydrophobicContact CG1-CB 4.18Å; L181-A209 HydrophobicContact CD1-CB 4.44Å
210	E	77.3	Confident	70.7	Confident	50 Å²	50	85.2 Å²	85.2	23%	0.234	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-43	171.4	-176.3	-178.1	171	0	0	109.9	I160 E232 A233 R779	I160-E210 PolarHBondContact O-N 2.93Å; E210-E232 PolarHBondContact OE1-N 2.99Å; E210-E232 PolarHBondContact OE2-N 3.01Å; E210-A233 HydrophobicContact CB-CB 4.49Å; E210-A233 WeakPolarHBondContact OE2-CB 3.34Å; E210-A233 PolarHBondContact OE2-N 2.98Å; E210-R779 IonicContact OE1-NH1 2.98Å
211	K	84.6	Confident	73.3	Confident	71 Å²	71	82.1 Å²	82.1	31%	0.309	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	148.1	174.4	-155.1	162.2	-169.9	173.3	0	111.1	L162 L213 E227 L231	L162-K211 PolarHBondContact N-O 3.4Å; L162-K211 VanDerWaalsContact N-O 3.1Å; K211-L213 HydrophobicContact CD-CD2 4.03Å; K211-L213 HydrophobicContact CG-CD2 4.1Å; K211-E227 WeakPolarHBondContact CE-OE1 3.46Å; K211-E227 IonicContact NZ-OE1 2.78Å; K211-E227 PolarHBondContact NZ-OE1 2.96Å; K211-L231 HydrophobicContact CB-CD1 3.69Å; K211-L231 HydrophobicContact CD-CD1 4.27Å; K211-L231 HydrophobicContact CD-CD2 4.24Å
212	V	88.7	Confident	75.6	Confident	43 Å²	43	75.7 Å²	75.7	26%	0.261	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	128.7	165.5	-173.3	0	0	0	0	107.9	L162 V164 Q174 Q214	L162-V212 HydrophobicContact CB-CG1 4.32Å; L162-V212 HydrophobicContact CB-CG2 4.28Å; L162-V212 HydrophobicContact CD2-CG1 3.94Å; L162-V212 HydrophobicContact CD2-CG2 4.14Å; L162-V212 HydrophobicContact CG-CG1 4.16Å; L162-V212 CarbonylContact O-C 3.54Å; L162-V212 WeakPolarHBondContact O-CA 3.4Å; V164-V212 HydrophobicContact CG2-CG1 4.07Å; Q174-V212 HydrophobicContact CG-CG1 4.2Å; V212-Q214 HydrophobicContact CG1-CG 4.49Å
213	L	90.1	Very high	78.1	Confident	6 Å²	6	73.4 Å²	73.4	3%	0.031	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	107.6	-179.3	-63.7	176.9	0	0	0	108.3	I161 L162 I163 V164 K211 L224 A228	I161-L213 HydrophobicContact CG2-CD1 3.95Å; I161-L213 HydrophobicContact CG2-CG 4.48Å; L162-L213 PolarHBondContact O-N 3.38Å; I163-L213 WeakPolarHBondContact CA-O 3.21Å; I163-L213 HydrophobicContact CG1-CB 4.41Å; V164-L213 PolarHBondContact N-O 2.91Å; K211-L213 HydrophobicContact CD-CD2 4.03Å; K211-L213 HydrophobicContact CG-CD2 4.1Å; L213-L224 HydrophobicContact CB-CD1 4.1Å; L213-L224 HydrophobicContact CB-CD2 4.35Å; L213-L224 HydrophobicContact CB-CG 4.27Å; L213-L224 HydrophobicContact CD1-CG 4.43Å; L213-L224 HydrophobicContact CD2-CD1 4.1Å; L213-L224 HydrophobicContact CG-CD1 4.49Å; L213-A228 HydrophobicContact CD1-CB 3.58Å
214	Q	90.9	Very high	80.6	Confident	94 Å²	94	67.8 Å²	67.8	44%	0.439	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	136.6	177.1	-68.7	175.1	-16	0	0	109.4	V164 V212	V164-Q214 HydrophobicContact CG2-CG 3.96Å; V164-Q214 WeakPolarHBondContact O-CA 3.17Å; V212-Q214 HydrophobicContact CG1-CG 4.49Å
215	F	92.1	Very high	82.7	Confident	5 Å²	5	59.7 Å²	59.7	2%	0.022	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	152.7	-178.9	78.5	-92.3	0	0	0	112.6	I163 V164 S165 D166 L221 L224 L238 A240 D244 V248	I163-F215 HydrophobicContact CG2-CD1 3.77Å; I163-F215 HydrophobicContact CG2-CE1 3.89Å; V164-F215 VanDerWaalsContact C-CD1 3.48Å; V164-F215 VanDerWaalsContact C-CE1 3.47Å; V164-F215 WeakPolarHBondContact O-CD1 3.47Å; V164-F215 PolarHBondContact O-N 3.33Å; S165-F215 CarbonylContact C-O 3.57Å; S165-F215 WeakPolarHBondContact CA-O 3.4Å; D166-F215 PolarHBondContact N-O 3.16Å; F215-L221 HydrophobicContact CB-CD2 4.2Å; F215-L221 HydrophobicContact CD2-CD2 3.71Å; F215-L221 HydrophobicContact CE2-CD2 4.29Å; F215-L221 HydrophobicContact CG-CD2 4.03Å; F215-L224 HydrophobicContact CB-CD2 3.67Å; F215-L238 HydrophobicContact CE1-CD1 4.3Å; F215-A240 HydrophobicContact CZ-CB 4.04Å; F215-D244 HydrophobicContact CE2-CB 3.91Å; F215-D244 HydrophobicContact CZ-CB 4.03Å; F215-V248 HydrophobicContact CZ-CG2 4.21Å
216	S	89.1	Confident	84.4	Confident	50 Å²	50	58.3 Å²	58.3	35%	0.35	32%	0.315	S	S	.	.			trans	-132.3	171.3	175.4	81.2	0	0	0	0	110.6	E218 T219	S216-E218 PolarHBondContact O-N 2.73Å; S216-E218 VanDerWaalsContact O-N 3.07Å; S216-T219 PolarHBondContact N-OG1 2.88Å; S216-T219 PolarHBondContact O-N 3.03Å; S216-T219 PolarHBondContact O-OG1 2.98Å
217	Q	80.2	Confident	85.7	Confident	177 Å²	177	61.3 Å²	61.3	83%	0.827	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.7	-177.1	-65.9	-178.2	-16.1	0	0	114.2
218	E	80.4	Confident	86.5	Confident	190 Å²	190	60.9 Å²	60.9	89%	0.888	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-11.6	176.5	-61.6	-178.8	173.2	0	0	113	S216	S216-E218 PolarHBondContact O-N 2.73Å; S216-E218 VanDerWaalsContact O-N 3.07Å
219	T	81.2	Confident	87.2	Confident	57 Å²	57	61.7 Å²	61.7	35%	0.35	32%	0.324	S	S	.	.	S	Bend	trans	-79.5	137	-174.5	61	0	0	0	0	112.8	S216 L221	S216-T219 PolarHBondContact N-OG1 2.88Å; S216-T219 PolarHBondContact O-N 3.03Å; S216-T219 PolarHBondContact O-OG1 2.98Å; T219-L221 PolarHBondContact O-N 2.97Å
220	N	88.6	Confident	87.6	Confident	104 Å²	104	66.7 Å²	66.7	56%	0.556	34%	0.341	S	S	*	.			trans	-75	94.2	172.6	-177.8	0.2	0	0	0	110.7	T222 A223 L224	N220-T222 PolarHBondContact ND2-OG1 2.83Å; N220-T222 PolarHBondContact O-N 3.28Å; N220-T222 PolarHBondContact OD1-N 2.84Å; N220-T222 VanDerWaalsContact OD1-N 3.08Å; N220-T222 PolarHBondContact OD1-OG1 2.77Å; N220-A223 HydrophobicContact CB-CB 4.46Å; N220-A223 PolarHBondContact O-N 2.85Å; N220-L224 PolarHBondContact O-N 3.33Å
221	L	89.3	Confident	88	Confident	30 Å²	30	65.2 Å²	65.2	16%	0.157	34%	0.335	C	S	.	.	H	α-helix	trans	-50.7	-30.4	177.9	-61.4	177.5	0	0	0	113.9	F215 T219 L225 A247 V248 A251	F215-L221 HydrophobicContact CB-CD2 4.2Å; F215-L221 HydrophobicContact CD2-CD2 3.71Å; F215-L221 HydrophobicContact CE2-CD2 4.29Å; F215-L221 HydrophobicContact CG-CD2 4.03Å; T219-L221 PolarHBondContact O-N 2.97Å; L221-L225 WeakPolarHBondContact O-CB 3.44Å; L221-L225 WeakPolarHBondContact O-CG 3.24Å; L221-L225 PolarHBondContact O-N 3.02Å; L221-A247 HydrophobicContact CD1-CB 3.8Å; L221-V248 HydrophobicContact CD1-CG2 4.15Å; L221-V248 HydrophobicContact CD2-CG2 4.31Å; L221-A251 HydrophobicContact CB-CB 4.31Å
222	T	90.8	Very high	87.9	Confident	48 Å²	48	63.2 Å²	63.2	29%	0.294	33%	0.326	S	S	.	.	H	α-helix	trans	-71.4	-32.5	179	64.5	0	0	0	0	112.9	N220 L226 A251	N220-T222 PolarHBondContact ND2-OG1 2.83Å; N220-T222 PolarHBondContact O-N 3.28Å; N220-T222 PolarHBondContact OD1-N 2.84Å; N220-T222 VanDerWaalsContact OD1-N 3.08Å; N220-T222 PolarHBondContact OD1-OG1 2.77Å; T222-L226 VanDerWaalsContact O-CG 3.3Å; T222-L226 WeakPolarHBondContact O-CG 3.25Å; T222-L226 PolarHBondContact O-N 2.77Å; T222-A251 HydrophobicContact CG2-CB 4.25Å
223	A	89.9	Confident	87.9	Confident	52 Å²	52	61.1 Å²	61.1	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-72.2	-43	174.4	0	0	0	0	0	111	N220 L225 L226 E227	N220-A223 HydrophobicContact CB-CB 4.46Å; N220-A223 PolarHBondContact O-N 2.85Å; A223-L225 VanDerWaalsContact C-N 3.32Å; A223-L225 PolarHBondContact O-N 2.94Å; A223-L226 WeakPolarHBondContact O-CB 3.5Å; A223-L226 PolarHBondContact O-N 3.35Å; A223-E227 PolarHBondContact O-N 3.16Å
224	L	91.3	Very high	88	Confident	26 Å²	26	62.4 Å²	62.4	14%	0.136	32%	0.319	C	S	.	.	H	α-helix	trans	-60.7	-39.7	176.5	-167.8	75	0	0	0	112.5	L213 F215 N220 E227 A228	L213-L224 HydrophobicContact CB-CD1 4.1Å; L213-L224 HydrophobicContact CB-CD2 4.35Å; L213-L224 HydrophobicContact CB-CG 4.27Å; L213-L224 HydrophobicContact CD1-CG 4.43Å; L213-L224 HydrophobicContact CD2-CD1 4.1Å; L213-L224 HydrophobicContact CG-CD1 4.49Å; F215-L224 HydrophobicContact CB-CD2 3.67Å; N220-L224 PolarHBondContact O-N 3.33Å; L224-E227 PolarHBondContact O-N 3.03Å; L224-A228 PolarHBondContact O-N 3.06Å
225	L	91.9	Very high	88.1	Confident	3 Å²	3	58 Å²	58	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-78.3	-24.4	177.8	-72.6	169.5	0	0	0	113.1	I163 L221 A223 K229 A251 A252 L255 M257 W264	I163-L225 HydrophobicContact CD1-CD2 3.83Å; L221-L225 WeakPolarHBondContact O-CB 3.44Å; L221-L225 WeakPolarHBondContact O-CG 3.24Å; L221-L225 PolarHBondContact O-N 3.02Å; A223-L225 VanDerWaalsContact C-N 3.32Å; A223-L225 PolarHBondContact O-N 2.94Å; L225-K229 VanDerWaalsContact O-CB 3.32Å; L225-K229 WeakPolarHBondContact O-CB 3.31Å; L225-K229 PolarHBondContact O-N 3.27Å; L225-K229 VanDerWaalsContact O-N 3.08Å; L225-A251 HydrophobicContact CD1-CB 3.6Å; L225-A252 HydrophobicContact CD1-CB 4.37Å; L225-L255 HydrophobicContact CB-CD1 3.35Å; L225-L255 HydrophobicContact CD1-CD1 4.48Å; L225-M257 HydrophobicContact CB-SD 3.85Å; L225-M257 HydrophobicContact CD2-CE 4Å; L225-M257 HydrophobicContact CD2-SD 4.07Å; L225-M257 HydrophobicContact CG-SD 4.48Å; L225-M257 VanDerWaalsContact O-SD 3.38Å; L225-W264 HydrophobicContact CD2-CH2 4.37Å
226	L	91.1	Very high	88.2	Confident	89 Å²	89	57.7 Å²	57.7	47%	0.466	30%	0.297	S	S	.	.	H	α-helix	trans	-66.2	-44.3	166.8	-80.3	166.4	0	0	0	111	T222 A223 A228 K229 E230 L255	T222-L226 VanDerWaalsContact O-CG 3.3Å; T222-L226 WeakPolarHBondContact O-CG 3.25Å; T222-L226 PolarHBondContact O-N 2.77Å; A223-L226 WeakPolarHBondContact O-CB 3.5Å; A223-L226 PolarHBondContact O-N 3.35Å; L226-A228 PolarHBondContact O-N 2.98Å; L226-K229 WeakPolarHBondContact O-CB 3.09Å; L226-K229 PolarHBondContact O-N 3.36Å; L226-K229 VanDerWaalsContact O-N 3.1Å; L226-E230 PolarHBondContact O-N 3.07Å; L226-L255 HydrophobicContact CD2-CD2 3.71Å; L226-L255 HydrophobicContact CG-CD1 4.3Å; L226-L255 HydrophobicContact CG-CD2 3.88Å
227	E	88.8	Confident	88.5	Confident	82 Å²	82	55.3 Å²	55.3	38%	0.383	28%	0.28	S	S	.	.	H	α-helix	trans	-59.5	-45.5	172.9	-176	-176.4	-177.8	0	0	111.5	K211 A223 L224 K229 E230	K211-E227 WeakPolarHBondContact CE-OE1 3.46Å; K211-E227 IonicContact NZ-OE1 2.78Å; K211-E227 PolarHBondContact NZ-OE1 2.96Å; A223-E227 PolarHBondContact O-N 3.16Å; L224-E227 PolarHBondContact O-N 3.03Å; E227-K229 PolarHBondContact O-N 3.15Å; E227-E230 PolarHBondContact O-N 3.16Å
228	A	88.9	Confident	89.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.3	-28.8	174.8	0	0	0	0	0	113.5	I161 L213 L224 L226 M257	I161-A228 HydrophobicContact CD1-CB 4.35Å; I161-A228 VanDerWaalsContact CD1-O 3.27Å; I161-A228 WeakPolarHBondContact CD1-O 3.39Å; L213-A228 HydrophobicContact CD1-CB 3.58Å; L224-A228 PolarHBondContact O-N 3.06Å; L226-A228 PolarHBondContact O-N 2.98Å; A228-M257 HydrophobicContact CB-CE 4Å
229	K	89.3	Confident	89.9	Confident	82 Å²	82	38 Å²	38	36%	0.357	20%	0.199	S	C	.	.	H	α-helix	trans	-79.6	-23.4	-178.4	-175.4	172.4	178.6	176.6	0	113.3	L225 L226 E227 L231 L255 M257	L225-K229 VanDerWaalsContact O-CB 3.32Å; L225-K229 WeakPolarHBondContact O-CB 3.31Å; L225-K229 PolarHBondContact O-N 3.27Å; L225-K229 VanDerWaalsContact O-N 3.08Å; L226-K229 WeakPolarHBondContact O-CB 3.09Å; L226-K229 PolarHBondContact O-N 3.36Å; L226-K229 VanDerWaalsContact O-N 3.1Å; E227-K229 PolarHBondContact O-N 3.15Å; K229-L231 VanDerWaalsContact C-N 3.34Å; K229-L255 PolarHBondContact NZ-O 3.31Å; K229-M257 HydrophobicContact CB-CE 4.45Å; K229-M257 HydrophobicContact CB-SD 4.33Å; K229-M257 HydrophobicContact CD-CG 4.37Å
230	E	85.2	Confident	90.4	Very high	141 Å²	141	35.3 Å²	35.3	66%	0.659	18%	0.183	S	C	*	.	H	α-helix	trans	-77.6	-16.3	173	-72.8	-163.4	-149.6	0	0	113.7	L226 E227 K417	L226-E230 PolarHBondContact O-N 3.07Å; E227-E230 PolarHBondContact O-N 3.16Å; E230-K417 IonicContact OE2-NZ 3.97Å; E230-K417 PolarHBondContact OE2-NZ 3.38Å
231	L	84.8	Confident	90.4	Very high	19 Å²	19	31.7 Å²	31.7	10%	0.099	17%	0.166	C	C	.	.	S	Bend	trans	-67	162.4	176.7	-60.2	180	0	0	0	112.5	I161 K211 K229 R234	I161-L231 HydrophobicContact CD1-CB 4.15Å; I161-L231 HydrophobicContact CD1-CD1 3.92Å; I161-L231 HydrophobicContact CG1-CD1 3.94Å; I161-L231 HydrophobicContact CG2-CD1 4.3Å; K211-L231 HydrophobicContact CB-CD1 3.69Å; K211-L231 HydrophobicContact CD-CD1 4.27Å; K211-L231 HydrophobicContact CD-CD2 4.24Å; K229-L231 VanDerWaalsContact C-N 3.34Å; L231-R234 PolarHBondContact O-NH1 3.5Å; L231-R234 PolarHBondContact O-NH2 2.78Å
232	E	83.5	Confident	90.4	Very high	29 Å²	29	32.7 Å²	32.7	14%	0.136	17%	0.17	C	C	.	.	S	Bend	trans	-80.4	-32.4	179.3	-63.3	-165.5	139.2	0	0	112.5	E210 F410 Q411	E210-E232 PolarHBondContact OE1-N 2.99Å; E210-E232 PolarHBondContact OE2-N 3.01Å; E232-F410 CarbonylContact O-C 3.54Å; E232-F410 WeakPolarHBondContact O-CA 3.35Å; E232-Q411 PolarHBondContact O-N 3.13Å
233	A	88.6	Confident	90.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-66.6	146.5	178.4	0	0	0	0	0	113.3	H159 I161 E210	H159-A233 HydrophobicContact CB-CB 3.98Å; I161-A233 HydrophobicContact CD1-CB 4.45Å; I161-A233 HydrophobicContact CG1-CB 3.84Å; E210-A233 HydrophobicContact CB-CB 4.49Å; E210-A233 WeakPolarHBondContact OE2-CB 3.34Å; E210-A233 PolarHBondContact OE2-N 2.98Å
234	R	91.4	Very high	90.4	Very high	33 Å²	33	33.7 Å²	33.7	13%	0.125	17%	0.166	C	C	.	.			trans	-124	-5.2	177.2	-60	-68.9	166.2	-107.7	-1.2	113.4	L231 G261 Y262 V263 G409 Q411	L231-R234 PolarHBondContact O-NH1 3.5Å; L231-R234 PolarHBondContact O-NH2 2.78Å; R234-G261 WeakPolarHBondContact CB-O 3.43Å; R234-Y262 HydrophobicContact CB-CD1 4.46Å; R234-Y262 WeakPolarHBondContact O-CA 3.19Å; R234-V263 PolarHBondContact O-N 3.03Å; R234-G409 PolarHBondContact N-O 3.4Å; R234-Q411 HydrophobicContact CG-CB 3.98Å
235	V	93	Very high	90.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	118.2	167.7	-179.3	0	0	0	0	109.1	W157 I160 I161 V263 L265 G409	W157-V235 HydrophobicContact CB-CG2 4.07Å; W157-V235 HydrophobicContact CD2-CG2 3.61Å; W157-V235 HydrophobicContact CE3-CG1 4.04Å; W157-V235 HydrophobicContact CE3-CG2 3.98Å; W157-V235 HydrophobicContact CG-CG2 3.66Å; W157-V235 HydrophobicContact CZ3-CG1 4.46Å; I160-V235 WeakPolarHBondContact CA-O 3.41Å; I160-V235 HydrophobicContact CG2-CB 3.99Å; I160-V235 HydrophobicContact CG2-CG1 3.76Å; I161-V235 PolarHBondContact N-O 3.4Å; V235-V263 HydrophobicContact CG2-CB 4.14Å; V235-V263 HydrophobicContact CG2-CG2 4.38Å; V235-L265 HydrophobicContact CG1-CD1 4.18Å; V235-L265 HydrophobicContact CG1-CG 4.36Å; V235-G409 PolarHBondContact N-O 2.91Å
236	I	94.8	Very high	90.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.8	-179.4	-58.8	170.8	0	0	0	108.2	I161 I163 M257 Y262 V263 W264 L265	I161-I236 HydrophobicContact CB-CG1 4.33Å; I161-I236 HydrophobicContact CD1-CG1 4.23Å; I161-I236 WeakPolarHBondContact O-CA 3.27Å; I163-I236 HydrophobicContact CD1-CG2 3.64Å; I163-I236 HydrophobicContact CG1-CG2 4.06Å; I236-M257 HydrophobicContact CD1-CE 3.74Å; I236-Y262 HydrophobicContact CD1-CD1 4Å; I236-Y262 HydrophobicContact CD1-CE1 4.36Å; I236-V263 PolarHBondContact N-O 3.36Å; I236-W264 HydrophobicContact CB-CD2 4.25Å; I236-W264 HydrophobicContact CB-CE3 4.22Å; I236-W264 HydrophobicContact CB-CZ3 4.4Å; I236-W264 HydrophobicContact CD1-CD2 4.47Å; I236-W264 HydrophobicContact CD1-CH2 3.96Å; I236-W264 HydrophobicContact CD1-CZ2 3.52Å; I236-W264 HydrophobicContact CG2-CD2 4.37Å; I236-W264 HydrophobicContact CG2-CE3 3.85Å; I236-W264 HydrophobicContact CG2-CH2 3.99Å; I236-W264 HydrophobicContact CG2-CZ2 4.47Å; I236-W264 HydrophobicContact CG2-CZ3 3.65Å; I236-W264 WeakPolarHBondContact O-CA 3.4Å; I236-L265 PolarHBondContact O-N 2.98Å
237	I	95.1	Very high	90.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124	170.4	-51.6	-168.7	0	0	0	108.1	W148 M152 I160 I161 L162 I163 L177 L265	W148-I237 HydrophobicContact CB-CD1 4.12Å; W148-I237 HydrophobicContact CD2-CG2 3.7Å; W148-I237 HydrophobicContact CE3-CG2 3.63Å; W148-I237 HydrophobicContact CG-CD1 4.48Å; W148-I237 HydrophobicContact CG-CG2 4.26Å; W148-I237 HydrophobicContact CH2-CG2 4.35Å; W148-I237 HydrophobicContact CZ2-CG2 4.35Å; W148-I237 HydrophobicContact CZ3-CG2 3.98Å; M152-I237 HydrophobicContact SD-CD1 4.43Å; I160-I237 HydrophobicContact CD1-CD1 3.52Å; I160-I237 HydrophobicContact CD1-CG1 4.17Å; I161-I237 PolarHBondContact O-N 2.89Å; L162-I237 HydrophobicContact CD1-CB 3.94Å; L162-I237 HydrophobicContact CD1-CG2 3.95Å; I163-I237 PolarHBondContact N-O 3.44Å; L177-I237 HydrophobicContact CD2-CD1 4.12Å; I237-L265 WeakPolarHBondContact CA-O 3.38Å; I237-L265 HydrophobicContact CD1-CD1 4.39Å; I237-L265 HydrophobicContact CG1-CB 4.28Å; I237-L265 HydrophobicContact CG1-CD1 4.29Å
238	L	95.4	Very high	90.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	129.5	176.1	179.6	64.6	0	0	0	110.5	I163 F215 A240 A245 V248 Y249 L265 V266	I163-L238 HydrophobicContact CB-CD1 4.01Å; I163-L238 HydrophobicContact CG2-CD1 3.79Å; I163-L238 WeakPolarHBondContact O-CA 3.39Å; F215-L238 HydrophobicContact CE1-CD1 4.3Å; L238-A240 HydrophobicContact CD1-CB 4.24Å; L238-A240 HydrophobicContact CG-CB 4.38Å; L238-A245 HydrophobicContact CD2-CB 4.38Å; L238-V248 HydrophobicContact CD1-CG1 4.2Å; L238-V248 HydrophobicContact CD1-CG2 4.35Å; L238-V248 HydrophobicContact CD2-CB 4.18Å; L238-V248 HydrophobicContact CD2-CG1 3.94Å; L238-Y249 HydrophobicContact CD2-CE1 3.9Å; L238-L265 PolarHBondContact N-O 3.32Å; L238-V266 HydrophobicContact CB-CG1 4.12Å
239	S	94.5	Very high	91	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.014	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.1	163.1	-160.1	0	0	0	0	111.5	I163 V164 S165 E270	I163-S239 PolarHBondContact O-N 2.88Å; V164-S239 WeakPolarHBondContact CA-O 3.36Å; S165-S239 PolarHBondContact N-O 3.5Å; S239-E270 VanDerWaalsContact CA-OE1 3.25Å; S239-E270 WeakPolarHBondContact CA-OE1 3.39Å; S239-E270 PolarHBondContact OG-OE1 3.08Å
240	A	92.3	Very high	91.2	Very high	2 Å²	2	30 Å²	30	2%	0.017	16%	0.155	C	C	.	.			trans	-158.3	-177.8	-165.5	0	0	0	0	0	113.1	F215 L238 D244 A245 R269 E270	F215-A240 HydrophobicContact CZ-CB 4.04Å; L238-A240 HydrophobicContact CD1-CB 4.24Å; L238-A240 HydrophobicContact CG-CB 4.38Å; A240-D244 HydrophobicContact CB-CB 4.06Å; A240-A245 HydrophobicContact CB-CB 4.39Å; A240-R269 PolarHBondContact O-NH1 2.99Å; A240-R269 VanDerWaalsContact O-NH1 3.17Å; A240-E270 HydrophobicContact CB-CG 4.37Å; A240-E270 PolarHBondContact N-OE1 3.3Å
241	S	89.7	Confident	91.6	Very high	28 Å²	28	23.8 Å²	23.8	20%	0.196	13%	0.128	C	C	.	.			trans	-80.6	169.1	160	85.1	0	0	0	0	111.6	D244 A245	S241-D244 VanDerWaalsContact CB-OD2 3.25Å; S241-D244 WeakPolarHBondContact CB-OD2 3.07Å; S241-D244 PolarHBondContact OG-N 3.07Å; S241-D244 PolarHBondContact OG-OD2 3.09Å; S241-A245 VanDerWaalsContact O-CB 3.29Å; S241-A245 WeakPolarHBondContact O-CB 3.36Å; S241-A245 PolarHBondContact O-N 2.6Å
242	E	89.1	Confident	92	Very high	51 Å²	51	22.9 Å²	22.9	24%	0.238	12%	0.123	C	C	.	.	H	α-helix	trans	-64.4	-41.5	177.9	-170.8	-176.3	109.1	0	0	112.2	A246 S272 G273 K274 A275	E242-A246 PolarHBondContact O-N 3.07Å; E242-S272 VanDerWaalsContact CD-C 3.48Å; E242-S272 VanDerWaalsContact CD-O 3.32Å; E242-S272 WeakPolarHBondContact CG-O 3.2Å; E242-S272 VanDerWaalsContact OE2-CB 3.28Å; E242-S272 WeakPolarHBondContact OE2-CB 3.38Å; E242-S272 PolarHBondContact OE2-OG 3.25Å; E242-G273 WeakPolarHBondContact OE1-CA 3.42Å; E242-G273 PolarHBondContact OE2-N 3.06Å; E242-K274 PolarHBondContact OE1-N 2.72Å; E242-A275 HydrophobicContact CG-CB 3.97Å
243	D	88.4	Confident	92.4	Very high	89 Å²	89	29.2 Å²	29.2	48%	0.476	15%	0.146	S	C	.	.	H	α-helix	trans	-68.9	-41.5	177.7	-89.3	-61.2	0	0	0	111.7	A246 A247 K274	D243-A246 PolarHBondContact O-N 2.88Å; D243-A247 PolarHBondContact O-N 3.04Å; D243-K274 WeakPolarHBondContact OD1-CD 3.24Å; D243-K274 WeakPolarHBondContact OD1-CE 2.76Å; D243-K274 IonicContact OD1-NZ 3.49Å; D243-K274 PolarHBondContact OD1-NZ 2.83Å; D243-K274 IonicContact OD2-NZ 2.75Å; D243-K274 PolarHBondContact OD2-NZ 3.46Å
244	D	90.9	Very high	92.6	Very high	31 Å²	31	37 Å²	37	17%	0.166	18%	0.18	C	C	.	.	H	α-helix	trans	-65.2	-42.1	176.6	-64.3	-50.8	0	0	0	111.7	F215 A240 S241 A246 A247 V248	F215-D244 HydrophobicContact CE2-CB 3.91Å; F215-D244 HydrophobicContact CZ-CB 4.03Å; A240-D244 HydrophobicContact CB-CB 4.06Å; S241-D244 VanDerWaalsContact CB-OD2 3.25Å; S241-D244 WeakPolarHBondContact CB-OD2 3.07Å; S241-D244 PolarHBondContact OG-N 3.07Å; S241-D244 PolarHBondContact OG-OD2 3.09Å; D244-A246 VanDerWaalsContact C-N 3.33Å; D244-A246 PolarHBondContact O-N 2.55Å; D244-A247 WeakPolarHBondContact O-CB 3.29Å; D244-A247 PolarHBondContact O-N 3.41Å; D244-A247 VanDerWaalsContact O-N 3.13Å; D244-V248 WeakPolarHBondContact O-CG2 3.29Å; D244-V248 PolarHBondContact O-N 3.05Å
245	A	92.3	Very high	92.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.9	-41.1	178.3	0	0	0	0	0	112.1	L238 A240 S241 A247 V248 Y249 E270 A275	L238-A245 HydrophobicContact CD2-CB 4.38Å; A240-A245 HydrophobicContact CB-CB 4.39Å; S241-A245 VanDerWaalsContact O-CB 3.29Å; S241-A245 WeakPolarHBondContact O-CB 3.36Å; S241-A245 PolarHBondContact O-N 2.6Å; A245-A247 VanDerWaalsContact C-N 3.32Å; A245-A247 PolarHBondContact O-N 2.87Å; A245-V248 PolarHBondContact O-N 2.84Å; A245-Y249 HydrophobicContact CB-CE2 4.36Å; A245-Y249 WeakPolarHBondContact O-CD2 3.37Å; A245-Y249 VanDerWaalsContact O-CG 3.25Å; A245-Y249 PolarHBondContact O-N 3.07Å; A245-E270 HydrophobicContact CB-CB 4.01Å; A245-E270 HydrophobicContact CB-CG 4.16Å; A245-A275 HydrophobicContact CB-CB 3.94Å
246	A	92.8	Very high	92.6	Very high	16 Å²	16	42.1 Å²	42.1	13%	0.132	21%	0.21	C	C	.	.	H	α-helix	trans	-61.2	-39.7	174.3	0	0	0	0	0	112.2	E242 D243 D244 K250 K274	E242-A246 PolarHBondContact O-N 3.07Å; D243-A246 PolarHBondContact O-N 2.88Å; D244-A246 VanDerWaalsContact C-N 3.33Å; D244-A246 PolarHBondContact O-N 2.55Å; A246-K250 WeakPolarHBondContact O-CB 3.49Å; A246-K250 PolarHBondContact O-N 2.98Å; A246-K274 HydrophobicContact CB-CB 4.48Å
247	A	92.1	Very high	92.5	Very high	44 Å²	44	42.1 Å²	42.1	36%	0.364	21%	0.21	S	C	.	.	H	α-helix	trans	-66.8	-41.9	175.2	0	0	0	0	0	112.5	L221 D243 D244 A245 K250 A251	L221-A247 HydrophobicContact CD1-CB 3.8Å; D243-A247 PolarHBondContact O-N 3.04Å; D244-A247 WeakPolarHBondContact O-CB 3.29Å; D244-A247 PolarHBondContact O-N 3.41Å; D244-A247 VanDerWaalsContact O-N 3.13Å; A245-A247 VanDerWaalsContact C-N 3.32Å; A245-A247 PolarHBondContact O-N 2.87Å; A247-K250 PolarHBondContact O-N 2.69Å; A247-A251 PolarHBondContact O-N 3.29Å; A247-A251 VanDerWaalsContact O-N 3.1Å
248	V	94.2	Very high	92.3	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-45.8	176.1	175.1	0	0	0	0	111.4	F215 L221 L238 D244 A245 K250 A251 A252 W264	F215-V248 HydrophobicContact CZ-CG2 4.21Å; L221-V248 HydrophobicContact CD1-CG2 4.15Å; L221-V248 HydrophobicContact CD2-CG2 4.31Å; L238-V248 HydrophobicContact CD1-CG1 4.2Å; L238-V248 HydrophobicContact CD1-CG2 4.35Å; L238-V248 HydrophobicContact CD2-CB 4.18Å; L238-V248 HydrophobicContact CD2-CG1 3.94Å; D244-V248 WeakPolarHBondContact O-CG2 3.29Å; D244-V248 PolarHBondContact O-N 3.05Å; A245-V248 PolarHBondContact O-N 2.84Å; V248-K250 VanDerWaalsContact C-N 3.33Å; V248-K250 PolarHBondContact O-N 2.78Å; V248-A251 PolarHBondContact O-N 2.98Å; V248-A252 WeakPolarHBondContact O-CB 3.37Å; V248-A252 PolarHBondContact O-N 2.91Å; V248-W264 HydrophobicContact CG1-CH2 4.32Å; V248-W264 HydrophobicContact CG1-CZ3 4.14Å
249	Y	93.9	Very high	91.9	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-42.1	178.3	-62.5	-30.5	0	0	0	112.3	L238 A245 A251 A252 R253 E270 A275 E278 A279 L283	L238-Y249 HydrophobicContact CD2-CE1 3.9Å; A245-Y249 HydrophobicContact CB-CE2 4.36Å; A245-Y249 WeakPolarHBondContact O-CD2 3.37Å; A245-Y249 VanDerWaalsContact O-CG 3.25Å; A245-Y249 PolarHBondContact O-N 3.07Å; Y249-A251 PolarHBondContact O-N 3.17Å; Y249-A252 PolarHBondContact O-N 2.94Å; Y249-R253 WeakPolarHBondContact O-CB 3.43Å; Y249-R253 PolarHBondContact O-N 2.99Å; Y249-E270 WeakPolarHBondContact CE2-O 3.47Å; Y249-E270 PolarHBondContact OH-O 2.83Å; Y249-A275 HydrophobicContact CE2-CB 4.15Å; Y249-E278 WeakPolarHBondContact CB-O 3.38Å; Y249-E278 HydrophobicContact CD2-CB 4.47Å; Y249-A279 HydrophobicContact CD2-CB 4.32Å; Y249-A279 HydrophobicContact CE2-CB 4.08Å; Y249-L283 HydrophobicContact CD1-CD1 4.49Å; Y249-L283 HydrophobicContact CE1-CD1 3.64Å
250	K	92.8	Very high	91.6	Very high	140 Å²	140	48 Å²	48	61%	0.609	25%	0.254	S	S	*	.	H	α-helix	trans	-61.6	-42.1	176.6	-173.1	172.4	-178.2	172.2	0	112.4	A246 A247 V248 F254	A246-K250 WeakPolarHBondContact O-CB 3.49Å; A246-K250 PolarHBondContact O-N 2.98Å; A247-K250 PolarHBondContact O-N 2.69Å; V248-K250 VanDerWaalsContact C-N 3.33Å; V248-K250 PolarHBondContact O-N 2.78Å; K250-F254 PolarHBondContact O-N 3.28Å
251	A	93.4	Very high	91.3	Very high	11 Å²	11	49.3 Å²	49.3	9%	0.091	27%	0.268	C	S	.	.	H	α-helix	trans	-71.1	-40.6	176.3	0	0	0	0	0	112.7	L221 T222 L225 A247 V248 Y249 R253 F254 L255	L221-A251 HydrophobicContact CB-CB 4.31Å; T222-A251 HydrophobicContact CG2-CB 4.25Å; L225-A251 HydrophobicContact CD1-CB 3.6Å; A247-A251 PolarHBondContact O-N 3.29Å; A247-A251 VanDerWaalsContact O-N 3.1Å; V248-A251 PolarHBondContact O-N 2.98Å; Y249-A251 PolarHBondContact O-N 3.17Å; A251-R253 VanDerWaalsContact C-N 3.32Å; A251-R253 PolarHBondContact O-N 3.42Å; A251-F254 WeakPolarHBondContact O-CB 3.4Å; A251-F254 PolarHBondContact O-N 3.14Å; A251-L255 PolarHBondContact O-N 3.34Å; A251-L255 VanDerWaalsContact O-N 3.11Å
252	A	93.9	Very high	91.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-38.9	175.7	0	0	0	0	0	112.2	L225 V248 Y249 L255 N256 M257 T258 W264	L225-A252 HydrophobicContact CD1-CB 4.37Å; V248-A252 WeakPolarHBondContact O-CB 3.37Å; V248-A252 PolarHBondContact O-N 2.91Å; Y249-A252 PolarHBondContact O-N 2.94Å; A252-L255 CarbonylContact O-C 3.58Å; A252-L255 PolarHBondContact O-N 3.03Å; A252-N256 PolarHBondContact O-N 3.19Å; A252-M257 HydrophobicContact CB-CB 4.33Å; A252-M257 PolarHBondContact O-N 2.76Å; A252-T258 HydrophobicContact CB-CG2 4.2Å; A252-W264 HydrophobicContact CB-CH2 3.7Å; A252-W264 HydrophobicContact CB-CZ2 3.57Å
253	R	92.3	Very high	91.7	Very high	162 Å²	162	46.9 Å²	46.9	61%	0.611	25%	0.252	S	S	*	.	H	α-helix	trans	-64.9	-42.1	174.3	-170.8	175.6	-172.8	157.5	4.5	112	Y249 A251 L255 N256	Y249-R253 WeakPolarHBondContact O-CB 3.43Å; Y249-R253 PolarHBondContact O-N 2.99Å; A251-R253 VanDerWaalsContact C-N 3.32Å; A251-R253 PolarHBondContact O-N 3.42Å; R253-L255 VanDerWaalsContact C-N 3.26Å; R253-L255 PolarHBondContact O-N 2.93Å; R253-N256 PolarHBondContact O-N 2.66Å
254	F	92.9	Very high	92	Very high	163 Å²	163	42.6 Å²	42.6	72%	0.715	23%	0.229	S	C	*	.	H	α-helix	trans	-61.1	-34.1	174.6	179.1	-102	0	0	0	112.7	K250 A251	K250-F254 PolarHBondContact O-N 3.28Å; A251-F254 WeakPolarHBondContact O-CB 3.4Å; A251-F254 PolarHBondContact O-N 3.14Å
255	L	92.1	Very high	92.2	Very high	16 Å²	16	41.2 Å²	41.2	8%	0.084	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	5.2	179.1	-66.7	170.4	0	0	0	114.3	L225 L226 K229 A251 A252 R253 M257	L225-L255 HydrophobicContact CB-CD1 3.35Å; L225-L255 HydrophobicContact CD1-CD1 4.48Å; L226-L255 HydrophobicContact CD2-CD2 3.71Å; L226-L255 HydrophobicContact CG-CD1 4.3Å; L226-L255 HydrophobicContact CG-CD2 3.88Å; K229-L255 PolarHBondContact NZ-O 3.31Å; A251-L255 PolarHBondContact O-N 3.34Å; A251-L255 VanDerWaalsContact O-N 3.11Å; A252-L255 CarbonylContact O-C 3.58Å; A252-L255 PolarHBondContact O-N 3.03Å; R253-L255 VanDerWaalsContact C-N 3.26Å; R253-L255 PolarHBondContact O-N 2.93Å; L255-M257 HydrophobicContact CB-CG 4.05Å; L255-M257 HydrophobicContact CB-SD 4.07Å; L255-M257 HydrophobicContact CD1-SD 4.27Å; L255-M257 PolarHBondContact O-N 2.92Å
256	N	92.4	Very high	92.3	Very high	124 Å²	124	41.2 Å²	41.2	66%	0.663	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	26.4	-174.4	-66.6	-29.1	0	0	0	114.8	A252 R253 T258 G259	A252-N256 PolarHBondContact O-N 3.19Å; R253-N256 PolarHBondContact O-N 2.66Å; N256-T258 PolarHBondContact O-N 3.23Å; N256-G259 PolarHBondContact O-N 2.91Å
257	M	91.8	Very high	92.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	4.3	175.8	-62.1	172.8	72.8	0	0	113	L225 A228 K229 I236 A252 L255 Y262 W264	L225-M257 HydrophobicContact CB-SD 3.85Å; L225-M257 HydrophobicContact CD2-CE 4Å; L225-M257 HydrophobicContact CD2-SD 4.07Å; L225-M257 HydrophobicContact CG-SD 4.48Å; L225-M257 VanDerWaalsContact O-SD 3.38Å; A228-M257 HydrophobicContact CB-CE 4Å; K229-M257 HydrophobicContact CB-CE 4.45Å; K229-M257 HydrophobicContact CB-SD 4.33Å; K229-M257 HydrophobicContact CD-CG 4.37Å; I236-M257 HydrophobicContact CD1-CE 3.74Å; A252-M257 HydrophobicContact CB-CB 4.33Å; A252-M257 PolarHBondContact O-N 2.76Å; L255-M257 HydrophobicContact CB-CG 4.05Å; L255-M257 HydrophobicContact CB-SD 4.07Å; L255-M257 HydrophobicContact CD1-SD 4.27Å; L255-M257 PolarHBondContact O-N 2.92Å; M257-Y262 HydrophobicContact CB-CD1 4.41Å; M257-Y262 HydrophobicContact CB-CE1 4.26Å; M257-Y262 HydrophobicContact CE-CE1 4.33Å; M257-Y262 HydrophobicContact CG-CE1 4.3Å; M257-Y262 WeakPolarHBondContact O-CB 3.28Å; M257-W264 HydrophobicContact CB-CZ2 4.14Å; M257-W264 PolarHBondContact O-NE1 2.82Å
258	T	91.1	Very high	92.2	Very high	30 Å²	30	39.5 Å²	39.5	18%	0.184	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	12.5	173.5	65	0	0	0	0	112.2	A252 N256 P280	A252-T258 HydrophobicContact CB-CG2 4.2Å; N256-T258 PolarHBondContact O-N 3.23Å; T258-P280 HydrophobicContact CG2-CB 3.66Å; T258-P280 HydrophobicContact CG2-CG 3.91Å
259	G	87.6	Confident	92	Very high	26 Å²	26	41.2 Å²	41.2	27%	0.268	21%	0.21	S	C	.	.	S	Bend	trans	-82.2	-174	173.7	0	0	0	0	0	113.1	N256 P400	N256-G259 PolarHBondContact O-N 2.91Å; G259-P400 VanDerWaalsContact O-CB 3.3Å; G259-P400 WeakPolarHBondContact O-CB 3.14Å
260	S	88.3	Confident	91.9	Very high	71 Å²	71	41.3 Å²	41.3	50%	0.497	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	156.4	176.9	37.2	0	0	0	0	113.5	Y262 P400 E403	S260-Y262 PolarHBondContact O-N 3.3Å; S260-P400 WeakPolarHBondContact CA-O 3.46Å; S260-E403 WeakPolarHBondContact CB-OE1 3.47Å; S260-E403 WeakPolarHBondContact CB-OE2 3.5Å
261	G	86.4	Confident	91.6	Very high	29 Å²	29	35.4 Å²	35.4	30%	0.299	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	-21.5	-177.4	0	0	0	0	0	116.3	R234 E403	R234-G261 WeakPolarHBondContact CB-O 3.43Å; G261-E403 PolarHBondContact N-OE2 3.3Å
262	Y	92.2	Very high	91.2	Very high	26 Å²	26	36.6 Å²	36.6	10%	0.102	19%	0.193	C	C	.	.			trans	-80.9	149.9	172.1	-74.8	-92.6	0	0	0	111.9	R234 I236 M257 S260 P400	R234-Y262 HydrophobicContact CB-CD1 4.46Å; R234-Y262 WeakPolarHBondContact O-CA 3.19Å; I236-Y262 HydrophobicContact CD1-CD1 4Å; I236-Y262 HydrophobicContact CD1-CE1 4.36Å; M257-Y262 HydrophobicContact CB-CD1 4.41Å; M257-Y262 HydrophobicContact CB-CE1 4.26Å; M257-Y262 HydrophobicContact CE-CE1 4.33Å; M257-Y262 HydrophobicContact CG-CE1 4.3Å; M257-Y262 WeakPolarHBondContact O-CB 3.28Å; S260-Y262 PolarHBondContact O-N 3.3Å; Y262-P400 WeakPolarHBondContact O-CD 3.41Å; Y262-P400 VanDerWaalsContact O-CG 3.3Å; Y262-P400 WeakPolarHBondContact O-CG 3.18Å
263	V	93.9	Very high	90.8	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	133.7	172.8	179.2	0	0	0	0	109.2	W157 R234 V235 I236 L265 W399 P407	W157-V263 HydrophobicContact CH2-CG1 3.69Å; W157-V263 HydrophobicContact CH2-CG2 4.35Å; W157-V263 HydrophobicContact CZ2-CG1 4.16Å; W157-V263 HydrophobicContact CZ2-CG2 3.96Å; W157-V263 HydrophobicContact CZ3-CG1 4.12Å; R234-V263 PolarHBondContact O-N 3.03Å; V235-V263 HydrophobicContact CG2-CB 4.14Å; V235-V263 HydrophobicContact CG2-CG2 4.38Å; I236-V263 PolarHBondContact N-O 3.36Å; V263-L265 HydrophobicContact CG1-CD2 3.94Å; V263-L265 HydrophobicContact CG1-CG 4.36Å; V263-W399 HydrophobicContact CG1-CE3 4.35Å; V263-W399 HydrophobicContact CG1-CZ3 3.95Å; V263-W399 HydrophobicContact CG2-CE3 4.04Å; V263-W399 HydrophobicContact CG2-CZ3 4.1Å; V263-P407 HydrophobicContact CG2-CB 4.49Å; V263-P407 HydrophobicContact CG2-CG 3.38Å
264	W	94.1	Very high	90.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.1	174.8	-70.4	79.1	0	0	0	109.9	L225 I236 V248 A252 M257 L283 I284	L225-W264 HydrophobicContact CD2-CH2 4.37Å; I236-W264 HydrophobicContact CB-CD2 4.25Å; I236-W264 HydrophobicContact CB-CE3 4.22Å; I236-W264 HydrophobicContact CB-CZ3 4.4Å; I236-W264 HydrophobicContact CD1-CD2 4.47Å; I236-W264 HydrophobicContact CD1-CH2 3.96Å; I236-W264 HydrophobicContact CD1-CZ2 3.52Å; I236-W264 HydrophobicContact CG2-CD2 4.37Å; I236-W264 HydrophobicContact CG2-CE3 3.85Å; I236-W264 HydrophobicContact CG2-CH2 3.99Å; I236-W264 HydrophobicContact CG2-CZ2 4.47Å; I236-W264 HydrophobicContact CG2-CZ3 3.65Å; I236-W264 WeakPolarHBondContact O-CA 3.4Å; V248-W264 HydrophobicContact CG1-CH2 4.32Å; V248-W264 HydrophobicContact CG1-CZ3 4.14Å; A252-W264 HydrophobicContact CB-CH2 3.7Å; A252-W264 HydrophobicContact CB-CZ2 3.57Å; M257-W264 HydrophobicContact CB-CZ2 4.14Å; M257-W264 PolarHBondContact O-NE1 2.82Å; W264-L283 HydrophobicContact CB-CB 4.39Å; W264-L283 HydrophobicContact CB-CD1 4Å; W264-L283 HydrophobicContact CB-CG 3.78Å; W264-I284 PolarHBondContact O-N 3.49Å
265	L	95.1	Very high	90.3	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128	170.7	-53.2	-175.1	0	0	0	108.6	W157 V235 I236 I237 L238 V263 I284	W157-L265 HydrophobicContact CZ3-CD1 4.13Å; W157-L265 HydrophobicContact CZ3-CD2 4.12Å; V235-L265 HydrophobicContact CG1-CD1 4.18Å; V235-L265 HydrophobicContact CG1-CG 4.36Å; I236-L265 PolarHBondContact O-N 2.98Å; I237-L265 WeakPolarHBondContact CA-O 3.38Å; I237-L265 HydrophobicContact CD1-CD1 4.39Å; I237-L265 HydrophobicContact CG1-CB 4.28Å; I237-L265 HydrophobicContact CG1-CD1 4.29Å; L238-L265 PolarHBondContact N-O 3.32Å; V263-L265 HydrophobicContact CG1-CD2 3.94Å; V263-L265 HydrophobicContact CG1-CG 4.36Å; L265-I284 WeakPolarHBondContact CA-O 3.41Å; L265-I284 HydrophobicContact CD2-CB 3.86Å; L265-I284 HydrophobicContact CD2-CD1 4.25Å; L265-I284 HydrophobicContact CD2-CG2 4.23Å
266	V	95.6	Very high	90.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	171.9	-179.2	-43.7	0	0	0	0	112.3	W148 L238 E270 M271 L283 I284 A285	W148-V266 PolarHBondContact NE1-O 3.25Å; W148-V266 VanDerWaalsContact NE1-O 3.08Å; L238-V266 HydrophobicContact CB-CG1 4.12Å; V266-E270 HydrophobicContact CB-CB 3.79Å; V266-E270 HydrophobicContact CB-CG 4.37Å; V266-E270 HydrophobicContact CG2-CB 3.85Å; V266-M271 HydrophobicContact CG2-CE 4.47Å; V266-L283 HydrophobicContact CB-CD2 4.29Å; V266-L283 HydrophobicContact CG1-CD1 3.94Å; V266-L283 HydrophobicContact CG1-CD2 3.82Å; V266-L283 HydrophobicContact CG1-CG 4.14Å; V266-L283 HydrophobicContact CG2-CD2 3.52Å; V266-I284 PolarHBondContact N-O 3.47Å; V266-A285 HydrophobicContact CG2-CB 3.72Å
267	G	92.8	Very high	90	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	19%	0.187	C	C	.	.			trans	-80.6	-141.9	175.4	0	0	0	0	0	113.6	E270 L286	G267-E270 WeakPolarHBondContact CA-OE2 3.28Å; G267-E270 PolarHBondContact N-OE2 3.05Å; G267-L286 PolarHBondContact O-N 3.32Å; G267-L286 VanDerWaalsContact O-N 3.16Å
268	E	90.4	Very high	90	Very high	25 Å²	25	32.8 Å²	32.8	12%	0.117	20%	0.204	C	C	.	.	S	Bend	trans	-109.3	-22.9	-180	-168.3	173.6	140.9	0	0	113.7	R121 Y141 E270 L286 Q287 L288	R121-E268 IonicContact CZ-OE2 3.21Å; R121-E268 IonicContact NH1-OE1 2.66Å; R121-E268 PolarHBondContact NH1-OE1 3.1Å; R121-E268 IonicContact NH1-OE2 2.9Å; R121-E268 PolarHBondContact NH1-OE2 3.06Å; R121-E268 IonicContact NH2-OE2 2.71Å; Y141-E268 HydrophobicContact CE1-CB 4.47Å; E268-E270 PolarHBondContact N-OE2 2.86Å; E268-L286 WeakPolarHBondContact CA-O 3.43Å; E268-L286 VanDerWaalsContact CB-O 3.24Å; E268-L286 WeakPolarHBondContact CB-O 3.31Å; E268-Q287 WeakPolarHBondContact OE2-CA 3.16Å; E268-L288 WeakPolarHBondContact OE2-CB 3.45Å; E268-L288 PolarHBondContact OE2-N 3.3Å
269	R	88.8	Confident	90	Very high	39 Å²	39	31.8 Å²	31.8	15%	0.147	20%	0.198	C	C	.	.	S	Bend	trans	-82.7	-32.5	179.1	-63.1	174.9	75.5	-152	11.5	111.1	D97 Y141 A240 M271 S272	D97-R269 IonicContact OD2-CZ 2.98Å; D97-R269 IonicContact OD2-NH2 3.94Å; D97-R269 PolarHBondContact OD2-NH2 3.32Å; Y141-R269 HydrophobicContact CD1-CG 4.45Å; Y141-R269 HydrophobicContact CE1-CG 4Å; Y141-R269 HydrophobicContact CE2-CG 4.29Å; A240-R269 PolarHBondContact O-NH1 2.99Å; A240-R269 VanDerWaalsContact O-NH1 3.17Å; R269-M271 PolarHBondContact O-N 2.98Å; R269-M271 VanDerWaalsContact O-N 3.1Å; R269-S272 PolarHBondContact O-N 2.98Å; R269-S272 PolarHBondContact O-OG 2.59Å; R269-S272 VanDerWaalsContact O-OG 3.06Å
270	E	91.2	Very high	90.2	Very high	3 Å²	3	31.3 Å²	31.3	1%	0.014	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-1	178.8	-54	82.8	172.4	0	0	112.2	S239 A240 A245 Y249 V266 G267 E268 A275	S239-E270 VanDerWaalsContact CA-OE1 3.25Å; S239-E270 WeakPolarHBondContact CA-OE1 3.39Å; S239-E270 PolarHBondContact OG-OE1 3.08Å; A240-E270 HydrophobicContact CB-CG 4.37Å; A240-E270 PolarHBondContact N-OE1 3.3Å; A245-E270 HydrophobicContact CB-CB 4.01Å; A245-E270 HydrophobicContact CB-CG 4.16Å; Y249-E270 WeakPolarHBondContact CE2-O 3.47Å; Y249-E270 PolarHBondContact OH-O 2.83Å; V266-E270 HydrophobicContact CB-CB 3.79Å; V266-E270 HydrophobicContact CB-CG 4.37Å; V266-E270 HydrophobicContact CG2-CB 3.85Å; G267-E270 WeakPolarHBondContact CA-OE2 3.28Å; G267-E270 PolarHBondContact N-OE2 3.05Å; E268-E270 PolarHBondContact N-OE2 2.86Å; E270-A275 WeakPolarHBondContact O-CB 3.23Å
271	M	87.3	Confident	90.3	Very high	16 Å²	16	31.9 Å²	31.9	8%	0.079	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132	18.9	178.4	-164.6	53.7	68.5	0	0	112.2	V266 R269 L276 A279 L283 A285 Y373 L378	V266-M271 HydrophobicContact CG2-CE 4.47Å; R269-M271 PolarHBondContact O-N 2.98Å; R269-M271 VanDerWaalsContact O-N 3.1Å; M271-L276 HydrophobicContact CG-CD1 4.3Å; M271-L276 HydrophobicContact SD-CD1 3.46Å; M271-L276 WeakPolarHBondContact SD-CD1 3.48Å; M271-A279 HydrophobicContact CE-CB 4.05Å; M271-A279 HydrophobicContact SD-CB 4.15Å; M271-L283 HydrophobicContact CE-CD1 4.2Å; M271-L283 HydrophobicContact CE-CD2 3.33Å; M271-L283 HydrophobicContact CE-CG 4.23Å; M271-A285 HydrophobicContact CB-CB 3.91Å; M271-A285 HydrophobicContact CE-CB 3.98Å; M271-A285 HydrophobicContact CG-CB 3.83Å; M271-Y373 HydrophobicContact SD-CD2 4.36Å; M271-L378 HydrophobicContact CG-CD1 4.15Å; M271-L378 HydrophobicContact CG-CD2 3.8Å; M271-L378 HydrophobicContact SD-CD2 3.9Å
272	S	85.3	Confident	90.4	Very high	37 Å²	37	30.5 Å²	30.5	26%	0.259	17%	0.174	S	C	.	.	S	Bend	trans	-108.1	167	171.7	61.3	0	0	0	0	112.8	E242 R269 K274 A275 L276	E242-S272 VanDerWaalsContact CD-C 3.48Å; E242-S272 VanDerWaalsContact CD-O 3.32Å; E242-S272 WeakPolarHBondContact CG-O 3.2Å; E242-S272 VanDerWaalsContact OE2-CB 3.28Å; E242-S272 WeakPolarHBondContact OE2-CB 3.38Å; E242-S272 PolarHBondContact OE2-OG 3.25Å; R269-S272 PolarHBondContact O-N 2.98Å; R269-S272 PolarHBondContact O-OG 2.59Å; R269-S272 VanDerWaalsContact O-OG 3.06Å; S272-K274 PolarHBondContact O-N 2.88Å; S272-A275 WeakPolarHBondContact O-CB 3.17Å; S272-A275 PolarHBondContact O-N 3.1Å; S272-L276 PolarHBondContact O-N 2.64Å; S272-L276 VanDerWaalsContact O-N 3.17Å
273	G	85.6	Confident	90.4	Very high	52 Å²	52	29.3 Å²	29.3	54%	0.536	17%	0.169	S	C	.	.	H	α-helix	trans	37.9	-114.8	171.9	0	0	0	0	0	115.4	E242	E242-G273 WeakPolarHBondContact OE1-CA 3.42Å; E242-G273 PolarHBondContact OE2-N 3.06Å
274	K	85.7	Confident	90.5	Very high	108 Å²	108	29.4 Å²	29.4	47%	0.47	17%	0.17	S	C	.	.	H	α-helix	trans	-68.9	-33.5	-176.7	-58.7	172.7	-168	159.8	0	113.3	E242 D243 A246 S272 L276 S277	E242-K274 PolarHBondContact OE1-N 2.72Å; D243-K274 WeakPolarHBondContact OD1-CD 3.24Å; D243-K274 WeakPolarHBondContact OD1-CE 2.76Å; D243-K274 IonicContact OD1-NZ 3.49Å; D243-K274 PolarHBondContact OD1-NZ 2.83Å; D243-K274 IonicContact OD2-NZ 2.75Å; D243-K274 PolarHBondContact OD2-NZ 3.46Å; A246-K274 HydrophobicContact CB-CB 4.48Å; S272-K274 PolarHBondContact O-N 2.88Å; K274-L276 VanDerWaalsContact C-N 3.3Å; K274-L276 PolarHBondContact O-N 3.29Å; K274-S277 PolarHBondContact O-N 3.01Å; K274-S277 PolarHBondContact O-OG 3.22Å
275	A	88.8	Confident	90.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.8	-38.8	179.2	0	0	0	0	0	111.2	E242 A245 Y249 E270 S272 S277 E278 A279	E242-A275 HydrophobicContact CG-CB 3.97Å; A245-A275 HydrophobicContact CB-CB 3.94Å; Y249-A275 HydrophobicContact CE2-CB 4.15Å; E270-A275 WeakPolarHBondContact O-CB 3.23Å; S272-A275 WeakPolarHBondContact O-CB 3.17Å; S272-A275 PolarHBondContact O-N 3.1Å; A275-S277 VanDerWaalsContact C-N 3.29Å; A275-S277 PolarHBondContact O-N 3.17Å; A275-E278 PolarHBondContact O-N 3.23Å; A275-A279 PolarHBondContact O-N 3.48Å
276	L	89.8	Confident	90.4	Very high	59 Å²	59	29.5 Å²	29.5	31%	0.309	17%	0.17	S	C	.	.	H	α-helix	trans	-61.1	-33.2	177.7	-178.8	62.9	0	0	0	113.2	M271 S272 K274 Y373 L378	M271-L276 HydrophobicContact CG-CD1 4.3Å; M271-L276 HydrophobicContact SD-CD1 3.46Å; M271-L276 WeakPolarHBondContact SD-CD1 3.48Å; S272-L276 PolarHBondContact O-N 2.64Å; S272-L276 VanDerWaalsContact O-N 3.17Å; K274-L276 VanDerWaalsContact C-N 3.3Å; K274-L276 PolarHBondContact O-N 3.29Å; L276-Y373 HydrophobicContact CD1-CD2 4.09Å; L276-Y373 HydrophobicContact CD1-CE2 3.71Å; L276-Y373 PolarHBondContact O-OH 2.61Å; L276-L378 HydrophobicContact CD1-CD1 4.34Å
277	S	88.7	Confident	90.3	Very high	91 Å²	91	33.4 Å²	33.4	64%	0.636	19%	0.188	S	C	*	.	H	α-helix	trans	-72.8	-26.2	178.1	29.5	0	0	0	0	114.5	K274 A275	K274-S277 PolarHBondContact O-N 3.01Å; K274-S277 PolarHBondContact O-OG 3.22Å; A275-S277 VanDerWaalsContact C-N 3.29Å; A275-S277 PolarHBondContact O-N 3.17Å
278	E	90.6	Very high	90.3	Very high	75 Å²	75	33.9 Å²	33.9	35%	0.35	19%	0.191	S	C	.	.	H	α-helix	trans	-102.6	-3	179.1	-66	-70.4	173.9	0	0	112.7	Y249 A275	Y249-E278 WeakPolarHBondContact CB-O 3.38Å; Y249-E278 HydrophobicContact CD2-CB 4.47Å; A275-E278 PolarHBondContact O-N 3.23Å
279	A	91.2	Very high	90.3	Very high	9 Å²	9	35.8 Å²	35.8	7%	0.074	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-61.7	134.9	-175.7	0	0	0	0	0	112.9	Y249 M271 A275 Y373	Y249-A279 HydrophobicContact CD2-CB 4.32Å; Y249-A279 HydrophobicContact CE2-CB 4.08Å; M271-A279 HydrophobicContact CE-CB 4.05Å; M271-A279 HydrophobicContact SD-CB 4.15Å; A275-A279 PolarHBondContact O-N 3.48Å; A279-Y373 HydrophobicContact CB-CD1 4.27Å; A279-Y373 HydrophobicContact CB-CE1 4.09Å; A279-Y373 WeakPolarHBondContact O-CE1 3.4Å
280	P	91.7	Very high	90.3	Very high	16 Å²	16	36.8 Å²	36.8	10%	0.104	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-78.5	145.4	176.7	30.8	-34.7	0	0	0	113.1	T258 L283 Y373	T258-P280 HydrophobicContact CG2-CB 3.66Å; T258-P280 HydrophobicContact CG2-CG 3.91Å; P280-L283 HydrophobicContact CG-CB 4.39Å; P280-L283 HydrophobicContact CG-CD1 3.9Å; P280-L283 VanDerWaalsContact O-CB 3.31Å; P280-L283 WeakPolarHBondContact O-CB 3.24Å; P280-L283 PolarHBondContact O-N 3.45Å; P280-Y373 WeakPolarHBondContact O-CD1 3.13Å
281	D	90.4	Very high	89.9	Confident	83 Å²	83	37 Å²	37	44%	0.444	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	142.5	172.7	-84.5	-59.3	0	0	0	112.3	L283 K375	D281-L283 VanDerWaalsContact C-N 3.32Å; D281-K375 PolarHBondContact OD1-N 2.82Å
282	G	90.2	Very high	89.7	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	1.7	179	0	0	0	0	0	115.4	Y373 I398	G282-Y373 PolarHBondContact N-O 2.82Å; G282-I398 WeakPolarHBondContact CA-O 3.46Å
283	L	92.4	Very high	89.9	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	25%	0.246	C	C	.	.			trans	-67.4	140.2	175.1	-172.7	161.1	0	0	0	111.6	Y249 W264 V266 M271 P280 D281 A285 N372 Y373	Y249-L283 HydrophobicContact CD1-CD1 4.49Å; Y249-L283 HydrophobicContact CE1-CD1 3.64Å; W264-L283 HydrophobicContact CB-CB 4.39Å; W264-L283 HydrophobicContact CB-CD1 4Å; W264-L283 HydrophobicContact CB-CG 3.78Å; V266-L283 HydrophobicContact CB-CD2 4.29Å; V266-L283 HydrophobicContact CG1-CD1 3.94Å; V266-L283 HydrophobicContact CG1-CD2 3.82Å; V266-L283 HydrophobicContact CG1-CG 4.14Å; V266-L283 HydrophobicContact CG2-CD2 3.52Å; M271-L283 HydrophobicContact CE-CD1 4.2Å; M271-L283 HydrophobicContact CE-CD2 3.33Å; M271-L283 HydrophobicContact CE-CG 4.23Å; P280-L283 HydrophobicContact CG-CB 4.39Å; P280-L283 HydrophobicContact CG-CD1 3.9Å; P280-L283 VanDerWaalsContact O-CB 3.31Å; P280-L283 WeakPolarHBondContact O-CB 3.24Å; P280-L283 PolarHBondContact O-N 3.45Å; D281-L283 VanDerWaalsContact C-N 3.32Å; L283-A285 HydrophobicContact CD2-CB 4.14Å; L283-N372 WeakPolarHBondContact O-CA 3.27Å; L283-Y373 PolarHBondContact O-N 3.05Å
284	I	94.1	Very high	90.1	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	117.6	178.2	-60.4	177.6	0	0	0	110.2	F155 W264 L265 V266 I370 L371 I397 W399	F155-I284 HydrophobicContact CE2-CD1 4.37Å; W264-I284 PolarHBondContact O-N 3.49Å; L265-I284 WeakPolarHBondContact CA-O 3.41Å; L265-I284 HydrophobicContact CD2-CB 3.86Å; L265-I284 HydrophobicContact CD2-CD1 4.25Å; L265-I284 HydrophobicContact CD2-CG2 4.23Å; V266-I284 PolarHBondContact N-O 3.47Å; I284-I370 HydrophobicContact CG2-CG2 3.71Å; I284-L371 CarbonylContact C-O 3.56Å; I284-L371 WeakPolarHBondContact CA-O 3.43Å; I284-I397 HydrophobicContact CD1-CG2 4.31Å; I284-W399 HydrophobicContact CD1-CE3 4.39Å; I284-W399 HydrophobicContact CD1-CH2 3.91Å; I284-W399 HydrophobicContact CD1-CZ3 3.56Å
285	A	94.1	Very high	90.5	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.008	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	161.2	-178.9	0	0	0	0	0	112.1	V266 M271 L283 L371	V266-A285 HydrophobicContact CG2-CB 3.72Å; M271-A285 HydrophobicContact CB-CB 3.91Å; M271-A285 HydrophobicContact CE-CB 3.98Å; M271-A285 HydrophobicContact CG-CB 3.83Å; L283-A285 HydrophobicContact CD2-CB 4.14Å; A285-L371 PolarHBondContact N-O 3.27Å; A285-L371 PolarHBondContact O-N 3.26Å
286	L	94.4	Very high	90.6	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	139.9	-179.2	-63	179.7	0	0	0	111.3	Q144 V147 W148 L151 G267 E268 I370	Q144-L286 HydrophobicContact CB-CD1 3.87Å; Q144-L286 HydrophobicContact CG-CD1 4.28Å; V147-L286 HydrophobicContact CB-CD1 3.79Å; V147-L286 HydrophobicContact CB-CD2 4.3Å; V147-L286 HydrophobicContact CG1-CD1 4.08Å; V147-L286 HydrophobicContact CG1-CD2 3.63Å; W148-L286 HydrophobicContact CG-CD1 4.41Å; L151-L286 HydrophobicContact CD1-CD2 4.12Å; G267-L286 PolarHBondContact O-N 3.32Å; G267-L286 VanDerWaalsContact O-N 3.16Å; E268-L286 WeakPolarHBondContact CA-O 3.43Å; E268-L286 VanDerWaalsContact CB-O 3.24Å; E268-L286 WeakPolarHBondContact CB-O 3.31Å; L286-I370 HydrophobicContact CD2-CG1 4.06Å
287	Q	93.3	Very high	90.8	Very high	81 Å²	81	38 Å²	38	38%	0.379	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	132.6	174.4	176.3	174.5	67.2	0	0	111.2	E268 Y368 T369 L371	E268-Q287 WeakPolarHBondContact OE2-CA 3.16Å; Q287-Y368 CarbonylContact O-C 3.57Å; Q287-Y368 WeakPolarHBondContact O-CA 3.46Å; Q287-Y368 WeakPolarHBondContact O-CB 3.47Å; Q287-T369 PolarHBondContact N-O 3.08Å; Q287-T369 PolarHBondContact O-N 3.41Å; Q287-T369 PolarHBondContact O-OG1 3.45Å; Q287-L371 HydrophobicContact CB-CD1 3.89Å; Q287-L371 HydrophobicContact CB-CG 4.41Å
288	L	92.6	Very high	91.1	Very high	11 Å²	11	33.7 Å²	33.7	6%	0.058	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	124	178	179.1	67	0	0	0	111.3	V138 P139 E268 N290 G291 A366 Y368	V138-L288 HydrophobicContact CB-CD2 4.11Å; V138-L288 HydrophobicContact CG1-CD2 3.95Å; P139-L288 HydrophobicContact CG-CD1 3.77Å; P139-L288 HydrophobicContact CG-CD2 4.15Å; E268-L288 WeakPolarHBondContact OE2-CB 3.45Å; E268-L288 PolarHBondContact OE2-N 3.3Å; L288-N290 PolarHBondContact O-N 3.3Å; L288-G291 PolarHBondContact O-N 3.43Å; L288-G291 VanDerWaalsContact O-N 3.15Å; L288-A366 HydrophobicContact CD1-CB 4.07Å; L288-Y368 HydrophobicContact CB-CD1 4.11Å; L288-Y368 HydrophobicContact CB-CE1 4.08Å; L288-Y368 HydrophobicContact CD1-CD1 4.22Å; L288-Y368 HydrophobicContact CD1-CE1 3.96Å; L288-Y368 HydrophobicContact CD1-CE2 4.35Å
289	I	91.1	Very high	91.2	Very high	65 Å²	65	31.8 Å²	31.8	33%	0.333	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	133.8	175.8	-60.3	-175.6	0	0	0	109.4	G291 H367 T369 I383	I289-G291 PolarHBondContact O-N 2.81Å; I289-H367 HydrophobicContact CB-CB 4.4Å; I289-H367 WeakPolarHBondContact CB-O 3.41Å; I289-H367 HydrophobicContact CD1-CB 3.9Å; I289-H367 HydrophobicContact CG1-CB 4.37Å; I289-H367 PolarHBondContact N-O 3.13Å; I289-T369 HydrophobicContact CD1-CG2 4.05Å; I289-T369 HydrophobicContact CG1-CG2 4.04Å; I289-I383 HydrophobicContact CD1-CG2 4.24Å
290	N	88.2	Confident	91.3	Very high	60 Å²	60	31.5 Å²	31.5	32%	0.321	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	13.3	-174.2	-69.9	-33.6	0	0	0	115.5	L288 K292 N293 H297 L351 T352	L288-N290 PolarHBondContact O-N 3.3Å; N290-K292 PolarHBondContact O-N 2.96Å; N290-K292 VanDerWaalsContact O-N 3.1Å; N290-N293 HydrophobicContact CB-CB 4.27Å; N290-N293 PolarHBondContact O-N 2.04Å; N290-H297 PolarHBondContact O-CD2 2.84Å; N290-H297 PolarHBondContact O-NE2 2.78Å; N290-L351 PolarHBondContact ND2-O 2.62Å; N290-T352 HydrophobicContact CB-CG2 4.23Å
291	G	82.8	Confident	91.4	Very high	7 Å²	7	30.8 Å²	30.8	7%	0.072	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.4	-175.3	0	0	0	0	0	115.6	L288 I289	L288-G291 PolarHBondContact O-N 3.43Å; L288-G291 VanDerWaalsContact O-N 3.15Å; I289-G291 PolarHBondContact O-N 2.81Å
292	K	82.9	Confident	91.7	Very high	164 Å²	164	26.9 Å²	26.9	71%	0.713	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.7	1.8	177.7	-60.7	-176.8	-179.9	-177.2	0	113.7	N290 E294	N290-K292 PolarHBondContact O-N 2.96Å; N290-K292 VanDerWaalsContact O-N 3.1Å; K292-E294 PolarHBondContact O-N 2.93Å
293	N	90.2	Very high	91.8	Very high	63 Å²	63	27.4 Å²	27.4	34%	0.337	14%	0.143	S	C	.	.			trans	-94.2	80.3	-172.5	-172	2.8	0	0	0	111.7	N290 S295 A296 H297	N290-N293 HydrophobicContact CB-CB 4.27Å; N290-N293 PolarHBondContact O-N 2.04Å; N293-S295 VanDerWaalsContact C-N 3.27Å; N293-S295 PolarHBondContact O-N 3.09Å; N293-S295 PolarHBondContact OD1-OG 2.95Å; N293-S295 VanDerWaalsContact OD1-OG 3.04Å; N293-A296 HydrophobicContact CB-CB 4.45Å; N293-A296 PolarHBondContact O-N 3.12Å; N293-H297 PolarHBondContact O-CD2 3.33Å; N293-H297 PolarHBondContact O-N 2.92Å
294	E	89.7	Confident	91.9	Very high	17 Å²	17	27.5 Å²	27.5	8%	0.079	14%	0.144	C	C	.	.	H	α-helix	trans	-59.1	-33.7	-172.1	-45.4	-146.8	112.2	0	0	113.5	S31 Y35 S90 T119 K292 H297 I298	S31-E294 VanDerWaalsContact CB-OE2 3.27Å; S31-E294 WeakPolarHBondContact CB-OE2 3.44Å; S31-E294 PolarHBondContact OG-OE2 3.07Å; Y35-E294 HydrophobicContact CD1-CB 4.3Å; Y35-E294 HydrophobicContact CE1-CB 3.85Å; Y35-E294 HydrophobicContact CE2-CB 4.37Å; Y35-E294 HydrophobicContact CE2-CG 4.42Å; Y35-E294 WeakPolarHBondContact CE2-OE2 3.41Å; S90-E294 VanDerWaalsContact CB-OE1 3.29Å; S90-E294 WeakPolarHBondContact CB-OE1 3.08Å; S90-E294 PolarHBondContact OG-OE1 3.15Å; T119-E294 WeakPolarHBondContact CB-OE1 3.42Å; T119-E294 HydrophobicContact CG2-CG 3.83Å; T119-E294 VanDerWaalsContact CG2-OE1 3.29Å; T119-E294 WeakPolarHBondContact CG2-OE1 3.33Å; T119-E294 PolarHBondContact OG1-OE1 3.47Å; K292-E294 PolarHBondContact O-N 2.93Å; E294-H297 PolarHBondContact O-N 3.43Å; E294-I298 WeakPolarHBondContact O-CD1 3.35Å; E294-I298 WeakPolarHBondContact O-CG1 3.41Å; E294-I298 PolarHBondContact O-N 3.24Å
295	S	92.7	Very high	91.9	Very high	40 Å²	40	27.4 Å²	27.4	28%	0.28	14%	0.144	S	C	.	.	H	α-helix	trans	-66.5	-39.3	-179.3	49.2	0	0	0	0	112.8	N293 I298 T299	N293-S295 VanDerWaalsContact C-N 3.27Å; N293-S295 PolarHBondContact O-N 3.09Å; N293-S295 PolarHBondContact OD1-OG 2.95Å; N293-S295 VanDerWaalsContact OD1-OG 3.04Å; S295-I298 PolarHBondContact O-N 2.84Å; S295-T299 PolarHBondContact O-N 2.9Å; S295-T299 VanDerWaalsContact O-N 3.12Å; S295-T299 PolarHBondContact O-OG1 2.91Å
296	A	92.6	Very high	91.8	Very high	7 Å²	7	27.4 Å²	27.4	6%	0.058	14%	0.143	C	C	.	.	H	α-helix	trans	-66	-41.2	175.8	0	0	0	0	0	111.7	N293 T299 D300 L351 T352	N293-A296 HydrophobicContact CB-CB 4.45Å; N293-A296 PolarHBondContact O-N 3.12Å; A296-T299 PolarHBondContact O-N 3.3Å; A296-D300 PolarHBondContact O-N 3.42Å; A296-D300 VanDerWaalsContact O-N 3.11Å; A296-L351 HydrophobicContact CB-CB 4.13Å; A296-T352 HydrophobicContact CB-CG2 3.63Å
297	H	92.7	Very high	91.7	Very high	3 Å²	3	29 Å²	29	1%	0.014	15%	0.151	C	C	.	.	H	α-helix	trans	-66.8	-34.9	174.8	-73.2	-74.3	0	0	0	112.7	L118 T137 V138 N290 N293 E294 A301	L118-H297 HydrophobicContact CB-CB 4.23Å; L118-H297 HydrophobicContact CD2-CB 4.24Å; T137-H297 WeakPolarHBondContact CB-ND1 3.34Å; T137-H297 PolarHBondContact OG1-ND1 3.02Å; V138-H297 WeakPolarHBondContact CG1-CE1 3.36Å; N290-H297 PolarHBondContact O-CD2 2.84Å; N290-H297 PolarHBondContact O-NE2 2.78Å; N293-H297 PolarHBondContact O-CD2 3.33Å; N293-H297 PolarHBondContact O-N 2.92Å; E294-H297 PolarHBondContact O-N 3.43Å; H297-A301 WeakPolarHBondContact O-CB 3.28Å; H297-A301 PolarHBondContact O-N 3.1Å
298	I	94.6	Very high	91.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.4	-50.5	174.3	-73	163.8	0	0	0	110.4	L30 Y35 V38 F39 A42 L118 E294 S295 A301 V302	L30-I298 HydrophobicContact CD2-CD1 4.08Å; L30-I298 HydrophobicContact CD2-CG1 4.42Å; Y35-I298 HydrophobicContact CD1-CD1 4.06Å; Y35-I298 HydrophobicContact CG-CD1 4.24Å; V38-I298 HydrophobicContact CG1-CG2 4.22Å; F39-I298 HydrophobicContact CB-CG2 3.97Å; F39-I298 HydrophobicContact CD2-CG2 4.24Å; A42-I298 HydrophobicContact CB-CG2 4.35Å; L118-I298 HydrophobicContact CD1-CG1 3.67Å; E294-I298 WeakPolarHBondContact O-CD1 3.35Å; E294-I298 WeakPolarHBondContact O-CG1 3.41Å; E294-I298 PolarHBondContact O-N 3.24Å; S295-I298 PolarHBondContact O-N 2.84Å; I298-A301 PolarHBondContact O-N 3.4Å; I298-V302 HydrophobicContact CG2-CG2 4.46Å; I298-V302 WeakPolarHBondContact O-CB 3.46Å; I298-V302 VanDerWaalsContact O-CG2 3.29Å; I298-V302 WeakPolarHBondContact O-CG2 3.37Å; I298-V302 PolarHBondContact O-N 3.25Å
299	T	93.5	Very high	91.6	Very high	34 Å²	34	24.6 Å²	24.6	21%	0.209	13%	0.13	C	C	.	.	H	α-helix	trans	-60.6	-48.7	-179.6	-52.3	0	0	0	0	111.7	S295 A296 V302 A303 L351	S295-T299 PolarHBondContact O-N 2.9Å; S295-T299 VanDerWaalsContact O-N 3.12Å; S295-T299 PolarHBondContact O-OG1 2.91Å; A296-T299 PolarHBondContact O-N 3.3Å; T299-V302 PolarHBondContact O-N 2.95Å; T299-A303 PolarHBondContact O-N 3.21Å; T299-L351 HydrophobicContact CG2-CD1 4.05Å
300	D	93.6	Very high	91.6	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.016	13%	0.128	C	C	.	.	H	α-helix	trans	-64.6	-41.9	179.5	-70.5	-3.3	0	0	0	111.9	A296 A303 V304 G350 L351 T352 V355	A296-D300 PolarHBondContact O-N 3.42Å; A296-D300 VanDerWaalsContact O-N 3.11Å; D300-A303 PolarHBondContact O-N 2.95Å; D300-V304 WeakPolarHBondContact O-CB 3.38Å; D300-V304 VanDerWaalsContact O-CG2 3.29Å; D300-V304 WeakPolarHBondContact O-CG2 3.3Å; D300-V304 PolarHBondContact O-N 3.47Å; D300-G350 WeakPolarHBondContact OD1-CA 3.29Å; D300-L351 PolarHBondContact OD1-N 3.19Å; D300-L351 PolarHBondContact OD2-N 3.43Å; D300-T352 VanDerWaalsContact OD2-CB 3.26Å; D300-T352 WeakPolarHBondContact OD2-CB 3.44Å; D300-T352 WeakPolarHBondContact OD2-CG2 3.4Å; D300-T352 PolarHBondContact OD2-N 3.07Å; D300-T352 PolarHBondContact OD2-OG1 2.9Å; D300-V355 HydrophobicContact CB-CG2 4.39Å
301	A	94.4	Very high	91.6	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.008	13%	0.126	C	C	.	.	H	α-helix	trans	-65	-40.5	177.7	0	0	0	0	0	112.3	L88 V116 L118 T137 H297 I298 V305	L88-A301 HydrophobicContact CD2-CB 3.78Å; L88-A301 HydrophobicContact CG-CB 4.25Å; V116-A301 HydrophobicContact CG1-CB 4.13Å; L118-A301 HydrophobicContact CD2-CB 3.54Å; T137-A301 HydrophobicContact CG2-CB 3.92Å; H297-A301 WeakPolarHBondContact O-CB 3.28Å; H297-A301 PolarHBondContact O-N 3.1Å; I298-A301 PolarHBondContact O-N 3.4Å; A301-V305 WeakPolarHBondContact O-CB 3.3Å; A301-V305 VanDerWaalsContact O-CG2 3.26Å; A301-V305 WeakPolarHBondContact O-CG2 3.31Å; A301-V305 PolarHBondContact O-N 2.99Å
302	V	94.9	Very high	92	Very high	1 Å²	1	24 Å²	24	1%	0.006	12%	0.122	C	C	.	.	H	α-helix	trans	-66.5	-41	176.3	170.8	0	0	0	0	110.9	F39 A42 V43 A46 L88 I298 T299 V305 A306	F39-V302 HydrophobicContact CD2-CG2 3.73Å; F39-V302 HydrophobicContact CE2-CG2 3.76Å; A42-V302 HydrophobicContact CB-CB 4.15Å; A42-V302 HydrophobicContact CB-CG1 4.23Å; A42-V302 HydrophobicContact CB-CG2 4.2Å; V43-V302 HydrophobicContact CB-CG1 4.42Å; V43-V302 HydrophobicContact CG2-CG1 3.69Å; V43-V302 HydrophobicContact CG2-CG2 4.11Å; A46-V302 HydrophobicContact CB-CG1 3.94Å; L88-V302 HydrophobicContact CD2-CG2 3.79Å; I298-V302 HydrophobicContact CG2-CG2 4.46Å; I298-V302 WeakPolarHBondContact O-CB 3.46Å; I298-V302 VanDerWaalsContact O-CG2 3.29Å; I298-V302 WeakPolarHBondContact O-CG2 3.37Å; I298-V302 PolarHBondContact O-N 3.25Å; T299-V302 PolarHBondContact O-N 2.95Å; V302-V305 PolarHBondContact O-N 2.97Å; V302-A306 VanDerWaalsContact O-CB 3.26Å; V302-A306 WeakPolarHBondContact O-CB 3.4Å; V302-A306 PolarHBondContact O-N 2.98Å
303	A	93.3	Very high	92.2	Very high	11 Å²	11	18.4 Å²	18.4	9%	0.091	10%	0.098	C	C	.	.	H	α-helix	trans	-62.1	-47.6	175.5	0	0	0	0	0	112.1	T299 D300 V305 A306 Q307 Y347	T299-A303 PolarHBondContact O-N 3.21Å; D300-A303 PolarHBondContact O-N 2.95Å; A303-V305 PolarHBondContact O-N 3.41Å; A303-A306 PolarHBondContact O-N 3.4Å; A303-Q307 WeakPolarHBondContact O-CB 3.19Å; A303-Q307 PolarHBondContact O-N 3.35Å; A303-Y347 HydrophobicContact CB-CE1 4.08Å; A303-Y347 HydrophobicContact CB-CE2 3.98Å
304	V	94.3	Very high	91.9	Very high	3 Å²	3	21.2 Å²	21.2	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-59.7	-42.5	176	165.8	0	0	0	0	111.9	D300 S308 L342 Y347 V355 F357	D300-V304 WeakPolarHBondContact O-CB 3.38Å; D300-V304 VanDerWaalsContact O-CG2 3.29Å; D300-V304 WeakPolarHBondContact O-CG2 3.3Å; D300-V304 PolarHBondContact O-N 3.47Å; V304-S308 VanDerWaalsContact O-CB 3.28Å; V304-S308 WeakPolarHBondContact O-CB 3.15Å; V304-S308 PolarHBondContact O-N 3.12Å; V304-S308 PolarHBondContact O-OG 3.37Å; V304-L342 HydrophobicContact CG1-CD1 3.85Å; V304-Y347 HydrophobicContact CG2-CD1 4.32Å; V304-Y347 HydrophobicContact CG2-CG 4.02Å; V304-V355 HydrophobicContact CG2-CB 4.17Å; V304-V355 HydrophobicContact CG2-CG1 4.11Å; V304-F357 HydrophobicContact CG1-CE2 4.02Å; V304-F357 HydrophobicContact CG1-CZ 4.29Å
305	V	94.4	Very high	91.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-67.5	-42.1	175.9	167.4	0	0	0	0	111.3	I26 A86 L88 V116 A301 V302 A303 S308 I309 L342	I26-V305 HydrophobicContact CD1-CG1 3.76Å; I26-V305 HydrophobicContact CG1-CG1 4.32Å; A86-V305 HydrophobicContact CB-CG1 4.29Å; L88-V305 HydrophobicContact CD1-CG2 4.42Å; V116-V305 HydrophobicContact CG2-CG2 4.32Å; A301-V305 WeakPolarHBondContact O-CB 3.3Å; A301-V305 VanDerWaalsContact O-CG2 3.26Å; A301-V305 WeakPolarHBondContact O-CG2 3.31Å; A301-V305 PolarHBondContact O-N 2.99Å; V302-V305 PolarHBondContact O-N 2.97Å; A303-V305 PolarHBondContact O-N 3.41Å; V305-S308 PolarHBondContact O-N 3.5Å; V305-I309 HydrophobicContact CG1-CD1 3.61Å; V305-I309 HydrophobicContact CG1-CG1 4.33Å; V305-I309 WeakPolarHBondContact O-CB 3.01Å; V305-I309 WeakPolarHBondContact O-CG1 3.44Å; V305-I309 PolarHBondContact O-N 3.49Å; V305-L342 HydrophobicContact CG2-CD1 4.02Å
306	A	92.6	Very high	90.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.6	-46	178.6	0	0	0	0	0	112.6	A46 Y50 L57 V302 A303 I309 Q310	A46-A306 HydrophobicContact CB-CB 3.88Å; Y50-A306 HydrophobicContact CD2-CB 3.6Å; Y50-A306 HydrophobicContact CE2-CB 4.09Å; Y50-A306 HydrophobicContact CG-CB 4.1Å; L57-A306 HydrophobicContact CD1-CB 3.63Å; V302-A306 VanDerWaalsContact O-CB 3.26Å; V302-A306 WeakPolarHBondContact O-CB 3.4Å; V302-A306 PolarHBondContact O-N 2.98Å; A303-A306 PolarHBondContact O-N 3.4Å; A306-I309 PolarHBondContact O-N 2.78Å; A306-Q310 PolarHBondContact O-N 2.69Å
307	Q	92.1	Very high	89.9	Confident	36 Å²	36	37.7 Å²	37.7	17%	0.168	18%	0.184	C	C	.	.	H	α-helix	trans	-56.6	-50	171.2	174.8	-179.5	-19.7	0	0	110.9	Y50 A303 I309 Q310 E311	Y50-Q307 HydrophobicContact CE1-CB 4Å; A303-Q307 WeakPolarHBondContact O-CB 3.19Å; A303-Q307 PolarHBondContact O-N 3.35Å; Q307-I309 VanDerWaalsContact C-N 3.26Å; Q307-I309 PolarHBondContact O-N 3.02Å; Q307-Q310 WeakPolarHBondContact O-CB 3.02Å; Q307-Q310 PolarHBondContact O-N 3.36Å; Q307-E311 WeakPolarHBondContact CG-OE1 3.43Å; Q307-E311 PolarHBondContact NE2-OE1 2.95Å; Q307-E311 PolarHBondContact O-N 3.04Å
308	S	92.3	Very high	89.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.3	-27.8	-178.3	-58.8	0	0	0	0	113.3	V304 V305 L312 V341 L342 S345	V304-S308 VanDerWaalsContact O-CB 3.28Å; V304-S308 WeakPolarHBondContact O-CB 3.15Å; V304-S308 PolarHBondContact O-N 3.12Å; V304-S308 PolarHBondContact O-OG 3.37Å; V305-S308 PolarHBondContact O-N 3.5Å; S308-L312 VanDerWaalsContact O-CB 3.32Å; S308-L312 WeakPolarHBondContact O-CB 3.47Å; S308-L312 PolarHBondContact O-N 3.11Å; S308-V341 WeakPolarHBondContact O-CG1 3.37Å; S308-L342 WeakPolarHBondContact OG-CD1 3.43Å; S308-S345 WeakPolarHBondContact OG-CB 3.25Å
309	I	91.4	Very high	89.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-72.1	-39.7	172.5	-73.6	166.4	0	0	0	110.3	V24 I26 F55 L57 V305 A306 Q307 L312 F313 F338	V24-I309 HydrophobicContact CG1-CD1 4.02Å; V24-I309 HydrophobicContact CG1-CG2 4.31Å; I26-I309 HydrophobicContact CD1-CD1 4.18Å; I26-I309 HydrophobicContact CG1-CD1 4.35Å; F55-I309 HydrophobicContact CD1-CG2 4.45Å; F55-I309 HydrophobicContact CD2-CG2 3.99Å; F55-I309 HydrophobicContact CE1-CG2 4.19Å; F55-I309 HydrophobicContact CE2-CG2 3.7Å; F55-I309 HydrophobicContact CG-CG2 4.37Å; F55-I309 HydrophobicContact CZ-CB 4.47Å; F55-I309 HydrophobicContact CZ-CG2 3.81Å; L57-I309 HydrophobicContact CD2-CD1 3.76Å; L57-I309 HydrophobicContact CD2-CG2 4.27Å; V305-I309 HydrophobicContact CG1-CD1 3.61Å; V305-I309 HydrophobicContact CG1-CG1 4.33Å; V305-I309 WeakPolarHBondContact O-CB 3.01Å; V305-I309 WeakPolarHBondContact O-CG1 3.44Å; V305-I309 PolarHBondContact O-N 3.49Å; A306-I309 PolarHBondContact O-N 2.78Å; Q307-I309 VanDerWaalsContact C-N 3.26Å; Q307-I309 PolarHBondContact O-N 3.02Å; I309-L312 WeakPolarHBondContact O-CB 3.42Å; I309-L312 PolarHBondContact O-N 3.33Å; I309-F313 HydrophobicContact CG2-CD2 3.65Å; I309-F313 HydrophobicContact CG2-CE2 3.71Å; I309-F313 VanDerWaalsContact O-CD2 3.31Å; I309-F313 WeakPolarHBondContact O-CD2 3.3Å; I309-F313 PolarHBondContact O-N 3.16Å; I309-F338 HydrophobicContact CD1-CZ 4.29Å; I309-F338 HydrophobicContact CG1-CE2 3.83Å; I309-F338 HydrophobicContact CG1-CZ 3.6Å
310	Q	89.7	Confident	89	Confident	64 Å²	64	45 Å²	45	30%	0.299	22%	0.221	S	C	.	.	H	α-helix	trans	-64.1	-46.2	174.5	-168.9	165.9	-54.7	0	0	111.8	G51 F55 A306 Q307 L312 F313 E314	G51-Q310 VanDerWaalsContact N-OE1 3.16Å; F55-Q310 HydrophobicContact CE1-CB 3.95Å; F55-Q310 HydrophobicContact CE1-CG 4.21Å; F55-Q310 HydrophobicContact CZ-CB 3.98Å; A306-Q310 PolarHBondContact O-N 2.69Å; Q307-Q310 WeakPolarHBondContact O-CB 3.02Å; Q307-Q310 PolarHBondContact O-N 3.36Å; Q310-L312 PolarHBondContact O-N 2.61Å; Q310-F313 PolarHBondContact O-N 3.32Å; Q310-E314 PolarHBondContact O-N 2.9Å
311	E	89.5	Confident	88.9	Confident	57 Å²	57	45 Å²	45	27%	0.266	22%	0.221	S	C	.	.	H	α-helix	trans	-64.4	-22.1	173.1	-69	179.1	-149.7	0	0	113.4	Q307 K315 V341	Q307-E311 WeakPolarHBondContact CG-OE1 3.43Å; Q307-E311 PolarHBondContact NE2-OE1 2.95Å; Q307-E311 PolarHBondContact O-N 3.04Å; E311-K315 VanDerWaalsContact O-CE 3.29Å; E311-K315 WeakPolarHBondContact O-CE 3.39Å; E311-V341 HydrophobicContact CB-CG1 3.62Å
312	L	89.8	Confident	88.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-77	-48.3	172.2	-176.2	70.6	0	0	0	111.1	S308 I309 Q310 E314 K315 I318 T334 L337 F338	S308-L312 VanDerWaalsContact O-CB 3.32Å; S308-L312 WeakPolarHBondContact O-CB 3.47Å; S308-L312 PolarHBondContact O-N 3.11Å; I309-L312 WeakPolarHBondContact O-CB 3.42Å; I309-L312 PolarHBondContact O-N 3.33Å; Q310-L312 PolarHBondContact O-N 2.61Å; L312-E314 PolarHBondContact O-N 3.01Å; L312-K315 WeakPolarHBondContact O-CB 3.43Å; L312-K315 PolarHBondContact O-N 2.5Å; L312-I318 HydrophobicContact CG-CD1 4.16Å; L312-I318 HydrophobicContact CG-CG1 4.49Å; L312-I318 WeakPolarHBondContact O-CD1 3.41Å; L312-T334 HydrophobicContact CD1-CG2 4.05Å; L312-T334 HydrophobicContact CD2-CG2 4.29Å; L312-L337 HydrophobicContact CD1-CD2 4.3Å; L312-L337 HydrophobicContact CD1-CG 4.21Å; L312-F338 HydrophobicContact CB-CD2 4.26Å; L312-F338 HydrophobicContact CD1-CB 4.17Å; L312-F338 HydrophobicContact CD1-CD2 4.5Å; L312-F338 HydrophobicContact CD2-CB 3.97Å; L312-F338 HydrophobicContact CD2-CD2 3.8Å; L312-F338 HydrophobicContact CD2-CE2 4.5Å; L312-F338 HydrophobicContact CD2-CG 3.91Å; L312-F338 HydrophobicContact CG-CD2 4.41Å
313	F	87.5	Confident	88.2	Confident	45 Å²	45	52.5 Å²	52.5	20%	0.197	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	5.2	-179.3	-80.3	-67.3	0	0	0	115	K22 V24 F55 Y85 I309 Q310 I318	K22-F313 HydrophobicContact CD-CE1 4.34Å; K22-F313 HydrophobicContact CD-CZ 4.4Å; V24-F313 HydrophobicContact CG2-CE2 3.71Å; V24-F313 HydrophobicContact CG2-CZ 3.96Å; F55-F313 AromaticContact CD1-CD2 3.93Å; F55-F313 HydrophobicContact CD1-CD2 3.93Å; F55-F313 HydrophobicContact CD1-CG 4.5Å; F55-F313 HydrophobicContact CE1-CD2 4.43Å; F55-F313 HydrophobicContact CG-CD2 4.29Å; Y85-F313 HydrophobicContact CE1-CZ 4.26Å; I309-F313 HydrophobicContact CG2-CD2 3.65Å; I309-F313 HydrophobicContact CG2-CE2 3.71Å; I309-F313 VanDerWaalsContact O-CD2 3.31Å; I309-F313 WeakPolarHBondContact O-CD2 3.3Å; I309-F313 PolarHBondContact O-N 3.16Å; Q310-F313 PolarHBondContact O-N 3.32Å; F313-I318 HydrophobicContact CD1-CD1 3.48Å; F313-I318 VanDerWaalsContact CD1-CD1 3.48Å; F313-I318 HydrophobicContact CE1-CD1 3.85Å; F313-I318 HydrophobicContact CE1-CG2 4.29Å; F313-I318 HydrophobicContact CG-CD1 4.12Å
314	E	85.3	Confident	87.7	Confident	122 Å²	122	52.2 Å²	52.2	57%	0.57	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	2.1	165.4	-72.7	170.7	-179.1	0	0	112.8	K54 Q310 L312	K54-E314 IonicContact NZ-OE1 3.03Å; Q310-E314 PolarHBondContact O-N 2.9Å; L312-E314 PolarHBondContact O-N 3.01Å
315	K	83.3	Confident	87.3	Confident	92 Å²	92	53.8 Å²	53.8	40%	0.4	26%	0.263	S	S	.	.	S	Bend	trans	-113.8	139.7	-179.6	-56.3	179.2	-174.4	174.6	0	110.8	E311 L312 I318 V341	E311-K315 VanDerWaalsContact O-CE 3.29Å; E311-K315 WeakPolarHBondContact O-CE 3.39Å; L312-K315 WeakPolarHBondContact O-CB 3.43Å; L312-K315 PolarHBondContact O-N 2.5Å; K315-I318 WeakPolarHBondContact O-CD1 3.35Å; K315-V341 VanDerWaalsContact NZ-CG2 3.29Å
316	E	70.6	Confident	86.8	Confident	169 Å²	169	60.4 Å²	60.4	79%	0.79	30%	0.303	S	S	*	.	S	Bend	trans	-71.9	163.4	180	-59.9	-178.8	169.7	0	0	112.4
317	N	78.6	Confident	86.1	Confident	149 Å²	149	64.4 Å²	64.4	80%	0.797	34%	0.344	S	S	*	.			trans	64.1	41	172.8	-56.8	-62.7	0	0	0	116	T319	N317-T319 PolarHBondContact O-N 3.29Å
318	I	85.9	Confident	85.4	Confident	47 Å²	47	65.4 Å²	65.4	24%	0.241	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-76.1	120	172	-63.6	167	0	0	0	111	L312 F313 K315 T334	L312-I318 HydrophobicContact CG-CD1 4.16Å; L312-I318 HydrophobicContact CG-CG1 4.49Å; L312-I318 WeakPolarHBondContact O-CD1 3.41Å; F313-I318 HydrophobicContact CD1-CD1 3.48Å; F313-I318 VanDerWaalsContact CD1-CD1 3.48Å; F313-I318 HydrophobicContact CE1-CD1 3.85Å; F313-I318 HydrophobicContact CE1-CG2 4.29Å; F313-I318 HydrophobicContact CG-CD1 4.12Å; K315-I318 WeakPolarHBondContact O-CD1 3.35Å; I318-T334 HydrophobicContact CG1-CG2 4.46Å; I318-T334 HydrophobicContact CG2-CG2 4.3Å
319	T	88.8	Confident	84.9	Confident	57 Å²	57	71 Å²	71	35%	0.35	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-90.3	150.4	165.1	59.7	0	0	0	0	110.9	N317 W332 T334	N317-T319 PolarHBondContact O-N 3.29Å; T319-W332 PolarHBondContact O-NE1 2.65Å; T319-W332 PolarHBondContact OG1-NE1 3.36Å; T319-T334 PolarHBondContact N-OG1 2.74Å; T319-T334 PolarHBondContact OG1-OG1 2.78Å
320	E	87.5	Confident	84.6	Confident	88 Å²	88	76.4 Å²	76.4	41%	0.411	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-76.7	152.2	171.1	-65.8	-176.4	-180	0	0	112.2	K22 Q83 W332	K22-E320 WeakPolarHBondContact CE-OE1 3.47Å; K22-E320 IonicContact NZ-OE1 3.58Å; K22-E320 PolarHBondContact NZ-OE1 2.84Å; Q83-E320 PolarHBondContact NE2-OE2 2.7Å; E320-W332 VanDerWaalsContact C-NE1 3.28Å; E320-W332 PolarHBondContact O-NE1 3.14Å
321	P	90.4	Very high	84.7	Confident	3 Å²	3	77.9 Å²	77.9	2%	0.019	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-66.4	157.6	169	28.5	-33.5	0	0	0	111.5	Q83 Y85 W332	Q83-P321 HydrophobicContact CB-CG 4.04Å; Q83-P321 PolarHBondContact NE2-O 2.88Å; Q83-P321 VanDerWaalsContact O-CG 3.31Å; Q83-P321 WeakPolarHBondContact O-CG 3.45Å; Y85-P321 HydrophobicContact CD2-CG 3.8Å; Y85-P321 HydrophobicContact CE2-CG 3.83Å; Y85-P321 HydrophobicContact CG-CG 4.39Å; P321-W332 HydrophobicContact CB-CD2 4Å; P321-W332 HydrophobicContact CB-CE3 4.28Å; P321-W332 HydrophobicContact CB-CG 4.35Å; P321-W332 HydrophobicContact CB-CZ2 4.38Å; P321-W332 HydrophobicContact CG-CZ2 4.46Å
322	P	89.7	Confident	84.8	Confident	11 Å²	11	75.5 Å²	75.5	7%	0.071	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-63.6	146.7	-173.4	27.3	-37.1	0	0	0	113	I80 Y111 G324	I80-P322 HydrophobicContact CG2-CG 4.29Å; Y111-P322 HydrophobicContact CD1-CB 4.44Å; Y111-P322 HydrophobicContact CD1-CG 3.68Å; Y111-P322 HydrophobicContact CE1-CG 4.15Å; Y111-P322 HydrophobicContact CG-CG 3.9Å; P322-G324 PolarHBondContact O-N 2.9Å; P322-G324 VanDerWaalsContact O-N 3.15Å
323	K	85.3	Confident	84.8	Confident	148 Å²	148	83.8 Å²	83.8	64%	0.643	45%	0.448	S	S	*	.	S	Bend	trans	-83.1	80.4	173.4	-74.1	179.9	173.7	178.8	0	110.4	Q83	Q83-K323 VanDerWaalsContact CD-CG 3.43Å; Q83-K323 HydrophobicContact CG-CB 4.48Å; Q83-K323 HydrophobicContact CG-CG 3.53Å
324	G	83.6	Confident	85	Confident	5 Å²	5	81.9 Å²	81.9	5%	0.052	44%	0.44	C	S	.	.	S	Bend	trans	81	174.6	178.8	0	0	0	0	0	114.5	I80 P322	I80-G324 PolarHBondContact O-N 3.04Å; P322-G324 PolarHBondContact O-N 2.9Å; P322-G324 VanDerWaalsContact O-N 3.15Å
325	C	85.8	Confident	85.3	Confident	35 Å²	35	76.1 Å²	76.1	24%	0.236	41%	0.413	C	S	.	.	S	Bend	trans	-91.2	-2.9	-173.7	-66.4	0	0	0	0	115.3	C76 Y111	C76-C325 WeakPolarHBondContact CA-SG 3.3Å; C76-C325 HydrophobicContact CB-CB 3.73Å; C76-C325 WeakPolarHBondContact CB-SG 3.16Å; C76-C325 WeakPolarHBondContact SG-CB 3.23Å; C76-C325 CovalentContact SG-SG 2.04Å; C76-C325 PolarHBondContact SG-SG 3.31Å; Y111-C325 HydrophobicContact CE2-CB 4.5Å; Y111-C325 WeakPolarHBondContact OH-CA 3.14Å; Y111-C325 PolarHBondContact OH-O 2.85Å
326	V	82.9	Confident	85.7	Confident	140 Å²	140	74.8 Å²	74.8	85%	0.848	41%	0.414	S	S	*	.	S	Bend	trans	-97.1	131.1	-176.7	-178.2	0	0	0	0	110	N328	V326-N328 VanDerWaalsContact C-N 3.31Å; V326-N328 PolarHBondContact O-N 2.82Å
327	G	77.4	Confident	86.7	Confident	84 Å²	84	69.7 Å²	69.7	87%	0.866	39%	0.391	S	S	*	.	S	Bend	trans	79.7	-4.4	171.1	0	0	0	0	0	116.6
328	N	78.3	Confident	87.4	Confident	58 Å²	58	62.6 Å²	62.6	31%	0.31	35%	0.354	S	S	.	.			trans	-117.3	108.8	176.8	-167	-1.3	0	0	0	112.2	Y111 V326 N330	Y111-N328 PolarHBondContact OH-O 3.42Å; V326-N328 VanDerWaalsContact C-N 3.31Å; V326-N328 PolarHBondContact O-N 2.82Å; N328-N330 PolarHBondContact OD1-N 2.93Å; N328-N330 VanDerWaalsContact OD1-N 3.08Å
329	T	81.2	Confident	87.7	Confident	117 Å²	117	61.4 Å²	61.4	72%	0.718	35%	0.347	S	S	*	.			trans	-92.7	-2.9	178.1	51.1	0	0	0	0	113.7
330	N	86.1	Confident	87.8	Confident	114 Å²	114	67 Å²	67	61%	0.61	36%	0.361	S	S	*	.	S	Bend	trans	-89.9	142.5	-175	-70.3	-70.9	0	0	0	112.8	N328	N328-N330 PolarHBondContact OD1-N 2.93Å; N328-N330 VanDerWaalsContact OD1-N 3.08Å
331	I	90.3	Very high	88.1	Confident	95 Å²	95	63 Å²	63	49%	0.487	34%	0.342	S	S	.	.			trans	-68.8	147	171.7	62.6	174.2	0	0	0	111.6	R112 K333	R112-I331 HydrophobicContact CG-CB 4.17Å; R112-I331 HydrophobicContact CG-CG2 4.29Å; I331-K333 PolarHBondContact O-N 3.09Å; I331-K333 VanDerWaalsContact O-N 3.16Å
332	W	92.5	Very high	88.2	Confident	7 Å²	7	62.8 Å²	62.8	3%	0.027	34%	0.341	C	S	.	.			trans	-72	108.3	173.7	177.7	39.5	0	0	0	110	Y85 Y111 I113 T319 E320 P321 T334 G335 P336 F338	Y85-W332 AromaticContact CD1-CH2 3.82Å; Y85-W332 HydrophobicContact CD1-CH2 3.82Å; Y85-W332 AromaticContact CD1-CZ2 3.89Å; Y85-W332 HydrophobicContact CD1-CZ2 3.89Å; Y85-W332 HydrophobicContact CE1-CH2 4.45Å; Y85-W332 HydrophobicContact CE1-CZ2 4.05Å; Y85-W332 HydrophobicContact CG-CH2 4.23Å; Y111-W332 VanDerWaalsContact O-CB 3.24Å; Y111-W332 WeakPolarHBondContact O-CB 3.46Å; Y111-W332 PolarHBondContact O-N 2.98Å; I113-W332 HydrophobicContact CG1-CE3 3.9Å; I113-W332 HydrophobicContact CG1-CZ3 4.3Å; T319-W332 PolarHBondContact O-NE1 2.65Å; T319-W332 PolarHBondContact OG1-NE1 3.36Å; E320-W332 VanDerWaalsContact C-NE1 3.28Å; E320-W332 PolarHBondContact O-NE1 3.14Å; P321-W332 HydrophobicContact CB-CD2 4Å; P321-W332 HydrophobicContact CB-CE3 4.28Å; P321-W332 HydrophobicContact CB-CG 4.35Å; P321-W332 HydrophobicContact CB-CZ2 4.38Å; P321-W332 HydrophobicContact CG-CZ2 4.46Å; W332-T334 HydrophobicContact CZ2-CG2 4.43Å; W332-T334 PolarHBondContact O-N 2.92Å; W332-G335 PolarHBondContact O-N 3.17Å; W332-P336 VanDerWaalsContact O-CD 3.31Å; W332-P336 WeakPolarHBondContact O-CD 3.49Å; W332-F338 AromaticContact CH2-CD1 4Å; W332-F338 HydrophobicContact CH2-CD1 4Å; W332-F338 HydrophobicContact CZ3-CD1 4.34Å
333	K	89.8	Confident	88.3	Confident	174 Å²	174	64.8 Å²	64.8	76%	0.757	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-33.4	-174.2	-68.3	-175.9	179.1	179.7	0	113.3	I331	I331-K333 PolarHBondContact O-N 3.09Å; I331-K333 VanDerWaalsContact O-N 3.16Å
334	T	91.8	Very high	88.6	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.031	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-18	178.9	-49	0	0	0	0	113.2	L312 I318 T319 W332 L337 F338	L312-T334 HydrophobicContact CD1-CG2 4.05Å; L312-T334 HydrophobicContact CD2-CG2 4.29Å; I318-T334 HydrophobicContact CG1-CG2 4.46Å; I318-T334 HydrophobicContact CG2-CG2 4.3Å; T319-T334 PolarHBondContact N-OG1 2.74Å; T319-T334 PolarHBondContact OG1-OG1 2.78Å; W332-T334 HydrophobicContact CZ2-CG2 4.43Å; W332-T334 PolarHBondContact O-N 2.92Å; T334-L337 WeakPolarHBondContact O-CB 3.31Å; T334-L337 PolarHBondContact O-N 3.3Å; T334-F338 PolarHBondContact O-N 3.03Å
335	G	91	Very high	88.9	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-54.8	-49.8	-178.2	0	0	0	0	0	114.6	R112 W332 L337 F338 K339	R112-G335 CarbonylContact O-C 3.6Å; R112-G335 WeakPolarHBondContact O-CA 3.37Å; W332-G335 PolarHBondContact O-N 3.17Å; G335-L337 VanDerWaalsContact C-N 3.31Å; G335-L337 PolarHBondContact O-N 2.7Å; G335-F338 PolarHBondContact O-N 2.86Å; G335-K339 PolarHBondContact O-N 2.83Å
336	P	91.8	Very high	89.2	Confident	65 Å²	65	65.5 Å²	65.5	42%	0.422	36%	0.357	S	S	.	.	H	α-helix	trans	-63.4	-31.3	174.7	-25.1	35.7	0	0	0	114.4	R112 W332 R340	R112-P336 HydrophobicContact CB-CG 4.06Å; R112-P336 HydrophobicContact CG-CG 4.25Å; W332-P336 VanDerWaalsContact O-CD 3.31Å; W332-P336 WeakPolarHBondContact O-CD 3.49Å; P336-R340 PolarHBondContact O-N 2.92Å; P336-R340 VanDerWaalsContact O-N 3.15Å
337	L	91.9	Very high	89.5	Confident	62 Å²	62	61.2 Å²	61.2	33%	0.325	33%	0.326	S	S	.	.	H	α-helix	trans	-69.9	-45.8	174.3	176.8	62.1	0	0	0	110.5	L312 T334 G335 R340 V341	L312-L337 HydrophobicContact CD1-CD2 4.3Å; L312-L337 HydrophobicContact CD1-CG 4.21Å; T334-L337 WeakPolarHBondContact O-CB 3.31Å; T334-L337 PolarHBondContact O-N 3.3Å; G335-L337 VanDerWaalsContact C-N 3.31Å; G335-L337 PolarHBondContact O-N 2.7Å; L337-R340 WeakPolarHBondContact O-CB 3.16Å; L337-R340 PolarHBondContact O-N 3.18Å; L337-R340 VanDerWaalsContact O-N 3.1Å; L337-V341 PolarHBondContact O-N 3.27Å
338	F	92.9	Very high	90	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64	-40.5	176.6	-178	-141.6	0	0	0	111.7	Y85 A86 P114 I309 L312 W332 T334 G335 R340 V341 L342	Y85-F338 WeakPolarHBondContact O-CE1 3.26Å; A86-F338 HydrophobicContact CB-CE1 4.05Å; P114-F338 HydrophobicContact CG-CD1 3.79Å; P114-F338 HydrophobicContact CG-CE1 4.31Å; P114-F338 HydrophobicContact CG-CG 4.45Å; I309-F338 HydrophobicContact CD1-CZ 4.29Å; I309-F338 HydrophobicContact CG1-CE2 3.83Å; I309-F338 HydrophobicContact CG1-CZ 3.6Å; L312-F338 HydrophobicContact CB-CD2 4.26Å; L312-F338 HydrophobicContact CD1-CB 4.17Å; L312-F338 HydrophobicContact CD1-CD2 4.5Å; L312-F338 HydrophobicContact CD2-CB 3.97Å; L312-F338 HydrophobicContact CD2-CD2 3.8Å; L312-F338 HydrophobicContact CD2-CE2 4.5Å; L312-F338 HydrophobicContact CD2-CG 3.91Å; L312-F338 HydrophobicContact CG-CD2 4.41Å; W332-F338 AromaticContact CH2-CD1 4Å; W332-F338 HydrophobicContact CH2-CD1 4Å; W332-F338 HydrophobicContact CZ3-CD1 4.34Å; T334-F338 PolarHBondContact O-N 3.03Å; G335-F338 PolarHBondContact O-N 2.86Å; F338-R340 VanDerWaalsContact C-N 3.26Å; F338-R340 PolarHBondContact O-N 2.9Å; F338-V341 PolarHBondContact O-N 3.47Å; F338-L342 WeakPolarHBondContact O-CB 3.29Å; F338-L342 PolarHBondContact O-N 2.82Å
339	K	92.3	Very high	90.3	Very high	22 Å²	22	66.9 Å²	66.9	10%	0.096	34%	0.336	C	S	.	.	H	α-helix	trans	-55.6	-41.8	170.6	-161.1	-148	171.9	-171.5	0	111.5	P114 L132 L135 G335 L342 M343	P114-K339 HydrophobicContact CG-CB 4.17Å; L132-K339 VanDerWaalsContact O-CE 3.25Å; L132-K339 WeakPolarHBondContact O-CE 3.06Å; L132-K339 PolarHBondContact O-NZ 3.27Å; L135-K339 HydrophobicContact CD1-CD 4.47Å; L135-K339 HydrophobicContact CD1-CG 3.83Å; G335-K339 PolarHBondContact O-N 2.83Å; K339-L342 PolarHBondContact O-N 3.3Å; K339-M343 HydrophobicContact CD-CE 4.06Å; K339-M343 HydrophobicContact CD-SD 4.09Å; K339-M343 WeakPolarHBondContact CE-SD 3.49Å; K339-M343 HydrophobicContact CG-CE 4.39Å; K339-M343 HydrophobicContact CG-SD 4.45Å; K339-M343 VanDerWaalsContact O-CG 3.3Å; K339-M343 WeakPolarHBondContact O-CG 3.24Å; K339-M343 PolarHBondContact O-N 3.13Å
340	R	91.9	Very high	90.5	Very high	175 Å²	175	62 Å²	62	66%	0.66	31%	0.309	S	S	*	.	H	α-helix	trans	-64.5	-43.1	178	-168.7	-177.7	-64.9	167.1	0.3	112	P336 L337 F338 M343 S344	P336-R340 PolarHBondContact O-N 2.92Å; P336-R340 VanDerWaalsContact O-N 3.15Å; L337-R340 WeakPolarHBondContact O-CB 3.16Å; L337-R340 PolarHBondContact O-N 3.18Å; L337-R340 VanDerWaalsContact O-N 3.1Å; F338-R340 VanDerWaalsContact C-N 3.26Å; F338-R340 PolarHBondContact O-N 2.9Å; R340-M343 PolarHBondContact O-N 3.21Å; R340-S344 PolarHBondContact O-N 3.32Å; R340-S344 PolarHBondContact O-OG 2.91Å; R340-S344 VanDerWaalsContact O-OG 3.1Å
341	V	92.9	Very high	90.6	Very high	2 Å²	2	62 Å²	62	1%	0.012	31%	0.308	C	S	.	.	H	α-helix	trans	-60.9	-48.2	174.7	177.8	0	0	0	0	111	S308 E311 K315 L337 F338 M343 S344 S345	S308-V341 WeakPolarHBondContact O-CG1 3.37Å; E311-V341 HydrophobicContact CB-CG1 3.62Å; K315-V341 VanDerWaalsContact NZ-CG2 3.29Å; L337-V341 PolarHBondContact O-N 3.27Å; F338-V341 PolarHBondContact O-N 3.47Å; V341-M343 VanDerWaalsContact C-N 3.33Å; V341-M343 PolarHBondContact O-N 2.82Å; V341-S344 WeakPolarHBondContact CA-OG 3.07Å; V341-S344 CarbonylContact O-C 3.44Å; V341-S344 PolarHBondContact O-N 2.81Å; V341-S344 PolarHBondContact O-OG 3.04Å; V341-S345 PolarHBondContact O-N 3.24Å
342	L	92.8	Very high	90.5	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.1	-40.9	178.4	-168.2	66.6	0	0	0	112.1	P114 V116 L135 V304 V305 S308 F338 K339 S345 F357	P114-L342 HydrophobicContact CB-CD2 4.01Å; V116-L342 HydrophobicContact CG2-CD2 3.98Å; L135-L342 HydrophobicContact CD1-CD2 4.06Å; L135-L342 HydrophobicContact CD2-CB 4.33Å; L135-L342 HydrophobicContact CD2-CD2 3.86Å; L135-L342 HydrophobicContact CD2-CG 3.85Å; V304-L342 HydrophobicContact CG1-CD1 3.85Å; V305-L342 HydrophobicContact CG2-CD1 4.02Å; S308-L342 WeakPolarHBondContact OG-CD1 3.43Å; F338-L342 WeakPolarHBondContact O-CB 3.29Å; F338-L342 PolarHBondContact O-N 2.82Å; K339-L342 PolarHBondContact O-N 3.3Å; L342-S345 WeakPolarHBondContact O-CB 3.42Å; L342-S345 PolarHBondContact O-N 3.33Å; L342-S345 PolarHBondContact O-OG 2.96Å; L342-F357 VanDerWaalsContact O-CD2 3.24Å; L342-F357 WeakPolarHBondContact O-CD2 3.48Å; L342-F357 VanDerWaalsContact O-CE2 3.31Å; L342-F357 WeakPolarHBondContact O-CE2 3.44Å
343	M	91.9	Very high	90.3	Very high	52 Å²	52	59.1 Å²	59.1	26%	0.256	30%	0.3	S	S	.	.	H	α-helix	trans	-69.3	-30.9	174.3	-69.3	-177.2	-52.7	0	0	113.7	L135 K339 R340 V341	L135-M343 HydrophobicContact CD2-CG 3.64Å; L135-M343 HydrophobicContact CG-CG 4.3Å; K339-M343 HydrophobicContact CD-CE 4.06Å; K339-M343 HydrophobicContact CD-SD 4.09Å; K339-M343 WeakPolarHBondContact CE-SD 3.49Å; K339-M343 HydrophobicContact CG-CE 4.39Å; K339-M343 HydrophobicContact CG-SD 4.45Å; K339-M343 VanDerWaalsContact O-CG 3.3Å; K339-M343 WeakPolarHBondContact O-CG 3.24Å; K339-M343 PolarHBondContact O-N 3.13Å; R340-M343 PolarHBondContact O-N 3.21Å; V341-M343 VanDerWaalsContact C-N 3.33Å; V341-M343 PolarHBondContact O-N 2.82Å
344	S	91.9	Very high	90.3	Very high	71 Å²	71	55.9 Å²	55.9	50%	0.497	28%	0.283	S	S	.	.	H	α-helix	trans	-82.9	-14	176.4	56.3	0	0	0	0	114.4	R340 V341	R340-S344 PolarHBondContact O-N 3.32Å; R340-S344 PolarHBondContact O-OG 2.91Å; R340-S344 VanDerWaalsContact O-OG 3.1Å; V341-S344 WeakPolarHBondContact CA-OG 3.07Å; V341-S344 CarbonylContact O-C 3.44Å; V341-S344 PolarHBondContact O-N 2.81Å; V341-S344 PolarHBondContact O-OG 3.04Å
345	S	89.9	Confident	90.3	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.014	28%	0.282	C	S	.	.			trans	-59.5	146.9	178.6	73.1	0	0	0	0	111.8	S308 V341 L342	S308-S345 WeakPolarHBondContact OG-CB 3.25Å; V341-S345 PolarHBondContact O-N 3.24Å; L342-S345 WeakPolarHBondContact O-CB 3.42Å; L342-S345 PolarHBondContact O-N 3.33Å; L342-S345 PolarHBondContact O-OG 2.96Å
346	K	91.3	Very high	90.4	Very high	130 Å²	130	56.7 Å²	56.7	57%	0.565	29%	0.287	S	S	*	.			trans	-135.1	119.1	178.7	-60.2	-178.8	-178.5	174.3	0	108.7	E356	K346-E356 HydrophobicContact CB-CG 4.22Å; K346-E356 HydrophobicContact CG-CG 4.05Å
347	Y	90.6	Very high	90.4	Very high	51 Å²	51	54 Å²	54	20%	0.2	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-123.1	97.2	-179.6	-167.1	-106.9	0	0	0	109.5	A303 V304 E349 V355	A303-Y347 HydrophobicContact CB-CE1 4.08Å; A303-Y347 HydrophobicContact CB-CE2 3.98Å; V304-Y347 HydrophobicContact CG2-CD1 4.32Å; V304-Y347 HydrophobicContact CG2-CG 4.02Å; Y347-E349 WeakPolarHBondContact CE1-O 3.49Å; Y347-V355 PolarHBondContact N-O 2.74Å; Y347-V355 PolarHBondContact O-N 3.3Å
348	P	86.5	Confident	90.4	Very high	86 Å²	86	52 Å²	52	56%	0.558	26%	0.258	S	S	*	.	S	Bend	trans	-71.4	-38.5	-174.1	-20.8	34.1	0	0	0	113.9	G350 R354	P348-G350 PolarHBondContact O-N 2.84Å; P348-R354 WeakPolarHBondContact O-CA 3.46Å
349	E	84.4	Confident	90.2	Very high	174 Å²	174	58.7 Å²	58.7	81%	0.813	29%	0.294	S	S	*	.	S	Bend	trans	-101.5	55.2	-168.2	-60.3	-170.8	171.2	0	0	112.6	Y347	Y347-E349 WeakPolarHBondContact CE1-O 3.49Å
350	G	85.6	Confident	90.1	Very high	15 Å²	15	61 Å²	61	16%	0.155	31%	0.307	C	S	.	.			trans	-82.2	149.6	172	0	0	0	0	0	113.6	D300 P348 T352 G353	D300-G350 WeakPolarHBondContact OD1-CA 3.29Å; P348-G350 PolarHBondContact O-N 2.84Å; G350-T352 PolarHBondContact O-N 3.25Å; G350-G353 WeakPolarHBondContact O-CA 3.21Å; G350-G353 PolarHBondContact O-N 3.35Å
351	L	89.3	Confident	90	Very high	115 Å²	115	52.7 Å²	52.7	60%	0.602	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.2	170.8	-65.4	178.9	0	0	0	112.1	N290 A296 T299 D300	N290-L351 PolarHBondContact ND2-O 2.62Å; A296-L351 HydrophobicContact CB-CB 4.13Å; T299-L351 HydrophobicContact CG2-CD1 4.05Å; D300-L351 PolarHBondContact OD1-N 3.19Å; D300-L351 PolarHBondContact OD2-N 3.43Å
352	T	88.2	Confident	89.9	Confident	18 Å²	18	52.9 Å²	52.9	11%	0.11	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	9.4	173	68.8	0	0	0	0	112.8	N290 A296 D300 G350 R363	N290-T352 HydrophobicContact CB-CG2 4.23Å; A296-T352 HydrophobicContact CB-CG2 3.63Å; D300-T352 VanDerWaalsContact OD2-CB 3.26Å; D300-T352 WeakPolarHBondContact OD2-CB 3.44Å; D300-T352 WeakPolarHBondContact OD2-CG2 3.4Å; D300-T352 PolarHBondContact OD2-N 3.07Å; D300-T352 PolarHBondContact OD2-OG1 2.9Å; G350-T352 PolarHBondContact O-N 3.25Å; T352-R363 PolarHBondContact O-NH2 3.31Å; T352-R363 PolarHBondContact OG1-NH1 3.2Å; T352-R363 PolarHBondContact OG1-NH2 3.29Å; T352-R363 VanDerWaalsContact OG1-NH2 3.17Å
353	G	87.6	Confident	89.9	Confident	22 Å²	22	53.3 Å²	53.3	23%	0.227	28%	0.278	C	S	.	.	S	Bend	trans	86.8	-173.4	-170.6	0	0	0	0	0	113.1	G350 V355 R363	G350-G353 WeakPolarHBondContact O-CA 3.21Å; G350-G353 PolarHBondContact O-N 3.35Å; G353-V355 PolarHBondContact O-N 3.06Å; G353-R363 VanDerWaalsContact C-NH2 3.31Å; G353-R363 PolarHBondContact O-NH2 3.27Å
354	R	90.1	Very high	89.7	Confident	107 Å²	107	54.2 Å²	54.2	40%	0.404	28%	0.281	S	S	.	.			trans	-53.8	132.7	-179.1	179.7	172.6	176.4	-165.8	-4.5	112.4	P348 E356 R363	P348-R354 WeakPolarHBondContact O-CA 3.46Å; R354-E356 HydrophobicContact CG-CG 4.28Å; R354-E356 IonicContact CZ-OE1 2.62Å; R354-E356 IonicContact CZ-OE2 3.83Å; R354-E356 VanDerWaalsContact NE-CD 3.31Å; R354-E356 IonicContact NE-OE1 2.74Å; R354-E356 PolarHBondContact NE-OE1 2.75Å; R354-E356 IonicContact NE-OE2 2.71Å; R354-E356 IonicContact NH2-OE1 2.67Å; R354-E356 PolarHBondContact NH2-OE1 2.79Å; R354-E356 IonicContact NH2-OE2 3.66Å; R354-E356 PolarHBondContact NH2-OE2 2.85Å; R354-E356 VanDerWaalsContact NH2-OE2 3.08Å; R354-R363 PolarHBondContact O-NE 3.13Å; R354-R363 VanDerWaalsContact O-NE 3.15Å; R354-R363 PolarHBondContact O-NH2 3.06Å
355	V	91.6	Very high	89.5	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-114.4	117.3	175.5	-169.7	0	0	0	0	109.3	D300 V304 Y347 G353 F357	D300-V355 HydrophobicContact CB-CG2 4.39Å; V304-V355 HydrophobicContact CG2-CB 4.17Å; V304-V355 HydrophobicContact CG2-CG1 4.11Å; Y347-V355 PolarHBondContact N-O 2.74Å; Y347-V355 PolarHBondContact O-N 3.3Å; G353-V355 PolarHBondContact O-N 3.06Å; V355-F357 HydrophobicContact CG1-CZ 4.24Å
356	E	92.3	Very high	89.5	Confident	21 Å²	21	55.2 Å²	55.2	10%	0.098	28%	0.275	C	S	.	.			trans	-146.5	150.4	170.8	-65.2	-172.6	177.8	0	0	108.4	K346 R354 R363 K364	K346-E356 HydrophobicContact CB-CG 4.22Å; K346-E356 HydrophobicContact CG-CG 4.05Å; R354-E356 HydrophobicContact CG-CG 4.28Å; R354-E356 IonicContact CZ-OE1 2.62Å; R354-E356 IonicContact CZ-OE2 3.83Å; R354-E356 VanDerWaalsContact NE-CD 3.31Å; R354-E356 IonicContact NE-OE1 2.74Å; R354-E356 PolarHBondContact NE-OE1 2.75Å; R354-E356 IonicContact NE-OE2 2.71Å; R354-E356 IonicContact NH2-OE1 2.67Å; R354-E356 PolarHBondContact NH2-OE1 2.79Å; R354-E356 IonicContact NH2-OE2 3.66Å; R354-E356 PolarHBondContact NH2-OE2 2.85Å; R354-E356 VanDerWaalsContact NH2-OE2 3.08Å; E356-R363 WeakPolarHBondContact O-CA 3.38Å; E356-K364 PolarHBondContact O-N 3.22Å
357	F	93.3	Very high	89.5	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.035	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-103.9	155.1	-177.8	-57.7	-76.7	0	0	0	112.9	L135 R136 V304 L342 V355 G361 D362 K364	L135-F357 HydrophobicContact CB-CD1 4.4Å; L135-F357 HydrophobicContact CB-CE1 4.12Å; L135-F357 HydrophobicContact CD2-CD1 4.15Å; L135-F357 HydrophobicContact CD2-CD2 4.11Å; L135-F357 HydrophobicContact CD2-CE1 4.16Å; L135-F357 HydrophobicContact CD2-CE2 4.13Å; L135-F357 HydrophobicContact CD2-CG 4.11Å; L135-F357 HydrophobicContact CD2-CZ 4.15Å; R136-F357 WeakPolarHBondContact O-CE1 3.36Å; V304-F357 HydrophobicContact CG1-CE2 4.02Å; V304-F357 HydrophobicContact CG1-CZ 4.29Å; L342-F357 VanDerWaalsContact O-CD2 3.24Å; L342-F357 WeakPolarHBondContact O-CD2 3.48Å; L342-F357 VanDerWaalsContact O-CE2 3.31Å; L342-F357 WeakPolarHBondContact O-CE2 3.44Å; V355-F357 HydrophobicContact CG1-CZ 4.24Å; F357-G361 VanDerWaalsContact CD1-O 3.28Å; F357-G361 WeakPolarHBondContact CD1-O 3.32Å; F357-D362 CarbonylContact C-O 3.58Å; F357-D362 WeakPolarHBondContact CA-O 3.41Å; F357-K364 WeakPolarHBondContact O-CD 3.46Å; F357-K364 VanDerWaalsContact O-CE 3.29Å; F357-K364 WeakPolarHBondContact O-CE 3.46Å; F357-K364 PolarHBondContact O-NZ 2.81Å
358	N	90.7	Very high	89.7	Confident	21 Å²	21	50.1 Å²	50.1	11%	0.112	26%	0.255	C	S	.	.			trans	-89.5	179.4	161.6	83.3	-19.4	0	0	0	111.4	D360 G361 D362 K364	N358-D360 PolarHBondContact ND2-OD2 2.65Å; N358-D360 PolarHBondContact O-N 2.78Å; N358-D360 VanDerWaalsContact OD1-CA 3.29Å; N358-D360 WeakPolarHBondContact OD1-CA 3.42Å; N358-D360 WeakPolarHBondContact OD1-CB 3.47Å; N358-D360 PolarHBondContact OD1-N 2.9Å; N358-D360 VanDerWaalsContact OD1-N 3.07Å; N358-G361 WeakPolarHBondContact O-CA 3.16Å; N358-G361 PolarHBondContact O-N 2.85Å; N358-G361 PolarHBondContact OD1-N 3.1Å; N358-G361 VanDerWaalsContact OD1-N 3.09Å; N358-D362 PolarHBondContact N-O 3.48Å; N358-D362 WeakPolarHBondContact OD1-CA 3.41Å; N358-D362 WeakPolarHBondContact OD1-CB 3.49Å; N358-D362 PolarHBondContact OD1-N 3.02Å; N358-D362 PolarHBondContact OD1-O 3.3Å; N358-K364 VanDerWaalsContact CA-CE 3.5Å; N358-K364 HydrophobicContact CB-CD 4.41Å; N358-K364 HydrophobicContact CB-CG 4.09Å
359	D	89.4	Confident	90	Very high	140 Å²	140	46.7 Å²	46.7	75%	0.749	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-25	-178.6	-47.3	-81	0	0	0	111.5	G361	D359-G361 PolarHBondContact O-N 2.81Å
360	D	89.1	Confident	90.5	Very high	71 Å²	71	38.4 Å²	38.4	38%	0.38	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	11.8	167.5	-40.8	-64	0	0	0	113.5	K128 N358 D362	K128-D360 WeakPolarHBondContact CE-O 3.28Å; K128-D360 PolarHBondContact NZ-O 3.43Å; N358-D360 PolarHBondContact ND2-OD2 2.65Å; N358-D360 PolarHBondContact O-N 2.78Å; N358-D360 VanDerWaalsContact OD1-CA 3.29Å; N358-D360 WeakPolarHBondContact OD1-CA 3.42Å; N358-D360 WeakPolarHBondContact OD1-CB 3.47Å; N358-D360 PolarHBondContact OD1-N 2.9Å; N358-D360 VanDerWaalsContact OD1-N 3.07Å; D360-D362 PolarHBondContact O-N 3.08Å
361	G	90.1	Very high	90.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	63.4	11.4	179.4	0	0	0	0	0	115.5	L135 R136 F357 N358 D359	L135-G361 CarbonylContact C-O 3.4Å; L135-G361 WeakPolarHBondContact CA-O 3.21Å; L135-G361 WeakPolarHBondContact CB-O 3.45Å; R136-G361 PolarHBondContact N-O 3.01Å; R136-G361 VanDerWaalsContact N-O 3.09Å; F357-G361 VanDerWaalsContact CD1-O 3.28Å; F357-G361 WeakPolarHBondContact CD1-O 3.32Å; N358-G361 WeakPolarHBondContact O-CA 3.16Å; N358-G361 PolarHBondContact O-N 2.85Å; N358-G361 PolarHBondContact OD1-N 3.1Å; N358-G361 VanDerWaalsContact OD1-N 3.09Å; D359-G361 PolarHBondContact O-N 2.81Å
362	D	92.3	Very high	91.1	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.027	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-92.9	147.6	180	-65.9	-23.2	0	0	0	110.5	S126 R136 F357 N358 D360 K364	S126-D362 WeakPolarHBondContact CB-OD2 3.32Å; S126-D362 PolarHBondContact OG-OD2 3.12Å; R136-D362 IonicContact CZ-OD1 2.99Å; R136-D362 IonicContact CZ-OD2 3.48Å; R136-D362 IonicContact NE-OD1 2.74Å; R136-D362 PolarHBondContact NE-OD1 2.55Å; R136-D362 IonicContact NE-OD2 3.77Å; R136-D362 VanDerWaalsContact NH2-CG 3.26Å; R136-D362 IonicContact NH2-OD1 3.7Å; R136-D362 PolarHBondContact NH2-OD1 3.18Å; R136-D362 IonicContact NH2-OD2 2.72Å; R136-D362 PolarHBondContact NH2-OD2 2.71Å; F357-D362 CarbonylContact C-O 3.58Å; F357-D362 WeakPolarHBondContact CA-O 3.41Å; N358-D362 PolarHBondContact N-O 3.48Å; N358-D362 WeakPolarHBondContact OD1-CA 3.41Å; N358-D362 WeakPolarHBondContact OD1-CB 3.49Å; N358-D362 PolarHBondContact OD1-N 3.02Å; N358-D362 PolarHBondContact OD1-O 3.3Å; D360-D362 PolarHBondContact O-N 3.08Å; D362-K364 PolarHBondContact O-N 3.24Å
363	R	91.7	Very high	91.3	Very high	10 Å²	10	33 Å²	33	4%	0.038	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-68.7	127.1	-176.4	179.4	171.9	-178.8	177.2	3.9	113.4	T137 T352 G353 R354 E356	T137-R363 WeakPolarHBondContact O-CD 3.23Å; T137-R363 PolarHBondContact O-NH1 3.08Å; T352-R363 PolarHBondContact O-NH2 3.31Å; T352-R363 PolarHBondContact OG1-NH1 3.2Å; T352-R363 PolarHBondContact OG1-NH2 3.29Å; T352-R363 VanDerWaalsContact OG1-NH2 3.17Å; G353-R363 VanDerWaalsContact C-NH2 3.31Å; G353-R363 PolarHBondContact O-NH2 3.27Å; R354-R363 PolarHBondContact O-NE 3.13Å; R354-R363 VanDerWaalsContact O-NE 3.15Å; R354-R363 PolarHBondContact O-NH2 3.06Å; E356-R363 WeakPolarHBondContact O-CA 3.38Å
364	K	88.7	Confident	91.4	Very high	71 Å²	71	33.4 Å²	33.4	31%	0.309	16%	0.156	S	C	.	.	S	Bend	trans	-81	160.8	167.4	-69.9	172.6	174.1	145.5	0	111.8	E356 F357 N358 D362 A366	E356-K364 PolarHBondContact O-N 3.22Å; F357-K364 WeakPolarHBondContact O-CD 3.46Å; F357-K364 VanDerWaalsContact O-CE 3.29Å; F357-K364 WeakPolarHBondContact O-CE 3.46Å; F357-K364 PolarHBondContact O-NZ 2.81Å; N358-K364 VanDerWaalsContact CA-CE 3.5Å; N358-K364 HydrophobicContact CB-CD 4.41Å; N358-K364 HydrophobicContact CB-CG 4.09Å; D362-K364 PolarHBondContact O-N 3.24Å; K364-A366 PolarHBondContact O-N 2.94Å; K364-A366 VanDerWaalsContact O-N 3.16Å
365	Y	87.9	Confident	91	Very high	89 Å²	89	36.6 Å²	36.6	35%	0.349	17%	0.172	S	C	.	.	S	Bend	trans	57.4	26.2	170.7	-50.7	-62.5	0	0	0	115.9	H367 T387	Y365-H367 PolarHBondContact O-CD2 3.06Å; Y365-H367 VanDerWaalsContact O-CD2 3.29Å; Y365-T387 HydrophobicContact CD1-CG2 3.76Å; Y365-T387 HydrophobicContact CE1-CG2 3.79Å
366	A	89.1	Confident	90.6	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.033	20%	0.202	C	C	.	.			trans	-66	140.7	174.9	0	0	0	0	0	112	P139 L288 K364 Y368	P139-A366 HydrophobicContact CB-CB 4.25Å; P139-A366 HydrophobicContact CG-CB 3.57Å; L288-A366 HydrophobicContact CD1-CB 4.07Å; K364-A366 PolarHBondContact O-N 2.94Å; K364-A366 VanDerWaalsContact O-N 3.16Å; A366-Y368 HydrophobicContact CB-CE2 4.25Å
367	H	91.9	Very high	90.5	Very high	74 Å²	74	49.1 Å²	49.1	34%	0.343	23%	0.232	S	C	.	.			trans	-93.5	138	-179	-59.9	177.1	0	0	0	112	I289 Y365 Y384	I289-H367 HydrophobicContact CB-CB 4.4Å; I289-H367 WeakPolarHBondContact CB-O 3.41Å; I289-H367 HydrophobicContact CD1-CB 3.9Å; I289-H367 HydrophobicContact CG1-CB 4.37Å; I289-H367 PolarHBondContact N-O 3.13Å; Y365-H367 PolarHBondContact O-CD2 3.06Å; Y365-H367 VanDerWaalsContact O-CD2 3.29Å; H367-Y384 VanDerWaalsContact CA-O 3.24Å; H367-Y384 WeakPolarHBondContact CA-O 3.43Å
368	Y	93.4	Very high	90.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	144.3	177.7	-63.2	-103.5	0	0	0	111	P139 Q144 V147 Q287 L288 A366 I383 Y384	P139-Y368 HydrophobicContact CG-CE2 4.42Å; P139-Y368 WeakPolarHBondContact CG-OH 3.48Å; Q144-Y368 HydrophobicContact CG-CD1 4.45Å; Q144-Y368 HydrophobicContact CG-CE1 3.63Å; V147-Y368 HydrophobicContact CG2-CD2 3.73Å; V147-Y368 HydrophobicContact CG2-CE2 3.97Å; V147-Y368 HydrophobicContact CG2-CG 4.15Å; Q287-Y368 CarbonylContact O-C 3.57Å; Q287-Y368 WeakPolarHBondContact O-CA 3.46Å; Q287-Y368 WeakPolarHBondContact O-CB 3.47Å; L288-Y368 HydrophobicContact CB-CD1 4.11Å; L288-Y368 HydrophobicContact CB-CE1 4.08Å; L288-Y368 HydrophobicContact CD1-CD1 4.22Å; L288-Y368 HydrophobicContact CD1-CE1 3.96Å; L288-Y368 HydrophobicContact CD1-CE2 4.35Å; A366-Y368 HydrophobicContact CB-CE2 4.25Å; Y368-I383 CarbonylContact O-C 3.57Å; Y368-I383 WeakPolarHBondContact O-CA 3.16Å; Y368-Y384 HydrophobicContact CD2-CD1 4.08Å; Y368-Y384 PolarHBondContact N-O 3Å; Y368-Y384 VanDerWaalsContact N-O 3.16Å; Y368-Y384 PolarHBondContact O-N 2.69Å
369	T	93.8	Very high	90.4	Very high	15 Å²	15	52.9 Å²	52.9	9%	0.092	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	137	162.8	38.4	0	0	0	0	110	Q287 I289 Q380	Q287-T369 PolarHBondContact N-O 3.08Å; Q287-T369 PolarHBondContact O-N 3.41Å; Q287-T369 PolarHBondContact O-OG1 3.45Å; I289-T369 HydrophobicContact CD1-CG2 4.05Å; I289-T369 HydrophobicContact CG1-CG2 4.04Å; T369-Q380 HydrophobicContact CG2-CG 4.1Å
370	I	94.6	Very high	90.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.5	173.1	-59.4	154.2	0	0	0	106.8	L151 I284 L286 Q380 V381 G382 V389 M391	L151-I370 HydrophobicContact CD2-CD1 4.03Å; L151-I370 HydrophobicContact CD2-CG2 4.39Å; I284-I370 HydrophobicContact CG2-CG2 3.71Å; L286-I370 HydrophobicContact CD2-CG1 4.06Å; I370-Q380 WeakPolarHBondContact O-CA 3.35Å; I370-V381 HydrophobicContact CG2-CG2 3.92Å; I370-V381 PolarHBondContact O-N 2.91Å; I370-G382 PolarHBondContact N-O 3.03Å; I370-G382 PolarHBondContact O-N 3.16Å; I370-V389 HydrophobicContact CD1-CB 4.5Å; I370-V389 HydrophobicContact CD1-CG1 3.64Å; I370-V389 HydrophobicContact CD1-CG2 4.24Å; I370-M391 HydrophobicContact CD1-SD 4.36Å
371	L	93.3	Very high	90.7	Very high	13 Å²	13	46.3 Å²	46.3	7%	0.068	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	142.1	-175.9	-54.1	-178.8	0	0	0	109.8	I284 A285 Q287 L378 Q380	I284-L371 CarbonylContact C-O 3.56Å; I284-L371 WeakPolarHBondContact CA-O 3.43Å; A285-L371 PolarHBondContact N-O 3.27Å; A285-L371 PolarHBondContact O-N 3.26Å; Q287-L371 HydrophobicContact CB-CD1 3.89Å; Q287-L371 HydrophobicContact CB-CG 4.41Å; L371-L378 HydrophobicContact CB-CD2 4.23Å; L371-L378 HydrophobicContact CD1-CB 4.4Å; L371-L378 HydrophobicContact CD1-CD1 4.24Å; L371-L378 HydrophobicContact CD1-CD2 4.36Å; L371-Q380 HydrophobicContact CD2-CB 3.96Å
372	N	94.1	Very high	90.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	133.6	167.7	-177.1	-50.8	0	0	0	108.4	L283 Q374 V379 V381 I397 I398	L283-N372 WeakPolarHBondContact O-CA 3.27Å; N372-Q374 HydrophobicContact CB-CG 4.31Å; N372-Q374 WeakPolarHBondContact OD1-CG 3.36Å; N372-Q374 PolarHBondContact OD1-NE2 2.99Å; N372-V379 PolarHBondContact N-O 3.1Å; N372-V379 PolarHBondContact O-N 3.44Å; N372-V381 HydrophobicContact CB-CG1 3.73Å; N372-V381 HydrophobicContact CB-CG2 4.06Å; N372-I397 WeakPolarHBondContact ND2-CG2 3.2Å; N372-I398 PolarHBondContact ND2-N 3.44Å; N372-I398 PolarHBondContact ND2-O 3.21Å
373	Y	92.6	Very high	90.9	Very high	20 Å²	20	48.9 Å²	48.9	8%	0.078	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	108.8	176	-174.8	-109.4	0	0	0	110.5	M271 L276 A279 P280 G282 L283 L378	M271-Y373 HydrophobicContact SD-CD2 4.36Å; L276-Y373 HydrophobicContact CD1-CD2 4.09Å; L276-Y373 HydrophobicContact CD1-CE2 3.71Å; L276-Y373 PolarHBondContact O-OH 2.61Å; A279-Y373 HydrophobicContact CB-CD1 4.27Å; A279-Y373 HydrophobicContact CB-CE1 4.09Å; A279-Y373 WeakPolarHBondContact O-CE1 3.4Å; P280-Y373 WeakPolarHBondContact O-CD1 3.13Å; G282-Y373 PolarHBondContact N-O 2.82Å; L283-Y373 PolarHBondContact O-N 3.05Å; Y373-L378 HydrophobicContact CD2-CD2 4.01Å; Y373-L378 HydrophobicContact CD2-CG 4.37Å
374	Q	90	Very high	90.9	Very high	32 Å²	32	48.9 Å²	48.9	15%	0.15	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	114.1	-173.2	-57.8	-173.1	-7.5	0	0	110.6	N372 S376 R377 V379 K396 I398	N372-Q374 HydrophobicContact CB-CG 4.31Å; N372-Q374 WeakPolarHBondContact OD1-CG 3.36Å; N372-Q374 PolarHBondContact OD1-NE2 2.99Å; Q374-S376 VanDerWaalsContact C-N 3.33Å; Q374-S376 PolarHBondContact O-N 3.13Å; Q374-R377 PolarHBondContact N-O 3.4Å; Q374-R377 PolarHBondContact O-N 3.26Å; Q374-V379 HydrophobicContact CB-CG2 4.17Å; Q374-V379 HydrophobicContact CG-CB 4.5Å; Q374-V379 HydrophobicContact CG-CG2 4.3Å; Q374-K396 PolarHBondContact NE2-O 3.44Å; Q374-K396 VanDerWaalsContact NE2-O 3.09Å; Q374-I398 HydrophobicContact CB-CD1 4.26Å; Q374-I398 HydrophobicContact CG-CB 4.33Å; Q374-I398 HydrophobicContact CG-CD1 4.04Å; Q374-I398 HydrophobicContact CG-CG1 4.36Å
375	K	82.3	Confident	90.8	Very high	173 Å²	173	49 Å²	49	75%	0.752	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	50.9	174.2	-56.6	-177.1	179.6	-177.5	0	111.9	D281 R377	D281-K375 PolarHBondContact OD1-N 2.82Å; K375-R377 VanDerWaalsContact C-N 3.28Å; K375-R377 PolarHBondContact O-N 2.98Å
376	S	83.1	Confident	90.5	Very high	91 Å²	91	45.2 Å²	45.2	64%	0.636	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	28.9	-176.7	-48.4	0	0	0	0	115.2	Q374	Q374-S376 VanDerWaalsContact C-N 3.33Å; Q374-S376 PolarHBondContact O-N 3.13Å
377	R	88.9	Confident	90.2	Very high	194 Å²	194	49.1 Å²	49.1	73%	0.732	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-136.5	141.3	173.8	-62.9	-175.2	179.1	-169.2	-1.1	111.2	Q374 K375	Q374-R377 PolarHBondContact N-O 3.4Å; Q374-R377 PolarHBondContact O-N 3.26Å; K375-R377 VanDerWaalsContact C-N 3.28Å; K375-R377 PolarHBondContact O-N 2.98Å
378	L	89.4	Confident	89.9	Confident	72 Å²	72	51.3 Å²	51.3	38%	0.377	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	118.1	173.1	-69.8	167.6	0	0	0	110.2	M271 L276 L371 Y373	M271-L378 HydrophobicContact CG-CD1 4.15Å; M271-L378 HydrophobicContact CG-CD2 3.8Å; M271-L378 HydrophobicContact SD-CD2 3.9Å; L276-L378 HydrophobicContact CD1-CD1 4.34Å; L371-L378 HydrophobicContact CB-CD2 4.23Å; L371-L378 HydrophobicContact CD1-CB 4.4Å; L371-L378 HydrophobicContact CD1-CD1 4.24Å; L371-L378 HydrophobicContact CD1-CD2 4.36Å; Y373-L378 HydrophobicContact CD2-CD2 4.01Å; Y373-L378 HydrophobicContact CD2-CG 4.37Å
379	V	92.2	Very high	89.7	Confident	36 Å²	36	52 Å²	52	22%	0.218	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	118	178.3	-179.4	0	0	0	0	108.8	N372 Q374 V381	N372-V379 PolarHBondContact N-O 3.1Å; N372-V379 PolarHBondContact O-N 3.44Å; Q374-V379 HydrophobicContact CB-CG2 4.17Å; Q374-V379 HydrophobicContact CG-CB 4.5Å; Q374-V379 HydrophobicContact CG-CG2 4.3Å; V379-V381 HydrophobicContact CG1-CG1 4.45Å; V379-V381 PolarHBondContact O-N 3.21Å
380	Q	92.8	Very high	89.5	Confident	71 Å²	71	54.3 Å²	54.3	33%	0.332	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	119.4	171.6	179.5	-166.3	-0.5	0	0	110	T369 I370 L371 I383 R395	T369-Q380 HydrophobicContact CG2-CG 4.1Å; I370-Q380 WeakPolarHBondContact O-CA 3.35Å; L371-Q380 HydrophobicContact CD2-CB 3.96Å; Q380-I383 VanDerWaalsContact NE2-CG1 3.3Å; Q380-R395 WeakPolarHBondContact O-CD 3.14Å; Q380-R395 PolarHBondContact O-NH1 3.1Å
381	V	92.8	Very high	89.1	Confident	2 Å²	2	56 Å²	56	1%	0.012	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-15.3	-179.9	-67.5	0	0	0	0	113.4	I370 N372 V379 N392 I397	I370-V381 HydrophobicContact CG2-CG2 3.92Å; I370-V381 PolarHBondContact O-N 2.91Å; N372-V381 HydrophobicContact CB-CG1 3.73Å; N372-V381 HydrophobicContact CB-CG2 4.06Å; V379-V381 HydrophobicContact CG1-CG1 4.45Å; V379-V381 PolarHBondContact O-N 3.21Å; V381-N392 WeakPolarHBondContact O-CB 3.36Å; V381-N392 PolarHBondContact O-N 2.93Å; V381-I397 HydrophobicContact CB-CG1 4.13Å; V381-I397 HydrophobicContact CG1-CG1 4.21Å; V381-I397 HydrophobicContact CG2-CG1 4.33Å
382	G	92.5	Very high	88.8	Confident	3 Å²	3	58.5 Å²	58.5	3%	0.031	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	177.4	177.1	0	0	0	0	0	113.7	I370 V390	I370-G382 PolarHBondContact N-O 3.03Å; I370-G382 PolarHBondContact O-N 3.16Å; G382-V390 CarbonylContact C-O 3.58Å; G382-V390 VanDerWaalsContact CA-O 3.3Å; G382-V390 WeakPolarHBondContact CA-O 3.25Å
383	I	93.3	Very high	87.9	Confident	57 Å²	57	66.2 Å²	66.2	29%	0.292	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	139.2	174.5	-53.6	178.2	0	0	0	108.9	I289 Y368 Q380 N385 V390	I289-I383 HydrophobicContact CD1-CG2 4.24Å; Y368-I383 CarbonylContact O-C 3.57Å; Y368-I383 WeakPolarHBondContact O-CA 3.16Å; Q380-I383 VanDerWaalsContact NE2-CG1 3.3Å; I383-N385 VanDerWaalsContact CG2-OD1 3.28Å; I383-N385 WeakPolarHBondContact CG2-OD1 3.46Å; I383-V390 PolarHBondContact N-O 2.73Å; I383-V390 PolarHBondContact O-N 2.89Å
384	Y	92.3	Very high	87.2	Confident	10 Å²	10	73.6 Å²	73.6	4%	0.039	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	115.6	167.4	-175.1	-103	0	0	0	109.7	V147 D150 H367 Y368 G386 Q388 V389	V147-Y384 HydrophobicContact CG1-CD2 4.07Å; V147-Y384 HydrophobicContact CG1-CG 4.01Å; V147-Y384 HydrophobicContact CG2-CD1 3.79Å; V147-Y384 HydrophobicContact CG2-CD2 4.34Å; V147-Y384 HydrophobicContact CG2-CE1 4.06Å; V147-Y384 HydrophobicContact CG2-CG 3.93Å; D150-Y384 HydrophobicContact CB-CE2 4.02Å; D150-Y384 VanDerWaalsContact OD2-CE2 3.31Å; D150-Y384 WeakPolarHBondContact OD2-CE2 3.42Å; D150-Y384 PolarHBondContact OD2-OH 3.45Å; D150-Y384 VanDerWaalsContact OD2-OH 3.13Å; H367-Y384 VanDerWaalsContact CA-O 3.24Å; H367-Y384 WeakPolarHBondContact CA-O 3.43Å; Y368-Y384 HydrophobicContact CD2-CD1 4.08Å; Y368-Y384 PolarHBondContact N-O 3Å; Y368-Y384 VanDerWaalsContact N-O 3.16Å; Y368-Y384 PolarHBondContact O-N 2.69Å; Y384-G386 VanDerWaalsContact C-N 3.26Å; Y384-G386 VanDerWaalsContact CE1-C 3.45Å; Y384-G386 VanDerWaalsContact CE1-CA 3.41Å; Y384-G386 PolarHBondContact O-N 3.39Å; Y384-Q388 VanDerWaalsContact CD2-C 3.47Å; Y384-Q388 WeakPolarHBondContact CD2-O 3.45Å; Y384-V389 HydrophobicContact CD2-CG2 3.81Å; Y384-V389 HydrophobicContact CE2-CG2 4.41Å
385	N	86.9	Confident	86.9	Confident	73 Å²	73	77.6 Å²	77.6	39%	0.39	39%	0.387	S	S	.	.			trans	-91.5	39.2	-176.6	-72.3	-10.1	0	0	0	112.4	I383 T387 Q388	I383-N385 VanDerWaalsContact CG2-OD1 3.28Å; I383-N385 WeakPolarHBondContact CG2-OD1 3.46Å; N385-T387 PolarHBondContact O-N 2.91Å; N385-Q388 PolarHBondContact N-O 2.88Å
386	G	81.6	Confident	87	Confident	9 Å²	9	77 Å²	77	9%	0.093	38%	0.384	C	S	.	.	S	Bend	trans	72	-13.3	178.9	0	0	0	0	0	116.3	Y384	Y384-G386 VanDerWaalsContact C-N 3.26Å; Y384-G386 VanDerWaalsContact CE1-C 3.45Å; Y384-G386 VanDerWaalsContact CE1-CA 3.41Å; Y384-G386 PolarHBondContact O-N 3.39Å
387	T	82.2	Confident	87.3	Confident	87 Å²	87	74 Å²	74	53%	0.534	36%	0.36	S	S	.	.	S	Bend	trans	-136.5	-20.9	-176.9	55.4	0	0	0	0	115	Y365 N385	Y365-T387 HydrophobicContact CD1-CG2 3.76Å; Y365-T387 HydrophobicContact CE1-CG2 3.79Å; N385-T387 PolarHBondContact O-N 2.91Å
388	Q	86.3	Confident	87.4	Confident	119 Å²	119	66.8 Å²	66.8	56%	0.556	34%	0.336	S	S	*	.	S	Bend	trans	-157.5	154.9	178.3	66.6	-175.5	16.4	0	0	110.7	Y384 N385 V390	Y384-Q388 VanDerWaalsContact CD2-C 3.47Å; Y384-Q388 WeakPolarHBondContact CD2-O 3.45Å; N385-Q388 PolarHBondContact N-O 2.88Å; Q388-V390 HydrophobicContact CG-CG2 4.33Å
389	V	88.9	Confident	87.5	Confident	14 Å²	14	63.6 Å²	63.6	9%	0.085	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	141.9	166.9	172.4	0	0	0	0	109.5	D150 L151 I370 Y384 M391	D150-V389 HydrophobicContact CB-CG2 3.9Å; L151-V389 HydrophobicContact CD2-CG1 4.27Å; L151-V389 HydrophobicContact CD2-CG2 4.27Å; L151-V389 HydrophobicContact CG-CG2 4.2Å; I370-V389 HydrophobicContact CD1-CB 4.5Å; I370-V389 HydrophobicContact CD1-CG1 3.64Å; I370-V389 HydrophobicContact CD1-CG2 4.24Å; Y384-V389 HydrophobicContact CD2-CG2 3.81Å; Y384-V389 HydrophobicContact CE2-CG2 4.41Å; V389-M391 HydrophobicContact CG1-CE 3.86Å; V389-M391 HydrophobicContact CG1-CG 4.09Å; V389-M391 HydrophobicContact CG1-SD 3.92Å
390	V	89.5	Confident	87.4	Confident	65 Å²	65	61.9 Å²	61.9	39%	0.394	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	110.7	170.3	-176.5	0	0	0	0	107.9	G382 I383 Q388	G382-V390 CarbonylContact C-O 3.58Å; G382-V390 VanDerWaalsContact CA-O 3.3Å; G382-V390 WeakPolarHBondContact CA-O 3.25Å; I383-V390 PolarHBondContact N-O 2.73Å; I383-V390 PolarHBondContact O-N 2.89Å; Q388-V390 HydrophobicContact CG-CG2 4.33Å
391	M	86.8	Confident	87.1	Confident	36 Å²	36	61.2 Å²	61.2	18%	0.177	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	150.3	178.7	-65.8	-58.9	-163.1	0	0	112	L151 E154 F155 I370 V389 I397	L151-M391 HydrophobicContact CD2-CE 3.48Å; L151-M391 VanDerWaalsContact CD2-CE 3.48Å; E154-M391 HydrophobicContact CG-CE 4.42Å; E154-M391 HydrophobicContact CG-CG 4.31Å; F155-M391 HydrophobicContact CE1-CE 4.2Å; F155-M391 HydrophobicContact CE2-CE 3.7Å; F155-M391 HydrophobicContact CZ-CE 3.39Å; I370-M391 HydrophobicContact CD1-SD 4.36Å; V389-M391 HydrophobicContact CG1-CE 3.86Å; V389-M391 HydrophobicContact CG1-CG 4.09Å; V389-M391 HydrophobicContact CG1-SD 3.92Å; M391-I397 HydrophobicContact CE-CD1 4.44Å
392	N	85.6	Confident	86.7	Confident	64 Å²	64	63.6 Å²	63.6	34%	0.342	35%	0.345	S	S	.	.			trans	-96.6	99.2	176.7	-176	-10	0	0	0	111	V381 Q394 R395	V381-N392 WeakPolarHBondContact O-CB 3.36Å; V381-N392 PolarHBondContact O-N 2.93Å; N392-Q394 PolarHBondContact O-N 3.24Å; N392-Q394 WeakPolarHBondContact OD1-CB 3.29Å; N392-Q394 PolarHBondContact OD1-N 3.4Å; N392-R395 PolarHBondContact O-N 2.83Å
393	N	76.5	Confident	86.5	Confident	162 Å²	162	67.1 Å²	67.1	87%	0.866	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-18.5	179.9	-63.8	-7.5	0	0	0	114.9
394	Q	78.4	Confident	86.1	Confident	176 Å²	176	68.6 Å²	68.6	82%	0.822	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-17	176.8	-59.7	-178.7	-14.4	0	0	113.6	N392	N392-Q394 PolarHBondContact O-N 3.24Å; N392-Q394 WeakPolarHBondContact OD1-CB 3.29Å; N392-Q394 PolarHBondContact OD1-N 3.4Å
395	R	83.3	Confident	85.9	Confident	116 Å²	116	76 Å²	76	44%	0.438	41%	0.408	S	S	.	.	S	Bend	trans	-117.6	101.3	-175.5	-72	-175.6	173.7	-176.9	-0.2	110.6	Q380 N392 I397	Q380-R395 WeakPolarHBondContact O-CD 3.14Å; Q380-R395 PolarHBondContact O-NH1 3.1Å; N392-R395 PolarHBondContact O-N 2.83Å; R395-I397 PolarHBondContact O-N 3.29Å
396	K	84.3	Confident	85.8	Confident	161 Å²	161	77.1 Å²	77.1	70%	0.7	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-60.8	135.5	177.9	-67.3	-167.6	175.2	-168.5	0	111.3	Q374	Q374-K396 PolarHBondContact NE2-O 3.44Å; Q374-K396 VanDerWaalsContact NE2-O 3.09Å
397	I	89.7	Confident	86.1	Confident	27 Å²	27	77.3 Å²	77.3	14%	0.138	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-76.4	130.3	168.4	-58.6	-178	0	0	0	106.9	F155 I284 N372 V381 M391 R395 W399	F155-I397 HydrophobicContact CE1-CD1 4.18Å; F155-I397 HydrophobicContact CZ-CD1 3.7Å; I284-I397 HydrophobicContact CD1-CG2 4.31Å; N372-I397 WeakPolarHBondContact ND2-CG2 3.2Å; V381-I397 HydrophobicContact CB-CG1 4.13Å; V381-I397 HydrophobicContact CG1-CG1 4.21Å; V381-I397 HydrophobicContact CG2-CG1 4.33Å; M391-I397 HydrophobicContact CE-CD1 4.44Å; R395-I397 PolarHBondContact O-N 3.29Å; I397-W399 HydrophobicContact CB-CZ2 4.27Å; I397-W399 HydrophobicContact CD1-CZ2 4.41Å; I397-W399 HydrophobicContact CG2-CD2 3.89Å; I397-W399 HydrophobicContact CG2-CE3 4.23Å; I397-W399 HydrophobicContact CG2-CH2 3.98Å; I397-W399 HydrophobicContact CG2-CZ2 3.6Å; I397-W399 HydrophobicContact CG2-CZ3 4.27Å
398	I	91	Very high	86	Confident	42 Å²	42	80 Å²	80	22%	0.215	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-99.3	136.9	166.9	-60.3	176.3	0	0	0	106	G282 N372 Q374 E403	G282-I398 WeakPolarHBondContact CA-O 3.46Å; N372-I398 PolarHBondContact ND2-N 3.44Å; N372-I398 PolarHBondContact ND2-O 3.21Å; Q374-I398 HydrophobicContact CB-CD1 4.26Å; Q374-I398 HydrophobicContact CG-CB 4.33Å; Q374-I398 HydrophobicContact CG-CD1 4.04Å; Q374-I398 HydrophobicContact CG-CG1 4.36Å; I398-E403 WeakPolarHBondContact CA-O 3.42Å
399	W	91.4	Very high	85.8	Confident	5 Å²	5	74.5 Å²	74.5	2%	0.019	39%	0.391	C	S	.	.			trans	-105.4	163.6	179.7	-56.8	97.9	0	0	0	110.5	F155 W157 V263 I284 I397 G402 E403 E405 K406 P407	F155-W399 HydrophobicContact CD1-CH2 4.34Å; F155-W399 HydrophobicContact CD2-CH2 4.48Å; F155-W399 AromaticContact CE1-CH2 3.87Å; F155-W399 HydrophobicContact CE1-CH2 3.87Å; F155-W399 HydrophobicContact CE1-CZ2 4.02Å; F155-W399 HydrophobicContact CE2-CH2 4.01Å; F155-W399 AromaticContact CZ-CH2 3.67Å; F155-W399 HydrophobicContact CZ-CH2 3.67Å; F155-W399 HydrophobicContact CZ-CZ2 4.16Å; W157-W399 AromaticContact CH2-CH2 3.59Å; W157-W399 HydrophobicContact CH2-CH2 3.59Å; W157-W399 AromaticContact CH2-CZ3 3.57Å; W157-W399 HydrophobicContact CH2-CZ3 3.57Å; W157-W399 AromaticContact CZ2-CH2 3.61Å; W157-W399 HydrophobicContact CZ2-CH2 3.61Å; W157-W399 AromaticContact CZ2-CZ3 3.7Å; W157-W399 HydrophobicContact CZ2-CZ3 3.7Å; V263-W399 HydrophobicContact CG1-CE3 4.35Å; V263-W399 HydrophobicContact CG1-CZ3 3.95Å; V263-W399 HydrophobicContact CG2-CE3 4.04Å; V263-W399 HydrophobicContact CG2-CZ3 4.1Å; I284-W399 HydrophobicContact CD1-CE3 4.39Å; I284-W399 HydrophobicContact CD1-CH2 3.91Å; I284-W399 HydrophobicContact CD1-CZ3 3.56Å; I397-W399 HydrophobicContact CB-CZ2 4.27Å; I397-W399 HydrophobicContact CD1-CZ2 4.41Å; I397-W399 HydrophobicContact CG2-CD2 3.89Å; I397-W399 HydrophobicContact CG2-CE3 4.23Å; I397-W399 HydrophobicContact CG2-CH2 3.98Å; I397-W399 HydrophobicContact CG2-CZ2 3.6Å; I397-W399 HydrophobicContact CG2-CZ3 4.27Å; W399-G402 WeakPolarHBondContact O-CA 3.45Å; W399-G402 PolarHBondContact O-N 3.05Å; W399-E403 HydrophobicContact CB-CB 4.32Å; W399-E403 PolarHBondContact N-O 3.4Å; W399-E405 PolarHBondContact NE1-O 3.01Å; W399-K406 HydrophobicContact CH2-CG 4.21Å; W399-K406 HydrophobicContact CZ2-CB 4.04Å; W399-K406 HydrophobicContact CZ2-CG 3.77Å; W399-P407 HydrophobicContact CD2-CG 4.3Å; W399-P407 HydrophobicContact CE3-CG 4.28Å
400	P	90	Very high	85.5	Confident	1 Å²	1	78 Å²	78	1%	0.006	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-50	146.4	171.6	-30	39.7	0	0	0	112	G259 S260 Y262 G402	G259-P400 VanDerWaalsContact O-CB 3.3Å; G259-P400 WeakPolarHBondContact O-CB 3.14Å; S260-P400 WeakPolarHBondContact CA-O 3.46Å; Y262-P400 WeakPolarHBondContact O-CD 3.41Å; Y262-P400 VanDerWaalsContact O-CG 3.3Å; Y262-P400 WeakPolarHBondContact O-CG 3.18Å; P400-G402 PolarHBondContact O-N 2.96Å
401	G	85	Confident	85.2	Confident	56 Å²	56	80.6 Å²	80.6	58%	0.577	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	75.6	-6.2	-167.2	0	0	0	0	0	115.7
402	G	85.6	Confident	84.8	Confident	52 Å²	52	81.3 Å²	81.3	54%	0.536	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	88.9	11.3	177.9	0	0	0	0	0	114.7	W399 P400	W399-G402 WeakPolarHBondContact O-CA 3.45Å; W399-G402 PolarHBondContact O-N 3.05Å; P400-G402 PolarHBondContact O-N 2.96Å
403	E	87.1	Confident	84.5	Confident	78 Å²	78	80.7 Å²	80.7	36%	0.364	42%	0.417	S	S	.	.			trans	-69	153.1	179.3	-60.2	177.6	145.5	0	0	111.2	S260 G261 I398 W399	S260-E403 WeakPolarHBondContact CB-OE1 3.47Å; S260-E403 WeakPolarHBondContact CB-OE2 3.5Å; G261-E403 PolarHBondContact N-OE2 3.3Å; I398-E403 WeakPolarHBondContact CA-O 3.42Å; W399-E403 HydrophobicContact CB-CB 4.32Å; W399-E403 PolarHBondContact N-O 3.4Å
404	T	86.3	Confident	84.9	Confident	87 Å²	87	77.6 Å²	77.6	53%	0.534	40%	0.404	S	S	.	.			trans	-118.1	-8.4	174.4	62.8	0	0	0	0	113.6
405	E	86.7	Confident	85.5	Confident	167 Å²	167	75.9 Å²	75.9	78%	0.78	39%	0.39	S	S	*	.	S	Bend	trans	-86.3	146.9	168.9	-60.9	-167.9	173.5	0	0	109.8	W399 P407	W399-E405 PolarHBondContact NE1-O 3.01Å; E405-P407 WeakPolarHBondContact O-CD 3.3Å
406	K	86.1	Confident	85.9	Confident	95 Å²	95	70.5 Å²	70.5	41%	0.413	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-74.4	118.9	-176.7	-176.7	-151.4	70.1	173.2	0	110.2	F155 W157 W399	F155-K406 HydrophobicContact CB-CD 4.01Å; F155-K406 HydrophobicContact CD1-CD 3.6Å; F155-K406 HydrophobicContact CD1-CG 3.99Å; F155-K406 HydrophobicContact CE1-CD 4.48Å; F155-K406 HydrophobicContact CG-CD 4.19Å; F155-K406 PolarHBondContact O-NZ 3.47Å; W157-K406 HydrophobicContact CZ2-CG 4.29Å; W399-K406 HydrophobicContact CH2-CG 4.21Å; W399-K406 HydrophobicContact CZ2-CB 4.04Å; W399-K406 HydrophobicContact CZ2-CG 3.77Å
407	P	87.3	Confident	86.3	Confident	14 Å²	14	66 Å²	66	9%	0.091	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-64.5	151.4	176.4	28.1	-35.4	0	0	0	111.6	W157 V263 W399 E405 G409	W157-P407 PolarHBondContact NE1-O 3.28Å; V263-P407 HydrophobicContact CG2-CB 4.49Å; V263-P407 HydrophobicContact CG2-CG 3.38Å; W399-P407 HydrophobicContact CD2-CG 4.3Å; W399-P407 HydrophobicContact CE3-CG 4.28Å; E405-P407 WeakPolarHBondContact O-CD 3.3Å; P407-G409 PolarHBondContact O-N 3.12Å
408	Q	80.9	Confident	86.6	Confident	143 Å²	143	64.8 Å²	64.8	67%	0.668	34%	0.344	S	S	*	.			trans	-68.2	-19.9	-178.8	-62.2	-169.6	8	0	0	113.2	F410	Q408-F410 VanDerWaalsContact C-N 3.33Å; Q408-F410 HydrophobicContact CB-CD1 4.28Å; Q408-F410 HydrophobicContact CB-CE1 4.07Å; Q408-F410 PolarHBondContact O-N 2.93Å
409	G	81.3	Confident	86.9	Confident	4 Å²	4	62.8 Å²	62.8	4%	0.041	33%	0.334	C	S	.	.	S	Bend	trans	83.9	-0.3	173.5	0	0	0	0	0	115.6	R234 V235 P407	R234-G409 PolarHBondContact N-O 3.4Å; V235-G409 PolarHBondContact N-O 2.91Å; P407-G409 PolarHBondContact O-N 3.12Å
410	F	83.3	Confident	87.1	Confident	86 Å²	86	62.8 Å²	62.8	38%	0.377	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-140.1	156	170.6	70.3	-78	0	0	0	109.6	E232 Q408	E232-F410 CarbonylContact O-C 3.54Å; E232-F410 WeakPolarHBondContact O-CA 3.35Å; Q408-F410 VanDerWaalsContact C-N 3.33Å; Q408-F410 HydrophobicContact CB-CD1 4.28Å; Q408-F410 HydrophobicContact CB-CE1 4.07Å; Q408-F410 PolarHBondContact O-N 2.93Å
411	Q	83.4	Confident	87.2	Confident	120 Å²	120	63 Å²	63	56%	0.561	34%	0.336	S	S	*	.			trans	-134.6	100.1	173.3	176.8	58.2	68.6	0	0	108.4	E232 R234 S413	E232-Q411 PolarHBondContact O-N 3.13Å; R234-Q411 HydrophobicContact CG-CB 3.98Å; Q411-S413 PolarHBondContact O-N 3.29Å
412	M	77.6	Confident	87.5	Confident	52 Å²	52	65.1 Å²	65.1	26%	0.256	33%	0.33	S	S	.	.			trans	-60.1	128.5	176.3	-166.4	163.6	175.4	0	0	109.7	P783 W784	M412-P783 HydrophobicContact CE-CB 3.84Å; M412-P783 HydrophobicContact CE-CG 3.83Å; M412-P783 HydrophobicContact CG-CG 4.28Å; M412-P783 HydrophobicContact SD-CB 4.07Å; M412-P783 HydrophobicContact SD-CG 4.02Å; M412-W784 HydrophobicContact CE-CD2 3.42Å; M412-W784 VanDerWaalsContact CE-CD2 3.42Å; M412-W784 HydrophobicContact CE-CE3 3.82Å; M412-W784 HydrophobicContact CE-CG 3.93Å; M412-W784 HydrophobicContact CE-CH2 3.92Å; M412-W784 HydrophobicContact CE-CZ2 3.53Å; M412-W784 HydrophobicContact CE-CZ3 4.04Å; M412-W784 HydrophobicContact CG-CZ2 4.25Å
413	S	78.8	Confident	87.9	Confident	51 Å²	51	63.7 Å²	63.7	36%	0.357	31%	0.31	S	S	.	.			trans	-76.4	133.7	175.9	-176.9	0	0	0	0	110.3	Q411 R415 W784	Q411-S413 PolarHBondContact O-N 3.29Å; S413-R415 VanDerWaalsContact C-N 3.31Å; S413-R415 PolarHBondContact OG-N 3.32Å; S413-R415 VanDerWaalsContact OG-N 3.11Å; S413-R415 PolarHBondContact OG-O 3.2Å; S413-W784 WeakPolarHBondContact O-CZ2 3.44Å
414	T	85.1	Confident	88	Confident	96 Å²	96	62.5 Å²	62.5	59%	0.589	30%	0.304	S	S	*	.	S	Bend	trans	-85.7	-4.4	169.7	52.8	0	0	0	0	113	F488 T489	T414-F488 CarbonylContact O-C 3.52Å; T414-F488 WeakPolarHBondContact O-CA 3.27Å; T414-T489 PolarHBondContact O-N 3.46Å; T414-T489 PolarHBondContact O-OG1 3.23Å
415	R	90.5	Very high	88.3	Confident	141 Å²	141	58.3 Å²	58.3	53%	0.532	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	120.1	178.7	179.6	175.3	171	172.9	-2.6	109.1	S413 T489 E491	S413-R415 VanDerWaalsContact C-N 3.31Å; S413-R415 PolarHBondContact OG-N 3.32Å; S413-R415 VanDerWaalsContact OG-N 3.11Å; S413-R415 PolarHBondContact OG-O 3.2Å; R415-T489 WeakPolarHBondContact CA-O 3.26Å; R415-E491 IonicContact CZ-OE1 3.55Å; R415-E491 VanDerWaalsContact CZ-OE1 3.27Å; R415-E491 IonicContact CZ-OE2 3.14Å; R415-E491 IonicContact NE-OE1 3.31Å; R415-E491 PolarHBondContact NE-OE1 2.94Å; R415-E491 IonicContact NE-OE2 2.65Å; R415-E491 IonicContact NH2-OE1 3.6Å; R415-E491 PolarHBondContact NH2-OE1 3.01Å; R415-E491 IonicContact NH2-OE2 3.78Å; R415-E491 PolarHBondContact NH2-OE2 2.92Å
416	L	91.9	Very high	88.7	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.016	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	136.7	-174.3	-61.6	179.7	0	0	0	112.4	I418 F488 T489 Y490 E491 D527 M528 W784	L416-I418 HydrophobicContact CB-CD1 3.88Å; L416-F488 HydrophobicContact CD1-CB 4.49Å; L416-F488 HydrophobicContact CD1-CD2 3.8Å; L416-F488 HydrophobicContact CD1-CE2 4.18Å; L416-F488 HydrophobicContact CD1-CG 4.1Å; L416-F488 HydrophobicContact CG-CD2 4.31Å; L416-T489 PolarHBondContact N-O 3.43Å; L416-Y490 WeakPolarHBondContact O-CA 3.33Å; L416-E491 PolarHBondContact O-N 2.85Å; L416-D527 HydrophobicContact CD2-CB 4.19Å; L416-M528 HydrophobicContact CD1-CE 4.13Å; L416-W784 HydrophobicContact CD1-CD2 4.36Å; L416-W784 HydrophobicContact CD1-CG 4.5Å
417	K	93.7	Very high	89.2	Confident	66 Å²	66	45.9 Å²	45.9	29%	0.287	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	112.2	172	-59	173.1	-169.7	170.2	0	108.9	E230 L525 D527 M528	E230-K417 IonicContact OE2-NZ 3.97Å; E230-K417 PolarHBondContact OE2-NZ 3.38Å; K417-L525 WeakPolarHBondContact CD-O 3.43Å; K417-D527 PolarHBondContact N-OD2 2.99Å; K417-D527 PolarHBondContact O-N 3.03Å; K417-M528 PolarHBondContact O-N 2.73Å
418	I	96.6	Very high	89.4	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	114.3	-175.5	-49.2	-61.3	0	0	0	110	L416 L479 E491 V492 H493 M528 V530	L416-I418 HydrophobicContact CB-CD1 3.88Å; I418-L479 HydrophobicContact CD1-CD1 4.43Å; I418-L479 HydrophobicContact CG1-CD1 4.24Å; I418-L479 HydrophobicContact CG1-CD2 4.45Å; I418-L479 HydrophobicContact CG2-CD2 4.2Å; I418-E491 WeakPolarHBondContact CA-O 3.3Å; I418-E491 WeakPolarHBondContact CB-O 3.27Å; I418-E491 PolarHBondContact N-O 3.47Å; I418-V492 WeakPolarHBondContact O-CA 3.32Å; I418-H493 PolarHBondContact O-N 3.18Å; I418-M528 WeakPolarHBondContact CA-O 3.28Å; I418-M528 HydrophobicContact CD1-CB 3.8Å; I418-M528 HydrophobicContact CD1-CG 4.4Å; I418-M528 HydrophobicContact CD1-SD 4.23Å; I418-V530 HydrophobicContact CG2-CB 3.9Å; I418-V530 HydrophobicContact CG2-CG2 3.77Å
419	V	96.6	Very high	89.9	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	142	171.4	68.5	0	0	0	0	111.1	H493 V495 M517 E520 A526 M528 I529 V530	V419-H493 WeakPolarHBondContact CA-O 3.4Å; V419-V495 HydrophobicContact CG2-CB 4.01Å; V419-M517 HydrophobicContact CG1-CB 4.22Å; V419-M517 HydrophobicContact CG1-CG 4.31Å; V419-M517 HydrophobicContact CG2-CG 3.99Å; V419-E520 WeakPolarHBondContact CG2-OE2 3.49Å; V419-A526 HydrophobicContact CB-CB 3.75Å; V419-A526 HydrophobicContact CG1-CB 3.59Å; V419-M528 PolarHBondContact N-O 2.71Å; V419-M528 VanDerWaalsContact N-O 3.11Å; V419-I529 HydrophobicContact CG1-CB 4.22Å; V419-I529 HydrophobicContact CG1-CG1 3.6Å; V419-I529 HydrophobicContact CG1-CG2 4.38Å; V419-V530 PolarHBondContact O-N 3.03Å; V419-V530 VanDerWaalsContact O-N 3.16Å
420	T	95.6	Very high	90.3	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	179.9	172	-158.8	0	0	0	0	112.1	V427 V492 H493 L494 V495 V530	T420-V427 HydrophobicContact CG2-CG1 4.21Å; T420-V492 HydrophobicContact CG2-CG1 3.86Å; T420-H493 PolarHBondContact N-O 3.25Å; T420-L494 HydrophobicContact CG2-CD2 3.82Å; T420-L494 WeakPolarHBondContact O-CA 3.36Å; T420-V495 PolarHBondContact O-N 3.4Å; T420-V530 WeakPolarHBondContact CB-O 3.47Å; T420-V530 PolarHBondContact OG1-O 2.71Å
421	I	92.8	Very high	90.6	Very high	7 Å²	7	45.9 Å²	45.9	4%	0.036	23%	0.229	C	C	.	.			trans	-135.7	145	-177.1	-169.9	169.9	0	0	0	109.3	Q423 V427 V495 G498 F500 M517 A531	I421-Q423 HydrophobicContact CG2-CB 4.45Å; I421-Q423 PolarHBondContact O-N 2.66Å; I421-V427 VanDerWaalsContact O-CB 3.31Å; I421-V427 WeakPolarHBondContact O-CB 3.38Å; I421-V495 HydrophobicContact CB-CG1 4.07Å; I421-V495 HydrophobicContact CD1-CG1 4.28Å; I421-V495 HydrophobicContact CG1-CG1 3.93Å; I421-G498 WeakPolarHBondContact CD1-O 3.49Å; I421-F500 HydrophobicContact CD1-CD1 4.31Å; I421-F500 HydrophobicContact CD1-CD2 3.91Å; I421-F500 HydrophobicContact CD1-CE1 4.33Å; I421-F500 HydrophobicContact CD1-CE2 3.92Å; I421-F500 HydrophobicContact CD1-CG 4.1Å; I421-F500 HydrophobicContact CD1-CZ 4.14Å; I421-F500 HydrophobicContact CG2-CD1 4.4Å; I421-F500 HydrophobicContact CG2-CE1 3.93Å; I421-F500 HydrophobicContact CG2-CZ 4.27Å; I421-M517 HydrophobicContact CB-CE 3.8Å; I421-M517 HydrophobicContact CB-SD 3.84Å; I421-M517 HydrophobicContact CD1-CE 4.27Å; I421-M517 HydrophobicContact CG2-CE 3.54Å; I421-M517 HydrophobicContact CG2-SD 4.01Å; I421-A531 HydrophobicContact CG2-CB 4Å
422	H	91.3	Very high	90.9	Very high	99 Å²	99	41.9 Å²	41.9	46%	0.458	21%	0.213	S	C	.	.			trans	-68.5	116.1	170.1	176.9	36.2	0	0	0	109.8	E424 V427 V429	H422-E424 IonicContact CE1-OE1 3.1Å; H422-V427 PolarHBondContact ND1-O 3.21Å; H422-V429 HydrophobicContact CB-CG2 3.84Å
423	Q	92	Very high	91.3	Very high	23 Å²	23	43.4 Å²	43.4	11%	0.107	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-156.9	102.7	176.3	177.4	60	82.3	0	0	108.5	I421 F426 V427 F500 P532 V751	I421-Q423 HydrophobicContact CG2-CB 4.45Å; I421-Q423 PolarHBondContact O-N 2.66Å; Q423-F426 WeakPolarHBondContact O-CA 3.35Å; Q423-F426 WeakPolarHBondContact O-CB 3.42Å; Q423-F426 PolarHBondContact O-N 3.39Å; Q423-V427 CarbonylContact C-O 3.5Å; Q423-V427 PolarHBondContact N-O 3.06Å; Q423-V427 VanDerWaalsContact N-O 3.12Å; Q423-V427 PolarHBondContact O-N 3.36Å; Q423-F500 HydrophobicContact CG-CZ 4.43Å; Q423-P532 HydrophobicContact CB-CG 4Å; Q423-P532 HydrophobicContact CG-CG 3.76Å; Q423-V751 HydrophobicContact CG-CG2 4.25Å
424	E	91.1	Very high	91.5	Very high	52 Å²	52	50.6 Å²	50.6	24%	0.243	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	144.7	172.4	-51.7	-163.9	169.3	0	0	109.7	H422 Y428 F754	H422-E424 IonicContact CE1-OE1 3.1Å; E424-Y428 HydrophobicContact CB-CD1 4.44Å; E424-Y428 HydrophobicContact CB-CE1 3.93Å; E424-Y428 HydrophobicContact CG-CD1 3.7Å; E424-Y428 HydrophobicContact CG-CE1 3.62Å; E424-Y428 HydrophobicContact CG-CG 4.5Å; E424-Y428 VanDerWaalsContact OE1-CD1 3.23Å; E424-Y428 WeakPolarHBondContact OE1-CD1 3.11Å; E424-Y428 WeakPolarHBondContact OE2-CE1 3.4Å; E424-F754 HydrophobicContact CB-CE1 4.46Å
425	P	92	Very high	91.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	cis	-85.1	3.7	-2.7	35.7	-37.2	0	0	0	114.8	Y428 F754 W808 V809	P425-Y428 HydrophobicContact CB-CE2 4.44Å; P425-Y428 VanDerWaalsContact O-CE2 3.26Å; P425-Y428 WeakPolarHBondContact O-CE2 3.45Å; P425-F754 HydrophobicContact CB-CD1 3.92Å; P425-F754 HydrophobicContact CB-CD2 3.8Å; P425-F754 HydrophobicContact CB-CE1 3.98Å; P425-F754 HydrophobicContact CB-CE2 3.87Å; P425-F754 HydrophobicContact CB-CG 3.83Å; P425-F754 HydrophobicContact CB-CZ 3.96Å; P425-F754 HydrophobicContact CG-CB 3.99Å; P425-F754 HydrophobicContact CG-CD1 4.05Å; P425-F754 HydrophobicContact CG-CD2 4.07Å; P425-F754 HydrophobicContact CG-CG 3.76Å; P425-W808 WeakPolarHBondContact CB-O 3.42Å; P425-V809 HydrophobicContact CG-CG2 4.03Å
426	F	95.1	Very high	90.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-39.1	-170.8	-69	-81.1	0	0	0	114.2	Q423 G473 F474 C475 P532 F549 A750 V751 F774	Q423-F426 WeakPolarHBondContact O-CA 3.35Å; Q423-F426 WeakPolarHBondContact O-CB 3.42Å; Q423-F426 PolarHBondContact O-N 3.39Å; F426-G473 CarbonylContact O-C 3.52Å; F426-F474 HydrophobicContact CD1-CB 4.02Å; F426-F474 AromaticContact CD1-CD1 3.92Å; F426-F474 HydrophobicContact CD1-CD1 3.92Å; F426-F474 HydrophobicContact CD1-CG 4Å; F426-F474 HydrophobicContact CE1-CD1 4.13Å; F426-F474 HydrophobicContact CE1-CE1 4.47Å; F426-F474 HydrophobicContact CE1-CG 4.22Å; F426-F474 PolarHBondContact O-N 2.89Å; F426-C475 PolarHBondContact O-N 3.02Å; F426-C475 VanDerWaalsContact O-N 3.09Å; F426-P532 HydrophobicContact CB-CB 4.37Å; F426-P532 HydrophobicContact CB-CG 3.92Å; F426-P532 HydrophobicContact CD1-CB 4.36Å; F426-P532 HydrophobicContact CD2-CB 3.79Å; F426-P532 HydrophobicContact CD2-CG 3.93Å; F426-P532 HydrophobicContact CE2-CB 4.17Å; F426-P532 HydrophobicContact CG-CB 3.9Å; F426-P532 HydrophobicContact CG-CG 3.97Å; F426-F549 HydrophobicContact CE1-CE2 4.32Å; F426-A750 HydrophobicContact CE2-CB 4.03Å; F426-A750 HydrophobicContact CZ-CB 3.8Å; F426-V751 HydrophobicContact CE2-CG2 4.27Å; F426-F774 HydrophobicContact CE1-CD2 4.29Å; F426-F774 HydrophobicContact CE1-CE2 4.4Å; F426-F774 HydrophobicContact CE2-CD2 4.49Å; F426-F774 AromaticContact CE2-CE2 3.84Å; F426-F774 HydrophobicContact CE2-CE2 3.84Å; F426-F774 AromaticContact CZ-CD2 3.97Å; F426-F774 HydrophobicContact CZ-CD2 3.97Å; F426-F774 AromaticContact CZ-CE2 3.65Å; F426-F774 HydrophobicContact CZ-CE2 3.65Å
427	V	95.6	Very high	90.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-144.4	104.5	-179.9	-177.5	0	0	0	0	110	T420 I421 H422 Q423 V429 Y472 C475	T420-V427 HydrophobicContact CG2-CG1 4.21Å; I421-V427 VanDerWaalsContact O-CB 3.31Å; I421-V427 WeakPolarHBondContact O-CB 3.38Å; H422-V427 PolarHBondContact ND1-O 3.21Å; Q423-V427 CarbonylContact C-O 3.5Å; Q423-V427 PolarHBondContact N-O 3.06Å; Q423-V427 VanDerWaalsContact N-O 3.12Å; Q423-V427 PolarHBondContact O-N 3.36Å; V427-V429 HydrophobicContact CG1-CG2 4.49Å; V427-Y472 WeakPolarHBondContact CA-O 3.33Å; V427-C475 HydrophobicContact CG2-CB 3.83Å
428	Y	92.6	Very high	90.5	Very high	28 Å²	28	48.9 Å²	48.9	11%	0.11	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	146.1	166.9	-62.6	-88.9	0	0	0	110.1	E424 P425 C471 Y472 F754 W808	E424-Y428 HydrophobicContact CB-CD1 4.44Å; E424-Y428 HydrophobicContact CB-CE1 3.93Å; E424-Y428 HydrophobicContact CG-CD1 3.7Å; E424-Y428 HydrophobicContact CG-CE1 3.62Å; E424-Y428 HydrophobicContact CG-CG 4.5Å; E424-Y428 VanDerWaalsContact OE1-CD1 3.23Å; E424-Y428 WeakPolarHBondContact OE1-CD1 3.11Å; E424-Y428 WeakPolarHBondContact OE2-CE1 3.4Å; P425-Y428 HydrophobicContact CB-CE2 4.44Å; P425-Y428 VanDerWaalsContact O-CE2 3.26Å; P425-Y428 WeakPolarHBondContact O-CE2 3.45Å; Y428-C471 WeakPolarHBondContact O-CA 3.47Å; Y428-Y472 VanDerWaalsContact CB-CE2 3.48Å; Y428-Y472 HydrophobicContact CD1-CE2 4.45Å; Y428-Y472 AromaticContact CD2-CD2 3.94Å; Y428-Y472 HydrophobicContact CD2-CD2 3.94Å; Y428-Y472 AromaticContact CD2-CE2 3.75Å; Y428-Y472 HydrophobicContact CD2-CE2 3.75Å; Y428-Y472 HydrophobicContact CG-CD2 4.15Å; Y428-Y472 AromaticContact CG-CE2 3.64Å; Y428-Y472 HydrophobicContact CG-CE2 3.64Å; Y428-Y472 PolarHBondContact N-O 2.77Å; Y428-Y472 PolarHBondContact O-N 2.98Å; Y428-Y472 VanDerWaalsContact O-N 3.13Å; Y428-F754 WeakPolarHBondContact OH-CZ 3.24Å; Y428-W808 HydrophobicContact CD2-CE3 4.44Å; Y428-W808 HydrophobicContact CD2-CZ3 4.03Å; Y428-W808 AromaticContact CE2-CE3 3.8Å; Y428-W808 HydrophobicContact CE2-CE3 3.8Å; Y428-W808 AromaticContact CE2-CZ3 3.74Å; Y428-W808 HydrophobicContact CE2-CZ3 3.74Å
429	V	91.4	Very high	90.1	Very high	27 Å²	27	52 Å²	52	16%	0.164	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.8	175.1	-178.6	0	0	0	0	108.8	H422 V427 Q469 L494	H422-V429 HydrophobicContact CB-CG2 3.84Å; V427-V429 HydrophobicContact CG1-CG2 4.49Å; V429-Q469 HydrophobicContact CG1-CB 4.15Å; V429-L494 HydrophobicContact CG1-CD1 3.99Å; V429-L494 HydrophobicContact CG2-CD1 3.82Å; V429-L494 HydrophobicContact CG2-CD2 4.07Å
430	K	90.1	Very high	89.5	Confident	91 Å²	91	60.2 Å²	60.2	40%	0.396	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	152.8	172.3	-60.8	-63.8	169.8	-145.3	0	109.9	C470 Y472	K430-C470 PolarHBondContact N-O 3.31Å; K430-C470 PolarHBondContact O-N 3.24Å; K430-Y472 WeakPolarHBondContact CE-OH 3.34Å; K430-Y472 HydrophobicContact CG-CE1 3.75Å
431	P	88.8	Confident	88.9	Confident	101 Å²	101	63.2 Å²	63.2	66%	0.656	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	155.9	170	28.8	-35.7	0	0	0	111.1
432	T	89.3	Confident	88.3	Confident	37 Å²	37	70 Å²	70	23%	0.227	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-69.8	163.8	168.8	59	0	0	0	0	111.3	T437 P468	T432-T437 WeakPolarHBondContact CA-O 3.35Å; T432-T437 WeakPolarHBondContact CB-O 3.49Å; T432-P468 HydrophobicContact CG2-CB 4.34Å
433	M	87.4	Confident	87.4	Confident	83 Å²	83	66.5 Å²	66.5	41%	0.409	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-62.5	169	159.1	-68.3	-163.2	169.2	0	0	111.2	D435 G436 T437 N439	M433-D435 PolarHBondContact O-N 3.37Å; M433-G436 PolarHBondContact O-N 3.02Å; M433-T437 PolarHBondContact N-O 3.27Å; M433-N439 HydrophobicContact CE-CB 4.2Å; M433-N439 WeakPolarHBondContact CE-OD1 3.39Å; M433-N439 VanDerWaalsContact CG-OD1 3.27Å; M433-N439 WeakPolarHBondContact CG-OD1 3.4Å
434	Q	81.4	Confident	86.3	Confident	203 Å²	203	72.1 Å²	72.1	95%	0.949	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.8	173.7	-64.6	-177.5	1.6	0	0	112.1	G436	Q434-G436 PolarHBondContact O-N 3.41Å
435	D	82.6	Confident	85.3	Confident	137 Å²	137	74.1 Å²	74.1	73%	0.733	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	4.4	176.2	-51	-44.5	0	0	0	113.7	M433 T437	M433-D435 PolarHBondContact O-N 3.37Å; D435-T437 PolarHBondContact O-N 3.12Å
436	G	81.7	Confident	84.3	Confident	32 Å²	32	76.3 Å²	76.3	33%	0.33	41%	0.413	S	S	.	.	S	Bend	trans	76	1.4	-177.9	0	0	0	0	0	115.3	M433 Q434	M433-G436 PolarHBondContact O-N 3.02Å; Q434-G436 PolarHBondContact O-N 3.41Å
437	T	88.3	Confident	83.5	Confident	70 Å²	70	80.5 Å²	80.5	43%	0.429	44%	0.438	S	S	.	.			trans	-91.3	174.4	-179.7	56.2	0	0	0	0	112.6	T432 M433 D435	T432-T437 WeakPolarHBondContact CA-O 3.35Å; T432-T437 WeakPolarHBondContact CB-O 3.49Å; M433-T437 PolarHBondContact N-O 3.27Å; D435-T437 PolarHBondContact O-N 3.12Å
438	C	88.6	Confident	82.9	Confident	30 Å²	30	84.7 Å²	84.7	20%	0.203	46%	0.46	C	S	.	.			trans	-111.9	138.3	-180	-62.5	0	0	0	0	111.9	E440 K451 C470	C438-E440 PolarHBondContact O-N 3.26Å; C438-K451 HydrophobicContact CB-CB 4.08Å; C438-K451 HydrophobicContact CB-CD 4.11Å; C438-C470 WeakPolarHBondContact CA-SG 3.48Å; C438-C470 HydrophobicContact CB-CB 3.86Å; C438-C470 WeakPolarHBondContact CB-SG 3.4Å; C438-C470 WeakPolarHBondContact SG-CB 3.42Å; C438-C470 CovalentContact SG-SG 2.03Å; C438-C470 PolarHBondContact SG-SG 3.22Å
439	N	87.2	Confident	82.7	Confident	68 Å²	68	84.7 Å²	84.7	36%	0.364	46%	0.461	S	S	.	.			trans	-58.1	123.7	178.2	-58.3	20	0	0	0	111.9	M433 E441 K451	M433-N439 HydrophobicContact CE-CB 4.2Å; M433-N439 WeakPolarHBondContact CE-OD1 3.39Å; M433-N439 VanDerWaalsContact CG-OD1 3.27Å; M433-N439 WeakPolarHBondContact CG-OD1 3.4Å; N439-E441 PolarHBondContact O-N 2.75Å; N439-K451 WeakPolarHBondContact O-CD 3.39Å; N439-K451 WeakPolarHBondContact O-CE 3.49Å; N439-K451 PolarHBondContact O-NZ 3.18Å
440	E	83.7	Confident	82.7	Confident	171 Å²	171	87.7 Å²	87.7	80%	0.799	47%	0.472	S	S	*	.			trans	-68.4	120.4	167.5	-67.6	-169.5	-179.1	0	0	110.2	C438	C438-E440 PolarHBondContact O-N 3.26Å
441	E	84.4	Confident	82.8	Confident	68 Å²	68	85.4 Å²	85.4	32%	0.318	46%	0.462	S	S	.	.			trans	-129.2	150.8	177.4	-79.3	154.1	-145.2	0	0	109	N439 I449 K451	N439-E441 PolarHBondContact O-N 2.75Å; E441-I449 HydrophobicContact CB-CD1 4.17Å; E441-I449 PolarHBondContact O-N 2.96Å; E441-K451 IonicContact OE1-NZ 2.61Å; E441-K451 PolarHBondContact OE1-NZ 2.86Å; E441-K451 IonicContact OE2-NZ 3.88Å; E441-K451 PolarHBondContact OE2-NZ 3.28Å
442	K	80.1	Confident	83	Confident	149 Å²	149	81.3 Å²	81.3	65%	0.648	44%	0.435	S	S	*	.	B	Isolated β-bridge	trans	-116	137.5	178	-64.7	-179	-178.4	-179.1	0	109.8	V447 I448	K442-V447 VanDerWaalsContact CA-O 3.31Å; K442-V447 WeakPolarHBondContact CA-O 3.43Å; K442-I448 HydrophobicContact CG-CG1 4.2Å
443	A	73.1	Confident	83.2	Confident	26 Å²	26	84.3 Å²	84.3	22%	0.215	45%	0.449	C	S	.	.			trans	-73.8	168.6	170.9	0	0	0	0	0	110.8	N445 G446 V447 I449	A443-N445 WeakPolarHBondContact CB-OD1 3.19Å; A443-N445 PolarHBondContact O-N 3.48Å; A443-G446 PolarHBondContact O-N 3.43Å; A443-V447 PolarHBondContact N-O 2.8Å; A443-I449 HydrophobicContact CB-CD1 4.46Å; A443-I449 HydrophobicContact CB-CG1 4.23Å
444	L	68.6	Low	83.5	Confident	141 Å²	141	80.4 Å²	80.4	74%	0.738	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-26.8	-179.5	-92.7	175.3	0	0	0	114.2	G446 Y811	L444-G446 PolarHBondContact O-N 2.89Å; L444-Y811 HydrophobicContact CD1-CE1 4.11Å; L444-Y811 HydrophobicContact CD1-CE2 4.01Å; L444-Y811 VanDerWaalsContact CD1-OH 3.32Å; L444-Y811 WeakPolarHBondContact CD1-OH 3.22Å; L444-Y811 HydrophobicContact CG-CE2 4.38Å; L444-Y811 WeakPolarHBondContact CG-OH 3.15Å
445	N	69.6	Low	84	Confident	94 Å²	94	73.9 Å²	73.9	50%	0.503	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	3.1	175.9	62.3	10.2	0	0	0	113.9	A443 V447	A443-N445 WeakPolarHBondContact CB-OD1 3.19Å; A443-N445 PolarHBondContact O-N 3.48Å; N445-V447 VanDerWaalsContact C-N 3.26Å; N445-V447 PolarHBondContact O-N 3.04Å; N445-V447 VanDerWaalsContact OD1-CB 3.29Å; N445-V447 WeakPolarHBondContact OD1-CB 3.47Å; N445-V447 WeakPolarHBondContact OD1-CG2 3.47Å; N445-V447 PolarHBondContact OD1-N 2.91Å
446	G	71.6	Confident	84.2	Confident	47 Å²	47	67.4 Å²	67.4	49%	0.485	37%	0.37	S	S	.	.	S	Bend	trans	80.4	-4.9	-179	0	0	0	0	0	115.3	A443 L444	A443-G446 PolarHBondContact O-N 3.43Å; L444-G446 PolarHBondContact O-N 2.89Å
447	V	78.1	Confident	84.2	Confident	87 Å²	87	67.3 Å²	67.3	53%	0.527	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-73.9	138.8	178.9	-177.2	0	0	0	0	110.1	K442 A443 N445 I449	K442-V447 VanDerWaalsContact CA-O 3.31Å; K442-V447 WeakPolarHBondContact CA-O 3.43Å; A443-V447 PolarHBondContact N-O 2.8Å; N445-V447 VanDerWaalsContact C-N 3.26Å; N445-V447 PolarHBondContact O-N 3.04Å; N445-V447 VanDerWaalsContact OD1-CB 3.29Å; N445-V447 WeakPolarHBondContact OD1-CB 3.47Å; N445-V447 WeakPolarHBondContact OD1-CG2 3.47Å; N445-V447 PolarHBondContact OD1-N 2.91Å; V447-I449 PolarHBondContact O-N 3.13Å
448	I	83.3	Confident	83.6	Confident	89 Å²	89	65.6 Å²	65.6	46%	0.456	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-70.8	126.2	175.4	-59	172.3	0	0	0	109	K442 K450	K442-I448 HydrophobicContact CG-CG1 4.2Å; I448-K450 PolarHBondContact O-N 2.91Å
449	I	88.1	Confident	82.7	Confident	28 Å²	28	71.2 Å²	71.2	14%	0.144	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-68.9	120.2	176.1	-65.5	172.8	0	0	0	108.4	E441 A443 V447 K451 Y472 W808	E441-I449 HydrophobicContact CB-CD1 4.17Å; E441-I449 PolarHBondContact O-N 2.96Å; A443-I449 HydrophobicContact CB-CD1 4.46Å; A443-I449 HydrophobicContact CB-CG1 4.23Å; V447-I449 PolarHBondContact O-N 3.13Å; I449-K451 HydrophobicContact CG2-CG 4.26Å; I449-Y472 HydrophobicContact CG2-CD2 3.85Å; I449-Y472 HydrophobicContact CG2-CG 4.14Å; I449-W808 HydrophobicContact CD1-CH2 4.46Å; I449-W808 HydrophobicContact CG1-CH2 4.45Å; I449-W808 HydrophobicContact CG2-CH2 3.8Å; I449-W808 HydrophobicContact CG2-CZ2 4.25Å
450	K	91.1	Very high	81.9	Confident	89 Å²	89	73.6 Å²	73.6	39%	0.387	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-73.7	131.3	176.1	-54.3	-173	-152.8	109	0	109.6	I448 Y472 D477 I480	I448-K450 PolarHBondContact O-N 2.91Å; K450-Y472 WeakPolarHBondContact O-CB 3.3Å; K450-D477 IonicContact NZ-OD1 2.66Å; K450-D477 PolarHBondContact NZ-OD1 3.11Å; K450-I480 HydrophobicContact CB-CD1 3.64Å; K450-I480 HydrophobicContact CD-CD1 3.83Å; K450-I480 HydrophobicContact CD-CG2 4.12Å; K450-I480 HydrophobicContact CG-CD1 4.39Å
451	K	92.5	Very high	81.2	Confident	43 Å²	43	69 Å²	69	19%	0.187	37%	0.372	C	S	.	.			trans	-126.1	144.9	179	-51.3	-165.7	170.9	173.3	0	109.6	C438 N439 E441 I449 Y472	C438-K451 HydrophobicContact CB-CB 4.08Å; C438-K451 HydrophobicContact CB-CD 4.11Å; N439-K451 WeakPolarHBondContact O-CD 3.39Å; N439-K451 WeakPolarHBondContact O-CE 3.49Å; N439-K451 PolarHBondContact O-NZ 3.18Å; E441-K451 IonicContact OE1-NZ 2.61Å; E441-K451 PolarHBondContact OE1-NZ 2.86Å; E441-K451 IonicContact OE2-NZ 3.88Å; E441-K451 PolarHBondContact OE2-NZ 3.28Å; I449-K451 HydrophobicContact CG2-CG 4.26Å; K451-Y472 HydrophobicContact CD-CD1 3.85Å; K451-Y472 HydrophobicContact CD-CE1 4.38Å; K451-Y472 HydrophobicContact CD-CG 4.37Å; K451-Y472 HydrophobicContact CG-CD1 4.11Å; K451-Y472 HydrophobicContact CG-CG 4.21Å
452	V	93.4	Very high	79.6	Confident	15 Å²	15	71.8 Å²	71.8	9%	0.091	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	146.4	174.8	-59	0	0	0	0	109.3	C454 C471 V476 I480 Y490 V492	V452-C454 PolarHBondContact O-N 3.42Å; V452-C471 HydrophobicContact CG2-CB 4.04Å; V452-C471 PolarHBondContact N-O 3.1Å; V452-C471 PolarHBondContact O-N 3.1Å; V452-V476 HydrophobicContact CB-CG1 4.33Å; V452-V476 HydrophobicContact CG1-CG1 3.72Å; V452-V476 HydrophobicContact CG2-CG1 3.73Å; V452-V476 HydrophobicContact CG2-CG2 4.45Å; V452-I480 HydrophobicContact CG1-CD1 4.18Å; V452-I480 HydrophobicContact CG1-CG1 4.47Å; V452-Y490 HydrophobicContact CG1-CE2 4.14Å; V452-V492 HydrophobicContact CG2-CB 4.43Å; V452-V492 HydrophobicContact CG2-CG2 4.02Å
453	I	93.1	Very high	78.9	Confident	101 Å²	101	68.4 Å²	68.4	52%	0.518	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	128.2	168.8	-59.3	174.8	0	0	0	107.2	P468 Q469	I453-P468 HydrophobicContact CG2-CB 4.09Å; I453-Q469 WeakPolarHBondContact CA-O 3.39Å
454	C	93.1	Very high	78.8	Confident	1 Å²	1	73 Å²	73	1%	0.007	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.8	174.9	55.8	0	0	0	0	109.7	V452 Q469 C471 V492	V452-C454 PolarHBondContact O-N 3.42Å; C454-Q469 PolarHBondContact N-O 2.72Å; C454-Q469 PolarHBondContact O-N 3.14Å; C454-C471 HydrophobicContact CB-CB 3.79Å; C454-C471 WeakPolarHBondContact CB-SG 3.32Å; C454-C471 WeakPolarHBondContact SG-CB 3.32Å; C454-C471 PolarHBondContact SG-N 3.08Å; C454-C471 VanDerWaalsContact SG-N 3.38Å; C454-C471 CovalentContact SG-SG 2.04Å; C454-C471 PolarHBondContact SG-SG 3.49Å; C454-V492 WeakPolarHBondContact CA-O 3.29Å; C454-V492 HydrophobicContact CB-CB 4.05Å; C454-V492 HydrophobicContact CB-CG1 3.9Å
455	T	91.8	Very high	79.2	Confident	66 Å²	66	68.8 Å²	68.8	41%	0.405	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	137.5	172.3	50	0	0	0	0	110	V467 V492 H493 L494	T455-V467 WeakPolarHBondContact CA-O 3.36Å; T455-V492 PolarHBondContact N-O 3Å; T455-V492 VanDerWaalsContact N-O 3.14Å; T455-H493 CarbonylContact O-C 3.52Å; T455-H493 WeakPolarHBondContact O-CA 3.14Å; T455-H493 WeakPolarHBondContact O-CB 3.44Å; T455-H493 WeakPolarHBondContact OG1-CB 3.26Å; T455-L494 PolarHBondContact O-N 2.82Å
456	G	86.1	Confident	79.8	Confident	1 Å²	1	70.6 Å²	70.6	1%	0.01	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	157.9	-177	0	0	0	0	0	114.4	N458 I466 V467	G456-N458 PolarHBondContact O-N 2.93Å; G456-I466 WeakPolarHBondContact O-CA 3.34Å; G456-V467 PolarHBondContact N-O 3.3Å; G456-V467 PolarHBondContact O-N 3.38Å
457	P	83	Confident	80.6	Confident	29 Å²	29	70.2 Å²	70.2	19%	0.188	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	127.5	174.4	28.7	-34.1	0	0	0	110	R464	P457-R464 HydrophobicContact CB-CB 4.17Å
458	N	76.2	Confident	81.2	Confident	35 Å²	35	69.4 Å²	69.4	19%	0.187	39%	0.389	C	S	.	.			trans	-87.5	113.7	172.4	-171.5	5.1	0	0	0	111.6	G456 T460 I461 P465 V467	G456-N458 PolarHBondContact O-N 2.93Å; N458-T460 VanDerWaalsContact C-N 3.25Å; N458-T460 PolarHBondContact ND2-OG1 2.91Å; N458-T460 PolarHBondContact O-N 3.47Å; N458-T460 PolarHBondContact OD1-N 2.9Å; N458-T460 PolarHBondContact OD1-OG1 2.81Å; N458-T460 VanDerWaalsContact OD1-OG1 3.05Å; N458-I461 HydrophobicContact CB-CD1 4.25Å; N458-I461 HydrophobicContact CB-CG1 4.47Å; N458-I461 VanDerWaalsContact ND2-CD1 3.33Å; N458-I461 WeakPolarHBondContact ND2-CD1 3.41Å; N458-I461 WeakPolarHBondContact ND2-CG1 3.46Å; N458-I461 PolarHBondContact O-N 3.18Å; N458-P465 PolarHBondContact N-O 2.95Å; N458-V467 HydrophobicContact CB-CG2 3.81Å
459	E	68.8	Low	81.6	Confident	147 Å²	147	66.1 Å²	66.1	69%	0.687	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-21.1	177.4	-58	-156.8	119.9	0	0	113.9	I461 R464	E459-I461 VanDerWaalsContact C-N 3.26Å; E459-I461 PolarHBondContact O-N 2.6Å; E459-R464 IonicContact OE1-CZ 2.82Å; E459-R464 IonicContact OE1-NH2 2.72Å; E459-R464 PolarHBondContact OE1-NH2 3.37Å; E459-R464 VanDerWaalsContact OE1-NH2 3.1Å
460	T	69.8	Low	81.8	Confident	119 Å²	119	64.9 Å²	64.9	73%	0.73	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.6	179.5	71.9	0	0	0	0	113.9	N458	N458-T460 VanDerWaalsContact C-N 3.25Å; N458-T460 PolarHBondContact ND2-OG1 2.91Å; N458-T460 PolarHBondContact O-N 3.47Å; N458-T460 PolarHBondContact OD1-N 2.9Å; N458-T460 PolarHBondContact OD1-OG1 2.81Å; N458-T460 VanDerWaalsContact OD1-OG1 3.05Å
461	I	69	Low	82	Confident	73 Å²	73	60.6 Å²	60.6	37%	0.374	35%	0.347	S	S	.	.	S	Bend	trans	-114.9	124.8	-177.4	-57.8	172.3	0	0	0	109.9	N458 E459 G463 R464 P465	N458-I461 HydrophobicContact CB-CD1 4.25Å; N458-I461 HydrophobicContact CB-CG1 4.47Å; N458-I461 VanDerWaalsContact ND2-CD1 3.33Å; N458-I461 WeakPolarHBondContact ND2-CD1 3.41Å; N458-I461 WeakPolarHBondContact ND2-CG1 3.46Å; N458-I461 PolarHBondContact O-N 3.18Å; E459-I461 VanDerWaalsContact C-N 3.26Å; E459-I461 PolarHBondContact O-N 2.6Å; I461-G463 PolarHBondContact O-N 2.96Å; I461-R464 PolarHBondContact O-N 3.12Å; I461-P465 HydrophobicContact CB-CG 3.94Å; I461-P465 HydrophobicContact CD1-CG 4.08Å; I461-P465 HydrophobicContact CG2-CG 3.73Å
462	P	51.7	Low	82.1	Confident	127 Å²	127	59.5 Å²	59.5	83%	0.825	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	128.1	173.3	-26.8	35.3	0	0	0	111.8
463	G	64.1	Low	82.1	Confident	79 Å²	79	58.8 Å²	58.8	81%	0.814	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.6	-0.5	-176.2	0	0	0	0	0	115.6	I461	I461-G463 PolarHBondContact O-N 2.96Å
464	R	72.1	Confident	82.2	Confident	123 Å²	123	54 Å²	54	46%	0.464	31%	0.313	S	S	.	.			trans	48.4	52.5	174.8	-65.8	-177.3	168.5	-161.9	-9.8	114.2	P457 E459 I461	P457-R464 HydrophobicContact CB-CB 4.17Å; E459-R464 IonicContact OE1-CZ 2.82Å; E459-R464 IonicContact OE1-NH2 2.72Å; E459-R464 PolarHBondContact OE1-NH2 3.37Å; E459-R464 VanDerWaalsContact OE1-NH2 3.1Å; I461-R464 PolarHBondContact O-N 3.12Å
465	P	77.3	Confident	82.4	Confident	51 Å²	51	54 Å²	54	33%	0.331	31%	0.314	S	S	.	.			trans	-59.8	143.5	176.9	28.2	-35.5	0	0	0	111.1	N458 I461 V467	N458-P465 PolarHBondContact N-O 2.95Å; I461-P465 HydrophobicContact CB-CG 3.94Å; I461-P465 HydrophobicContact CD1-CG 4.08Å; I461-P465 HydrophobicContact CG2-CG 3.73Å; P465-V467 HydrophobicContact CB-CG1 4.48Å; P465-V467 HydrophobicContact CG-CG1 4.44Å; P465-V467 PolarHBondContact O-N 2.91Å
466	I	82.8	Confident	82.6	Confident	133 Å²	133	51.2 Å²	51.2	68%	0.682	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	120.2	172.7	-58.5	172.9	0	0	0	108	G456	G456-I466 WeakPolarHBondContact O-CA 3.34Å
467	V	87.9	Confident	83	Confident	38 Å²	38	52 Å²	52	23%	0.23	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	154.5	-179.5	-59	0	0	0	0	110.7	T455 G456 N458 P465 Q469	T455-V467 WeakPolarHBondContact CA-O 3.36Å; G456-V467 PolarHBondContact N-O 3.3Å; G456-V467 PolarHBondContact O-N 3.38Å; N458-V467 HydrophobicContact CB-CG2 3.81Å; P465-V467 HydrophobicContact CB-CG1 4.48Å; P465-V467 HydrophobicContact CG-CG1 4.44Å; P465-V467 PolarHBondContact O-N 2.91Å; V467-Q469 HydrophobicContact CG2-CG 4Å
468	P	90.2	Very high	83.6	Confident	71 Å²	71	50.6 Å²	50.6	46%	0.461	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	139.3	168.8	29.4	-34.8	0	0	0	110.8	T432 I453	T432-P468 HydrophobicContact CG2-CB 4.34Å; I453-P468 HydrophobicContact CG2-CB 4.09Å
469	Q	91.4	Very high	84.6	Confident	19 Å²	19	49.1 Å²	49.1	9%	0.089	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	167.2	-179.4	-64	179	-12.8	0	0	108.9	V429 I453 C454 V467 L494	V429-Q469 HydrophobicContact CG1-CB 4.15Å; I453-Q469 WeakPolarHBondContact CA-O 3.39Å; C454-Q469 PolarHBondContact N-O 2.72Å; C454-Q469 PolarHBondContact O-N 3.14Å; V467-Q469 HydrophobicContact CG2-CG 4Å; Q469-L494 VanDerWaalsContact OE1-CD1 3.24Å
470	C	93.4	Very high	85.9	Confident	2 Å²	2	43 Å²	43	1%	0.014	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	110.1	178.5	-66.1	0	0	0	0	110.1	K430 C438	K430-C470 PolarHBondContact N-O 3.31Å; K430-C470 PolarHBondContact O-N 3.24Å; C438-C470 WeakPolarHBondContact CA-SG 3.48Å; C438-C470 HydrophobicContact CB-CB 3.86Å; C438-C470 WeakPolarHBondContact CB-SG 3.4Å; C438-C470 WeakPolarHBondContact SG-CB 3.42Å; C438-C470 CovalentContact SG-SG 2.03Å; C438-C470 PolarHBondContact SG-SG 3.22Å
471	C	94.1	Very high	87.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	138.7	175.6	-71.9	0	0	0	0	111	Y428 V452 C454 V476	Y428-C471 WeakPolarHBondContact O-CA 3.47Å; V452-C471 HydrophobicContact CG2-CB 4.04Å; V452-C471 PolarHBondContact N-O 3.1Å; V452-C471 PolarHBondContact O-N 3.1Å; C454-C471 HydrophobicContact CB-CB 3.79Å; C454-C471 WeakPolarHBondContact CB-SG 3.32Å; C454-C471 WeakPolarHBondContact SG-CB 3.32Å; C454-C471 PolarHBondContact SG-N 3.08Å; C454-C471 VanDerWaalsContact SG-N 3.38Å; C454-C471 CovalentContact SG-SG 2.04Å; C454-C471 PolarHBondContact SG-SG 3.49Å; C471-V476 HydrophobicContact CB-CG2 4.46Å
472	Y	94.4	Very high	88.4	Confident	20 Å²	20	37.3 Å²	37.3	8%	0.078	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	168	174.4	61.9	-89.7	0	0	0	112	V427 Y428 K430 I449 K450 K451 W808	V427-Y472 WeakPolarHBondContact CA-O 3.33Å; Y428-Y472 VanDerWaalsContact CB-CE2 3.48Å; Y428-Y472 HydrophobicContact CD1-CE2 4.45Å; Y428-Y472 AromaticContact CD2-CD2 3.94Å; Y428-Y472 HydrophobicContact CD2-CD2 3.94Å; Y428-Y472 AromaticContact CD2-CE2 3.75Å; Y428-Y472 HydrophobicContact CD2-CE2 3.75Å; Y428-Y472 HydrophobicContact CG-CD2 4.15Å; Y428-Y472 AromaticContact CG-CE2 3.64Å; Y428-Y472 HydrophobicContact CG-CE2 3.64Å; Y428-Y472 PolarHBondContact N-O 2.77Å; Y428-Y472 PolarHBondContact O-N 2.98Å; Y428-Y472 VanDerWaalsContact O-N 3.13Å; K430-Y472 WeakPolarHBondContact CE-OH 3.34Å; K430-Y472 HydrophobicContact CG-CE1 3.75Å; I449-Y472 HydrophobicContact CG2-CD2 3.85Å; I449-Y472 HydrophobicContact CG2-CG 4.14Å; K450-Y472 WeakPolarHBondContact O-CB 3.3Å; K451-Y472 HydrophobicContact CD-CD1 3.85Å; K451-Y472 HydrophobicContact CD-CE1 4.38Å; K451-Y472 HydrophobicContact CD-CG 4.37Å; K451-Y472 HydrophobicContact CG-CD1 4.11Å; K451-Y472 HydrophobicContact CG-CG 4.21Å; Y472-W808 AromaticContact CD2-CH2 3.82Å; Y472-W808 HydrophobicContact CD2-CH2 3.82Å; Y472-W808 HydrophobicContact CD2-CZ3 4.15Å; Y472-W808 HydrophobicContact CE2-CH2 4.43Å; Y472-W808 HydrophobicContact CE2-CZ3 4.43Å
473	G	93.8	Very high	90.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	129.3	-177.2	-179.1	0	0	0	0	0	113	F426 C475 V476 D477	F426-G473 CarbonylContact O-C 3.52Å; G473-C475 VanDerWaalsContact C-N 3.29Å; G473-C475 PolarHBondContact O-N 3.21Å; G473-C475 VanDerWaalsContact O-N 3.17Å; G473-V476 WeakPolarHBondContact O-CB 3.31Å; G473-V476 PolarHBondContact O-N 3.07Å; G473-D477 PolarHBondContact O-N 2.98Å
474	F	94.8	Very high	91.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-45.2	-48.8	-177.4	-174.4	-71.5	0	0	0	113.3	F426 V476 L478 F549 M801 L804 D805 W808 V809	F426-F474 HydrophobicContact CD1-CB 4.02Å; F426-F474 AromaticContact CD1-CD1 3.92Å; F426-F474 HydrophobicContact CD1-CD1 3.92Å; F426-F474 HydrophobicContact CD1-CG 4Å; F426-F474 HydrophobicContact CE1-CD1 4.13Å; F426-F474 HydrophobicContact CE1-CE1 4.47Å; F426-F474 HydrophobicContact CE1-CG 4.22Å; F426-F474 PolarHBondContact O-N 2.89Å; F474-V476 VanDerWaalsContact C-N 3.32Å; F474-V476 PolarHBondContact O-N 3.48Å; F474-L478 WeakPolarHBondContact O-CB 3.41Å; F474-L478 PolarHBondContact O-N 3.5Å; F474-L478 VanDerWaalsContact O-N 3.08Å; F474-F549 HydrophobicContact CD1-CE2 4.24Å; F474-F549 AromaticContact CE1-CD2 3.62Å; F474-F549 HydrophobicContact CE1-CD2 3.62Å; F474-F549 AromaticContact CE1-CE2 3.7Å; F474-F549 HydrophobicContact CE1-CE2 3.7Å; F474-F549 HydrophobicContact CZ-CD2 4.28Å; F474-M801 HydrophobicContact CE1-SD 3.99Å; F474-M801 HydrophobicContact CZ-CG 4.38Å; F474-M801 HydrophobicContact CZ-SD 3.63Å; F474-L804 HydrophobicContact CD2-CB 3.72Å; F474-L804 HydrophobicContact CE2-CB 3.54Å; F474-L804 HydrophobicContact CG-CB 4.45Å; F474-L804 HydrophobicContact CZ-CB 4.12Å; F474-L804 HydrophobicContact CZ-CD1 4.48Å; F474-D805 HydrophobicContact CE2-CB 4.38Å; F474-W808 HydrophobicContact CB-CB 4.1Å; F474-W808 HydrophobicContact CB-CG 4.04Å; F474-W808 HydrophobicContact CD2-CB 4.26Å; F474-V809 HydrophobicContact CD2-CG2 4.42Å
475	C	96.9	Very high	92.9	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.014	18%	0.176	C	C	.	.	H	α-helix	trans	-70.6	-27.8	-177.3	-75.2	0	0	0	0	112.9	F426 V427 G473 L479 V530	F426-C475 PolarHBondContact O-N 3.02Å; F426-C475 VanDerWaalsContact O-N 3.09Å; V427-C475 HydrophobicContact CG2-CB 3.83Å; G473-C475 VanDerWaalsContact C-N 3.29Å; G473-C475 PolarHBondContact O-N 3.21Å; G473-C475 VanDerWaalsContact O-N 3.17Å; C475-L479 WeakPolarHBondContact O-CB 3.46Å; C475-L479 PolarHBondContact O-N 3.26Å; C475-V530 HydrophobicContact CB-CG1 4.29Å
476	V	96.3	Very high	93.6	Very high	7 Å²	7	31.4 Å²	31.4	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-77.6	-42	178.1	179.2	0	0	0	0	110.7	V452 C471 G473 F474 L478 L479 I480	V452-V476 HydrophobicContact CB-CG1 4.33Å; V452-V476 HydrophobicContact CG1-CG1 3.72Å; V452-V476 HydrophobicContact CG2-CG1 3.73Å; V452-V476 HydrophobicContact CG2-CG2 4.45Å; C471-V476 HydrophobicContact CB-CG2 4.46Å; G473-V476 WeakPolarHBondContact O-CB 3.31Å; G473-V476 PolarHBondContact O-N 3.07Å; F474-V476 VanDerWaalsContact C-N 3.32Å; F474-V476 PolarHBondContact O-N 3.48Å; V476-L478 VanDerWaalsContact C-N 3.31Å; V476-L478 PolarHBondContact O-N 3.1Å; V476-L479 PolarHBondContact O-N 3.47Å; V476-I480 HydrophobicContact CG1-CD1 4.03Å; V476-I480 VanDerWaalsContact O-CG1 3.29Å; V476-I480 WeakPolarHBondContact O-CG1 3.48Å; V476-I480 PolarHBondContact O-N 2.87Å
477	D	95.3	Very high	94.1	Very high	16 Å²	16	31.8 Å²	31.8	9%	0.086	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-40.3	172	-89.6	-49.4	0	0	0	111.9	K450 G473 I480 K481 L804 W808	K450-D477 IonicContact NZ-OD1 2.66Å; K450-D477 PolarHBondContact NZ-OD1 3.11Å; G473-D477 PolarHBondContact O-N 2.98Å; D477-I480 PolarHBondContact O-N 3.38Å; D477-K481 WeakPolarHBondContact O-CB 3.5Å; D477-K481 PolarHBondContact O-N 3.4Å; D477-L804 HydrophobicContact CB-CD1 4.45Å; D477-L804 HydrophobicContact CB-CD2 3.65Å; D477-W808 PolarHBondContact OD2-NE1 2.89Å
478	L	96.1	Very high	94.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-44.1	174.3	-178.6	59.5	0	0	0	111.8	F474 V476 I480 K481 L482 F549 F800 M801 L804	F474-L478 WeakPolarHBondContact O-CB 3.41Å; F474-L478 PolarHBondContact O-N 3.5Å; F474-L478 VanDerWaalsContact O-N 3.08Å; V476-L478 VanDerWaalsContact C-N 3.31Å; V476-L478 PolarHBondContact O-N 3.1Å; L478-I480 PolarHBondContact O-N 2.91Å; L478-K481 PolarHBondContact O-N 3.48Å; L478-L482 HydrophobicContact CD1-CD1 4.38Å; L478-L482 HydrophobicContact CD1-CG 4.36Å; L478-L482 HydrophobicContact CG-CD1 4.18Å; L478-L482 VanDerWaalsContact O-CG 3.31Å; L478-L482 WeakPolarHBondContact O-CG 3.33Å; L478-L482 PolarHBondContact O-N 2.99Å; L478-F549 HydrophobicContact CD2-CB 4.05Å; L478-F549 HydrophobicContact CD2-CD1 4.27Å; L478-F549 HydrophobicContact CD2-CD2 4.19Å; L478-F549 HydrophobicContact CD2-CG 3.94Å; L478-F800 HydrophobicContact CD1-CE1 4.48Å; L478-M801 HydrophobicContact CD1-CE 4.02Å; L478-L804 HydrophobicContact CB-CD1 4.37Å
479	L	96.9	Very high	94.6	Very high	5 Å²	5	31.2 Å²	31.2	3%	0.026	17%	0.165	C	C	.	.	H	α-helix	trans	-58.2	-46.1	174.4	175.5	59.9	0	0	0	111.8	I418 C475 V476 K481 L482 A483 F488 Y490 V492 V530	I418-L479 HydrophobicContact CD1-CD1 4.43Å; I418-L479 HydrophobicContact CG1-CD1 4.24Å; I418-L479 HydrophobicContact CG1-CD2 4.45Å; I418-L479 HydrophobicContact CG2-CD2 4.2Å; C475-L479 WeakPolarHBondContact O-CB 3.46Å; C475-L479 PolarHBondContact O-N 3.26Å; V476-L479 PolarHBondContact O-N 3.47Å; L479-K481 PolarHBondContact O-N 3.28Å; L479-L482 PolarHBondContact O-N 2.74Å; L479-A483 WeakPolarHBondContact O-CB 3.5Å; L479-A483 PolarHBondContact O-N 2.8Å; L479-F488 HydrophobicContact CD1-CE2 4.07Å; L479-F488 HydrophobicContact CD1-CZ 4.09Å; L479-Y490 HydrophobicContact CD1-CD1 4.41Å; L479-Y490 HydrophobicContact CD1-CG 4.36Å; L479-Y490 HydrophobicContact CD2-CD2 3.8Å; L479-Y490 HydrophobicContact CD2-CE2 3.87Å; L479-Y490 HydrophobicContact CD2-CG 4.26Å; L479-Y490 HydrophobicContact CG-CD1 4.41Å; L479-Y490 HydrophobicContact CG-CD2 4.32Å; L479-Y490 HydrophobicContact CG-CE1 4.39Å; L479-Y490 HydrophobicContact CG-CE2 4.31Å; L479-Y490 HydrophobicContact CG-CG 4.38Å; L479-V492 HydrophobicContact CD2-CG2 3.74Å; L479-V530 HydrophobicContact CB-CG1 4.33Å; L479-V530 HydrophobicContact CD1-CG2 4.39Å
480	I	96	Very high	94.8	Very high	17 Å²	17	33.4 Å²	33.4	9%	0.087	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-44.2	177.5	-68.2	163.1	0	0	0	110.8	K450 V452 V476 D477 L478 L482 A483 M484 Y490	K450-I480 HydrophobicContact CB-CD1 3.64Å; K450-I480 HydrophobicContact CD-CD1 3.83Å; K450-I480 HydrophobicContact CD-CG2 4.12Å; K450-I480 HydrophobicContact CG-CD1 4.39Å; V452-I480 HydrophobicContact CG1-CD1 4.18Å; V452-I480 HydrophobicContact CG1-CG1 4.47Å; V476-I480 HydrophobicContact CG1-CD1 4.03Å; V476-I480 VanDerWaalsContact O-CG1 3.29Å; V476-I480 WeakPolarHBondContact O-CG1 3.48Å; V476-I480 PolarHBondContact O-N 2.87Å; D477-I480 PolarHBondContact O-N 3.38Å; L478-I480 PolarHBondContact O-N 2.91Å; I480-L482 PolarHBondContact O-N 3.11Å; I480-A483 PolarHBondContact O-N 3.3Å; I480-M484 HydrophobicContact CG2-CE 3.79Å; I480-M484 HydrophobicContact CG2-SD 3.99Å; I480-M484 WeakPolarHBondContact O-CB 3.39Å; I480-M484 WeakPolarHBondContact O-CG 3.49Å; I480-M484 PolarHBondContact O-N 3.48Å; I480-Y490 WeakPolarHBondContact CG1-OH 3.34Å
481	K	95.2	Very high	94.8	Very high	72 Å²	72	37.3 Å²	37.3	31%	0.313	19%	0.191	S	C	.	.	H	α-helix	trans	-61.1	-43	176	176.5	63.6	178.2	-178.5	0	111.8	D477 L478 L479 T485 F800	D477-K481 WeakPolarHBondContact O-CB 3.5Å; D477-K481 PolarHBondContact O-N 3.4Å; L478-K481 PolarHBondContact O-N 3.48Å; L479-K481 PolarHBondContact O-N 3.28Å; K481-T485 WeakPolarHBondContact O-CB 3.28Å; K481-T485 PolarHBondContact O-N 3.48Å; K481-T485 PolarHBondContact O-OG1 3.34Å; K481-F800 HydrophobicContact CB-CE1 3.71Å; K481-F800 HydrophobicContact CB-CZ 3.77Å; K481-F800 HydrophobicContact CD-CE1 4.42Å; K481-F800 HydrophobicContact CD-CZ 4.44Å; K481-F800 HydrophobicContact CG-CD1 4.09Å; K481-F800 HydrophobicContact CG-CE1 3.61Å; K481-F800 HydrophobicContact CG-CZ 3.96Å
482	L	95.9	Very high	94.9	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-44.7	177.1	-71	171.9	0	0	0	111.7	L478 L479 I480 M484 T485 M486 F488 I776 A791	L478-L482 HydrophobicContact CD1-CD1 4.38Å; L478-L482 HydrophobicContact CD1-CG 4.36Å; L478-L482 HydrophobicContact CG-CD1 4.18Å; L478-L482 VanDerWaalsContact O-CG 3.31Å; L478-L482 WeakPolarHBondContact O-CG 3.33Å; L478-L482 PolarHBondContact O-N 2.99Å; L479-L482 PolarHBondContact O-N 2.74Å; I480-L482 PolarHBondContact O-N 3.11Å; L482-M484 PolarHBondContact O-N 3.24Å; L482-T485 PolarHBondContact O-N 3.11Å; L482-T485 VanDerWaalsContact O-N 3.12Å; L482-M486 HydrophobicContact CB-CE 3.94Å; L482-M486 HydrophobicContact CD2-CE 3.97Å; L482-M486 HydrophobicContact CG-CE 4.48Å; L482-M486 PolarHBondContact O-N 2.99Å; L482-F488 HydrophobicContact CB-CE1 4.23Å; L482-F488 HydrophobicContact CB-CZ 4.24Å; L482-I776 HydrophobicContact CD1-CD1 3.4Å; L482-I776 VanDerWaalsContact CD1-CD1 3.4Å; L482-A791 HydrophobicContact CD2-CB 3.53Å
483	A	95.7	Very high	94.9	Very high	10 Å²	10	38.7 Å²	38.7	8%	0.083	20%	0.199	C	C	.	.	H	α-helix	trans	-58.8	-46	176.6	0	0	0	0	0	112.3	L479 I480 T485 N487 F488 Y490	L479-A483 WeakPolarHBondContact O-CB 3.5Å; L479-A483 PolarHBondContact O-N 2.8Å; I480-A483 PolarHBondContact O-N 3.3Å; A483-T485 VanDerWaalsContact C-N 3.29Å; A483-T485 PolarHBondContact O-N 3.39Å; A483-N487 WeakPolarHBondContact O-CA 3.44Å; A483-N487 PolarHBondContact O-N 3.36Å; A483-F488 VanDerWaalsContact CA-CE1 3.42Å; A483-F488 HydrophobicContact CB-CD2 4.42Å; A483-F488 HydrophobicContact CB-CE1 4.2Å; A483-F488 HydrophobicContact CB-CE2 4.03Å; A483-F488 HydrophobicContact CB-CZ 3.91Å; A483-Y490 HydrophobicContact CB-CD1 3.72Å; A483-Y490 HydrophobicContact CB-CE1 3.58Å
484	M	94	Very high	94.9	Very high	139 Å²	139	39.5 Å²	39.5	69%	0.685	20%	0.204	S	C	*	.	H	α-helix	trans	-67	-25.1	175.3	-70.4	176	172.3	0	0	113.9	I480 L482	I480-M484 HydrophobicContact CG2-CE 3.79Å; I480-M484 HydrophobicContact CG2-SD 3.99Å; I480-M484 WeakPolarHBondContact O-CB 3.39Å; I480-M484 WeakPolarHBondContact O-CG 3.49Å; I480-M484 PolarHBondContact O-N 3.48Å; L482-M484 PolarHBondContact O-N 3.24Å
485	T	93.6	Very high	94.9	Very high	75 Å²	75	39.7 Å²	39.7	46%	0.46	21%	0.205	S	C	.	.	H	α-helix	trans	-88.6	-27.6	-178.7	-53.7	0	0	0	0	112.1	K481 L482 A483 A791	K481-T485 WeakPolarHBondContact O-CB 3.28Å; K481-T485 PolarHBondContact O-N 3.48Å; K481-T485 PolarHBondContact O-OG1 3.34Å; L482-T485 PolarHBondContact O-N 3.11Å; L482-T485 VanDerWaalsContact O-N 3.12Å; A483-T485 VanDerWaalsContact C-N 3.29Å; A483-T485 PolarHBondContact O-N 3.39Å; T485-A791 HydrophobicContact CG2-CB 4.48Å
486	M	91.3	Very high	94.4	Very high	31 Å²	31	42.7 Å²	42.7	15%	0.153	23%	0.229	C	C	.	.	H	α-helix	trans	-117.6	4.1	-174.4	-63.2	-175.3	-62.6	0	0	114.2	L482 F488 W784 N787 V788 A791	L482-M486 HydrophobicContact CB-CE 3.94Å; L482-M486 HydrophobicContact CD2-CE 3.97Å; L482-M486 HydrophobicContact CG-CE 4.48Å; L482-M486 PolarHBondContact O-N 2.99Å; M486-F488 HydrophobicContact CB-CD1 3.91Å; M486-F488 HydrophobicContact CB-CE1 4.21Å; M486-F488 HydrophobicContact CE-CD1 4.29Å; M486-F488 HydrophobicContact CE-CE1 3.63Å; M486-F488 PolarHBondContact O-N 3.37Å; M486-W784 HydrophobicContact CB-CZ3 4.24Å; M486-N787 HydrophobicContact SD-CB 3.53Å; M486-N787 VanDerWaalsContact SD-CB 3.53Å; M486-V788 HydrophobicContact CE-CB 4.46Å; M486-V788 HydrophobicContact CE-CG2 3.69Å; M486-V788 HydrophobicContact SD-CG2 4.27Å; M486-A791 HydrophobicContact SD-CB 4.4Å
487	N	92.8	Very high	93.8	Very high	141 Å²	141	44.9 Å²	44.9	75%	0.754	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	42.6	175.8	-66.7	-28.3	0	0	0	115	A483	A483-N487 WeakPolarHBondContact O-CA 3.44Å; A483-N487 PolarHBondContact O-N 3.36Å
488	F	93.4	Very high	93.4	Very high	10 Å²	10	46.4 Å²	46.4	4%	0.044	26%	0.26	C	S	.	.			trans	-105.6	150.5	169.5	69.7	-90.7	0	0	0	111.5	T414 L416 L479 L482 A483 M486 Y490 W784	T414-F488 CarbonylContact O-C 3.52Å; T414-F488 WeakPolarHBondContact O-CA 3.27Å; L416-F488 HydrophobicContact CD1-CB 4.49Å; L416-F488 HydrophobicContact CD1-CD2 3.8Å; L416-F488 HydrophobicContact CD1-CE2 4.18Å; L416-F488 HydrophobicContact CD1-CG 4.1Å; L416-F488 HydrophobicContact CG-CD2 4.31Å; L479-F488 HydrophobicContact CD1-CE2 4.07Å; L479-F488 HydrophobicContact CD1-CZ 4.09Å; L482-F488 HydrophobicContact CB-CE1 4.23Å; L482-F488 HydrophobicContact CB-CZ 4.24Å; A483-F488 VanDerWaalsContact CA-CE1 3.42Å; A483-F488 HydrophobicContact CB-CD2 4.42Å; A483-F488 HydrophobicContact CB-CE1 4.2Å; A483-F488 HydrophobicContact CB-CE2 4.03Å; A483-F488 HydrophobicContact CB-CZ 3.91Å; M486-F488 HydrophobicContact CB-CD1 3.91Å; M486-F488 HydrophobicContact CB-CE1 4.21Å; M486-F488 HydrophobicContact CE-CD1 4.29Å; M486-F488 HydrophobicContact CE-CE1 3.63Å; M486-F488 PolarHBondContact O-N 3.37Å; F488-Y490 HydrophobicContact CD2-CD1 4.41Å; F488-Y490 HydrophobicContact CE2-CD1 4.04Å; F488-Y490 HydrophobicContact CE2-CG 4.45Å; F488-W784 HydrophobicContact CB-CH2 3.93Å; F488-W784 HydrophobicContact CB-CZ2 4.34Å; F488-W784 HydrophobicContact CB-CZ3 4.45Å; F488-W784 HydrophobicContact CD1-CZ3 4.34Å
489	T	94.9	Very high	93	Very high	87 Å²	87	49.2 Å²	49.2	53%	0.534	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	155.7	166.4	62.6	0	0	0	0	109.8	T414 R415 L416	T414-T489 PolarHBondContact O-N 3.46Å; T414-T489 PolarHBondContact O-OG1 3.23Å; R415-T489 WeakPolarHBondContact CA-O 3.26Å; L416-T489 PolarHBondContact N-O 3.43Å
490	Y	95.2	Very high	92.6	Very high	66 Å²	66	50.2 Å²	50.2	26%	0.259	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	154.6	-173.5	59.7	-93.9	0	0	0	112	L416 V452 L479 I480 A483 F488 V492	L416-Y490 WeakPolarHBondContact O-CA 3.33Å; V452-Y490 HydrophobicContact CG1-CE2 4.14Å; L479-Y490 HydrophobicContact CD1-CD1 4.41Å; L479-Y490 HydrophobicContact CD1-CG 4.36Å; L479-Y490 HydrophobicContact CD2-CD2 3.8Å; L479-Y490 HydrophobicContact CD2-CE2 3.87Å; L479-Y490 HydrophobicContact CD2-CG 4.26Å; L479-Y490 HydrophobicContact CG-CD1 4.41Å; L479-Y490 HydrophobicContact CG-CD2 4.32Å; L479-Y490 HydrophobicContact CG-CE1 4.39Å; L479-Y490 HydrophobicContact CG-CE2 4.31Å; L479-Y490 HydrophobicContact CG-CG 4.38Å; I480-Y490 WeakPolarHBondContact CG1-OH 3.34Å; A483-Y490 HydrophobicContact CB-CD1 3.72Å; A483-Y490 HydrophobicContact CB-CE1 3.58Å; F488-Y490 HydrophobicContact CD2-CD1 4.41Å; F488-Y490 HydrophobicContact CE2-CD1 4.04Å; F488-Y490 HydrophobicContact CE2-CG 4.45Å; Y490-V492 HydrophobicContact CD2-CG2 3.72Å; Y490-V492 HydrophobicContact CE2-CG2 3.93Å
491	E	94.8	Very high	92.3	Very high	84 Å²	84	49.4 Å²	49.4	39%	0.393	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.2	167.2	-68.2	169.4	-86.2	0	0	107.4	R415 L416 I418	R415-E491 IonicContact CZ-OE1 3.55Å; R415-E491 VanDerWaalsContact CZ-OE1 3.27Å; R415-E491 IonicContact CZ-OE2 3.14Å; R415-E491 IonicContact NE-OE1 3.31Å; R415-E491 PolarHBondContact NE-OE1 2.94Å; R415-E491 IonicContact NE-OE2 2.65Å; R415-E491 IonicContact NH2-OE1 3.6Å; R415-E491 PolarHBondContact NH2-OE1 3.01Å; R415-E491 IonicContact NH2-OE2 3.78Å; R415-E491 PolarHBondContact NH2-OE2 2.92Å; L416-E491 PolarHBondContact O-N 2.85Å; I418-E491 WeakPolarHBondContact CA-O 3.3Å; I418-E491 WeakPolarHBondContact CB-O 3.27Å; I418-E491 PolarHBondContact N-O 3.47Å
492	V	95.7	Very high	91.9	Very high	12 Å²	12	46.1 Å²	46.1	7%	0.073	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	133.3	178.1	-172.9	0	0	0	0	109.5	I418 T420 V452 C454 T455 L479 Y490	I418-V492 WeakPolarHBondContact O-CA 3.32Å; T420-V492 HydrophobicContact CG2-CG1 3.86Å; V452-V492 HydrophobicContact CG2-CB 4.43Å; V452-V492 HydrophobicContact CG2-CG2 4.02Å; C454-V492 WeakPolarHBondContact CA-O 3.29Å; C454-V492 HydrophobicContact CB-CB 4.05Å; C454-V492 HydrophobicContact CB-CG1 3.9Å; T455-V492 PolarHBondContact N-O 3Å; T455-V492 VanDerWaalsContact N-O 3.14Å; L479-V492 HydrophobicContact CD2-CG2 3.74Å; Y490-V492 HydrophobicContact CD2-CG2 3.72Å; Y490-V492 HydrophobicContact CE2-CG2 3.93Å
493	H	95.2	Very high	91.5	Very high	36 Å²	36	47.4 Å²	47.4	17%	0.167	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.4	167.2	73.2	-95.5	0	0	0	111.8	I418 V419 T420 T455 E520	I418-H493 PolarHBondContact O-N 3.18Å; V419-H493 WeakPolarHBondContact CA-O 3.4Å; T420-H493 PolarHBondContact N-O 3.25Å; T455-H493 CarbonylContact O-C 3.52Å; T455-H493 WeakPolarHBondContact O-CA 3.14Å; T455-H493 WeakPolarHBondContact O-CB 3.44Å; T455-H493 WeakPolarHBondContact OG1-CB 3.26Å; H493-E520 IonicContact CD2-OE2 2.89Å; H493-E520 PolarHBondContact CD2-OE2 3.44Å; H493-E520 IonicContact CE1-OE2 3.95Å; H493-E520 IonicContact NE2-OE2 2.76Å; H493-E520 PolarHBondContact NE2-OE2 2.94Å
494	L	93.9	Very high	90.9	Very high	18 Å²	18	50.6 Å²	50.6	9%	0.094	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135.6	174.2	-71.1	162.5	0	0	0	109.4	T420 V429 T455 Q469	T420-L494 HydrophobicContact CG2-CD2 3.82Å; T420-L494 WeakPolarHBondContact O-CA 3.36Å; V429-L494 HydrophobicContact CG1-CD1 3.99Å; V429-L494 HydrophobicContact CG2-CD1 3.82Å; V429-L494 HydrophobicContact CG2-CD2 4.07Å; T455-L494 PolarHBondContact O-N 2.82Å; Q469-L494 VanDerWaalsContact OE1-CD1 3.24Å
495	V	93	Very high	90.4	Very high	4 Å²	4	52.5 Å²	52.5	2%	0.024	28%	0.277	C	S	.	.			trans	-52.9	134	178.5	61.9	0	0	0	0	112.5	V419 T420 I421 D497 G498 M517 E520	V419-V495 HydrophobicContact CG2-CB 4.01Å; T420-V495 PolarHBondContact O-N 3.4Å; I421-V495 HydrophobicContact CB-CG1 4.07Å; I421-V495 HydrophobicContact CD1-CG1 4.28Å; I421-V495 HydrophobicContact CG1-CG1 3.93Å; V495-D497 WeakPolarHBondContact CG2-OD1 3.34Å; V495-D497 PolarHBondContact O-N 3.09Å; V495-G498 PolarHBondContact O-N 2.89Å; V495-M517 HydrophobicContact CB-CG 3.73Å; V495-M517 HydrophobicContact CG1-CG 4.06Å; V495-M517 HydrophobicContact CG2-CG 3.9Å; V495-E520 WeakPolarHBondContact CA-OE1 3.5Å; V495-E520 WeakPolarHBondContact CG2-OE1 3.35Å
496	A	86.8	Confident	89.6	Confident	64 Å²	64	51.2 Å²	51.2	53%	0.529	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-27	-168.3	0	0	0	0	0	114.8	E520	A496-E520 PolarHBondContact N-OE1 2.95Å
497	D	84.8	Confident	88.7	Confident	54 Å²	54	57 Å²	57	29%	0.289	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-7	-178.1	72.7	-4.5	0	0	0	114.3	V495 K499 G516	V495-D497 WeakPolarHBondContact CG2-OD1 3.34Å; V495-D497 PolarHBondContact O-N 3.09Å; D497-K499 WeakPolarHBondContact OD1-CB 3.49Å; D497-K499 PolarHBondContact OD1-N 3.24Å; D497-G516 WeakPolarHBondContact OD1-CA 3.32Å; D497-G516 VanDerWaalsContact OD2-CA 3.3Å; D497-G516 WeakPolarHBondContact OD2-CA 3.37Å; D497-G516 PolarHBondContact OD2-N 3.47Å
498	G	85.9	Confident	87.7	Confident	48 Å²	48	58.4 Å²	58.4	50%	0.495	31%	0.308	S	S	.	.	S	Bend	trans	77.7	15.9	-175.9	0	0	0	0	0	115.6	I421 V495	I421-G498 WeakPolarHBondContact CD1-O 3.49Å; V495-G498 PolarHBondContact O-N 2.89Å
499	K	88.6	Confident	86.9	Confident	58 Å²	58	60.2 Å²	60.2	25%	0.252	32%	0.322	S	S	.	.			trans	-120.8	149.6	-169	-62.8	176.4	174.3	179.9	0	115.1	D497 G501 G516 M517	D497-K499 WeakPolarHBondContact OD1-CB 3.49Å; D497-K499 PolarHBondContact OD1-N 3.24Å; K499-G501 VanDerWaalsContact C-N 3.27Å; K499-G501 PolarHBondContact O-N 3.16Å; K499-G516 WeakPolarHBondContact O-CA 3.45Å; K499-M517 PolarHBondContact O-N 2.81Å
500	F	88.7	Confident	86.1	Confident	26 Å²	26	63.3 Å²	63.3	11%	0.114	34%	0.336	C	S	.	.			trans	-67.6	-25	175.4	-69.1	-87.8	0	0	0	114	I421 Q423 M517 P532 W747	I421-F500 HydrophobicContact CD1-CD1 4.31Å; I421-F500 HydrophobicContact CD1-CD2 3.91Å; I421-F500 HydrophobicContact CD1-CE1 4.33Å; I421-F500 HydrophobicContact CD1-CE2 3.92Å; I421-F500 HydrophobicContact CD1-CG 4.1Å; I421-F500 HydrophobicContact CD1-CZ 4.14Å; I421-F500 HydrophobicContact CG2-CD1 4.4Å; I421-F500 HydrophobicContact CG2-CE1 3.93Å; I421-F500 HydrophobicContact CG2-CZ 4.27Å; Q423-F500 HydrophobicContact CG-CZ 4.43Å; F500-M517 HydrophobicContact CB-CE 4.4Å; F500-M517 HydrophobicContact CD1-CE 3.65Å; F500-M517 HydrophobicContact CE1-CE 4.31Å; F500-M517 HydrophobicContact CG-CE 4.28Å; F500-P532 HydrophobicContact CE1-CG 4.32Å; F500-P532 WeakPolarHBondContact CE1-O 3.18Å; F500-W747 HydrophobicContact CE2-CZ2 4.29Å
501	G	88.6	Confident	85.3	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.351	C	S	.	.			trans	97.8	126.5	176.5	0	0	0	0	0	115.1	K499 N515 R539	K499-G501 VanDerWaalsContact C-N 3.27Å; K499-G501 PolarHBondContact O-N 3.16Å; G501-N515 WeakPolarHBondContact CA-O 3.45Å; G501-N515 WeakPolarHBondContact CA-OD1 3.39Å; G501-R539 PolarHBondContact O-NE 3.18Å; G501-R539 PolarHBondContact O-NH2 3.03Å
502	T	88.1	Confident	84.7	Confident	4 Å²	4	68.5 Å²	68.5	3%	0.025	36%	0.358	C	S	.	.			trans	-141.5	166.3	-177.7	68.1	0	0	0	0	110.6	W514 N515 Q702 I707	T502-W514 VanDerWaalsContact C-CE3 3.47Å; T502-W514 WeakPolarHBondContact O-CA 3.34Å; T502-N515 PolarHBondContact N-OD1 3.28Å; T502-N515 PolarHBondContact O-N 3.18Å; T502-N515 VanDerWaalsContact O-N 3.09Å; T502-N515 PolarHBondContact O-OD1 2.82Å; T502-N515 PolarHBondContact OG1-OD1 3.11Å; T502-Q702 VanDerWaalsContact CG2-C 3.44Å; T502-Q702 HydrophobicContact CG2-CB 4.07Å; T502-Q702 WeakPolarHBondContact CG2-O 3.32Å; T502-I707 HydrophobicContact CG2-CD1 3.68Å; T502-I707 HydrophobicContact CG2-CG1 4.36Å
503	Q	87	Confident	84.3	Confident	28 Å²	28	71.5 Å²	71.5	13%	0.131	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	115	173.6	-66.7	-171.3	-15.3	0	0	111.2	K512 E513 W514 Y542	Q503-K512 HydrophobicContact CB-CD 4.22Å; Q503-E513 WeakPolarHBondContact CA-O 3.37Å; Q503-W514 HydrophobicContact CG-CD2 3.82Å; Q503-W514 HydrophobicContact CG-CE3 4.05Å; Q503-W514 HydrophobicContact CG-CG 4.5Å; Q503-W514 HydrophobicContact CG-CH2 3.87Å; Q503-W514 HydrophobicContact CG-CZ2 3.62Å; Q503-W514 HydrophobicContact CG-CZ3 4.08Å; Q503-Y542 PolarHBondContact NE2-OH 3.27Å
504	E	83.4	Confident	84	Confident	78 Å²	78	71.5 Å²	71.5	36%	0.364	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	158.1	172	-64.4	-166.1	114.4	0	0	111.1	K512 E513 N515 Q702	E504-K512 VanDerWaalsContact O-CA 3.27Å; E504-K512 WeakPolarHBondContact O-CA 3.41Å; E504-E513 PolarHBondContact N-O 3.45Å; E504-E513 PolarHBondContact O-N 2.88Å; E504-N515 PolarHBondContact OE2-ND2 3.11Å; E504-Q702 PolarHBondContact OE1-NE2 2.74Å
505	R	82	Confident	83.9	Confident	178 Å²	178	71.7 Å²	71.7	67%	0.672	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	118.1	172.1	-75	-177.2	178.6	139.4	-5	109.4
506	V	78.7	Confident	83.7	Confident	48 Å²	48	71.7 Å²	71.7	29%	0.291	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-87.2	134.8	-177.4	179.6	0	0	0	0	110.6	N508 S509 K511 E513	V506-N508 VanDerWaalsContact C-N 3.32Å; V506-N508 PolarHBondContact O-N 3.04Å; V506-S509 WeakPolarHBondContact O-CB 3.43Å; V506-S509 PolarHBondContact O-N 3.35Å; V506-S509 PolarHBondContact O-OG 3.18Å; V506-K511 PolarHBondContact N-O 3.07Å; V506-E513 HydrophobicContact CG2-CB 3.87Å; V506-E513 HydrophobicContact CG2-CG 3.96Å; V506-E513 WeakPolarHBondContact CG2-OE2 3.49Å
507	N	72.3	Confident	84	Confident	153 Å²	153	68.7 Å²	68.7	82%	0.818	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	51.1	41.6	174.7	-60.9	-17.3	0	0	0	114.9	S509	N507-S509 PolarHBondContact O-N 2.99Å
508	N	71.6	Confident	84.5	Confident	170 Å²	170	66.1 Å²	66.1	91%	0.909	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	55.2	13.1	-174.8	-70	-23.7	0	0	0	115.3	V506	V506-N508 VanDerWaalsContact C-N 3.32Å; V506-N508 PolarHBondContact O-N 3.04Å
509	S	76.1	Confident	84.8	Confident	48 Å²	48	64.8 Å²	64.8	34%	0.336	32%	0.32	S	S	.	.	S	Bend	trans	-80.9	166.7	177.4	78.2	0	0	0	0	111.7	V506 N507 K511	V506-S509 WeakPolarHBondContact O-CB 3.43Å; V506-S509 PolarHBondContact O-N 3.35Å; V506-S509 PolarHBondContact O-OG 3.18Å; N507-S509 PolarHBondContact O-N 2.99Å; S509-K511 PolarHBondContact O-N 2.99Å; S509-K511 VanDerWaalsContact OG-CB 3.28Å; S509-K511 WeakPolarHBondContact OG-CB 3.48Å; S509-K511 PolarHBondContact OG-N 2.95Å; S509-K511 VanDerWaalsContact OG-N 3.1Å
510	N	78.6	Confident	85	Confident	153 Å²	153	63.1 Å²	63.1	82%	0.818	31%	0.313	S	S	*	.	S	Bend	trans	-74.1	-4.3	168.3	-75.9	-38	0	0	0	113.1	K512	N510-K512 PolarHBondContact O-N 2.69Å
511	K	77.7	Confident	85.2	Confident	132 Å²	132	61.9 Å²	61.9	57%	0.574	31%	0.307	S	S	*	.			trans	-72.9	118.7	177	-159.6	-175	-176.2	-158.8	0	108.8	V506 S509 E513	V506-K511 PolarHBondContact N-O 3.07Å; S509-K511 PolarHBondContact O-N 2.99Å; S509-K511 VanDerWaalsContact OG-CB 3.28Å; S509-K511 WeakPolarHBondContact OG-CB 3.48Å; S509-K511 PolarHBondContact OG-N 2.95Å; S509-K511 VanDerWaalsContact OG-N 3.1Å; K511-E513 HydrophobicContact CD-CG 4.38Å; K511-E513 VanDerWaalsContact CD-OE1 3.28Å; K511-E513 WeakPolarHBondContact CD-OE1 3.26Å; K511-E513 WeakPolarHBondContact CE-OE1 3.29Å; K511-E513 HydrophobicContact CG-CG 4.34Å; K511-E513 IonicContact NZ-OE1 3.19Å; K511-E513 PolarHBondContact NZ-OE1 3.41Å
512	K	82.2	Confident	85.3	Confident	126 Å²	126	65.1 Å²	65.1	55%	0.548	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	133.4	169.6	-66.5	-174	174.4	-175	0	109.5	Q503 E504 N510	Q503-K512 HydrophobicContact CB-CD 4.22Å; E504-K512 VanDerWaalsContact O-CA 3.27Å; E504-K512 WeakPolarHBondContact O-CA 3.41Å; N510-K512 PolarHBondContact O-N 2.69Å
513	E	86.9	Confident	85.2	Confident	76 Å²	76	67.3 Å²	67.3	36%	0.355	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	157.3	173.3	-57.6	-169.8	158.1	0	0	109.5	Q503 E504 V506 K511	Q503-E513 WeakPolarHBondContact CA-O 3.37Å; E504-E513 PolarHBondContact N-O 3.45Å; E504-E513 PolarHBondContact O-N 2.88Å; V506-E513 HydrophobicContact CG2-CB 3.87Å; V506-E513 HydrophobicContact CG2-CG 3.96Å; V506-E513 WeakPolarHBondContact CG2-OE2 3.49Å; K511-E513 HydrophobicContact CD-CG 4.38Å; K511-E513 VanDerWaalsContact CD-OE1 3.28Å; K511-E513 WeakPolarHBondContact CD-OE1 3.26Å; K511-E513 WeakPolarHBondContact CE-OE1 3.29Å; K511-E513 HydrophobicContact CG-CG 4.34Å; K511-E513 IonicContact NZ-OE1 3.19Å; K511-E513 PolarHBondContact NZ-OE1 3.41Å
514	W	90	Very high	85	Confident	35 Å²	35	67.4 Å²	67.4	13%	0.133	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	125.7	-179.9	-75.2	98.9	0	0	0	109.8	T502 Q503 M518 G519 L522 E538 R539 Y542	T502-W514 VanDerWaalsContact C-CE3 3.47Å; T502-W514 WeakPolarHBondContact O-CA 3.34Å; Q503-W514 HydrophobicContact CG-CD2 3.82Å; Q503-W514 HydrophobicContact CG-CE3 4.05Å; Q503-W514 HydrophobicContact CG-CG 4.5Å; Q503-W514 HydrophobicContact CG-CH2 3.87Å; Q503-W514 HydrophobicContact CG-CZ2 3.62Å; Q503-W514 HydrophobicContact CG-CZ3 4.08Å; W514-M518 HydrophobicContact CB-CB 4.18Å; W514-M518 HydrophobicContact CD2-CB 4.16Å; W514-M518 HydrophobicContact CD2-CE 4.19Å; W514-M518 HydrophobicContact CE3-CB 3.7Å; W514-M518 HydrophobicContact CE3-CE 4.14Å; W514-M518 HydrophobicContact CE3-CG 3.94Å; W514-M518 HydrophobicContact CG-CB 4.41Å; W514-M518 HydrophobicContact CH2-CE 4.26Å; W514-M518 HydrophobicContact CZ2-CE 4.3Å; W514-M518 HydrophobicContact CZ3-CB 4.39Å; W514-M518 HydrophobicContact CZ3-CE 4.17Å; W514-M518 HydrophobicContact CZ3-CG 4.13Å; W514-G519 WeakPolarHBondContact O-CA 3.3Å; W514-L522 HydrophobicContact CB-CD1 4.2Å; W514-L522 HydrophobicContact CG-CD1 3.79Å; W514-E538 HydrophobicContact CH2-CB 4.48Å; W514-E538 WeakPolarHBondContact CZ2-O 3.41Å; W514-R539 HydrophobicContact CH2-CB 4.45Å; W514-R539 HydrophobicContact CH2-CG 3.72Å; W514-R539 HydrophobicContact CZ3-CG 3.91Å; W514-Y542 AromaticContact CE2-CD2 3.9Å; W514-Y542 AromaticContact CZ2-CD2 3.57Å; W514-Y542 HydrophobicContact CZ2-CD2 3.57Å; W514-Y542 AromaticContact CZ2-CE2 3.88Å; W514-Y542 HydrophobicContact CZ2-CE2 3.88Å; W514-Y542 HydrophobicContact CZ2-CG 4.26Å; W514-Y542 AromaticContact NE1-CD1 3.69Å; W514-Y542 AromaticContact NE1-CD2 3.62Å; W514-Y542 AromaticContact NE1-CE1 3.95Å; W514-Y542 AromaticContact NE1-CE2 3.89Å; W514-Y542 AromaticContact NE1-CG 3.52Å
515	N	90.1	Very high	85.2	Confident	23 Å²	23	69 Å²	69	12%	0.123	37%	0.367	C	S	.	.			trans	-88.8	-177.2	168	71.8	8.6	0	0	0	111.5	G501 T502 E504 G519 Q702	G501-N515 WeakPolarHBondContact CA-O 3.45Å; G501-N515 WeakPolarHBondContact CA-OD1 3.39Å; T502-N515 PolarHBondContact N-OD1 3.28Å; T502-N515 PolarHBondContact O-N 3.18Å; T502-N515 VanDerWaalsContact O-N 3.09Å; T502-N515 PolarHBondContact O-OD1 2.82Å; T502-N515 PolarHBondContact OG1-OD1 3.11Å; E504-N515 PolarHBondContact OE2-ND2 3.11Å; N515-G519 PolarHBondContact O-N 2.68Å; N515-G519 VanDerWaalsContact O-N 3.07Å; N515-Q702 PolarHBondContact ND2-OE1 3.16Å
516	G	90.8	Very high	85.7	Confident	4 Å²	4	60.6 Å²	60.6	4%	0.041	34%	0.335	C	S	.	.	H	α-helix	trans	59.2	-159.6	176.2	0	0	0	0	0	116.4	D497 K499 M518 G519 E520	D497-G516 WeakPolarHBondContact OD1-CA 3.32Å; D497-G516 VanDerWaalsContact OD2-CA 3.3Å; D497-G516 WeakPolarHBondContact OD2-CA 3.37Å; D497-G516 PolarHBondContact OD2-N 3.47Å; K499-G516 WeakPolarHBondContact O-CA 3.45Å; G516-M518 PolarHBondContact O-N 2.84Å; G516-M518 VanDerWaalsContact O-N 3.1Å; G516-G519 WeakPolarHBondContact O-CA 3.43Å; G516-G519 PolarHBondContact O-N 3.31Å; G516-E520 PolarHBondContact O-N 3.06Å; G516-E520 VanDerWaalsContact O-N 3.14Å
517	M	93.1	Very high	86.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-53.5	-32.7	178.2	-67.2	-172.7	-74.2	0	0	112.9	V419 I421 V495 K499 F500 L521 I529 A531 L533	V419-M517 HydrophobicContact CG1-CB 4.22Å; V419-M517 HydrophobicContact CG1-CG 4.31Å; V419-M517 HydrophobicContact CG2-CG 3.99Å; I421-M517 HydrophobicContact CB-CE 3.8Å; I421-M517 HydrophobicContact CB-SD 3.84Å; I421-M517 HydrophobicContact CD1-CE 4.27Å; I421-M517 HydrophobicContact CG2-CE 3.54Å; I421-M517 HydrophobicContact CG2-SD 4.01Å; V495-M517 HydrophobicContact CB-CG 3.73Å; V495-M517 HydrophobicContact CG1-CG 4.06Å; V495-M517 HydrophobicContact CG2-CG 3.9Å; K499-M517 PolarHBondContact O-N 2.81Å; F500-M517 HydrophobicContact CB-CE 4.4Å; F500-M517 HydrophobicContact CD1-CE 3.65Å; F500-M517 HydrophobicContact CE1-CE 4.31Å; F500-M517 HydrophobicContact CG-CE 4.28Å; M517-L521 WeakPolarHBondContact O-CB 3.4Å; M517-L521 PolarHBondContact O-N 3.28Å; M517-I529 HydrophobicContact CB-CD1 4.05Å; M517-I529 HydrophobicContact CB-CG1 4.28Å; M517-I529 HydrophobicContact CB-CG2 4.25Å; M517-I529 HydrophobicContact CE-CG2 4.28Å; M517-I529 HydrophobicContact SD-CG2 3.61Å; M517-A531 HydrophobicContact CE-CB 3.81Å; M517-A531 HydrophobicContact SD-CB 3.79Å; M517-L533 HydrophobicContact CE-CD1 4.48Å
518	M	93.5	Very high	87.4	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-41.2	173.7	-72.1	-66.3	-50.5	0	0	112.5	W514 G516 L522 I529 R539 I543	W514-M518 HydrophobicContact CB-CB 4.18Å; W514-M518 HydrophobicContact CD2-CB 4.16Å; W514-M518 HydrophobicContact CD2-CE 4.19Å; W514-M518 HydrophobicContact CE3-CB 3.7Å; W514-M518 HydrophobicContact CE3-CE 4.14Å; W514-M518 HydrophobicContact CE3-CG 3.94Å; W514-M518 HydrophobicContact CG-CB 4.41Å; W514-M518 HydrophobicContact CH2-CE 4.26Å; W514-M518 HydrophobicContact CZ2-CE 4.3Å; W514-M518 HydrophobicContact CZ3-CB 4.39Å; W514-M518 HydrophobicContact CZ3-CE 4.17Å; W514-M518 HydrophobicContact CZ3-CG 4.13Å; G516-M518 PolarHBondContact O-N 2.84Å; G516-M518 VanDerWaalsContact O-N 3.1Å; M518-L522 HydrophobicContact CE-CD1 4.39Å; M518-L522 WeakPolarHBondContact O-CB 3.39Å; M518-L522 VanDerWaalsContact O-CG 3.26Å; M518-L522 WeakPolarHBondContact O-CG 3.41Å; M518-L522 PolarHBondContact O-N 2.98Å; M518-L522 VanDerWaalsContact O-N 3.16Å; M518-I529 HydrophobicContact SD-CD1 4.47Å; M518-R539 HydrophobicContact CE-CB 3.91Å; M518-R539 HydrophobicContact CE-CG 3.8Å; M518-R539 HydrophobicContact CG-CG 4.26Å; M518-R539 HydrophobicContact SD-CB 4.03Å; M518-R539 HydrophobicContact SD-CG 3.64Å; M518-I543 HydrophobicContact CE-CB 4.45Å; M518-I543 HydrophobicContact CE-CD1 4.04Å; M518-I543 HydrophobicContact CE-CG1 3.97Å; M518-I543 HydrophobicContact CE-CG2 3.66Å; M518-I543 HydrophobicContact SD-CD1 3.65Å; M518-I543 HydrophobicContact SD-CG1 4.26Å; M518-I543 HydrophobicContact SD-CG2 4.48Å
519	G	92.2	Very high	88.7	Confident	20 Å²	20	44.4 Å²	44.4	21%	0.206	25%	0.247	C	C	.	.	H	α-helix	trans	-65.3	-47.4	175.5	0	0	0	0	0	112.1	W514 N515 G516 L521 L522 G523	W514-G519 WeakPolarHBondContact O-CA 3.3Å; N515-G519 PolarHBondContact O-N 2.68Å; N515-G519 VanDerWaalsContact O-N 3.07Å; G516-G519 WeakPolarHBondContact O-CA 3.43Å; G516-G519 PolarHBondContact O-N 3.31Å; G519-L521 PolarHBondContact O-N 3Å; G519-L522 PolarHBondContact O-N 3.45Å; G519-G523 PolarHBondContact O-N 3.08Å
520	E	92.8	Very high	89.7	Confident	23 Å²	23	42.3 Å²	42.3	11%	0.107	23%	0.232	C	C	.	.	H	α-helix	trans	-63.5	-41.1	179.7	-66	-172.4	-160	0	0	113	V419 H493 V495 A496 G516 G523 G524 L525 A526	V419-E520 WeakPolarHBondContact CG2-OE2 3.49Å; H493-E520 IonicContact CD2-OE2 2.89Å; H493-E520 PolarHBondContact CD2-OE2 3.44Å; H493-E520 IonicContact CE1-OE2 3.95Å; H493-E520 IonicContact NE2-OE2 2.76Å; H493-E520 PolarHBondContact NE2-OE2 2.94Å; V495-E520 WeakPolarHBondContact CA-OE1 3.5Å; V495-E520 WeakPolarHBondContact CG2-OE1 3.35Å; A496-E520 PolarHBondContact N-OE1 2.95Å; G516-E520 PolarHBondContact O-N 3.06Å; G516-E520 VanDerWaalsContact O-N 3.14Å; E520-G523 PolarHBondContact O-N 2.97Å; E520-G524 PolarHBondContact O-N 3.08Å; E520-L525 HydrophobicContact CB-CB 4.24Å; E520-L525 HydrophobicContact CG-CD1 4.26Å; E520-L525 PolarHBondContact O-N 2.68Å; E520-A526 PolarHBondContact O-N 2.7Å
521	L	93.3	Very high	90.5	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-39.7	175.1	179.2	65.8	0	0	0	112.4	M517 G519 A526 D527 I529 I543 R779	M517-L521 WeakPolarHBondContact O-CB 3.4Å; M517-L521 PolarHBondContact O-N 3.28Å; G519-L521 PolarHBondContact O-N 3Å; L521-A526 WeakPolarHBondContact CD1-O 3.27Å; L521-D527 VanDerWaalsContact CD1-C 3.47Å; L521-D527 WeakPolarHBondContact CD1-O 3.03Å; L521-I529 HydrophobicContact CB-CD1 3.91Å; L521-I529 HydrophobicContact CB-CG1 4.06Å; L521-I529 HydrophobicContact CD2-CD1 3.45Å; L521-I529 VanDerWaalsContact CD2-CD1 3.45Å; L521-I529 HydrophobicContact CD2-CG1 3.82Å; L521-I529 HydrophobicContact CG-CD1 4.25Å; L521-I529 HydrophobicContact CG-CG1 4.35Å; L521-I543 HydrophobicContact CD2-CB 4.18Å; L521-I543 HydrophobicContact CD2-CD1 4.19Å; L521-I543 HydrophobicContact CD2-CG2 3.69Å; L521-I543 HydrophobicContact CG-CG2 4.46Å; L521-R779 HydrophobicContact CD1-CG 3.76Å; L521-R779 HydrophobicContact CG-CG 4.17Å; L521-R779 WeakPolarHBondContact O-CD 3.02Å; L521-R779 WeakPolarHBondContact O-CG 3.44Å
522	L	90.3	Very high	91.4	Very high	69 Å²	69	28.9 Å²	28.9	36%	0.361	17%	0.166	S	C	.	.	H	α-helix	trans	-78.7	-26.4	178.8	-69.8	172.4	0	0	0	112.8	W514 M518 G519 G524 I543	W514-L522 HydrophobicContact CB-CD1 4.2Å; W514-L522 HydrophobicContact CG-CD1 3.79Å; M518-L522 HydrophobicContact CE-CD1 4.39Å; M518-L522 WeakPolarHBondContact O-CB 3.39Å; M518-L522 VanDerWaalsContact O-CG 3.26Å; M518-L522 WeakPolarHBondContact O-CG 3.41Å; M518-L522 PolarHBondContact O-N 2.98Å; M518-L522 VanDerWaalsContact O-N 3.16Å; G519-L522 PolarHBondContact O-N 3.45Å; L522-G524 VanDerWaalsContact C-N 3.3Å; L522-I543 HydrophobicContact CD2-CG2 3.86Å; L522-I543 HydrophobicContact CG-CG2 4.19Å
523	G	85.8	Confident	92	Very high	50 Å²	50	22.9 Å²	22.9	52%	0.515	14%	0.14	S	C	.	.	H	α-helix	trans	-75.6	-14	171.8	0	0	0	0	0	114.2	G519 E520	G519-G523 PolarHBondContact O-N 3.08Å; E520-G523 PolarHBondContact O-N 2.97Å
524	G	84.6	Confident	92.4	Very high	29 Å²	29	19.3 Å²	19.3	30%	0.299	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	80	15.5	-176.4	0	0	0	0	0	114.4	E520 L522 A526	E520-G524 PolarHBondContact O-N 3.08Å; L522-G524 VanDerWaalsContact C-N 3.3Å; G524-A526 VanDerWaalsContact C-N 3.3Å
525	L	87.6	Confident	92.6	Very high	113 Å²	113	20 Å²	20	59%	0.592	13%	0.13	S	C	*	.	S	Bend	trans	-74.8	-26.3	170.3	-61.2	175.1	0	0	0	111.2	K417 E520	K417-L525 WeakPolarHBondContact CD-O 3.43Å; E520-L525 HydrophobicContact CB-CB 4.24Å; E520-L525 HydrophobicContact CG-CD1 4.26Å; E520-L525 PolarHBondContact O-N 2.68Å
526	A	92.3	Very high	92.7	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	13%	0.128	C	C	.	.			trans	-127	152.7	171.7	0	0	0	0	0	111.3	V419 E520 L521 G524	V419-A526 HydrophobicContact CB-CB 3.75Å; V419-A526 HydrophobicContact CG1-CB 3.59Å; E520-A526 PolarHBondContact O-N 2.7Å; L521-A526 WeakPolarHBondContact CD1-O 3.27Å; G524-A526 VanDerWaalsContact C-N 3.3Å
527	D	91.7	Very high	92.6	Very high	28 Å²	28	24.9 Å²	24.9	15%	0.15	15%	0.154	C	C	.	.	S	Bend	trans	-98	-30.3	175.1	-60.5	-56.5	0	0	0	112.1	L416 K417 L521 R779	L416-D527 HydrophobicContact CD2-CB 4.19Å; K417-D527 PolarHBondContact N-OD2 2.99Å; K417-D527 PolarHBondContact O-N 3.03Å; L521-D527 VanDerWaalsContact CD1-C 3.47Å; L521-D527 WeakPolarHBondContact CD1-O 3.03Å; D527-R779 IonicContact OD1-CZ 2.61Å; D527-R779 IonicContact OD1-NE 2.86Å; D527-R779 IonicContact OD1-NH2 3.2Å; D527-R779 PolarHBondContact OD1-NH2 3.43Å
528	M	95.1	Very high	92.4	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.02	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	139.5	-174.4	-173.5	-176.3	-62.3	0	0	110.7	L416 K417 I418 V419 V530 I776 G777 M778 W784 V788	L416-M528 HydrophobicContact CD1-CE 4.13Å; K417-M528 PolarHBondContact O-N 2.73Å; I418-M528 WeakPolarHBondContact CA-O 3.28Å; I418-M528 HydrophobicContact CD1-CB 3.8Å; I418-M528 HydrophobicContact CD1-CG 4.4Å; I418-M528 HydrophobicContact CD1-SD 4.23Å; V419-M528 PolarHBondContact N-O 2.71Å; V419-M528 VanDerWaalsContact N-O 3.11Å; M528-V530 HydrophobicContact CG-CG2 3.99Å; M528-V530 HydrophobicContact SD-CG2 3.87Å; M528-I776 HydrophobicContact CG-CG2 3.37Å; M528-I776 HydrophobicContact SD-CG2 3.58Å; M528-I776 VanDerWaalsContact SD-CG2 3.58Å; M528-G777 CarbonylContact C-O 3.58Å; M528-G777 WeakPolarHBondContact CA-O 3.44Å; M528-M778 HydrophobicContact CB-CG 4.34Å; M528-M778 HydrophobicContact CE-CG 4.12Å; M528-M778 HydrophobicContact CE-SD 4.05Å; M528-M778 HydrophobicContact CG-CG 3.92Å; M528-W784 HydrophobicContact CE-CB 4.38Å; M528-V788 HydrophobicContact CE-CG2 3.88Å
529	I	97.8	Very high	92.3	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	117.7	172.2	-56.5	165.8	0	0	0	108.4	V419 M517 M518 L521 A531 L533 I776 G777	V419-I529 HydrophobicContact CG1-CB 4.22Å; V419-I529 HydrophobicContact CG1-CG1 3.6Å; V419-I529 HydrophobicContact CG1-CG2 4.38Å; M517-I529 HydrophobicContact CB-CD1 4.05Å; M517-I529 HydrophobicContact CB-CG1 4.28Å; M517-I529 HydrophobicContact CB-CG2 4.25Å; M517-I529 HydrophobicContact CE-CG2 4.28Å; M517-I529 HydrophobicContact SD-CG2 3.61Å; M518-I529 HydrophobicContact SD-CD1 4.47Å; L521-I529 HydrophobicContact CB-CD1 3.91Å; L521-I529 HydrophobicContact CB-CG1 4.06Å; L521-I529 HydrophobicContact CD2-CD1 3.45Å; L521-I529 VanDerWaalsContact CD2-CD1 3.45Å; L521-I529 HydrophobicContact CD2-CG1 3.82Å; L521-I529 HydrophobicContact CG-CD1 4.25Å; L521-I529 HydrophobicContact CG-CG1 4.35Å; I529-A531 HydrophobicContact CG2-CB 3.94Å; I529-L533 HydrophobicContact CB-CD2 4.26Å; I529-L533 HydrophobicContact CD1-CD2 3.77Å; I529-L533 HydrophobicContact CG2-CB 4.5Å; I529-L533 HydrophobicContact CG2-CD2 4.02Å; I529-I776 WeakPolarHBondContact O-CG2 3.43Å; I529-G777 PolarHBondContact N-O 3.38Å; I529-G777 PolarHBondContact O-N 3.24Å
530	V	97.5	Very high	92.2	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.024	17%	0.17	C	C	.	.			trans	-117	89.8	174	-174.3	0	0	0	0	109.3	I418 V419 T420 C475 L479 M528 I776	I418-V530 HydrophobicContact CG2-CB 3.9Å; I418-V530 HydrophobicContact CG2-CG2 3.77Å; V419-V530 PolarHBondContact O-N 3.03Å; V419-V530 VanDerWaalsContact O-N 3.16Å; T420-V530 WeakPolarHBondContact CB-O 3.47Å; T420-V530 PolarHBondContact OG1-O 2.71Å; C475-V530 HydrophobicContact CB-CG1 4.29Å; L479-V530 HydrophobicContact CB-CG1 4.33Å; L479-V530 HydrophobicContact CD1-CG2 4.39Å; M528-V530 HydrophobicContact CG-CG2 3.99Å; M528-V530 HydrophobicContact SD-CG2 3.87Å; V530-I776 HydrophobicContact CG1-CD1 4.44Å; V530-I776 HydrophobicContact CG2-CD1 4.17Å; V530-I776 HydrophobicContact CG2-CG1 4.38Å; V530-I776 HydrophobicContact CG2-CG2 4.21Å
531	A	96.2	Very high	92	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	-153.4	169.7	-172	0	0	0	0	0	109.7	I421 M517 I529 L533	I421-A531 HydrophobicContact CG2-CB 4Å; M517-A531 HydrophobicContact CE-CB 3.81Å; M517-A531 HydrophobicContact SD-CB 3.79Å; I529-A531 HydrophobicContact CG2-CB 3.94Å; A531-L533 PolarHBondContact O-N 3.23Å
532	P	95.3	Very high	91.8	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.019	21%	0.208	C	C	.	.			trans	-69.7	62.7	165.1	30	-34.5	0	0	0	111.3	Q423 F426 F500 T534 F774	Q423-P532 HydrophobicContact CB-CG 4Å; Q423-P532 HydrophobicContact CG-CG 3.76Å; F426-P532 HydrophobicContact CB-CB 4.37Å; F426-P532 HydrophobicContact CB-CG 3.92Å; F426-P532 HydrophobicContact CD1-CB 4.36Å; F426-P532 HydrophobicContact CD2-CB 3.79Å; F426-P532 HydrophobicContact CD2-CG 3.93Å; F426-P532 HydrophobicContact CE2-CB 4.17Å; F426-P532 HydrophobicContact CG-CB 3.9Å; F426-P532 HydrophobicContact CG-CG 3.97Å; F500-P532 HydrophobicContact CE1-CG 4.32Å; F500-P532 WeakPolarHBondContact CE1-O 3.18Å; P532-T534 PolarHBondContact O-N 3.36Å; P532-F774 VanDerWaalsContact C-CD1 3.43Å; P532-F774 HydrophobicContact CB-CD1 4.1Å; P532-F774 HydrophobicContact CB-CD2 3.86Å; P532-F774 HydrophobicContact CB-CE1 4.03Å; P532-F774 HydrophobicContact CB-CE2 3.79Å; P532-F774 HydrophobicContact CB-CG 4.03Å; P532-F774 HydrophobicContact CB-CZ 3.89Å; P532-F774 WeakPolarHBondContact O-CD1 3.49Å; P532-F774 WeakPolarHBondContact O-CE1 3.45Å
533	L	95.6	Very high	92	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.192	C	C	.	.			trans	-87	109.8	-177.4	-176.8	67.1	0	0	0	110.1	M517 I529 A531 I535 I543 F545 F774 G775	M517-L533 HydrophobicContact CE-CD1 4.48Å; I529-L533 HydrophobicContact CB-CD2 4.26Å; I529-L533 HydrophobicContact CD1-CD2 3.77Å; I529-L533 HydrophobicContact CG2-CB 4.5Å; I529-L533 HydrophobicContact CG2-CD2 4.02Å; A531-L533 PolarHBondContact O-N 3.23Å; L533-I535 PolarHBondContact O-N 2.96Å; L533-I543 HydrophobicContact CD2-CD1 4.27Å; L533-F545 HydrophobicContact CD2-CE1 3.79Å; L533-F545 HydrophobicContact CD2-CZ 4.38Å; L533-F545 HydrophobicContact CG-CE1 4.12Å; L533-F774 WeakPolarHBondContact O-CA 3.45Å; L533-G775 PolarHBondContact O-N 2.86Å
534	T	94.9	Very high	92.3	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-61.3	121.2	178.5	-20.7	0	0	0	0	111.1	P532 N536 R539 S704 S772	P532-T534 PolarHBondContact O-N 3.36Å; T534-N536 PolarHBondContact O-N 3.17Å; T534-R539 PolarHBondContact O-NH1 3.38Å; T534-R539 VanDerWaalsContact O-NH1 3.09Å; T534-S704 VanDerWaalsContact OG1-CB 3.32Å; T534-S704 WeakPolarHBondContact OG1-CB 3.46Å; T534-S704 PolarHBondContact OG1-OG 3.05Å; T534-S772 VanDerWaalsContact CG2-OG 3.27Å; T534-S772 WeakPolarHBondContact CG2-OG 3.31Å
535	I	94.5	Very high	92.8	Very high	50 Å²	50	33.9 Å²	33.9	26%	0.256	17%	0.171	S	C	.	.			trans	-67.3	123.4	172.9	-57.8	173.9	0	0	0	108.6	L533 F545 P548 G773	L533-I535 PolarHBondContact O-N 2.96Å; I535-F545 HydrophobicContact CB-CE1 4.5Å; I535-F545 HydrophobicContact CG1-CB 4.44Å; I535-F545 HydrophobicContact CG1-CD1 3.78Å; I535-F545 HydrophobicContact CG1-CE1 4.06Å; I535-F545 HydrophobicContact CG1-CG 4.06Å; I535-F545 HydrophobicContact CG2-CD2 3.95Å; I535-F545 HydrophobicContact CG2-CE2 4.19Å; I535-F545 HydrophobicContact CG2-CG 4.14Å; I535-P548 HydrophobicContact CD1-CB 4.01Å; I535-G773 WeakPolarHBondContact CG1-O 3.26Å; I535-G773 PolarHBondContact N-O 3.37Å
536	N	91	Very high	93.2	Very high	16 Å²	16	28.9 Å²	28.9	9%	0.086	15%	0.146	C	C	.	.			trans	-144.8	161.9	174.9	73.5	28.1	0	0	0	111.9	T534 E538 R539 A540	T534-N536 PolarHBondContact O-N 3.17Å; N536-E538 PolarHBondContact O-N 3.02Å; N536-E538 PolarHBondContact OD1-N 2.8Å; N536-R539 PolarHBondContact O-N 3.45Å; N536-R539 VanDerWaalsContact OD1-CB 3.29Å; N536-R539 WeakPolarHBondContact OD1-CB 3.46Å; N536-R539 VanDerWaalsContact OD1-CG 3.26Å; N536-R539 WeakPolarHBondContact OD1-CG 3.32Å; N536-R539 PolarHBondContact OD1-N 3.12Å; N536-A540 WeakPolarHBondContact O-CB 3.43Å; N536-A540 PolarHBondContact O-N 3.16Å
537	N	89.8	Confident	93.4	Very high	112 Å²	112	34.4 Å²	34.4	60%	0.599	17%	0.169	S	C	*	.	H	α-helix	trans	-62.3	-40.9	-177.2	-172.4	-1.2	0	0	0	112.2	R539 A540 Q541	N537-R539 PolarHBondContact O-N 3.29Å; N537-A540 PolarHBondContact O-N 3.33Å; N537-Q541 WeakPolarHBondContact O-CG 3.16Å; N537-Q541 PolarHBondContact O-N 3.1Å; N537-Q541 VanDerWaalsContact O-N 3.12Å; N537-Q541 PolarHBondContact OD1-NE2 3.36Å
538	E	87.9	Confident	93.6	Very high	43 Å²	43	34.1 Å²	34.1	20%	0.201	17%	0.169	C	C	.	.	H	α-helix	trans	-62.6	-40	-178.1	-70.5	168.3	-134.4	0	0	112.5	W514 N536 Y542 I707 R711	W514-E538 HydrophobicContact CH2-CB 4.48Å; W514-E538 WeakPolarHBondContact CZ2-O 3.41Å; N536-E538 PolarHBondContact O-N 3.02Å; N536-E538 PolarHBondContact OD1-N 2.8Å; E538-Y542 VanDerWaalsContact O-CD2 3.28Å; E538-Y542 WeakPolarHBondContact O-CD2 3.11Å; E538-I707 WeakPolarHBondContact OE1-CG2 3.37Å; E538-I707 WeakPolarHBondContact OE2-CG2 3.4Å; E538-R711 IonicContact OE1-NH1 2.7Å; E538-R711 PolarHBondContact OE1-NH1 2.88Å
539	R	91.8	Very high	93.6	Very high	1 Å²	1	34 Å²	34	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-74.4	-40.9	174.2	-67.3	174	176.2	151.8	-3.5	111.6	G501 W514 M518 T534 N536 N537 Q541 Y542 I543 F545	G501-R539 PolarHBondContact O-NE 3.18Å; G501-R539 PolarHBondContact O-NH2 3.03Å; W514-R539 HydrophobicContact CH2-CB 4.45Å; W514-R539 HydrophobicContact CH2-CG 3.72Å; W514-R539 HydrophobicContact CZ3-CG 3.91Å; M518-R539 HydrophobicContact CE-CB 3.91Å; M518-R539 HydrophobicContact CE-CG 3.8Å; M518-R539 HydrophobicContact CG-CG 4.26Å; M518-R539 HydrophobicContact SD-CB 4.03Å; M518-R539 HydrophobicContact SD-CG 3.64Å; T534-R539 PolarHBondContact O-NH1 3.38Å; T534-R539 VanDerWaalsContact O-NH1 3.09Å; N536-R539 PolarHBondContact O-N 3.45Å; N536-R539 VanDerWaalsContact OD1-CB 3.29Å; N536-R539 WeakPolarHBondContact OD1-CB 3.46Å; N536-R539 VanDerWaalsContact OD1-CG 3.26Å; N536-R539 WeakPolarHBondContact OD1-CG 3.32Å; N536-R539 PolarHBondContact OD1-N 3.12Å; N537-R539 PolarHBondContact O-N 3.29Å; R539-Q541 PolarHBondContact O-N 3.11Å; R539-Q541 VanDerWaalsContact O-N 3.13Å; R539-Y542 PolarHBondContact O-N 3.35Å; R539-I543 HydrophobicContact CB-CG1 4.31Å; R539-I543 WeakPolarHBondContact O-CG1 3.44Å; R539-I543 PolarHBondContact O-N 2.83Å; R539-F545 HydrophobicContact CB-CE2 3.81Å; R539-F545 HydrophobicContact CB-CZ 3.79Å
540	A	90.7	Very high	93.5	Very high	40 Å²	40	35.3 Å²	35.3	33%	0.331	18%	0.175	S	C	.	.	H	α-helix	trans	-62.9	-18.5	179	0	0	0	0	0	113.9	N536 N537 Y542 I543 F545 K780	N536-A540 WeakPolarHBondContact O-CB 3.43Å; N536-A540 PolarHBondContact O-N 3.16Å; N537-A540 PolarHBondContact O-N 3.33Å; A540-Y542 PolarHBondContact O-N 2.99Å; A540-I543 WeakPolarHBondContact CA-O 2.98Å; A540-F545 HydrophobicContact CB-CD2 4.17Å; A540-F545 HydrophobicContact CB-CE2 4.21Å; A540-K780 VanDerWaalsContact O-CE 3.32Å; A540-K780 WeakPolarHBondContact O-CE 3.45Å; A540-K780 PolarHBondContact O-NZ 3.39Å
541	Q	89	Confident	93.3	Very high	112 Å²	112	43 Å²	43	52%	0.523	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.9	170.1	-73.6	170	30.1	0	0	113.3	N537 R539 K780	N537-Q541 WeakPolarHBondContact O-CG 3.16Å; N537-Q541 PolarHBondContact O-N 3.1Å; N537-Q541 VanDerWaalsContact O-N 3.12Å; N537-Q541 PolarHBondContact OD1-NE2 3.36Å; R539-Q541 PolarHBondContact O-N 3.11Å; R539-Q541 VanDerWaalsContact O-N 3.13Å; Q541-K780 PolarHBondContact O-NZ 3.11Å
542	Y	89.2	Confident	93.2	Very high	100 Å²	100	43.4 Å²	43.4	39%	0.392	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-34.9	-176.4	-61	-96.1	0	0	0	114	Q503 W514 E538 R539 A540 K780	Q503-Y542 PolarHBondContact NE2-OH 3.27Å; W514-Y542 AromaticContact CE2-CD2 3.9Å; W514-Y542 AromaticContact CZ2-CD2 3.57Å; W514-Y542 HydrophobicContact CZ2-CD2 3.57Å; W514-Y542 AromaticContact CZ2-CE2 3.88Å; W514-Y542 HydrophobicContact CZ2-CE2 3.88Å; W514-Y542 HydrophobicContact CZ2-CG 4.26Å; W514-Y542 AromaticContact NE1-CD1 3.69Å; W514-Y542 AromaticContact NE1-CD2 3.62Å; W514-Y542 AromaticContact NE1-CE1 3.95Å; W514-Y542 AromaticContact NE1-CE2 3.89Å; W514-Y542 AromaticContact NE1-CG 3.52Å; E538-Y542 VanDerWaalsContact O-CD2 3.28Å; E538-Y542 WeakPolarHBondContact O-CD2 3.11Å; R539-Y542 PolarHBondContact O-N 3.35Å; A540-Y542 PolarHBondContact O-N 2.99Å; Y542-K780 WeakPolarHBondContact O-CD 3.45Å; Y542-K780 WeakPolarHBondContact O-CG 3.49Å
543	I	93	Very high	93.2	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	161.8	179.8	68.8	160.6	0	0	0	111.2	M518 L521 L522 L533 R539 A540 F545 M778	M518-I543 HydrophobicContact CE-CB 4.45Å; M518-I543 HydrophobicContact CE-CD1 4.04Å; M518-I543 HydrophobicContact CE-CG1 3.97Å; M518-I543 HydrophobicContact CE-CG2 3.66Å; M518-I543 HydrophobicContact SD-CD1 3.65Å; M518-I543 HydrophobicContact SD-CG1 4.26Å; M518-I543 HydrophobicContact SD-CG2 4.48Å; L521-I543 HydrophobicContact CD2-CB 4.18Å; L521-I543 HydrophobicContact CD2-CD1 4.19Å; L521-I543 HydrophobicContact CD2-CG2 3.69Å; L521-I543 HydrophobicContact CG-CG2 4.46Å; L522-I543 HydrophobicContact CD2-CG2 3.86Å; L522-I543 HydrophobicContact CG-CG2 4.19Å; L533-I543 HydrophobicContact CD2-CD1 4.27Å; R539-I543 HydrophobicContact CB-CG1 4.31Å; R539-I543 WeakPolarHBondContact O-CG1 3.44Å; R539-I543 PolarHBondContact O-N 2.83Å; A540-I543 WeakPolarHBondContact CA-O 2.98Å; I543-F545 HydrophobicContact CD1-CD1 4.45Å; I543-F545 HydrophobicContact CD1-CE1 3.94Å; I543-F545 HydrophobicContact CD1-CE2 4.08Å; I543-F545 HydrophobicContact CD1-CZ 3.74Å; I543-F545 HydrophobicContact CG1-CD2 4.46Å; I543-F545 HydrophobicContact CG1-CE2 4.05Å; I543-F545 HydrophobicContact CG1-CZ 4.21Å; I543-M778 WeakPolarHBondContact CB-O 3.39Å
544	E	92	Very high	93.2	Very high	64 Å²	64	43.2 Å²	43.2	30%	0.299	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132	173.3	-170.5	72.8	-178.6	0	0	109.4	M778 K780 K785	E544-M778 PolarHBondContact N-O 2.85Å; E544-M778 PolarHBondContact O-N 2.77Å; E544-K780 HydrophobicContact CB-CG 4.35Å; E544-K785 HydrophobicContact CG-CD 3.69Å; E544-K785 HydrophobicContact CG-CG 3.65Å; E544-K785 VanDerWaalsContact OE1-CE 3.27Å; E544-K785 WeakPolarHBondContact OE1-CE 3.32Å; E544-K785 IonicContact OE1-NZ 3.29Å; E544-K785 PolarHBondContact OE1-NZ 3.03Å
545	F	95.9	Very high	93.2	Very high	20 Å²	20	43.4 Å²	43.4	9%	0.088	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	148.5	177.2	-74.7	-79.4	0	0	0	112	L533 I535 R539 A540 I543 K785	L533-F545 HydrophobicContact CD2-CE1 3.79Å; L533-F545 HydrophobicContact CD2-CZ 4.38Å; L533-F545 HydrophobicContact CG-CE1 4.12Å; I535-F545 HydrophobicContact CB-CE1 4.5Å; I535-F545 HydrophobicContact CG1-CB 4.44Å; I535-F545 HydrophobicContact CG1-CD1 3.78Å; I535-F545 HydrophobicContact CG1-CE1 4.06Å; I535-F545 HydrophobicContact CG1-CG 4.06Å; I535-F545 HydrophobicContact CG2-CD2 3.95Å; I535-F545 HydrophobicContact CG2-CE2 4.19Å; I535-F545 HydrophobicContact CG2-CG 4.14Å; R539-F545 HydrophobicContact CB-CE2 3.81Å; R539-F545 HydrophobicContact CB-CZ 3.79Å; A540-F545 HydrophobicContact CB-CD2 4.17Å; A540-F545 HydrophobicContact CB-CE2 4.21Å; I543-F545 HydrophobicContact CD1-CD1 4.45Å; I543-F545 HydrophobicContact CD1-CE1 3.94Å; I543-F545 HydrophobicContact CD1-CE2 4.08Å; I543-F545 HydrophobicContact CD1-CZ 3.74Å; I543-F545 HydrophobicContact CG1-CD2 4.46Å; I543-F545 HydrophobicContact CG1-CE2 4.05Å; I543-F545 HydrophobicContact CG1-CZ 4.21Å; F545-K785 WeakPolarHBondContact O-CE 3.27Å
546	S	96	Very high	93.2	Very high	8 Å²	8	41 Å²	41	6%	0.056	19%	0.194	C	C	.	.			trans	-66.8	174.8	162.4	73.5	0	0	0	0	111.9	I776 I792	S546-I776 PolarHBondContact N-O 2.99Å; S546-I776 PolarHBondContact OG-N 3.35Å; S546-I792 WeakPolarHBondContact OG-CD1 3.41Å
547	K	95.8	Very high	93.3	Very high	115 Å²	115	40.2 Å²	40.2	50%	0.5	19%	0.19	S	C	.	.	S	Bend	trans	-59.7	147	157.7	-66.5	-65.5	-175	175.9	0	110	L793	K547-L793 HydrophobicContact CB-CD2 4.45Å; K547-L793 HydrophobicContact CB-CG 4.47Å; K547-L793 HydrophobicContact CG-CD1 4.23Å; K547-L793 HydrophobicContact CG-CD2 4.36Å; K547-L793 HydrophobicContact CG-CG 4.25Å
548	P	96.8	Very high	93.5	Very high	23 Å²	23	35.6 Å²	35.6	15%	0.149	17%	0.165	C	C	.	.			trans	-67	134.2	-177.9	26.5	-34.1	0	0	0	111.5	I535 Y551 F774 H796	I535-P548 HydrophobicContact CD1-CB 4.01Å; P548-Y551 HydrophobicContact CB-CE1 4.28Å; P548-Y551 HydrophobicContact CG-CD1 4.36Å; P548-Y551 HydrophobicContact CG-CE1 3.57Å; P548-F774 CarbonylContact C-O 3.49Å; P548-F774 WeakPolarHBondContact CA-O 3.41Å; P548-H796 PolarHBondContact O-NE2 2.92Å; P548-H796 VanDerWaalsContact O-NE2 3.14Å
549	F	96	Very high	93.6	Very high	1 Å²	1	37.2 Å²	37.2	0%	0.004	17%	0.172	C	C	.	.	S	Bend	trans	-89	-28.5	176.7	66.6	-101.8	0	0	0	112.1	F426 F474 L478 F774 I776 I792 H796 M801	F426-F549 HydrophobicContact CE1-CE2 4.32Å; F474-F549 HydrophobicContact CD1-CE2 4.24Å; F474-F549 AromaticContact CE1-CD2 3.62Å; F474-F549 HydrophobicContact CE1-CD2 3.62Å; F474-F549 AromaticContact CE1-CE2 3.7Å; F474-F549 HydrophobicContact CE1-CE2 3.7Å; F474-F549 HydrophobicContact CZ-CD2 4.28Å; L478-F549 HydrophobicContact CD2-CB 4.05Å; L478-F549 HydrophobicContact CD2-CD1 4.27Å; L478-F549 HydrophobicContact CD2-CD2 4.19Å; L478-F549 HydrophobicContact CD2-CG 3.94Å; F549-F774 HydrophobicContact CD1-CB 4.37Å; F549-F774 WeakPolarHBondContact CD1-O 3.36Å; F549-F774 HydrophobicContact CE1-CB 3.68Å; F549-F774 HydrophobicContact CE2-CB 3.91Å; F549-F774 HydrophobicContact CE2-CD2 4.48Å; F549-F774 HydrophobicContact CZ-CB 3.43Å; F549-F774 VanDerWaalsContact CZ-CB 3.43Å; F549-F774 HydrophobicContact CZ-CG 4.36Å; F549-F774 PolarHBondContact N-O 3.17Å; F549-I776 HydrophobicContact CD1-CG1 4.47Å; F549-I792 HydrophobicContact CB-CG2 4.12Å; F549-H796 PolarHBondContact O-CE1 3.13Å; F549-H796 PolarHBondContact O-NE2 3.41Å; F549-M801 HydrophobicContact CB-CE 3.88Å; F549-M801 HydrophobicContact CB-SD 4.08Å; F549-M801 VanDerWaalsContact O-CG 3.3Å; F549-M801 WeakPolarHBondContact O-CG 3.3Å
550	K	94.7	Very high	93.2	Very high	28 Å²	28	41 Å²	41	12%	0.122	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	129	174	178.1	75.6	-174.9	-163	0	109.3	G773 F774 D805	K550-G773 CarbonylContact O-C 3.56Å; K550-G773 WeakPolarHBondContact O-CA 3.41Å; K550-F774 HydrophobicContact CB-CD2 4.15Å; K550-F774 HydrophobicContact CG-CD2 4.27Å; K550-F774 PolarHBondContact O-N 2.85Å; K550-D805 IonicContact NZ-OD1 2.74Å; K550-D805 PolarHBondContact NZ-OD1 2.96Å; K550-D805 IonicContact NZ-OD2 2.71Å; K550-D805 PolarHBondContact NZ-OD2 3.17Å
551	Y	94.3	Very high	92.4	Very high	164 Å²	164	47 Å²	47	64%	0.643	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	142.6	167.8	-64.2	-79.5	0	0	0	109.8	P548	P548-Y551 HydrophobicContact CB-CE1 4.28Å; P548-Y551 HydrophobicContact CG-CD1 4.36Å; P548-Y551 HydrophobicContact CG-CE1 3.57Å
552	Q	93.6	Very high	91.5	Very high	9 Å²	9	48.1 Å²	48.1	4%	0.042	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	177.6	-173.5	78.5	100.4	28.8	0	0	111.2	D748 R771 S772 F774	Q552-D748 VanDerWaalsContact NE2-CG 3.27Å; Q552-D748 PolarHBondContact NE2-OD1 2.85Å; Q552-D748 PolarHBondContact OE1-OD1 2.94Å; Q552-R771 WeakPolarHBondContact O-CA 3.45Å; Q552-S772 PolarHBondContact N-O 2.85Å; Q552-S772 PolarHBondContact NE2-OG 3Å; Q552-S772 PolarHBondContact O-N 3.44Å; Q552-F774 HydrophobicContact CG-CE1 4.23Å; Q552-F774 HydrophobicContact CG-CE2 4.3Å; Q552-F774 HydrophobicContact CG-CZ 4.04Å
553	G	94.5	Very high	90.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	177.5	169.4	0	0	0	0	0	110.9	S749	G553-S749 WeakPolarHBondContact O-CB 3.38Å; G553-S749 PolarHBondContact O-N 2.82Å
554	L	95.1	Very high	88.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	137.7	173.4	-57.4	-178.8	0	0	0	110.4	V705 Y708 W747 D748 F769 F770	L554-V705 HydrophobicContact CD1-CG1 4.09Å; L554-V705 HydrophobicContact CD2-CG2 3.7Å; L554-Y708 HydrophobicContact CD1-CD1 4.24Å; L554-W747 WeakPolarHBondContact CA-O 3.34Å; L554-D748 VanDerWaalsContact CD2-OD1 3.26Å; L554-D748 WeakPolarHBondContact CD2-OD1 3.37Å; L554-F769 HydrophobicContact CB-CD1 4.21Å; L554-F769 HydrophobicContact CB-CD2 3.95Å; L554-F769 HydrophobicContact CB-CE1 3.89Å; L554-F769 HydrophobicContact CB-CE2 3.62Å; L554-F769 HydrophobicContact CB-CG 4.24Å; L554-F769 HydrophobicContact CB-CZ 3.6Å; L554-F769 HydrophobicContact CD1-CD2 4.23Å; L554-F769 HydrophobicContact CD1-CE2 3.7Å; L554-F769 HydrophobicContact CD1-CZ 4.3Å; L554-F769 HydrophobicContact CG-CE2 4.29Å; L554-F769 PolarHBondContact N-O 3.27Å; L554-F769 VanDerWaalsContact O-CD1 3.24Å; L554-F769 WeakPolarHBondContact O-CD1 3.26Å; L554-F769 PolarHBondContact O-N 2.92Å; L554-F770 HydrophobicContact CD1-CB 3.97Å; L554-F770 HydrophobicContact CD1-CD1 3.83Å; L554-F770 HydrophobicContact CD1-CG 4.33Å; L554-F770 HydrophobicContact CG-CB 4.14Å; L554-F770 HydrophobicContact CG-CD1 4Å
555	T	94.9	Very high	87.1	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.025	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	174.1	170.2	-170.2	0	0	0	0	109.7	W747 L752 T764 T765	T555-W747 PolarHBondContact N-O 3.09Å; T555-W747 VanDerWaalsContact N-O 3.12Å; T555-W747 PolarHBondContact O-N 3.36Å; T555-L752 HydrophobicContact CG2-CB 3.9Å; T555-L752 HydrophobicContact CG2-CD1 3.59Å; T555-L752 HydrophobicContact CG2-CG 4.29Å; T555-T764 HydrophobicContact CG2-CG2 3.7Å; T555-T765 PolarHBondContact OG1-O 3.02Å
556	I	95.4	Very high	85.8	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	113.1	-173.9	-47.2	-170.8	0	0	0	108.6	V558 I680 L688 A744 I746 T764 T765 F769	I556-V558 HydrophobicContact CG2-CG1 4.32Å; I556-I680 HydrophobicContact CD1-CG2 4.26Å; I556-I680 HydrophobicContact CG2-CD1 4.07Å; I556-L688 HydrophobicContact CD1-CD1 3.46Å; I556-L688 VanDerWaalsContact CD1-CD1 3.46Å; I556-A744 HydrophobicContact CG2-CB 3.73Å; I556-I746 HydrophobicContact CG1-CG1 4.32Å; I556-I746 HydrophobicContact CG2-CG1 4.4Å; I556-T764 CarbonylContact O-C 3.49Å; I556-T764 WeakPolarHBondContact O-CA 3.29Å; I556-T765 PolarHBondContact N-O 3.27Å; I556-T765 PolarHBondContact O-N 3.48Å; I556-T765 PolarHBondContact O-OG1 3.43Å; I556-F769 HydrophobicContact CD1-CE1 4.37Å; I556-F769 HydrophobicContact CG1-CE1 4.06Å
557	L	94	Very high	84.4	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	126.2	174.1	-170.5	76.7	0	0	0	109.3	I734 A744 F745 L752 L762 T764	L557-I734 HydrophobicContact CD2-CG1 4.1Å; L557-I734 HydrophobicContact CD2-CG2 4.43Å; L557-A744 WeakPolarHBondContact O-CA 3.42Å; L557-F745 HydrophobicContact CB-CB 4.33Å; L557-F745 HydrophobicContact CD2-CD1 4.18Å; L557-F745 PolarHBondContact N-O 3.39Å; L557-F745 PolarHBondContact O-N 3.4Å; L557-L752 HydrophobicContact CB-CD1 3.95Å; L557-L752 HydrophobicContact CB-CD2 3.95Å; L557-L752 HydrophobicContact CB-CG 4.4Å; L557-L752 HydrophobicContact CD1-CB 4.36Å; L557-L752 HydrophobicContact CD1-CD2 4.37Å; L557-L752 HydrophobicContact CD2-CD2 3.93Å; L557-L752 HydrophobicContact CG-CD2 4.31Å; L557-L762 HydrophobicContact CD1-CB 3.88Å; L557-L762 HydrophobicContact CD1-CD1 4.38Å; L557-L762 HydrophobicContact CD2-CD1 3.96Å; L557-L762 HydrophobicContact CG-CB 4.35Å; L557-L762 HydrophobicContact CG-CD1 4.43Å; L557-T764 HydrophobicContact CD1-CG2 4.39Å
558	V	92.4	Very high	83.2	Confident	14 Å²	14	63.9 Å²	63.9	9%	0.085	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	161.2	172	-57.9	0	0	0	0	110.1	I556 I680 A744 L762 V763 T765	I556-V558 HydrophobicContact CG2-CG1 4.32Å; V558-I680 HydrophobicContact CG1-CD1 3.5Å; V558-I680 VanDerWaalsContact CG1-CD1 3.5Å; V558-I680 HydrophobicContact CG1-CG1 4.29Å; V558-A744 HydrophobicContact CG1-CB 4.02Å; V558-L762 WeakPolarHBondContact O-CA 3.42Å; V558-V763 HydrophobicContact CG2-CG2 3.69Å; V558-V763 PolarHBondContact N-O 3.13Å; V558-V763 PolarHBondContact O-N 2.62Å; V558-T765 HydrophobicContact CG2-CG2 3.64Å
559	K	90.3	Very high	82.1	Confident	77 Å²	77	63.7 Å²	63.7	34%	0.335	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	141.2	172.6	-165.8	172.6	-178.9	169.6	0	111	E561 V737 R738 N740 L762	K559-E561 PolarHBondContact O-N 2.65Å; K559-V737 HydrophobicContact CB-CG1 4.16Å; K559-R738 PolarHBondContact NZ-O 3.27Å; K559-N740 WeakPolarHBondContact CD-OD1 3.39Å; K559-N740 WeakPolarHBondContact CE-OD1 3.39Å; K559-N740 PolarHBondContact NZ-OD1 2.9Å; K559-L762 HydrophobicContact CB-CD2 4.39Å
560	K	84.3	Confident	81.3	Confident	82 Å²	82	65.7 Å²	65.7	36%	0.357	32%	0.317	S	S	.	.			trans	-78.2	99.5	171.6	-174.4	-179.8	177.7	-179.9	0	108.9	D761 V763	K560-D761 WeakPolarHBondContact CB-O 3.49Å; K560-D761 PolarHBondContact N-O 3.27Å; K560-V763 HydrophobicContact CB-CG1 4.25Å; K560-V763 HydrophobicContact CD-CG1 4.37Å; K560-V763 HydrophobicContact CG-CG1 4.48Å
561	E	73.9	Confident	80.7	Confident	165 Å²	165	68.7 Å²	68.7	77%	0.771	33%	0.332	S	S	*	.			trans	-66.2	136.2	171.5	-60.1	-159.5	152.9	0	0	110.7	K559	K559-E561 PolarHBondContact O-N 2.65Å
562	I	69.4	Low	80	Confident	136 Å²	136	64.4 Å²	64.4	70%	0.697	32%	0.318	S	S	*	.			trans	-107.8	120.8	175.2	-56.4	175.2	0	0	0	106.1	R564	I562-R564 PolarHBondContact O-N 3.48Å
563	P	62.4	Low	79.6	Confident	94 Å²	94	64.3 Å²	64.3	61%	0.61	32%	0.318	S	S	*	.			trans	-62.2	133.2	-179.9	26.3	-33.9	0	0	0	110
564	R	58.8	Low	79.4	Confident	238 Å²	238	65.4 Å²	65.4	90%	0.898	32%	0.323	S	S	*	.			trans	-104.8	115.7	175.6	-70	-179.6	176.2	169.4	-1.4	109.1	I562	I562-R564 PolarHBondContact O-N 3.48Å
565	S	61.2	Low	79	Confident	42 Å²	42	72.1 Å²	72.1	29%	0.294	36%	0.355	S	S	.	.			trans	-70.4	148.2	173	50.2	0	0	0	0	112	N828	S565-N828 VanDerWaalsContact CB-CG 3.4Å; S565-N828 VanDerWaalsContact CB-ND2 3.35Å; S565-N828 WeakPolarHBondContact CB-ND2 3.47Å; S565-N828 WeakPolarHBondContact CB-OD1 3.44Å; S565-N828 PolarHBondContact OG-OD1 3.06Å
566	T	67.3	Low	78.7	Confident	66 Å²	66	76.1 Å²	76.1	41%	0.405	38%	0.383	S	S	.	.			trans	-104.3	148.3	175.6	61.5	0	0	0	0	110.9	D568 S569 Q572	T566-D568 WeakPolarHBondContact CB-OD1 3.44Å; T566-D568 PolarHBondContact O-N 3.1Å; T566-D568 VanDerWaalsContact O-N 3.13Å; T566-D568 PolarHBondContact OG1-OD1 2.78Å; T566-S569 PolarHBondContact O-N 3.06Å; T566-S569 PolarHBondContact O-OG 3.38Å; T566-Q572 PolarHBondContact OG1-NE2 2.67Å; T566-Q572 VanDerWaalsContact OG1-NE2 3.14Å
567	L	66.9	Low	78.5	Confident	119 Å²	119	79.3 Å²	79.3	62%	0.623	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-10.7	-173.5	-66.5	172.4	0	0	0	114.1	A830	L567-A830 HydrophobicContact CD2-CB 3.91Å
568	D	70.7	Confident	78.3	Confident	79 Å²	79	82.3 Å²	82.3	42%	0.422	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	0.1	177.8	69.3	-47	0	0	0	113.9	T566 F570 M571 Q572	T566-D568 WeakPolarHBondContact CB-OD1 3.44Å; T566-D568 PolarHBondContact O-N 3.1Å; T566-D568 VanDerWaalsContact O-N 3.13Å; T566-D568 PolarHBondContact OG1-OD1 2.78Å; D568-F570 PolarHBondContact O-N 3.14Å; D568-M571 PolarHBondContact O-N 3.48Å; D568-Q572 VanDerWaalsContact CG-NE2 3.25Å; D568-Q572 PolarHBondContact O-N 2.86Å; D568-Q572 PolarHBondContact OD1-NE2 2.74Å; D568-Q572 PolarHBondContact OD2-NE2 3.48Å
569	S	73.2	Confident	78.2	Confident	19 Å²	19	86.8 Å²	86.8	13%	0.133	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-26.2	-176	-67.5	0	0	0	0	115	T566	T566-S569 PolarHBondContact O-N 3.06Å; T566-S569 PolarHBondContact O-OG 3.38Å
570	F	79.3	Confident	78.2	Confident	43 Å²	43	89.5 Å²	89.5	19%	0.189	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-20.1	176.1	80.4	-86	0	0	0	114.3	D568 Y663 V832 L835	D568-F570 PolarHBondContact O-N 3.14Å; F570-Y663 PolarHBondContact O-OH 3.3Å; F570-V832 HydrophobicContact CB-CG2 3.82Å; F570-V832 HydrophobicContact CD1-CG2 3.81Å; F570-V832 HydrophobicContact CD2-CG2 3.83Å; F570-V832 HydrophobicContact CE1-CG2 4.3Å; F570-V832 HydrophobicContact CE2-CG2 4.31Å; F570-V832 HydrophobicContact CG-CG2 3.53Å; F570-L835 HydrophobicContact CE2-CD1 4.31Å; F570-L835 HydrophobicContact CZ-CD1 4.15Å
571	M	82.8	Confident	78.6	Confident	92 Å²	92	90.8 Å²	90.8	45%	0.453	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-29.7	174.8	-71.3	-168.4	168	0	0	112.2	D568 P573 F574 W579	D568-M571 PolarHBondContact O-N 3.48Å; M571-P573 VanDerWaalsContact C-N 3.31Å; M571-P573 VanDerWaalsContact O-N 3.14Å; M571-F574 PolarHBondContact O-N 2.92Å; M571-F574 VanDerWaalsContact O-N 3.13Å; M571-W579 PolarHBondContact O-NE1 3.04Å
572	Q	79.8	Confident	79.4	Confident	73 Å²	73	83.5 Å²	83.5	34%	0.341	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-33	-177.1	-70.9	172.6	-0.7	0	0	116.1	T566 D568 F574	T566-Q572 PolarHBondContact OG1-NE2 2.67Å; T566-Q572 VanDerWaalsContact OG1-NE2 3.14Å; D568-Q572 VanDerWaalsContact CG-NE2 3.25Å; D568-Q572 PolarHBondContact O-N 2.86Å; D568-Q572 PolarHBondContact OD1-NE2 2.74Å; D568-Q572 PolarHBondContact OD2-NE2 3.48Å; Q572-F574 PolarHBondContact O-N 3.07Å; Q572-F574 VanDerWaalsContact O-N 3.09Å
573	P	86.1	Confident	80.4	Confident	7 Å²	7	78 Å²	78	5%	0.045	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.1	177.2	-26.7	36.2	0	0	0	115.6	M571 Y663 N666 L667	M571-P573 VanDerWaalsContact C-N 3.31Å; M571-P573 VanDerWaalsContact O-N 3.14Å; P573-Y663 HydrophobicContact CB-CD2 3.88Å; P573-Y663 HydrophobicContact CB-CE2 3.84Å; P573-Y663 HydrophobicContact CG-CD2 4.41Å; P573-Y663 HydrophobicContact CG-CE2 3.87Å; P573-N666 HydrophobicContact CB-CB 4.48Å; P573-N666 PolarHBondContact O-ND2 3.33Å; P573-L667 HydrophobicContact CG-CB 4.09Å; P573-L667 HydrophobicContact CG-CD1 4Å
574	F	88.4	Confident	81.9	Confident	24 Å²	24	78.7 Å²	78.7	11%	0.105	40%	0.403	C	S	.	.	S	Bend	trans	-134.5	138.8	172.1	-71.6	-31	0	0	0	111.4	M571 Q572 L578 W579 I659 Y663	M571-F574 PolarHBondContact O-N 2.92Å; M571-F574 VanDerWaalsContact O-N 3.13Å; Q572-F574 PolarHBondContact O-N 3.07Å; Q572-F574 VanDerWaalsContact O-N 3.09Å; F574-L578 HydrophobicContact CB-CD2 4.15Å; F574-L578 HydrophobicContact CD1-CD2 3.63Å; F574-L578 HydrophobicContact CD2-CD2 4.45Å; F574-L578 HydrophobicContact CE1-CD2 4.08Å; F574-L578 HydrophobicContact CG-CD2 3.85Å; F574-W579 HydrophobicContact CB-CZ2 4.45Å; F574-W579 HydrophobicContact CD2-CH2 4.27Å; F574-W579 AromaticContact CD2-CZ2 3.96Å; F574-W579 HydrophobicContact CD2-CZ2 3.96Å; F574-W579 PolarHBondContact O-NE1 2.93Å; F574-I659 HydrophobicContact CE2-CG2 4.04Å; F574-I659 HydrophobicContact CZ-CG2 4.3Å; F574-Y663 HydrophobicContact CD2-CD2 4.12Å; F574-Y663 HydrophobicContact CE2-CD2 4.08Å; F574-Y663 HydrophobicContact CE2-CG 4.39Å
575	Q	88.6	Confident	83.4	Confident	141 Å²	141	69 Å²	69	66%	0.659	37%	0.371	S	S	*	.			trans	-59.7	143.5	173.5	-161.8	-178.5	22.5	0	0	110.6	T577 L578 W579	Q575-T577 VanDerWaalsContact CG-OG1 3.27Å; Q575-T577 WeakPolarHBondContact CG-OG1 3.43Å; Q575-T577 PolarHBondContact O-N 2.9Å; Q575-T577 VanDerWaalsContact O-N 3.11Å; Q575-T577 PolarHBondContact OE1-OG1 2.91Å; Q575-L578 WeakPolarHBondContact O-CA 3.37Å; Q575-L578 WeakPolarHBondContact O-CB 3.38Å; Q575-L578 PolarHBondContact O-N 3.22Å; Q575-W579 PolarHBondContact O-N 2.94Å
576	S	86.7	Confident	84.9	Confident	88 Å²	88	67 Å²	67	62%	0.615	36%	0.357	S	S	*	.	H	α-helix	trans	-55.6	-29.9	179.6	52.7	0	0	0	0	113.9	L580	S576-L580 WeakPolarHBondContact O-CG 3.36Å; S576-L580 PolarHBondContact O-N 3.3Å
577	T	91.4	Very high	86	Confident	66 Å²	66	67.8 Å²	67.8	41%	0.405	36%	0.357	S	S	.	.	H	α-helix	trans	-61.2	-42.3	170.3	47.7	0	0	0	0	112.7	Q575 L580 L581	Q575-T577 VanDerWaalsContact CG-OG1 3.27Å; Q575-T577 WeakPolarHBondContact CG-OG1 3.43Å; Q575-T577 PolarHBondContact O-N 2.9Å; Q575-T577 VanDerWaalsContact O-N 3.11Å; Q575-T577 PolarHBondContact OE1-OG1 2.91Å; T577-L580 PolarHBondContact O-N 3.09Å; T577-L581 WeakPolarHBondContact O-CG 3.46Å; T577-L581 PolarHBondContact O-N 3.17Å
578	L	91.3	Very high	87.2	Confident	64 Å²	64	65.8 Å²	65.8	34%	0.335	35%	0.349	S	S	.	.	H	α-helix	trans	-70.2	-40.1	180	-175.9	60.8	0	0	0	111.4	F574 Q575 L580 L581 V582	F574-L578 HydrophobicContact CB-CD2 4.15Å; F574-L578 HydrophobicContact CD1-CD2 3.63Å; F574-L578 HydrophobicContact CD2-CD2 4.45Å; F574-L578 HydrophobicContact CE1-CD2 4.08Å; F574-L578 HydrophobicContact CG-CD2 3.85Å; Q575-L578 WeakPolarHBondContact O-CA 3.37Å; Q575-L578 WeakPolarHBondContact O-CB 3.38Å; Q575-L578 PolarHBondContact O-N 3.22Å; L578-L580 VanDerWaalsContact C-N 3.3Å; L578-L580 PolarHBondContact O-N 2.67Å; L578-L581 PolarHBondContact O-N 2.91Å; L578-V582 HydrophobicContact CD1-CG2 4.31Å; L578-V582 HydrophobicContact CG-CG2 4.46Å; L578-V582 WeakPolarHBondContact O-CG2 3.22Å; L578-V582 PolarHBondContact O-N 3.14Å
579	W	89.9	Confident	88.2	Confident	107 Å²	107	63.1 Å²	63.1	41%	0.405	34%	0.335	S	S	.	.	H	α-helix	trans	-55.8	-44.1	172.2	-77.1	112.2	0	0	0	112.1	M571 F574 Q575 G583 Y663	M571-W579 PolarHBondContact O-NE1 3.04Å; F574-W579 HydrophobicContact CB-CZ2 4.45Å; F574-W579 HydrophobicContact CD2-CH2 4.27Å; F574-W579 AromaticContact CD2-CZ2 3.96Å; F574-W579 HydrophobicContact CD2-CZ2 3.96Å; F574-W579 PolarHBondContact O-NE1 2.93Å; Q575-W579 PolarHBondContact O-N 2.94Å; W579-G583 PolarHBondContact O-N 3.45Å; W579-Y663 HydrophobicContact CH2-CD2 4.46Å; W579-Y663 HydrophobicContact CH2-CE2 4.42Å; W579-Y663 HydrophobicContact CZ2-CD2 4.3Å; W579-Y663 HydrophobicContact CZ2-CE2 4.12Å
580	L	90.8	Very high	89	Confident	134 Å²	134	62.2 Å²	62.2	70%	0.702	33%	0.329	S	S	*	.	H	α-helix	trans	-68	-39.1	176.2	-68.1	171.7	0	0	0	112.6	S576 T577 L578 G583 L584	S576-L580 WeakPolarHBondContact O-CG 3.36Å; S576-L580 PolarHBondContact O-N 3.3Å; T577-L580 PolarHBondContact O-N 3.09Å; L578-L580 VanDerWaalsContact C-N 3.3Å; L578-L580 PolarHBondContact O-N 2.67Å; L580-G583 PolarHBondContact O-N 3.04Å; L580-L584 WeakPolarHBondContact O-CB 3.21Å; L580-L584 PolarHBondContact O-N 2.92Å
581	L	92	Very high	89.5	Confident	109 Å²	109	62.9 Å²	62.9	57%	0.571	34%	0.337	S	S	*	.	H	α-helix	trans	-67.6	-38.9	177.2	-74.3	168.6	0	0	0	112.8	T577 L578 L584 S585	T577-L581 WeakPolarHBondContact O-CG 3.46Å; T577-L581 PolarHBondContact O-N 3.17Å; L578-L581 PolarHBondContact O-N 2.91Å; L581-L584 PolarHBondContact O-N 3.37Å; L581-S585 WeakPolarHBondContact O-CB 3.42Å; L581-S585 PolarHBondContact O-N 3.22Å
582	V	91.4	Very high	89.8	Confident	12 Å²	12	63.1 Å²	63.1	7%	0.073	34%	0.338	C	S	.	.	H	α-helix	trans	-65.4	-46.6	172.2	172.5	0	0	0	0	110.1	L578 L584 S585 V586 L630 I659	L578-V582 HydrophobicContact CD1-CG2 4.31Å; L578-V582 HydrophobicContact CG-CG2 4.46Å; L578-V582 WeakPolarHBondContact O-CG2 3.22Å; L578-V582 PolarHBondContact O-N 3.14Å; V582-L584 VanDerWaalsContact C-N 3.27Å; V582-L584 PolarHBondContact O-N 3.47Å; V582-S585 PolarHBondContact O-N 3.23Å; V582-S585 VanDerWaalsContact O-N 3.16Å; V582-S585 PolarHBondContact O-OG 3.4Å; V582-V586 WeakPolarHBondContact O-CG2 3.49Å; V582-V586 PolarHBondContact O-N 3.11Å; V582-L630 HydrophobicContact CG1-CD1 4.44Å; V582-L630 HydrophobicContact CG1-CD2 3.81Å; V582-I659 HydrophobicContact CG2-CD1 4.27Å
583	G	90.2	Very high	90.1	Very high	22 Å²	22	59.8 Å²	59.8	23%	0.227	32%	0.322	C	S	.	.	H	α-helix	trans	-57.6	-38.4	174.8	0	0	0	0	0	113.1	W579 L580 H587	W579-G583 PolarHBondContact O-N 3.45Å; L580-G583 PolarHBondContact O-N 3.04Å; G583-H587 PolarHBondContact O-ND1 3.33Å
584	L	92.3	Very high	90.1	Very high	108 Å²	108	62.9 Å²	62.9	57%	0.565	33%	0.334	S	S	*	.	H	α-helix	trans	-69.8	-41.8	175.2	-177	61.8	0	0	0	112.3	L580 L581 V582 V586 H587 V588	L580-L584 WeakPolarHBondContact O-CB 3.21Å; L580-L584 PolarHBondContact O-N 2.92Å; L581-L584 PolarHBondContact O-N 3.37Å; V582-L584 VanDerWaalsContact C-N 3.27Å; V582-L584 PolarHBondContact O-N 3.47Å; L584-V586 VanDerWaalsContact C-N 3.34Å; L584-V586 PolarHBondContact O-N 2.92Å; L584-H587 PolarHBondContact O-N 3.06Å; L584-H587 VanDerWaalsContact O-N 3.13Å; L584-V588 PolarHBondContact O-N 2.73Å; L584-V588 VanDerWaalsContact O-N 3.09Å
585	S	91.8	Very high	89.9	Confident	33 Å²	33	64.7 Å²	64.7	23%	0.231	34%	0.344	C	S	.	.	H	α-helix	trans	-64.7	-35.9	-177.5	74	0	0	0	0	112.6	L581 V582 H587 V588 V589	L581-S585 WeakPolarHBondContact O-CB 3.42Å; L581-S585 PolarHBondContact O-N 3.22Å; V582-S585 PolarHBondContact O-N 3.23Å; V582-S585 VanDerWaalsContact O-N 3.16Å; V582-S585 PolarHBondContact O-OG 3.4Å; S585-H587 VanDerWaalsContact C-N 3.28Å; S585-H587 PolarHBondContact O-N 3.01Å; S585-V588 PolarHBondContact O-N 2.82Å; S585-V589 WeakPolarHBondContact O-CB 3.35Å; S585-V589 WeakPolarHBondContact O-CG2 3.31Å; S585-V589 PolarHBondContact O-N 3.43Å
586	V	91.6	Very high	89.6	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-52.6	-46.6	171.2	179.9	0	0	0	0	111.2	V582 L584 V589 A590 W627 L630 W652	V582-V586 WeakPolarHBondContact O-CG2 3.49Å; V582-V586 PolarHBondContact O-N 3.11Å; L584-V586 VanDerWaalsContact C-N 3.34Å; L584-V586 PolarHBondContact O-N 2.92Å; V586-V589 PolarHBondContact O-N 2.96Å; V586-A590 WeakPolarHBondContact O-CB 3.41Å; V586-A590 PolarHBondContact O-N 3.23Å; V586-W627 HydrophobicContact CG1-CD2 3.95Å; V586-W627 HydrophobicContact CG1-CG 3.83Å; V586-L630 HydrophobicContact CG2-CD2 3.45Å; V586-L630 VanDerWaalsContact CG2-CD2 3.45Å; V586-W652 HydrophobicContact CB-CH2 4.31Å; V586-W652 HydrophobicContact CB-CZ2 4.26Å; V586-W652 HydrophobicContact CG1-CZ2 4.48Å; V586-W652 HydrophobicContact CG2-CH2 3.76Å; V586-W652 HydrophobicContact CG2-CZ2 3.75Å
587	H	90.5	Very high	89.2	Confident	84 Å²	84	58 Å²	58	39%	0.389	31%	0.305	S	S	.	.	H	α-helix	trans	-72.4	-37	-177.6	-67.8	88.2	0	0	0	112.2	G583 L584 S585 V591 W627	G583-H587 PolarHBondContact O-ND1 3.33Å; L584-H587 PolarHBondContact O-N 3.06Å; L584-H587 VanDerWaalsContact O-N 3.13Å; S585-H587 VanDerWaalsContact C-N 3.28Å; S585-H587 PolarHBondContact O-N 3.01Å; H587-V591 WeakPolarHBondContact O-CG2 3.29Å; H587-V591 PolarHBondContact O-N 3.39Å; H587-W627 AromaticContact CE1-CZ2 3.99Å; H587-W627 AromaticContact CE1-NE1 3.81Å; H587-W627 AromaticContact NE2-NE1 3.9Å
588	V	92.9	Very high	88.5	Confident	77 Å²	77	61.3 Å²	61.3	47%	0.467	31%	0.311	S	S	.	.	H	α-helix	trans	-63.9	-44.4	173.8	176.4	0	0	0	0	110.7	L584 S585 V591 M592	L584-V588 PolarHBondContact O-N 2.73Å; L584-V588 VanDerWaalsContact O-N 3.09Å; S585-V588 PolarHBondContact O-N 2.82Å; V588-V591 PolarHBondContact O-N 3.04Å; V588-M592 HydrophobicContact CG1-CG 4.48Å; V588-M592 WeakPolarHBondContact O-CB 3.38Å; V588-M592 VanDerWaalsContact O-CG 3.31Å; V588-M592 WeakPolarHBondContact O-CG 3.45Å; V588-M592 PolarHBondContact O-N 2.98Å
589	V	91.3	Very high	87.7	Confident	22 Å²	22	65.7 Å²	65.7	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-66	-42.4	177.6	171.7	0	0	0	0	111.4	S585 V586 V591 M592 L593 W652	S585-V589 WeakPolarHBondContact O-CB 3.35Å; S585-V589 WeakPolarHBondContact O-CG2 3.31Å; S585-V589 PolarHBondContact O-N 3.43Å; V586-V589 PolarHBondContact O-N 2.96Å; V589-V591 VanDerWaalsContact C-N 3.35Å; V589-V591 PolarHBondContact O-N 2.69Å; V589-M592 PolarHBondContact O-N 2.98Å; V589-L593 HydrophobicContact CG1-CD1 3.85Å; V589-L593 HydrophobicContact CG1-CG 4.23Å; V589-L593 WeakPolarHBondContact O-CB 3.21Å; V589-L593 WeakPolarHBondContact O-CG 3.19Å; V589-L593 PolarHBondContact O-N 3.18Å; V589-W652 HydrophobicContact CB-CD2 4.39Å; V589-W652 HydrophobicContact CB-CE3 4.25Å; V589-W652 HydrophobicContact CG1-CB 4.24Å; V589-W652 HydrophobicContact CG1-CD2 3.92Å; V589-W652 HydrophobicContact CG1-CE3 4.17Å; V589-W652 HydrophobicContact CG1-CG 3.93Å; V589-W652 HydrophobicContact CG2-CD2 4.35Å; V589-W652 HydrophobicContact CG2-CE3 3.76Å; V589-W652 HydrophobicContact CG2-CZ3 3.98Å
590	A	89.4	Confident	86.7	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.008	31%	0.313	C	S	.	.	H	α-helix	trans	-58.4	-43.9	174.9	0	0	0	0	0	112.7	V586 Y594 M623 S626	V586-A590 WeakPolarHBondContact O-CB 3.41Å; V586-A590 PolarHBondContact O-N 3.23Å; A590-Y594 WeakPolarHBondContact O-CB 3.23Å; A590-Y594 PolarHBondContact O-N 2.95Å; A590-M623 HydrophobicContact CB-CB 4.44Å; A590-M623 HydrophobicContact CB-CG 3.89Å; A590-S626 WeakPolarHBondContact CA-OG 3.28Å; A590-S626 WeakPolarHBondContact CB-OG 3.41Å
591	V	90.3	Very high	85.3	Confident	57 Å²	57	59.3 Å²	59.3	35%	0.345	31%	0.308	S	S	.	.	H	α-helix	trans	-66.5	-42.1	175.8	170.6	0	0	0	0	111.1	H587 V588 V589 Y594 L595 L619	H587-V591 WeakPolarHBondContact O-CG2 3.29Å; H587-V591 PolarHBondContact O-N 3.39Å; V588-V591 PolarHBondContact O-N 3.04Å; V589-V591 VanDerWaalsContact C-N 3.35Å; V589-V591 PolarHBondContact O-N 2.69Å; V591-Y594 PolarHBondContact O-N 2.9Å; V591-L595 HydrophobicContact CG1-CD1 3.75Å; V591-L595 HydrophobicContact CG1-CG 4.27Å; V591-L595 WeakPolarHBondContact O-CB 3.49Å; V591-L595 VanDerWaalsContact O-CG 3.24Å; V591-L595 WeakPolarHBondContact O-CG 3.35Å; V591-L595 PolarHBondContact O-N 2.73Å; V591-L619 HydrophobicContact CG2-CD1 4.2Å
592	M	88.8	Confident	83.6	Confident	96 Å²	96	61.7 Å²	61.7	47%	0.473	31%	0.314	S	S	.	.	H	α-helix	trans	-67.3	-39.4	178.5	-71.9	-63.8	177.4	0	0	112.8	V588 V589 L595 L596 L648	V588-M592 HydrophobicContact CG1-CG 4.48Å; V588-M592 WeakPolarHBondContact O-CB 3.38Å; V588-M592 VanDerWaalsContact O-CG 3.31Å; V588-M592 WeakPolarHBondContact O-CG 3.45Å; V588-M592 PolarHBondContact O-N 2.98Å; V589-M592 PolarHBondContact O-N 2.98Å; M592-L595 PolarHBondContact O-N 3.45Å; M592-L595 HydrophobicContact SD-CD1 4.39Å; M592-L596 VanDerWaalsContact O-CB 3.31Å; M592-L596 WeakPolarHBondContact O-CB 3.34Å; M592-L596 VanDerWaalsContact O-CG 3.24Å; M592-L596 WeakPolarHBondContact O-CG 3.24Å; M592-L596 PolarHBondContact O-N 3.38Å; M592-L648 HydrophobicContact CB-CD2 4.06Å
593	L	86.8	Confident	81.8	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-60.3	-47.4	172.3	-74.6	169.1	0	0	0	111.1	V589 L595 L596 D597 F625 A645 L648	V589-L593 HydrophobicContact CG1-CD1 3.85Å; V589-L593 HydrophobicContact CG1-CG 4.23Å; V589-L593 WeakPolarHBondContact O-CB 3.21Å; V589-L593 WeakPolarHBondContact O-CG 3.19Å; V589-L593 PolarHBondContact O-N 3.18Å; L593-L595 PolarHBondContact O-N 3.49Å; L593-L596 PolarHBondContact O-N 3.11Å; L593-D597 WeakPolarHBondContact O-CB 3.34Å; L593-D597 PolarHBondContact O-N 2.98Å; L593-F625 HydrophobicContact CD1-CD1 3.82Å; L593-F625 HydrophobicContact CD1-CE1 3.96Å; L593-A645 HydrophobicContact CD2-CB 3.9Å; L593-A645 WeakPolarHBondContact CD2-O 3.35Å; L593-L648 HydrophobicContact CD2-CB 4.04Å; L593-L648 HydrophobicContact CD2-CD2 3.87Å; L593-L648 HydrophobicContact CD2-CG 4.01Å; L593-L648 HydrophobicContact CG-CD2 4.02Å; L593-L648 HydrophobicContact CG-CG 4.43Å
594	Y	86	Confident	80.1	Confident	72 Å²	72	69.3 Å²	69.3	28%	0.282	34%	0.339	S	S	.	.	H	α-helix	trans	-59	-46.4	175.7	171.5	-105.7	0	0	0	112.5	A590 V591 R598 L617 L619	A590-Y594 WeakPolarHBondContact O-CB 3.23Å; A590-Y594 PolarHBondContact O-N 2.95Å; V591-Y594 PolarHBondContact O-N 2.9Å; Y594-R598 WeakPolarHBondContact O-CB 3.43Å; Y594-R598 PolarHBondContact O-N 3.3Å; Y594-L617 WeakPolarHBondContact CD2-O 3.28Å; Y594-L619 HydrophobicContact CD1-CD1 4.07Å; Y594-L619 HydrophobicContact CD2-CB 4.22Å; Y594-L619 HydrophobicContact CE2-CB 4.4Å; Y594-L619 HydrophobicContact CG-CB 4.31Å; Y594-L619 HydrophobicContact CG-CD1 4.01Å
595	L	84.1	Confident	77.9	Confident	62 Å²	62	71.1 Å²	71.1	33%	0.325	34%	0.342	S	S	.	.	H	α-helix	trans	-65.7	-45.7	179.1	-68.4	169.3	0	0	0	111.8	V591 M592 L593 R598 F599	V591-L595 HydrophobicContact CG1-CD1 3.75Å; V591-L595 HydrophobicContact CG1-CG 4.27Å; V591-L595 WeakPolarHBondContact O-CB 3.49Å; V591-L595 VanDerWaalsContact O-CG 3.24Å; V591-L595 WeakPolarHBondContact O-CG 3.35Å; V591-L595 PolarHBondContact O-N 2.73Å; M592-L595 PolarHBondContact O-N 3.45Å; M592-L595 HydrophobicContact SD-CD1 4.39Å; L593-L595 PolarHBondContact O-N 3.49Å; L595-R598 PolarHBondContact O-N 3.3Å; L595-F599 HydrophobicContact CB-CD2 4.42Å; L595-F599 HydrophobicContact CD2-CD2 4.37Å; L595-F599 HydrophobicContact CD2-CE2 3.86Å; L595-F599 WeakPolarHBondContact O-CB 3.4Å; L595-F599 VanDerWaalsContact O-CD2 3.24Å; L595-F599 WeakPolarHBondContact O-CD2 3.44Å; L595-F599 PolarHBondContact O-N 3.12Å
596	L	82.8	Confident	75.6	Confident	68 Å²	68	77.9 Å²	77.9	36%	0.356	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-44.8	179.6	-74.1	171	0	0	0	111.9	M592 L593 S600 L648	M592-L596 VanDerWaalsContact O-CB 3.31Å; M592-L596 WeakPolarHBondContact O-CB 3.34Å; M592-L596 VanDerWaalsContact O-CG 3.24Å; M592-L596 WeakPolarHBondContact O-CG 3.24Å; M592-L596 PolarHBondContact O-N 3.38Å; L593-L596 PolarHBondContact O-N 3.11Å; L596-S600 WeakPolarHBondContact O-CB 3.5Å; L596-S600 PolarHBondContact O-N 2.83Å; L596-L648 HydrophobicContact CD1-CD2 3.69Å
597	D	78.3	Confident	73.3	Confident	20 Å²	20	84 Å²	84	11%	0.107	41%	0.405	C	S	.	.	H	α-helix	trans	-70.3	-33.9	179.2	-141.5	64.4	0	0	0	111.9	L593 L617 R641 S642	L593-D597 WeakPolarHBondContact O-CB 3.34Å; L593-D597 PolarHBondContact O-N 2.98Å; D597-L617 HydrophobicContact CB-CD1 4.28Å; D597-R641 PolarHBondContact OD1-N 3.36Å; D597-S642 WeakPolarHBondContact OD1-CB 3.3Å; D597-S642 PolarHBondContact OD1-N 2.76Å; D597-S642 PolarHBondContact OD1-OG 3.02Å
598	R	75.4	Confident	71.1	Confident	137 Å²	137	87.3 Å²	87.3	52%	0.517	43%	0.426	S	S	.	.	H	α-helix	trans	-71.3	-33.5	177.9	-175	58.9	176.7	179.6	-0.7	114.1	Y594 L595	Y594-R598 WeakPolarHBondContact O-CB 3.43Å; Y594-R598 PolarHBondContact O-N 3.3Å; L595-R598 PolarHBondContact O-N 3.3Å
599	F	74.6	Confident	68.6	Low	156 Å²	156	88 Å²	88	68%	0.684	43%	0.433	S	S	*	.	H	α-helix	trans	-101.3	-15.2	-177.3	-71.6	-63	0	0	0	114.7	L595	L595-F599 HydrophobicContact CB-CD2 4.42Å; L595-F599 HydrophobicContact CD2-CD2 4.37Å; L595-F599 HydrophobicContact CD2-CE2 3.86Å; L595-F599 WeakPolarHBondContact O-CB 3.4Å; L595-F599 VanDerWaalsContact O-CD2 3.24Å; L595-F599 WeakPolarHBondContact O-CD2 3.44Å; L595-F599 PolarHBondContact O-N 3.12Å
600	S	69.8	Low	66.4	Low	16 Å²	16	97 Å²	97	11%	0.112	47%	0.474	C	S	.	.			trans	-63.9	123.1	177.6	-175.4	0	0	0	0	111.5	L596 F602 G603	L596-S600 WeakPolarHBondContact O-CB 3.5Å; L596-S600 PolarHBondContact O-N 2.83Å; S600-F602 PolarHBondContact O-N 3.17Å; S600-G603 PolarHBondContact O-N 2.74Å; S600-G603 VanDerWaalsContact O-N 3.13Å
601	P	61	Low	64.3	Low	91 Å²	91	105 Å²	105	59%	0.591	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-64.5	-28.1	-179	25.6	-33.7	0	0	0	112.3	G603 R604	P601-G603 VanDerWaalsContact C-N 3.32Å; P601-G603 PolarHBondContact O-N 2.9Å; P601-R604 PolarHBondContact O-N 2.66Å
602	F	55.6	Low	62.1	Low	158 Å²	158	111.3 Å²	111.3	69%	0.693	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-74.2	-19.9	178.2	-64.1	-75.3	0	0	0	113.6	S600 R604	S600-F602 PolarHBondContact O-N 3.17Å; F602-R604 PolarHBondContact O-N 3.35Å
603	G	55.4	Low	60.1	Low	14 Å²	14	115.9 Å²	115.9	14%	0.144	56%	0.558	C	S	.	*	G	3₁₀ helix	trans	-63.4	-23.4	174.6	0	0	0	0	0	113.4	S600 P601 R641	S600-G603 PolarHBondContact O-N 2.74Å; S600-G603 VanDerWaalsContact O-N 3.13Å; P601-G603 VanDerWaalsContact C-N 3.32Å; P601-G603 PolarHBondContact O-N 2.9Å; G603-R641 PolarHBondContact O-NE 2.98Å; G603-R641 VanDerWaalsContact O-NE 3.16Å
604	R	54	Low	58.5	Low	181 Å²	181	123.7 Å²	123.7	68%	0.683	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-96.5	-1	-174.6	-64.7	-171.9	-173.2	171.8	7.2	115.7	P601 F602 K606	P601-R604 PolarHBondContact O-N 2.66Å; F602-R604 PolarHBondContact O-N 3.35Å; R604-K606 PolarHBondContact O-N 3.05Å
605	F	45.9	Very low	57.1	Low	145 Å²	145	127.8 Å²	127.8	64%	0.636	62%	0.62	S	S	*	*			trans	-71.4	106.3	174.8	-89.9	-90.8	0	0	0	110.2	R641	F605-R641 PolarHBondContact O-NH2 2.78Å; F605-R641 VanDerWaalsContact O-NH2 3.09Å
606	K	44	Very low	55.9	Low	175 Å²	175	128.1 Å²	128.1	76%	0.761	63%	0.632	S	S	*	*			trans	-72.7	122	156.9	-82.7	-163.5	171.9	-162.2	0	108.1	R604	R604-K606 PolarHBondContact O-N 3.05Å
607	V	42.9	Very low	55.2	Low	130 Å²	130	126 Å²	126	79%	0.788	62%	0.621	S	S	*	*			trans	-93.8	142.3	148.4	178.8	0	0	0	0	105.6	S609	V607-S609 PolarHBondContact O-N 3.4Å
608	N	42.9	Very low	55	Low	153 Å²	153	128 Å²	128	82%	0.818	63%	0.634	S	S	*	*			trans	-79.7	113.1	-173.9	-69.3	-12.4	0	0	0	111.4
609	S	40.9	Very low	55.3	Low	90 Å²	90	124.8 Å²	124.8	63%	0.629	63%	0.627	S	S	*	*			trans	-145.8	138.9	158.6	50	0	0	0	0	108.3	V607 E611	V607-S609 PolarHBondContact O-N 3.4Å; S609-E611 PolarHBondContact O-N 3.1Å
610	E	46.2	Very low	55.7	Low	211 Å²	211	120.7 Å²	120.7	99%	0.986	62%	0.617	S	S	*	*			trans	-90.5	48.3	-175.9	-63.5	-176.1	122.5	0	0	111.6
611	E	45	Very low	56.3	Low	169 Å²	169	120.9 Å²	120.9	79%	0.79	62%	0.619	S	S	*	*	S	Bend	trans	-112.9	162.8	175	-66.5	-179.1	152.2	0	0	109.8	S609	S609-E611 PolarHBondContact O-N 3.1Å
612	E	44.5	Very low	57.4	Low	191 Å²	191	116.6 Å²	116.6	89%	0.893	59%	0.591	S	S	*	*			trans	-51.8	146.1	-152	-58.3	-178	136.9	0	0	116.2	E614	E612-E614 PolarHBondContact O-N 3.13Å
613	E	46.8	Very low	59	Low	192 Å²	192	112.2 Å²	112.2	90%	0.897	57%	0.574	S	S	*	*			trans	-67.5	90.9	-178.7	-68.5	-167.9	117.9	0	0	112	D615	E613-D615 PolarHBondContact O-N 2.84Å
614	E	52.3	Low	60.5	Low	167 Å²	167	119.1 Å²	119.1	78%	0.78	60%	0.596	S	S	*	*			trans	-60.9	97.5	163.2	-76.1	-165.9	151.9	0	0	110.1	E612	E612-E614 PolarHBondContact O-N 3.13Å
615	D	57.2	Low	62	Low	157 Å²	157	112.5 Å²	112.5	84%	0.84	57%	0.572	S	S	*	*			trans	-62.7	136.9	-176.8	-136	-15.5	0	0	0	111.5	E613	E613-D615 PolarHBondContact O-N 2.84Å
616	A	59.3	Low	64	Low	69 Å²	69	105.6 Å²	105.6	57%	0.57	54%	0.542	S	S	*	.			trans	-68	136.9	-172.5	0	0	0	0	0	111.9	T618	A616-T618 PolarHBondContact O-N 2.87Å
617	L	66.3	Low	66.2	Low	25 Å²	25	101.7 Å²	101.7	13%	0.131	52%	0.522	C	S	.	.			trans	-45.3	107.5	-174.1	-95.3	171.7	0	0	0	113.2	Y594 D597 P640	Y594-L617 WeakPolarHBondContact CD2-O 3.28Å; D597-L617 HydrophobicContact CB-CD1 4.28Å; L617-P640 HydrophobicContact CD1-CB 4.44Å
618	T	75.6	Confident	68.4	Low	61 Å²	61	95.9 Å²	95.9	37%	0.374	49%	0.488	S	S	.	.			trans	-75.8	157.1	172.1	72.3	0	0	0	0	110	A616 S620 S621 A622	A616-T618 PolarHBondContact O-N 2.87Å; T618-S620 PolarHBondContact O-N 2.95Å; T618-S620 PolarHBondContact OG1-OG 3.12Å; T618-S621 PolarHBondContact N-OG 2.92Å; T618-S621 PolarHBondContact O-N 3.44Å; T618-S621 VanDerWaalsContact O-N 3.13Å; T618-S621 PolarHBondContact O-OG 3.08Å; T618-S621 PolarHBondContact OG1-N 3.24Å; T618-S621 PolarHBondContact OG1-OG 2.89Å; T618-A622 PolarHBondContact O-N 3.45Å
619	L	80.5	Confident	70.5	Confident	70 Å²	70	90.2 Å²	90.2	37%	0.366	46%	0.459	S	S	.	.	H	α-helix	trans	-56.8	-36.1	174	-177.7	63.1	0	0	0	111.8	V591 Y594 M623	V591-L619 HydrophobicContact CG2-CD1 4.2Å; Y594-L619 HydrophobicContact CD1-CD1 4.07Å; Y594-L619 HydrophobicContact CD2-CB 4.22Å; Y594-L619 HydrophobicContact CE2-CB 4.4Å; Y594-L619 HydrophobicContact CG-CB 4.31Å; Y594-L619 HydrophobicContact CG-CD1 4.01Å; L619-M623 HydrophobicContact CD1-CE 4.05Å; L619-M623 HydrophobicContact CD2-CE 4.1Å; L619-M623 HydrophobicContact CG-CE 3.84Å; L619-M623 HydrophobicContact CG-SD 4.35Å; L619-M623 VanDerWaalsContact O-CG 3.27Å; L619-M623 WeakPolarHBondContact O-CG 3.29Å; L619-M623 PolarHBondContact O-N 3.37Å
620	S	82.7	Confident	72.8	Confident	69 Å²	69	87 Å²	87	48%	0.483	43%	0.434	S	S	.	.	H	α-helix	trans	-63	-46.3	173.7	25.1	0	0	0	0	113.3	T618 M623 W624	T618-S620 PolarHBondContact O-N 2.95Å; T618-S620 PolarHBondContact OG1-OG 3.12Å; S620-M623 PolarHBondContact O-N 2.88Å; S620-W624 VanDerWaalsContact O-CD1 3.23Å; S620-W624 PolarHBondContact O-N 2.8Å
621	S	83.3	Confident	74.9	Confident	21 Å²	21	82.3 Å²	82.3	15%	0.147	42%	0.416	C	S	.	.	H	α-helix	trans	-70.5	-32.4	177.7	38.7	0	0	0	0	112.3	T618 W624 F625	T618-S621 PolarHBondContact N-OG 2.92Å; T618-S621 PolarHBondContact O-N 3.44Å; T618-S621 VanDerWaalsContact O-N 3.13Å; T618-S621 PolarHBondContact O-OG 3.08Å; T618-S621 PolarHBondContact OG1-N 3.24Å; T618-S621 PolarHBondContact OG1-OG 2.89Å; S621-W624 PolarHBondContact O-N 3.44Å; S621-F625 VanDerWaalsContact O-CB 3.28Å; S621-F625 WeakPolarHBondContact O-CB 3.07Å; S621-F625 PolarHBondContact O-N 3.35Å
622	A	85.2	Confident	76.9	Confident	1 Å²	1	79.3 Å²	79.3	1%	0.008	41%	0.405	C	S	.	.	H	α-helix	trans	-66.2	-35.3	170.9	0	0	0	0	0	113.2	T618 S626	T618-A622 PolarHBondContact O-N 3.45Å; A622-S626 WeakPolarHBondContact O-CB 3.33Å; A622-S626 PolarHBondContact O-N 2.97Å; A622-S626 VanDerWaalsContact O-N 3.09Å; A622-S626 PolarHBondContact O-OG 2.04Å
623	M	87.3	Confident	78.8	Confident	65 Å²	65	72.5 Å²	72.5	32%	0.32	38%	0.379	S	S	.	.	H	α-helix	trans	-66.7	-48.3	171.8	-74.7	170.3	174.5	0	0	111.7	A590 L619 S620 S626 W627	A590-M623 HydrophobicContact CB-CB 4.44Å; A590-M623 HydrophobicContact CB-CG 3.89Å; L619-M623 HydrophobicContact CD1-CE 4.05Å; L619-M623 HydrophobicContact CD2-CE 4.1Å; L619-M623 HydrophobicContact CG-CE 3.84Å; L619-M623 HydrophobicContact CG-SD 4.35Å; L619-M623 VanDerWaalsContact O-CG 3.27Å; L619-M623 WeakPolarHBondContact O-CG 3.29Å; L619-M623 PolarHBondContact O-N 3.37Å; S620-M623 PolarHBondContact O-N 2.88Å; M623-S626 PolarHBondContact O-N 2.8Å; M623-W627 PolarHBondContact O-N 2.9Å
624	W	87.5	Confident	80.4	Confident	160 Å²	160	67.5 Å²	67.5	61%	0.606	38%	0.378	S	S	*	.	H	α-helix	trans	-60.6	-44.6	176.5	-80.7	116.7	0	0	0	112.3	S620 S621 S626 W627 G628 I635	S620-W624 VanDerWaalsContact O-CD1 3.23Å; S620-W624 PolarHBondContact O-N 2.8Å; S621-W624 PolarHBondContact O-N 3.44Å; W624-S626 PolarHBondContact O-N 3.13Å; W624-W627 PolarHBondContact O-N 3.38Å; W624-G628 PolarHBondContact O-N 2.96Å; W624-I635 HydrophobicContact CE3-CG2 4.48Å
625	F	86.6	Confident	81.4	Confident	42 Å²	42	64.6 Å²	64.6	18%	0.184	37%	0.367	C	S	.	.	H	α-helix	trans	-56.4	-47.3	173.7	178.2	-91.5	0	0	0	112	L593 S621 G628 V629 P640	L593-F625 HydrophobicContact CD1-CD1 3.82Å; L593-F625 HydrophobicContact CD1-CE1 3.96Å; S621-F625 VanDerWaalsContact O-CB 3.28Å; S621-F625 WeakPolarHBondContact O-CB 3.07Å; S621-F625 PolarHBondContact O-N 3.35Å; F625-G628 PolarHBondContact O-N 2.99Å; F625-V629 HydrophobicContact CE1-CG2 4.3Å; F625-V629 HydrophobicContact CE2-CG2 4.47Å; F625-V629 HydrophobicContact CZ-CG2 4.23Å; F625-V629 WeakPolarHBondContact O-CG2 3.17Å; F625-V629 PolarHBondContact O-N 2.87Å; F625-P640 HydrophobicContact CZ-CG 4.15Å
626	S	88.1	Confident	81.9	Confident	0 Å²	0	59 Å²	59	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-67	-40.4	-177.1	-55	0	0	0	0	112.5	A590 A622 M623 W624 L630 W652	A590-S626 WeakPolarHBondContact CA-OG 3.28Å; A590-S626 WeakPolarHBondContact CB-OG 3.41Å; A622-S626 WeakPolarHBondContact O-CB 3.33Å; A622-S626 PolarHBondContact O-N 2.97Å; A622-S626 VanDerWaalsContact O-N 3.09Å; A622-S626 PolarHBondContact O-OG 2.04Å; M623-S626 PolarHBondContact O-N 2.8Å; W624-S626 PolarHBondContact O-N 3.13Å; S626-L630 PolarHBondContact O-N 3.49Å; S626-W652 PolarHBondContact O-NE1 2.81Å
627	W	89.5	Confident	82.1	Confident	93 Å²	93	65 Å²	65	35%	0.352	36%	0.362	S	S	.	.	H	α-helix	trans	-70.6	-40.6	173.9	-87.8	104.8	0	0	0	113	V586 H587 M623 W624 V629 L630 L631	V586-W627 HydrophobicContact CG1-CD2 3.95Å; V586-W627 HydrophobicContact CG1-CG 3.83Å; H587-W627 AromaticContact CE1-CZ2 3.99Å; H587-W627 AromaticContact CE1-NE1 3.81Å; H587-W627 AromaticContact NE2-NE1 3.9Å; M623-W627 PolarHBondContact O-N 2.9Å; W624-W627 PolarHBondContact O-N 3.38Å; W627-V629 PolarHBondContact O-N 2.94Å; W627-L630 PolarHBondContact O-N 2.85Å; W627-L631 HydrophobicContact CE3-CD1 3.94Å; W627-L631 HydrophobicContact CE3-CG 4.2Å; W627-L631 WeakPolarHBondContact O-CB 3.27Å; W627-L631 WeakPolarHBondContact O-CG 3.3Å; W627-L631 PolarHBondContact O-N 2.77Å
628	G	88.1	Confident	82.1	Confident	7 Å²	7	64.8 Å²	64.8	7%	0.072	37%	0.366	C	S	.	.	H	α-helix	trans	-59.7	-46.2	178.3	0	0	0	0	0	111.8	W624 F625 L630 L631 N632 S633	W624-G628 PolarHBondContact O-N 2.96Å; F625-G628 PolarHBondContact O-N 2.99Å; G628-L630 PolarHBondContact O-N 3.39Å; G628-L631 PolarHBondContact O-N 3.07Å; G628-N632 PolarHBondContact O-N 2.86Å; G628-S633 CarbonylContact C-O 3.57Å; G628-S633 WeakPolarHBondContact CA-O 3.4Å; G628-S633 PolarHBondContact O-N 3.35Å
629	V	88.6	Confident	82.1	Confident	35 Å²	35	65.4 Å²	65.4	21%	0.212	38%	0.378	C	S	.	.	H	α-helix	trans	-61.6	-39.9	175.1	171.9	0	0	0	0	112.3	F625 W627 W652 A653 A656	F625-V629 HydrophobicContact CE1-CG2 4.3Å; F625-V629 HydrophobicContact CE2-CG2 4.47Å; F625-V629 HydrophobicContact CZ-CG2 4.23Å; F625-V629 WeakPolarHBondContact O-CG2 3.17Å; F625-V629 PolarHBondContact O-N 2.87Å; W627-V629 PolarHBondContact O-N 2.94Å; V629-W652 HydrophobicContact CG1-CG 4.46Å; V629-A653 HydrophobicContact CG1-CB 3.87Å; V629-A656 HydrophobicContact CG1-CB 4.13Å
630	L	88.5	Confident	81.9	Confident	21 Å²	21	62.8 Å²	62.8	11%	0.11	37%	0.365	C	S	.	.	H	α-helix	trans	-69.3	-37	177.5	-178.6	62.2	0	0	0	112.8	V582 V586 S626 W627 G628 N632 W652 A656	V582-L630 HydrophobicContact CG1-CD1 4.44Å; V582-L630 HydrophobicContact CG1-CD2 3.81Å; V586-L630 HydrophobicContact CG2-CD2 3.45Å; V586-L630 VanDerWaalsContact CG2-CD2 3.45Å; S626-L630 PolarHBondContact O-N 3.49Å; W627-L630 PolarHBondContact O-N 2.85Å; G628-L630 PolarHBondContact O-N 3.39Å; L630-N632 VanDerWaalsContact C-N 3.34Å; L630-W652 HydrophobicContact CB-CZ2 4.21Å; L630-A656 HydrophobicContact CD1-CB 4.14Å
631	L	89.2	Confident	81.5	Confident	114 Å²	114	65 Å²	65	60%	0.597	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	3.7	-177.6	-64	175.3	0	0	0	113.6	W627 G628 S633	W627-L631 HydrophobicContact CE3-CD1 3.94Å; W627-L631 HydrophobicContact CE3-CG 4.2Å; W627-L631 WeakPolarHBondContact O-CB 3.27Å; W627-L631 WeakPolarHBondContact O-CG 3.3Å; W627-L631 PolarHBondContact O-N 2.77Å; G628-L631 PolarHBondContact O-N 3.07Å; L631-S633 PolarHBondContact O-N 2.87Å
632	N	87.1	Confident	81.3	Confident	106 Å²	106	64 Å²	64	57%	0.567	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	35.1	-169.2	-68.4	-55.5	0	0	0	113.2	G628 L630	G628-N632 PolarHBondContact O-N 2.86Å; L630-N632 VanDerWaalsContact C-N 3.34Å
633	S	86.1	Confident	81.1	Confident	48 Å²	48	71.7 Å²	71.7	34%	0.336	39%	0.39	S	S	.	.			trans	-103.3	126.8	-178.3	179.6	0	0	0	0	110.7	G628 L631 I635	G628-S633 CarbonylContact C-O 3.57Å; G628-S633 WeakPolarHBondContact CA-O 3.4Å; G628-S633 PolarHBondContact O-N 3.35Å; L631-S633 PolarHBondContact O-N 2.87Å; S633-I635 PolarHBondContact O-N 3.29Å
634	G	78.4	Confident	80.9	Confident	86 Å²	86	70.8 Å²	70.8	89%	0.887	39%	0.39	S	S	*	.			trans	-71.7	11.7	179.2	0	0	0	0	0	115.6	G636	G634-G636 PolarHBondContact O-N 2.92Å
635	I	74.8	Confident	80.7	Confident	106 Å²	106	63.1 Å²	63.1	54%	0.544	36%	0.361	S	S	.	.			trans	-84.1	90.6	-179.6	-57.3	174.4	0	0	0	109.1	W624 S633	W624-I635 HydrophobicContact CE3-CG2 4.48Å; S633-I635 PolarHBondContact O-N 3.29Å
636	G	67.8	Low	80.7	Confident	39 Å²	39	67.8 Å²	67.8	40%	0.402	38%	0.377	S	S	.	.			trans	-153.8	90.5	178.5	0	0	0	0	0	112.6	G634 G638	G634-G636 PolarHBondContact O-N 2.92Å; G636-G638 PolarHBondContact O-N 3.16Å
637	E	62.2	Low	80.7	Confident	195 Å²	195	71.6 Å²	71.6	91%	0.911	40%	0.397	S	S	*	.	S	Bend	trans	-74.5	35.6	179.3	-58.2	178.8	154.9	0	0	113.3
638	G	67.9	Low	80.7	Confident	21 Å²	21	69.6 Å²	69.6	22%	0.216	39%	0.393	C	S	.	.			trans	178.5	124.5	179.6	0	0	0	0	0	113.1	G636	G636-G638 PolarHBondContact O-N 3.16Å
639	A	74.3	Confident	80.6	Confident	75 Å²	75	69.7 Å²	69.7	62%	0.62	39%	0.393	S	S	*	.			trans	-107.3	149	178.5	0	0	0	0	0	111.5	R641	A639-R641 PolarHBondContact O-N 3.04Å
640	P	77.3	Confident	80.6	Confident	14 Å²	14	74.4 Å²	74.4	9%	0.091	42%	0.415	C	S	.	.			trans	-62.1	122.8	178.4	22.1	-31.6	0	0	0	112.5	L617 F625 A645 R646	L617-P640 HydrophobicContact CD1-CB 4.44Å; F625-P640 HydrophobicContact CZ-CG 4.15Å; P640-A645 HydrophobicContact CB-CB 3.54Å; P640-R646 HydrophobicContact CB-CG 4.16Å; P640-R646 HydrophobicContact CG-CG 4.08Å; P640-R646 VanDerWaalsContact O-CG 3.24Å; P640-R646 WeakPolarHBondContact O-CG 3.29Å; P640-R646 PolarHBondContact O-NE 3.24Å
641	R	73.4	Confident	80.8	Confident	115 Å²	115	78 Å²	78	43%	0.434	44%	0.437	S	S	.	.			trans	-82	-44.4	178.6	-174.7	177.3	176.6	111.4	-2.5	111.5	D597 G603 F605 A639	D597-R641 PolarHBondContact OD1-N 3.36Å; G603-R641 PolarHBondContact O-NE 2.98Å; G603-R641 VanDerWaalsContact O-NE 3.16Å; F605-R641 PolarHBondContact O-NH2 2.78Å; F605-R641 VanDerWaalsContact O-NH2 3.09Å; A639-R641 PolarHBondContact O-N 3.04Å
642	S	78.9	Confident	80.9	Confident	2 Å²	2	73 Å²	73	1%	0.014	41%	0.411	C	S	.	.	S	Bend	trans	-72	139.9	-178.3	65.1	0	0	0	0	112.6	D597 S644 A645 R646	D597-S642 WeakPolarHBondContact OD1-CB 3.3Å; D597-S642 PolarHBondContact OD1-N 2.76Å; D597-S642 PolarHBondContact OD1-OG 3.02Å; S642-S644 PolarHBondContact O-N 2.84Å; S642-S644 PolarHBondContact OG-OG 2.93Å; S642-A645 PolarHBondContact O-N 3.1Å; S642-A645 VanDerWaalsContact OG-CB 3.22Å; S642-A645 WeakPolarHBondContact OG-CB 3.34Å; S642-A645 PolarHBondContact OG-N 3.26Å; S642-R646 PolarHBondContact O-N 3.35Å
643	F	81.5	Confident	81.1	Confident	161 Å²	161	69.9 Å²	69.9	71%	0.706	40%	0.399	S	S	*	.	H	α-helix	trans	-56.4	-39.4	178.9	-174.4	-98.5	0	0	0	112.4	A645 R646 I647	F643-A645 PolarHBondContact O-N 3.38Å; F643-R646 PolarHBondContact O-N 3.39Å; F643-I647 HydrophobicContact CD1-CG1 4.28Å; F643-I647 HydrophobicContact CE1-CD1 4.4Å; F643-I647 HydrophobicContact CE1-CG1 3.93Å; F643-I647 HydrophobicContact CZ-CD1 4.14Å; F643-I647 HydrophobicContact CZ-CG1 4.15Å; F643-I647 WeakPolarHBondContact O-CG1 3.38Å; F643-I647 PolarHBondContact O-N 2.81Å
644	S	83.8	Confident	81.4	Confident	46 Å²	46	69.1 Å²	69.1	32%	0.322	40%	0.399	S	S	.	.	H	α-helix	trans	-57.6	-45.1	173	39.5	0	0	0	0	113.4	S642 L648	S642-S644 PolarHBondContact O-N 2.84Å; S642-S644 PolarHBondContact OG-OG 2.93Å; S644-L648 PolarHBondContact O-N 2.71Å; S644-L648 VanDerWaalsContact O-N 3.13Å
645	A	82.9	Confident	82	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-74.3	-30.1	178.5	0	0	0	0	0	112.1	L593 P640 S642 F643 L648 G649	L593-A645 HydrophobicContact CD2-CB 3.9Å; L593-A645 WeakPolarHBondContact CD2-O 3.35Å; P640-A645 HydrophobicContact CB-CB 3.54Å; S642-A645 PolarHBondContact O-N 3.1Å; S642-A645 VanDerWaalsContact OG-CB 3.22Å; S642-A645 WeakPolarHBondContact OG-CB 3.34Å; S642-A645 PolarHBondContact OG-N 3.26Å; F643-A645 PolarHBondContact O-N 3.38Å; A645-L648 PolarHBondContact O-N 2.84Å; A645-G649 PolarHBondContact O-N 2.95Å
646	R	86.1	Confident	82.7	Confident	139 Å²	139	63.8 Å²	63.8	53%	0.525	35%	0.348	S	S	.	.	H	α-helix	trans	-63.9	-46.5	172.4	-71	179.5	177.9	-171.2	-1.9	112.1	P640 S642 F643 G649 M650	P640-R646 HydrophobicContact CB-CG 4.16Å; P640-R646 HydrophobicContact CG-CG 4.08Å; P640-R646 VanDerWaalsContact O-CG 3.24Å; P640-R646 WeakPolarHBondContact O-CG 3.29Å; P640-R646 PolarHBondContact O-NE 3.24Å; S642-R646 PolarHBondContact O-N 3.35Å; F643-R646 PolarHBondContact O-N 3.39Å; R646-G649 PolarHBondContact O-N 2.83Å; R646-M650 WeakPolarHBondContact O-CG 3.14Å; R646-M650 PolarHBondContact O-N 3Å
647	I	89.2	Confident	83.8	Confident	80 Å²	80	67.1 Å²	67.1	41%	0.41	35%	0.354	S	S	.	.	H	α-helix	trans	-63.2	-43.7	175.7	-63.9	-62.8	0	0	0	111	F643 G649 M650 V651	F643-I647 HydrophobicContact CD1-CG1 4.28Å; F643-I647 HydrophobicContact CE1-CD1 4.4Å; F643-I647 HydrophobicContact CE1-CG1 3.93Å; F643-I647 HydrophobicContact CZ-CD1 4.14Å; F643-I647 HydrophobicContact CZ-CG1 4.15Å; F643-I647 WeakPolarHBondContact O-CG1 3.38Å; F643-I647 PolarHBondContact O-N 2.81Å; I647-G649 VanDerWaalsContact C-N 3.32Å; I647-G649 PolarHBondContact O-N 3.02Å; I647-M650 HydrophobicContact CD1-SD 4.32Å; I647-M650 PolarHBondContact O-N 2.89Å; I647-V651 WeakPolarHBondContact O-CG2 3.26Å; I647-V651 PolarHBondContact O-N 3.12Å
648	L	88.8	Confident	85.2	Confident	52 Å²	52	63 Å²	63	27%	0.272	34%	0.337	S	S	.	.	H	α-helix	trans	-61.4	-40.2	175	-177.3	59.8	0	0	0	112.1	M592 L593 L596 S644 A645 V651 W652	M592-L648 HydrophobicContact CB-CD2 4.06Å; L593-L648 HydrophobicContact CD2-CB 4.04Å; L593-L648 HydrophobicContact CD2-CD2 3.87Å; L593-L648 HydrophobicContact CD2-CG 4.01Å; L593-L648 HydrophobicContact CG-CD2 4.02Å; L593-L648 HydrophobicContact CG-CG 4.43Å; L596-L648 HydrophobicContact CD1-CD2 3.69Å; S644-L648 PolarHBondContact O-N 2.71Å; S644-L648 VanDerWaalsContact O-N 3.13Å; A645-L648 PolarHBondContact O-N 2.84Å; L648-V651 PolarHBondContact O-N 2.73Å; L648-W652 WeakPolarHBondContact O-CB 3.41Å; L648-W652 PolarHBondContact O-N 3.07Å
649	G	86.9	Confident	86.4	Confident	8 Å²	8	63.2 Å²	63.2	8%	0.082	33%	0.333	C	S	.	.	H	α-helix	trans	-64.4	-38.7	175.2	0	0	0	0	0	113.6	A645 R646 I647 W652 A653	A645-G649 PolarHBondContact O-N 2.95Å; R646-G649 PolarHBondContact O-N 2.83Å; I647-G649 VanDerWaalsContact C-N 3.32Å; I647-G649 PolarHBondContact O-N 3.02Å; G649-W652 PolarHBondContact O-N 2.88Å; G649-A653 WeakPolarHBondContact O-CB 3.35Å; G649-A653 PolarHBondContact O-N 2.86Å
650	M	88.3	Confident	87.1	Confident	134 Å²	134	62.1 Å²	62.1	66%	0.66	32%	0.319	S	S	*	.	H	α-helix	trans	-64.4	-43.9	173.9	-72.8	173.6	172.9	0	0	111.9	R646 I647 A653 G654	R646-M650 WeakPolarHBondContact O-CG 3.14Å; R646-M650 PolarHBondContact O-N 3Å; I647-M650 HydrophobicContact CD1-SD 4.32Å; I647-M650 PolarHBondContact O-N 2.89Å; M650-A653 PolarHBondContact O-N 2.86Å; M650-G654 PolarHBondContact O-N 3.01Å
651	V	92.7	Very high	87.8	Confident	96 Å²	96	64 Å²	64	58%	0.582	34%	0.335	S	S	*	.	H	α-helix	trans	-65.8	-39.2	175.9	174.9	0	0	0	0	111.1	I647 L648 G654 F655	I647-V651 WeakPolarHBondContact O-CG2 3.26Å; I647-V651 PolarHBondContact O-N 3.12Å; L648-V651 PolarHBondContact O-N 2.73Å; V651-G654 PolarHBondContact O-N 2.72Å; V651-F655 PolarHBondContact O-N 2.04Å
652	W	91.6	Very high	88.6	Confident	11 Å²	11	60.9 Å²	60.9	4%	0.042	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-43.3	174.4	178.3	-116.2	0	0	0	112.6	V586 V589 S626 V629 L630 L648 G649 G654 F655 A656	V586-W652 HydrophobicContact CB-CH2 4.31Å; V586-W652 HydrophobicContact CB-CZ2 4.26Å; V586-W652 HydrophobicContact CG1-CZ2 4.48Å; V586-W652 HydrophobicContact CG2-CH2 3.76Å; V586-W652 HydrophobicContact CG2-CZ2 3.75Å; V589-W652 HydrophobicContact CB-CD2 4.39Å; V589-W652 HydrophobicContact CB-CE3 4.25Å; V589-W652 HydrophobicContact CG1-CB 4.24Å; V589-W652 HydrophobicContact CG1-CD2 3.92Å; V589-W652 HydrophobicContact CG1-CE3 4.17Å; V589-W652 HydrophobicContact CG1-CG 3.93Å; V589-W652 HydrophobicContact CG2-CD2 4.35Å; V589-W652 HydrophobicContact CG2-CE3 3.76Å; V589-W652 HydrophobicContact CG2-CZ3 3.98Å; S626-W652 PolarHBondContact O-NE1 2.81Å; V629-W652 HydrophobicContact CG1-CG 4.46Å; L630-W652 HydrophobicContact CB-CZ2 4.21Å; L648-W652 WeakPolarHBondContact O-CB 3.41Å; L648-W652 PolarHBondContact O-N 3.07Å; G649-W652 PolarHBondContact O-N 2.88Å; W652-G654 PolarHBondContact O-N 2.91Å; W652-F655 AromaticContact CE3-CD1 3.8Å; W652-F655 HydrophobicContact CE3-CD1 3.8Å; W652-F655 HydrophobicContact CH2-CD1 4.19Å; W652-F655 HydrophobicContact CH2-CE1 4.26Å; W652-F655 AromaticContact CZ3-CD1 3.45Å; W652-F655 HydrophobicContact CZ3-CD1 3.45Å; W652-F655 VanDerWaalsContact CZ3-CD1 3.45Å; W652-F655 AromaticContact CZ3-CE1 3.73Å; W652-F655 HydrophobicContact CZ3-CE1 3.73Å; W652-F655 PolarHBondContact O-N 3.43Å; W652-A656 WeakPolarHBondContact O-CB 3.31Å; W652-A656 PolarHBondContact O-N 3.47Å
653	A	89.9	Confident	89.2	Confident	39 Å²	39	63.5 Å²	63.5	32%	0.322	34%	0.341	S	S	.	.	H	α-helix	trans	-63	-40	174.8	0	0	0	0	0	112.3	V629 G649 M650 A656 M657	V629-A653 HydrophobicContact CG1-CB 3.87Å; G649-A653 WeakPolarHBondContact O-CB 3.35Å; G649-A653 PolarHBondContact O-N 2.86Å; M650-A653 PolarHBondContact O-N 2.86Å; A653-A656 PolarHBondContact O-N 2.96Å; A653-M657 WeakPolarHBondContact O-CG 3.47Å; A653-M657 PolarHBondContact O-N 2.96Å
654	G	91.9	Very high	89.6	Confident	33 Å²	33	59.6 Å²	59.6	34%	0.34	33%	0.331	S	S	.	.	H	α-helix	trans	-60.3	-45.6	171.9	0	0	0	0	0	112.6	M650 V651 W652 M657 I658	M650-G654 PolarHBondContact O-N 3.01Å; V651-G654 PolarHBondContact O-N 2.72Å; W652-G654 PolarHBondContact O-N 2.91Å; G654-M657 PolarHBondContact O-N 3.36Å; G654-I658 VanDerWaalsContact O-CG1 3.29Å; G654-I658 WeakPolarHBondContact O-CG1 3.39Å; G654-I658 PolarHBondContact O-N 3.06Å
655	F	91.9	Very high	89.9	Confident	79 Å²	79	60.3 Å²	60.3	35%	0.346	34%	0.339	S	S	.	.	H	α-helix	trans	-63	-44.2	176	176.5	-99.4	0	0	0	112.5	V651 W652 M657 I658 I659	V651-F655 PolarHBondContact O-N 2.04Å; W652-F655 AromaticContact CE3-CD1 3.8Å; W652-F655 HydrophobicContact CE3-CD1 3.8Å; W652-F655 HydrophobicContact CH2-CD1 4.19Å; W652-F655 HydrophobicContact CH2-CE1 4.26Å; W652-F655 AromaticContact CZ3-CD1 3.45Å; W652-F655 HydrophobicContact CZ3-CD1 3.45Å; W652-F655 VanDerWaalsContact CZ3-CD1 3.45Å; W652-F655 AromaticContact CZ3-CE1 3.73Å; W652-F655 HydrophobicContact CZ3-CE1 3.73Å; W652-F655 PolarHBondContact O-N 3.43Å; F655-M657 PolarHBondContact O-N 3.34Å; F655-I658 PolarHBondContact O-N 3.48Å; F655-I659 HydrophobicContact CD1-CG1 4.25Å; F655-I659 HydrophobicContact CE1-CD1 4.38Å; F655-I659 HydrophobicContact CE1-CG1 3.77Å; F655-I659 HydrophobicContact CE2-CD1 4.1Å; F655-I659 HydrophobicContact CE2-CG1 4.06Å; F655-I659 HydrophobicContact CZ-CD1 3.8Å; F655-I659 HydrophobicContact CZ-CG1 3.67Å; F655-I659 WeakPolarHBondContact O-CG1 3.04Å; F655-I659 PolarHBondContact O-N 2.91Å
656	A	90.1	Very high	90.1	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.008	36%	0.36	C	S	.	.	H	α-helix	trans	-58.3	-46.6	176.2	0	0	0	0	0	111.8	V629 L630 W652 A653 I658 I659 V660	V629-A656 HydrophobicContact CG1-CB 4.13Å; L630-A656 HydrophobicContact CD1-CB 4.14Å; W652-A656 WeakPolarHBondContact O-CB 3.31Å; W652-A656 PolarHBondContact O-N 3.47Å; A653-A656 PolarHBondContact O-N 2.96Å; A656-I658 VanDerWaalsContact C-N 3.34Å; A656-I658 PolarHBondContact O-N 3.49Å; A656-I659 PolarHBondContact O-N 3.44Å; A656-V660 WeakPolarHBondContact O-CG2 3.06Å; A656-V660 PolarHBondContact O-N 2.74Å
657	M	89.9	Confident	89.9	Confident	109 Å²	109	59.4 Å²	59.4	54%	0.537	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-39.1	175.7	-74.5	-62	-63.9	0	0	112.6	A653 G654 F655 V660 A661	A653-M657 WeakPolarHBondContact O-CG 3.47Å; A653-M657 PolarHBondContact O-N 2.96Å; G654-M657 PolarHBondContact O-N 3.36Å; F655-M657 PolarHBondContact O-N 3.34Å; M657-V660 PolarHBondContact O-N 3.22Å; M657-A661 VanDerWaalsContact O-CB 3.26Å; M657-A661 WeakPolarHBondContact O-CB 3.46Å; M657-A661 PolarHBondContact O-N 2.98Å
658	I	92.8	Very high	89.5	Confident	107 Å²	107	58.2 Å²	58.2	55%	0.549	35%	0.347	S	S	.	.	H	α-helix	trans	-64.5	-41.9	175.3	-69.8	164.1	0	0	0	111.4	G654 F655 A656 S662	G654-I658 VanDerWaalsContact O-CG1 3.29Å; G654-I658 WeakPolarHBondContact O-CG1 3.39Å; G654-I658 PolarHBondContact O-N 3.06Å; F655-I658 PolarHBondContact O-N 3.48Å; A656-I658 VanDerWaalsContact C-N 3.34Å; A656-I658 PolarHBondContact O-N 3.49Å; I658-S662 VanDerWaalsContact O-CB 3.28Å; I658-S662 WeakPolarHBondContact O-CB 3.45Å; I658-S662 PolarHBondContact O-N 2.99Å; I658-S662 PolarHBondContact O-OG 3.01Å
659	I	91.3	Very high	89.2	Confident	27 Å²	27	57.7 Å²	57.7	14%	0.138	35%	0.35	C	S	.	.	H	α-helix	trans	-64.5	-46.4	177	-68.7	-66.1	0	0	0	111	F574 V582 F655 A656 S662 Y663	F574-I659 HydrophobicContact CE2-CG2 4.04Å; F574-I659 HydrophobicContact CZ-CG2 4.3Å; V582-I659 HydrophobicContact CG2-CD1 4.27Å; F655-I659 HydrophobicContact CD1-CG1 4.25Å; F655-I659 HydrophobicContact CE1-CD1 4.38Å; F655-I659 HydrophobicContact CE1-CG1 3.77Å; F655-I659 HydrophobicContact CE2-CD1 4.1Å; F655-I659 HydrophobicContact CE2-CG1 4.06Å; F655-I659 HydrophobicContact CZ-CD1 3.8Å; F655-I659 HydrophobicContact CZ-CG1 3.67Å; F655-I659 WeakPolarHBondContact O-CG1 3.04Å; F655-I659 PolarHBondContact O-N 2.91Å; A656-I659 PolarHBondContact O-N 3.44Å; I659-S662 PolarHBondContact O-N 2.83Å; I659-Y663 PolarHBondContact O-N 2.79Å
660	V	90.3	Very high	88.7	Confident	52 Å²	52	61 Å²	61	32%	0.315	36%	0.362	S	S	.	.	H	α-helix	trans	-63	-44	178	173.4	0	0	0	0	111.4	A656 M657 S662 Y663 T664	A656-V660 WeakPolarHBondContact O-CG2 3.06Å; A656-V660 PolarHBondContact O-N 2.74Å; M657-V660 PolarHBondContact O-N 3.22Å; V660-S662 VanDerWaalsContact C-N 3.35Å; V660-S662 PolarHBondContact O-N 2.03Å; V660-Y663 PolarHBondContact O-N 2.84Å; V660-T664 PolarHBondContact O-N 3.02Å; V660-T664 VanDerWaalsContact O-N 3.09Å; V660-T664 PolarHBondContact O-OG1 3.2Å
661	A	90.8	Very high	88.1	Confident	52 Å²	52	57.5 Å²	57.5	43%	0.43	35%	0.346	S	S	.	.	H	α-helix	trans	-65.7	-35.8	177	0	0	0	0	0	112.7	M657 T664 A665	M657-A661 VanDerWaalsContact O-CB 3.26Å; M657-A661 WeakPolarHBondContact O-CB 3.46Å; M657-A661 PolarHBondContact O-N 2.98Å; A661-T664 PolarHBondContact O-OG1 3.09Å; A661-T664 VanDerWaalsContact O-OG1 3.09Å; A661-A665 VanDerWaalsContact O-CB 3.22Å; A661-A665 WeakPolarHBondContact O-CB 3.39Å; A661-A665 PolarHBondContact O-N 2.75Å
662	S	91.9	Very high	87.2	Confident	51 Å²	51	57.4 Å²	57.4	36%	0.357	35%	0.345	S	S	.	.	H	α-helix	trans	-68.3	-38.7	176.2	-59.5	0	0	0	0	111.9	I658 I659 V660 N666	I658-S662 VanDerWaalsContact O-CB 3.28Å; I658-S662 WeakPolarHBondContact O-CB 3.45Å; I658-S662 PolarHBondContact O-N 2.99Å; I658-S662 PolarHBondContact O-OG 3.01Å; I659-S662 PolarHBondContact O-N 2.83Å; V660-S662 VanDerWaalsContact C-N 3.35Å; V660-S662 PolarHBondContact O-N 2.03Å; S662-N666 WeakPolarHBondContact O-CB 3.32Å; S662-N666 PolarHBondContact O-N 3.49Å
663	Y	90.3	Very high	86.2	Confident	56 Å²	56	63.6 Å²	63.6	22%	0.22	38%	0.378	C	S	.	.	H	α-helix	trans	-62.6	-48.8	174.3	175.3	-94	0	0	0	111.5	F570 P573 F574 W579 I659 V660 N666 L667	F570-Y663 PolarHBondContact O-OH 3.3Å; P573-Y663 HydrophobicContact CB-CD2 3.88Å; P573-Y663 HydrophobicContact CB-CE2 3.84Å; P573-Y663 HydrophobicContact CG-CD2 4.41Å; P573-Y663 HydrophobicContact CG-CE2 3.87Å; F574-Y663 HydrophobicContact CD2-CD2 4.12Å; F574-Y663 HydrophobicContact CE2-CD2 4.08Å; F574-Y663 HydrophobicContact CE2-CG 4.39Å; W579-Y663 HydrophobicContact CH2-CD2 4.46Å; W579-Y663 HydrophobicContact CH2-CE2 4.42Å; W579-Y663 HydrophobicContact CZ2-CD2 4.3Å; W579-Y663 HydrophobicContact CZ2-CE2 4.12Å; I659-Y663 PolarHBondContact O-N 2.79Å; V660-Y663 PolarHBondContact O-N 2.84Å; Y663-N666 PolarHBondContact O-N 3.42Å; Y663-L667 HydrophobicContact CE1-CD2 4.21Å; Y663-L667 VanDerWaalsContact O-CB 3.31Å; Y663-L667 WeakPolarHBondContact O-CB 3.41Å; Y663-L667 PolarHBondContact O-N 2.88Å
664	T	89.4	Confident	85	Confident	80 Å²	80	66.2 Å²	66.2	49%	0.491	39%	0.387	S	S	.	.	H	α-helix	trans	-67.5	-37	179.7	54.5	0	0	0	0	112.3	V660 A661 A668	V660-T664 PolarHBondContact O-N 3.02Å; V660-T664 VanDerWaalsContact O-N 3.09Å; V660-T664 PolarHBondContact O-OG1 3.2Å; A661-T664 PolarHBondContact O-OG1 3.09Å; A661-T664 VanDerWaalsContact O-OG1 3.09Å; T664-A668 WeakPolarHBondContact O-CB 3.36Å; T664-A668 PolarHBondContact O-N 3.28Å
665	A	90	Very high	83.7	Confident	60 Å²	60	73.8 Å²	73.8	50%	0.496	41%	0.405	S	S	.	.	H	α-helix	trans	-64.4	-45.1	174.5	0	0	0	0	0	112.4	A661 A668 A669	A661-A665 VanDerWaalsContact O-CB 3.22Å; A661-A665 WeakPolarHBondContact O-CB 3.39Å; A661-A665 PolarHBondContact O-N 2.75Å; A665-A668 PolarHBondContact O-N 3.06Å; A665-A669 WeakPolarHBondContact O-CB 3.19Å; A665-A669 PolarHBondContact O-N 3.01Å
666	N	87.8	Confident	82.3	Confident	80 Å²	80	73.8 Å²	73.8	43%	0.428	41%	0.414	S	S	.	.	H	α-helix	trans	-72.8	-34.5	-179.5	-159.8	33.4	0	0	0	112.5	P573 S662 Y663 A669 F670	P573-N666 HydrophobicContact CB-CB 4.48Å; P573-N666 PolarHBondContact O-ND2 3.33Å; S662-N666 WeakPolarHBondContact O-CB 3.32Å; S662-N666 PolarHBondContact O-N 3.49Å; Y663-N666 PolarHBondContact O-N 3.42Å; N666-A669 PolarHBondContact O-N 2.84Å; N666-F670 WeakPolarHBondContact O-CB 3.34Å; N666-F670 PolarHBondContact O-N 2.71Å
667	L	82.5	Confident	81.1	Confident	40 Å²	40	80.5 Å²	80.5	21%	0.209	45%	0.445	C	S	.	.	H	α-helix	trans	-61.2	-43.4	170.9	178.8	62.2	0	0	0	111.6	P573 Y663 F670 L671	P573-L667 HydrophobicContact CG-CB 4.09Å; P573-L667 HydrophobicContact CG-CD1 4Å; Y663-L667 HydrophobicContact CE1-CD2 4.21Å; Y663-L667 VanDerWaalsContact O-CB 3.31Å; Y663-L667 WeakPolarHBondContact O-CB 3.41Å; Y663-L667 PolarHBondContact O-N 2.88Å; L667-F670 PolarHBondContact O-N 2.93Å; L667-L671 HydrophobicContact CD1-CD1 4.45Å; L667-L671 HydrophobicContact CG-CD1 4.42Å; L667-L671 WeakPolarHBondContact O-CG 3.37Å; L667-L671 PolarHBondContact O-N 2.82Å
668	A	80.6	Confident	79.9	Confident	55 Å²	55	83 Å²	83	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-65.4	-40.7	175.8	0	0	0	0	0	112.3	T664 A665 V672	T664-A668 WeakPolarHBondContact O-CB 3.36Å; T664-A668 PolarHBondContact O-N 3.28Å; A665-A668 PolarHBondContact O-N 3.06Å; A668-V672 WeakPolarHBondContact O-CG2 3.27Å; A668-V672 PolarHBondContact O-N 3.44Å
669	A	82.3	Confident	79.1	Confident	41 Å²	41	83.5 Å²	83.5	34%	0.339	45%	0.45	S	S	.	.	H	α-helix	trans	-63.5	-43	175.5	0	0	0	0	0	112.1	A665 N666 L671 V672 L673	A665-A669 WeakPolarHBondContact O-CB 3.19Å; A665-A669 PolarHBondContact O-N 3.01Å; N666-A669 PolarHBondContact O-N 2.84Å; A669-L671 PolarHBondContact O-N 3.37Å; A669-V672 PolarHBondContact O-N 3.25Å; A669-L673 WeakPolarHBondContact O-CG 3.24Å; A669-L673 PolarHBondContact O-N 3.19Å; A669-L673 VanDerWaalsContact O-N 3.12Å
670	F	76.3	Confident	78.8	Confident	77 Å²	77	82.8 Å²	82.8	34%	0.338	45%	0.446	S	S	.	.	H	α-helix	trans	-59.2	-47.6	177.8	-174.9	-93.2	0	0	0	112	N666 L667 V672 L673 D674	N666-F670 WeakPolarHBondContact O-CB 3.34Å; N666-F670 PolarHBondContact O-N 2.71Å; L667-F670 PolarHBondContact O-N 2.93Å; F670-V672 PolarHBondContact O-N 2.66Å; F670-V672 VanDerWaalsContact O-N 3.15Å; F670-L673 PolarHBondContact O-N 3.27Å; F670-D674 HydrophobicContact CD1-CB 4.4Å; F670-D674 HydrophobicContact CE1-CB 4.03Å; F670-D674 HydrophobicContact CZ-CB 4.27Å; F670-D674 WeakPolarHBondContact O-CB 3.4Å; F670-D674 PolarHBondContact O-N 3.21Å
671	L	74.8	Confident	78.6	Confident	61 Å²	61	84.9 Å²	84.9	32%	0.319	46%	0.459	S	S	.	.	H	α-helix	trans	-64.5	-17.3	178.9	-68	168.5	0	0	0	114.5	L667 A669 L824	L667-L671 HydrophobicContact CD1-CD1 4.45Å; L667-L671 HydrophobicContact CG-CD1 4.42Å; L667-L671 WeakPolarHBondContact O-CG 3.37Å; L667-L671 PolarHBondContact O-N 2.82Å; A669-L671 PolarHBondContact O-N 3.37Å; L671-L824 HydrophobicContact CD1-CD1 3.97Å; L671-L824 HydrophobicContact CD1-CG 4.37Å; L671-L824 HydrophobicContact CD2-CD2 4.22Å; L671-L824 HydrophobicContact CD2-CG 4.17Å
672	V	74.9	Confident	78.5	Confident	94 Å²	94	82.8 Å²	82.8	57%	0.57	44%	0.443	S	S	*	.	H	α-helix	trans	-89.5	-30.2	173.9	173.2	0	0	0	0	111.8	A668 A669 F670	A668-V672 WeakPolarHBondContact O-CG2 3.27Å; A668-V672 PolarHBondContact O-N 3.44Å; A669-V672 PolarHBondContact O-N 3.25Å; F670-V672 PolarHBondContact O-N 2.66Å; F670-V672 VanDerWaalsContact O-N 3.15Å
673	L	69.6	Low	78.4	Confident	141 Å²	141	81.6 Å²	81.6	74%	0.738	43%	0.432	S	S	*	.	H	α-helix	trans	-89.3	-28.1	-177.7	-69.7	171.5	0	0	0	113.8	A669 F670 R675	A669-L673 WeakPolarHBondContact O-CG 3.24Å; A669-L673 PolarHBondContact O-N 3.19Å; A669-L673 VanDerWaalsContact O-N 3.12Å; F670-L673 PolarHBondContact O-N 3.27Å; L673-R675 PolarHBondContact O-N 2.88Å
674	D	65.3	Low	78.4	Confident	95 Å²	95	84.3 Å²	84.3	51%	0.508	45%	0.451	S	S	.	.			trans	-75.3	56.4	175.7	-167.6	33.6	0	0	0	111.7	F670	F670-D674 HydrophobicContact CD1-CB 4.4Å; F670-D674 HydrophobicContact CE1-CB 4.03Å; F670-D674 HydrophobicContact CZ-CB 4.27Å; F670-D674 WeakPolarHBondContact O-CB 3.4Å; F670-D674 PolarHBondContact O-N 3.21Å
675	R	64.3	Low	78.5	Confident	191 Å²	191	81.1 Å²	81.1	72%	0.721	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-83.4	131.3	165.3	-65.1	-176.4	179.7	-161.6	-3	107.6	L673	L673-R675 PolarHBondContact O-N 2.88Å
676	P	63.7	Low	78.5	Confident	80 Å²	80	82.5 Å²	82.5	52%	0.519	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-59.8	153.9	170.9	28.1	-35.1	0	0	0	109.8	E678	P676-E678 PolarHBondContact O-N 2.89Å
677	E	64.8	Low	78.5	Confident	142 Å²	142	83.8 Å²	83.8	66%	0.664	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-50.9	138.6	-178.6	-63.3	-161	149.4	0	0	111.8	R679 R687	E677-R679 PolarHBondContact O-N 2.94Å; E677-R687 VanDerWaalsContact CD-NH2 3.28Å; E677-R687 IonicContact OE1-NH2 3.93Å; E677-R687 PolarHBondContact OE1-NH2 3.22Å; E677-R687 IonicContact OE2-CZ 3.9Å; E677-R687 IonicContact OE2-NH1 2.75Å; E677-R687 PolarHBondContact OE2-NH1 2.91Å; E677-R687 IonicContact OE2-NH2 3.1Å; E677-R687 PolarHBondContact OE2-NH2 3.35Å
678	E	64.4	Low	78.9	Confident	160 Å²	160	81.9 Å²	81.9	75%	0.748	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-60.9	134.3	178.7	-64.2	-168.3	158.7	0	0	110.3	P676	P676-E678 PolarHBondContact O-N 2.89Å
679	R	76.5	Confident	79.4	Confident	118 Å²	118	82.4 Å²	82.4	45%	0.445	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-63	153.8	178.1	-62.3	-174.8	-169.7	162.7	7.1	109.9	E677 T681 T765	E677-R679 PolarHBondContact O-N 2.94Å; R679-T681 PolarHBondContact O-N 3.01Å; R679-T681 VanDerWaalsContact O-N 3.1Å; R679-T765 HydrophobicContact CB-CG2 4.03Å
680	I	84.9	Confident	79.7	Confident	13 Å²	13	86.4 Å²	86.4	7%	0.067	43%	0.429	C	S	.	.			trans	-45.9	119.7	176.7	-52.6	176.2	0	0	0	110	I556 V558 G682 D685 L688 F695 A744	I556-I680 HydrophobicContact CD1-CG2 4.26Å; I556-I680 HydrophobicContact CG2-CD1 4.07Å; V558-I680 HydrophobicContact CG1-CD1 3.5Å; V558-I680 VanDerWaalsContact CG1-CD1 3.5Å; V558-I680 HydrophobicContact CG1-CG1 4.29Å; I680-G682 VanDerWaalsContact C-N 3.3Å; I680-G682 PolarHBondContact O-N 3.17Å; I680-D685 HydrophobicContact CG2-CB 3.81Å; I680-L688 HydrophobicContact CG2-CD1 3.75Å; I680-L688 HydrophobicContact CG2-CG 4.41Å; I680-F695 HydrophobicContact CD1-CE1 4.39Å; I680-F695 HydrophobicContact CD1-CZ 3.71Å; I680-F695 HydrophobicContact CG1-CZ 4.43Å; I680-A744 HydrophobicContact CD1-CB 3.81Å
681	T	85.6	Confident	80.4	Confident	95 Å²	95	85 Å²	85	58%	0.583	43%	0.428	S	S	*	.			trans	-70.5	-28.1	-174.9	51.5	0	0	0	0	112.6	R679 D685 G766	R679-T681 PolarHBondContact O-N 3.01Å; R679-T681 VanDerWaalsContact O-N 3.1Å; T681-D685 PolarHBondContact N-OD2 3.34Å; T681-D685 PolarHBondContact OG1-OD2 3.08Å; T681-G766 WeakPolarHBondContact O-CA 3.48Å
682	G	89.1	Confident	81	Confident	8 Å²	8	84.7 Å²	84.7	8%	0.082	43%	0.43	C	S	.	.	S	Bend	trans	152	-159.9	174.3	0	0	0	0	0	111.9	I680 N684 D685 L688	I680-G682 VanDerWaalsContact C-N 3.3Å; I680-G682 PolarHBondContact O-N 3.17Å; G682-N684 PolarHBondContact O-N 3.48Å; G682-D685 VanDerWaalsContact O-CB 3.23Å; G682-D685 WeakPolarHBondContact O-CB 3.47Å; G682-D685 PolarHBondContact O-N 3.16Å; G682-L688 WeakPolarHBondContact O-CD1 3.39Å
683	I	90.3	Very high	81.5	Confident	26 Å²	26	86.5 Å²	86.5	13%	0.133	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-14.3	-176	-167.8	53	0	0	0	115.2	R689 F709 M718 F769	I683-R689 PolarHBondContact O-NE 3.04Å; I683-F709 HydrophobicContact CD1-CE1 4.08Å; I683-F709 HydrophobicContact CD1-CZ 3.93Å; I683-M718 HydrophobicContact CD1-CE 3.87Å; I683-M718 HydrophobicContact CD1-SD 4.24Å; I683-F769 HydrophobicContact CB-CD1 3.93Å; I683-F769 HydrophobicContact CB-CD2 4.18Å; I683-F769 HydrophobicContact CB-CE1 4.05Å; I683-F769 HydrophobicContact CB-CE2 4.29Å; I683-F769 HydrophobicContact CB-CG 4Å; I683-F769 HydrophobicContact CB-CZ 4.22Å; I683-F769 HydrophobicContact CD1-CD2 4.46Å; I683-F769 HydrophobicContact CD1-CE1 4.43Å; I683-F769 HydrophobicContact CD1-CE2 3.84Å; I683-F769 HydrophobicContact CD1-CZ 3.82Å; I683-F769 HydrophobicContact CG1-CD2 3.98Å; I683-F769 HydrophobicContact CG1-CE1 4.45Å; I683-F769 HydrophobicContact CG1-CE2 3.87Å; I683-F769 HydrophobicContact CG1-CG 4.31Å; I683-F769 HydrophobicContact CG1-CZ 4.11Å; I683-F769 HydrophobicContact CG2-CB 4.11Å; I683-F769 HydrophobicContact CG2-CD1 4.29Å; I683-F769 HydrophobicContact CG2-CD2 4.46Å; I683-F769 HydrophobicContact CG2-CG 4.06Å
684	N	90.1	Very high	82.4	Confident	114 Å²	114	88.6 Å²	88.6	61%	0.61	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	6.3	177.1	-68.4	-28.7	0	0	0	113.5	G682 R689	G682-N684 PolarHBondContact O-N 3.48Å; N684-R689 PolarHBondContact OD1-NH2 2.92Å
685	D	91.4	Very high	83.7	Confident	12 Å²	12	85.5 Å²	85.5	6%	0.064	42%	0.422	C	S	.	.			trans	-60.2	133.6	178.6	-163	-71.3	0	0	0	111.6	I680 T681 G682 R687 L688 R689	I680-D685 HydrophobicContact CG2-CB 3.81Å; T681-D685 PolarHBondContact N-OD2 3.34Å; T681-D685 PolarHBondContact OG1-OD2 3.08Å; G682-D685 VanDerWaalsContact O-CB 3.23Å; G682-D685 WeakPolarHBondContact O-CB 3.47Å; G682-D685 PolarHBondContact O-N 3.16Å; D685-R687 PolarHBondContact O-N 3.5Å; D685-R687 VanDerWaalsContact O-N 3.16Å; D685-R687 VanDerWaalsContact OD1-CB 3.27Å; D685-R687 WeakPolarHBondContact OD1-CB 3.44Å; D685-R687 WeakPolarHBondContact OD1-CG 3.4Å; D685-R687 PolarHBondContact OD1-N 3.07Å; D685-L688 HydrophobicContact CB-CD1 4.34Å; D685-L688 PolarHBondContact O-N 3.42Å; D685-R689 PolarHBondContact O-N 3.35Å
686	P	89.8	Confident	85.1	Confident	89 Å²	89	78.5 Å²	78.5	58%	0.578	40%	0.399	S	S	*	.	H	α-helix	trans	-54.9	-32.4	177.9	-27.6	35.8	0	0	0	114	L688 N690	P686-L688 PolarHBondContact O-N 3.38Å; P686-N690 PolarHBondContact O-N 2.74Å
687	R	88.1	Confident	86.6	Confident	107 Å²	107	74.7 Å²	74.7	40%	0.404	37%	0.374	S	S	.	.	H	α-helix	trans	-66	-26.2	179	-60.6	173.7	176.4	-138.5	-8.3	112.6	E677 D685 F695	E677-R687 VanDerWaalsContact CD-NH2 3.28Å; E677-R687 IonicContact OE1-NH2 3.93Å; E677-R687 PolarHBondContact OE1-NH2 3.22Å; E677-R687 IonicContact OE2-CZ 3.9Å; E677-R687 IonicContact OE2-NH1 2.75Å; E677-R687 PolarHBondContact OE2-NH1 2.91Å; E677-R687 IonicContact OE2-NH2 3.1Å; E677-R687 PolarHBondContact OE2-NH2 3.35Å; D685-R687 PolarHBondContact O-N 3.5Å; D685-R687 VanDerWaalsContact O-N 3.16Å; D685-R687 VanDerWaalsContact OD1-CB 3.27Å; D685-R687 WeakPolarHBondContact OD1-CB 3.44Å; D685-R687 WeakPolarHBondContact OD1-CG 3.4Å; D685-R687 PolarHBondContact OD1-N 3.07Å; R687-F695 HydrophobicContact CB-CD1 4.4Å
688	L	90.3	Very high	88.1	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-90.9	-49.8	175.7	-70.4	173.7	0	0	0	111.4	I556 I680 G682 D685 P686 N690 F695 Y697 M718	I556-L688 HydrophobicContact CD1-CD1 3.46Å; I556-L688 VanDerWaalsContact CD1-CD1 3.46Å; I680-L688 HydrophobicContact CG2-CD1 3.75Å; I680-L688 HydrophobicContact CG2-CG 4.41Å; G682-L688 WeakPolarHBondContact O-CD1 3.39Å; D685-L688 HydrophobicContact CB-CD1 4.34Å; D685-L688 PolarHBondContact O-N 3.42Å; P686-L688 PolarHBondContact O-N 3.38Å; L688-N690 VanDerWaalsContact C-N 3.31Å; L688-N690 PolarHBondContact O-N 2.76Å; L688-F695 HydrophobicContact CD2-CE1 3.91Å; L688-Y697 HydrophobicContact CD2-CD1 3.6Å; L688-Y697 HydrophobicContact CD2-CD2 3.98Å; L688-Y697 HydrophobicContact CD2-CE1 3.83Å; L688-Y697 HydrophobicContact CD2-CE2 4.21Å; L688-Y697 HydrophobicContact CD2-CG 3.67Å; L688-Y697 PolarHBondContact O-OH 3.4Å; L688-M718 HydrophobicContact CB-CE 3.81Å; L688-M718 HydrophobicContact CB-SD 4.49Å; L688-M718 HydrophobicContact CD2-CE 4.37Å
689	R	90.1	Very high	89.5	Confident	67 Å²	67	60.4 Å²	60.4	25%	0.253	31%	0.307	S	S	.	.	H	α-helix	trans	-63.7	-34.1	-175.6	-74.3	-66.7	-167.6	143.4	8.5	113.2	I683 N684 D685 P691 E714 L715	I683-R689 PolarHBondContact O-NE 3.04Å; N684-R689 PolarHBondContact OD1-NH2 2.92Å; D685-R689 PolarHBondContact O-N 3.35Å; R689-P691 WeakPolarHBondContact O-CD 3.46Å; R689-E714 PolarHBondContact NH1-O 2.95Å; R689-E714 VanDerWaalsContact NH1-O 3.11Å; R689-L715 VanDerWaalsContact CZ-CD2 3.49Å
690	N	90.5	Very high	90.4	Very high	125 Å²	125	55.2 Å²	55.2	67%	0.668	29%	0.289	S	S	*	.	S	Bend	trans	-107.7	81.9	171.8	-67.2	-30.4	0	0	0	109.6	P686 L688	P686-N690 PolarHBondContact O-N 2.74Å; L688-N690 VanDerWaalsContact C-N 3.31Å; L688-N690 PolarHBondContact O-N 2.76Å
691	P	89.6	Confident	90.6	Very high	47 Å²	47	58.6 Å²	58.6	31%	0.305	30%	0.303	S	S	.	.			trans	-59	141.4	-177	21.6	-32.3	0	0	0	112.3	R689 Y697 H721	R689-P691 WeakPolarHBondContact O-CD 3.46Å; P691-Y697 HydrophobicContact CB-CE1 4.2Å; P691-H721 HydrophobicContact CB-CB 3.69Å; P691-H721 HydrophobicContact CG-CB 4.11Å
692	S	87.9	Confident	90.6	Very high	54 Å²	54	56 Å²	56	38%	0.378	28%	0.284	S	S	.	.			trans	-135.5	152.5	173.7	71.5	0	0	0	0	110.5	K694 F695 H721	S692-K694 PolarHBondContact O-N 3.39Å; S692-F695 CarbonylContact O-C 3.59Å; S692-F695 PolarHBondContact O-N 2.89Å; S692-H721 PolarHBondContact O-NE2 3.1Å
693	D	86.3	Confident	90.6	Very high	132 Å²	132	55.8 Å²	55.8	71%	0.706	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-12	-179.6	-53.3	-46.7	0	0	0	112.8
694	K	88.1	Confident	90.6	Very high	185 Å²	185	54.9 Å²	54.9	80%	0.804	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-27.2	170.3	-66.9	-175.2	178.2	-177.2	0	113.1	S692 H743	S692-K694 PolarHBondContact O-N 3.39Å; K694-H743 PolarHBondContact O-CE1 3.35Å
695	F	91.6	Very high	90.8	Very high	31 Å²	31	49.4 Å²	49.4	14%	0.136	25%	0.248	C	C	.	.	S	Bend	trans	-122	83.3	-174.3	-170.6	-97.9	0	0	0	109.9	I680 R687 L688 S692 Y697 H721 H743 A744	I680-F695 HydrophobicContact CD1-CE1 4.39Å; I680-F695 HydrophobicContact CD1-CZ 3.71Å; I680-F695 HydrophobicContact CG1-CZ 4.43Å; R687-F695 HydrophobicContact CB-CD1 4.4Å; L688-F695 HydrophobicContact CD2-CE1 3.91Å; S692-F695 CarbonylContact O-C 3.59Å; S692-F695 PolarHBondContact O-N 2.89Å; F695-Y697 AromaticContact CD1-CD1 3.86Å; F695-Y697 HydrophobicContact CD1-CD1 3.86Å; F695-Y697 AromaticContact CE1-CD1 3.99Å; F695-Y697 HydrophobicContact CE1-CD1 3.99Å; F695-H721 PolarHBondContact O-CE1 3.4Å; F695-H743 HydrophobicContact CD2-CB 3.78Å; F695-H743 HydrophobicContact CE2-CB 3.45Å; F695-H743 VanDerWaalsContact CE2-CB 3.45Å; F695-H743 HydrophobicContact CZ-CB 3.95Å; F695-A744 HydrophobicContact CE1-CB 4.3Å; F695-A744 HydrophobicContact CZ-CB 3.94Å
696	I	94.1	Very high	90.8	Very high	44 Å²	44	49.5 Å²	49.5	23%	0.226	25%	0.248	C	C	.	.			trans	-79.6	123.6	-177.9	-52.2	177.7	0	0	0	109.6	H725 L742 H743	I696-H725 HydrophobicContact CG2-CB 4.04Å; I696-L742 HydrophobicContact CG2-CD1 3.96Å; I696-H743 PolarHBondContact N-ND1 3.07Å; I696-H743 WeakPolarHBondContact O-CB 3.2Å; I696-H743 PolarHBondContact O-N 3.43Å
697	Y	94.4	Very high	90.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	152.8	172.5	63.1	-93.3	0	0	0	110.7	L688 P691 F695 M718 H721 M722 A744 I746	L688-Y697 HydrophobicContact CD2-CD1 3.6Å; L688-Y697 HydrophobicContact CD2-CD2 3.98Å; L688-Y697 HydrophobicContact CD2-CE1 3.83Å; L688-Y697 HydrophobicContact CD2-CE2 4.21Å; L688-Y697 HydrophobicContact CD2-CG 3.67Å; L688-Y697 PolarHBondContact O-OH 3.4Å; P691-Y697 HydrophobicContact CB-CE1 4.2Å; F695-Y697 AromaticContact CD1-CD1 3.86Å; F695-Y697 HydrophobicContact CD1-CD1 3.86Å; F695-Y697 AromaticContact CE1-CD1 3.99Å; F695-Y697 HydrophobicContact CE1-CD1 3.99Å; Y697-M718 HydrophobicContact CE2-CB 4.21Å; Y697-M718 HydrophobicContact CE2-CE 3.76Å; Y697-M718 WeakPolarHBondContact OH-CA 3.43Å; Y697-M718 WeakPolarHBondContact OH-CB 3.4Å; Y697-M718 WeakPolarHBondContact OH-CG 3.42Å; Y697-H721 AromaticContact CD1-CE1 3.65Å; Y697-H721 AromaticContact CD1-ND1 3.73Å; Y697-H721 AromaticContact CE1-CE1 3.62Å; Y697-H721 AromaticContact CE1-ND1 3.43Å; Y697-H721 WeakPolarHBondContact CE1-ND1 3.33Å; Y697-H721 AromaticContact CE2-ND1 3.96Å; Y697-H721 AromaticContact CZ-ND1 3.55Å; Y697-M722 HydrophobicContact CD2-CG 3.49Å; Y697-M722 VanDerWaalsContact CD2-CG 3.49Å; Y697-M722 HydrophobicContact CD2-SD 3.77Å; Y697-M722 HydrophobicContact CE2-CE 4.49Å; Y697-M722 HydrophobicContact CE2-CG 3.44Å; Y697-M722 VanDerWaalsContact CE2-CG 3.44Å; Y697-M722 HydrophobicContact CE2-SD 3.8Å; Y697-A744 WeakPolarHBondContact CA-O 3.43Å; Y697-A744 WeakPolarHBondContact CB-O 3.33Å; Y697-I746 HydrophobicContact CD2-CD1 4.32Å
698	A	95.9	Very high	91	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	170.8	-169.8	0	0	0	0	0	112.9	H725 Y727 L742 A744 F745 I746	A698-H725 HydrophobicContact CB-CB 4.19Å; A698-H725 WeakPolarHBondContact CB-O 3.3Å; A698-Y727 HydrophobicContact CB-CD2 4.23Å; A698-Y727 HydrophobicContact CB-CE2 4.23Å; A698-L742 HydrophobicContact CB-CD1 3.69Å; A698-L742 HydrophobicContact CB-CD2 4.11Å; A698-A744 PolarHBondContact N-O 3.33Å; A698-F745 WeakPolarHBondContact O-CD2 3.35Å; A698-I746 PolarHBondContact O-N 3.06Å
699	T	95.8	Very high	91.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	21%	0.207	C	C	.	.			trans	-136	-172.9	167.1	-165.1	0	0	0	0	110.4	V705 N726 Y727 I746	T699-V705 HydrophobicContact CG2-CB 4.31Å; T699-V705 HydrophobicContact CG2-CG1 4.07Å; T699-V705 WeakPolarHBondContact OG1-CB 3.36Å; T699-V705 WeakPolarHBondContact OG1-CG1 3.23Å; T699-N726 WeakPolarHBondContact CG2-OD1 3.45Å; T699-N726 PolarHBondContact N-OD1 2.78Å; T699-N726 WeakPolarHBondContact O-CA 3.3Å; T699-N726 VanDerWaalsContact O-CB 3.3Å; T699-N726 WeakPolarHBondContact O-CB 3.35Å; T699-N726 PolarHBondContact O-OD1 2.9Å; T699-N726 VanDerWaalsContact O-OD1 3.12Å; T699-Y727 PolarHBondContact O-N 3.05Å; T699-I746 WeakPolarHBondContact CB-O 3.31Å; T699-I746 PolarHBondContact OG1-O 3.42Å
700	V	93.5	Very high	91.1	Very high	10 Å²	10	44.3 Å²	44.3	6%	0.061	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-88	136.7	174.8	-168.5	0	0	0	0	109.9	S703 Y727 E728 A730 F745 W747	V700-S703 VanDerWaalsContact O-CB 3.29Å; V700-S703 WeakPolarHBondContact O-CB 3.44Å; V700-S703 PolarHBondContact O-OG 3.32Å; V700-Y727 WeakPolarHBondContact CA-O 3.45Å; V700-Y727 WeakPolarHBondContact CG1-O 3.46Å; V700-E728 WeakPolarHBondContact CG1-O 3.07Å; V700-A730 HydrophobicContact CG2-CB 4.12Å; V700-F745 HydrophobicContact CG2-CE2 3.96Å; V700-F745 HydrophobicContact CG2-CZ 3.87Å; V700-W747 HydrophobicContact CB-CE3 4.25Å; V700-W747 HydrophobicContact CB-CH2 3.56Å; V700-W747 HydrophobicContact CB-CZ2 4.43Å; V700-W747 HydrophobicContact CB-CZ3 3.46Å; V700-W747 VanDerWaalsContact CB-CZ3 3.46Å; V700-W747 HydrophobicContact CG1-CH2 4.37Å; V700-W747 HydrophobicContact CG2-CD2 4.24Å; V700-W747 HydrophobicContact CG2-CE3 3.8Å; V700-W747 HydrophobicContact CG2-CH2 3.58Å; V700-W747 HydrophobicContact CG2-CZ2 4.02Å; V700-W747 HydrophobicContact CG2-CZ3 3.47Å; V700-W747 VanDerWaalsContact CG2-CZ3 3.47Å
701	K	90.4	Very high	91.1	Very high	83 Å²	83	43.3 Å²	43.3	36%	0.361	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	151.7	176.1	-60.9	179.2	-157.7	168.8	0	111.2	S703 N726 Y727 E728	K701-S703 PolarHBondContact O-N 3.18Å; K701-S703 VanDerWaalsContact O-N 3.17Å; K701-N726 WeakPolarHBondContact CE-O 3.34Å; K701-N726 HydrophobicContact CG-CB 3.51Å; K701-Y727 PolarHBondContact N-O 3.03Å; K701-E728 WeakPolarHBondContact CD-OE1 3.47Å; K701-E728 WeakPolarHBondContact CE-OE1 3.06Å; K701-E728 IonicContact NZ-OE1 3.28Å; K701-E728 PolarHBondContact NZ-OE1 3.28Å
702	Q	85.8	Confident	91.1	Very high	42 Å²	42	44.3 Å²	44.3	20%	0.196	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	38.4	173.2	-51.3	-171.8	-1.4	0	0	112.9	T502 E504 N515 D706	T502-Q702 VanDerWaalsContact CG2-C 3.44Å; T502-Q702 HydrophobicContact CG2-CB 4.07Å; T502-Q702 WeakPolarHBondContact CG2-O 3.32Å; E504-Q702 PolarHBondContact OE1-NE2 2.74Å; N515-Q702 PolarHBondContact ND2-OE1 3.16Å; Q702-D706 WeakPolarHBondContact CA-OD2 3.42Å; Q702-D706 PolarHBondContact N-OD2 3.2Å
703	S	89.7	Confident	91.3	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.014	22%	0.223	C	C	.	.	S	Bend	trans	-107.2	172.1	-179	64	0	0	0	0	112.2	V700 K701 V705 D706 I707 W747	V700-S703 VanDerWaalsContact O-CB 3.29Å; V700-S703 WeakPolarHBondContact O-CB 3.44Å; V700-S703 PolarHBondContact O-OG 3.32Å; K701-S703 PolarHBondContact O-N 3.18Å; K701-S703 VanDerWaalsContact O-N 3.17Å; S703-V705 PolarHBondContact O-N 3.42Å; S703-V705 PolarHBondContact OG-N 3.12Å; S703-D706 WeakPolarHBondContact OG-CB 3.32Å; S703-D706 PolarHBondContact OG-N 3.49Å; S703-I707 WeakPolarHBondContact O-CG1 3.4Å; S703-I707 PolarHBondContact O-N 2.85Å; S703-I707 VanDerWaalsContact O-N 3.11Å; S703-W747 VanDerWaalsContact CB-CZ3 3.49Å
704	S	90.2	Very high	91.5	Very high	7 Å²	7	48.7 Å²	48.7	5%	0.049	22%	0.224	C	C	.	.	H	α-helix	trans	-55.9	-34.6	164.2	40.6	0	0	0	0	112.2	T534 Y708	T534-S704 VanDerWaalsContact OG1-CB 3.32Å; T534-S704 WeakPolarHBondContact OG1-CB 3.46Å; T534-S704 PolarHBondContact OG1-OG 3.05Å; S704-Y708 WeakPolarHBondContact O-CB 3.36Å; S704-Y708 PolarHBondContact O-N 2.82Å
705	V	93	Very high	91.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-74.1	-46.5	-178.7	-167.7	0	0	0	0	111.5	L554 T699 S703 I707 Y708 F709 I746 W747	L554-V705 HydrophobicContact CD1-CG1 4.09Å; L554-V705 HydrophobicContact CD2-CG2 3.7Å; T699-V705 HydrophobicContact CG2-CB 4.31Å; T699-V705 HydrophobicContact CG2-CG1 4.07Å; T699-V705 WeakPolarHBondContact OG1-CB 3.36Å; T699-V705 WeakPolarHBondContact OG1-CG1 3.23Å; S703-V705 PolarHBondContact O-N 3.42Å; S703-V705 PolarHBondContact OG-N 3.12Å; V705-I707 PolarHBondContact O-N 3.06Å; V705-Y708 WeakPolarHBondContact O-CB 2.99Å; V705-Y708 PolarHBondContact O-N 3.43Å; V705-Y708 VanDerWaalsContact O-N 3.11Å; V705-F709 HydrophobicContact CG1-CD2 3.8Å; V705-F709 HydrophobicContact CG1-CE2 3.73Å; V705-F709 WeakPolarHBondContact O-CD2 3.02Å; V705-F709 PolarHBondContact O-N 3.15Å; V705-I746 HydrophobicContact CG1-CG2 4.17Å; V705-W747 HydrophobicContact CB-CE3 4.41Å; V705-W747 HydrophobicContact CB-CZ3 4.3Å; V705-W747 HydrophobicContact CG2-CE3 3.63Å; V705-W747 HydrophobicContact CG2-CZ3 3.72Å
706	D	91.5	Very high	91.7	Very high	13 Å²	13	40.8 Å²	40.8	7%	0.07	20%	0.195	C	C	.	.	H	α-helix	trans	-55.8	-49.7	172.6	174.6	22.5	0	0	0	110.9	Q702 S703 Y708 F709 R710 Y719	Q702-D706 WeakPolarHBondContact CA-OD2 3.42Å; Q702-D706 PolarHBondContact N-OD2 3.2Å; S703-D706 WeakPolarHBondContact OG-CB 3.32Å; S703-D706 PolarHBondContact OG-N 3.49Å; D706-Y708 VanDerWaalsContact C-N 3.32Å; D706-Y708 PolarHBondContact O-N 3.32Å; D706-F709 PolarHBondContact O-N 3.29Å; D706-R710 WeakPolarHBondContact O-CB 3.44Å; D706-R710 PolarHBondContact O-N 3.04Å; D706-Y719 WeakPolarHBondContact OD1-CE2 3.5Å; D706-Y719 PolarHBondContact OD1-OH 2.9Å
707	I	89.4	Confident	91.6	Very high	3 Å²	3	42 Å²	42	2%	0.015	20%	0.204	C	C	.	.	H	α-helix	trans	-56.9	-43.7	173.6	-71.6	172.5	0	0	0	111.8	T502 E538 S703 V705 R711	T502-I707 HydrophobicContact CG2-CD1 3.68Å; T502-I707 HydrophobicContact CG2-CG1 4.36Å; E538-I707 WeakPolarHBondContact OE1-CG2 3.37Å; E538-I707 WeakPolarHBondContact OE2-CG2 3.4Å; S703-I707 WeakPolarHBondContact O-CG1 3.4Å; S703-I707 PolarHBondContact O-N 2.85Å; S703-I707 VanDerWaalsContact O-N 3.11Å; V705-I707 PolarHBondContact O-N 3.06Å; I707-R711 WeakPolarHBondContact O-CB 3.21Å; I707-R711 PolarHBondContact O-N 3.4Å; I707-R711 VanDerWaalsContact O-N 3.12Å
708	Y	91.9	Very high	91.6	Very high	24 Å²	24	42 Å²	42	9%	0.094	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-54.5	179.1	171.7	-96.2	0	0	0	111.7	L554 S704 V705 D706 R710 R711 Q712 L715 F770	L554-Y708 HydrophobicContact CD1-CD1 4.24Å; S704-Y708 WeakPolarHBondContact O-CB 3.36Å; S704-Y708 PolarHBondContact O-N 2.82Å; V705-Y708 WeakPolarHBondContact O-CB 2.99Å; V705-Y708 PolarHBondContact O-N 3.43Å; V705-Y708 VanDerWaalsContact O-N 3.11Å; D706-Y708 VanDerWaalsContact C-N 3.32Å; D706-Y708 PolarHBondContact O-N 3.32Å; Y708-R710 PolarHBondContact O-N 2.82Å; Y708-R711 PolarHBondContact O-N 3.21Å; Y708-R711 VanDerWaalsContact O-N 3.16Å; Y708-Q712 HydrophobicContact CD2-CG 4.21Å; Y708-Q712 HydrophobicContact CE1-CG 4.2Å; Y708-Q712 HydrophobicContact CE2-CG 3.85Å; Y708-Q712 VanDerWaalsContact O-CG 3.32Å; Y708-Q712 WeakPolarHBondContact O-CG 3.27Å; Y708-Q712 PolarHBondContact O-N 3.44Å; Y708-L715 HydrophobicContact CE1-CD1 3.83Å; Y708-F770 HydrophobicContact CD2-CB 4.21Å; Y708-F770 AromaticContact CD2-CD1 3.91Å; Y708-F770 HydrophobicContact CD2-CD1 3.91Å; Y708-F770 AromaticContact CD2-CD2 3.4Å; Y708-F770 HydrophobicContact CD2-CD2 3.4Å; Y708-F770 HydrophobicContact CD2-CE1 4.13Å; Y708-F770 AromaticContact CD2-CE2 3.65Å; Y708-F770 HydrophobicContact CD2-CE2 3.65Å; Y708-F770 AromaticContact CD2-CG 3.55Å; Y708-F770 HydrophobicContact CD2-CG 3.55Å; Y708-F770 HydrophobicContact CD2-CZ 4.01Å; Y708-F770 HydrophobicContact CE1-CB 4.5Å; Y708-F770 HydrophobicContact CE2-CB 3.8Å; Y708-F770 HydrophobicContact CE2-CD1 4.36Å; Y708-F770 AromaticContact CE2-CD2 3.33Å; Y708-F770 HydrophobicContact CE2-CD2 3.33Å; Y708-F770 AromaticContact CE2-CE2 3.99Å; Y708-F770 HydrophobicContact CE2-CE2 3.99Å; Y708-F770 AromaticContact CE2-CG 3.56Å; Y708-F770 HydrophobicContact CE2-CG 3.56Å; Y708-F770 HydrophobicContact CG-CD1 4.19Å; Y708-F770 HydrophobicContact CG-CD2 4.42Å; Y708-F770 HydrophobicContact CG-CE1 4.44Å; Y708-F770 HydrophobicContact CG-CG 4.18Å
709	F	93.3	Very high	91.5	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.009	21%	0.21	C	C	.	.	H	α-helix	trans	-66.9	-35.6	-178.9	-78.8	-82.6	0	0	0	112.7	I683 V705 D706 R711 Q712 L715 M718 Y719 M722 I746 F769	I683-F709 HydrophobicContact CD1-CE1 4.08Å; I683-F709 HydrophobicContact CD1-CZ 3.93Å; V705-F709 HydrophobicContact CG1-CD2 3.8Å; V705-F709 HydrophobicContact CG1-CE2 3.73Å; V705-F709 WeakPolarHBondContact O-CD2 3.02Å; V705-F709 PolarHBondContact O-N 3.15Å; D706-F709 PolarHBondContact O-N 3.29Å; F709-R711 PolarHBondContact O-N 3.27Å; F709-Q712 PolarHBondContact O-N 2.86Å; F709-L715 HydrophobicContact CD1-CB 3.78Å; F709-L715 HydrophobicContact CD1-CD1 3.9Å; F709-L715 HydrophobicContact CD1-CG 4.38Å; F709-L715 HydrophobicContact CE1-CB 4.18Å; F709-L715 HydrophobicContact CE1-CD1 3.81Å; F709-L715 HydrophobicContact CE1-CD2 4.46Å; F709-L715 HydrophobicContact CE1-CG 4.38Å; F709-M718 HydrophobicContact CE1-CE 4.14Å; F709-M718 HydrophobicContact CE1-SD 4.42Å; F709-Y719 HydrophobicContact CB-CD2 3.6Å; F709-Y719 HydrophobicContact CB-CE2 4.34Å; F709-Y719 HydrophobicContact CB-CG 4.42Å; F709-M722 HydrophobicContact CB-CE 4Å; F709-M722 HydrophobicContact CD1-CE 3.55Å; F709-M722 HydrophobicContact CD2-CE 3.74Å; F709-M722 HydrophobicContact CE1-CE 3.84Å; F709-M722 HydrophobicContact CE2-CE 4.03Å; F709-M722 HydrophobicContact CG-CE 3.5Å; F709-M722 VanDerWaalsContact CG-CE 3.5Å; F709-M722 HydrophobicContact CZ-CE 4.07Å; F709-I746 HydrophobicContact CE2-CD1 4.49Å; F709-I746 HydrophobicContact CE2-CG2 4.07Å; F709-I746 HydrophobicContact CZ-CD1 4.09Å; F709-I746 HydrophobicContact CZ-CG2 4.4Å; F709-F769 HydrophobicContact CZ-CE2 4.23Å
710	R	90.8	Very high	91.4	Very high	125 Å²	125	51.1 Å²	51.1	47%	0.472	24%	0.239	S	C	.	.	H	α-helix	trans	-61.6	-28.9	173.9	-168.7	173.5	67.6	-171.3	1.7	113	D706 Y708 Y719	D706-R710 WeakPolarHBondContact O-CB 3.44Å; D706-R710 PolarHBondContact O-N 3.04Å; Y708-R710 PolarHBondContact O-N 2.82Å; R710-Y719 HydrophobicContact CB-CD2 4.37Å; R710-Y719 HydrophobicContact CB-CE1 4.09Å; R710-Y719 HydrophobicContact CB-CE2 3.75Å; R710-Y719 WeakPolarHBondContact CD-OH 3.4Å; R710-Y719 HydrophobicContact CG-CE1 3.96Å; R710-Y719 HydrophobicContact CG-CE2 4.46Å
711	R	89.6	Confident	91.5	Very high	105 Å²	105	51.1 Å²	51.1	40%	0.396	24%	0.238	S	C	.	.	H	α-helix	trans	-85.7	-30.6	-179.9	-169.2	-180	69.4	-137.8	-2.9	113.3	E538 I707 Y708 F709 V713	E538-R711 IonicContact OE1-NH1 2.7Å; E538-R711 PolarHBondContact OE1-NH1 2.88Å; I707-R711 WeakPolarHBondContact O-CB 3.21Å; I707-R711 PolarHBondContact O-N 3.4Å; I707-R711 VanDerWaalsContact O-N 3.12Å; Y708-R711 PolarHBondContact O-N 3.21Å; Y708-R711 VanDerWaalsContact O-N 3.16Å; F709-R711 PolarHBondContact O-N 3.27Å; R711-V713 PolarHBondContact O-N 2.85Å
712	Q	90.1	Very high	91.7	Very high	68 Å²	68	47.2 Å²	47.2	32%	0.318	22%	0.221	S	C	.	.			trans	-86.3	103.7	-172.9	-63.2	-69.2	53.3	0	0	111.9	Y708 F709 E714 L715 S716	Y708-Q712 HydrophobicContact CD2-CG 4.21Å; Y708-Q712 HydrophobicContact CE1-CG 4.2Å; Y708-Q712 HydrophobicContact CE2-CG 3.85Å; Y708-Q712 VanDerWaalsContact O-CG 3.32Å; Y708-Q712 WeakPolarHBondContact O-CG 3.27Å; Y708-Q712 PolarHBondContact O-N 3.44Å; F709-Q712 PolarHBondContact O-N 2.86Å; Q712-E714 VanDerWaalsContact C-N 3.27Å; Q712-E714 PolarHBondContact O-N 3.28Å; Q712-L715 HydrophobicContact CB-CB 4.17Å; Q712-L715 HydrophobicContact CB-CD1 3.89Å; Q712-L715 HydrophobicContact CB-CG 4.21Å; Q712-L715 HydrophobicContact CG-CD1 4.23Å; Q712-L715 PolarHBondContact O-N 2.73Å; Q712-S716 PolarHBondContact O-N 3.17Å
713	V	91.1	Very high	92	Very high	123 Å²	123	50.6 Å²	50.6	75%	0.745	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-55.5	-39.9	-178.3	-175.1	0	0	0	0	112.4	R711 L715 S716	R711-V713 PolarHBondContact O-N 2.85Å; V713-L715 PolarHBondContact O-N 3.04Å; V713-S716 VanDerWaalsContact O-CB 3.28Å; V713-S716 WeakPolarHBondContact O-CB 3.47Å; V713-S716 PolarHBondContact O-N 3.38Å; V713-S716 PolarHBondContact O-OG 3.35Å
714	E	90.4	Very high	92.2	Very high	155 Å²	155	58 Å²	58	72%	0.724	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-62.7	-21	177	-63.7	179.8	-163.7	0	0	114.8	R689 Q712	R689-E714 PolarHBondContact NH1-O 2.95Å; R689-E714 VanDerWaalsContact NH1-O 3.11Å; Q712-E714 VanDerWaalsContact C-N 3.27Å; Q712-E714 PolarHBondContact O-N 3.28Å
715	L	91.8	Very high	92.4	Very high	6 Å²	6	60.4 Å²	60.4	3%	0.031	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-108.9	9.6	-177.7	-58.9	168.9	0	0	0	111.7	R689 Y708 F709 Q712 V713 T717 M718 Y719	R689-L715 VanDerWaalsContact CZ-CD2 3.49Å; Y708-L715 HydrophobicContact CE1-CD1 3.83Å; F709-L715 HydrophobicContact CD1-CB 3.78Å; F709-L715 HydrophobicContact CD1-CD1 3.9Å; F709-L715 HydrophobicContact CD1-CG 4.38Å; F709-L715 HydrophobicContact CE1-CB 4.18Å; F709-L715 HydrophobicContact CE1-CD1 3.81Å; F709-L715 HydrophobicContact CE1-CD2 4.46Å; F709-L715 HydrophobicContact CE1-CG 4.38Å; Q712-L715 HydrophobicContact CB-CB 4.17Å; Q712-L715 HydrophobicContact CB-CD1 3.89Å; Q712-L715 HydrophobicContact CB-CG 4.21Å; Q712-L715 HydrophobicContact CG-CD1 4.23Å; Q712-L715 PolarHBondContact O-N 2.73Å; V713-L715 PolarHBondContact O-N 3.04Å; L715-T717 PolarHBondContact O-N 3.09Å; L715-M718 HydrophobicContact CD2-SD 3.7Å; L715-M718 WeakPolarHBondContact O-CB 3.33Å; L715-M718 PolarHBondContact O-N 3.3Å; L715-Y719 PolarHBondContact O-N 3.04Å
716	S	92.9	Very high	92.4	Very high	44 Å²	44	61.1 Å²	61.1	31%	0.308	28%	0.283	S	S	.	.	H	α-helix	trans	-64.2	-22.6	-177.3	59.7	0	0	0	0	114.5	Q712 V713 R720	Q712-S716 PolarHBondContact O-N 3.17Å; V713-S716 VanDerWaalsContact O-CB 3.28Å; V713-S716 WeakPolarHBondContact O-CB 3.47Å; V713-S716 PolarHBondContact O-N 3.38Å; V713-S716 PolarHBondContact O-OG 3.35Å; S716-R720 WeakPolarHBondContact O-CG 3.46Å; S716-R720 PolarHBondContact O-N 3.42Å
717	T	92.6	Very high	92.6	Very high	68 Å²	68	63.4 Å²	63.4	42%	0.417	29%	0.291	S	S	.	.	H	α-helix	trans	-68	-46.9	169.4	49.9	0	0	0	0	111.4	L715 Y719	L715-T717 PolarHBondContact O-N 3.09Å; T717-Y719 VanDerWaalsContact C-N 3.35Å
718	M	93.9	Very high	92.5	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-41.5	175.8	-57.5	-175.4	57.1	0	0	111.2	I683 L688 Y697 F709 L715 R720 H721 M722	I683-M718 HydrophobicContact CD1-CE 3.87Å; I683-M718 HydrophobicContact CD1-SD 4.24Å; L688-M718 HydrophobicContact CB-CE 3.81Å; L688-M718 HydrophobicContact CB-SD 4.49Å; L688-M718 HydrophobicContact CD2-CE 4.37Å; Y697-M718 HydrophobicContact CE2-CB 4.21Å; Y697-M718 HydrophobicContact CE2-CE 3.76Å; Y697-M718 WeakPolarHBondContact OH-CA 3.43Å; Y697-M718 WeakPolarHBondContact OH-CB 3.4Å; Y697-M718 WeakPolarHBondContact OH-CG 3.42Å; F709-M718 HydrophobicContact CE1-CE 4.14Å; F709-M718 HydrophobicContact CE1-SD 4.42Å; L715-M718 HydrophobicContact CD2-SD 3.7Å; L715-M718 WeakPolarHBondContact O-CB 3.33Å; L715-M718 PolarHBondContact O-N 3.3Å; M718-R720 PolarHBondContact O-N 2.97Å; M718-H721 PolarHBondContact O-N 3.15Å; M718-H721 VanDerWaalsContact O-N 3.09Å; M718-M722 HydrophobicContact CB-CE 4.23Å; M718-M722 PolarHBondContact O-N 2.95Å
719	Y	94.7	Very high	92.4	Very high	32 Å²	32	69.8 Å²	69.8	13%	0.125	33%	0.328	C	S	.	.	H	α-helix	trans	-55.5	-49.3	179.2	-171.3	-112	0	0	0	112.2	D706 F709 R710 L715 T717 H721 M722 E723	D706-Y719 WeakPolarHBondContact OD1-CE2 3.5Å; D706-Y719 PolarHBondContact OD1-OH 2.9Å; F709-Y719 HydrophobicContact CB-CD2 3.6Å; F709-Y719 HydrophobicContact CB-CE2 4.34Å; F709-Y719 HydrophobicContact CB-CG 4.42Å; R710-Y719 HydrophobicContact CB-CD2 4.37Å; R710-Y719 HydrophobicContact CB-CE1 4.09Å; R710-Y719 HydrophobicContact CB-CE2 3.75Å; R710-Y719 WeakPolarHBondContact CD-OH 3.4Å; R710-Y719 HydrophobicContact CG-CE1 3.96Å; R710-Y719 HydrophobicContact CG-CE2 4.46Å; L715-Y719 PolarHBondContact O-N 3.04Å; T717-Y719 VanDerWaalsContact C-N 3.35Å; Y719-H721 PolarHBondContact O-N 3.45Å; Y719-M722 PolarHBondContact O-N 3.38Å; Y719-E723 VanDerWaalsContact O-CB 3.24Å; Y719-E723 WeakPolarHBondContact O-CB 3.22Å; Y719-E723 PolarHBondContact O-N 2.95Å
720	R	93.6	Very high	92.2	Very high	161 Å²	161	70 Å²	70	61%	0.608	33%	0.329	S	S	*	.	H	α-helix	trans	-66.1	-15.9	179.1	-69.4	171.2	179.9	149.3	0.2	114.7	S716 M718 K724	S716-R720 WeakPolarHBondContact O-CG 3.46Å; S716-R720 PolarHBondContact O-N 3.42Å; M718-R720 PolarHBondContact O-N 2.97Å; R720-K724 WeakPolarHBondContact O-CE 3.2Å
721	H	94.1	Very high	92.2	Very high	11 Å²	11	67.1 Å²	67.1	5%	0.051	33%	0.333	C	S	.	.	H	α-helix	trans	-88.9	-44.7	173.8	178.1	-98.1	0	0	0	110.7	P691 S692 F695 Y697 M718 Y719 H725	P691-H721 HydrophobicContact CB-CB 3.69Å; P691-H721 HydrophobicContact CG-CB 4.11Å; S692-H721 PolarHBondContact O-NE2 3.1Å; F695-H721 PolarHBondContact O-CE1 3.4Å; Y697-H721 AromaticContact CD1-CE1 3.65Å; Y697-H721 AromaticContact CD1-ND1 3.73Å; Y697-H721 AromaticContact CE1-CE1 3.62Å; Y697-H721 AromaticContact CE1-ND1 3.43Å; Y697-H721 WeakPolarHBondContact CE1-ND1 3.33Å; Y697-H721 AromaticContact CE2-ND1 3.96Å; Y697-H721 AromaticContact CZ-ND1 3.55Å; M718-H721 PolarHBondContact O-N 3.15Å; M718-H721 VanDerWaalsContact O-N 3.09Å; Y719-H721 PolarHBondContact O-N 3.45Å; H721-H725 PolarHBondContact O-ND1 3.18Å
722	M	94.5	Very high	92.3	Very high	1 Å²	1	66.8 Å²	66.8	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-65.7	-38.7	174.9	-67.2	-173.9	-66.7	0	0	113	Y697 F709 M718 Y719 K724 H725 N726 I746	Y697-M722 HydrophobicContact CD2-CG 3.49Å; Y697-M722 VanDerWaalsContact CD2-CG 3.49Å; Y697-M722 HydrophobicContact CD2-SD 3.77Å; Y697-M722 HydrophobicContact CE2-CE 4.49Å; Y697-M722 HydrophobicContact CE2-CG 3.44Å; Y697-M722 VanDerWaalsContact CE2-CG 3.44Å; Y697-M722 HydrophobicContact CE2-SD 3.8Å; F709-M722 HydrophobicContact CB-CE 4Å; F709-M722 HydrophobicContact CD1-CE 3.55Å; F709-M722 HydrophobicContact CD2-CE 3.74Å; F709-M722 HydrophobicContact CE1-CE 3.84Å; F709-M722 HydrophobicContact CE2-CE 4.03Å; F709-M722 HydrophobicContact CG-CE 3.5Å; F709-M722 VanDerWaalsContact CG-CE 3.5Å; F709-M722 HydrophobicContact CZ-CE 4.07Å; M718-M722 HydrophobicContact CB-CE 4.23Å; M718-M722 PolarHBondContact O-N 2.95Å; Y719-M722 PolarHBondContact O-N 3.38Å; M722-K724 PolarHBondContact O-N 2.72Å; M722-H725 CarbonylContact O-C 3.58Å; M722-H725 PolarHBondContact O-N 3.47Å; M722-N726 PolarHBondContact O-N 3.25Å; M722-N726 PolarHBondContact O-ND2 2.83Å; M722-N726 PolarHBondContact O-OD1 2.66Å; M722-N726 VanDerWaalsContact O-OD1 3.06Å; M722-I746 HydrophobicContact SD-CD1 4.11Å
723	E	93	Very high	92.5	Very high	112 Å²	112	63.6 Å²	63.6	52%	0.523	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-29.8	179.9	-176.1	173.5	-144.1	0	0	113.1	Y719	Y719-E723 VanDerWaalsContact O-CB 3.24Å; Y719-E723 WeakPolarHBondContact O-CB 3.22Å; Y719-E723 PolarHBondContact O-N 2.95Å
724	K	92.9	Very high	92.7	Very high	158 Å²	158	58 Å²	58	69%	0.687	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-22	176.5	-55	178.4	-174.3	176.9	0	114.5	R720 M722	R720-K724 WeakPolarHBondContact O-CE 3.2Å; M722-K724 PolarHBondContact O-N 2.72Å
725	H	94.3	Very high	92.8	Very high	57 Å²	57	54.9 Å²	54.9	26%	0.264	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	-0.1	-166.9	-56.7	111.2	0	0	0	113.8	I696 A698 H721 M722 Y727	I696-H725 HydrophobicContact CG2-CB 4.04Å; A698-H725 HydrophobicContact CB-CB 4.19Å; A698-H725 WeakPolarHBondContact CB-O 3.3Å; H721-H725 PolarHBondContact O-ND1 3.18Å; M722-H725 CarbonylContact O-C 3.58Å; M722-H725 PolarHBondContact O-N 3.47Å; H725-Y727 WeakPolarHBondContact O-CD2 3.37Å; H725-Y727 VanDerWaalsContact O-CE2 3.3Å; H725-Y727 WeakPolarHBondContact O-CE2 2.94Å
726	N	94.7	Very high	93	Very high	16 Å²	16	54.8 Å²	54.8	9%	0.086	27%	0.273	C	S	.	.			trans	-64	144.4	-179.7	-74.2	-21.3	0	0	0	112.6	T699 K701 M722	T699-N726 WeakPolarHBondContact CG2-OD1 3.45Å; T699-N726 PolarHBondContact N-OD1 2.78Å; T699-N726 WeakPolarHBondContact O-CA 3.3Å; T699-N726 VanDerWaalsContact O-CB 3.3Å; T699-N726 WeakPolarHBondContact O-CB 3.35Å; T699-N726 PolarHBondContact O-OD1 2.9Å; T699-N726 VanDerWaalsContact O-OD1 3.12Å; K701-N726 WeakPolarHBondContact CE-O 3.34Å; K701-N726 HydrophobicContact CG-CB 3.51Å; M722-N726 PolarHBondContact O-N 3.25Å; M722-N726 PolarHBondContact O-ND2 2.83Å; M722-N726 PolarHBondContact O-OD1 2.66Å; M722-N726 VanDerWaalsContact O-OD1 3.06Å
727	Y	94.1	Very high	93.1	Very high	60 Å²	60	52.8 Å²	52.8	24%	0.235	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-97	165.1	-179.1	-70.2	-97.3	0	0	0	111.7	A698 T699 V700 K701 H725 E732 A733 A736 L742	A698-Y727 HydrophobicContact CB-CD2 4.23Å; A698-Y727 HydrophobicContact CB-CE2 4.23Å; T699-Y727 PolarHBondContact O-N 3.05Å; V700-Y727 WeakPolarHBondContact CA-O 3.45Å; V700-Y727 WeakPolarHBondContact CG1-O 3.46Å; K701-Y727 PolarHBondContact N-O 3.03Å; H725-Y727 WeakPolarHBondContact O-CD2 3.37Å; H725-Y727 VanDerWaalsContact O-CE2 3.3Å; H725-Y727 WeakPolarHBondContact O-CE2 2.94Å; Y727-E732 HydrophobicContact CD1-CB 3.82Å; Y727-A733 HydrophobicContact CD2-CB 3.86Å; Y727-A733 HydrophobicContact CG-CB 3.91Å; Y727-A736 HydrophobicContact CE1-CB 3.94Å; Y727-A736 HydrophobicContact CE2-CB 4.41Å; Y727-A736 WeakPolarHBondContact OH-CB 3.17Å; Y727-L742 HydrophobicContact CD2-CD2 4.47Å; Y727-L742 HydrophobicContact CE2-CD1 4.43Å; Y727-L742 HydrophobicContact CE2-CD2 3.92Å
728	E	88.8	Confident	93.1	Very high	108 Å²	108	50.8 Å²	50.8	51%	0.505	24%	0.243	S	C	.	.	S	Bend	trans	-86	-29.5	176	-58.7	-61.9	157.9	0	0	111.7	V700 K701 E732	V700-E728 WeakPolarHBondContact CG1-O 3.07Å; K701-E728 WeakPolarHBondContact CD-OE1 3.47Å; K701-E728 WeakPolarHBondContact CE-OE1 3.06Å; K701-E728 IonicContact NZ-OE1 3.28Å; K701-E728 PolarHBondContact NZ-OE1 3.28Å; E728-E732 PolarHBondContact N-OE2 2.69Å; E728-E732 VanDerWaalsContact N-OE2 3.16Å
729	S	88.4	Confident	93.1	Very high	54 Å²	54	54.1 Å²	54.1	38%	0.378	26%	0.261	S	S	.	.	S	Bend	trans	-130.5	149.9	177	176.4	0	0	0	0	113.2	A731 E732 A733	S729-A731 VanDerWaalsContact C-N 3.28Å; S729-A731 PolarHBondContact O-N 3.2Å; S729-A731 PolarHBondContact OG-N 3.43Å; S729-E732 PolarHBondContact N-OE2 2.93Å; S729-E732 PolarHBondContact O-N 3.05Å; S729-A733 PolarHBondContact O-N 3.49Å
730	A	90.6	Very high	92.9	Very high	5 Å²	5	57.3 Å²	57.3	4%	0.041	28%	0.28	C	S	.	.	H	α-helix	trans	-61.2	-36.3	174.2	0	0	0	0	0	112	V700 E732 A733 I734 F745 W747	V700-A730 HydrophobicContact CG2-CB 4.12Å; A730-E732 VanDerWaalsContact C-N 3.34Å; A730-E732 PolarHBondContact O-N 2.8Å; A730-A733 PolarHBondContact O-N 3.09Å; A730-I734 HydrophobicContact CB-CD1 4.48Å; A730-I734 VanDerWaalsContact O-CD1 3.31Å; A730-I734 WeakPolarHBondContact O-CD1 3.37Å; A730-I734 VanDerWaalsContact O-CG1 3.24Å; A730-I734 WeakPolarHBondContact O-CG1 3.44Å; A730-I734 PolarHBondContact O-N 3.3Å; A730-F745 HydrophobicContact CB-CE1 4.47Å; A730-F745 HydrophobicContact CB-CZ 4.14Å; A730-W747 HydrophobicContact CB-CZ2 4.45Å
731	A	89.7	Confident	92.9	Very high	66 Å²	66	55.9 Å²	55.9	55%	0.545	28%	0.278	S	S	.	.	H	α-helix	trans	-63	-39	-179.8	0	0	0	0	0	112.3	S729 Q735	S729-A731 VanDerWaalsContact C-N 3.28Å; S729-A731 PolarHBondContact O-N 3.2Å; S729-A731 PolarHBondContact OG-N 3.43Å; A731-Q735 PolarHBondContact O-N 3.14Å; A731-Q735 VanDerWaalsContact O-N 3.08Å
732	E	92.5	Very high	92.9	Very high	98 Å²	98	55.4 Å²	55.4	46%	0.458	28%	0.276	S	S	.	.	H	α-helix	trans	-63.1	-45.9	174.4	-59.3	176.4	136.4	0	0	111.2	Y727 E728 S729 A730 Q735 A736	Y727-E732 HydrophobicContact CD1-CB 3.82Å; E728-E732 PolarHBondContact N-OE2 2.69Å; E728-E732 VanDerWaalsContact N-OE2 3.16Å; S729-E732 PolarHBondContact N-OE2 2.93Å; S729-E732 PolarHBondContact O-N 3.05Å; A730-E732 VanDerWaalsContact C-N 3.34Å; A730-E732 PolarHBondContact O-N 2.8Å; E732-Q735 PolarHBondContact O-N 2.87Å; E732-A736 WeakPolarHBondContact O-CB 3.33Å; E732-A736 PolarHBondContact O-N 3.19Å
733	A	94.5	Very high	92.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.3	-42.1	-178.9	0	0	0	0	0	112.1	Y727 S729 A730 Q735 A736 V737 L742 F745	Y727-A733 HydrophobicContact CD2-CB 3.86Å; Y727-A733 HydrophobicContact CG-CB 3.91Å; S729-A733 PolarHBondContact O-N 3.49Å; A730-A733 PolarHBondContact O-N 3.09Å; A733-Q735 VanDerWaalsContact C-N 3.34Å; A733-Q735 PolarHBondContact O-N 3.36Å; A733-A736 WeakPolarHBondContact O-CB 3.5Å; A733-A736 PolarHBondContact O-N 2.98Å; A733-V737 WeakPolarHBondContact O-CG2 3.49Å; A733-V737 PolarHBondContact O-N 3.48Å; A733-L742 HydrophobicContact CB-CD2 4.42Å; A733-F745 HydrophobicContact CB-CD1 4.28Å; A733-F745 HydrophobicContact CB-CD2 3.53Å; A733-F745 HydrophobicContact CB-CE1 4.16Å; A733-F745 HydrophobicContact CB-CE2 3.38Å; A733-F745 HydrophobicContact CB-CG 4Å; A733-F745 HydrophobicContact CB-CZ 3.73Å
734	I	94.3	Very high	92.9	Very high	6 Å²	6	53.9 Å²	53.9	3%	0.031	27%	0.269	C	S	.	.	H	α-helix	trans	-60.7	-44.2	174.8	-66.8	155.4	0	0	0	110.4	L557 A730 A736 V737 R738 F745 E755 L762	L557-I734 HydrophobicContact CD2-CG1 4.1Å; L557-I734 HydrophobicContact CD2-CG2 4.43Å; A730-I734 HydrophobicContact CB-CD1 4.48Å; A730-I734 VanDerWaalsContact O-CD1 3.31Å; A730-I734 WeakPolarHBondContact O-CD1 3.37Å; A730-I734 VanDerWaalsContact O-CG1 3.24Å; A730-I734 WeakPolarHBondContact O-CG1 3.44Å; A730-I734 PolarHBondContact O-N 3.3Å; I734-A736 VanDerWaalsContact C-N 3.34Å; I734-A736 PolarHBondContact O-N 3.09Å; I734-V737 PolarHBondContact O-N 3.45Å; I734-R738 VanDerWaalsContact CG2-NH1 3.34Å; I734-R738 PolarHBondContact O-N 3.14Å; I734-F745 HydrophobicContact CG1-CD1 4.11Å; I734-F745 HydrophobicContact CG1-CE1 3.94Å; I734-E755 HydrophobicContact CD1-CG 3.84Å; I734-E755 HydrophobicContact CG2-CG 4.37Å; I734-L762 HydrophobicContact CG2-CD1 3.95Å
735	Q	93.8	Very high	93.1	Very high	89 Å²	89	46.3 Å²	46.3	42%	0.416	24%	0.236	S	C	.	.	H	α-helix	trans	-66.6	-35.3	175.5	-170.5	58.3	40.1	0	0	112	A731 E732 A733 V737 R738 D739	A731-Q735 PolarHBondContact O-N 3.14Å; A731-Q735 VanDerWaalsContact O-N 3.08Å; E732-Q735 PolarHBondContact O-N 2.87Å; A733-Q735 VanDerWaalsContact C-N 3.34Å; A733-Q735 PolarHBondContact O-N 3.36Å; Q735-V737 VanDerWaalsContact C-N 3.3Å; Q735-V737 PolarHBondContact O-N 2.67Å; Q735-R738 PolarHBondContact O-N 3.31Å; Q735-D739 PolarHBondContact NE2-OD1 3.42Å; Q735-D739 WeakPolarHBondContact O-CB 3.24Å; Q735-D739 VanDerWaalsContact O-CG 3.25Å; Q735-D739 PolarHBondContact O-N 3.19Å
736	A	95.4	Very high	93.2	Very high	5 Å²	5	43.6 Å²	43.6	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-33	174.1	0	0	0	0	0	113	Y727 E732 A733 I734 N740 K741 L742	Y727-A736 HydrophobicContact CE1-CB 3.94Å; Y727-A736 HydrophobicContact CE2-CB 4.41Å; Y727-A736 WeakPolarHBondContact OH-CB 3.17Å; E732-A736 WeakPolarHBondContact O-CB 3.33Å; E732-A736 PolarHBondContact O-N 3.19Å; A733-A736 WeakPolarHBondContact O-CB 3.5Å; A733-A736 PolarHBondContact O-N 2.98Å; I734-A736 VanDerWaalsContact C-N 3.34Å; I734-A736 PolarHBondContact O-N 3.09Å; A736-N740 PolarHBondContact O-N 3.01Å; A736-K741 HydrophobicContact CB-CB 4.25Å; A736-K741 PolarHBondContact O-N 2.58Å; A736-L742 HydrophobicContact CB-CB 3.92Å; A736-L742 PolarHBondContact O-N 3.49Å
737	V	94.5	Very high	93.3	Very high	1 Å²	1	43 Å²	43	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-69.3	-44.2	170.5	-178.5	0	0	0	0	111	K559 A733 I734 Q735 D739 N740 L742 F745 L762	K559-V737 HydrophobicContact CB-CG1 4.16Å; A733-V737 WeakPolarHBondContact O-CG2 3.49Å; A733-V737 PolarHBondContact O-N 3.48Å; I734-V737 PolarHBondContact O-N 3.45Å; Q735-V737 VanDerWaalsContact C-N 3.3Å; Q735-V737 PolarHBondContact O-N 2.67Å; V737-D739 PolarHBondContact O-N 3.06Å; V737-N740 PolarHBondContact O-N 3.41Å; V737-N740 VanDerWaalsContact O-N 3.15Å; V737-L742 WeakPolarHBondContact CA-O 3.09Å; V737-L742 HydrophobicContact CG2-CB 4.02Å; V737-L742 HydrophobicContact CG2-CD2 3.9Å; V737-L742 HydrophobicContact CG2-CG 4.05Å; V737-F745 HydrophobicContact CG2-CB 3.77Å; V737-L762 HydrophobicContact CB-CD2 4.22Å; V737-L762 HydrophobicContact CG1-CD2 3.59Å
738	R	92.8	Very high	93.3	Very high	26 Å²	26	40.4 Å²	40.4	10%	0.098	21%	0.21	C	C	.	.	H	α-helix	trans	-59.1	-34.2	174.5	-69.8	-175.3	166.4	117.4	9.7	112.5	K559 I734 Q735 N740 E755 D761 L762	K559-R738 PolarHBondContact NZ-O 3.27Å; I734-R738 VanDerWaalsContact CG2-NH1 3.34Å; I734-R738 PolarHBondContact O-N 3.14Å; Q735-R738 PolarHBondContact O-N 3.31Å; R738-N740 VanDerWaalsContact C-N 3.33Å; R738-N740 PolarHBondContact O-N 3.08Å; R738-E755 IonicContact CZ-OE2 3.32Å; R738-E755 IonicContact NH1-OE2 2.66Å; R738-E755 PolarHBondContact NH1-OE2 3.21Å; R738-E755 PolarHBondContact NH2-O 3.05Å; R738-E755 IonicContact NH2-OE2 3.02Å; R738-E755 PolarHBondContact NH2-OE2 2.82Å; R738-D761 WeakPolarHBondContact CD-OD2 3.27Å; R738-D761 WeakPolarHBondContact CG-OD2 3.45Å; R738-D761 IonicContact CZ-OD2 3.67Å; R738-D761 IonicContact NE-OD1 2.77Å; R738-D761 IonicContact NE-OD2 2.6Å; R738-D761 PolarHBondContact NE-OD2 3Å; R738-D761 IonicContact NH2-OD1 2.66Å; R738-L762 HydrophobicContact CG-CD1 4Å; R738-L762 HydrophobicContact CG-CD2 4.02Å; R738-L762 HydrophobicContact CG-CG 4.19Å
739	D	93.5	Very high	93.6	Very high	70 Å²	70	35.4 Å²	35.4	37%	0.374	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-0.6	179.3	-72.8	2.1	0	0	0	114.8	Q735 V737 K741	Q735-D739 PolarHBondContact NE2-OD1 3.42Å; Q735-D739 WeakPolarHBondContact O-CB 3.24Å; Q735-D739 VanDerWaalsContact O-CG 3.25Å; Q735-D739 PolarHBondContact O-N 3.19Å; V737-D739 PolarHBondContact O-N 3.06Å; D739-K741 HydrophobicContact CB-CD 3.73Å; D739-K741 HydrophobicContact CB-CG 3.89Å; D739-K741 PolarHBondContact O-N 3.21Å; D739-K741 WeakPolarHBondContact OD2-CE 3.39Å; D739-K741 IonicContact OD2-NZ 3.48Å; D739-K741 PolarHBondContact OD2-NZ 3.04Å
740	N	90.8	Very high	93.7	Very high	99 Å²	99	32.9 Å²	32.9	53%	0.529	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	18.1	-168.6	-64.2	26.5	0	0	0	114.6	K559 A736 V737 R738	K559-N740 WeakPolarHBondContact CD-OD1 3.39Å; K559-N740 WeakPolarHBondContact CE-OD1 3.39Å; K559-N740 PolarHBondContact NZ-OD1 2.9Å; A736-N740 PolarHBondContact O-N 3.01Å; V737-N740 PolarHBondContact O-N 3.41Å; V737-N740 VanDerWaalsContact O-N 3.15Å; R738-N740 VanDerWaalsContact C-N 3.33Å; R738-N740 PolarHBondContact O-N 3.08Å
741	K	93.6	Very high	93.8	Very high	131 Å²	131	32.9 Å²	32.9	57%	0.57	17%	0.169	S	C	*	.	S	Bend	trans	-80.4	-32.2	175.7	-66.2	165.6	-177.1	161.8	0	111.7	A736 D739	A736-K741 HydrophobicContact CB-CB 4.25Å; A736-K741 PolarHBondContact O-N 2.58Å; D739-K741 HydrophobicContact CB-CD 3.73Å; D739-K741 HydrophobicContact CB-CG 3.89Å; D739-K741 PolarHBondContact O-N 3.21Å; D739-K741 WeakPolarHBondContact OD2-CE 3.39Å; D739-K741 IonicContact OD2-NZ 3.48Å; D739-K741 PolarHBondContact OD2-NZ 3.04Å
742	L	94.8	Very high	94	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.01	14%	0.143	C	C	.	.			trans	-118.8	131.7	177.1	-173.9	64.7	0	0	0	108.6	I696 A698 Y727 A733 A736 V737 A744 F745	I696-L742 HydrophobicContact CG2-CD1 3.96Å; A698-L742 HydrophobicContact CB-CD1 3.69Å; A698-L742 HydrophobicContact CB-CD2 4.11Å; Y727-L742 HydrophobicContact CD2-CD2 4.47Å; Y727-L742 HydrophobicContact CE2-CD1 4.43Å; Y727-L742 HydrophobicContact CE2-CD2 3.92Å; A733-L742 HydrophobicContact CB-CD2 4.42Å; A736-L742 HydrophobicContact CB-CB 3.92Å; A736-L742 PolarHBondContact O-N 3.49Å; V737-L742 WeakPolarHBondContact CA-O 3.09Å; V737-L742 HydrophobicContact CG2-CB 4.02Å; V737-L742 HydrophobicContact CG2-CD2 3.9Å; V737-L742 HydrophobicContact CG2-CG 4.05Å; L742-A744 WeakPolarHBondContact CG-O 3.41Å; L742-F745 HydrophobicContact CD2-CB 3.9Å; L742-F745 HydrophobicContact CD2-CD2 4.37Å; L742-F745 HydrophobicContact CD2-CG 4.49Å
743	H	93.1	Very high	93.9	Very high	80 Å²	80	27.9 Å²	27.9	37%	0.37	13%	0.134	S	C	.	.	S	Bend	trans	-86.9	-33.8	-176	-60.1	77.5	0	0	0	111.9	K694 F695 I696	K694-H743 PolarHBondContact O-CE1 3.35Å; F695-H743 HydrophobicContact CD2-CB 3.78Å; F695-H743 HydrophobicContact CE2-CB 3.45Å; F695-H743 VanDerWaalsContact CE2-CB 3.45Å; F695-H743 HydrophobicContact CZ-CB 3.95Å; I696-H743 PolarHBondContact N-ND1 3.07Å; I696-H743 WeakPolarHBondContact O-CB 3.2Å; I696-H743 PolarHBondContact O-N 3.43Å
744	A	94.4	Very high	93.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	137.9	176.8	0	0	0	0	0	111.8	I556 L557 V558 I680 F695 Y697 A698 L742	I556-A744 HydrophobicContact CG2-CB 3.73Å; L557-A744 WeakPolarHBondContact O-CA 3.42Å; V558-A744 HydrophobicContact CG1-CB 4.02Å; I680-A744 HydrophobicContact CD1-CB 3.81Å; F695-A744 HydrophobicContact CE1-CB 4.3Å; F695-A744 HydrophobicContact CZ-CB 3.94Å; Y697-A744 WeakPolarHBondContact CA-O 3.43Å; Y697-A744 WeakPolarHBondContact CB-O 3.33Å; A698-A744 PolarHBondContact N-O 3.33Å; L742-A744 WeakPolarHBondContact CG-O 3.41Å
745	F	96.6	Very high	93.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.8	176.1	174.5	-127.9	0	0	0	110.1	L557 A698 V700 A730 A733 I734 V737 L742 W747 L752	L557-F745 HydrophobicContact CB-CB 4.33Å; L557-F745 HydrophobicContact CD2-CD1 4.18Å; L557-F745 PolarHBondContact N-O 3.39Å; L557-F745 PolarHBondContact O-N 3.4Å; A698-F745 WeakPolarHBondContact O-CD2 3.35Å; V700-F745 HydrophobicContact CG2-CE2 3.96Å; V700-F745 HydrophobicContact CG2-CZ 3.87Å; A730-F745 HydrophobicContact CB-CE1 4.47Å; A730-F745 HydrophobicContact CB-CZ 4.14Å; A733-F745 HydrophobicContact CB-CD1 4.28Å; A733-F745 HydrophobicContact CB-CD2 3.53Å; A733-F745 HydrophobicContact CB-CE1 4.16Å; A733-F745 HydrophobicContact CB-CE2 3.38Å; A733-F745 HydrophobicContact CB-CG 4Å; A733-F745 HydrophobicContact CB-CZ 3.73Å; I734-F745 HydrophobicContact CG1-CD1 4.11Å; I734-F745 HydrophobicContact CG1-CE1 3.94Å; V737-F745 HydrophobicContact CG2-CB 3.77Å; L742-F745 HydrophobicContact CD2-CB 3.9Å; L742-F745 HydrophobicContact CD2-CD2 4.37Å; L742-F745 HydrophobicContact CD2-CG 4.49Å; F745-W747 HydrophobicContact CD1-CB 4.2Å; F745-W747 HydrophobicContact CE1-CB 3.61Å; F745-W747 AromaticContact CE1-CG 3.86Å; F745-W747 HydrophobicContact CE1-CG 3.86Å; F745-W747 HydrophobicContact CE2-CB 4.38Å; F745-W747 HydrophobicContact CE2-CE3 4.48Å; F745-W747 HydrophobicContact CZ-CB 3.71Å; F745-W747 AromaticContact CZ-CD2 3.91Å; F745-W747 HydrophobicContact CZ-CD2 3.91Å; F745-W747 HydrophobicContact CZ-CE3 4.18Å; F745-W747 AromaticContact CZ-CG 3.71Å; F745-W747 HydrophobicContact CZ-CG 3.71Å; F745-L752 HydrophobicContact CD1-CD2 3.84Å; F745-L752 HydrophobicContact CE1-CD2 3.88Å
746	I	96.6	Very high	93.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	117	-177.3	-56.6	179.1	0	0	0	109.5	I556 Y697 A698 T699 V705 F709 M722 F769	I556-I746 HydrophobicContact CG1-CG1 4.32Å; I556-I746 HydrophobicContact CG2-CG1 4.4Å; Y697-I746 HydrophobicContact CD2-CD1 4.32Å; A698-I746 PolarHBondContact O-N 3.06Å; T699-I746 WeakPolarHBondContact CB-O 3.31Å; T699-I746 PolarHBondContact OG1-O 3.42Å; V705-I746 HydrophobicContact CG1-CG2 4.17Å; F709-I746 HydrophobicContact CE2-CD1 4.49Å; F709-I746 HydrophobicContact CE2-CG2 4.07Å; F709-I746 HydrophobicContact CZ-CD1 4.09Å; F709-I746 HydrophobicContact CZ-CG2 4.4Å; M722-I746 HydrophobicContact SD-CD1 4.11Å; I746-F769 HydrophobicContact CG2-CZ 3.77Å
747	W	95.8	Very high	92.9	Very high	4 Å²	4	26.2 Å²	26.2	2%	0.015	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	175.5	-175.2	-157	-121.1	0	0	0	113.5	F500 L554 T555 V700 S703 V705 A730 F745 L752	F500-W747 HydrophobicContact CE2-CZ2 4.29Å; L554-W747 WeakPolarHBondContact CA-O 3.34Å; T555-W747 PolarHBondContact N-O 3.09Å; T555-W747 VanDerWaalsContact N-O 3.12Å; T555-W747 PolarHBondContact O-N 3.36Å; V700-W747 HydrophobicContact CB-CE3 4.25Å; V700-W747 HydrophobicContact CB-CH2 3.56Å; V700-W747 HydrophobicContact CB-CZ2 4.43Å; V700-W747 HydrophobicContact CB-CZ3 3.46Å; V700-W747 VanDerWaalsContact CB-CZ3 3.46Å; V700-W747 HydrophobicContact CG1-CH2 4.37Å; V700-W747 HydrophobicContact CG2-CD2 4.24Å; V700-W747 HydrophobicContact CG2-CE3 3.8Å; V700-W747 HydrophobicContact CG2-CH2 3.58Å; V700-W747 HydrophobicContact CG2-CZ2 4.02Å; V700-W747 HydrophobicContact CG2-CZ3 3.47Å; V700-W747 VanDerWaalsContact CG2-CZ3 3.47Å; S703-W747 VanDerWaalsContact CB-CZ3 3.49Å; V705-W747 HydrophobicContact CB-CE3 4.41Å; V705-W747 HydrophobicContact CB-CZ3 4.3Å; V705-W747 HydrophobicContact CG2-CE3 3.63Å; V705-W747 HydrophobicContact CG2-CZ3 3.72Å; A730-W747 HydrophobicContact CB-CZ2 4.45Å; F745-W747 HydrophobicContact CD1-CB 4.2Å; F745-W747 HydrophobicContact CE1-CB 3.61Å; F745-W747 AromaticContact CE1-CG 3.86Å; F745-W747 HydrophobicContact CE1-CG 3.86Å; F745-W747 HydrophobicContact CE2-CB 4.38Å; F745-W747 HydrophobicContact CE2-CE3 4.48Å; F745-W747 HydrophobicContact CZ-CB 3.71Å; F745-W747 AromaticContact CZ-CD2 3.91Å; F745-W747 HydrophobicContact CZ-CD2 3.91Å; F745-W747 HydrophobicContact CZ-CE3 4.18Å; F745-W747 AromaticContact CZ-CG 3.71Å; F745-W747 HydrophobicContact CZ-CG 3.71Å; W747-L752 HydrophobicContact CB-CD1 3.7Å; W747-L752 HydrophobicContact CB-CD2 3.92Å; W747-L752 HydrophobicContact CB-CG 3.86Å
748	D	94.9	Very high	92.4	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.027	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	125.5	177.3	-81.2	-12.8	0	0	0	111.2	Q552 L554 A750 V751 L752 F774	Q552-D748 VanDerWaalsContact NE2-CG 3.27Å; Q552-D748 PolarHBondContact NE2-OD1 2.85Å; Q552-D748 PolarHBondContact OE1-OD1 2.94Å; L554-D748 VanDerWaalsContact CD2-OD1 3.26Å; L554-D748 WeakPolarHBondContact CD2-OD1 3.37Å; D748-A750 VanDerWaalsContact C-N 3.34Å; D748-A750 PolarHBondContact O-N 3.43Å; D748-V751 PolarHBondContact O-N 3.02Å; D748-V751 VanDerWaalsContact O-N 3.13Å; D748-L752 PolarHBondContact O-N 3.23Å; D748-F774 HydrophobicContact CB-CZ 4.09Å; D748-F774 WeakPolarHBondContact OD2-CE1 3.38Å
749	S	94.1	Very high	91.7	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-66.1	-31.9	-164.7	81.9	0	0	0	0	114.1	G553 V751 L752 E753 L768	G553-S749 WeakPolarHBondContact O-CB 3.38Å; G553-S749 PolarHBondContact O-N 2.82Å; S749-V751 PolarHBondContact O-N 3.25Å; S749-V751 VanDerWaalsContact O-N 3.1Å; S749-L752 PolarHBondContact O-N 3.46Å; S749-E753 WeakPolarHBondContact CB-OE1 3.39Å; S749-E753 VanDerWaalsContact O-CB 3.3Å; S749-E753 WeakPolarHBondContact O-CB 3.36Å; S749-E753 VanDerWaalsContact O-CG 3.27Å; S749-E753 WeakPolarHBondContact O-CG 3.49Å; S749-E753 PolarHBondContact O-N 3.4Å; S749-E753 PolarHBondContact OG-OE1 3.13Å; S749-L768 VanDerWaalsContact CB-CD2 3.4Å; S749-L768 WeakPolarHBondContact OG-CD2 3.28Å
750	A	92	Very high	91.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.8	-18.3	178.7	0	0	0	0	0	113.6	F426 D748 F774	F426-A750 HydrophobicContact CE2-CB 4.03Å; F426-A750 HydrophobicContact CZ-CB 3.8Å; D748-A750 VanDerWaalsContact C-N 3.34Å; D748-A750 PolarHBondContact O-N 3.43Å; A750-F774 HydrophobicContact CB-CE2 4.13Å
751	V	92.9	Very high	91.1	Very high	5 Å²	5	29.8 Å²	29.8	3%	0.03	15%	0.146	C	C	.	.	H	α-helix	trans	-89	-42.2	170.5	178.1	0	0	0	0	110.7	Q423 F426 D748 S749 F754 E755	Q423-V751 HydrophobicContact CG-CG2 4.25Å; F426-V751 HydrophobicContact CE2-CG2 4.27Å; D748-V751 PolarHBondContact O-N 3.02Å; D748-V751 VanDerWaalsContact O-N 3.13Å; S749-V751 PolarHBondContact O-N 3.25Å; S749-V751 VanDerWaalsContact O-N 3.1Å; V751-F754 PolarHBondContact O-N 3.32Å; V751-E755 PolarHBondContact O-N 2.95Å; V751-E755 VanDerWaalsContact O-N 3.08Å
752	L	92.9	Very high	90.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-72.8	-35.4	-176.3	-61.9	-173	0	0	0	113.8	T555 L557 F745 W747 D748 S749 A756 T764	T555-L752 HydrophobicContact CG2-CB 3.9Å; T555-L752 HydrophobicContact CG2-CD1 3.59Å; T555-L752 HydrophobicContact CG2-CG 4.29Å; L557-L752 HydrophobicContact CB-CD1 3.95Å; L557-L752 HydrophobicContact CB-CD2 3.95Å; L557-L752 HydrophobicContact CB-CG 4.4Å; L557-L752 HydrophobicContact CD1-CB 4.36Å; L557-L752 HydrophobicContact CD1-CD2 4.37Å; L557-L752 HydrophobicContact CD2-CD2 3.93Å; L557-L752 HydrophobicContact CG-CD2 4.31Å; F745-L752 HydrophobicContact CD1-CD2 3.84Å; F745-L752 HydrophobicContact CE1-CD2 3.88Å; W747-L752 HydrophobicContact CB-CD1 3.7Å; W747-L752 HydrophobicContact CB-CD2 3.92Å; W747-L752 HydrophobicContact CB-CG 3.86Å; D748-L752 PolarHBondContact O-N 3.23Å; S749-L752 PolarHBondContact O-N 3.46Å; L752-A756 WeakPolarHBondContact O-CB 3.38Å; L752-A756 PolarHBondContact O-N 2.97Å; L752-T764 HydrophobicContact CB-CG2 3.72Å
753	E	89.8	Confident	90.7	Very high	60 Å²	60	24.8 Å²	24.8	28%	0.28	13%	0.127	S	C	.	.	H	α-helix	trans	-61.4	-44.2	172.7	-72	167.3	-132.2	0	0	110.5	S749 S757	S749-E753 WeakPolarHBondContact CB-OE1 3.39Å; S749-E753 VanDerWaalsContact O-CB 3.3Å; S749-E753 WeakPolarHBondContact O-CB 3.36Å; S749-E753 VanDerWaalsContact O-CG 3.27Å; S749-E753 WeakPolarHBondContact O-CG 3.49Å; S749-E753 PolarHBondContact O-N 3.4Å; S749-E753 PolarHBondContact OG-OE1 3.13Å; E753-S757 VanDerWaalsContact O-CB 3.29Å; E753-S757 WeakPolarHBondContact O-CB 3.22Å; E753-S757 PolarHBondContact O-N 3.33Å
754	F	91.3	Very high	90.6	Very high	11 Å²	11	23.4 Å²	23.4	5%	0.048	12%	0.124	C	C	.	.	H	α-helix	trans	-64.1	-46.1	176.1	170.1	-100.1	0	0	0	112.8	E424 P425 Y428 V751 A756 S757 Q758 V809	E424-F754 HydrophobicContact CB-CE1 4.46Å; P425-F754 HydrophobicContact CB-CD1 3.92Å; P425-F754 HydrophobicContact CB-CD2 3.8Å; P425-F754 HydrophobicContact CB-CE1 3.98Å; P425-F754 HydrophobicContact CB-CE2 3.87Å; P425-F754 HydrophobicContact CB-CG 3.83Å; P425-F754 HydrophobicContact CB-CZ 3.96Å; P425-F754 HydrophobicContact CG-CB 3.99Å; P425-F754 HydrophobicContact CG-CD1 4.05Å; P425-F754 HydrophobicContact CG-CD2 4.07Å; P425-F754 HydrophobicContact CG-CG 3.76Å; Y428-F754 WeakPolarHBondContact OH-CZ 3.24Å; V751-F754 PolarHBondContact O-N 3.32Å; F754-A756 PolarHBondContact O-N 2.94Å; F754-S757 PolarHBondContact O-N 3.13Å; F754-S757 PolarHBondContact O-OG 3.32Å; F754-Q758 VanDerWaalsContact CZ-NE2 3.32Å; F754-Q758 WeakPolarHBondContact O-CB 3.46Å; F754-Q758 PolarHBondContact O-N 2.98Å; F754-V809 HydrophobicContact CB-CG1 4.36Å
755	E	90.9	Very high	90.3	Very high	22 Å²	22	24 Å²	24	10%	0.103	13%	0.127	C	C	.	.	H	α-helix	trans	-66.2	-36.9	178.8	-86.3	-78.6	172.1	0	0	113.1	I734 R738 V751	I734-E755 HydrophobicContact CD1-CG 3.84Å; I734-E755 HydrophobicContact CG2-CG 4.37Å; R738-E755 IonicContact CZ-OE2 3.32Å; R738-E755 IonicContact NH1-OE2 2.66Å; R738-E755 PolarHBondContact NH1-OE2 3.21Å; R738-E755 PolarHBondContact NH2-O 3.05Å; R738-E755 IonicContact NH2-OE2 3.02Å; R738-E755 PolarHBondContact NH2-OE2 2.82Å; V751-E755 PolarHBondContact O-N 2.95Å; V751-E755 VanDerWaalsContact O-N 3.08Å
756	A	88.9	Confident	89.7	Confident	12 Å²	12	25.6 Å²	25.6	10%	0.099	14%	0.144	C	C	.	.	H	α-helix	trans	-65.2	-41.6	171.6	0	0	0	0	0	111.3	L752 F754 Q758 C760 C814	L752-A756 WeakPolarHBondContact O-CB 3.38Å; L752-A756 PolarHBondContact O-N 2.97Å; F754-A756 PolarHBondContact O-N 2.94Å; A756-Q758 PolarHBondContact O-N 3.15Å; A756-C760 WeakPolarHBondContact O-CA 3.35Å; A756-C760 PolarHBondContact O-N 3.22Å; A756-C814 PolarHBondContact O-SG 3.49Å; A756-C814 VanDerWaalsContact O-SG 3.34Å
757	S	85.7	Confident	89.3	Confident	19 Å²	19	33.2 Å²	33.2	13%	0.133	18%	0.18	C	C	.	.	H	α-helix	trans	-69	-29.7	-179.3	84.5	0	0	0	0	113.7	E753 F754 Q812 C814	E753-S757 VanDerWaalsContact O-CB 3.29Å; E753-S757 WeakPolarHBondContact O-CB 3.22Å; E753-S757 PolarHBondContact O-N 3.33Å; F754-S757 PolarHBondContact O-N 3.13Å; F754-S757 PolarHBondContact O-OG 3.32Å; S757-Q812 WeakPolarHBondContact CB-O 3.43Å; S757-C814 PolarHBondContact O-SG 3.43Å
758	Q	84.2	Confident	89.1	Confident	72 Å²	72	36.2 Å²	36.2	34%	0.336	20%	0.196	S	C	.	.	H	α-helix	trans	-72.4	-36.7	-175	-168.7	-172.1	97.9	0	0	113.7	F754 A756	F754-Q758 VanDerWaalsContact CZ-NE2 3.32Å; F754-Q758 WeakPolarHBondContact O-CB 3.46Å; F754-Q758 PolarHBondContact O-N 2.98Å; A756-Q758 PolarHBondContact O-N 3.15Å
759	K	78.4	Confident	89	Confident	106 Å²	106	37.1 Å²	37.1	46%	0.461	20%	0.199	S	C	.	.	H	α-helix	trans	-128.8	-10.9	-171.5	-65.2	-177.2	-158.2	144.9	0	115.1	D761	K759-D761 WeakPolarHBondContact CB-OD1 3.36Å; K759-D761 PolarHBondContact O-N 3.19Å
760	C	84.5	Confident	88.8	Confident	45 Å²	45	39.5 Å²	39.5	30%	0.304	21%	0.209	S	C	.	.	S	Bend	trans	56.4	9	177.1	-45.4	0	0	0	0	116.3	A756 C814	A756-C760 WeakPolarHBondContact O-CA 3.35Å; A756-C760 PolarHBondContact O-N 3.22Å; C760-C814 WeakPolarHBondContact CA-SG 3.24Å; C760-C814 HydrophobicContact CB-CB 3.9Å; C760-C814 WeakPolarHBondContact CB-SG 3.24Å; C760-C814 WeakPolarHBondContact SG-CB 3.31Å; C760-C814 CovalentContact SG-SG 2.04Å; C760-C814 PolarHBondContact SG-SG 3.24Å
761	D	87.6	Confident	88.8	Confident	49 Å²	49	48.7 Å²	48.7	26%	0.262	24%	0.244	S	C	.	.	S	Bend	trans	-86.6	-19.8	175.3	64.9	-33.4	0	0	0	112.6	K560 R738 K759	K560-D761 WeakPolarHBondContact CB-O 3.49Å; K560-D761 PolarHBondContact N-O 3.27Å; R738-D761 WeakPolarHBondContact CD-OD2 3.27Å; R738-D761 WeakPolarHBondContact CG-OD2 3.45Å; R738-D761 IonicContact CZ-OD2 3.67Å; R738-D761 IonicContact NE-OD1 2.77Å; R738-D761 IonicContact NE-OD2 2.6Å; R738-D761 PolarHBondContact NE-OD2 3Å; R738-D761 IonicContact NH2-OD1 2.66Å; K759-D761 WeakPolarHBondContact CB-OD1 3.36Å; K759-D761 PolarHBondContact O-N 3.19Å
762	L	89.9	Confident	88.8	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	155.2	177.5	-58.7	168.4	0	0	0	109.9	L557 V558 K559 I734 V737 R738	L557-L762 HydrophobicContact CD1-CB 3.88Å; L557-L762 HydrophobicContact CD1-CD1 4.38Å; L557-L762 HydrophobicContact CD2-CD1 3.96Å; L557-L762 HydrophobicContact CG-CB 4.35Å; L557-L762 HydrophobicContact CG-CD1 4.43Å; V558-L762 WeakPolarHBondContact O-CA 3.42Å; K559-L762 HydrophobicContact CB-CD2 4.39Å; I734-L762 HydrophobicContact CG2-CD1 3.95Å; V737-L762 HydrophobicContact CB-CD2 4.22Å; V737-L762 HydrophobicContact CG1-CD2 3.59Å; R738-L762 HydrophobicContact CG-CD1 4Å; R738-L762 HydrophobicContact CG-CD2 4.02Å; R738-L762 HydrophobicContact CG-CG 4.19Å
763	V	89.4	Confident	88.9	Confident	26 Å²	26	49.7 Å²	49.7	16%	0.158	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	142.6	173.8	-70.1	0	0	0	0	110.5	V558 K560 T765	V558-V763 HydrophobicContact CG2-CG2 3.69Å; V558-V763 PolarHBondContact N-O 3.13Å; V558-V763 PolarHBondContact O-N 2.62Å; K560-V763 HydrophobicContact CB-CG1 4.25Å; K560-V763 HydrophobicContact CD-CG1 4.37Å; K560-V763 HydrophobicContact CG-CG1 4.48Å; V763-T765 HydrophobicContact CG2-CG2 4.41Å
764	T	91.1	Very high	89.2	Confident	50 Å²	50	46.9 Å²	46.9	31%	0.307	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	150.1	166	47	0	0	0	0	110.3	T555 I556 L557 L752	T555-T764 HydrophobicContact CG2-CG2 3.7Å; I556-T764 CarbonylContact O-C 3.49Å; I556-T764 WeakPolarHBondContact O-CA 3.29Å; L557-T764 HydrophobicContact CD1-CG2 4.39Å; L752-T764 HydrophobicContact CB-CG2 3.72Å
765	T	87.7	Confident	89.4	Confident	12 Å²	12	46.4 Å²	46.4	7%	0.074	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	148.6	-173.7	51.3	0	0	0	0	112.2	T555 I556 V558 R679 V763	T555-T765 PolarHBondContact OG1-O 3.02Å; I556-T765 PolarHBondContact N-O 3.27Å; I556-T765 PolarHBondContact O-N 3.48Å; I556-T765 PolarHBondContact O-OG1 3.43Å; V558-T765 HydrophobicContact CG2-CG2 3.64Å; R679-T765 HydrophobicContact CB-CG2 4.03Å; V763-T765 HydrophobicContact CG2-CG2 4.41Å
766	G	83.9	Confident	89.8	Confident	35 Å²	35	45.3 Å²	45.3	36%	0.361	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	73.2	168.9	-175.6	0	0	0	0	0	115.1	T681	T681-G766 WeakPolarHBondContact O-CA 3.48Å
767	E	88.7	Confident	90.1	Very high	160 Å²	160	44.8 Å²	44.8	75%	0.748	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	154.6	173.4	-66.5	-166.9	176.3	0	0	113	F769	E767-F769 PolarHBondContact O-N 3.04Å
768	L	92.1	Very high	90.5	Very high	67 Å²	67	43.9 Å²	43.9	35%	0.351	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	98.8	173.3	-65.5	176	0	0	0	111.7	S749 R771	S749-L768 VanDerWaalsContact CB-CD2 3.4Å; S749-L768 WeakPolarHBondContact OG-CD2 3.28Å; L768-R771 PolarHBondContact O-NE 2.88Å
769	F	91.7	Very high	90.8	Very high	23 Å²	23	43.5 Å²	43.5	10%	0.101	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	162.9	172.8	67.7	-83	0	0	0	111.3	L554 I556 I683 F709 I746 E767 R771	L554-F769 HydrophobicContact CB-CD1 4.21Å; L554-F769 HydrophobicContact CB-CD2 3.95Å; L554-F769 HydrophobicContact CB-CE1 3.89Å; L554-F769 HydrophobicContact CB-CE2 3.62Å; L554-F769 HydrophobicContact CB-CG 4.24Å; L554-F769 HydrophobicContact CB-CZ 3.6Å; L554-F769 HydrophobicContact CD1-CD2 4.23Å; L554-F769 HydrophobicContact CD1-CE2 3.7Å; L554-F769 HydrophobicContact CD1-CZ 4.3Å; L554-F769 HydrophobicContact CG-CE2 4.29Å; L554-F769 PolarHBondContact N-O 3.27Å; L554-F769 VanDerWaalsContact O-CD1 3.24Å; L554-F769 WeakPolarHBondContact O-CD1 3.26Å; L554-F769 PolarHBondContact O-N 2.92Å; I556-F769 HydrophobicContact CD1-CE1 4.37Å; I556-F769 HydrophobicContact CG1-CE1 4.06Å; I683-F769 HydrophobicContact CB-CD1 3.93Å; I683-F769 HydrophobicContact CB-CD2 4.18Å; I683-F769 HydrophobicContact CB-CE1 4.05Å; I683-F769 HydrophobicContact CB-CE2 4.29Å; I683-F769 HydrophobicContact CB-CG 4Å; I683-F769 HydrophobicContact CB-CZ 4.22Å; I683-F769 HydrophobicContact CD1-CD2 4.46Å; I683-F769 HydrophobicContact CD1-CE1 4.43Å; I683-F769 HydrophobicContact CD1-CE2 3.84Å; I683-F769 HydrophobicContact CD1-CZ 3.82Å; I683-F769 HydrophobicContact CG1-CD2 3.98Å; I683-F769 HydrophobicContact CG1-CE1 4.45Å; I683-F769 HydrophobicContact CG1-CE2 3.87Å; I683-F769 HydrophobicContact CG1-CG 4.31Å; I683-F769 HydrophobicContact CG1-CZ 4.11Å; I683-F769 HydrophobicContact CG2-CB 4.11Å; I683-F769 HydrophobicContact CG2-CD1 4.29Å; I683-F769 HydrophobicContact CG2-CD2 4.46Å; I683-F769 HydrophobicContact CG2-CG 4.06Å; F709-F769 HydrophobicContact CZ-CE2 4.23Å; I746-F769 HydrophobicContact CG2-CZ 3.77Å; E767-F769 PolarHBondContact O-N 3.04Å; F769-R771 PolarHBondContact O-N 3.4Å
770	F	90.9	Very high	91	Very high	53 Å²	53	43 Å²	43	23%	0.232	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	45.7	55.8	-174.3	-174.8	-119.8	0	0	0	113.3	L554 Y708 S772	L554-F770 HydrophobicContact CD1-CB 3.97Å; L554-F770 HydrophobicContact CD1-CD1 3.83Å; L554-F770 HydrophobicContact CD1-CG 4.33Å; L554-F770 HydrophobicContact CG-CB 4.14Å; L554-F770 HydrophobicContact CG-CD1 4Å; Y708-F770 HydrophobicContact CD2-CB 4.21Å; Y708-F770 AromaticContact CD2-CD1 3.91Å; Y708-F770 HydrophobicContact CD2-CD1 3.91Å; Y708-F770 AromaticContact CD2-CD2 3.4Å; Y708-F770 HydrophobicContact CD2-CD2 3.4Å; Y708-F770 HydrophobicContact CD2-CE1 4.13Å; Y708-F770 AromaticContact CD2-CE2 3.65Å; Y708-F770 HydrophobicContact CD2-CE2 3.65Å; Y708-F770 AromaticContact CD2-CG 3.55Å; Y708-F770 HydrophobicContact CD2-CG 3.55Å; Y708-F770 HydrophobicContact CD2-CZ 4.01Å; Y708-F770 HydrophobicContact CE1-CB 4.5Å; Y708-F770 HydrophobicContact CE2-CB 3.8Å; Y708-F770 HydrophobicContact CE2-CD1 4.36Å; Y708-F770 AromaticContact CE2-CD2 3.33Å; Y708-F770 HydrophobicContact CE2-CD2 3.33Å; Y708-F770 AromaticContact CE2-CE2 3.99Å; Y708-F770 HydrophobicContact CE2-CE2 3.99Å; Y708-F770 AromaticContact CE2-CG 3.56Å; Y708-F770 HydrophobicContact CE2-CG 3.56Å; Y708-F770 HydrophobicContact CG-CD1 4.19Å; Y708-F770 HydrophobicContact CG-CD2 4.42Å; Y708-F770 HydrophobicContact CG-CE1 4.44Å; Y708-F770 HydrophobicContact CG-CG 4.18Å; F770-S772 PolarHBondContact O-N 2.92Å
771	R	92.6	Very high	90.7	Very high	193 Å²	193	43.8 Å²	43.8	73%	0.728	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-58.3	130.9	178.2	-60.6	-176.3	-172.4	-178.5	3.1	110.8	Q552 L768 F769	Q552-R771 WeakPolarHBondContact O-CA 3.45Å; L768-R771 PolarHBondContact O-NE 2.88Å; F769-R771 PolarHBondContact O-N 3.4Å
772	S	92.5	Very high	90.5	Very high	21 Å²	21	42.5 Å²	42.5	15%	0.147	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	-167.2	-177.1	79	0	0	0	0	110.5	T534 Q552 F770	T534-S772 VanDerWaalsContact CG2-OG 3.27Å; T534-S772 WeakPolarHBondContact CG2-OG 3.31Å; Q552-S772 PolarHBondContact N-O 2.85Å; Q552-S772 PolarHBondContact NE2-OG 3Å; Q552-S772 PolarHBondContact O-N 3.44Å; F770-S772 PolarHBondContact O-N 2.92Å
773	G	94.4	Very high	90.2	Very high	6 Å²	6	44.9 Å²	44.9	6%	0.062	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	163.2	165.4	0	0	0	0	0	112.1	I535 K550	I535-G773 WeakPolarHBondContact CG1-O 3.26Å; I535-G773 PolarHBondContact N-O 3.37Å; K550-G773 CarbonylContact O-C 3.56Å; K550-G773 WeakPolarHBondContact O-CA 3.41Å
774	F	96.4	Very high	90.1	Very high	1 Å²	1	44.7 Å²	44.7	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	137.4	166.2	-58.1	-43.6	0	0	0	109.7	F426 P532 L533 P548 F549 K550 Q552 D748 A750	F426-F774 HydrophobicContact CE1-CD2 4.29Å; F426-F774 HydrophobicContact CE1-CE2 4.4Å; F426-F774 HydrophobicContact CE2-CD2 4.49Å; F426-F774 AromaticContact CE2-CE2 3.84Å; F426-F774 HydrophobicContact CE2-CE2 3.84Å; F426-F774 AromaticContact CZ-CD2 3.97Å; F426-F774 HydrophobicContact CZ-CD2 3.97Å; F426-F774 AromaticContact CZ-CE2 3.65Å; F426-F774 HydrophobicContact CZ-CE2 3.65Å; P532-F774 VanDerWaalsContact C-CD1 3.43Å; P532-F774 HydrophobicContact CB-CD1 4.1Å; P532-F774 HydrophobicContact CB-CD2 3.86Å; P532-F774 HydrophobicContact CB-CE1 4.03Å; P532-F774 HydrophobicContact CB-CE2 3.79Å; P532-F774 HydrophobicContact CB-CG 4.03Å; P532-F774 HydrophobicContact CB-CZ 3.89Å; P532-F774 WeakPolarHBondContact O-CD1 3.49Å; P532-F774 WeakPolarHBondContact O-CE1 3.45Å; L533-F774 WeakPolarHBondContact O-CA 3.45Å; P548-F774 CarbonylContact C-O 3.49Å; P548-F774 WeakPolarHBondContact CA-O 3.41Å; F549-F774 HydrophobicContact CD1-CB 4.37Å; F549-F774 WeakPolarHBondContact CD1-O 3.36Å; F549-F774 HydrophobicContact CE1-CB 3.68Å; F549-F774 HydrophobicContact CE2-CB 3.91Å; F549-F774 HydrophobicContact CE2-CD2 4.48Å; F549-F774 HydrophobicContact CZ-CB 3.43Å; F549-F774 VanDerWaalsContact CZ-CB 3.43Å; F549-F774 HydrophobicContact CZ-CG 4.36Å; F549-F774 PolarHBondContact N-O 3.17Å; K550-F774 HydrophobicContact CB-CD2 4.15Å; K550-F774 HydrophobicContact CG-CD2 4.27Å; K550-F774 PolarHBondContact O-N 2.85Å; Q552-F774 HydrophobicContact CG-CE1 4.23Å; Q552-F774 HydrophobicContact CG-CE2 4.3Å; Q552-F774 HydrophobicContact CG-CZ 4.04Å; D748-F774 HydrophobicContact CB-CZ 4.09Å; D748-F774 WeakPolarHBondContact OD2-CE1 3.38Å; A750-F774 HydrophobicContact CB-CE2 4.13Å
775	G	96.4	Very high	90.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.219	C	C	.	.			trans	-142	152.1	179.3	0	0	0	0	0	111.5	L533 G777	L533-G775 PolarHBondContact O-N 2.86Å; G775-G777 PolarHBondContact O-N 3.19Å
776	I	97.6	Very high	90.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.239	C	C	.	.			trans	-70.4	127.9	173.3	-65.5	-176.8	0	0	0	108	L482 M528 I529 V530 S546 F549 M778 V788 I792	L482-I776 HydrophobicContact CD1-CD1 3.4Å; L482-I776 VanDerWaalsContact CD1-CD1 3.4Å; M528-I776 HydrophobicContact CG-CG2 3.37Å; M528-I776 HydrophobicContact SD-CG2 3.58Å; M528-I776 VanDerWaalsContact SD-CG2 3.58Å; I529-I776 WeakPolarHBondContact O-CG2 3.43Å; V530-I776 HydrophobicContact CG1-CD1 4.44Å; V530-I776 HydrophobicContact CG2-CD1 4.17Å; V530-I776 HydrophobicContact CG2-CG1 4.38Å; V530-I776 HydrophobicContact CG2-CG2 4.21Å; S546-I776 PolarHBondContact N-O 2.99Å; S546-I776 PolarHBondContact OG-N 3.35Å; F549-I776 HydrophobicContact CD1-CG1 4.47Å; I776-M778 HydrophobicContact CG2-CE 4.26Å; I776-M778 HydrophobicContact CG2-CG 4.49Å; I776-V788 HydrophobicContact CB-CG1 4.34Å; I776-V788 HydrophobicContact CD1-CG1 4.1Å; I776-V788 HydrophobicContact CG2-CG1 4.3Å; I776-I792 HydrophobicContact CD1-CD1 4.1Å; I776-I792 HydrophobicContact CG1-CD1 4.37Å
777	G	96.2	Very high	90.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	137.4	178.1	0	0	0	0	0	111.2	M528 I529 G775	M528-G777 CarbonylContact C-O 3.58Å; M528-G777 WeakPolarHBondContact CA-O 3.44Å; I529-G777 PolarHBondContact N-O 3.38Å; I529-G777 PolarHBondContact O-N 3.24Å; G775-G777 PolarHBondContact O-N 3.19Å
778	M	94.5	Very high	90.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	157.1	177.9	-71.8	157.7	-76.6	0	0	110.4	M528 I543 E544 I776 W784 K785 V788	M528-M778 HydrophobicContact CB-CG 4.34Å; M528-M778 HydrophobicContact CE-CG 4.12Å; M528-M778 HydrophobicContact CE-SD 4.05Å; M528-M778 HydrophobicContact CG-CG 3.92Å; I543-M778 WeakPolarHBondContact CB-O 3.39Å; E544-M778 PolarHBondContact N-O 2.85Å; E544-M778 PolarHBondContact O-N 2.77Å; I776-M778 HydrophobicContact CG2-CE 4.26Å; I776-M778 HydrophobicContact CG2-CG 4.49Å; M778-W784 HydrophobicContact SD-CB 4.41Å; M778-K785 HydrophobicContact CE-CB 3.86Å; M778-K785 HydrophobicContact CE-CG 3.73Å; M778-K785 VanDerWaalsContact SD-CA 3.59Å; M778-K785 HydrophobicContact SD-CB 3.85Å; M778-K785 HydrophobicContact SD-CG 4.41Å; M778-V788 HydrophobicContact CE-CB 4.41Å; M778-V788 HydrophobicContact CE-CG1 4.19Å; M778-V788 HydrophobicContact SD-CB 4.36Å; M778-V788 HydrophobicContact SD-CG2 4.09Å
779	R	89.9	Confident	91.1	Very high	65 Å²	65	41 Å²	41	25%	0.245	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	145.4	168.8	-68.3	-167.9	-85.2	136.4	-6.7	109.9	E210 L521 D527 S782	E210-R779 IonicContact OE1-NH1 2.98Å; L521-R779 HydrophobicContact CD1-CG 3.76Å; L521-R779 HydrophobicContact CG-CG 4.17Å; L521-R779 WeakPolarHBondContact O-CD 3.02Å; L521-R779 WeakPolarHBondContact O-CG 3.44Å; D527-R779 IonicContact OD1-CZ 2.61Å; D527-R779 IonicContact OD1-NE 2.86Å; D527-R779 IonicContact OD1-NH2 3.2Å; D527-R779 PolarHBondContact OD1-NH2 3.43Å; R779-S782 WeakPolarHBondContact O-CB 3.37Å; R779-S782 PolarHBondContact O-N 3.25Å
780	K	83.1	Confident	91.3	Very high	95 Å²	95	44.4 Å²	44.4	41%	0.413	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	147.9	-180	-91	-175.2	173	-172.9	0	111.9	A540 Q541 Y542 E544 S782	A540-K780 VanDerWaalsContact O-CE 3.32Å; A540-K780 WeakPolarHBondContact O-CE 3.45Å; A540-K780 PolarHBondContact O-NZ 3.39Å; Q541-K780 PolarHBondContact O-NZ 3.11Å; Y542-K780 WeakPolarHBondContact O-CD 3.45Å; Y542-K780 WeakPolarHBondContact O-CG 3.49Å; E544-K780 HydrophobicContact CB-CG 4.35Å; K780-S782 PolarHBondContact O-N 2.99Å; K780-S782 VanDerWaalsContact O-N 3.08Å
781	D	77.4	Confident	91.5	Very high	61 Å²	61	42.4 Å²	42.4	33%	0.326	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	8.3	-173.8	-72.4	-67.3	0	0	0	115.9	R205 K208	R205-D781 IonicContact NH1-OD1 3.88Å; R205-D781 PolarHBondContact NH1-OD1 3.28Å; R205-D781 VanDerWaalsContact NH1-OD1 3.14Å; K208-D781 IonicContact NZ-OD1 2.69Å; K208-D781 IonicContact NZ-OD2 3.79Å; K208-D781 PolarHBondContact NZ-OD2 3.48Å
782	S	83.8	Confident	91.7	Very high	23 Å²	23	33.2 Å²	33.2	16%	0.161	17%	0.17	C	C	.	.			trans	-54.8	131.5	179.1	177.9	0	0	0	0	112.9	R779 K780 W784 K785	R779-S782 WeakPolarHBondContact O-CB 3.37Å; R779-S782 PolarHBondContact O-N 3.25Å; K780-S782 PolarHBondContact O-N 2.99Å; K780-S782 VanDerWaalsContact O-N 3.08Å; S782-W784 VanDerWaalsContact C-N 3.26Å; S782-W784 PolarHBondContact O-N 3.01Å; S782-K785 PolarHBondContact O-N 3.37Å
783	P	83.1	Confident	91.8	Very high	52 Å²	52	35.5 Å²	35.5	34%	0.338	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-28	-176.3	25.2	-34.4	0	0	0	113.3	M412 K785	M412-P783 HydrophobicContact CE-CB 3.84Å; M412-P783 HydrophobicContact CE-CG 3.83Å; M412-P783 HydrophobicContact CG-CG 4.28Å; M412-P783 HydrophobicContact SD-CB 4.07Å; M412-P783 HydrophobicContact SD-CG 4.02Å; P783-K785 VanDerWaalsContact C-N 3.26Å; P783-K785 PolarHBondContact O-N 3.45Å
784	W	88.6	Confident	92	Very high	21 Å²	21	37.8 Å²	37.8	8%	0.08	20%	0.195	C	C	.	.	H	α-helix	trans	-66	-24.8	-179.2	-67.7	104.9	0	0	0	114	M412 S413 L416 M486 F488 M528 M778 S782 Q786 N787 V788	M412-W784 HydrophobicContact CE-CD2 3.42Å; M412-W784 VanDerWaalsContact CE-CD2 3.42Å; M412-W784 HydrophobicContact CE-CE3 3.82Å; M412-W784 HydrophobicContact CE-CG 3.93Å; M412-W784 HydrophobicContact CE-CH2 3.92Å; M412-W784 HydrophobicContact CE-CZ2 3.53Å; M412-W784 HydrophobicContact CE-CZ3 4.04Å; M412-W784 HydrophobicContact CG-CZ2 4.25Å; S413-W784 WeakPolarHBondContact O-CZ2 3.44Å; L416-W784 HydrophobicContact CD1-CD2 4.36Å; L416-W784 HydrophobicContact CD1-CG 4.5Å; M486-W784 HydrophobicContact CB-CZ3 4.24Å; F488-W784 HydrophobicContact CB-CH2 3.93Å; F488-W784 HydrophobicContact CB-CZ2 4.34Å; F488-W784 HydrophobicContact CB-CZ3 4.45Å; F488-W784 HydrophobicContact CD1-CZ3 4.34Å; M528-W784 HydrophobicContact CE-CB 4.38Å; M778-W784 HydrophobicContact SD-CB 4.41Å; S782-W784 VanDerWaalsContact C-N 3.26Å; S782-W784 PolarHBondContact O-N 3.01Å; W784-Q786 VanDerWaalsContact C-N 3.32Å; W784-Q786 PolarHBondContact O-N 2.86Å; W784-N787 PolarHBondContact O-N 3.3Å; W784-N787 VanDerWaalsContact O-N 3.13Å; W784-V788 HydrophobicContact CB-CG2 4.23Å; W784-V788 VanDerWaalsContact O-CG2 3.3Å; W784-V788 WeakPolarHBondContact O-CG2 3.36Å; W784-V788 PolarHBondContact O-N 2.96Å
785	K	89.9	Confident	91.9	Very high	53 Å²	53	38 Å²	38	23%	0.23	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-35.5	-166.3	179.1	-103.3	173.7	156.9	0	114.6	E544 F545 M778 S782 P783 S789	E544-K785 HydrophobicContact CG-CD 3.69Å; E544-K785 HydrophobicContact CG-CG 3.65Å; E544-K785 VanDerWaalsContact OE1-CE 3.27Å; E544-K785 WeakPolarHBondContact OE1-CE 3.32Å; E544-K785 IonicContact OE1-NZ 3.29Å; E544-K785 PolarHBondContact OE1-NZ 3.03Å; F545-K785 WeakPolarHBondContact O-CE 3.27Å; M778-K785 HydrophobicContact CE-CB 3.86Å; M778-K785 HydrophobicContact CE-CG 3.73Å; M778-K785 VanDerWaalsContact SD-CA 3.59Å; M778-K785 HydrophobicContact SD-CB 3.85Å; M778-K785 HydrophobicContact SD-CG 4.41Å; S782-K785 PolarHBondContact O-N 3.37Å; P783-K785 VanDerWaalsContact C-N 3.26Å; P783-K785 PolarHBondContact O-N 3.45Å; K785-S789 VanDerWaalsContact O-CB 3.29Å; K785-S789 WeakPolarHBondContact O-CB 3.45Å; K785-S789 PolarHBondContact O-N 3.23Å; K785-S789 VanDerWaalsContact O-N 3.08Å; K785-S789 PolarHBondContact O-OG 3.34Å
786	Q	90.3	Very high	91.9	Very high	107 Å²	107	41.2 Å²	41.2	50%	0.5	21%	0.212	S	C	.	.	H	α-helix	trans	-70.4	-46.7	178.2	-173.3	65.2	0.3	0	0	110.9	W784 S789 L790	W784-Q786 VanDerWaalsContact C-N 3.32Å; W784-Q786 PolarHBondContact O-N 2.86Å; Q786-S789 PolarHBondContact O-N 3.49Å; Q786-L790 HydrophobicContact CG-CD1 4.25Å; Q786-L790 WeakPolarHBondContact O-CG 3.39Å; Q786-L790 PolarHBondContact O-N 3.05Å
787	N	92.2	Very high	91.8	Very high	79 Å²	79	48.8 Å²	48.8	42%	0.422	25%	0.247	S	C	.	.	H	α-helix	trans	-65	-44.3	-180	-61.6	-4	0	0	0	111.2	M486 W784 S789 L790 A791	M486-N787 HydrophobicContact SD-CB 3.53Å; M486-N787 VanDerWaalsContact SD-CB 3.53Å; W784-N787 PolarHBondContact O-N 3.3Å; W784-N787 VanDerWaalsContact O-N 3.13Å; N787-S789 VanDerWaalsContact C-N 3.3Å; N787-S789 PolarHBondContact O-N 3.19Å; N787-L790 PolarHBondContact O-N 2.94Å; N787-A791 WeakPolarHBondContact O-CB 3.48Å; N787-A791 PolarHBondContact O-N 2.98Å
788	V	95.1	Very high	91.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-56.8	-44.3	173	172.2	0	0	0	0	110.9	M486 M528 I776 M778 W784 A791 I792	M486-V788 HydrophobicContact CE-CB 4.46Å; M486-V788 HydrophobicContact CE-CG2 3.69Å; M486-V788 HydrophobicContact SD-CG2 4.27Å; M528-V788 HydrophobicContact CE-CG2 3.88Å; I776-V788 HydrophobicContact CB-CG1 4.34Å; I776-V788 HydrophobicContact CD1-CG1 4.1Å; I776-V788 HydrophobicContact CG2-CG1 4.3Å; M778-V788 HydrophobicContact CE-CB 4.41Å; M778-V788 HydrophobicContact CE-CG1 4.19Å; M778-V788 HydrophobicContact SD-CB 4.36Å; M778-V788 HydrophobicContact SD-CG2 4.09Å; W784-V788 HydrophobicContact CB-CG2 4.23Å; W784-V788 VanDerWaalsContact O-CG2 3.3Å; W784-V788 WeakPolarHBondContact O-CG2 3.36Å; W784-V788 PolarHBondContact O-N 2.96Å; V788-A791 PolarHBondContact O-N 3.26Å; V788-I792 HydrophobicContact CG1-CD1 3.94Å; V788-I792 WeakPolarHBondContact O-CG1 3.48Å; V788-I792 PolarHBondContact O-N 3.49Å
789	S	95.7	Very high	91.7	Very high	8 Å²	8	54.1 Å²	54.1	6%	0.056	28%	0.281	C	S	.	.	H	α-helix	trans	-66.6	-40.5	-179.7	-62.6	0	0	0	0	112.7	K785 Q786 N787 L793	K785-S789 VanDerWaalsContact O-CB 3.29Å; K785-S789 WeakPolarHBondContact O-CB 3.45Å; K785-S789 PolarHBondContact O-N 3.23Å; K785-S789 VanDerWaalsContact O-N 3.08Å; K785-S789 PolarHBondContact O-OG 3.34Å; Q786-S789 PolarHBondContact O-N 3.49Å; N787-S789 VanDerWaalsContact C-N 3.3Å; N787-S789 PolarHBondContact O-N 3.19Å; S789-L793 WeakPolarHBondContact O-CG 3.39Å; S789-L793 PolarHBondContact O-N 3.07Å; S789-L793 VanDerWaalsContact O-N 3.12Å
790	L	95.8	Very high	91.9	Very high	95 Å²	95	52.9 Å²	52.9	50%	0.497	28%	0.278	S	S	.	.	H	α-helix	trans	-68.3	-40.7	175.9	-69.1	170.6	0	0	0	111.8	Q786 N787 I792 L793 S794	Q786-L790 HydrophobicContact CG-CD1 4.25Å; Q786-L790 WeakPolarHBondContact O-CG 3.39Å; Q786-L790 PolarHBondContact O-N 3.05Å; N787-L790 PolarHBondContact O-N 2.94Å; L790-I792 VanDerWaalsContact C-N 3.35Å; L790-I792 PolarHBondContact O-N 3.26Å; L790-L793 PolarHBondContact O-N 3.22Å; L790-S794 PolarHBondContact O-N 3.46Å
791	A	95.8	Very high	92.5	Very high	11 Å²	11	48.9 Å²	48.9	9%	0.091	26%	0.261	C	S	.	.	H	α-helix	trans	-65.3	-35.8	176.9	0	0	0	0	0	112.5	L482 T485 M486 N787 V788 S795	L482-A791 HydrophobicContact CD2-CB 3.53Å; T485-A791 HydrophobicContact CG2-CB 4.48Å; M486-A791 HydrophobicContact SD-CB 4.4Å; N787-A791 WeakPolarHBondContact O-CB 3.48Å; N787-A791 PolarHBondContact O-N 2.98Å; V788-A791 PolarHBondContact O-N 3.26Å; A791-S795 VanDerWaalsContact O-CB 3.3Å; A791-S795 WeakPolarHBondContact O-CB 3.43Å; A791-S795 PolarHBondContact O-N 3.41Å; A791-S795 PolarHBondContact O-OG 3.28Å
792	I	96.6	Very high	93.1	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66.2	-44.4	172	-71.4	166.9	0	0	0	111.2	S546 F549 I776 V788 L790 S795 H796	S546-I792 WeakPolarHBondContact OG-CD1 3.41Å; F549-I792 HydrophobicContact CB-CG2 4.12Å; I776-I792 HydrophobicContact CD1-CD1 4.1Å; I776-I792 HydrophobicContact CG1-CD1 4.37Å; V788-I792 HydrophobicContact CG1-CD1 3.94Å; V788-I792 WeakPolarHBondContact O-CG1 3.48Å; V788-I792 PolarHBondContact O-N 3.49Å; L790-I792 VanDerWaalsContact C-N 3.35Å; L790-I792 PolarHBondContact O-N 3.26Å; I792-S795 CarbonylContact O-C 3.54Å; I792-S795 WeakPolarHBondContact O-CB 3.36Å; I792-S795 PolarHBondContact O-N 3.04Å; I792-S795 VanDerWaalsContact O-N 3.16Å; I792-H796 PolarHBondContact O-CD2 3.33Å; I792-H796 VanDerWaalsContact O-CD2 3.3Å; I792-H796 PolarHBondContact O-N 3.31Å; I792-H796 VanDerWaalsContact O-N 3.1Å
793	L	96.2	Very high	93.5	Very high	68 Å²	68	56.8 Å²	56.8	36%	0.356	30%	0.296	S	S	.	.	H	α-helix	trans	-61.4	-48.9	177.5	-71.7	170.6	0	0	0	111.5	K547 S789 L790 S795 H796 E797	K547-L793 HydrophobicContact CB-CD2 4.45Å; K547-L793 HydrophobicContact CB-CG 4.47Å; K547-L793 HydrophobicContact CG-CD1 4.23Å; K547-L793 HydrophobicContact CG-CD2 4.36Å; K547-L793 HydrophobicContact CG-CG 4.25Å; S789-L793 WeakPolarHBondContact O-CG 3.39Å; S789-L793 PolarHBondContact O-N 3.07Å; S789-L793 VanDerWaalsContact O-N 3.12Å; L790-L793 PolarHBondContact O-N 3.22Å; L793-S795 PolarHBondContact O-N 3.35Å; L793-H796 WeakPolarHBondContact O-CB 3.48Å; L793-H796 PolarHBondContact O-N 3.27Å; L793-E797 WeakPolarHBondContact O-CG 3.49Å; L793-E797 PolarHBondContact O-N 3.17Å
794	S	96.7	Very high	93.9	Very high	55 Å²	55	54.8 Å²	54.8	39%	0.385	28%	0.283	S	S	.	.	H	α-helix	trans	-59.1	-31.9	174.6	-175.3	0	0	0	0	112.6	L790 H796 E797 N798	L790-S794 PolarHBondContact O-N 3.46Å; S794-H796 VanDerWaalsContact C-N 3.35Å; S794-E797 PolarHBondContact O-N 3.24Å; S794-N798 WeakPolarHBondContact O-CB 3.5Å; S794-N798 PolarHBondContact O-N 3.16Å; S794-N798 PolarHBondContact O-ND2 3.09Å; S794-N798 PolarHBondContact O-OD1 3.3Å
795	S	95.7	Very high	93.9	Very high	4 Å²	4	54.8 Å²	54.8	3%	0.028	29%	0.285	C	S	.	.	H	α-helix	trans	-76.5	-15	175.9	-59	0	0	0	0	114.6	A791 I792 L793 N798 F800 M801	A791-S795 VanDerWaalsContact O-CB 3.3Å; A791-S795 WeakPolarHBondContact O-CB 3.43Å; A791-S795 PolarHBondContact O-N 3.41Å; A791-S795 PolarHBondContact O-OG 3.28Å; I792-S795 CarbonylContact O-C 3.54Å; I792-S795 WeakPolarHBondContact O-CB 3.36Å; I792-S795 PolarHBondContact O-N 3.04Å; I792-S795 VanDerWaalsContact O-N 3.16Å; L793-S795 PolarHBondContact O-N 3.35Å; S795-N798 WeakPolarHBondContact CA-OD1 3.45Å; S795-N798 PolarHBondContact O-OD1 2.81Å; S795-F800 PolarHBondContact O-N 2.95Å; S795-M801 WeakPolarHBondContact O-CB 3.37Å; S795-M801 PolarHBondContact O-N 3Å
796	H	95.5	Very high	93.8	Very high	69 Å²	69	59.4 Å²	59.4	32%	0.319	31%	0.305	S	S	.	.	H	α-helix	trans	-82.8	-47.2	163.1	-75.5	-78.5	0	0	0	110.4	P548 F549 I792 L793 S794 N798 G799	P548-H796 PolarHBondContact O-NE2 2.92Å; P548-H796 VanDerWaalsContact O-NE2 3.14Å; F549-H796 PolarHBondContact O-CE1 3.13Å; F549-H796 PolarHBondContact O-NE2 3.41Å; I792-H796 PolarHBondContact O-CD2 3.33Å; I792-H796 VanDerWaalsContact O-CD2 3.3Å; I792-H796 PolarHBondContact O-N 3.31Å; I792-H796 VanDerWaalsContact O-N 3.1Å; L793-H796 WeakPolarHBondContact O-CB 3.48Å; L793-H796 PolarHBondContact O-N 3.27Å; S794-H796 VanDerWaalsContact C-N 3.35Å; H796-N798 VanDerWaalsContact C-N 3.27Å; H796-N798 PolarHBondContact O-N 3.48Å; H796-G799 PolarHBondContact O-N 2.89Å; H796-G799 VanDerWaalsContact O-N 3.13Å
797	E	95.6	Very high	93.6	Very high	159 Å²	159	56.5 Å²	56.5	74%	0.743	29%	0.294	S	S	*	.	H	α-helix	trans	-60	-32.1	-177.7	-69.4	167.1	177.2	0	0	113.7	L793 S794	L793-E797 WeakPolarHBondContact O-CG 3.49Å; L793-E797 PolarHBondContact O-N 3.17Å; S794-E797 PolarHBondContact O-N 3.24Å
798	N	95	Very high	93.4	Very high	86 Å²	86	53.9 Å²	53.9	46%	0.46	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	6.3	179	70.2	26	0	0	0	114.8	S794 S795 H796 F800	S794-N798 WeakPolarHBondContact O-CB 3.5Å; S794-N798 PolarHBondContact O-N 3.16Å; S794-N798 PolarHBondContact O-ND2 3.09Å; S794-N798 PolarHBondContact O-OD1 3.3Å; S795-N798 WeakPolarHBondContact CA-OD1 3.45Å; S795-N798 PolarHBondContact O-OD1 2.81Å; H796-N798 VanDerWaalsContact C-N 3.27Å; H796-N798 PolarHBondContact O-N 3.48Å; N798-F800 VanDerWaalsContact C-N 3.28Å; N798-F800 PolarHBondContact O-N 2.92Å; N798-F800 WeakPolarHBondContact OD1-CB 3.35Å; N798-F800 PolarHBondContact OD1-N 3.42Å
799	G	94.1	Very high	93	Very high	25 Å²	25	54 Å²	54	26%	0.258	28%	0.279	S	S	.	.	S	Bend	trans	79.2	-8.7	178.4	0	0	0	0	0	116.3	H796 M801 E802 D803	H796-G799 PolarHBondContact O-N 2.89Å; H796-G799 VanDerWaalsContact O-N 3.13Å; G799-M801 PolarHBondContact O-N 3.43Å; G799-M801 VanDerWaalsContact O-N 3.12Å; G799-E802 WeakPolarHBondContact O-CA 3.37Å; G799-E802 WeakPolarHBondContact O-CB 3.39Å; G799-E802 PolarHBondContact O-N 2.72Å; G799-D803 PolarHBondContact O-N 2.89Å; G799-D803 VanDerWaalsContact O-N 3.1Å
800	F	94.7	Very high	92.1	Very high	40 Å²	40	61.2 Å²	61.2	18%	0.175	31%	0.305	C	S	.	.	H	α-helix	trans	-56.6	-34.1	-176.8	177.3	-105.6	0	0	0	113.5	L478 K481 S795 N798 E802 D803 L804	L478-F800 HydrophobicContact CD1-CE1 4.48Å; K481-F800 HydrophobicContact CB-CE1 3.71Å; K481-F800 HydrophobicContact CB-CZ 3.77Å; K481-F800 HydrophobicContact CD-CE1 4.42Å; K481-F800 HydrophobicContact CD-CZ 4.44Å; K481-F800 HydrophobicContact CG-CD1 4.09Å; K481-F800 HydrophobicContact CG-CE1 3.61Å; K481-F800 HydrophobicContact CG-CZ 3.96Å; S795-F800 PolarHBondContact O-N 2.95Å; N798-F800 VanDerWaalsContact C-N 3.28Å; N798-F800 PolarHBondContact O-N 2.92Å; N798-F800 WeakPolarHBondContact OD1-CB 3.35Å; N798-F800 PolarHBondContact OD1-N 3.42Å; F800-E802 VanDerWaalsContact C-N 3.33Å; F800-D803 PolarHBondContact O-N 2.78Å; F800-L804 HydrophobicContact CD1-CD1 4.15Å; F800-L804 HydrophobicContact CE1-CD1 3.51Å; F800-L804 HydrophobicContact CE1-CG 4.09Å; F800-L804 HydrophobicContact CE2-CD2 4.42Å; F800-L804 HydrophobicContact CE2-CG 4.35Å; F800-L804 HydrophobicContact CZ-CD1 3.77Å; F800-L804 HydrophobicContact CZ-CD2 4.14Å; F800-L804 HydrophobicContact CZ-CG 4Å; F800-L804 WeakPolarHBondContact O-CG 3.24Å; F800-L804 PolarHBondContact O-N 3.42Å; F800-L804 VanDerWaalsContact O-N 3.11Å
801	M	94.1	Very high	90.8	Very high	10 Å²	10	62.5 Å²	62.5	5%	0.049	30%	0.304	C	S	.	.	H	α-helix	trans	-67.7	-31.4	176.1	-155.5	66.9	61.9	0	0	113	F474 L478 F549 S795 G799 D805	F474-M801 HydrophobicContact CE1-SD 3.99Å; F474-M801 HydrophobicContact CZ-CG 4.38Å; F474-M801 HydrophobicContact CZ-SD 3.63Å; L478-M801 HydrophobicContact CD1-CE 4.02Å; F549-M801 HydrophobicContact CB-CE 3.88Å; F549-M801 HydrophobicContact CB-SD 4.08Å; F549-M801 VanDerWaalsContact O-CG 3.3Å; F549-M801 WeakPolarHBondContact O-CG 3.3Å; S795-M801 WeakPolarHBondContact O-CB 3.37Å; S795-M801 PolarHBondContact O-N 3Å; G799-M801 PolarHBondContact O-N 3.43Å; G799-M801 VanDerWaalsContact O-N 3.12Å; M801-D805 WeakPolarHBondContact O-CB 3.48Å; M801-D805 PolarHBondContact O-N 3.35Å; M801-D805 VanDerWaalsContact O-N 3.11Å
802	E	91.9	Very high	89.7	Confident	147 Å²	147	66.7 Å²	66.7	69%	0.687	32%	0.322	S	S	*	.	H	α-helix	trans	-75.6	-40.3	176.2	-172.4	175.3	172.7	0	0	111.2	G799 F800 L804 D805 K806	G799-E802 WeakPolarHBondContact O-CA 3.37Å; G799-E802 WeakPolarHBondContact O-CB 3.39Å; G799-E802 PolarHBondContact O-N 2.72Å; F800-E802 VanDerWaalsContact C-N 3.33Å; E802-L804 VanDerWaalsContact C-N 3.31Å; E802-L804 PolarHBondContact O-N 3.26Å; E802-D805 PolarHBondContact O-N 3.09Å; E802-K806 WeakPolarHBondContact O-CB 3.5Å; E802-K806 PolarHBondContact O-N 3.43Å
803	D	91.1	Very high	88.6	Confident	103 Å²	103	75.4 Å²	75.4	55%	0.551	36%	0.363	S	S	*	.	H	α-helix	trans	-57.7	-42.7	172.1	-78.4	-32.7	0	0	0	111.9	G799 F800 T807	G799-D803 PolarHBondContact O-N 2.89Å; G799-D803 VanDerWaalsContact O-N 3.1Å; F800-D803 PolarHBondContact O-N 2.78Å; D803-T807 VanDerWaalsContact O-CB 3.26Å; D803-T807 WeakPolarHBondContact O-CB 3.36Å; D803-T807 PolarHBondContact O-N 3.4Å; D803-T807 PolarHBondContact O-OG1 3.06Å
804	L	91.1	Very high	87.7	Confident	10 Å²	10	74.1 Å²	74.1	5%	0.052	36%	0.359	C	S	.	.	H	α-helix	trans	-66.1	-41.5	174.7	-71.2	-176.7	0	0	0	112.3	F474 D477 L478 F800 E802 T807 W808	F474-L804 HydrophobicContact CD2-CB 3.72Å; F474-L804 HydrophobicContact CE2-CB 3.54Å; F474-L804 HydrophobicContact CG-CB 4.45Å; F474-L804 HydrophobicContact CZ-CB 4.12Å; F474-L804 HydrophobicContact CZ-CD1 4.48Å; D477-L804 HydrophobicContact CB-CD1 4.45Å; D477-L804 HydrophobicContact CB-CD2 3.65Å; L478-L804 HydrophobicContact CB-CD1 4.37Å; F800-L804 HydrophobicContact CD1-CD1 4.15Å; F800-L804 HydrophobicContact CE1-CD1 3.51Å; F800-L804 HydrophobicContact CE1-CG 4.09Å; F800-L804 HydrophobicContact CE2-CD2 4.42Å; F800-L804 HydrophobicContact CE2-CG 4.35Å; F800-L804 HydrophobicContact CZ-CD1 3.77Å; F800-L804 HydrophobicContact CZ-CD2 4.14Å; F800-L804 HydrophobicContact CZ-CG 4Å; F800-L804 WeakPolarHBondContact O-CG 3.24Å; F800-L804 PolarHBondContact O-N 3.42Å; F800-L804 VanDerWaalsContact O-N 3.11Å; E802-L804 VanDerWaalsContact C-N 3.31Å; E802-L804 PolarHBondContact O-N 3.26Å; L804-T807 PolarHBondContact O-N 2.9Å; L804-W808 WeakPolarHBondContact O-CB 3.41Å; L804-W808 PolarHBondContact O-N 2.79Å
805	D	90	Very high	86.2	Confident	22 Å²	22	76.8 Å²	76.8	12%	0.118	37%	0.369	C	S	.	.	H	α-helix	trans	-65.4	-40.6	179.7	-156.9	44.8	0	0	0	111.5	F474 K550 M801 E802 V809 R810	F474-D805 HydrophobicContact CE2-CB 4.38Å; K550-D805 IonicContact NZ-OD1 2.74Å; K550-D805 PolarHBondContact NZ-OD1 2.96Å; K550-D805 IonicContact NZ-OD2 2.71Å; K550-D805 PolarHBondContact NZ-OD2 3.17Å; M801-D805 WeakPolarHBondContact O-CB 3.48Å; M801-D805 PolarHBondContact O-N 3.35Å; M801-D805 VanDerWaalsContact O-N 3.11Å; E802-D805 PolarHBondContact O-N 3.09Å; D805-V809 WeakPolarHBondContact O-CA 3.37Å; D805-V809 WeakPolarHBondContact O-CB 3.17Å; D805-V809 PolarHBondContact O-N 3.46Å; D805-V809 WeakPolarHBondContact OD1-CB 3.36Å; D805-V809 VanDerWaalsContact OD1-CG2 3.3Å; D805-V809 WeakPolarHBondContact OD1-CG2 3.28Å; D805-R810 PolarHBondContact O-N 3.27Å
806	K	87.8	Confident	84.6	Confident	149 Å²	149	82 Å²	82	65%	0.648	41%	0.406	S	S	*	.	H	α-helix	trans	-67.1	-37.5	174	-171.8	173.9	-177.2	174.7	0	112.7	E802	E802-K806 WeakPolarHBondContact O-CB 3.5Å; E802-K806 PolarHBondContact O-N 3.43Å
807	T	86	Confident	82.8	Confident	47 Å²	47	88 Å²	88	29%	0.288	43%	0.426	S	S	.	.	H	α-helix	trans	-74.4	-40.8	-179.6	-59.6	0	0	0	0	112.6	D803 L804	D803-T807 VanDerWaalsContact O-CB 3.26Å; D803-T807 WeakPolarHBondContact O-CB 3.36Å; D803-T807 PolarHBondContact O-N 3.4Å; D803-T807 PolarHBondContact O-OG1 3.06Å; L804-T807 PolarHBondContact O-N 2.9Å
808	W	87.8	Confident	80.8	Confident	23 Å²	23	85.6 Å²	85.6	9%	0.087	43%	0.426	C	S	.	.	H	α-helix	trans	-106.6	-31	-169.6	-69.4	109.2	0	0	0	115	P425 Y428 I449 Y472 F474 D477 L804	P425-W808 WeakPolarHBondContact CB-O 3.42Å; Y428-W808 HydrophobicContact CD2-CE3 4.44Å; Y428-W808 HydrophobicContact CD2-CZ3 4.03Å; Y428-W808 AromaticContact CE2-CE3 3.8Å; Y428-W808 HydrophobicContact CE2-CE3 3.8Å; Y428-W808 AromaticContact CE2-CZ3 3.74Å; Y428-W808 HydrophobicContact CE2-CZ3 3.74Å; I449-W808 HydrophobicContact CD1-CH2 4.46Å; I449-W808 HydrophobicContact CG1-CH2 4.45Å; I449-W808 HydrophobicContact CG2-CH2 3.8Å; I449-W808 HydrophobicContact CG2-CZ2 4.25Å; Y472-W808 AromaticContact CD2-CH2 3.82Å; Y472-W808 HydrophobicContact CD2-CH2 3.82Å; Y472-W808 HydrophobicContact CD2-CZ3 4.15Å; Y472-W808 HydrophobicContact CE2-CH2 4.43Å; Y472-W808 HydrophobicContact CE2-CZ3 4.43Å; F474-W808 HydrophobicContact CB-CB 4.1Å; F474-W808 HydrophobicContact CB-CG 4.04Å; F474-W808 HydrophobicContact CD2-CB 4.26Å; D477-W808 PolarHBondContact OD2-NE1 2.89Å; L804-W808 WeakPolarHBondContact O-CB 3.41Å; L804-W808 PolarHBondContact O-N 2.79Å
809	V	85	Confident	78.9	Confident	3 Å²	3	86.3 Å²	86.3	2%	0.018	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-46.3	-171.6	-171.6	0	0	0	0	111.6	P425 F474 F754 D805 Y811	P425-V809 HydrophobicContact CG-CG2 4.03Å; F474-V809 HydrophobicContact CD2-CG2 4.42Å; F754-V809 HydrophobicContact CB-CG1 4.36Å; D805-V809 WeakPolarHBondContact O-CA 3.37Å; D805-V809 WeakPolarHBondContact O-CB 3.17Å; D805-V809 PolarHBondContact O-N 3.46Å; D805-V809 WeakPolarHBondContact OD1-CB 3.36Å; D805-V809 VanDerWaalsContact OD1-CG2 3.3Å; D805-V809 WeakPolarHBondContact OD1-CG2 3.28Å; V809-Y811 PolarHBondContact O-N 2.97Å
810	R	76.9	Confident	77	Confident	160 Å²	160	88.4 Å²	88.4	60%	0.604	44%	0.444	S	S	*	.	S	Bend	trans	-97.7	49.7	178.6	-65.7	-176.1	175.4	171.1	-0.7	112.6	D805 Q812	D805-R810 PolarHBondContact O-N 3.27Å; R810-Q812 PolarHBondContact O-N 3.07Å
811	Y	69.2	Low	75	Confident	121 Å²	121	91.8 Å²	91.8	48%	0.475	47%	0.47	S	S	.	.			trans	-68.1	-30.2	-174.2	-176.5	-96.9	0	0	0	114.1	L444 V809	L444-Y811 HydrophobicContact CD1-CE1 4.11Å; L444-Y811 HydrophobicContact CD1-CE2 4.01Å; L444-Y811 VanDerWaalsContact CD1-OH 3.32Å; L444-Y811 WeakPolarHBondContact CD1-OH 3.22Å; L444-Y811 HydrophobicContact CG-CE2 4.38Å; L444-Y811 WeakPolarHBondContact CG-OH 3.15Å; V809-Y811 PolarHBondContact O-N 2.97Å
812	Q	73.4	Confident	73.2	Confident	100 Å²	100	93.9 Å²	93.9	47%	0.467	49%	0.489	S	S	.	.			trans	-150	131.6	-173.8	-177.1	164.8	-16.9	0	0	110.9	S757 R810	S757-Q812 WeakPolarHBondContact CB-O 3.43Å; R810-Q812 PolarHBondContact O-N 3.07Å
813	E	73.4	Confident	71.5	Confident	183 Å²	183	91.9 Å²	91.9	86%	0.855	49%	0.487	S	S	*	.			trans	-94	114.6	177.4	-66.8	-176.9	159	0	0	110.2	D815	E813-D815 PolarHBondContact O-N 3.25Å
814	C	75.9	Confident	70.2	Confident	41 Å²	41	90.2 Å²	90.2	28%	0.277	48%	0.478	S	S	.	.			trans	-70.5	117.5	169.1	-67	0	0	0	0	109.3	A756 S757 C760 S816	A756-C814 PolarHBondContact O-SG 3.49Å; A756-C814 VanDerWaalsContact O-SG 3.34Å; S757-C814 PolarHBondContact O-SG 3.43Å; C760-C814 WeakPolarHBondContact CA-SG 3.24Å; C760-C814 HydrophobicContact CB-CB 3.9Å; C760-C814 WeakPolarHBondContact CB-SG 3.24Å; C760-C814 WeakPolarHBondContact SG-CB 3.31Å; C760-C814 CovalentContact SG-SG 2.04Å; C760-C814 PolarHBondContact SG-SG 3.24Å; C814-S816 PolarHBondContact O-N 3.13Å
815	D	66.4	Low	69.1	Low	110 Å²	110	92.8 Å²	92.8	59%	0.588	49%	0.494	S	S	*	.			trans	-55.1	104.7	-177.3	-169.7	1.8	0	0	0	110.9	E813 R817	E813-D815 PolarHBondContact O-N 3.25Å; D815-R817 PolarHBondContact O-N 3.48Å; D815-R817 WeakPolarHBondContact OD1-CG 3.48Å; D815-R817 IonicContact OD1-NE 3.87Å; D815-R817 IonicContact OD2-CZ 3.8Å; D815-R817 VanDerWaalsContact OD2-CZ 3.31Å; D815-R817 IonicContact OD2-NE 2.7Å; D815-R817 PolarHBondContact OD2-NE 2.64Å; D815-R817 IonicContact OD2-NH2 2.82Å; D815-R817 PolarHBondContact OD2-NH2 2.99Å
816	S	62.1	Low	68.1	Low	114 Å²	114	99.2 Å²	99.2	80%	0.797	52%	0.521	S	S	*	.			trans	-84.8	38	-166.3	58	0	0	0	0	112.5	C814 S818	C814-S816 PolarHBondContact O-N 3.13Å; S816-S818 PolarHBondContact O-N 2.91Å
817	R	56.9	Low	67.3	Low	196 Å²	196	98.4 Å²	98.4	74%	0.74	52%	0.52	S	S	*	.			trans	-52.6	105.9	171.9	-61.6	-170.4	-167.8	-144.6	-4.8	108.8	D815 N819	D815-R817 PolarHBondContact O-N 3.48Å; D815-R817 WeakPolarHBondContact OD1-CG 3.48Å; D815-R817 IonicContact OD1-NE 3.87Å; D815-R817 IonicContact OD2-CZ 3.8Å; D815-R817 VanDerWaalsContact OD2-CZ 3.31Å; D815-R817 IonicContact OD2-NE 2.7Å; D815-R817 PolarHBondContact OD2-NE 2.64Å; D815-R817 IonicContact OD2-NH2 2.82Å; D815-R817 PolarHBondContact OD2-NH2 2.99Å; R817-N819 PolarHBondContact O-N 3.45Å
818	S	53	Low	66.7	Low	108 Å²	108	97.4 Å²	97.4	76%	0.755	51%	0.513	S	S	*	.			trans	-48.9	128.4	170.2	45.6	0	0	0	0	107.9	S816 A820	S816-S818 PolarHBondContact O-N 2.91Å; S818-A820 PolarHBondContact O-N 2.88Å
819	N	55.3	Low	66.3	Low	101 Å²	101	100.6 Å²	100.6	54%	0.54	53%	0.53	S	S	.	.			trans	-49.2	106.2	-174.4	-71	4.9	0	0	0	109.3	R817	R817-N819 PolarHBondContact O-N 3.45Å
820	A	54.6	Low	66.2	Low	68 Å²	68	101.5 Å²	101.5	56%	0.562	54%	0.538	S	S	*	.			trans	-57.9	140.2	173	0	0	0	0	0	107.8	S818 A822	S818-A820 PolarHBondContact O-N 2.88Å; A820-A822 PolarHBondContact O-N 3.4Å
821	P	53.8	Low	66.5	Low	111 Å²	111	94.5 Å²	94.5	72%	0.721	52%	0.516	S	S	*	.	S	Bend	trans	-52.9	128.9	177.5	23.9	-34	0	0	0	108.3	T823	P821-T823 PolarHBondContact O-N 3.37Å
822	A	55	Low	67.4	Low	54 Å²	54	91.6 Å²	91.6	45%	0.446	51%	0.51	S	S	.	.			trans	-50.8	99.8	-155.9	0	0	0	0	0	112	A820 L824	A820-A822 PolarHBondContact O-N 3.4Å; A822-L824 PolarHBondContact O-N 2.9Å
823	T	57.1	Low	68	Low	105 Å²	105	92.2 Å²	92.2	64%	0.644	51%	0.512	S	S	*	.			trans	-66.5	121.9	-177	46.8	0	0	0	0	107.9	P821 T825	P821-T823 PolarHBondContact O-N 3.37Å; T823-T825 VanDerWaalsContact O-CG2 3.27Å; T823-T825 WeakPolarHBondContact O-CG2 3.31Å; T823-T825 PolarHBondContact O-N 2.93Å
824	L	63.4	Low	68.7	Low	69 Å²	69	90.3 Å²	90.3	36%	0.361	50%	0.504	S	S	.	.			trans	-51.9	104.7	179.7	-81.3	165.6	0	0	0	109.6	L671 A822 N828 M829	L671-L824 HydrophobicContact CD1-CD1 3.97Å; L671-L824 HydrophobicContact CD1-CG 4.37Å; L671-L824 HydrophobicContact CD2-CD2 4.22Å; L671-L824 HydrophobicContact CD2-CG 4.17Å; A822-L824 PolarHBondContact O-N 2.9Å; L824-N828 HydrophobicContact CD2-CB 3.81Å; L824-M829 HydrophobicContact CD1-CE 4.2Å
825	T	67.3	Low	69.3	Low	63 Å²	63	93.1 Å²	93.1	39%	0.387	52%	0.516	S	S	.	.			trans	-79.2	169.1	-176.3	80.8	0	0	0	0	110.1	T823 E827 N828 M829	T823-T825 VanDerWaalsContact O-CG2 3.27Å; T823-T825 WeakPolarHBondContact O-CG2 3.31Å; T823-T825 PolarHBondContact O-N 2.93Å; T825-E827 PolarHBondContact O-N 3.21Å; T825-E827 WeakPolarHBondContact OG1-CB 3.48Å; T825-E827 PolarHBondContact OG1-N 3.16Å; T825-E827 VanDerWaalsContact OG1-N 3.08Å; T825-N828 WeakPolarHBondContact CB-OD1 3.44Å; T825-N828 PolarHBondContact N-OD1 2.82Å; T825-N828 PolarHBondContact O-N 3.4Å; T825-N828 PolarHBondContact OG1-N 2.79Å; T825-N828 PolarHBondContact OG1-OD1 3.41Å; T825-M829 PolarHBondContact O-N 3.05Å
826	F	70.6	Confident	70.5	Confident	157 Å²	157	91.7 Å²	91.7	69%	0.689	51%	0.511	S	S	*	.	H	α-helix	trans	-55.9	-31.2	170.5	-176.3	-100	0	0	0	112.3	M829 A830 F833	F826-M829 PolarHBondContact O-N 3.35Å; F826-A830 PolarHBondContact O-N 3.09Å; F826-F833 HydrophobicContact CD2-CE2 4.3Å; F826-F833 HydrophobicContact CE2-CD2 4.15Å; F826-F833 AromaticContact CE2-CE2 3.95Å; F826-F833 HydrophobicContact CE2-CE2 3.95Å
827	E	70.8	Confident	71.8	Confident	133 Å²	133	88.8 Å²	88.8	62%	0.621	49%	0.494	S	S	*	.	H	α-helix	trans	-70.5	-41.5	178.4	-55.3	-170.7	160.3	0	0	111.8	T825 M829 A830	T825-E827 PolarHBondContact O-N 3.21Å; T825-E827 WeakPolarHBondContact OG1-CB 3.48Å; T825-E827 PolarHBondContact OG1-N 3.16Å; T825-E827 VanDerWaalsContact OG1-N 3.08Å; E827-M829 PolarHBondContact O-N 2.95Å; E827-A830 WeakPolarHBondContact O-CB 3.46Å; E827-A830 PolarHBondContact O-N 2.87Å
828	N	73.1	Confident	73.6	Confident	25 Å²	25	81.5 Å²	81.5	13%	0.134	48%	0.48	C	S	.	.	H	α-helix	trans	-59.1	-34	174.5	-56.8	64.6	0	0	0	112.2	S565 L824 T825	S565-N828 VanDerWaalsContact CB-CG 3.4Å; S565-N828 VanDerWaalsContact CB-ND2 3.35Å; S565-N828 WeakPolarHBondContact CB-ND2 3.47Å; S565-N828 WeakPolarHBondContact CB-OD1 3.44Å; S565-N828 PolarHBondContact OG-OD1 3.06Å; L824-N828 HydrophobicContact CD2-CB 3.81Å; T825-N828 WeakPolarHBondContact CB-OD1 3.44Å; T825-N828 PolarHBondContact N-OD1 2.82Å; T825-N828 PolarHBondContact O-N 3.4Å; T825-N828 PolarHBondContact OG1-N 2.79Å; T825-N828 PolarHBondContact OG1-OD1 3.41Å
829	M	79.5	Confident	75.5	Confident	90 Å²	90	78.5 Å²	78.5	44%	0.443	47%	0.466	S	S	.	.	H	α-helix	trans	-93.5	-6.5	-179.9	-73.3	-168.1	164.2	0	0	114.3	L824 T825 F826 E827 G831 V832 F833	L824-M829 HydrophobicContact CD1-CE 4.2Å; T825-M829 PolarHBondContact O-N 3.05Å; F826-M829 PolarHBondContact O-N 3.35Å; E827-M829 PolarHBondContact O-N 2.95Å; M829-G831 PolarHBondContact O-N 3.44Å; M829-G831 VanDerWaalsContact O-N 3.15Å; M829-V832 WeakPolarHBondContact O-CB 3.34Å; M829-V832 PolarHBondContact O-N 3.31Å; M829-F833 HydrophobicContact CB-CE2 4.15Å; M829-F833 WeakPolarHBondContact O-CD2 3.27Å
830	A	81.9	Confident	77.3	Confident	23 Å²	23	78.6 Å²	78.6	19%	0.19	47%	0.465	C	S	.	.	H	α-helix	trans	-57.7	-33.9	-175.2	0	0	0	0	0	113.2	L567 F826 E827 V832 F833 M834	L567-A830 HydrophobicContact CD2-CB 3.91Å; F826-A830 PolarHBondContact O-N 3.09Å; E827-A830 WeakPolarHBondContact O-CB 3.46Å; E827-A830 PolarHBondContact O-N 2.87Å; A830-V832 VanDerWaalsContact C-N 3.28Å; A830-V832 PolarHBondContact O-N 2.87Å; A830-F833 PolarHBondContact O-N 2.96Å; A830-M834 WeakPolarHBondContact O-CG 3.44Å; A830-M834 PolarHBondContact O-N 3.22Å
831	G	84	Confident	79.2	Confident	13 Å²	13	78.2 Å²	78.2	13%	0.134	46%	0.462	C	S	.	.	H	α-helix	trans	-58.9	-34.2	175.2	0	0	0	0	0	114	M829 L835	M829-G831 PolarHBondContact O-N 3.44Å; M829-G831 VanDerWaalsContact O-N 3.15Å; G831-L835 PolarHBondContact O-N 2.98Å; G831-L835 VanDerWaalsContact O-N 3.07Å
832	V	86.9	Confident	81	Confident	59 Å²	59	75.1 Å²	75.1	36%	0.358	45%	0.446	S	S	.	.	H	α-helix	trans	-70.3	-44.9	177.6	-175.4	0	0	0	0	110.5	F570 M829 A830 M834 L835 V836	F570-V832 HydrophobicContact CB-CG2 3.82Å; F570-V832 HydrophobicContact CD1-CG2 3.81Å; F570-V832 HydrophobicContact CD2-CG2 3.83Å; F570-V832 HydrophobicContact CE1-CG2 4.3Å; F570-V832 HydrophobicContact CE2-CG2 4.31Å; F570-V832 HydrophobicContact CG-CG2 3.53Å; M829-V832 WeakPolarHBondContact O-CB 3.34Å; M829-V832 PolarHBondContact O-N 3.31Å; A830-V832 VanDerWaalsContact C-N 3.28Å; A830-V832 PolarHBondContact O-N 2.87Å; V832-M834 VanDerWaalsContact C-N 3.34Å; V832-M834 PolarHBondContact O-N 2.84Å; V832-L835 WeakPolarHBondContact O-CB 3.38Å; V832-L835 PolarHBondContact O-N 3.03Å; V832-V836 WeakPolarHBondContact O-CG2 3.41Å; V832-V836 PolarHBondContact O-N 3.38Å
833	F	87.1	Confident	82.8	Confident	114 Å²	114	74.2 Å²	74.2	50%	0.5	44%	0.442	S	S	.	.	H	α-helix	trans	-64.5	-37.9	177	-65.3	-67.5	0	0	0	112.3	F826 M829 A830 V836 A837	F826-F833 HydrophobicContact CD2-CE2 4.3Å; F826-F833 HydrophobicContact CE2-CD2 4.15Å; F826-F833 AromaticContact CE2-CE2 3.95Å; F826-F833 HydrophobicContact CE2-CE2 3.95Å; M829-F833 HydrophobicContact CB-CE2 4.15Å; M829-F833 WeakPolarHBondContact O-CD2 3.27Å; A830-F833 PolarHBondContact O-N 2.96Å; F833-V836 PolarHBondContact O-N 2.89Å; F833-A837 WeakPolarHBondContact O-CB 3.35Å; F833-A837 PolarHBondContact O-N 2.88Å
834	M	87.2	Confident	84.5	Confident	142 Å²	142	73.9 Å²	73.9	70%	0.7	44%	0.435	S	S	*	.	H	α-helix	trans	-63.5	-38.7	173.7	-72.5	-65.1	-70.6	0	0	112.4	A830 V832 A837 G838	A830-M834 WeakPolarHBondContact O-CG 3.44Å; A830-M834 PolarHBondContact O-N 3.22Å; V832-M834 VanDerWaalsContact C-N 3.34Å; V832-M834 PolarHBondContact O-N 2.84Å; M834-A837 PolarHBondContact O-N 3.48Å; M834-G838 PolarHBondContact O-N 2.96Å
835	L	88.7	Confident	85.9	Confident	101 Å²	101	77.2 Å²	77.2	53%	0.529	45%	0.447	S	S	.	.	H	α-helix	trans	-63.6	-45.1	174.5	-168.6	159.9	0	0	0	111.1	F570 G831 V832 A837 G838 G839	F570-L835 HydrophobicContact CE2-CD1 4.31Å; F570-L835 HydrophobicContact CZ-CD1 4.15Å; G831-L835 PolarHBondContact O-N 2.98Å; G831-L835 VanDerWaalsContact O-N 3.07Å; V832-L835 WeakPolarHBondContact O-CB 3.38Å; V832-L835 PolarHBondContact O-N 3.03Å; L835-A837 PolarHBondContact O-N 3.32Å; L835-G838 PolarHBondContact O-N 3.35Å; L835-G839 PolarHBondContact O-N 3.07Å
836	V	91.2	Very high	87.1	Confident	79 Å²	79	78.8 Å²	78.8	48%	0.479	45%	0.453	S	S	.	.	H	α-helix	trans	-61.4	-43.8	175.8	173.9	0	0	0	0	111.6	V832 F833 G838 G839 I840	V832-V836 WeakPolarHBondContact O-CG2 3.41Å; V832-V836 PolarHBondContact O-N 3.38Å; F833-V836 PolarHBondContact O-N 2.89Å; V836-G838 VanDerWaalsContact C-N 3.35Å; V836-G838 PolarHBondContact O-N 3.49Å; V836-G839 PolarHBondContact O-N 3.01Å; V836-G839 VanDerWaalsContact O-N 3.17Å; V836-I840 HydrophobicContact CG1-CD1 4.14Å; V836-I840 WeakPolarHBondContact O-CG1 3.24Å; V836-I840 PolarHBondContact O-N 3.04Å
837	A	91.1	Very high	88.1	Confident	54 Å²	54	75 Å²	75	45%	0.446	44%	0.439	S	S	.	.	H	α-helix	trans	-61.5	-41.6	176	0	0	0	0	0	112.3	F833 M834 L835 I840 A841	F833-A837 WeakPolarHBondContact O-CB 3.35Å; F833-A837 PolarHBondContact O-N 2.88Å; M834-A837 PolarHBondContact O-N 3.48Å; L835-A837 PolarHBondContact O-N 3.32Å; A837-I840 PolarHBondContact O-N 3.23Å; A837-A841 PolarHBondContact O-N 3.46Å
838	G	93.5	Very high	89.1	Confident	42 Å²	42	75.5 Å²	75.5	43%	0.433	44%	0.439	S	S	.	.	H	α-helix	trans	-61.8	-40.4	172.2	0	0	0	0	0	112.9	M834 L835 V836 A841 A842	M834-G838 PolarHBondContact O-N 2.96Å; L835-G838 PolarHBondContact O-N 3.35Å; V836-G838 VanDerWaalsContact C-N 3.35Å; V836-G838 PolarHBondContact O-N 3.49Å; G838-A841 PolarHBondContact O-N 3.13Å; G838-A842 WeakPolarHBondContact O-CB 3.1Å; G838-A842 PolarHBondContact O-N 3.23Å
839	G	93.2	Very high	89.8	Confident	45 Å²	45	78.3 Å²	78.3	46%	0.464	45%	0.453	S	S	.	.	H	α-helix	trans	-61.8	-41.4	174.5	0	0	0	0	0	113.2	L835 V836 A842 G843	L835-G839 PolarHBondContact O-N 3.07Å; V836-G839 PolarHBondContact O-N 3.01Å; V836-G839 VanDerWaalsContact O-N 3.17Å; G839-A842 PolarHBondContact O-N 2.95Å; G839-G843 PolarHBondContact O-N 2.93Å
840	I	94.1	Very high	90.3	Very high	104 Å²	104	80 Å²	80	53%	0.533	46%	0.46	S	S	.	.	H	α-helix	trans	-64	-44.7	174.8	-66.4	164.8	0	0	0	110.7	V836 A837 A842 G843 I844	V836-I840 HydrophobicContact CG1-CD1 4.14Å; V836-I840 WeakPolarHBondContact O-CG1 3.24Å; V836-I840 PolarHBondContact O-N 3.04Å; A837-I840 PolarHBondContact O-N 3.23Å; I840-A842 PolarHBondContact O-N 3.18Å; I840-G843 PolarHBondContact O-N 2.81Å; I840-I844 HydrophobicContact CG2-CD1 4.11Å; I840-I844 WeakPolarHBondContact O-CG1 3.45Å; I840-I844 PolarHBondContact O-N 3.01Å
841	A	92.8	Very high	90.7	Very high	59 Å²	59	83.4 Å²	83.4	49%	0.488	47%	0.474	S	S	.	.	H	α-helix	trans	-62.4	-40.9	176.4	0	0	0	0	0	112.3	A837 G838 I844 F845	A837-A841 PolarHBondContact O-N 3.46Å; G838-A841 PolarHBondContact O-N 3.13Å; A841-I844 PolarHBondContact O-N 3.27Å; A841-F845 PolarHBondContact O-N 2.85Å
842	A	92.8	Very high	90.8	Very high	47 Å²	47	85.6 Å²	85.6	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-64.4	-39.4	173.7	0	0	0	0	0	112.1	G838 G839 I840 F845 L846	G838-A842 WeakPolarHBondContact O-CB 3.1Å; G838-A842 PolarHBondContact O-N 3.23Å; G839-A842 PolarHBondContact O-N 2.95Å; I840-A842 PolarHBondContact O-N 3.18Å; A842-F845 WeakPolarHBondContact O-CB 3.4Å; A842-F845 PolarHBondContact O-N 3.43Å; A842-L846 WeakPolarHBondContact O-CB 3.5Å; A842-L846 WeakPolarHBondContact O-CG 3.23Å; A842-L846 PolarHBondContact O-N 2.97Å
843	G	93.3	Very high	90.9	Very high	35 Å²	35	89.7 Å²	89.7	36%	0.361	50%	0.501	S	S	.	.	H	α-helix	trans	-61.1	-42.8	173.5	0	0	0	0	0	113	G839 I840 F845 L846 I847	G839-G843 PolarHBondContact O-N 2.93Å; I840-G843 PolarHBondContact O-N 2.81Å; G843-F845 VanDerWaalsContact C-N 3.3Å; G843-F845 PolarHBondContact O-N 3.21Å; G843-L846 PolarHBondContact O-N 3.37Å; G843-I847 PolarHBondContact O-N 3.47Å
844	I	92.8	Very high	90.9	Very high	97 Å²	97	91 Å²	91	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-61.7	-38.4	174	-67.6	165	0	0	0	111	I840 A841 I847 F848	I840-I844 HydrophobicContact CG2-CD1 4.11Å; I840-I844 WeakPolarHBondContact O-CG1 3.45Å; I840-I844 PolarHBondContact O-N 3.01Å; A841-I844 PolarHBondContact O-N 3.27Å; I844-I847 VanDerWaalsContact O-CG2 3.23Å; I844-I847 WeakPolarHBondContact O-CG2 3.21Å; I844-F848 HydrophobicContact CG2-CE2 4.16Å; I844-F848 WeakPolarHBondContact O-CD2 3.33Å
845	F	92.2	Very high	90.7	Very high	139 Å²	139	93.8 Å²	93.8	61%	0.61	51%	0.509	S	S	*	.	H	α-helix	trans	-69.5	-41.6	175	-175.6	-114	0	0	0	112.5	A841 A842 G843 F848 I849	A841-F845 PolarHBondContact O-N 2.85Å; A842-F845 WeakPolarHBondContact O-CB 3.4Å; A842-F845 PolarHBondContact O-N 3.43Å; G843-F845 VanDerWaalsContact C-N 3.3Å; G843-F845 PolarHBondContact O-N 3.21Å; F845-F848 PolarHBondContact O-N 3.07Å; F845-I849 HydrophobicContact CD1-CD1 3.84Å; F845-I849 HydrophobicContact CE1-CD1 3.5Å; F845-I849 HydrophobicContact CZ-CD1 3.98Å; F845-I849 PolarHBondContact O-N 2.83Å
846	L	92.4	Very high	90.3	Very high	97 Å²	97	95.2 Å²	95.2	51%	0.508	51%	0.513	S	S	.	.	H	α-helix	trans	-64.3	-41.1	179.1	-76.3	169	0	0	0	112.7	A842 G843 F848 I849 E850	A842-L846 WeakPolarHBondContact O-CB 3.5Å; A842-L846 WeakPolarHBondContact O-CG 3.23Å; A842-L846 PolarHBondContact O-N 2.97Å; G843-L846 PolarHBondContact O-N 3.37Å; L846-F848 VanDerWaalsContact C-N 3.28Å; L846-F848 PolarHBondContact O-N 2.96Å; L846-I849 CarbonylContact O-C 3.56Å; L846-I849 WeakPolarHBondContact O-CA 3.4Å; L846-I849 WeakPolarHBondContact O-CB 3.44Å; L846-I849 PolarHBondContact O-N 3.01Å; L846-E850 PolarHBondContact O-N 3.24Å
847	I	92.3	Very high	89.8	Confident	78 Å²	78	96.1 Å²	96.1	40%	0.4	51%	0.51	S	S	.	.	H	α-helix	trans	-64.4	-31.5	177.6	-173	59.2	0	0	0	112.4	G843 I844 E850 I851	G843-I847 PolarHBondContact O-N 3.47Å; I844-I847 VanDerWaalsContact O-CG2 3.23Å; I844-I847 WeakPolarHBondContact O-CG2 3.21Å; I847-E850 HydrophobicContact CD1-CB 4.43Å; I847-E850 PolarHBondContact O-N 3.32Å; I847-I851 HydrophobicContact CD1-CD1 4.32Å; I847-I851 HydrophobicContact CD1-CG1 4.3Å; I847-I851 HydrophobicContact CG1-CD1 3.99Å; I847-I851 HydrophobicContact CG1-CG1 4.45Å; I847-I851 WeakPolarHBondContact O-CB 3.14Å; I847-I851 WeakPolarHBondContact O-CD1 3.45Å; I847-I851 WeakPolarHBondContact O-CG1 3.4Å; I847-I851 PolarHBondContact O-N 3.31Å
848	F	90.4	Very high	89	Confident	142 Å²	142	96 Å²	96	62%	0.623	50%	0.502	S	S	*	.	H	α-helix	trans	-64.9	-40.7	169.7	-77.3	-65	0	0	0	112.2	I844 F845 L846 A852	I844-F848 HydrophobicContact CG2-CE2 4.16Å; I844-F848 WeakPolarHBondContact O-CD2 3.33Å; F845-F848 PolarHBondContact O-N 3.07Å; L846-F848 VanDerWaalsContact C-N 3.28Å; L846-F848 PolarHBondContact O-N 2.96Å; F848-A852 WeakPolarHBondContact O-CB 3.16Å; F848-A852 PolarHBondContact O-N 2.77Å
849	I	89.3	Confident	88.1	Confident	85 Å²	85	96.2 Å²	96.2	44%	0.436	50%	0.5	S	S	.	.	H	α-helix	trans	-64.3	-44.1	175.1	-68.1	170.2	0	0	0	110.9	F845 L846 A852 Y853	F845-I849 HydrophobicContact CD1-CD1 3.84Å; F845-I849 HydrophobicContact CE1-CD1 3.5Å; F845-I849 HydrophobicContact CZ-CD1 3.98Å; F845-I849 PolarHBondContact O-N 2.83Å; L846-I849 CarbonylContact O-C 3.56Å; L846-I849 WeakPolarHBondContact O-CA 3.4Å; L846-I849 WeakPolarHBondContact O-CB 3.44Å; L846-I849 PolarHBondContact O-N 3.01Å; I849-A852 PolarHBondContact O-N 2.98Å; I849-Y853 VanDerWaalsContact O-CB 3.28Å; I849-Y853 WeakPolarHBondContact O-CB 3.1Å; I849-Y853 PolarHBondContact O-N 2.8Å
850	E	90	Very high	87.1	Confident	125 Å²	125	102.4 Å²	102.4	58%	0.584	51%	0.509	S	S	*	.	H	α-helix	trans	-63.1	-44.4	177.4	-72.1	-170	165.4	0	0	112.3	L846 I847 A852 Y853 K854	L846-E850 PolarHBondContact O-N 3.24Å; I847-E850 HydrophobicContact CD1-CB 4.43Å; I847-E850 PolarHBondContact O-N 3.32Å; E850-A852 VanDerWaalsContact C-N 3.32Å; E850-A852 PolarHBondContact O-N 3.42Å; E850-Y853 PolarHBondContact O-N 3.29Å; E850-K854 WeakPolarHBondContact O-CB 3.37Å; E850-K854 PolarHBondContact O-N 2.79Å
851	I	89.4	Confident	86.1	Confident	94 Å²	94	104.1 Å²	104.1	48%	0.482	51%	0.509	S	S	.	.	H	α-helix	trans	-60.6	-43.8	175.5	-71.3	166.6	0	0	0	110.2	I847 R855	I847-I851 HydrophobicContact CD1-CD1 4.32Å; I847-I851 HydrophobicContact CD1-CG1 4.3Å; I847-I851 HydrophobicContact CG1-CD1 3.99Å; I847-I851 HydrophobicContact CG1-CG1 4.45Å; I847-I851 WeakPolarHBondContact O-CB 3.14Å; I847-I851 WeakPolarHBondContact O-CD1 3.45Å; I847-I851 WeakPolarHBondContact O-CG1 3.4Å; I847-I851 PolarHBondContact O-N 3.31Å; I851-R855 WeakPolarHBondContact O-CB 3.28Å; I851-R855 PolarHBondContact O-N 3.29Å
852	A	86.6	Confident	85	Confident	59 Å²	59	107.8 Å²	107.8	49%	0.488	51%	0.514	S	S	.	.	H	α-helix	trans	-64.6	-47.6	176.5	0	0	0	0	0	112.2	F848 I849 E850 R855 H856	F848-A852 WeakPolarHBondContact O-CB 3.16Å; F848-A852 PolarHBondContact O-N 2.77Å; I849-A852 PolarHBondContact O-N 2.98Å; E850-A852 VanDerWaalsContact C-N 3.32Å; E850-A852 PolarHBondContact O-N 3.42Å; A852-R855 PolarHBondContact O-N 2.99Å; A852-H856 WeakPolarHBondContact O-CB 3.27Å; A852-H856 PolarHBondContact O-N 2.87Å
853	Y	88.3	Confident	83.9	Confident	145 Å²	145	111.9 Å²	111.9	57%	0.569	53%	0.525	S	S	*	.	H	α-helix	trans	-63.2	-46.6	179.5	176.7	-94.3	0	0	0	111.9	I849 E850 H856 K857	I849-Y853 VanDerWaalsContact O-CB 3.28Å; I849-Y853 WeakPolarHBondContact O-CB 3.1Å; I849-Y853 PolarHBondContact O-N 2.8Å; E850-Y853 PolarHBondContact O-N 3.29Å; Y853-H856 PolarHBondContact O-N 2.81Å; Y853-K857 HydrophobicContact CE1-CD 3.82Å; Y853-K857 VanDerWaalsContact O-CB 3.27Å; Y853-K857 WeakPolarHBondContact O-CB 3.4Å; Y853-K857 PolarHBondContact O-N 3.37Å
854	K	86.8	Confident	82.6	Confident	142 Å²	142	116.4 Å²	116.4	62%	0.617	54%	0.538	S	S	*	.	H	α-helix	trans	-62.5	-46.2	176.7	-171.7	170.9	-176.4	171.8	0	110.9	E850 H856 K857 D858	E850-K854 WeakPolarHBondContact O-CB 3.37Å; E850-K854 PolarHBondContact O-N 2.79Å; K854-H856 VanDerWaalsContact C-N 3.32Å; K854-H856 PolarHBondContact O-N 3.46Å; K854-K857 PolarHBondContact O-N 2.87Å; K854-D858 WeakPolarHBondContact O-CB 3.31Å; K854-D858 PolarHBondContact O-N 3.33Å
855	R	83.6	Confident	81.4	Confident	200 Å²	200	118 Å²	118	76%	0.755	54%	0.544	S	S	*	.	H	α-helix	trans	-59.8	-40.1	175.3	-175.2	175.4	180	177.3	-1.3	112.2	I851 A852 A859	I851-R855 WeakPolarHBondContact O-CB 3.28Å; I851-R855 PolarHBondContact O-N 3.29Å; A852-R855 PolarHBondContact O-N 2.99Å; R855-A859 VanDerWaalsContact O-CB 3.31Å; R855-A859 WeakPolarHBondContact O-CB 3.46Å; R855-A859 PolarHBondContact O-N 3.02Å
856	H	80.8	Confident	80.2	Confident	131 Å²	131	117.3 Å²	117.3	61%	0.606	55%	0.546	S	S	*	.	H	α-helix	trans	-71.5	-43.2	176.7	-169.5	-115.4	0	0	0	112.3	A852 Y853 K854 D858 A859 R860	A852-H856 WeakPolarHBondContact O-CB 3.27Å; A852-H856 PolarHBondContact O-N 2.87Å; Y853-H856 PolarHBondContact O-N 2.81Å; K854-H856 VanDerWaalsContact C-N 3.32Å; K854-H856 PolarHBondContact O-N 3.46Å; H856-D858 VanDerWaalsContact C-N 3.35Å; H856-D858 PolarHBondContact O-N 3Å; H856-A859 PolarHBondContact O-N 3.38Å; H856-R860 WeakPolarHBondContact O-CB 3.35Å; H856-R860 PolarHBondContact O-N 3.45Å
857	K	79.6	Confident	78.9	Confident	99 Å²	99	115.3 Å²	115.3	43%	0.43	54%	0.543	S	S	.	.	H	α-helix	trans	-60.8	-42.1	175.9	-172	170.5	-175.2	170.8	0	111.6	Y853 K854 R860 R861	Y853-K857 HydrophobicContact CE1-CD 3.82Å; Y853-K857 VanDerWaalsContact O-CB 3.27Å; Y853-K857 WeakPolarHBondContact O-CB 3.4Å; Y853-K857 PolarHBondContact O-N 3.37Å; K854-K857 PolarHBondContact O-N 2.87Å; K857-R860 PolarHBondContact O-N 3.31Å; K857-R861 WeakPolarHBondContact O-CG 3.28Å; K857-R861 PolarHBondContact O-N 2.9Å
858	D	75.3	Confident	77.7	Confident	51 Å²	51	117.6 Å²	117.6	27%	0.273	55%	0.551	S	S	.	*	H	α-helix	trans	-78.6	-27.1	179.3	-67.2	-21.3	0	0	0	112.9	K854 H856 R861 K862	K854-D858 WeakPolarHBondContact O-CB 3.31Å; K854-D858 PolarHBondContact O-N 3.33Å; H856-D858 VanDerWaalsContact C-N 3.35Å; H856-D858 PolarHBondContact O-N 3Å; D858-R861 IonicContact OD1-CZ 2.68Å; D858-R861 VanDerWaalsContact OD1-CZ 3.32Å; D858-R861 IonicContact OD1-NE 2.73Å; D858-R861 PolarHBondContact OD1-NE 3.5Å; D858-R861 IonicContact OD1-NH2 2.74Å; D858-R861 PolarHBondContact OD1-NH2 3.42Å; D858-K862 VanDerWaalsContact O-CG 3.29Å; D858-K862 WeakPolarHBondContact O-CG 3.42Å; D858-K862 PolarHBondContact O-N 2.97Å
859	A	73.8	Confident	76.4	Confident	47 Å²	47	113.4 Å²	113.4	39%	0.388	54%	0.542	S	S	.	.	H	α-helix	trans	-64	-45.4	165.3	0	0	0	0	0	111.3	R855 H856 R861 K862 Q863	R855-A859 VanDerWaalsContact O-CB 3.31Å; R855-A859 WeakPolarHBondContact O-CB 3.46Å; R855-A859 PolarHBondContact O-N 3.02Å; H856-A859 PolarHBondContact O-N 3.38Å; A859-R861 PolarHBondContact O-N 2.82Å; A859-K862 PolarHBondContact O-N 3.2Å; A859-Q863 PolarHBondContact O-N 3.39Å
860	R	73.5	Confident	75.2	Confident	175 Å²	175	112.3 Å²	112.3	66%	0.66	55%	0.546	S	S	*	.	H	α-helix	trans	-65	-38.3	177.3	-153.1	176.7	-167.2	-173.8	4.9	112	H856 K857 Q863 M864	H856-R860 WeakPolarHBondContact O-CB 3.35Å; H856-R860 PolarHBondContact O-N 3.45Å; K857-R860 PolarHBondContact O-N 3.31Å; R860-Q863 PolarHBondContact O-N 2.88Å; R860-M864 WeakPolarHBondContact O-CB 3.44Å; R860-M864 PolarHBondContact O-N 2.66Å
861	R	72.1	Confident	74.2	Confident	139 Å²	139	109.9 Å²	109.9	53%	0.525	54%	0.539	S	S	.	.	H	α-helix	trans	-61.3	-43.3	170.8	-77.5	-162.2	-91	-152.2	1.8	112.2	K857 D858 A859 M864 Q865	K857-R861 WeakPolarHBondContact O-CG 3.28Å; K857-R861 PolarHBondContact O-N 2.9Å; D858-R861 IonicContact OD1-CZ 2.68Å; D858-R861 VanDerWaalsContact OD1-CZ 3.32Å; D858-R861 IonicContact OD1-NE 2.73Å; D858-R861 PolarHBondContact OD1-NE 3.5Å; D858-R861 IonicContact OD1-NH2 2.74Å; D858-R861 PolarHBondContact OD1-NH2 3.42Å; A859-R861 PolarHBondContact O-N 2.82Å; R861-M864 PolarHBondContact O-N 3.35Å; R861-Q865 WeakPolarHBondContact O-CB 2.99Å; R861-Q865 WeakPolarHBondContact O-CG 3.29Å; R861-Q865 PolarHBondContact O-N 3.49Å
862	K	70.6	Confident	72.9	Confident	136 Å²	136	109 Å²	109	59%	0.591	54%	0.536	S	S	*	.	H	α-helix	trans	-64.1	-41.3	176.6	-74.1	168.9	-177.4	177.5	0	112.5	D858 A859 Q865 L866	D858-K862 VanDerWaalsContact O-CG 3.29Å; D858-K862 WeakPolarHBondContact O-CG 3.42Å; D858-K862 PolarHBondContact O-N 2.97Å; A859-K862 PolarHBondContact O-N 3.2Å; K862-Q865 PolarHBondContact O-N 3.42Å; K862-L866 WeakPolarHBondContact O-CG 3.49Å; K862-L866 PolarHBondContact O-N 3.49Å
863	Q	69.7	Low	71.9	Confident	134 Å²	134	110.7 Å²	110.7	63%	0.626	54%	0.54	S	S	*	.	H	α-helix	trans	-59.7	-45.1	171.6	-72.8	175.3	-31.9	0	0	111.8	A859 R860 Q865 L866 A867	A859-Q863 PolarHBondContact O-N 3.39Å; R860-Q863 PolarHBondContact O-N 2.88Å; Q863-Q865 PolarHBondContact O-N 2.88Å; Q863-L866 PolarHBondContact O-N 3.05Å; Q863-A867 PolarHBondContact O-N 2.97Å
864	M	65.1	Low	70.4	Confident	129 Å²	129	113 Å²	113	64%	0.635	55%	0.547	S	S	*	.	H	α-helix	trans	-68.2	-33.9	-179.6	-162	168.7	-174.9	0	0	112.8	R860 R861 A867 F868	R860-M864 WeakPolarHBondContact O-CB 3.44Å; R860-M864 PolarHBondContact O-N 2.66Å; R861-M864 PolarHBondContact O-N 3.35Å; M864-A867 PolarHBondContact O-N 3.01Å; M864-F868 PolarHBondContact O-N 3.24Å
865	Q	68.1	Low	68.9	Low	130 Å²	130	114 Å²	114	61%	0.607	55%	0.547	S	S	*	.	H	α-helix	trans	-67.2	-40.9	171.6	-75.8	174	-29.9	0	0	112.3	R861 K862 Q863 F868 A869	R861-Q865 WeakPolarHBondContact O-CB 2.99Å; R861-Q865 WeakPolarHBondContact O-CG 3.29Å; R861-Q865 PolarHBondContact O-N 3.49Å; K862-Q865 PolarHBondContact O-N 3.42Å; Q863-Q865 PolarHBondContact O-N 2.88Å; Q865-F868 PolarHBondContact O-N 2.97Å; Q865-A869 WeakPolarHBondContact O-CB 3.36Å; Q865-A869 PolarHBondContact O-N 3.28Å
866	L	67.6	Low	67.5	Low	126 Å²	126	113.1 Å²	113.1	66%	0.66	55%	0.549	S	S	*	.	H	α-helix	trans	-64.2	-39.8	174.3	-72.2	166.5	0	0	0	111.8	K862 Q863 A869 A870	K862-L866 WeakPolarHBondContact O-CG 3.49Å; K862-L866 PolarHBondContact O-N 3.49Å; Q863-L866 PolarHBondContact O-N 3.05Å; L866-A869 PolarHBondContact O-N 3.01Å; L866-A870 PolarHBondContact O-N 3.44Å
867	A	64.4	Low	66.4	Low	55 Å²	55	113.5 Å²	113.5	46%	0.455	56%	0.555	S	S	.	*	H	α-helix	trans	-62.8	-44.7	173.4	0	0	0	0	0	112.2	Q863 M864 A869 A870 V871	Q863-A867 PolarHBondContact O-N 2.97Å; M864-A867 PolarHBondContact O-N 3.01Å; A867-A869 VanDerWaalsContact C-N 3.33Å; A867-A869 PolarHBondContact O-N 2.86Å; A867-A870 PolarHBondContact O-N 3.24Å; A867-V871 WeakPolarHBondContact O-CG2 3.34Å; A867-V871 PolarHBondContact O-N 3.01Å
868	F	66.1	Low	65.1	Low	126 Å²	126	114.2 Å²	114.2	55%	0.553	56%	0.564	S	S	*	*	H	α-helix	trans	-63.3	-36.5	175.1	-111.3	-82.8	0	0	0	112.9	M864 Q865 V871 N872	M864-F868 PolarHBondContact O-N 3.24Å; Q865-F868 PolarHBondContact O-N 2.97Å; F868-V871 PolarHBondContact O-N 3.49Å; F868-N872 WeakPolarHBondContact O-CB 3.41Å; F868-N872 PolarHBondContact O-N 3.48Å
869	A	64.4	Low	63.5	Low	53 Å²	53	120.6 Å²	120.6	44%	0.438	59%	0.592	S	S	.	*	H	α-helix	trans	-63.6	-45.5	174.3	0	0	0	0	0	111.5	Q865 L866 A867 V871 N872 V873	Q865-A869 WeakPolarHBondContact O-CB 3.36Å; Q865-A869 PolarHBondContact O-N 3.28Å; L866-A869 PolarHBondContact O-N 3.01Å; A867-A869 VanDerWaalsContact C-N 3.33Å; A867-A869 PolarHBondContact O-N 2.86Å; A869-V871 PolarHBondContact O-N 3.01Å; A869-N872 PolarHBondContact O-N 3.29Å; A869-V873 WeakPolarHBondContact O-CG2 3.47Å; A869-V873 PolarHBondContact O-N 3.44Å
870	A	64.7	Low	61.8	Low	63 Å²	63	124.6 Å²	124.6	52%	0.521	61%	0.614	S	S	.	*	H	α-helix	trans	-60.9	-43.6	176.1	0	0	0	0	0	112.4	L866 A867 N872 V873 W874	L866-A870 PolarHBondContact O-N 3.44Å; A867-A870 PolarHBondContact O-N 3.24Å; A870-N872 VanDerWaalsContact C-N 3.34Å; A870-N872 PolarHBondContact O-N 3.02Å; A870-V873 PolarHBondContact O-N 2.92Å; A870-W874 PolarHBondContact O-N 3.34Å
871	V	69.1	Low	59.9	Low	73 Å²	73	121.8 Å²	121.8	44%	0.442	62%	0.621	S	S	.	*	H	α-helix	trans	-61.7	-39.7	175.5	170.1	0	0	0	0	111.9	A867 F868 A869 W874 R875	A867-V871 WeakPolarHBondContact O-CG2 3.34Å; A867-V871 PolarHBondContact O-N 3.01Å; F868-V871 PolarHBondContact O-N 3.49Å; A869-V871 PolarHBondContact O-N 3.01Å; V871-W874 PolarHBondContact O-N 3.05Å; V871-R875 WeakPolarHBondContact O-CB 3.47Å; V871-R875 PolarHBondContact O-N 3.38Å
872	N	62.1	Low	58.1	Low	77 Å²	77	121.2 Å²	121.2	41%	0.412	64%	0.638	S	S	.	*	H	α-helix	trans	-72.5	-27.4	177.6	-78.7	-23.7	0	0	0	113.6	F868 A869 A870 R875 K876	F868-N872 WeakPolarHBondContact O-CB 3.41Å; F868-N872 PolarHBondContact O-N 3.48Å; A869-N872 PolarHBondContact O-N 3.29Å; A870-N872 VanDerWaalsContact C-N 3.34Å; A870-N872 PolarHBondContact O-N 3.02Å; N872-R875 PolarHBondContact OD1-NH1 3.37Å; N872-K876 PolarHBondContact O-N 2.95Å
873	V	63.6	Low	56.3	Low	94 Å²	94	119.5 Å²	119.5	57%	0.57	64%	0.644	S	S	*	*	H	α-helix	trans	-70.4	-45.6	169.1	171.7	0	0	0	0	110.4	A869 A870 R875 K876	A869-V873 WeakPolarHBondContact O-CG2 3.47Å; A869-V873 PolarHBondContact O-N 3.44Å; A870-V873 PolarHBondContact O-N 2.92Å; V873-R875 VanDerWaalsContact C-N 3.31Å; V873-R875 PolarHBondContact O-N 3.29Å; V873-K876 PolarHBondContact O-N 3.4Å
874	W	58	Low	54.7	Low	193 Å²	193	119.6 Å²	119.6	73%	0.731	65%	0.653	S	S	*	*	H	α-helix	trans	-59.3	-42.1	177.2	-162.4	76.9	0	0	0	111.9	A870 V871 K876 N877 L878	A870-W874 PolarHBondContact O-N 3.34Å; V871-W874 PolarHBondContact O-N 3.05Å; W874-K876 VanDerWaalsContact C-N 3.26Å; W874-K876 PolarHBondContact O-N 2.96Å; W874-N877 PolarHBondContact O-N 2.99Å; W874-L878 HydrophobicContact CH2-CD1 4.35Å; W874-L878 HydrophobicContact CZ3-CD1 4.45Å
875	R	54.8	Low	53.2	Low	162 Å²	162	120.4 Å²	120.4	61%	0.611	66%	0.655	S	S	*	*	H	α-helix	trans	-62.2	-25.8	174.8	-175.1	179.1	-73.5	140.7	-8.4	113.9	V871 N872 V873	V871-R875 WeakPolarHBondContact O-CB 3.47Å; V871-R875 PolarHBondContact O-N 3.38Å; N872-R875 PolarHBondContact OD1-NH1 3.37Å; V873-R875 VanDerWaalsContact C-N 3.31Å; V873-R875 PolarHBondContact O-N 3.29Å
876	K	55.5	Low	51.6	Low	182 Å²	182	120.2 Å²	120.2	79%	0.791	66%	0.663	S	S	*	*	H	α-helix	trans	-80.2	-15.2	-178.9	-94.4	-167.3	170.5	-168.2	0	114.8	N872 V873 W874	N872-K876 PolarHBondContact O-N 2.95Å; V873-K876 PolarHBondContact O-N 3.4Å; W874-K876 VanDerWaalsContact C-N 3.26Å; W874-K876 PolarHBondContact O-N 2.96Å
877	N	57.5	Low	50.1	Low	139 Å²	139	121.9 Å²	121.9	74%	0.743	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	9.5	-173	-71.8	1.5	0	0	0	114.3	W874	W874-N877 PolarHBondContact O-N 2.99Å
878	L	51.5	Low	48.8	Very low	115 Å²	115	125.4 Å²	125.4	60%	0.602	68%	0.678	S	S	*	*	S	Bend	trans	-125	7.2	-160.7	-112.3	168.8	0	0	0	117.3	W874	W874-L878 HydrophobicContact CH2-CD1 4.35Å; W874-L878 HydrophobicContact CZ3-CD1 4.45Å
879	Q	41.1	Very low	47.4	Very low	184 Å²	184	124.6 Å²	124.6	86%	0.86	68%	0.68	S	S	*	*			trans	-155.3	133.2	169.8	-115.7	158.9	12.1	0	0	113.4
880	P	39.3	Very low	46	Very low	131 Å²	131	131 Å²	131	85%	0.851	69%	0.693	S	S	*	*			trans	-90.4	177.8	-179.6	37.1	-36.3	0	0	0	113.9
881	S	33.8	Very low	44.6	Very low	117 Å²	117	136.6 Å²	136.6	82%	0.818	71%	0.705	S	S	*	*			trans	-88	153.5	-166.8	53.8	0	0	0	0	116.9
882	S	33.7	Very low	42.9	Very low	126 Å²	126	138.7 Å²	138.7	88%	0.881	72%	0.724	S	S	*	*			trans	-138.8	156	135.7	58.7	0	0	0	0	110
883	S	33.4	Very low	41.4	Very low	101 Å²	101	138.6 Å²	138.6	71%	0.706	74%	0.741	S	S	*	*			trans	-138.8	167	-170.4	54.9	0	0	0	0	111.4
884	V	34.3	Very low	39.7	Very low	136 Å²	136	146 Å²	146	82%	0.824	76%	0.758	S	S	*	*			trans	-171.2	147.9	141.3	134.7	0	0	0	0	111.1
885	E	35.1	Very low	38.4	Very low	145 Å²	145	141.3 Å²	141.3	68%	0.678	76%	0.761	S	S	*	*			trans	-89	-170.3	179.6	-58.2	96.3	108.8	0	0	112.1
886	T	34.8	Very low	37.4	Very low	127 Å²	127	142.3 Å²	142.3	78%	0.779	77%	0.772	S	S	*	*			cis	-154.7	176.6	20.6	36.6	0	0	0	0	109.2
887	Q	35.1	Very low	37.3	Very low	161 Å²	161	138.3 Å²	138.3	75%	0.752	77%	0.765	S	S	*	*			cis	-172	-169.9	-35.5	-158.4	179	-98.2	0	0	107.4
888	D	36.3	Very low	36	Very low	128 Å²	128	136.7 Å²	136.7	68%	0.684	76%	0.756	S	S	*	*			trans	74.6	141.9	156.2	-71.2	10.1	0	0	0	121.8
889	D	37.4	Very low	35.6	Very low	109 Å²	109	136.3 Å²	136.3	58%	0.583	76%	0.761	S	S	*	*			cis	-167	164.2	-21.6	-173.2	18.3	0	0	0	110.3
890	R	35.8	Very low	35.1	Very low	188 Å²	188	134.4 Å²	134.4	71%	0.709	75%	0.749	S	S	*	*			trans	77.9	147.4	160.5	-48.4	-170.7	177.7	156.6	11.5	118.5
891	K	35.6	Very low	34.8	Very low	180 Å²	180	136.4 Å²	136.4	78%	0.783	75%	0.745	S	S	*	*			cis	-170.4	170.6	-13.2	-105.7	174.2	-175.8	-177.8	0	108
892	S	32	Very low	34.5	Very low	118 Å²	118	140.1 Å²	140.1	83%	0.825	75%	0.746	S	S	*	*			cis	-179.1	133.5	-44	-177.4	0	0	0	0	110.6
893	G	30	Very low	34.3	Very low	75 Å²	75	138.2 Å²	138.2	77%	0.773	74%	0.738	S	S	*	*			trans	104.7	158.7	171.1	0	0	0	0	0	116.3
894	R	29.6	Very low	33.9	Very low	249 Å²	249	138.4 Å²	138.4	94%	0.94	74%	0.739	S	S	*	*			cis	-164.5	162.1	-6.2	-161.7	173.9	-175.4	165.8	1.2	110.9
895	A	29.8	Very low	33.6	Very low	94 Å²	94	139.3 Å²	139.3	78%	0.777	73%	0.733	S	S	*	*			trans	83.7	88.9	160.7	0	0	0	0	0	121.1
896	E	33.4	Very low	33.3	Very low	183 Å²	183	142 Å²	142	86%	0.855	74%	0.736	S	S	*	*				-14.4	171.8	125.8	-77.7	-169.8	114.8	0	0	121.2
897	P	53	Low	32.9	Very low	98 Å²	98	140 Å²	140	64%	0.636	73%	0.728	S	S	*	*			cis	-148	-178.4	-30.3	40.1	-21.3	0	0	0	117.1
898	D	31.2	Very low	32.7	Very low	106 Å²	106	139.6 Å²	139.6	57%	0.567	73%	0.73	S	S	*	*			trans	75.3	158.6	144	-97.8	-10	0	0	0	122.7	K900	D898-K900 VanDerWaalsContact OD1-CD 3.28Å; D898-K900 WeakPolarHBondContact OD1-CD 3.47Å; D898-K900 WeakPolarHBondContact OD1-CE 3.37Å; D898-K900 IonicContact OD1-NZ 2.71Å; D898-K900 PolarHBondContact OD1-NZ 3.25Å; D898-K900 IonicContact OD2-NZ 3.27Å; D898-K900 PolarHBondContact OD2-NZ 3.38Å
899	P	43.6	Very low	32.3	Very low	107 Å²	107	138 Å²	138	70%	0.695	73%	0.728	S	S	*	*			cis	-130.8	149.1	-12.2	31.1	-10.8	0	0	0	117.6
900	K	31	Very low	32	Very low	143 Å²	143	138.9 Å²	138.9	62%	0.622	74%	0.738	S	S	*	*				14.5	146	121	-58.6	141.5	-170.2	157.2	0	117.2	D898	D898-K900 VanDerWaalsContact OD1-CD 3.28Å; D898-K900 WeakPolarHBondContact OD1-CD 3.47Å; D898-K900 WeakPolarHBondContact OD1-CE 3.37Å; D898-K900 IonicContact OD1-NZ 2.71Å; D898-K900 PolarHBondContact OD1-NZ 3.25Å; D898-K900 IonicContact OD2-NZ 3.27Å; D898-K900 PolarHBondContact OD2-NZ 3.38Å
901	K	31.4	Very low	31.7	Very low	173 Å²	173	136.4 Å²	136.4	75%	0.752	74%	0.744	S	S	*	*			cis	-170.8	159.3	12.7	-114.1	167.3	-169.1	172	0	109
902	K	28	Very low	31.4	Very low	195 Å²	195	135.6 Å²	135.6	85%	0.848	75%	0.747	S	S	*	*				31.1	144.1	103.3	-61.5	-174.3	-179.5	-176.9	0	116.9
903	A	29.7	Very low	31.4	Very low	86 Å²	86	134.2 Å²	134.2	71%	0.711	74%	0.743	S	S	*	*			cis	179.9	-167.2	-11	0	0	0	0	0	108.2
904	S	25.7	Very low	31.3	Very low	105 Å²	105	135.9 Å²	135.9	73%	0.734	74%	0.743	S	S	*	*			trans	74.1	152.7	160	-92.9	0	0	0	0	117.6
905	F	27.8	Very low	31.3	Very low	156 Å²	156	129 Å²	129	68%	0.684	73%	0.733	S	S	*	*			cis	-158.3	178.9	-15.6	-139.9	-144.6	0	0	0	110.7
906	R	28.3	Very low	31.3	Very low	200 Å²	200	131.2 Å²	131.2	76%	0.755	73%	0.73	S	S	*	*			trans	-11.1	153.8	147.3	-70.9	-173.4	-171.4	168.6	1.2	118.8
907	S	26.3	Very low	31.1	Very low	87 Å²	87	130 Å²	130	61%	0.608	72%	0.722	S	S	*	*			cis	175.5	159	-1.1	50.3	0	0	0	0	114.8
908	I	31.3	Very low	30	Very low	152 Å²	152	135.5 Å²	135.5	78%	0.779	73%	0.73	S	S	*	*			trans	75.8	153.7	141.1	-74.9	160.6	0	0	0	120
909	S	27.6	Very low	29.9	Very low	93 Å²	93	140.5 Å²	140.5	65%	0.65	74%	0.741	S	S	*	*			trans	67.2	112.9	168.4	43.4	0	0	0	0	118.1
910	T	30.4	Very low	29.4	Very low	128 Å²	128	146.1 Å²	146.1	79%	0.785	75%	0.748	S	S	*	*				48.6	129.7	77.4	68.3	0	0	0	0	113.6
911	T	29.6	Very low	29.2	Very low	136 Å²	136	144.7 Å²	144.7	83%	0.834	76%	0.756	S	S	*	*			cis	-152.1	171.6	45.1	43.4	0	0	0	0	116.3
912	L	30.3	Very low	29	Very low	163 Å²	163	141.3 Å²	141.3	85%	0.853	75%	0.754	S	S	*	*			trans	-27.5	140.4	170	-101.1	66.7	0	0	0	121.9
913	A	30.8	Very low	29.2	Very low	89 Å²	89	139.8 Å²	139.8	74%	0.736	75%	0.748	S	S	*	*				64.7	111	121.4	0	0	0	0	0	123.8
914	S	29.6	Very low	29.2	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	74%	0.744	S	S	*	*				-176.7	127.9	128.7	27.1	0	0	0	0	107.4
915	S	28.1	Very low	29.3	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	75%	0.748	S	S	*	*			cis	99.7	145.7	39.2	79.8	0	0	0	0	113.6
916	I	31.1	Very low	29.3	Very low	140 Å²	140	144.1 Å²	144.1	72%	0.718	76%	0.757	S	S	*	*			trans	94.1	105.4	158.5	-65.3	174.5	0	0	0	120.9
917	K	29	Very low	29.4	Very low	159 Å²	159	145.3 Å²	145.3	69%	0.691	76%	0.763	S	S	*	*			trans	78.5	116.5	138.4	-75.1	173.6	-169	162.3	0	124.4
918	R	29.8	Very low	30.2	Very low	213 Å²	213	146.6 Å²	146.6	80%	0.804	77%	0.769	S	S	*	*				68	153.2	121.9	-65.1	177.4	177.1	176.6	-1.7	118
919	R	29.5	Very low	31.2	Very low	211 Å²	211	144.4 Å²	144.4	80%	0.796	77%	0.765	S	S	*	*			cis	-160.1	129.8	26.5	-149.5	178.7	-170.7	176.6	0.7	114.1
920	R	31.6	Very low	31.4	Very low	225 Å²	225	146.7 Å²	146.7	85%	0.849	78%	0.775	S	S	*	*			trans	52.6	150.1	140.1	-81.8	-169.7	169.7	177.7	-4.5	125.4
921	S	26.8	Very low	31.3	Very low	112 Å²	112	148 Å²	148	78%	0.783	78%	0.777	S	S	*	*			trans	90.8	146.8	143.8	-71.7	0	0	0	0	120
922	S	28.9	Very low	31.4	Very low	103 Å²	103	146.5 Å²	146.5	72%	0.72	78%	0.779	S	S	*	*			cis	-174.1	153.8	-26	-158.2	0	0	0	0	113.8
923	K	31	Very low	31.5	Very low	163 Å²	163	146 Å²	146	71%	0.709	78%	0.783	S	S	*	*			trans	85.9	135.3	146.9	-92.2	-175.5	151.7	-76	0	123.8
924	D	29	Very low	31.3	Very low	116 Å²	116	145.7 Å²	145.7	62%	0.62	79%	0.788	S	S	*	*			trans	59.2	154.2	146.6	-45	-23	0	0	0	120
925	T	28.9	Very low	31.3	Very low	136 Å²	136	149 Å²	149	83%	0.834	79%	0.791	S	S	*	*			cis	-150.7	-163.2	32.2	-38.8	0	0	0	0	113.5
926	Q	27.3	Very low	31.3	Very low	186 Å²	186	152.4 Å²	152.4	87%	0.869	80%	0.8	S	S	*	*			trans	-102.4	170.5	-159.4	-76.5	164.8	-95.6	0	0	118.9
927	Y	30.3	Very low	31.2	Very low	225 Å²	225	152 Å²	152	88%	0.882	80%	0.8	S	S	*	*			trans	-56.6	-177.7	161.6	-77.4	-85.1	0	0	0	115.4
928	P	42.5	Very low	31.3	Very low	114 Å²	114	152.4 Å²	152.4	74%	0.74	81%	0.809	S	S	*	*			cis	-132.8	-132.5	3.3	28.9	-1.4	0	0	0	114.1
929	P	53.6	Low	31.3	Very low	106 Å²	106	146.9 Å²	146.9	69%	0.688	80%	0.803	S	S	*	*				-124.4	179.8	-81.3	35.8	-19.3	0	0	0	116.1
930	T	30.6	Very low	31.4	Very low	141 Å²	141	144.2 Å²	144.2	87%	0.865	80%	0.804	S	S	*	*			trans	-170.8	164.2	136.4	10	0	0	0	0	113.5
931	D	28.9	Very low	31.7	Very low	155 Å²	155	139.4 Å²	139.4	83%	0.829	80%	0.802	S	S	*	*			trans	-92.8	163.4	-168.1	-51.5	-92.2	0	0	0	117
932	A	31.6	Very low	31.9	Very low	104 Å²	104	138.9 Å²	138.9	86%	0.86	80%	0.799	S	S	*	*			trans	-157.7	143.4	140.6	0	0	0	0	0	111.2
933	T	32.2	Very low	32.1	Very low	153 Å²	153	140.2 Å²	140.2	94%	0.939	80%	0.802	S	S	*	*			trans	-110.5	157	-177.7	46.8	0	0	0	0	112.8
934	G	27.6	Very low	31.9	Very low	83 Å²	83	138.1 Å²	138.1	86%	0.856	81%	0.808	S	S	*	*			trans	-169.9	118.8	171.5	0	0	0	0	0	113.1
935	Q	29.9	Very low	32	Very low	180 Å²	180	138.5 Å²	138.5	84%	0.841	82%	0.815	S	S	*	*			trans	-97.4	160.4	172.8	-60.3	173.5	-75.8	0	0	110.7
936	L	28.2	Very low	32.1	Very low	175 Å²	175	138.4 Å²	138.4	92%	0.916	81%	0.814	S	S	*	*			trans	-162.8	151.2	136.3	-109.6	163.4	0	0	0	111.6
937	N	28.6	Very low	32.4	Very low	133 Å²	133	139.7 Å²	139.7	71%	0.711	83%	0.834	S	S	*	*			trans	-104.2	155.9	-175.6	-61.5	-33.2	0	0	0	111.9
938	L	30.9	Very low	32.5	Very low	166 Å²	166	135.4 Å²	135.4	87%	0.869	83%	0.831	S	S	*	*			trans	-166.1	104.2	144.6	-87.4	127.8	0	0	0	105.9
939	S	29.4	Very low	32	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	84%	0.836	S	S	*	*				79.2	124	61	75.5	0	0	0	0	114.4
940	D	31.4	Very low	30.8	Very low	155 Å²	155	138.2 Å²	138.2	83%	0.829	84%	0.844	S	S	*	*			trans	-59.7	170.6	177	-56.3	-81.2	0	0	0	114.2
941	P	38.6	Very low	30.8	Very low	125 Å²	125	138.1 Å²	138.1	81%	0.812	84%	0.843	S	S	*	*				-134.1	141.6	113.1	36.9	-28.3	0	0	0	116.6
942	S	29.5	Very low	30.9	Very low	101 Å²	101	137 Å²	137	71%	0.706	84%	0.844	S	S	*	*			trans	-26	139	162.9	55.5	0	0	0	0	120.4
943	V	33.3	Very low	30.9	Very low	131 Å²	131	139.2 Å²	139.2	79%	0.794	84%	0.843	S	S	*	*				32.7	122.1	121.1	-174.1	0	0	0	0	118.6
944	S	27.6	Very low	30.8	Very low	119 Å²	119	138.2 Å²	138.2	83%	0.832	84%	0.836	S	S	*	*			trans	-140.2	149.3	144.7	58.9	0	0	0	0	110.7
945	T	31.2	Very low	31	Very low	123 Å²	123	142.5 Å²	142.5	76%	0.755	83%	0.834	S	S	*	*			trans	-116.5	173.8	-179.5	41.2	0	0	0	0	111.1
946	V	30.6	Very low	31.1	Very low	134 Å²	134	139.3 Å²	139.3	81%	0.812	83%	0.834	S	S	*	*			trans	119.7	127.6	152.5	177.6	0	0	0	0	115.4
947	V	33.9	Very low	31.4	Very low	213 Å²	213	136.1 Å²	136.1	100%	1.291	83%	0.826	S	S	*	*			trans	64.8	0	-171.8	-161.6	0	0	0	0	115

Retrieved 947 of 947 residues in 247.8 ms (Link to these results)

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