A0A096NWP3_PAPAN 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 (A0A2J8RMK6), UniProt , Accession A0A096NWP3, Species PAPAN (Papio anubis, Olive baboon), Gene GRIN1, Length 959 aa.

						>A0A096NWP3_PAPAN|A0A096NWP3|GRIN1
MSTMRLLTLALLFSCSVARAACDPKIVNIGAVLSTRKHEQMFREAVNQANKRHGSWKIQLNATSVTHKPNAIQMALSVCEDLISSQVYAILVSHPPTPNDHFTPTPVSYTAGFYRIPVLGLTTRMSIYSDKSIHLSFLRTVPPYSHQSSVWFEMMRVYSWNHIILLVSDDHEGRAAQKRLETLLEERESKSKKRNYENLDQLSYDNKRGPKAEKVLQFDPGTKNVTALLMEAKELEARVIILSASEDDAATVYRAAAMLNMTGSGYVWLVGEREISGNALRYAPDGILGLQLINGKNESAHISDAVGVVAQAVHELLEKENITDPPRGCVGNTNIWKTGPLFKRVLMSSKYADGVTGRVEFNEDGDRKFANYSIMNLQNRKLVQVGIYNGTHVIPNDRKIIWPGGETEKPRGYQMSTRLKIVTIHQEPFVYVKPTLSDGTCKEEFTVNGDPVKKVICTGPNDTSPGSPRHTVPQCCYGFCIDLLIKLARTMNFTYEVHLVADGKFGTQERVNNSNKKEWNGMMGELLSGQADMIVAPLTINNERAQYIEFSKPFKYQGLTILVKKEIPRSTLDSFMQPFQSTLWLLVGLSVHVVAVMLYLLDRFSPFGRFKVNSEEEEEDALTLSSAMWFSWGVLLNSGIGEGAPRSFSARILGMVWAGFAMIIVASYTANLAAFLVLDRPEERITGINDPRLRNPSDKFIYATVKQSSVDIYFRRQVELSTMYRHMEKHNYESAAEAIQAVRDNKLHAFIWDSAVLEFEASQKCDLVTTGELFFRSGFGIGMRKDSPWKQNVSLSILKSHENGFMEDLDKTWVRYQECDSRSNAPATLTFENMAGVFMLVAGGIVAGIFLIFIEIAYKRHKDARRKQMQLAFAAVNVWRKNLQDRKSGRAEPDPKKKATFRAITSTLASSFKRRRSSKDTSTGGGRGALQNQKDTVLPRRAIEREEGQLQLCSRHRES
					

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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	51.8	Low	51.8	Low	234 Å²	234	133.5 Å²	133.5	100%	1.153	71%	0.71	S	S	*	*				0	38.2	0	-82.8	169	69.8	0	0	113.5
2	S	51.5	Low	51.6	Low	106 Å²	106	133.2 Å²	133.2	74%	0.741	71%	0.707	S	S	*	*			trans	-125.6	0.6	172.8	-70.5	0	0	0	0	114.8
3	T	48.9	Very low	51.2	Low	123 Å²	123	134.7 Å²	134.7	76%	0.755	70%	0.704	S	S	*	*	S	Bend	trans	-97.3	-13	-179.9	44.5	0	0	0	0	113.9
4	M	49.6	Very low	50.6	Low	165 Å²	165	130.3 Å²	130.3	81%	0.813	69%	0.691	S	S	*	*	H	α-helix	trans	-92.5	-11.5	-175.6	-123.1	164.2	92.8	0	0	114.9	T8	M4-T8 PolarHBondContact O-OG1 3.17Å
5	R	51.3	Low	49.7	Very low	210 Å²	210	128.3 Å²	128.3	79%	0.792	69%	0.69	S	S	*	*	H	α-helix	trans	-93.4	-18.6	176.9	-78.4	-173	176.2	-177.4	-0.7	114.2	T8	R5-T8 PolarHBondContact O-OG1 3.28Å
6	L	51.3	Low	49.2	Very low	136 Å²	136	125.9 Å²	125.9	71%	0.712	69%	0.686	S	S	*	*	H	α-helix	trans	-81.5	-32.8	175	-103.4	103.8	0	0	0	112.8	T8 A10	L6-T8 PolarHBondContact O-N 2.94Å; L6-A10 WeakPolarHBondContact O-CB 3.45Å; L6-A10 PolarHBondContact O-N 3.45Å
7	L	52.1	Low	48.8	Very low	121 Å²	121	125.2 Å²	125.2	63%	0.634	69%	0.686	S	S	*	*	H	α-helix	trans	-70.6	-31.7	-179.8	-117.9	102.1	0	0	0	112.9	L11	L7-L11 PolarHBondContact O-N 2.87Å
8	T	54.5	Low	48.2	Very low	84 Å²	84	123.1 Å²	123.1	52%	0.515	69%	0.688	S	S	.	*	H	α-helix	trans	-78.4	-30.3	-179.2	40.3	0	0	0	0	113	M4 R5 L6 L12	M4-T8 PolarHBondContact O-OG1 3.17Å; R5-T8 PolarHBondContact O-OG1 3.28Å; L6-T8 PolarHBondContact O-N 2.94Å; T8-L12 PolarHBondContact O-N 3.23Å
9	L	53.2	Low	47.6	Very low	119 Å²	119	128.4 Å²	128.4	62%	0.623	70%	0.696	S	S	*	*	H	α-helix	trans	-74.9	-34.9	170.9	-109.5	102.1	0	0	0	112.7	F13	L9-F13 PolarHBondContact O-N 3.35Å
10	A	54.1	Low	47.1	Very low	59 Å²	59	126.5 Å²	126.5	49%	0.488	70%	0.699	S	S	.	*	H	α-helix	trans	-68.6	-35.4	178.1	0	0	0	0	0	112.7	L6 S14	L6-A10 WeakPolarHBondContact O-CB 3.45Å; L6-A10 PolarHBondContact O-N 3.45Å; A10-S14 WeakPolarHBondContact O-CB 3.34Å; A10-S14 PolarHBondContact O-N 3.41Å; A10-S14 VanDerWaalsContact O-N 3.15Å; A10-S14 PolarHBondContact O-OG 2.99Å
11	L	51.6	Low	46.8	Very low	112 Å²	112	124.2 Å²	124.2	59%	0.586	70%	0.697	S	S	*	*	H	α-helix	trans	-73.4	-30.5	177.1	-87.8	155.8	0	0	0	113.5	L7 S14 C15	L7-L11 PolarHBondContact O-N 2.87Å; L11-S14 WeakPolarHBondContact CA-OG 3.49Å; L11-S14 PolarHBondContact O-OG 3.49Å; L11-C15 PolarHBondContact O-N 3.45Å
12	L	49.8	Very low	46.7	Very low	129 Å²	129	117.8 Å²	117.8	68%	0.675	67%	0.674	S	S	*	*	H	α-helix	trans	-78	-31.2	175.7	-75.9	165.7	0	0	0	112.8	T8 S16	T8-L12 PolarHBondContact O-N 3.23Å; L12-S16 PolarHBondContact O-OG 3.13Å
13	F	45.5	Very low	47.2	Very low	153 Å²	153	119.7 Å²	119.7	67%	0.671	68%	0.676	S	S	*	*	H	α-helix	trans	-75	-32.8	173.6	-108.2	-86.5	0	0	0	113.2	L9 S16	L9-F13 PolarHBondContact O-N 3.35Å; F13-S16 PolarHBondContact O-N 3.25Å
14	S	43.6	Very low	48.3	Very low	73 Å²	73	116 Å²	116	51%	0.51	65%	0.654	S	S	.	*	H	α-helix	trans	-76.8	-25.5	178.9	40.7	0	0	0	0	113.6	A10 L11 S16	A10-S14 WeakPolarHBondContact O-CB 3.34Å; A10-S14 PolarHBondContact O-N 3.41Å; A10-S14 VanDerWaalsContact O-N 3.15Å; A10-S14 PolarHBondContact O-OG 2.99Å; L11-S14 WeakPolarHBondContact CA-OG 3.49Å; L11-S14 PolarHBondContact O-OG 3.49Å; S14-S16 VanDerWaalsContact C-N 3.33Å
15	C	37.3	Very low	49.9	Very low	100 Å²	100	111.8 Å²	111.8	68%	0.676	63%	0.631	S	S	*	*	H	α-helix	trans	-77.1	-16.9	171.6	-110.5	0	0	0	0	114	L11	L11-C15 PolarHBondContact O-N 3.45Å
16	S	41.1	Very low	51.6	Low	90 Å²	90	106.4 Å²	106.4	63%	0.629	62%	0.617	S	S	*	*	H	α-helix	trans	-89.7	-19.7	-177	-56.4	0	0	0	0	113.3	L12 F13 S14	L12-S16 PolarHBondContact O-OG 3.13Å; F13-S16 PolarHBondContact O-N 3.25Å; S14-S16 VanDerWaalsContact C-N 3.33Å
17	V	41.8	Very low	53.5	Low	114 Å²	114	100 Å²	100	69%	0.691	58%	0.583	S	S	*	*	H	α-helix	trans	-92.9	-17.4	179.7	-179.1	0	0	0	0	112.5	R19	V17-R19 PolarHBondContact O-N 3.49Å
18	A	37.9	Very low	55.4	Low	87 Å²	87	95.4 Å²	95.4	72%	0.719	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	4.3	178.5	0	0	0	0	0	114.7
19	R	37.8	Very low	57.3	Low	224 Å²	224	91.4 Å²	91.4	85%	0.845	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	14.7	-179.8	-95.2	-174.6	177	162.7	-0.1	115.2	V17 A21	V17-R19 PolarHBondContact O-N 3.49Å; R19-A21 PolarHBondContact O-N 3.03Å
20	A	37	Very low	59.3	Low	90 Å²	90	85.8 Å²	85.8	74%	0.744	51%	0.505	S	S	*	.			trans	-73	71.6	154.7	0	0	0	0	0	108.2	C22	A20-C22 PolarHBondContact O-N 3.1Å; A20-C22 VanDerWaalsContact O-N 3.14Å
21	A	40.9	Very low	61.3	Low	80 Å²	80	83 Å²	83	66%	0.661	48%	0.482	S	S	*	.			trans	-54.9	117.2	166.7	0	0	0	0	0	107.1	R19 D23	R19-A21 PolarHBondContact O-N 3.03Å; A21-D23 PolarHBondContact O-N 3.23Å
22	C	50.6	Low	63.3	Low	99 Å²	99	77.6 Å²	77.6	67%	0.669	45%	0.454	S	S	*	.			trans	-60.8	105.9	166.3	-82.3	0	0	0	0	107.2	A20 W56	A20-C22 PolarHBondContact O-N 3.1Å; A20-C22 VanDerWaalsContact O-N 3.14Å; C22-W56 HydrophobicContact CB-CZ3 4.46Å
23	D	61.3	Low	65.3	Low	146 Å²	146	71.5 Å²	71.5	78%	0.781	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-59.2	133.7	168.5	-77.2	-33	0	0	0	108.8	A21 K25	A21-D23 PolarHBondContact O-N 3.23Å; D23-K25 PolarHBondContact O-N 3.24Å
24	P	73.1	Confident	67.3	Low	46 Å²	46	64.9 Å²	64.9	30%	0.299	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-63.5	138.2	-178.1	25.4	-33.2	0	0	0	110.3	I26 Q59	P24-I26 PolarHBondContact O-N 3.37Å; P24-Q59 HydrophobicContact CB-CB 4.3Å
25	K	82.1	Confident	69.5	Low	76 Å²	76	63.9 Å²	63.9	33%	0.33	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	117.9	175.2	-174.5	167.4	-178.4	166.5	0	109.1	D23 K57 Q59 L317 D324	D23-K25 PolarHBondContact O-N 3.24Å; K25-K57 PolarHBondContact N-O 3.18Å; K25-Q59 PolarHBondContact O-N 3.24Å; K25-L317 HydrophobicContact CD-CD2 4.26Å; K25-D324 WeakPolarHBondContact CE-OD1 3.12Å; K25-D324 IonicContact NZ-OD1 3.75Å; K25-D324 PolarHBondContact NZ-OD1 3.21Å
26	I	87.5	Confident	72	Confident	97 Å²	97	68.3 Å²	68.3	50%	0.497	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.9	179.4	-56.7	175.4	0	0	0	109.5	P24 Q59 N61	P24-I26 PolarHBondContact O-N 3.37Å; I26-Q59 CarbonylContact C-O 3.57Å; I26-Q59 WeakPolarHBondContact CA-O 3.42Å; I26-N61 HydrophobicContact CG2-CB 3.7Å
27	V	90	Very high	74.5	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	112.7	178	178.1	0	0	0	0	108.9	I58 Q59 L60 N61 Y88 V313 L317	V27-I58 HydrophobicContact CG2-CG2 4.07Å; V27-Q59 PolarHBondContact N-O 3.43Å; V27-L60 HydrophobicContact CB-CD2 4.05Å; V27-L60 HydrophobicContact CG1-CD2 4.22Å; V27-L60 CarbonylContact O-C 3.57Å; V27-L60 WeakPolarHBondContact O-CA 3.39Å; V27-N61 PolarHBondContact O-N 3.41Å; V27-Y88 HydrophobicContact CG1-CD1 4.34Å; V27-Y88 HydrophobicContact CG1-CD2 3.61Å; V27-Y88 HydrophobicContact CG1-CE2 4.05Å; V27-Y88 HydrophobicContact CG1-CG 3.75Å; V27-V313 HydrophobicContact CB-CG1 4.42Å; V27-V313 HydrophobicContact CG1-CG1 4.04Å; V27-V313 HydrophobicContact CG1-CG2 4.23Å; V27-V313 HydrophobicContact CG2-CG1 4.12Å; V27-L317 HydrophobicContact CG2-CD2 4.34Å
28	N	93.3	Very high	76.9	Confident	25 Å²	25	67.5 Å²	67.5	13%	0.134	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	132	-179.3	-63.1	-52.3	0	0	0	111.2	N61 S85 V87 Y88	N28-N61 CarbonylContact C-O 3.6Å; N28-N61 WeakPolarHBondContact CA-O 3.37Å; N28-N61 VanDerWaalsContact OD1-CB 3.3Å; N28-N61 WeakPolarHBondContact OD1-CB 3.35Å; N28-N61 PolarHBondContact OD1-ND2 3.16Å; N28-S85 WeakPolarHBondContact CB-O 3.49Å; N28-S85 PolarHBondContact ND2-O 3.07Å; N28-V87 HydrophobicContact CB-CG1 4.28Å; N28-V87 CarbonylContact O-C 3.57Å; N28-V87 WeakPolarHBondContact O-CA 3.36Å; N28-Y88 PolarHBondContact O-N 3.04Å
29	I	94.8	Very high	79.5	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.6	172.4	-55	173.3	0	0	0	107.9	F42 L60 N61 T63 L91 V309	I29-F42 HydrophobicContact CB-CZ 4.15Å; I29-F42 HydrophobicContact CG2-CE2 4.1Å; I29-F42 HydrophobicContact CG2-CZ 3.81Å; I29-L60 HydrophobicContact CD1-CB 4.48Å; I29-L60 HydrophobicContact CD1-CD1 4.41Å; I29-L60 HydrophobicContact CD1-CD2 4.29Å; I29-N61 PolarHBondContact N-O 3.16Å; I29-T63 PolarHBondContact O-N 2.56Å; I29-T63 PolarHBondContact O-OG1 3.35Å; I29-L91 HydrophobicContact CG2-CD1 3.6Å; I29-V309 HydrophobicContact CD1-CG1 3.64Å; I29-V309 HydrophobicContact CG1-CG1 4.13Å
30	G	95.3	Very high	82.1	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	149.2	177.8	0	0	0	0	0	112	T63 A89 I90 L91	G30-T63 CarbonylContact C-O 3.5Å; G30-T63 VanDerWaalsContact CA-O 3.24Å; G30-T63 WeakPolarHBondContact CA-O 3.15Å; G30-A89 PolarHBondContact N-O 3.24Å; G30-I90 CarbonylContact O-C 3.53Å; G30-I90 VanDerWaalsContact O-CA 3.3Å; G30-I90 WeakPolarHBondContact O-CA 3.38Å; G30-L91 PolarHBondContact O-N 3.42Å
31	A	95.1	Very high	84.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	140.5	169.3	0	0	0	0	0	112.7	L33 F42 T63 S64 V65 L91	A31-L33 HydrophobicContact CB-CD1 3.99Å; A31-L33 HydrophobicContact CB-CD2 4.35Å; A31-L33 HydrophobicContact CB-CG 3.93Å; A31-F42 HydrophobicContact CB-CD1 3.77Å; A31-F42 HydrophobicContact CB-CD2 4.12Å; A31-F42 HydrophobicContact CB-CE1 3.61Å; A31-F42 HydrophobicContact CB-CE2 3.98Å; A31-F42 HydrophobicContact CB-CG 4.02Å; A31-F42 HydrophobicContact CB-CZ 3.72Å; A31-T63 PolarHBondContact N-O 3.43Å; A31-S64 CarbonylContact O-C 3.58Å; A31-S64 VanDerWaalsContact O-CA 3.22Å; A31-S64 WeakPolarHBondContact O-CA 3.38Å; A31-V65 PolarHBondContact O-N 2.86Å; A31-L91 CarbonylContact C-O 3.57Å; A31-L91 VanDerWaalsContact CA-O 3.29Å; A31-L91 WeakPolarHBondContact CA-O 3.5Å; A31-L91 HydrophobicContact CB-CB 4.08Å
32	V	93.5	Very high	87.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	107.1	170.3	-177.3	0	0	0	0	108.4	V65 M74 V78 L82 I90 L91 V92 S93 V107	V32-V65 VanDerWaalsContact CA-O 3.32Å; V32-V65 WeakPolarHBondContact CA-O 3.43Å; V32-M74 HydrophobicContact CB-CE 4.22Å; V32-M74 HydrophobicContact CG1-CE 3.47Å; V32-M74 VanDerWaalsContact CG1-CE 3.47Å; V32-M74 HydrophobicContact CG1-SD 3.67Å; V32-M74 HydrophobicContact CG2-CE 3.62Å; V32-V78 HydrophobicContact CG2-CG2 4.28Å; V32-L82 HydrophobicContact CG2-CD1 3.75Å; V32-I90 HydrophobicContact CG2-CG2 4.37Å; V32-L91 PolarHBondContact N-O 3Å; V32-V92 HydrophobicContact CB-CG2 4.23Å; V32-S93 PolarHBondContact O-N 3.04Å; V32-S93 PolarHBondContact O-OG 3.45Å; V32-V107 HydrophobicContact CG2-CG1 4.46Å; V32-V107 HydrophobicContact CG2-CG2 4.31Å
33	L	91.8	Very high	89.4	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	153.8	-167.1	-61.3	175.5	0	0	0	113.3	A31 H38 E39 F42 V65 T66 H67 S93 L121 I302	A31-L33 HydrophobicContact CB-CD1 3.99Å; A31-L33 HydrophobicContact CB-CD2 4.35Å; A31-L33 HydrophobicContact CB-CG 3.93Å; L33-H38 HydrophobicContact CB-CB 4.16Å; L33-H38 HydrophobicContact CD1-CB 4.17Å; L33-H38 WeakPolarHBondContact CD1-O 3.08Å; L33-E39 HydrophobicContact CB-CG 4.29Å; L33-E39 HydrophobicContact CD1-CG 4.24Å; L33-F42 HydrophobicContact CD1-CB 3.69Å; L33-F42 HydrophobicContact CD1-CG 4.22Å; L33-V65 PolarHBondContact N-O 3.34Å; L33-T66 WeakPolarHBondContact O-CA 3.48Å; L33-H67 PolarHBondContact O-N 2.8Å; L33-H67 VanDerWaalsContact O-N 3.09Å; L33-S93 VanDerWaalsContact CA-OG 3.3Å; L33-S93 WeakPolarHBondContact CA-OG 3.22Å; L33-L121 HydrophobicContact CD2-CD1 4.01Å; L33-I302 HydrophobicContact CD1-CD1 4.36Å; L33-I302 HydrophobicContact CD2-CD1 4.04Å; L33-I302 HydrophobicContact CD2-CG1 4.37Å
34	S	87.7	Confident	91	Very high	15 Å²	15	54.8 Å²	54.8	11%	0.105	25%	0.251	C	S	.	.	S	Bend	trans	-66.5	-37.6	-176.3	64.4	0	0	0	0	113.4	H38 S93 H94 P96 E298	S34-H38 PolarHBondContact OG-ND1 3.33Å; S34-S93 PolarHBondContact N-OG 3.48Å; S34-S93 VanDerWaalsContact N-OG 3.16Å; S34-H94 WeakPolarHBondContact CB-O 3.14Å; S34-P96 WeakPolarHBondContact O-CG 3.36Å; S34-E298 WeakPolarHBondContact CB-OE2 3.49Å; S34-E298 PolarHBondContact OG-OE2 2.78Å
35	T	90.3	Very high	91.9	Very high	51 Å²	51	53 Å²	53	31%	0.313	24%	0.241	S	C	.	.	S	Bend	trans	-142.7	157.4	-177.1	72.7	0	0	0	0	111.7	K37 H38 E39 P96	T35-K37 PolarHBondContact O-N 3.49Å; T35-H38 PolarHBondContact O-N 3.4Å; T35-H38 PolarHBondContact OG1-N 2.92Å; T35-H38 PolarHBondContact OG1-ND1 3.09Å; T35-E39 PolarHBondContact O-N 3.35Å; T35-P96 HydrophobicContact CG2-CG 4.29Å
36	R	89.6	Confident	92.5	Very high	193 Å²	193	49.5 Å²	49.5	73%	0.728	23%	0.226	S	C	*	.	H	α-helix	trans	-60.8	-26.6	174.4	-69	-173	179.6	-179.7	-0.1	113.5	H38 E39 Q40 T66	R36-H38 VanDerWaalsContact C-N 3.33Å; R36-E39 WeakPolarHBondContact O-CB 3.41Å; R36-E39 PolarHBondContact O-N 2.8Å; R36-Q40 PolarHBondContact O-N 2.93Å; R36-T66 HydrophobicContact CG-CG2 3.89Å
37	K	92.2	Very high	92.7	Very high	150 Å²	150	49.4 Å²	49.4	65%	0.652	23%	0.226	S	C	*	.	H	α-helix	trans	-63.5	-42.4	174	-175.1	179.9	178.2	-179.2	0	110.6	T35 E39 Q40 M41	T35-K37 PolarHBondContact O-N 3.49Å; K37-E39 VanDerWaalsContact C-N 3.29Å; K37-E39 PolarHBondContact O-N 3.36Å; K37-Q40 PolarHBondContact O-N 3.18Å; K37-M41 WeakPolarHBondContact O-CG 3.27Å; K37-M41 PolarHBondContact O-N 3.39Å; K37-M41 VanDerWaalsContact O-N 3.11Å
38	H	92.8	Very high	92.7	Very high	38 Å²	38	53.8 Å²	53.8	18%	0.176	25%	0.247	C	C	.	.	H	α-helix	trans	-67.6	-29.3	176.6	-64.2	126.1	0	0	0	112.3	L33 S34 T35 R36 M41 F42 E298 I302	L33-H38 HydrophobicContact CB-CB 4.16Å; L33-H38 HydrophobicContact CD1-CB 4.17Å; L33-H38 WeakPolarHBondContact CD1-O 3.08Å; S34-H38 PolarHBondContact OG-ND1 3.33Å; T35-H38 PolarHBondContact O-N 3.4Å; T35-H38 PolarHBondContact OG1-N 2.92Å; T35-H38 PolarHBondContact OG1-ND1 3.09Å; R36-H38 VanDerWaalsContact C-N 3.33Å; H38-M41 PolarHBondContact O-N 2.91Å; H38-F42 WeakPolarHBondContact O-CB 3.28Å; H38-F42 PolarHBondContact O-N 3.02Å; H38-E298 IonicContact CE1-OE2 3.92Å; H38-E298 PolarHBondContact CE1-OE2 2.88Å; H38-E298 IonicContact CG-OE2 3.51Å; H38-E298 IonicContact ND1-OE2 2.64Å; H38-E298 PolarHBondContact ND1-OE2 3.1Å; H38-E298 VanDerWaalsContact ND1-OE2 3.16Å; H38-E298 IonicContact NE2-OE2 3.11Å; H38-I302 HydrophobicContact CB-CD1 3.99Å
39	E	92.4	Very high	92.5	Very high	26 Å²	26	52.9 Å²	52.9	12%	0.121	24%	0.243	C	C	.	.	H	α-helix	trans	-63.5	-41.7	171.7	-61.2	-176.9	152.9	0	0	112.6	L33 T35 R36 K37 F42 R43 S64 T66	L33-E39 HydrophobicContact CB-CG 4.29Å; L33-E39 HydrophobicContact CD1-CG 4.24Å; T35-E39 PolarHBondContact O-N 3.35Å; R36-E39 WeakPolarHBondContact O-CB 3.41Å; R36-E39 PolarHBondContact O-N 2.8Å; K37-E39 VanDerWaalsContact C-N 3.29Å; K37-E39 PolarHBondContact O-N 3.36Å; E39-F42 PolarHBondContact O-N 2.92Å; E39-R43 WeakPolarHBondContact O-CG 3.47Å; E39-R43 PolarHBondContact O-N 3.4Å; E39-S64 WeakPolarHBondContact CG-OG 3.46Å; E39-T66 VanDerWaalsContact OE1-CG2 3.26Å; E39-T66 WeakPolarHBondContact OE1-CG2 3.43Å; E39-T66 PolarHBondContact OE1-N 3.5Å; E39-T66 VanDerWaalsContact OE1-N 3.14Å
40	Q	92.8	Very high	92.2	Very high	127 Å²	127	54.2 Å²	54.2	59%	0.593	25%	0.25	S	C	*	.	H	α-helix	trans	-62.9	-47	174.5	-69.6	177.1	-19.7	0	0	110.9	R36 K37 F42 R43 E44	R36-Q40 PolarHBondContact O-N 2.93Å; K37-Q40 PolarHBondContact O-N 3.18Å; Q40-F42 VanDerWaalsContact C-N 3.27Å; Q40-F42 PolarHBondContact O-N 2.84Å; Q40-R43 PolarHBondContact O-N 3.36Å; Q40-R43 VanDerWaalsContact O-N 3.16Å; Q40-E44 WeakPolarHBondContact O-CG 3.29Å; Q40-E44 PolarHBondContact O-N 2.91Å
41	M	93.1	Very high	91.8	Very high	71 Å²	71	63 Å²	63	35%	0.35	29%	0.288	S	S	.	.	H	α-helix	trans	-59.3	-37.5	175.7	-64.2	-64.2	-63.1	0	0	112.3	K37 H38 E44 A45	K37-M41 WeakPolarHBondContact O-CG 3.27Å; K37-M41 PolarHBondContact O-N 3.39Å; K37-M41 VanDerWaalsContact O-N 3.11Å; H38-M41 PolarHBondContact O-N 2.91Å; M41-E44 PolarHBondContact O-N 3.24Å; M41-A45 WeakPolarHBondContact O-CB 3.34Å; M41-A45 PolarHBondContact O-N 2.93Å
42	F	95.4	Very high	91.2	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65.3	-45	175.3	169.7	-112.4	0	0	0	112.1	I29 A31 L33 H38 E39 Q40 E44 A45 V46 A62 L91 I302 V306	I29-F42 HydrophobicContact CB-CZ 4.15Å; I29-F42 HydrophobicContact CG2-CE2 4.1Å; I29-F42 HydrophobicContact CG2-CZ 3.81Å; A31-F42 HydrophobicContact CB-CD1 3.77Å; A31-F42 HydrophobicContact CB-CD2 4.12Å; A31-F42 HydrophobicContact CB-CE1 3.61Å; A31-F42 HydrophobicContact CB-CE2 3.98Å; A31-F42 HydrophobicContact CB-CG 4.02Å; A31-F42 HydrophobicContact CB-CZ 3.72Å; L33-F42 HydrophobicContact CD1-CB 3.69Å; L33-F42 HydrophobicContact CD1-CG 4.22Å; H38-F42 WeakPolarHBondContact O-CB 3.28Å; H38-F42 PolarHBondContact O-N 3.02Å; E39-F42 PolarHBondContact O-N 2.92Å; Q40-F42 VanDerWaalsContact C-N 3.27Å; Q40-F42 PolarHBondContact O-N 2.84Å; F42-E44 VanDerWaalsContact C-N 3.32Å; F42-E44 PolarHBondContact O-N 3.3Å; F42-A45 PolarHBondContact O-N 3.44Å; F42-V46 HydrophobicContact CD2-CG2 4.26Å; F42-V46 HydrophobicContact CE2-CG2 3.84Å; F42-V46 HydrophobicContact CZ-CG2 4Å; F42-V46 WeakPolarHBondContact O-CG2 3.49Å; F42-V46 PolarHBondContact O-N 3.1Å; F42-A62 HydrophobicContact CD1-CB 4.19Å; F42-A62 HydrophobicContact CE1-CB 3.7Å; F42-A62 HydrophobicContact CZ-CB 4.28Å; F42-L91 HydrophobicContact CD2-CD2 4.29Å; F42-L91 HydrophobicContact CE2-CD1 4.26Å; F42-L91 HydrophobicContact CE2-CD2 4.08Å; F42-I302 HydrophobicContact CB-CG2 3.96Å; F42-I302 HydrophobicContact CD2-CG2 4.1Å; F42-V306 HydrophobicContact CD2-CG2 3.7Å; F42-V306 HydrophobicContact CE2-CG2 3.66Å
43	R	94.4	Very high	90.4	Very high	135 Å²	135	74 Å²	74	51%	0.509	33%	0.332	S	S	.	.	H	α-helix	trans	-62	-41.2	174.7	-69.2	-179	-170.9	-170.3	2.4	111.8	E39 Q40 V46 N47 A62	E39-R43 WeakPolarHBondContact O-CG 3.47Å; E39-R43 PolarHBondContact O-N 3.4Å; Q40-R43 PolarHBondContact O-N 3.36Å; Q40-R43 VanDerWaalsContact O-N 3.16Å; R43-V46 PolarHBondContact O-N 3.39Å; R43-N47 WeakPolarHBondContact O-CB 3.21Å; R43-N47 VanDerWaalsContact O-CG 3.24Å; R43-N47 PolarHBondContact O-N 2.92Å; R43-N47 PolarHBondContact O-ND2 3.35Å; R43-A62 HydrophobicContact CG-CB 4.02Å
44	E	93.9	Very high	89.2	Confident	99 Å²	99	76 Å²	76	46%	0.463	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-44.2	174.9	-73	175.5	-166.7	0	0	111.9	Q40 M41 F42 V46 N47 Q48	Q40-E44 WeakPolarHBondContact O-CG 3.29Å; Q40-E44 PolarHBondContact O-N 2.91Å; M41-E44 PolarHBondContact O-N 3.24Å; F42-E44 VanDerWaalsContact C-N 3.32Å; F42-E44 PolarHBondContact O-N 3.3Å; E44-V46 PolarHBondContact O-N 2.68Å; E44-N47 PolarHBondContact O-N 3.1Å; E44-Q48 WeakPolarHBondContact O-CG 3.45Å; E44-Q48 PolarHBondContact O-N 3.5Å
45	A	93.1	Very high	88.2	Confident	10 Å²	10	77.4 Å²	77.4	8%	0.083	36%	0.362	C	S	.	.	H	α-helix	trans	-61.5	-41.5	176.2	0	0	0	0	0	112	M41 F42 Q48 A49 I302 V306	M41-A45 WeakPolarHBondContact O-CB 3.34Å; M41-A45 PolarHBondContact O-N 2.93Å; F42-A45 PolarHBondContact O-N 3.44Å; A45-Q48 PolarHBondContact O-N 2.81Å; A45-A49 WeakPolarHBondContact O-CB 3.27Å; A45-A49 PolarHBondContact O-N 3.25Å; A45-I302 HydrophobicContact CB-CG2 4.31Å; A45-V306 HydrophobicContact CB-CB 4.21Å; A45-V306 HydrophobicContact CB-CG1 4.3Å; A45-V306 HydrophobicContact CB-CG2 4.19Å
46	V	93.4	Very high	87	Confident	1 Å²	1	83.6 Å²	83.6	1%	0.006	38%	0.38	C	S	.	.	H	α-helix	trans	-65.9	-40	175.4	174.4	0	0	0	0	111.2	F42 R43 E44 Q48 A49 N50 L60 A62 V306	F42-V46 HydrophobicContact CD2-CG2 4.26Å; F42-V46 HydrophobicContact CE2-CG2 3.84Å; F42-V46 HydrophobicContact CZ-CG2 4Å; F42-V46 WeakPolarHBondContact O-CG2 3.49Å; F42-V46 PolarHBondContact O-N 3.1Å; R43-V46 PolarHBondContact O-N 3.39Å; E44-V46 PolarHBondContact O-N 2.68Å; V46-Q48 VanDerWaalsContact C-N 3.33Å; V46-Q48 PolarHBondContact O-N 3.46Å; V46-A49 PolarHBondContact O-N 3.4Å; V46-N50 PolarHBondContact O-N 3.36Å; V46-L60 HydrophobicContact CG1-CB 3.78Å; V46-A62 HydrophobicContact CB-CB 4.08Å; V46-A62 HydrophobicContact CG1-CB 4.16Å; V46-A62 HydrophobicContact CG2-CB 3.99Å; V46-V306 HydrophobicContact CB-CG1 4.42Å; V46-V306 HydrophobicContact CG2-CG1 3.77Å; V46-V306 HydrophobicContact CG2-CG2 4.15Å
47	N	91.8	Very high	86.2	Confident	95 Å²	95	80.2 Å²	80.2	51%	0.508	37%	0.371	S	S	.	.	H	α-helix	trans	-64.8	-36.8	174.5	-72.9	-26.3	0	0	0	112.4	R43 E44 N50 K51	R43-N47 WeakPolarHBondContact O-CB 3.21Å; R43-N47 VanDerWaalsContact O-CG 3.24Å; R43-N47 PolarHBondContact O-N 2.92Å; R43-N47 PolarHBondContact O-ND2 3.35Å; E44-N47 PolarHBondContact O-N 3.1Å; N47-N50 PolarHBondContact O-N 3.38Å; N47-K51 WeakPolarHBondContact O-CG 3.4Å; N47-K51 PolarHBondContact O-N 3.03Å; N47-K51 VanDerWaalsContact O-N 3.13Å
48	Q	90.1	Very high	85.7	Confident	93 Å²	93	74 Å²	74	44%	0.435	34%	0.344	S	S	.	.	H	α-helix	trans	-67.7	-40.4	172.7	-71.7	178.4	22.1	0	0	111.6	E44 A45 V46 N50 K51 R52	E44-Q48 WeakPolarHBondContact O-CG 3.45Å; E44-Q48 PolarHBondContact O-N 3.5Å; A45-Q48 PolarHBondContact O-N 2.81Å; V46-Q48 VanDerWaalsContact C-N 3.33Å; V46-Q48 PolarHBondContact O-N 3.46Å; Q48-N50 VanDerWaalsContact C-N 3.34Å; Q48-N50 PolarHBondContact O-N 2.95Å; Q48-K51 WeakPolarHBondContact O-CB 3.37Å; Q48-K51 PolarHBondContact O-N 3.42Å; Q48-K51 VanDerWaalsContact O-N 3.13Å; Q48-R52 PolarHBondContact O-N 3.35Å; Q48-R52 VanDerWaalsContact O-N 3.07Å
49	A	89	Confident	85.5	Confident	6 Å²	6	76.9 Å²	76.9	5%	0.05	36%	0.358	C	S	.	.	H	α-helix	trans	-63	-39.8	174.7	0	0	0	0	0	111.8	A45 V46 K51 R52 H53 L60 V306 A310	A45-A49 WeakPolarHBondContact O-CB 3.27Å; A45-A49 PolarHBondContact O-N 3.25Å; V46-A49 PolarHBondContact O-N 3.4Å; A49-K51 VanDerWaalsContact C-N 3.3Å; A49-K51 PolarHBondContact O-N 3.47Å; A49-R52 PolarHBondContact O-N 2.78Å; A49-H53 PolarHBondContact O-N 3.18Å; A49-L60 HydrophobicContact CB-CD1 4.04Å; A49-V306 HydrophobicContact CB-CG1 3.9Å; A49-A310 HydrophobicContact CB-CB 3.81Å
50	N	89.4	Confident	85.4	Confident	28 Å²	28	76.1 Å²	76.1	15%	0.15	35%	0.354	C	S	.	.	H	α-helix	trans	-61	-36.3	171.4	-81.2	-27.9	0	0	0	112.8	V46 N47 Q48 R52 G54 L60	V46-N50 PolarHBondContact O-N 3.36Å; N47-N50 PolarHBondContact O-N 3.38Å; Q48-N50 VanDerWaalsContact C-N 3.34Å; Q48-N50 PolarHBondContact O-N 2.95Å; N50-R52 VanDerWaalsContact C-N 3.34Å; N50-G54 WeakPolarHBondContact O-CA 3.38Å; N50-G54 PolarHBondContact O-N 2.96Å; N50-L60 PolarHBondContact ND2-O 2.92Å; N50-L60 WeakPolarHBondContact OD1-CA 3.33Å; N50-L60 WeakPolarHBondContact OD1-CB 3.37Å; N50-L60 WeakPolarHBondContact OD1-CG 3.44Å; N50-L60 PolarHBondContact OD1-N 3.39Å
51	K	86.3	Confident	85.5	Confident	185 Å²	185	73.6 Å²	73.6	80%	0.804	35%	0.345	S	S	*	.	H	α-helix	trans	-69.4	-32.2	175.5	-71.7	174.7	-178.5	-177.9	0	112.8	N47 Q48 A49	N47-K51 WeakPolarHBondContact O-CG 3.4Å; N47-K51 PolarHBondContact O-N 3.03Å; N47-K51 VanDerWaalsContact O-N 3.13Å; Q48-K51 WeakPolarHBondContact O-CB 3.37Å; Q48-K51 PolarHBondContact O-N 3.42Å; Q48-K51 VanDerWaalsContact O-N 3.13Å; A49-K51 VanDerWaalsContact C-N 3.3Å; A49-K51 PolarHBondContact O-N 3.47Å
52	R	83.3	Confident	85.5	Confident	170 Å²	170	71 Å²	71	64%	0.642	34%	0.335	S	S	*	.	H	α-helix	trans	-87.6	-43.9	-177.6	-70.6	-174.5	-176.1	177	2.6	113.7	Q48 A49 N50	Q48-R52 PolarHBondContact O-N 3.35Å; Q48-R52 VanDerWaalsContact O-N 3.07Å; A49-R52 PolarHBondContact O-N 2.78Å; N50-R52 VanDerWaalsContact C-N 3.34Å
53	H	75.8	Confident	85.4	Confident	61 Å²	61	72.2 Å²	72.2	28%	0.282	34%	0.342	S	S	.	.	H	α-helix	trans	-115.9	-5	-172.3	-63	-72	0	0	0	113.2	A49	A49-H53 PolarHBondContact O-N 3.18Å
54	G	67.2	Low	85.4	Confident	41 Å²	41	66.9 Å²	66.9	42%	0.423	33%	0.325	S	S	.	.			trans	-66.7	135.1	178.1	0	0	0	0	0	111.1	N50	N50-G54 WeakPolarHBondContact O-CA 3.38Å; N50-G54 PolarHBondContact O-N 2.96Å
55	S	65.9	Low	85.4	Confident	45 Å²	45	62.8 Å²	62.8	32%	0.315	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-122.1	160.8	175.6	164.6	0	0	0	0	107.9	K57 I58	S55-K57 PolarHBondContact O-N 3.14Å; S55-K57 PolarHBondContact OG-N 2.76Å; S55-I58 PolarHBondContact N-O 2.95Å; S55-I58 PolarHBondContact O-N 3.33Å; S55-I58 VanDerWaalsContact O-N 3.09Å; S55-I58 VanDerWaalsContact O-O 3.05Å
56	W	66.1	Low	85.2	Confident	181 Å²	181	64.1 Å²	64.1	69%	0.686	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-15.7	170	62.6	-85.8	0	0	0	113.2	C22	C22-W56 HydrophobicContact CB-CZ3 4.46Å
57	K	71.9	Confident	84.9	Confident	123 Å²	123	65.4 Å²	65.4	54%	0.535	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-26.2	177.1	-62.9	-174.2	-179.3	-179.9	0	115.2	K25 S55	K25-K57 PolarHBondContact N-O 3.18Å; S55-K57 PolarHBondContact O-N 3.14Å; S55-K57 PolarHBondContact OG-N 2.76Å
58	I	82.8	Confident	84.6	Confident	19 Å²	19	65.1 Å²	65.1	10%	0.097	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	128.8	-167.9	-53.6	167.3	0	0	0	110.3	V27 S55 V313 L317	V27-I58 HydrophobicContact CG2-CG2 4.07Å; S55-I58 PolarHBondContact N-O 2.95Å; S55-I58 PolarHBondContact O-N 3.33Å; S55-I58 VanDerWaalsContact O-N 3.09Å; S55-I58 VanDerWaalsContact O-O 3.05Å; I58-V313 HydrophobicContact CG2-CG1 4.37Å; I58-L317 HydrophobicContact CD1-CB 3.61Å; I58-L317 HydrophobicContact CD1-CD2 3.6Å; I58-L317 HydrophobicContact CD1-CG 4.19Å; I58-L317 HydrophobicContact CG1-CD2 3.72Å; I58-L317 HydrophobicContact CG2-CD2 4.25Å
59	Q	88.1	Confident	84.1	Confident	98 Å²	98	67 Å²	67	46%	0.458	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.7	174.2	-170.3	171.6	-0	0	0	110.3	P24 K25 I26 V27	P24-Q59 HydrophobicContact CB-CB 4.3Å; K25-Q59 PolarHBondContact O-N 3.24Å; I26-Q59 CarbonylContact C-O 3.57Å; I26-Q59 WeakPolarHBondContact CA-O 3.42Å; V27-Q59 PolarHBondContact N-O 3.43Å
60	L	90.5	Very high	83.9	Confident	10 Å²	10	70.2 Å²	70.2	5%	0.052	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	139.1	175.7	-52.8	171.5	0	0	0	109.6	V27 I29 V46 A49 N50 A310 V313	V27-L60 HydrophobicContact CB-CD2 4.05Å; V27-L60 HydrophobicContact CG1-CD2 4.22Å; V27-L60 CarbonylContact O-C 3.57Å; V27-L60 WeakPolarHBondContact O-CA 3.39Å; I29-L60 HydrophobicContact CD1-CB 4.48Å; I29-L60 HydrophobicContact CD1-CD1 4.41Å; I29-L60 HydrophobicContact CD1-CD2 4.29Å; V46-L60 HydrophobicContact CG1-CB 3.78Å; A49-L60 HydrophobicContact CB-CD1 4.04Å; N50-L60 PolarHBondContact ND2-O 2.92Å; N50-L60 WeakPolarHBondContact OD1-CA 3.33Å; N50-L60 WeakPolarHBondContact OD1-CB 3.37Å; N50-L60 WeakPolarHBondContact OD1-CG 3.44Å; N50-L60 PolarHBondContact OD1-N 3.39Å; L60-A310 HydrophobicContact CD1-CB 3.66Å; L60-V313 HydrophobicContact CD2-CB 4.45Å; L60-V313 HydrophobicContact CD2-CG1 4Å
61	N	93.1	Very high	83.7	Confident	75 Å²	75	71.5 Å²	71.5	40%	0.401	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	150.5	174.2	-178.1	37.1	0	0	0	110.1	I26 V27 N28 I29	I26-N61 HydrophobicContact CG2-CB 3.7Å; V27-N61 PolarHBondContact O-N 3.41Å; N28-N61 CarbonylContact C-O 3.6Å; N28-N61 WeakPolarHBondContact CA-O 3.37Å; N28-N61 VanDerWaalsContact OD1-CB 3.3Å; N28-N61 WeakPolarHBondContact OD1-CB 3.35Å; N28-N61 PolarHBondContact OD1-ND2 3.16Å; I29-N61 PolarHBondContact N-O 3.16Å
62	A	94.2	Very high	83.8	Confident	16 Å²	16	68.2 Å²	68.2	13%	0.132	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.5	-170.5	0	0	0	0	0	111.2	F42 R43 V46	F42-A62 HydrophobicContact CD1-CB 4.19Å; F42-A62 HydrophobicContact CE1-CB 3.7Å; F42-A62 HydrophobicContact CZ-CB 4.28Å; R43-A62 HydrophobicContact CG-CB 4.02Å; V46-A62 HydrophobicContact CB-CB 4.08Å; V46-A62 HydrophobicContact CG1-CB 4.16Å; V46-A62 HydrophobicContact CG2-CB 3.99Å
63	T	94.1	Very high	84.1	Confident	25 Å²	25	65.1 Å²	65.1	15%	0.153	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.2	169.6	56.1	0	0	0	0	109.3	I29 G30 A31 V87	I29-T63 PolarHBondContact O-N 2.56Å; I29-T63 PolarHBondContact O-OG1 3.35Å; G30-T63 CarbonylContact C-O 3.5Å; G30-T63 VanDerWaalsContact CA-O 3.24Å; G30-T63 WeakPolarHBondContact CA-O 3.15Å; A31-T63 PolarHBondContact N-O 3.43Å; T63-V87 WeakPolarHBondContact OG1-CG1 3.45Å
64	S	94.2	Very high	84.8	Confident	23 Å²	23	62.3 Å²	62.3	16%	0.161	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	150.1	-175.2	65.3	0	0	0	0	112.3	A31 E39	A31-S64 CarbonylContact O-C 3.58Å; A31-S64 VanDerWaalsContact O-CA 3.22Å; A31-S64 WeakPolarHBondContact O-CA 3.38Å; E39-S64 WeakPolarHBondContact CG-OG 3.46Å
65	V	93.1	Very high	85.9	Confident	14 Å²	14	61.5 Å²	61.5	9%	0.085	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	144.1	178	173.7	0	0	0	0	109	A31 V32 L33 M74 S77 D81 L82	A31-V65 PolarHBondContact O-N 2.86Å; V32-V65 VanDerWaalsContact CA-O 3.32Å; V32-V65 WeakPolarHBondContact CA-O 3.43Å; L33-V65 PolarHBondContact N-O 3.34Å; V65-M74 HydrophobicContact CG1-CE 4.11Å; V65-S77 VanDerWaalsContact CG1-OG 3.23Å; V65-S77 WeakPolarHBondContact CG1-OG 3.48Å; V65-D81 HydrophobicContact CG2-CB 3.66Å; V65-L82 HydrophobicContact CG2-CD2 4.01Å; V65-L82 HydrophobicContact CG2-CG 4.15Å
66	T	89.1	Confident	87.1	Confident	37 Å²	37	63.8 Å²	63.8	23%	0.227	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	144.3	171.6	44.3	0	0	0	0	111.5	L33 R36 E39 K68	L33-T66 WeakPolarHBondContact O-CA 3.48Å; R36-T66 HydrophobicContact CG-CG2 3.89Å; E39-T66 VanDerWaalsContact OE1-CG2 3.26Å; E39-T66 WeakPolarHBondContact OE1-CG2 3.43Å; E39-T66 PolarHBondContact OE1-N 3.5Å; E39-T66 VanDerWaalsContact OE1-N 3.14Å; T66-K68 PolarHBondContact O-N 3.31Å
67	H	86.4	Confident	88.3	Confident	29 Å²	29	55.6 Å²	55.6	13%	0.134	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-50.7	136.9	177.8	-97.4	-69.5	0	0	0	113.5	L33 S93 P95	L33-H67 PolarHBondContact O-N 2.8Å; L33-H67 VanDerWaalsContact O-N 3.09Å; H67-S93 PolarHBondContact NE2-O 3.31Å; H67-P95 HydrophobicContact CB-CB 4.2Å
68	K	85.9	Confident	89.3	Confident	89 Å²	89	49.7 Å²	49.7	39%	0.387	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-102.5	144.1	172.9	-57.3	-59.6	-177.2	179.5	0	109.8	T66 N70 Q73 M74	T66-K68 PolarHBondContact O-N 3.31Å; K68-N70 VanDerWaalsContact C-N 3.32Å; K68-N70 PolarHBondContact O-N 3.27Å; K68-Q73 HydrophobicContact CB-CB 4.21Å; K68-M74 HydrophobicContact CB-CB 4.41Å; K68-M74 HydrophobicContact CB-SD 4.37Å; K68-M74 HydrophobicContact CG-SD 4.34Å
69	P	80	Confident	89.8	Confident	132 Å²	132	50.1 Å²	50.1	86%	0.857	28%	0.282	S	S	*	.	S	Bend	trans	-67.6	-30.9	-178.2	26.3	-34.1	0	0	0	113
70	N	84.2	Confident	89.9	Confident	74 Å²	74	51.7 Å²	51.7	40%	0.396	29%	0.289	S	S	.	.	S	Bend	trans	-96	126.3	177.7	-175.2	-13.9	0	0	0	110.7	K68 I72 Q73 M74	K68-N70 VanDerWaalsContact C-N 3.32Å; K68-N70 PolarHBondContact O-N 3.27Å; N70-I72 VanDerWaalsContact C-N 3.25Å; N70-I72 PolarHBondContact O-N 3.43Å; N70-I72 PolarHBondContact OD1-N 3.06Å; N70-Q73 HydrophobicContact CB-CB 4.22Å; N70-Q73 HydrophobicContact CB-CG 4.05Å; N70-Q73 PolarHBondContact O-N 2.86Å; N70-Q73 VanDerWaalsContact O-N 3.15Å; N70-M74 PolarHBondContact O-N 3.4Å
71	A	85.9	Confident	90	Very high	54 Å²	54	54.9 Å²	54.9	45%	0.446	31%	0.307	S	S	.	.	H	α-helix	trans	-57.5	-34.5	178.9	0	0	0	0	0	113.5	M74 A75 P106	A71-M74 WeakPolarHBondContact O-CB 3.26Å; A71-M74 PolarHBondContact O-N 3.11Å; A71-A75 PolarHBondContact O-N 3.16Å; A71-P106 HydrophobicContact CB-CB 4.34Å; A71-P106 HydrophobicContact CB-CG 3.99Å
72	I	87.4	Confident	90	Very high	117 Å²	117	51.4 Å²	51.4	60%	0.6	29%	0.288	S	S	*	.	H	α-helix	trans	-67.6	-45.4	178	-60.9	172.5	0	0	0	110.2	N70 M74 A75 L76	N70-I72 VanDerWaalsContact C-N 3.25Å; N70-I72 PolarHBondContact O-N 3.43Å; N70-I72 PolarHBondContact OD1-N 3.06Å; I72-M74 PolarHBondContact O-N 2.91Å; I72-A75 PolarHBondContact O-N 3.21Å; I72-L76 HydrophobicContact CG2-CD1 4.31Å; I72-L76 WeakPolarHBondContact O-CG 3.41Å; I72-L76 PolarHBondContact O-N 3.24Å
73	Q	89.2	Confident	89.9	Confident	104 Å²	104	50.7 Å²	50.7	49%	0.486	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-35.1	176	-68.4	179.1	-13.8	0	0	111.3	K68 N70 L76 S77	K68-Q73 HydrophobicContact CB-CB 4.21Å; N70-Q73 HydrophobicContact CB-CB 4.22Å; N70-Q73 HydrophobicContact CB-CG 4.05Å; N70-Q73 PolarHBondContact O-N 2.86Å; N70-Q73 VanDerWaalsContact O-N 3.15Å; Q73-L76 PolarHBondContact O-N 2.88Å; Q73-S77 WeakPolarHBondContact O-CB 3.45Å; Q73-S77 PolarHBondContact O-N 3.32Å
74	M	90.5	Very high	89.8	Confident	2 Å²	2	52 Å²	52	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-45.4	174.1	-167.7	64.5	-113.1	0	0	111.4	V32 V65 K68 N70 A71 I72 L76 S77 V78 P106 V107	V32-M74 HydrophobicContact CB-CE 4.22Å; V32-M74 HydrophobicContact CG1-CE 3.47Å; V32-M74 VanDerWaalsContact CG1-CE 3.47Å; V32-M74 HydrophobicContact CG1-SD 3.67Å; V32-M74 HydrophobicContact CG2-CE 3.62Å; V65-M74 HydrophobicContact CG1-CE 4.11Å; K68-M74 HydrophobicContact CB-CB 4.41Å; K68-M74 HydrophobicContact CB-SD 4.37Å; K68-M74 HydrophobicContact CG-SD 4.34Å; N70-M74 PolarHBondContact O-N 3.4Å; A71-M74 WeakPolarHBondContact O-CB 3.26Å; A71-M74 PolarHBondContact O-N 3.11Å; I72-M74 PolarHBondContact O-N 2.91Å; M74-L76 VanDerWaalsContact C-N 3.35Å; M74-L76 PolarHBondContact O-N 3.27Å; M74-S77 PolarHBondContact O-N 3.21Å; M74-V78 HydrophobicContact CE-CG2 3.71Å; M74-V78 VanDerWaalsContact O-CG2 3.3Å; M74-V78 WeakPolarHBondContact O-CG2 3.49Å; M74-V78 PolarHBondContact O-N 3.38Å; M74-P106 HydrophobicContact CB-CG 4.36Å; M74-P106 HydrophobicContact CG-CG 4.43Å; M74-V107 HydrophobicContact CG-CG2 4.01Å
75	A	91.1	Very high	89.7	Confident	25 Å²	25	52.7 Å²	52.7	21%	0.207	30%	0.297	C	S	.	.	H	α-helix	trans	-61.8	-41.3	176.8	0	0	0	0	0	112.5	A71 I72 V78 C79 P106	A71-A75 PolarHBondContact O-N 3.16Å; I72-A75 PolarHBondContact O-N 3.21Å; A75-V78 PolarHBondContact O-N 3.46Å; A75-C79 PolarHBondContact O-N 3.07Å; A75-C79 VanDerWaalsContact O-N 3.14Å; A75-P106 HydrophobicContact CB-CB 4.22Å
76	L	91.3	Very high	89.6	Confident	92 Å²	92	53.8 Å²	53.8	48%	0.482	30%	0.301	S	S	.	.	H	α-helix	trans	-63.4	-47.3	175.9	-71.4	171.5	0	0	0	111.7	I72 Q73 M74 V78 C79 E80	I72-L76 HydrophobicContact CG2-CD1 4.31Å; I72-L76 WeakPolarHBondContact O-CG 3.41Å; I72-L76 PolarHBondContact O-N 3.24Å; Q73-L76 PolarHBondContact O-N 2.88Å; M74-L76 VanDerWaalsContact C-N 3.35Å; M74-L76 PolarHBondContact O-N 3.27Å; L76-V78 VanDerWaalsContact C-N 3.31Å; L76-V78 PolarHBondContact O-N 3.43Å; L76-C79 WeakPolarHBondContact O-CA 3.24Å; L76-C79 WeakPolarHBondContact O-CB 3.25Å; L76-C79 PolarHBondContact O-N 2.9Å; L76-E80 PolarHBondContact O-N 3.49Å
77	S	91.7	Very high	89.9	Confident	9 Å²	9	52 Å²	52	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-63.8	-34.4	178.1	-177.5	0	0	0	0	112.3	V65 Q73 M74 C79 D81	V65-S77 VanDerWaalsContact CG1-OG 3.23Å; V65-S77 WeakPolarHBondContact CG1-OG 3.48Å; Q73-S77 WeakPolarHBondContact O-CB 3.45Å; Q73-S77 PolarHBondContact O-N 3.32Å; M74-S77 PolarHBondContact O-N 3.21Å; S77-C79 VanDerWaalsContact C-N 3.32Å; S77-C79 PolarHBondContact O-N 3.16Å; S77-D81 WeakPolarHBondContact O-CA 3.47Å; S77-D81 WeakPolarHBondContact O-CB 3Å; S77-D81 PolarHBondContact O-N 3.09Å; S77-D81 PolarHBondContact OG-OD2 3.14Å
78	V	92.7	Very high	90.2	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.285	C	S	.	.	I	π-helix	trans	-61.6	-41.4	170.1	172.3	0	0	0	0	111.2	V32 M74 A75 L76 L82 I83 I90 V107 T110	V32-V78 HydrophobicContact CG2-CG2 4.28Å; M74-V78 HydrophobicContact CE-CG2 3.71Å; M74-V78 VanDerWaalsContact O-CG2 3.3Å; M74-V78 WeakPolarHBondContact O-CG2 3.49Å; M74-V78 PolarHBondContact O-N 3.38Å; A75-V78 PolarHBondContact O-N 3.46Å; L76-V78 VanDerWaalsContact C-N 3.31Å; L76-V78 PolarHBondContact O-N 3.43Å; V78-L82 HydrophobicContact CG1-CD1 4.48Å; V78-L82 HydrophobicContact CG2-CD1 4.26Å; V78-L82 WeakPolarHBondContact O-CB 3.45Å; V78-L82 PolarHBondContact O-N 3.03Å; V78-I83 HydrophobicContact CG1-CD1 4.1Å; V78-I83 HydrophobicContact CG1-CG1 4.33Å; V78-I83 WeakPolarHBondContact O-CG1 3.46Å; V78-I83 PolarHBondContact O-N 3.45Å; V78-I90 HydrophobicContact CG1-CD1 4.01Å; V78-V107 HydrophobicContact CG2-CB 4.4Å; V78-V107 HydrophobicContact CG2-CG1 4.09Å; V78-V107 HydrophobicContact CG2-CG2 3.97Å; V78-T110 HydrophobicContact CB-CG2 4.43Å; V78-T110 HydrophobicContact CG1-CG2 3.98Å
79	C	92	Very high	90.6	Very high	27 Å²	27	46.8 Å²	46.8	18%	0.182	27%	0.267	C	S	.	.	I	π-helix	trans	-68.7	-46.6	178.2	-93.9	0	0	0	0	113.4	A75 L76 S77 S84 T110 C329	A75-C79 PolarHBondContact O-N 3.07Å; A75-C79 VanDerWaalsContact O-N 3.14Å; L76-C79 WeakPolarHBondContact O-CA 3.24Å; L76-C79 WeakPolarHBondContact O-CB 3.25Å; L76-C79 PolarHBondContact O-N 2.9Å; S77-C79 VanDerWaalsContact C-N 3.32Å; S77-C79 PolarHBondContact O-N 3.16Å; C79-S84 PolarHBondContact O-N 2.83Å; C79-T110 VanDerWaalsContact SG-CG2 3.57Å; C79-C329 WeakPolarHBondContact CA-SG 3.44Å; C79-C329 HydrophobicContact CB-CB 3.78Å; C79-C329 WeakPolarHBondContact CB-SG 3.27Å; C79-C329 WeakPolarHBondContact SG-CB 3.48Å; C79-C329 CovalentContact SG-SG 2.05Å; C79-C329 PolarHBondContact SG-SG 2.88Å
80	E	91.6	Very high	91.3	Very high	131 Å²	131	40.5 Å²	40.5	61%	0.612	23%	0.226	S	C	*	.	I	π-helix	trans	-82.2	-36.9	-172.8	-69.9	177.5	177.6	0	0	113.2	L76 S84	L76-E80 PolarHBondContact O-N 3.49Å; E80-S84 WeakPolarHBondContact O-CB 3.4Å; E80-S84 PolarHBondContact O-OG 2.93Å
81	D	91.7	Very high	91.9	Very high	78 Å²	78	37 Å²	37	42%	0.417	21%	0.207	S	C	.	.	I	π-helix	trans	-101	-36.6	-173.2	-56.1	-47.6	0	0	0	112.6	V65 S77 S85	V65-D81 HydrophobicContact CG2-CB 3.66Å; S77-D81 WeakPolarHBondContact O-CA 3.47Å; S77-D81 WeakPolarHBondContact O-CB 3Å; S77-D81 PolarHBondContact O-N 3.09Å; S77-D81 PolarHBondContact OG-OD2 3.14Å; D81-S85 PolarHBondContact O-OG 2.88Å
82	L	92.9	Very high	92.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	19%	0.186	C	C	.	.	I	π-helix	trans	-95.4	-56.3	-177.4	-59.2	180	0	0	0	112.4	V32 V65 V78 S84 S85 V87 I90	V32-L82 HydrophobicContact CG2-CD1 3.75Å; V65-L82 HydrophobicContact CG2-CD2 4.01Å; V65-L82 HydrophobicContact CG2-CG 4.15Å; V78-L82 HydrophobicContact CG1-CD1 4.48Å; V78-L82 HydrophobicContact CG2-CD1 4.26Å; V78-L82 WeakPolarHBondContact O-CB 3.45Å; V78-L82 PolarHBondContact O-N 3.03Å; L82-S84 VanDerWaalsContact C-N 3.33Å; L82-S84 PolarHBondContact O-N 2.85Å; L82-S85 WeakPolarHBondContact O-CB 3.45Å; L82-S85 PolarHBondContact O-N 3.24Å; L82-S85 VanDerWaalsContact O-N 3.07Å; L82-V87 HydrophobicContact CB-CG1 4.37Å; L82-V87 HydrophobicContact CB-CG2 4.21Å; L82-V87 VanDerWaalsContact O-CG1 3.3Å; L82-V87 WeakPolarHBondContact O-CG1 3.46Å; L82-I90 HydrophobicContact CD1-CD1 4.33Å; L82-I90 HydrophobicContact CD1-CG2 4.05Å
83	I	92.4	Very high	92.3	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-68.8	-32.3	-175	-63.4	172.8	0	0	0	111.5	V78 S85 Q86 T110 Y114 I116 P326 G328	V78-I83 HydrophobicContact CG1-CD1 4.1Å; V78-I83 HydrophobicContact CG1-CG1 4.33Å; V78-I83 WeakPolarHBondContact O-CG1 3.46Å; V78-I83 PolarHBondContact O-N 3.45Å; I83-S85 PolarHBondContact O-N 2.77Å; I83-Q86 PolarHBondContact O-N 2.92Å; I83-T110 HydrophobicContact CD1-CG2 3.96Å; I83-Y114 HydrophobicContact CD1-CD2 4.08Å; I83-Y114 HydrophobicContact CD1-CE2 4.3Å; I83-I116 HydrophobicContact CG1-CD1 4.34Å; I83-P326 HydrophobicContact CG2-CG 4.35Å; I83-P326 VanDerWaalsContact O-O 3.06Å; I83-G328 PolarHBondContact O-N 2.99Å
84	S	91.8	Very high	92	Very high	53 Å²	53	26.1 Å²	26.1	37%	0.371	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-55.8	-33.4	171.1	65.1	0	0	0	0	112.8	C79 E80 L82 Q86	C79-S84 PolarHBondContact O-N 2.83Å; E80-S84 WeakPolarHBondContact O-CB 3.4Å; E80-S84 PolarHBondContact O-OG 2.93Å; L82-S84 VanDerWaalsContact C-N 3.33Å; L82-S84 PolarHBondContact O-N 2.85Å; S84-Q86 VanDerWaalsContact C-N 3.27Å; S84-Q86 PolarHBondContact O-N 2.83Å
85	S	91.8	Very high	91.6	Very high	38 Å²	38	27 Å²	27	27%	0.266	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-83.4	9.4	178.1	-59.6	0	0	0	0	113.5	N28 D81 L82 I83 V87	N28-S85 WeakPolarHBondContact CB-O 3.49Å; N28-S85 PolarHBondContact ND2-O 3.07Å; D81-S85 PolarHBondContact O-OG 2.88Å; L82-S85 WeakPolarHBondContact O-CB 3.45Å; L82-S85 PolarHBondContact O-N 3.24Å; L82-S85 VanDerWaalsContact O-N 3.07Å; I83-S85 PolarHBondContact O-N 2.77Å; S85-V87 PolarHBondContact O-N 2.9Å
86	Q	92.1	Very high	90.7	Very high	36 Å²	36	30 Å²	30	17%	0.168	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	51.4	178.5	-56.8	-169	-87.1	0	0	113.3	I83 S84 P325 R327	I83-Q86 PolarHBondContact O-N 2.92Å; S84-Q86 VanDerWaalsContact C-N 3.27Å; S84-Q86 PolarHBondContact O-N 2.83Å; Q86-P325 HydrophobicContact CB-CG 3.97Å; Q86-P325 PolarHBondContact NE2-O 2.88Å; Q86-P325 WeakPolarHBondContact O-CG 3.41Å; Q86-R327 VanDerWaalsContact CD-NE 3.32Å; Q86-R327 HydrophobicContact CG-CB 4.48Å; Q86-R327 HydrophobicContact CG-CG 3.54Å; Q86-R327 VanDerWaalsContact NE2-CG 3.32Å
87	V	94.3	Very high	89.7	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	135.9	179.3	-68	0	0	0	0	112.6	N28 T63 L82 S85 I90	N28-V87 HydrophobicContact CB-CG1 4.28Å; N28-V87 CarbonylContact O-C 3.57Å; N28-V87 WeakPolarHBondContact O-CA 3.36Å; T63-V87 WeakPolarHBondContact OG1-CG1 3.45Å; L82-V87 HydrophobicContact CB-CG1 4.37Å; L82-V87 HydrophobicContact CB-CG2 4.21Å; L82-V87 VanDerWaalsContact O-CG1 3.3Å; L82-V87 WeakPolarHBondContact O-CG1 3.46Å; S85-V87 PolarHBondContact O-N 2.9Å; V87-I90 HydrophobicContact CG2-CD1 4.02Å; V87-I90 HydrophobicContact CG2-CG1 3.85Å
88	Y	92.7	Very high	88.2	Confident	7 Å²	7	34.8 Å²	34.8	3%	0.027	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-31	178.9	-79.7	-108.8	0	0	0	112.9	V27 N28 P117 I322 D324 P325 W336 F342	V27-Y88 HydrophobicContact CG1-CD1 4.34Å; V27-Y88 HydrophobicContact CG1-CD2 3.61Å; V27-Y88 HydrophobicContact CG1-CE2 4.05Å; V27-Y88 HydrophobicContact CG1-CG 3.75Å; N28-Y88 PolarHBondContact O-N 3.04Å; Y88-P117 WeakPolarHBondContact O-CD 3.45Å; Y88-I322 HydrophobicContact CE1-CG2 4.12Å; Y88-D324 PolarHBondContact OH-OD1 3.45Å; Y88-P325 HydrophobicContact CD2-CG 3.98Å; Y88-P325 HydrophobicContact CE2-CG 3.94Å; Y88-P325 HydrophobicContact CG-CG 4.45Å; Y88-W336 AromaticContact CD1-CH2 3.69Å; Y88-W336 HydrophobicContact CD1-CH2 3.69Å; Y88-W336 AromaticContact CD1-CZ2 3.89Å; Y88-W336 HydrophobicContact CD1-CZ2 3.89Å; Y88-W336 HydrophobicContact CE1-CH2 4.23Å; Y88-W336 AromaticContact CE1-CZ2 3.94Å; Y88-W336 HydrophobicContact CE1-CZ2 3.94Å; Y88-W336 HydrophobicContact CG-CH2 4.35Å; Y88-F342 WeakPolarHBondContact O-CE1 3.41Å
89	A	94.9	Very high	86.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	153	173.3	0	0	0	0	0	109.8	G30 P117 L119 V309 F342	G30-A89 PolarHBondContact N-O 3.24Å; A89-P117 WeakPolarHBondContact CA-O 3.3Å; A89-L119 HydrophobicContact CB-CD1 4.37Å; A89-V309 HydrophobicContact CB-CG1 4.31Å; A89-V309 HydrophobicContact CB-CG2 4.33Å; A89-F342 HydrophobicContact CB-CE1 4.09Å
90	I	95.7	Very high	84.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.5	176.8	-56.9	178.3	0	0	0	109.6	G30 V32 V78 L82 V87 V107 A111 I116 P117 V118 L119	G30-I90 CarbonylContact O-C 3.53Å; G30-I90 VanDerWaalsContact O-CA 3.3Å; G30-I90 WeakPolarHBondContact O-CA 3.38Å; V32-I90 HydrophobicContact CG2-CG2 4.37Å; V78-I90 HydrophobicContact CG1-CD1 4.01Å; L82-I90 HydrophobicContact CD1-CD1 4.33Å; L82-I90 HydrophobicContact CD1-CG2 4.05Å; V87-I90 HydrophobicContact CG2-CD1 4.02Å; V87-I90 HydrophobicContact CG2-CG1 3.85Å; I90-V107 HydrophobicContact CG2-CG1 3.89Å; I90-A111 HydrophobicContact CD1-CB 4.09Å; I90-I116 HydrophobicContact CD1-CG2 4.49Å; I90-I116 HydrophobicContact CG1-CG2 4.28Å; I90-P117 PolarHBondContact N-O 3.46Å; I90-V118 HydrophobicContact CB-CG2 4.49Å; I90-V118 CarbonylContact O-C 3.36Å; I90-V118 VanDerWaalsContact O-CA 3.27Å; I90-V118 WeakPolarHBondContact O-CA 3.3Å; I90-L119 PolarHBondContact O-N 3.44Å
91	L	95.4	Very high	83.1	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	137.7	170.1	-73.9	72.9	0	0	0	109.1	I29 G30 A31 V32 F42 L119 L121 A305 V306	I29-L91 HydrophobicContact CG2-CD1 3.6Å; G30-L91 PolarHBondContact O-N 3.42Å; A31-L91 CarbonylContact C-O 3.57Å; A31-L91 VanDerWaalsContact CA-O 3.29Å; A31-L91 WeakPolarHBondContact CA-O 3.5Å; A31-L91 HydrophobicContact CB-CB 4.08Å; V32-L91 PolarHBondContact N-O 3Å; F42-L91 HydrophobicContact CD2-CD2 4.29Å; F42-L91 HydrophobicContact CE2-CD1 4.26Å; F42-L91 HydrophobicContact CE2-CD2 4.08Å; L91-L119 CarbonylContact C-O 3.51Å; L91-L119 WeakPolarHBondContact CA-O 3.32Å; L91-L119 HydrophobicContact CG-CB 4.43Å; L91-L121 HydrophobicContact CB-CD1 4.29Å; L91-L121 HydrophobicContact CD2-CD1 4.44Å; L91-L121 HydrophobicContact CD2-CD2 4.22Å; L91-A305 HydrophobicContact CD2-CB 3.65Å; L91-A305 HydrophobicContact CG-CB 4.3Å; L91-V306 HydrophobicContact CD2-CG2 3.95Å
92	V	92.8	Very high	81.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	126.8	178.4	65.5	0	0	0	0	111.1	V32 P104 V107 V118 L119 G120 L121 F137	V32-V92 HydrophobicContact CB-CG2 4.23Å; V92-P104 HydrophobicContact CG1-CB 4.03Å; V92-P104 HydrophobicContact CG2-CB 3.66Å; V92-V107 HydrophobicContact CG2-CB 4.49Å; V92-V107 HydrophobicContact CG2-CG2 4.24Å; V92-V118 HydrophobicContact CB-CG1 4.42Å; V92-V118 HydrophobicContact CG1-CG1 3.62Å; V92-L119 PolarHBondContact N-O 3.4Å; V92-G120 WeakPolarHBondContact O-CA 3.34Å; V92-L121 PolarHBondContact O-N 3.48Å; V92-F137 HydrophobicContact CG1-CE2 4.13Å; V92-F137 HydrophobicContact CG1-CZ 4.47Å
93	S	89.4	Confident	80.4	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.014	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-103.2	169.5	170.7	59.5	0	0	0	0	110.7	V32 L33 S34 H67	V32-S93 PolarHBondContact O-N 3.04Å; V32-S93 PolarHBondContact O-OG 3.45Å; L33-S93 VanDerWaalsContact CA-OG 3.3Å; L33-S93 WeakPolarHBondContact CA-OG 3.22Å; S34-S93 PolarHBondContact N-OG 3.48Å; S34-S93 VanDerWaalsContact N-OG 3.16Å; H67-S93 PolarHBondContact NE2-O 3.31Å
94	H	83.8	Confident	79.9	Confident	46 Å²	46	47.3 Å²	47.3	21%	0.213	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-81.3	146.6	170.8	-164.4	75.1	0	0	0	109.9	S34 T103 T122	S34-H94 WeakPolarHBondContact CB-O 3.14Å; H94-T103 PolarHBondContact CE1-OG1 3.15Å; H94-T103 PolarHBondContact ND1-OG1 2.82Å; H94-T122 WeakPolarHBondContact CB-OG1 3.23Å; H94-T122 PolarHBondContact N-OG1 3.01Å
95	P	81.4	Confident	79.7	Confident	19 Å²	19	45.9 Å²	45.9	12%	0.123	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-67.4	162.1	176.1	27.6	-34.8	0	0	0	112.4	H67 T97 T103	H67-P95 HydrophobicContact CB-CB 4.2Å; P95-T97 VanDerWaalsContact C-N 3.29Å; P95-T97 PolarHBondContact O-N 2.89Å; P95-T103 WeakPolarHBondContact CD-OG1 3.33Å; P95-T103 HydrophobicContact CG-CG2 3.57Å
96	P	71.6	Confident	79.6	Confident	88 Å²	88	44.9 Å²	44.9	57%	0.571	25%	0.247	S	C	*	.	S	Bend	trans	-64.9	-28.6	-179.7	-18.4	30	0	0	0	114.2	S34 T35	S34-P96 WeakPolarHBondContact O-CG 3.36Å; T35-P96 HydrophobicContact CG2-CG 4.29Å
97	T	70.1	Confident	79.6	Confident	98 Å²	98	43.2 Å²	43.2	60%	0.601	24%	0.239	S	C	*	.	S	Bend	trans	-98.6	115.8	178	51.3	0	0	0	0	109.6	P95 N99	P95-T97 VanDerWaalsContact C-N 3.29Å; P95-T97 PolarHBondContact O-N 2.89Å; T97-N99 PolarHBondContact O-N 3.12Å
98	P	62.1	Low	79.5	Confident	105 Å²	105	43.2 Å²	43.2	68%	0.682	24%	0.239	S	C	*	.			trans	-78.9	35.3	-173.3	32.6	-36	0	0	0	113.3	D100	P98-D100 VanDerWaalsContact C-N 3.26Å; P98-D100 PolarHBondContact O-N 3.22Å
99	N	55.6	Low	79.5	Confident	144 Å²	144	48.5 Å²	48.5	77%	0.77	26%	0.26	S	S	*	.			trans	-78	-5.8	-166.3	-135.1	30.6	0	0	0	114.3	T97	T97-N99 PolarHBondContact O-N 3.12Å
100	D	54.4	Low	79.3	Confident	109 Å²	109	49.8 Å²	49.8	58%	0.583	27%	0.267	S	S	*	.			trans	-151.4	134.5	174.2	-86.2	-46	0	0	0	112.1	P98 F102 T103	P98-D100 VanDerWaalsContact C-N 3.26Å; P98-D100 PolarHBondContact O-N 3.22Å; D100-F102 PolarHBondContact O-N 3.41Å; D100-F102 VanDerWaalsContact O-N 3.16Å; D100-T103 HydrophobicContact CB-CG2 4.18Å; D100-T103 WeakPolarHBondContact O-CG2 2.96Å
101	H	58.3	Low	79.2	Confident	100 Å²	100	49.8 Å²	49.8	46%	0.463	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-3.9	-179.9	-66.3	-54.8	0	0	0	114.4	M125	H101-M125 HydrophobicContact CB-CE 4.23Å
102	F	60.7	Low	79.1	Confident	116 Å²	116	50.2 Å²	50.2	51%	0.509	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	20.5	-170.6	-60	-68.4	0	0	0	115	D100 T105 I127	D100-F102 PolarHBondContact O-N 3.41Å; D100-F102 VanDerWaalsContact O-N 3.16Å; F102-T105 WeakPolarHBondContact O-CB 3.42Å; F102-T105 PolarHBondContact O-N 3.26Å; F102-T105 VanDerWaalsContact O-N 3.13Å; F102-T105 PolarHBondContact O-OG1 2.86Å; F102-I127 HydrophobicContact CE1-CD1 4.35Å
103	T	67.8	Low	79.1	Confident	30 Å²	30	55.5 Å²	55.5	18%	0.184	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-32	-171	50.9	0	0	0	0	116.5	H94 P95 D100	H94-T103 PolarHBondContact CE1-OG1 3.15Å; H94-T103 PolarHBondContact ND1-OG1 2.82Å; P95-T103 WeakPolarHBondContact CD-OG1 3.33Å; P95-T103 HydrophobicContact CG-CG2 3.57Å; D100-T103 HydrophobicContact CB-CG2 4.18Å; D100-T103 WeakPolarHBondContact O-CG2 2.96Å
104	P	82	Confident	79.2	Confident	2 Å²	2	56 Å²	56	1%	0.013	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-3.9	173.9	33	-30.3	0	0	0	114	V92 V107 S108 T123 Y128	V92-P104 HydrophobicContact CG1-CB 4.03Å; V92-P104 HydrophobicContact CG2-CB 3.66Å; P104-V107 PolarHBondContact O-N 2.91Å; P104-S108 PolarHBondContact O-N 3.36Å; P104-S108 VanDerWaalsContact O-N 3.15Å; P104-T123 HydrophobicContact CG-CG2 4.13Å; P104-Y128 WeakPolarHBondContact CD-OH 3.23Å; P104-Y128 HydrophobicContact CG-CE2 4.02Å; P104-Y128 WeakPolarHBondContact CG-OH 3.31Å
105	T	87.4	Confident	79.7	Confident	22 Å²	22	58 Å²	58	14%	0.135	30%	0.303	C	S	.	.	H	α-helix	trans	-54	-49.1	178.3	-58.1	0	0	0	0	114.2	F102 V107 S108 Y109 Y128	F102-T105 WeakPolarHBondContact O-CB 3.42Å; F102-T105 PolarHBondContact O-N 3.26Å; F102-T105 VanDerWaalsContact O-N 3.13Å; F102-T105 PolarHBondContact O-OG1 2.86Å; T105-V107 VanDerWaalsContact C-N 3.31Å; T105-V107 PolarHBondContact O-N 3.18Å; T105-S108 PolarHBondContact O-N 3.39Å; T105-S108 VanDerWaalsContact O-N 3.17Å; T105-Y109 HydrophobicContact CG2-CD2 3.59Å; T105-Y109 HydrophobicContact CG2-CE2 3.22Å; T105-Y109 WeakPolarHBondContact O-CD2 3.37Å; T105-Y109 PolarHBondContact O-N 3.33Å; T105-Y109 VanDerWaalsContact O-N 3.09Å; T105-Y128 PolarHBondContact N-OH 2.61Å; T105-Y128 PolarHBondContact OG1-OH 2.98Å
106	P	90.3	Very high	80.3	Confident	18 Å²	18	57.2 Å²	57.2	12%	0.117	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-39.8	-179.4	22.5	-34.4	0	0	0	112.3	A71 M74 A75 S108 Y109 T110	A71-P106 HydrophobicContact CB-CB 4.34Å; A71-P106 HydrophobicContact CB-CG 3.99Å; M74-P106 HydrophobicContact CB-CG 4.36Å; M74-P106 HydrophobicContact CG-CG 4.43Å; A75-P106 HydrophobicContact CB-CB 4.22Å; P106-S108 VanDerWaalsContact C-N 3.33Å; P106-S108 PolarHBondContact O-N 3.36Å; P106-Y109 PolarHBondContact O-N 3.17Å; P106-T110 PolarHBondContact O-N 2.77Å; P106-T110 PolarHBondContact O-OG1 2.64Å
107	V	91.1	Very high	81.5	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-42.9	177.7	-173.7	0	0	0	0	110.7	V32 M74 V78 I90 V92 P104 T105 Y109 A111	V32-V107 HydrophobicContact CG2-CG1 4.46Å; V32-V107 HydrophobicContact CG2-CG2 4.31Å; M74-V107 HydrophobicContact CG-CG2 4.01Å; V78-V107 HydrophobicContact CG2-CB 4.4Å; V78-V107 HydrophobicContact CG2-CG1 4.09Å; V78-V107 HydrophobicContact CG2-CG2 3.97Å; I90-V107 HydrophobicContact CG2-CG1 3.89Å; V92-V107 HydrophobicContact CG2-CB 4.49Å; V92-V107 HydrophobicContact CG2-CG2 4.24Å; P104-V107 PolarHBondContact O-N 2.91Å; T105-V107 VanDerWaalsContact C-N 3.31Å; T105-V107 PolarHBondContact O-N 3.18Å; V107-Y109 PolarHBondContact O-N 3.22Å; V107-A111 VanDerWaalsContact O-CB 3.27Å; V107-A111 WeakPolarHBondContact O-CB 3.38Å; V107-A111 PolarHBondContact O-N 3.23Å
108	S	92.4	Very high	82.7	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.014	24%	0.241	C	C	.	.	H	α-helix	trans	-63.1	-40.6	178.1	-177.6	0	0	0	0	112.8	P104 T105 P106 G112 H134	P104-S108 PolarHBondContact O-N 3.36Å; P104-S108 VanDerWaalsContact O-N 3.15Å; T105-S108 PolarHBondContact O-N 3.39Å; T105-S108 VanDerWaalsContact O-N 3.17Å; P106-S108 VanDerWaalsContact C-N 3.33Å; P106-S108 PolarHBondContact O-N 3.36Å; S108-G112 WeakPolarHBondContact O-CA 3.44Å; S108-G112 PolarHBondContact O-N 3.34Å; S108-H134 WeakPolarHBondContact CB-ND1 3.16Å; S108-H134 PolarHBondContact OG-ND1 3.13Å
109	Y	92.4	Very high	84.2	Confident	118 Å²	118	43.3 Å²	43.3	46%	0.463	21%	0.209	S	C	.	.	H	α-helix	trans	-71.1	-46.2	179.2	-74.9	-55.4	0	0	0	112	T105 P106 V107 A111 G112 F113 I133 H134	T105-Y109 HydrophobicContact CG2-CD2 3.59Å; T105-Y109 HydrophobicContact CG2-CE2 3.22Å; T105-Y109 WeakPolarHBondContact O-CD2 3.37Å; T105-Y109 PolarHBondContact O-N 3.33Å; T105-Y109 VanDerWaalsContact O-N 3.09Å; P106-Y109 PolarHBondContact O-N 3.17Å; V107-Y109 PolarHBondContact O-N 3.22Å; Y109-A111 PolarHBondContact O-N 3.2Å; Y109-G112 PolarHBondContact O-N 3.29Å; Y109-F113 PolarHBondContact O-N 2.87Å; Y109-I133 HydrophobicContact CE1-CG2 3.88Å; Y109-I133 WeakPolarHBondContact OH-CG2 3.38Å; Y109-H134 AromaticContact CE1-CE1 3.94Å; Y109-H134 AromaticContact CE2-CE1 3.98Å; Y109-H134 AromaticContact CZ-CE1 3.68Å
110	T	91.8	Very high	86	Confident	26 Å²	26	36.5 Å²	36.5	16%	0.16	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-47.1	179.6	-55.9	0	0	0	0	111.6	V78 C79 I83 P106 G112	V78-T110 HydrophobicContact CB-CG2 4.43Å; V78-T110 HydrophobicContact CG1-CG2 3.98Å; C79-T110 VanDerWaalsContact SG-CG2 3.57Å; I83-T110 HydrophobicContact CD1-CG2 3.96Å; P106-T110 PolarHBondContact O-N 2.77Å; P106-T110 PolarHBondContact O-OG1 2.64Å; T110-G112 VanDerWaalsContact C-N 3.35Å
111	A	92.5	Very high	87.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-69.7	-34	176.1	0	0	0	0	0	112.4	I90 V107 Y109 F113 Y114 R115 I116 V118	I90-A111 HydrophobicContact CD1-CB 4.09Å; V107-A111 VanDerWaalsContact O-CB 3.27Å; V107-A111 WeakPolarHBondContact O-CB 3.38Å; V107-A111 PolarHBondContact O-N 3.23Å; Y109-A111 PolarHBondContact O-N 3.2Å; A111-F113 VanDerWaalsContact C-N 3.29Å; A111-F113 PolarHBondContact O-N 2.88Å; A111-Y114 PolarHBondContact O-N 3.26Å; A111-R115 PolarHBondContact O-N 3.23Å; A111-I116 HydrophobicContact CB-CB 4.26Å; A111-I116 PolarHBondContact O-N 3.45Å; A111-V118 HydrophobicContact CB-CG2 3.38Å
112	G	92.8	Very high	89	Confident	9 Å²	9	27.6 Å²	27.6	9%	0.093	13%	0.129	C	C	.	.	H	α-helix	trans	-64.9	-28.5	179.5	0	0	0	0	0	114.2	S108 Y109 T110 R115 S136	S108-G112 WeakPolarHBondContact O-CA 3.44Å; S108-G112 PolarHBondContact O-N 3.34Å; Y109-G112 PolarHBondContact O-N 3.29Å; T110-G112 VanDerWaalsContact C-N 3.35Å; G112-R115 WeakPolarHBondContact O-CD 3.39Å; G112-R115 PolarHBondContact O-N 3.47Å; G112-R115 PolarHBondContact O-NH1 3.45Å; G112-R115 VanDerWaalsContact O-NH1 3.13Å; G112-S136 VanDerWaalsContact CA-OG 3.29Å; G112-S136 WeakPolarHBondContact CA-OG 3.31Å
113	F	92.6	Very high	90.2	Very high	112 Å²	112	22.4 Å²	22.4	49%	0.491	11%	0.107	S	C	.	.	H	α-helix	trans	-59.2	-48.6	172.4	-178	-99.7	0	0	0	111.2	Y109 A111 R115	Y109-F113 PolarHBondContact O-N 2.87Å; A111-F113 VanDerWaalsContact C-N 3.29Å; A111-F113 PolarHBondContact O-N 2.88Å; F113-R115 VanDerWaalsContact C-N 3.31Å; F113-R115 PolarHBondContact O-N 3.24Å
114	Y	92.9	Very high	91.3	Very high	11 Å²	11	21.4 Å²	21.4	4%	0.043	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	0.3	177.5	-63.8	-65.8	0	0	0	114.1	I83 A111 I116 P326 C329 N332 W336	I83-Y114 HydrophobicContact CD1-CD2 4.08Å; I83-Y114 HydrophobicContact CD1-CE2 4.3Å; A111-Y114 PolarHBondContact O-N 3.26Å; Y114-I116 PolarHBondContact O-N 3.19Å; Y114-P326 HydrophobicContact CD1-CB 4.47Å; Y114-P326 HydrophobicContact CD1-CG 3.69Å; Y114-P326 HydrophobicContact CD2-CG 4.38Å; Y114-P326 HydrophobicContact CE1-CB 4.46Å; Y114-P326 HydrophobicContact CE1-CG 4.08Å; Y114-P326 HydrophobicContact CG-CG 3.85Å; Y114-C329 WeakPolarHBondContact OH-CA 3.27Å; Y114-C329 PolarHBondContact OH-O 2.85Å; Y114-N332 WeakPolarHBondContact CE1-O 3.36Å; Y114-N332 PolarHBondContact OH-O 3.16Å; Y114-N332 VanDerWaalsContact OH-O 3.08Å; Y114-W336 VanDerWaalsContact O-CB 3.22Å; Y114-W336 WeakPolarHBondContact O-CB 3.47Å; Y114-W336 PolarHBondContact O-N 3.44Å
115	R	93.6	Very high	91.6	Very high	90 Å²	90	22.8 Å²	22.8	34%	0.34	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	28.4	-174.7	-50.1	-61.4	-173.1	-157.3	10.4	113.7	A111 G112 F113 P117 I335 G339 P340	A111-R115 PolarHBondContact O-N 3.23Å; G112-R115 WeakPolarHBondContact O-CD 3.39Å; G112-R115 PolarHBondContact O-N 3.47Å; G112-R115 PolarHBondContact O-NH1 3.45Å; G112-R115 VanDerWaalsContact O-NH1 3.13Å; F113-R115 VanDerWaalsContact C-N 3.31Å; F113-R115 PolarHBondContact O-N 3.24Å; R115-P117 WeakPolarHBondContact O-CD 3.38Å; R115-I335 HydrophobicContact CG-CB 4.32Å; R115-G339 CarbonylContact O-C 3.59Å; R115-G339 WeakPolarHBondContact O-CA 3.45Å; R115-P340 HydrophobicContact CB-CG 4.14Å; R115-P340 HydrophobicContact CG-CG 4.27Å
116	I	94.9	Very high	91.8	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	10%	0.1	C	C	.	.			trans	-77	123	173.3	-62	170.9	0	0	0	108.3	I83 I90 A111 Y114 S136 W336	I83-I116 HydrophobicContact CG1-CD1 4.34Å; I90-I116 HydrophobicContact CD1-CG2 4.49Å; I90-I116 HydrophobicContact CG1-CG2 4.28Å; A111-I116 HydrophobicContact CB-CB 4.26Å; A111-I116 PolarHBondContact O-N 3.45Å; Y114-I116 PolarHBondContact O-N 3.19Å; I116-S136 WeakPolarHBondContact O-CB 3.43Å; I116-S136 PolarHBondContact O-OG 2.85Å; I116-W336 HydrophobicContact CG1-CE3 4.03Å; I116-W336 HydrophobicContact CG1-CZ3 4.45Å
117	P	95.6	Very high	91.8	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	10%	0.104	C	C	.	.			trans	-59.9	137.2	178.6	-26.3	36.4	0	0	0	113.2	Y88 A89 I90 R115 S136 L138 F342 K343	Y88-P117 WeakPolarHBondContact O-CD 3.45Å; A89-P117 WeakPolarHBondContact CA-O 3.3Å; I90-P117 PolarHBondContact N-O 3.46Å; R115-P117 WeakPolarHBondContact O-CD 3.38Å; P117-S136 WeakPolarHBondContact CA-O 3.28Å; P117-L138 HydrophobicContact CB-CD1 4.28Å; P117-F342 HydrophobicContact CG-CD1 3.73Å; P117-F342 HydrophobicContact CG-CE1 4.35Å; P117-K343 HydrophobicContact CG-CB 4.13Å
118	V	94.9	Very high	91.8	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.1	176.9	-178.9	0	0	0	0	109.2	I90 V92 A111 S136 F137 L138	I90-V118 HydrophobicContact CB-CG2 4.49Å; I90-V118 CarbonylContact O-C 3.36Å; I90-V118 VanDerWaalsContact O-CA 3.27Å; I90-V118 WeakPolarHBondContact O-CA 3.3Å; V92-V118 HydrophobicContact CB-CG1 4.42Å; V92-V118 HydrophobicContact CG1-CG1 3.62Å; A111-V118 HydrophobicContact CB-CG2 3.38Å; V118-S136 PolarHBondContact N-O 3.4Å; V118-F137 HydrophobicContact CB-CD2 4.15Å; V118-F137 HydrophobicContact CG1-CD2 3.95Å; V118-F137 HydrophobicContact CG1-CE2 3.88Å; V118-L138 PolarHBondContact O-N 3.26Å
119	L	94.5	Very high	91.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	108.7	176.3	-77.7	83.4	0	0	0	110.4	A89 I90 L91 V92 L138 A305 V309 L346	A89-L119 HydrophobicContact CB-CD1 4.37Å; I90-L119 PolarHBondContact O-N 3.44Å; L91-L119 CarbonylContact C-O 3.51Å; L91-L119 WeakPolarHBondContact CA-O 3.32Å; L91-L119 HydrophobicContact CG-CB 4.43Å; V92-L119 PolarHBondContact N-O 3.4Å; L119-L138 CarbonylContact C-O 3.58Å; L119-L138 WeakPolarHBondContact CA-O 3.22Å; L119-A305 HydrophobicContact CD2-CB 4.2Å; L119-V309 HydrophobicContact CD1-CG2 4.09Å; L119-V309 HydrophobicContact CD2-CG2 3.99Å; L119-L346 HydrophobicContact CD1-CD1 3.98Å; L119-L346 HydrophobicContact CD1-CD2 4.09Å; L119-L346 HydrophobicContact CD2-CD2 4.25Å; L119-L346 HydrophobicContact CG-CD2 4.35Å
120	G	92.7	Very high	91.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	125.9	171.7	0	0	0	0	0	112.2	V92 L138 R139 T140	V92-G120 WeakPolarHBondContact O-CA 3.34Å; G120-L138 PolarHBondContact N-O 3.15Å; G120-R139 CarbonylContact O-C 3.55Å; G120-R139 WeakPolarHBondContact O-CA 3.13Å; G120-R139 VanDerWaalsContact O-CB 3.23Å; G120-R139 WeakPolarHBondContact O-CB 3.38Å; G120-T140 PolarHBondContact O-N 3.44Å; G120-T140 PolarHBondContact O-OG1 2.6Å
121	L	90.5	Very high	91.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.103	C	C	.	.	S	Bend	trans	-93	-40	-177.2	-57.9	176.7	0	0	0	112.9	L33 L91 V92 V141 H301 I302 A305	L33-L121 HydrophobicContact CD2-CD1 4.01Å; L91-L121 HydrophobicContact CB-CD1 4.29Å; L91-L121 HydrophobicContact CD2-CD1 4.44Å; L91-L121 HydrophobicContact CD2-CD2 4.22Å; V92-L121 PolarHBondContact O-N 3.48Å; L121-V141 VanDerWaalsContact O-CG1 3.25Å; L121-V141 WeakPolarHBondContact O-CG1 3.44Å; L121-V141 WeakPolarHBondContact O-CG2 3.5Å; L121-H301 HydrophobicContact CB-CB 4.25Å; L121-H301 HydrophobicContact CD2-CB 4.21Å; L121-I302 HydrophobicContact CD1-CG1 3.6Å; L121-A305 HydrophobicContact CD2-CB 3.52Å
122	T	85.7	Confident	91.6	Very high	23 Å²	23	26.2 Å²	26.2	14%	0.141	14%	0.137	C	C	.	.	S	Bend	trans	-126.8	-5.5	-175	44.7	0	0	0	0	114.6	H94 R124 E298	H94-T122 WeakPolarHBondContact CB-OG1 3.23Å; H94-T122 PolarHBondContact N-OG1 3.01Å; T122-R124 PolarHBondContact O-N 2.84Å; T122-E298 HydrophobicContact CG2-CG 3.74Å
123	T	86.3	Confident	91.4	Very high	7 Å²	7	28.9 Å²	28.9	4%	0.043	15%	0.148	C	C	.	.			trans	-78	125.6	179.3	178.6	0	0	0	0	112.6	P104 Y128 F137 V141	P104-T123 HydrophobicContact CG-CG2 4.13Å; T123-Y128 HydrophobicContact CG2-CD2 4.28Å; T123-Y128 HydrophobicContact CG2-CE2 4.43Å; T123-Y128 WeakPolarHBondContact OG1-CD2 3.21Å; T123-Y128 WeakPolarHBondContact OG1-CE2 3.47Å; T123-F137 HydrophobicContact CG2-CE1 3.93Å; T123-F137 HydrophobicContact CG2-CZ 3.44Å; T123-F137 VanDerWaalsContact CG2-CZ 3.44Å; T123-V141 WeakPolarHBondContact O-CG2 3.22Å
124	R	89.6	Confident	91.4	Very high	9 Å²	9	23.7 Å²	23.7	3%	0.034	13%	0.125	C	C	.	.			trans	-118.8	6.9	-176.5	-61.8	-173.4	68.6	-168.7	2	114	T122 S126 V141 P142 P143 Y144 E272 Y372	T122-R124 PolarHBondContact O-N 2.84Å; R124-S126 PolarHBondContact O-N 3.45Å; R124-V141 HydrophobicContact CG-CB 4.17Å; R124-V141 HydrophobicContact CG-CG2 3.82Å; R124-P142 PolarHBondContact NE-O 3.44Å; R124-P143 CarbonylContact O-C 3.58Å; R124-P143 WeakPolarHBondContact O-CA 3.45Å; R124-Y144 HydrophobicContact CB-CD1 4.3Å; R124-Y144 HydrophobicContact CB-CD2 4Å; R124-Y144 HydrophobicContact CB-CE1 3.98Å; R124-Y144 HydrophobicContact CB-CE2 3.67Å; R124-Y144 HydrophobicContact CB-CG 4.3Å; R124-Y144 WeakPolarHBondContact O-CD2 3.42Å; R124-Y144 PolarHBondContact O-N 3.47Å; R124-E272 IonicContact CZ-OE2 3.78Å; R124-E272 IonicContact NH1-OE1 3.35Å; R124-E272 PolarHBondContact NH1-OE1 2.76Å; R124-E272 IonicContact NH1-OE2 2.74Å; R124-E272 PolarHBondContact NH1-OE2 2.98Å; R124-E272 IonicContact NH2-OE2 2.73Å; R124-Y372 PolarHBondContact NH2-OH 3.47Å
125	M	89.1	Confident	91.3	Very high	31 Å²	31	26.3 Å²	26.3	15%	0.153	14%	0.14	C	C	.	.			trans	-67	131.1	176.9	-59.2	-58.8	-66.9	0	0	110.5	H101 I127 Y128 R139 Y144	H101-M125 HydrophobicContact CB-CE 4.23Å; M125-I127 HydrophobicContact CB-CG2 4.1Å; M125-I127 PolarHBondContact O-N 2.79Å; M125-Y128 HydrophobicContact CB-CD2 4.05Å; M125-Y128 HydrophobicContact CB-CE2 3.98Å; M125-Y128 HydrophobicContact CG-CE2 4.5Å; M125-R139 PolarHBondContact O-NH1 3.46Å; M125-Y144 HydrophobicContact SD-CE2 4.22Å
126	S	91.5	Very high	91.1	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.014	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-68.9	-15.8	-176.9	-70	0	0	0	0	114.2	R124 Y128 S129 S145 E172	R124-S126 PolarHBondContact O-N 3.45Å; S126-Y128 PolarHBondContact O-N 3.32Å; S126-S129 WeakPolarHBondContact O-CB 3.3Å; S126-S129 PolarHBondContact O-N 3.26Å; S126-S129 PolarHBondContact O-OG 2.89Å; S126-S145 WeakPolarHBondContact OG-CB 3.3Å; S126-S145 PolarHBondContact OG-N 2.98Å; S126-S145 PolarHBondContact OG-OG 3.3Å; S126-E172 WeakPolarHBondContact CB-OE1 3.18Å; S126-E172 VanDerWaalsContact CB-OE2 3.23Å; S126-E172 WeakPolarHBondContact CB-OE2 3.44Å; S126-E172 PolarHBondContact N-OE2 3.46Å; S126-E172 PolarHBondContact OG-OE1 3.13Å; S126-E172 PolarHBondContact OG-OE2 2.97Å
127	I	90.7	Very high	91.1	Very high	38 Å²	38	22.1 Å²	22.1	20%	0.195	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-58	-30.3	177.5	-164.8	169	0	0	0	113.4	F102 M125 S129 D130 H171	F102-I127 HydrophobicContact CE1-CD1 4.35Å; M125-I127 HydrophobicContact CB-CG2 4.1Å; M125-I127 PolarHBondContact O-N 2.79Å; I127-S129 VanDerWaalsContact C-N 3.27Å; I127-S129 PolarHBondContact O-N 3.06Å; I127-D130 PolarHBondContact O-N 3.36Å; I127-H171 VanDerWaalsContact CA-CE1 3.49Å; I127-H171 WeakPolarHBondContact CA-CE1 3.5Å
128	Y	91.4	Very high	91	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-77.2	-8.5	179.3	-58.7	-67.6	0	0	0	114.3	P104 T105 T123 M125 S126 D130 H134 F137	P104-Y128 WeakPolarHBondContact CD-OH 3.23Å; P104-Y128 HydrophobicContact CG-CE2 4.02Å; P104-Y128 WeakPolarHBondContact CG-OH 3.31Å; T105-Y128 PolarHBondContact N-OH 2.61Å; T105-Y128 PolarHBondContact OG1-OH 2.98Å; T123-Y128 HydrophobicContact CG2-CD2 4.28Å; T123-Y128 HydrophobicContact CG2-CE2 4.43Å; T123-Y128 WeakPolarHBondContact OG1-CD2 3.21Å; T123-Y128 WeakPolarHBondContact OG1-CE2 3.47Å; M125-Y128 HydrophobicContact CB-CD2 4.05Å; M125-Y128 HydrophobicContact CB-CE2 3.98Å; M125-Y128 HydrophobicContact CG-CE2 4.5Å; S126-Y128 PolarHBondContact O-N 3.32Å; Y128-D130 VanDerWaalsContact C-N 3.29Å; Y128-H134 AromaticContact CD1-CD2 3.62Å; Y128-H134 AromaticContact CD1-CE1 3.92Å; Y128-H134 AromaticContact CD1-CG 3.81Å; Y128-H134 AromaticContact CD1-ND1 3.98Å; Y128-H134 AromaticContact CD1-NE2 3.68Å; Y128-H134 AromaticContact CE1-CE1 3.83Å; Y128-H134 AromaticContact CE1-NE2 3.74Å; Y128-F137 HydrophobicContact CD1-CD2 4.31Å; Y128-F137 HydrophobicContact CD1-CE2 4.33Å; Y128-F137 HydrophobicContact CD1-CG 4.41Å; Y128-F137 HydrophobicContact CD1-CZ 4.46Å; Y128-F137 HydrophobicContact CG-CD1 4.21Å; Y128-F137 HydrophobicContact CG-CE1 4.03Å; Y128-F137 HydrophobicContact CG-CZ 4.26Å
129	S	91.4	Very high	90.8	Very high	18 Å²	18	22.1 Å²	22.1	13%	0.126	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-69.8	-31.8	172	-61.4	0	0	0	0	110.7	S126 I127 K131 R139 D366	S126-S129 WeakPolarHBondContact O-CB 3.3Å; S126-S129 PolarHBondContact O-N 3.26Å; S126-S129 PolarHBondContact O-OG 2.89Å; I127-S129 VanDerWaalsContact C-N 3.27Å; I127-S129 PolarHBondContact O-N 3.06Å; S129-K131 PolarHBondContact O-N 2.76Å; S129-K131 VanDerWaalsContact O-N 3.16Å; S129-R139 VanDerWaalsContact N-NH2 3.15Å; S129-R139 PolarHBondContact OG-NH2 2.97Å; S129-D366 WeakPolarHBondContact CB-OD2 2.78Å; S129-D366 PolarHBondContact OG-OD2 2.7Å
130	D	91.2	Very high	90.7	Very high	60 Å²	60	22.1 Å²	22.1	32%	0.321	13%	0.125	S	C	.	.			trans	-69.6	112.1	-174.8	-168.2	-19.7	0	0	0	111.6	I127 Y128 S132 I133 H134	I127-D130 PolarHBondContact O-N 3.36Å; Y128-D130 VanDerWaalsContact C-N 3.29Å; D130-S132 VanDerWaalsContact C-N 3.3Å; D130-S132 PolarHBondContact O-N 2.7Å; D130-S132 VanDerWaalsContact OD1-CB 3.28Å; D130-S132 WeakPolarHBondContact OD1-CB 3.35Å; D130-S132 PolarHBondContact OD1-N 3.23Å; D130-S132 PolarHBondContact OD1-OG 3.03Å; D130-S132 PolarHBondContact OD2-OG 2.97Å; D130-I133 PolarHBondContact O-N 3.45Å; D130-H134 PolarHBondContact O-N 3.02Å
131	K	90	Very high	90.6	Very high	38 Å²	38	22.2 Å²	22.2	17%	0.165	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-11.2	-179.5	-59.2	-50.1	174.2	-155.1	0	114.4	S129 L135 F137 D364	S129-K131 PolarHBondContact O-N 2.76Å; S129-K131 VanDerWaalsContact O-N 3.16Å; K131-L135 HydrophobicContact CB-CD1 4.34Å; K131-L135 WeakPolarHBondContact O-CD1 3.45Å; K131-F137 PolarHBondContact NZ-O 3.33Å; K131-D364 WeakPolarHBondContact CE-O 3.36Å; K131-D364 PolarHBondContact NZ-O 3.32Å
132	S	91	Very high	90.7	Very high	101 Å²	101	22.3 Å²	22.3	71%	0.706	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-35	169.9	72.3	0	0	0	0	111.4	D130	D130-S132 VanDerWaalsContact C-N 3.3Å; D130-S132 PolarHBondContact O-N 2.7Å; D130-S132 VanDerWaalsContact OD1-CB 3.28Å; D130-S132 WeakPolarHBondContact OD1-CB 3.35Å; D130-S132 PolarHBondContact OD1-N 3.23Å; D130-S132 PolarHBondContact OD1-OG 3.03Å; D130-S132 PolarHBondContact OD2-OG 2.97Å
133	I	90.4	Very high	91.1	Very high	66 Å²	66	21.2 Å²	21.2	34%	0.338	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-52.6	-179.8	-53	178.3	0	0	0	110.8	Y109 D130	Y109-I133 HydrophobicContact CE1-CG2 3.88Å; Y109-I133 WeakPolarHBondContact OH-CG2 3.38Å; D130-I133 PolarHBondContact O-N 3.45Å
134	H	92.4	Very high	91.4	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.009	13%	0.126	C	C	.	.			trans	-113.9	67.9	-171.4	-68.2	-68	0	0	0	111.7	S108 Y109 Y128 D130 S136 F137	S108-H134 WeakPolarHBondContact CB-ND1 3.16Å; S108-H134 PolarHBondContact OG-ND1 3.13Å; Y109-H134 AromaticContact CE1-CE1 3.94Å; Y109-H134 AromaticContact CE2-CE1 3.98Å; Y109-H134 AromaticContact CZ-CE1 3.68Å; Y128-H134 AromaticContact CD1-CD2 3.62Å; Y128-H134 AromaticContact CD1-CE1 3.92Å; Y128-H134 AromaticContact CD1-CG 3.81Å; Y128-H134 AromaticContact CD1-ND1 3.98Å; Y128-H134 AromaticContact CD1-NE2 3.68Å; Y128-H134 AromaticContact CE1-CE1 3.83Å; Y128-H134 AromaticContact CE1-NE2 3.74Å; D130-H134 PolarHBondContact O-N 3.02Å; H134-S136 VanDerWaalsContact C-N 3.35Å; H134-S136 PolarHBondContact O-N 3.16Å; H134-F137 HydrophobicContact CB-CB 3.91Å; H134-F137 PolarHBondContact O-N 2.96Å
135	L	89.9	Confident	91.6	Very high	66 Å²	66	23.1 Å²	23.1	35%	0.346	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-37.1	-172.8	-170	71.1	0	0	0	113.8	K131 K343	K131-L135 HydrophobicContact CB-CD1 4.34Å; K131-L135 WeakPolarHBondContact O-CD1 3.45Å; L135-K343 VanDerWaalsContact O-CE 3.24Å; L135-K343 WeakPolarHBondContact O-CE 3.23Å; L135-K343 PolarHBondContact O-NZ 3.26Å
136	S	89.4	Confident	91.7	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.028	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-0.7	-175.5	57.3	0	0	0	0	114.5	G112 I116 P117 V118 H134 L138	G112-S136 VanDerWaalsContact CA-OG 3.29Å; G112-S136 WeakPolarHBondContact CA-OG 3.31Å; I116-S136 WeakPolarHBondContact O-CB 3.43Å; I116-S136 PolarHBondContact O-OG 2.85Å; P117-S136 WeakPolarHBondContact CA-O 3.28Å; V118-S136 PolarHBondContact N-O 3.4Å; H134-S136 VanDerWaalsContact C-N 3.35Å; H134-S136 PolarHBondContact O-N 3.16Å; S136-L138 WeakPolarHBondContact O-CD1 3.37Å
137	F	93.9	Very high	91.8	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	135.2	-170.2	-158.2	-89	0	0	0	112.4	V92 V118 T123 Y128 K131 H134 R139	V92-F137 HydrophobicContact CG1-CE2 4.13Å; V92-F137 HydrophobicContact CG1-CZ 4.47Å; V118-F137 HydrophobicContact CB-CD2 4.15Å; V118-F137 HydrophobicContact CG1-CD2 3.95Å; V118-F137 HydrophobicContact CG1-CE2 3.88Å; T123-F137 HydrophobicContact CG2-CE1 3.93Å; T123-F137 HydrophobicContact CG2-CZ 3.44Å; T123-F137 VanDerWaalsContact CG2-CZ 3.44Å; Y128-F137 HydrophobicContact CD1-CD2 4.31Å; Y128-F137 HydrophobicContact CD1-CE2 4.33Å; Y128-F137 HydrophobicContact CD1-CG 4.41Å; Y128-F137 HydrophobicContact CD1-CZ 4.46Å; Y128-F137 HydrophobicContact CG-CD1 4.21Å; Y128-F137 HydrophobicContact CG-CE1 4.03Å; Y128-F137 HydrophobicContact CG-CZ 4.26Å; K131-F137 PolarHBondContact NZ-O 3.33Å; H134-F137 HydrophobicContact CB-CB 3.91Å; H134-F137 PolarHBondContact O-N 2.96Å; F137-R139 HydrophobicContact CE1-CB 4.08Å; F137-R139 HydrophobicContact CE1-CG 4.43Å
138	L	94.1	Very high	91.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	165.5	168.8	-58.9	94.5	0	0	0	108.7	P117 V118 L119 G120 S136 K343 L346 M347 F361 G365	P117-L138 HydrophobicContact CB-CD1 4.28Å; V118-L138 PolarHBondContact O-N 3.26Å; L119-L138 CarbonylContact C-O 3.58Å; L119-L138 WeakPolarHBondContact CA-O 3.22Å; G120-L138 PolarHBondContact N-O 3.15Å; S136-L138 WeakPolarHBondContact O-CD1 3.37Å; L138-K343 HydrophobicContact CD1-CG 4.19Å; L138-L346 HydrophobicContact CD1-CD2 4.27Å; L138-L346 HydrophobicContact CD2-CD2 3.51Å; L138-L346 HydrophobicContact CG-CD2 4.38Å; L138-M347 HydrophobicContact CD2-CG 3.48Å; L138-M347 VanDerWaalsContact CD2-CG 3.48Å; L138-F361 HydrophobicContact CB-CD1 4.46Å; L138-F361 HydrophobicContact CB-CE1 4.17Å; L138-F361 HydrophobicContact CD2-CD1 4.22Å; L138-F361 HydrophobicContact CD2-CD2 4.3Å; L138-F361 HydrophobicContact CD2-CE1 4.36Å; L138-F361 HydrophobicContact CD2-CE2 4.45Å; L138-F361 HydrophobicContact CD2-CG 4.18Å; L138-F361 HydrophobicContact CD2-CZ 4.48Å; L138-G365 CarbonylContact C-O 3.57Å; L138-G365 WeakPolarHBondContact CA-O 3.31Å; L138-G365 WeakPolarHBondContact CB-O 3.28Å
139	R	92.1	Very high	91.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	146.3	177.7	52.2	-177	154.9	-166.7	-12	115	G120 M125 S129 F137 V141 F361 G365 D366 R367	G120-R139 CarbonylContact O-C 3.55Å; G120-R139 WeakPolarHBondContact O-CA 3.13Å; G120-R139 VanDerWaalsContact O-CB 3.23Å; G120-R139 WeakPolarHBondContact O-CB 3.38Å; M125-R139 PolarHBondContact O-NH1 3.46Å; S129-R139 VanDerWaalsContact N-NH2 3.15Å; S129-R139 PolarHBondContact OG-NH2 2.97Å; F137-R139 HydrophobicContact CE1-CB 4.08Å; F137-R139 HydrophobicContact CE1-CG 4.43Å; R139-V141 VanDerWaalsContact C-N 3.31Å; R139-V141 WeakPolarHBondContact CD-O 3.49Å; R139-V141 WeakPolarHBondContact CG-O 3.27Å; R139-F361 WeakPolarHBondContact O-CE1 3.42Å; R139-G365 PolarHBondContact N-O 2.99Å; R139-G365 VanDerWaalsContact N-O 3.1Å; R139-D366 IonicContact CZ-OD1 3.85Å; R139-D366 IonicContact NE-OD1 2.64Å; R139-D366 PolarHBondContact NE-OD1 3.19Å; R139-D366 VanDerWaalsContact NH2-CG 3.31Å; R139-D366 IonicContact NH2-OD1 3.59Å; R139-D366 PolarHBondContact NH2-OD1 3.38Å; R139-D366 IonicContact NH2-OD2 3.66Å; R139-D366 PolarHBondContact NH2-OD2 3.37Å; R139-R367 PolarHBondContact O-N 3.31Å
140	T	90.6	Very high	92	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	-85.1	-4.7	178	60.3	0	0	0	0	113.4	G120 H301 A305 R367	G120-T140 PolarHBondContact O-N 3.44Å; G120-T140 PolarHBondContact O-OG1 2.6Å; T140-H301 PolarHBondContact OG1-ND1 3.06Å; T140-H301 VanDerWaalsContact OG1-ND1 3.13Å; T140-A305 HydrophobicContact CG2-CB 3.93Å; T140-R367 WeakPolarHBondContact O-CD 3.48Å; T140-R367 PolarHBondContact O-NH1 3.21Å
141	V	91.7	Very high	92.1	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.006	10%	0.103	C	C	.	.	S	Bend	trans	-116.6	138.2	172.3	-71.5	0	0	0	0	109.8	L121 T123 R124 R139 L292 H301	L121-V141 VanDerWaalsContact O-CG1 3.25Å; L121-V141 WeakPolarHBondContact O-CG1 3.44Å; L121-V141 WeakPolarHBondContact O-CG2 3.5Å; T123-V141 WeakPolarHBondContact O-CG2 3.22Å; R124-V141 HydrophobicContact CG-CB 4.17Å; R124-V141 HydrophobicContact CG-CG2 3.82Å; R139-V141 VanDerWaalsContact C-N 3.31Å; R139-V141 WeakPolarHBondContact CD-O 3.49Å; R139-V141 WeakPolarHBondContact CG-O 3.27Å; V141-L292 HydrophobicContact CB-CD2 4.23Å; V141-L292 HydrophobicContact CG1-CD2 4.1Å; V141-H301 WeakPolarHBondContact CG1-CE1 3.27Å
142	P	93.3	Very high	92.1	Very high	3 Å²	3	18.3 Å²	18.3	2%	0.019	10%	0.101	C	C	.	.			trans	-70.1	148.6	174.3	32.1	-39.7	0	0	0	111.7	R124 H146 L292 A370 Y372	R124-P142 PolarHBondContact NE-O 3.44Å; P142-H146 HydrophobicContact CB-CB 4.08Å; P142-L292 HydrophobicContact CG-CD1 3.92Å; P142-L292 HydrophobicContact CG-CD2 4.26Å; P142-A370 HydrophobicContact CB-CB 4.29Å; P142-A370 HydrophobicContact CG-CB 3.52Å; P142-Y372 HydrophobicContact CG-CE2 4.26Å; P142-Y372 WeakPolarHBondContact CG-OH 3.2Å
143	P	93.3	Very high	92.1	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.071	C	C	.	.			trans	-65.3	165.2	172.4	26.4	-33.3	0	0	0	112.9	R124 S145 H146	R124-P143 CarbonylContact O-C 3.58Å; R124-P143 WeakPolarHBondContact O-CA 3.45Å; P143-S145 VanDerWaalsContact C-N 3.33Å; P143-S145 PolarHBondContact O-N 2.86Å; P143-H146 HydrophobicContact CG-CB 4.25Å; P143-H146 VanDerWaalsContact CG-CD2 3.5Å; P143-H146 WeakPolarHBondContact CG-CD2 3.32Å; P143-H146 WeakPolarHBondContact O-CB 3.19Å; P143-H146 PolarHBondContact O-N 3.08Å
144	Y	93	Very high	92	Very high	49 Å²	49	11.2 Å²	11.2	19%	0.192	6%	0.056	C	C	.	.	G	3₁₀ helix	trans	-63.2	-37.2	175.3	-60.8	-64.4	0	0	0	112.2	R124 M125 H146 Q147 E172 R273	R124-Y144 HydrophobicContact CB-CD1 4.3Å; R124-Y144 HydrophobicContact CB-CD2 4Å; R124-Y144 HydrophobicContact CB-CE1 3.98Å; R124-Y144 HydrophobicContact CB-CE2 3.67Å; R124-Y144 HydrophobicContact CB-CG 4.3Å; R124-Y144 WeakPolarHBondContact O-CD2 3.42Å; R124-Y144 PolarHBondContact O-N 3.47Å; M125-Y144 HydrophobicContact SD-CE2 4.22Å; Y144-H146 PolarHBondContact O-N 2.83Å; Y144-H146 VanDerWaalsContact O-N 3.08Å; Y144-Q147 WeakPolarHBondContact O-CB 3.48Å; Y144-Q147 WeakPolarHBondContact O-CG 3.42Å; Y144-Q147 PolarHBondContact O-N 3.44Å; Y144-E172 VanDerWaalsContact CB-OE1 3.32Å; Y144-E172 WeakPolarHBondContact CB-OE1 3.43Å; Y144-R273 HydrophobicContact CD1-CG 4.44Å; Y144-R273 HydrophobicContact CE1-CG 3.96Å; Y144-R273 HydrophobicContact CE2-CG 4.3Å
145	S	92.9	Very high	91.8	Very high	6 Å²	6	11.1 Å²	11.1	4%	0.042	6%	0.056	C	C	.	.	G	3₁₀ helix	trans	-54.3	-29.6	173.4	57	0	0	0	0	114.4	S126 P143 Q147 S148 E172	S126-S145 WeakPolarHBondContact OG-CB 3.3Å; S126-S145 PolarHBondContact OG-N 2.98Å; S126-S145 PolarHBondContact OG-OG 3.3Å; P143-S145 VanDerWaalsContact C-N 3.33Å; P143-S145 PolarHBondContact O-N 2.86Å; S145-Q147 PolarHBondContact O-N 2.95Å; S145-S148 WeakPolarHBondContact O-CB 3.46Å; S145-S148 PolarHBondContact O-N 3.46Å; S145-S148 PolarHBondContact O-OG 2.86Å; S145-E172 PolarHBondContact N-OE1 2.86Å
146	H	91.8	Very high	91.6	Very high	25 Å²	25	14 Å²	14	12%	0.116	6%	0.062	C	C	.	.	G	3₁₀ helix	trans	-69	-18.3	176.8	-81.3	-156	0	0	0	113.4	P142 P143 Y144 S148 S149 D366	P142-H146 HydrophobicContact CB-CB 4.08Å; P143-H146 HydrophobicContact CG-CB 4.25Å; P143-H146 VanDerWaalsContact CG-CD2 3.5Å; P143-H146 WeakPolarHBondContact CG-CD2 3.32Å; P143-H146 WeakPolarHBondContact O-CB 3.19Å; P143-H146 PolarHBondContact O-N 3.08Å; Y144-H146 PolarHBondContact O-N 2.83Å; Y144-H146 VanDerWaalsContact O-N 3.08Å; H146-S148 PolarHBondContact O-N 2.75Å; H146-S149 WeakPolarHBondContact O-CB 3.45Å; H146-S149 PolarHBondContact O-N 2.79Å; H146-S149 PolarHBondContact O-OG 2.76Å; H146-S149 VanDerWaalsContact O-OG 3.1Å; H146-D366 IonicContact NE2-OD2 3.11Å
147	Q	92.6	Very high	91.4	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.019	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-60.2	-25	174.4	-64.1	-174	2.5	0	0	112.4	Y144 S145 S149 V150 W151 L290 Y372	Y144-Q147 WeakPolarHBondContact O-CB 3.48Å; Y144-Q147 WeakPolarHBondContact O-CG 3.42Å; Y144-Q147 PolarHBondContact O-N 3.44Å; S145-Q147 PolarHBondContact O-N 2.95Å; Q147-S149 PolarHBondContact O-N 3Å; Q147-S149 VanDerWaalsContact O-N 3.13Å; Q147-V150 WeakPolarHBondContact O-CA 3.32Å; Q147-V150 WeakPolarHBondContact O-CB 3.43Å; Q147-V150 PolarHBondContact O-N 3.44Å; Q147-W151 HydrophobicContact CB-CZ2 4.31Å; Q147-W151 PolarHBondContact O-N 2.61Å; Q147-W151 VanDerWaalsContact O-N 3.12Å; Q147-L290 HydrophobicContact CB-CD1 3.79Å; Q147-L290 HydrophobicContact CG-CD1 4.34Å; Q147-Y372 HydrophobicContact CG-CE1 3.82Å
148	S	92.8	Very high	91.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-55.6	-28.1	171.7	61.1	0	0	0	0	114.1	S145 H146 V150 W151 F152 R179	S145-S148 WeakPolarHBondContact O-CB 3.46Å; S145-S148 PolarHBondContact O-N 3.46Å; S145-S148 PolarHBondContact O-OG 2.86Å; H146-S148 PolarHBondContact O-N 2.75Å; S148-V150 VanDerWaalsContact C-N 3.3Å; S148-V150 PolarHBondContact O-N 3.48Å; S148-W151 VanDerWaalsContact CA-CE3 3.4Å; S148-W151 PolarHBondContact O-N 2.82Å; S148-F152 WeakPolarHBondContact O-CB 3.11Å; S148-F152 PolarHBondContact O-N 3.47Å; S148-R179 WeakPolarHBondContact OG-CB 3.21Å; S148-R179 WeakPolarHBondContact OG-CG 3.12Å
149	S	91.2	Very high	90.8	Very high	23 Å²	23	22.6 Å²	22.6	16%	0.161	11%	0.114	C	C	.	.	H	α-helix	trans	-67.3	-34.1	174.8	-45.4	0	0	0	0	111.6	H146 Q147 E153	H146-S149 WeakPolarHBondContact O-CB 3.45Å; H146-S149 PolarHBondContact O-N 2.79Å; H146-S149 PolarHBondContact O-OG 2.76Å; H146-S149 VanDerWaalsContact O-OG 3.1Å; Q147-S149 PolarHBondContact O-N 3Å; Q147-S149 VanDerWaalsContact O-N 3.13Å; S149-E153 PolarHBondContact O-N 2.7Å; S149-E153 VanDerWaalsContact O-N 3.11Å
150	V	93.6	Very high	90.6	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-73.3	-44.7	176	-169.9	0	0	0	0	109.9	Q147 S148 F152 E153 M154 L290 Y372 Y388	Q147-V150 WeakPolarHBondContact O-CA 3.32Å; Q147-V150 WeakPolarHBondContact O-CB 3.43Å; Q147-V150 PolarHBondContact O-N 3.44Å; S148-V150 VanDerWaalsContact C-N 3.3Å; S148-V150 PolarHBondContact O-N 3.48Å; V150-F152 VanDerWaalsContact C-N 3.27Å; V150-F152 PolarHBondContact O-N 2.99Å; V150-E153 PolarHBondContact O-N 3.37Å; V150-M154 HydrophobicContact CG1-CG 4.47Å; V150-M154 HydrophobicContact CG1-SD 4.39Å; V150-M154 WeakPolarHBondContact O-CB 3.26Å; V150-M154 VanDerWaalsContact O-CG 3.31Å; V150-M154 WeakPolarHBondContact O-CG 3.43Å; V150-M154 PolarHBondContact O-N 2.86Å; V150-L290 HydrophobicContact CB-CD1 3.87Å; V150-L290 HydrophobicContact CB-CD2 4.2Å; V150-L290 HydrophobicContact CG1-CD1 4.19Å; V150-L290 HydrophobicContact CG1-CD2 3.56Å; V150-L290 HydrophobicContact CG2-CD1 4.43Å; V150-Y372 HydrophobicContact CG2-CD2 3.78Å; V150-Y372 HydrophobicContact CG2-CE2 4.17Å; V150-Y372 HydrophobicContact CG2-CG 4.09Å; V150-Y388 HydrophobicContact CG1-CD2 4.37Å; V150-Y388 HydrophobicContact CG1-CG 4.13Å; V150-Y388 HydrophobicContact CG2-CD1 3.72Å; V150-Y388 HydrophobicContact CG2-CE1 3.88Å; V150-Y388 HydrophobicContact CG2-CG 4.09Å
151	W	93.2	Very high	90.2	Very high	3 Å²	3	25.6 Å²	25.6	1%	0.011	13%	0.13	C	C	.	.	H	α-helix	trans	-56.7	-43.4	173.6	-59.9	-34.6	0	0	0	111.4	Q147 S148 M154 M155 I241 V270 L290	Q147-W151 HydrophobicContact CB-CZ2 4.31Å; Q147-W151 PolarHBondContact O-N 2.61Å; Q147-W151 VanDerWaalsContact O-N 3.12Å; S148-W151 VanDerWaalsContact CA-CE3 3.4Å; S148-W151 PolarHBondContact O-N 2.82Å; W151-M154 WeakPolarHBondContact O-CB 3.25Å; W151-M154 PolarHBondContact O-N 2.93Å; W151-M155 HydrophobicContact CB-CE 3.89Å; W151-M155 WeakPolarHBondContact O-CE 2.85Å; W151-M155 VanDerWaalsContact O-CG 3.3Å; W151-M155 WeakPolarHBondContact O-CG 3.47Å; W151-M155 PolarHBondContact O-N 2.94Å; W151-I241 HydrophobicContact CB-CD1 4.33Å; W151-I241 HydrophobicContact CD2-CG2 3.67Å; W151-I241 HydrophobicContact CE3-CG2 3.54Å; W151-I241 HydrophobicContact CG-CG2 4.25Å; W151-I241 HydrophobicContact CH2-CG2 4.28Å; W151-I241 HydrophobicContact CZ2-CG2 4.34Å; W151-I241 HydrophobicContact CZ3-CG2 3.88Å; W151-V270 PolarHBondContact NE1-O 3.5Å; W151-L290 VanDerWaalsContact NE1-CD1 3.3Å
152	F	91	Very high	89.9	Confident	30 Å²	30	28.3 Å²	28.3	13%	0.132	14%	0.142	C	C	.	.	H	α-helix	trans	-61.4	-44.2	177.4	179.8	-98.2	0	0	0	112.8	S148 V150 M155 R156 L180 L183 L184 R187 P210	S148-F152 WeakPolarHBondContact O-CB 3.11Å; S148-F152 PolarHBondContact O-N 3.47Å; V150-F152 VanDerWaalsContact C-N 3.27Å; V150-F152 PolarHBondContact O-N 2.99Å; F152-M155 WeakPolarHBondContact O-CB 3.44Å; F152-M155 PolarHBondContact O-N 2.8Å; F152-R156 PolarHBondContact O-N 2.85Å; F152-L180 HydrophobicContact CB-CD1 4.36Å; F152-L183 HydrophobicContact CB-CD1 4.08Å; F152-L183 HydrophobicContact CD2-CB 4.05Å; F152-L183 HydrophobicContact CE2-CB 4.3Å; F152-L183 HydrophobicContact CG-CB 4.19Å; F152-L183 HydrophobicContact CG-CD1 4.4Å; F152-L184 HydrophobicContact CD2-CD2 4.09Å; F152-L184 HydrophobicContact CE2-CD2 3.99Å; F152-R187 HydrophobicContact CZ-CB 4.48Å; F152-P210 HydrophobicContact CD2-CG 4.24Å; F152-P210 HydrophobicContact CE2-CG 3.88Å
153	E	90.1	Very high	89.8	Confident	16 Å²	16	28.2 Å²	28.2	8%	0.075	14%	0.141	C	C	.	.	H	α-helix	trans	-70.1	-33.1	175.9	-170.2	68	-179.8	0	0	111.6	S149 V150 R156 V157 Y388 H392 V393	S149-E153 PolarHBondContact O-N 2.7Å; S149-E153 VanDerWaalsContact O-N 3.11Å; V150-E153 PolarHBondContact O-N 3.37Å; E153-R156 WeakPolarHBondContact O-CB 3.12Å; E153-R156 PolarHBondContact O-N 2.85Å; E153-R156 IonicContact OE1-CZ 3.9Å; E153-R156 IonicContact OE1-NH1 3.41Å; E153-R156 PolarHBondContact OE1-NH1 2.54Å; E153-R156 VanDerWaalsContact OE1-NH1 3.13Å; E153-R156 VanDerWaalsContact OE2-CD 3.25Å; E153-R156 WeakPolarHBondContact OE2-CD 3.26Å; E153-R156 IonicContact OE2-CZ 3.16Å; E153-R156 IonicContact OE2-NH1 2.61Å; E153-R156 PolarHBondContact OE2-NH1 3.16Å; E153-R156 VanDerWaalsContact OE2-NH1 3.11Å; E153-V157 WeakPolarHBondContact O-CG2 3.38Å; E153-V157 PolarHBondContact O-N 2.76Å; E153-Y388 HydrophobicContact CB-CE2 4.11Å; E153-Y388 HydrophobicContact CG-CE2 4.2Å; E153-H392 IonicContact OE1-ND1 2.61Å; E153-H392 PolarHBondContact OE1-ND1 2.84Å; E153-H392 VanDerWaalsContact OE1-ND1 3.09Å; E153-V393 HydrophobicContact CB-CG2 4.08Å; E153-V393 HydrophobicContact CG-CB 4.39Å; E153-V393 HydrophobicContact CG-CG2 3.77Å
154	M	89.6	Confident	89.8	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-62	-44.6	171.6	-73	179.7	70.8	0	0	111.7	V150 W151 R156 V157 Y158 L269 L288 L290 I374 V393	V150-M154 HydrophobicContact CG1-CG 4.47Å; V150-M154 HydrophobicContact CG1-SD 4.39Å; V150-M154 WeakPolarHBondContact O-CB 3.26Å; V150-M154 VanDerWaalsContact O-CG 3.31Å; V150-M154 WeakPolarHBondContact O-CG 3.43Å; V150-M154 PolarHBondContact O-N 2.86Å; W151-M154 WeakPolarHBondContact O-CB 3.25Å; W151-M154 PolarHBondContact O-N 2.93Å; M154-R156 PolarHBondContact O-N 2.97Å; M154-V157 PolarHBondContact O-N 3.24Å; M154-Y158 HydrophobicContact CB-CD2 4.44Å; M154-Y158 HydrophobicContact CE-CE2 4.24Å; M154-Y158 WeakPolarHBondContact O-CD2 3.23Å; M154-Y158 PolarHBondContact O-N 2.78Å; M154-L269 HydrophobicContact CE-CD2 3.68Å; M154-L288 HydrophobicContact CE-CB 4.05Å; M154-L288 HydrophobicContact CE-CD1 3.61Å; M154-L288 HydrophobicContact CE-CG 4.4Å; M154-L290 HydrophobicContact SD-CD2 4.21Å; M154-I374 HydrophobicContact CE-CG2 4.12Å; M154-I374 HydrophobicContact CG-CD1 4.25Å; M154-I374 HydrophobicContact SD-CD1 4.21Å; M154-I374 HydrophobicContact SD-CG2 4.45Å; M154-V393 HydrophobicContact CG-CG2 4.27Å
155	M	88.5	Confident	89.9	Confident	1 Å²	1	26 Å²	26	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-57.1	-36.8	174.3	-67.8	170.6	-135.9	0	0	111.6	W151 F152 Y158 S159 W160 I163 L180 P210 I241	W151-M155 HydrophobicContact CB-CE 3.89Å; W151-M155 WeakPolarHBondContact O-CE 2.85Å; W151-M155 VanDerWaalsContact O-CG 3.3Å; W151-M155 WeakPolarHBondContact O-CG 3.47Å; W151-M155 PolarHBondContact O-N 2.94Å; F152-M155 WeakPolarHBondContact O-CB 3.44Å; F152-M155 PolarHBondContact O-N 2.8Å; M155-Y158 CarbonylContact O-C 3.49Å; M155-S159 CarbonylContact O-C 3.39Å; M155-S159 VanDerWaalsContact O-CA 3.27Å; M155-S159 WeakPolarHBondContact O-CA 3.32Å; M155-S159 PolarHBondContact O-N 3.49Å; M155-W160 PolarHBondContact O-N 2.93Å; M155-I163 HydrophobicContact CE-CD1 3.76Å; M155-I163 HydrophobicContact CG-CG2 4.26Å; M155-I163 HydrophobicContact SD-CD1 3.84Å; M155-I163 HydrophobicContact SD-CG2 3.89Å; M155-L180 HydrophobicContact CE-CD1 3.97Å; M155-L180 HydrophobicContact CE-CD2 4.46Å; M155-P210 HydrophobicContact CB-CB 4.25Å; M155-P210 HydrophobicContact CB-CG 4.42Å; M155-P210 HydrophobicContact SD-CB 4.01Å; M155-P210 HydrophobicContact SD-CG 4.47Å; M155-I241 HydrophobicContact CE-CD1 3.2Å
156	R	84.5	Confident	90	Very high	127 Å²	127	25.8 Å²	25.8	48%	0.479	13%	0.131	S	C	.	.	H	α-helix	trans	-68.2	-48	176.9	-179.5	-170.7	170.7	-171.7	-2.5	112.1	F152 E153 M154 Y158 S159	F152-R156 PolarHBondContact O-N 2.85Å; E153-R156 WeakPolarHBondContact O-CB 3.12Å; E153-R156 PolarHBondContact O-N 2.85Å; E153-R156 IonicContact OE1-CZ 3.9Å; E153-R156 IonicContact OE1-NH1 3.41Å; E153-R156 PolarHBondContact OE1-NH1 2.54Å; E153-R156 VanDerWaalsContact OE1-NH1 3.13Å; E153-R156 VanDerWaalsContact OE2-CD 3.25Å; E153-R156 WeakPolarHBondContact OE2-CD 3.26Å; E153-R156 IonicContact OE2-CZ 3.16Å; E153-R156 IonicContact OE2-NH1 2.61Å; E153-R156 PolarHBondContact OE2-NH1 3.16Å; E153-R156 VanDerWaalsContact OE2-NH1 3.11Å; M154-R156 PolarHBondContact O-N 2.97Å; R156-Y158 VanDerWaalsContact C-N 3.25Å; R156-Y158 PolarHBondContact O-N 3.07Å; R156-S159 PolarHBondContact O-N 3.13Å
157	V	86.6	Confident	90.1	Very high	68 Å²	68	24.7 Å²	24.7	41%	0.412	13%	0.126	S	C	.	.	H	α-helix	trans	-58.2	-43	177.1	172	0	0	0	0	110.4	E153 M154 V393	E153-V157 WeakPolarHBondContact O-CG2 3.38Å; E153-V157 PolarHBondContact O-N 2.76Å; M154-V157 PolarHBondContact O-N 3.24Å; V157-V393 HydrophobicContact CG2-CB 4.1Å
158	Y	86.9	Confident	90.2	Very high	33 Å²	33	24.6 Å²	24.6	13%	0.129	13%	0.126	C	C	.	.	H	α-helix	trans	-90.6	2.6	-179.1	-62.9	-62.2	0	0	0	114.2	M154 M155 R156 W160 I400 W402 K409	M154-Y158 HydrophobicContact CB-CD2 4.44Å; M154-Y158 HydrophobicContact CE-CE2 4.24Å; M154-Y158 WeakPolarHBondContact O-CD2 3.23Å; M154-Y158 PolarHBondContact O-N 2.78Å; M155-Y158 CarbonylContact O-C 3.49Å; R156-Y158 VanDerWaalsContact C-N 3.25Å; R156-Y158 PolarHBondContact O-N 3.07Å; Y158-W160 VanDerWaalsContact CB-CD2 3.48Å; Y158-W160 VanDerWaalsContact CB-CE2 3.46Å; Y158-W160 HydrophobicContact CD1-CH2 4.41Å; Y158-W160 HydrophobicContact CD1-CZ2 4.32Å; Y158-W160 HydrophobicContact CD2-CE3 4.18Å; Y158-W160 AromaticContact CD2-CH2 3.44Å; Y158-W160 HydrophobicContact CD2-CH2 3.44Å; Y158-W160 VanDerWaalsContact CD2-CH2 3.44Å; Y158-W160 HydrophobicContact CD2-CZ2 4.08Å; Y158-W160 AromaticContact CD2-CZ3 3.51Å; Y158-W160 HydrophobicContact CD2-CZ3 3.51Å; Y158-W160 HydrophobicContact CE2-CH2 4.13Å; Y158-W160 HydrophobicContact CE2-CZ3 4.39Å; Y158-W160 HydrophobicContact CG-CD2 4.39Å; Y158-W160 HydrophobicContact CG-CE3 4.3Å; Y158-W160 AromaticContact CG-CH2 3.62Å; Y158-W160 HydrophobicContact CG-CH2 3.62Å; Y158-W160 AromaticContact CG-CZ2 3.76Å; Y158-W160 HydrophobicContact CG-CZ2 3.76Å; Y158-W160 AromaticContact CG-CZ3 3.92Å; Y158-W160 HydrophobicContact CG-CZ3 3.92Å; Y158-W160 PolarHBondContact O-N 3.45Å; Y158-W160 VanDerWaalsContact O-N 3.09Å; Y158-I400 WeakPolarHBondContact OH-CD1 3.37Å; Y158-W402 HydrophobicContact CD1-CH2 4.29Å; Y158-W402 HydrophobicContact CD1-CZ2 4.47Å; Y158-W402 AromaticContact CE1-CH2 3.98Å; Y158-W402 HydrophobicContact CE1-CH2 3.98Å; Y158-W402 HydrophobicContact CE1-CZ2 4.01Å; Y158-W402 HydrophobicContact CE2-CH2 4.33Å; Y158-K409 VanDerWaalsContact C-NZ 3.29Å; Y158-K409 HydrophobicContact CD1-CD 3.83Å; Y158-K409 HydrophobicContact CD1-CG 4.03Å; Y158-K409 WeakPolarHBondContact O-CE 3.41Å; Y158-K409 PolarHBondContact O-NZ 2.92Å
159	S	86.8	Confident	90.3	Very high	83 Å²	83	27.7 Å²	27.7	58%	0.58	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.1	36.3	-179.5	-53.1	0	0	0	0	113.8	M155 R156	M155-S159 CarbonylContact O-C 3.39Å; M155-S159 VanDerWaalsContact O-CA 3.27Å; M155-S159 WeakPolarHBondContact O-CA 3.32Å; M155-S159 PolarHBondContact O-N 3.49Å; R156-S159 PolarHBondContact O-N 3.13Å
160	W	88.3	Confident	90.3	Very high	3 Å²	3	28.6 Å²	28.6	1%	0.011	15%	0.146	C	C	.	.			trans	-85.4	113.9	175.5	-64.2	-40.5	0	0	0	108.9	M155 Y158 V239 V267 L269 W402 K409 P410	M155-W160 PolarHBondContact O-N 2.93Å; Y158-W160 VanDerWaalsContact CB-CD2 3.48Å; Y158-W160 VanDerWaalsContact CB-CE2 3.46Å; Y158-W160 HydrophobicContact CD1-CH2 4.41Å; Y158-W160 HydrophobicContact CD1-CZ2 4.32Å; Y158-W160 HydrophobicContact CD2-CE3 4.18Å; Y158-W160 AromaticContact CD2-CH2 3.44Å; Y158-W160 HydrophobicContact CD2-CH2 3.44Å; Y158-W160 VanDerWaalsContact CD2-CH2 3.44Å; Y158-W160 HydrophobicContact CD2-CZ2 4.08Å; Y158-W160 AromaticContact CD2-CZ3 3.51Å; Y158-W160 HydrophobicContact CD2-CZ3 3.51Å; Y158-W160 HydrophobicContact CE2-CH2 4.13Å; Y158-W160 HydrophobicContact CE2-CZ3 4.39Å; Y158-W160 HydrophobicContact CG-CD2 4.39Å; Y158-W160 HydrophobicContact CG-CE3 4.3Å; Y158-W160 AromaticContact CG-CH2 3.62Å; Y158-W160 HydrophobicContact CG-CH2 3.62Å; Y158-W160 AromaticContact CG-CZ2 3.76Å; Y158-W160 HydrophobicContact CG-CZ2 3.76Å; Y158-W160 AromaticContact CG-CZ3 3.92Å; Y158-W160 HydrophobicContact CG-CZ3 3.92Å; Y158-W160 PolarHBondContact O-N 3.45Å; Y158-W160 VanDerWaalsContact O-N 3.09Å; W160-V239 HydrophobicContact CB-CG2 4.05Å; W160-V239 HydrophobicContact CD2-CG1 4.45Å; W160-V239 HydrophobicContact CD2-CG2 3.79Å; W160-V239 HydrophobicContact CE3-CG1 4.04Å; W160-V239 HydrophobicContact CE3-CG2 4.22Å; W160-V239 HydrophobicContact CG-CG2 3.72Å; W160-V239 HydrophobicContact CZ3-CG1 4.5Å; W160-V267 HydrophobicContact CH2-CG1 3.74Å; W160-V267 HydrophobicContact CZ2-CG1 4.11Å; W160-V267 HydrophobicContact CZ2-CG2 4.14Å; W160-V267 HydrophobicContact CZ3-CG1 4.2Å; W160-L269 HydrophobicContact CE3-CD1 4.48Å; W160-L269 HydrophobicContact CZ3-CD1 4.1Å; W160-L269 HydrophobicContact CZ3-CD2 4.11Å; W160-L269 HydrophobicContact CZ3-CG 4.48Å; W160-W402 AromaticContact CH2-CH2 3.56Å; W160-W402 HydrophobicContact CH2-CH2 3.56Å; W160-W402 AromaticContact CH2-CZ3 3.55Å; W160-W402 HydrophobicContact CH2-CZ3 3.55Å; W160-W402 AromaticContact CZ2-CH2 3.65Å; W160-W402 HydrophobicContact CZ2-CH2 3.65Å; W160-W402 AromaticContact CZ2-CZ3 3.71Å; W160-W402 HydrophobicContact CZ2-CZ3 3.71Å; W160-K409 HydrophobicContact CZ2-CG 4.49Å; W160-P410 PolarHBondContact NE1-O 3.22Å; W160-P410 VanDerWaalsContact NE1-O 3.08Å
161	N	82.9	Confident	90.1	Very high	59 Å²	59	32 Å²	32	32%	0.316	16%	0.161	S	C	.	.			trans	-96.5	-18.7	-173.7	-63.8	-24.2	0	0	0	113.8	R208 K211	N161-R208 PolarHBondContact OD1-O 3.02Å; N161-K211 PolarHBondContact O-N 3.43Å; N161-K211 VanDerWaalsContact O-O 3.12Å
162	H	85.3	Confident	90	Very high	59 Å²	59	32.4 Å²	32.4	27%	0.273	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.9	-177.6	-57.1	-80.9	0	0	0	108.7	A237	H162-A237 HydrophobicContact CB-CB 3.97Å
163	I	91	Very high	90	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	155	179.7	66	168.1	0	0	0	111	M155 L180 K211 A212 E213 V239 I241	M155-I163 HydrophobicContact CE-CD1 3.76Å; M155-I163 HydrophobicContact CG-CG2 4.26Å; M155-I163 HydrophobicContact SD-CD1 3.84Å; M155-I163 HydrophobicContact SD-CG2 3.89Å; I163-L180 HydrophobicContact CD1-CD2 3.95Å; I163-K211 PolarHBondContact N-O 3.11Å; I163-A212 HydrophobicContact CD1-CB 4.42Å; I163-A212 HydrophobicContact CG1-CB 4.17Å; I163-E213 PolarHBondContact O-N 3.21Å; I163-V239 WeakPolarHBondContact CA-O 3.35Å; I163-V239 HydrophobicContact CG2-CB 4.15Å; I163-V239 HydrophobicContact CG2-CG1 4.06Å; I163-I241 HydrophobicContact CB-CD1 4.47Å; I163-I241 HydrophobicContact CD1-CD1 3.66Å
164	I	93.3	Very high	90.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.6	167.9	-51.4	173.8	0	0	0	107	L166 L216 A232 L235 A237 V239 I240 I241	I164-L166 HydrophobicContact CB-CD1 4.49Å; I164-L166 HydrophobicContact CG2-CD1 3.65Å; I164-L216 HydrophobicContact CG2-CD1 3.91Å; I164-L216 HydrophobicContact CG2-CG 4.39Å; I164-A232 HydrophobicContact CD1-CB 4.49Å; I164-L235 HydrophobicContact CD1-CB 4.11Å; I164-L235 HydrophobicContact CD1-CD1 3.91Å; I164-L235 HydrophobicContact CG1-CD1 4.03Å; I164-L235 HydrophobicContact CG2-CD1 4.29Å; I164-A237 HydrophobicContact CD1-CB 4.14Å; I164-A237 HydrophobicContact CG1-CB 3.66Å; I164-V239 PolarHBondContact N-O 3.14Å; I164-I240 HydrophobicContact CB-CG1 4.39Å; I164-I240 HydrophobicContact CD1-CG1 4.31Å; I164-I240 WeakPolarHBondContact O-CA 3.36Å; I164-I241 PolarHBondContact O-N 3.41Å
165	L	94.6	Very high	90.2	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.016	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.8	175.4	179.7	66	0	0	0	109.5	V167 Q177 L180 K214 V215 L216 I241	L165-V167 HydrophobicContact CD1-CG1 3.88Å; L165-V167 HydrophobicContact CD2-CG1 4.04Å; L165-V167 HydrophobicContact CG-CG1 3.8Å; L165-Q177 HydrophobicContact CD2-CB 3.97Å; L165-Q177 HydrophobicContact CD2-CG 3.98Å; L165-L180 HydrophobicContact CD1-CD2 4.13Å; L165-L180 HydrophobicContact CD2-CD2 4.23Å; L165-K214 PolarHBondContact N-O 3.37Å; L165-K214 VanDerWaalsContact N-O 3.12Å; L165-V215 HydrophobicContact CB-CG1 4.4Å; L165-V215 HydrophobicContact CB-CG2 4.33Å; L165-V215 HydrophobicContact CD2-CG1 4.04Å; L165-V215 HydrophobicContact CD2-CG2 4.24Å; L165-V215 HydrophobicContact CG-CG1 4.34Å; L165-V215 WeakPolarHBondContact O-CA 3.35Å; L165-L216 PolarHBondContact O-N 3.3Å; L165-I241 HydrophobicContact CD1-CB 3.98Å; L165-I241 HydrophobicContact CD1-CG2 3.99Å
166	L	95.1	Very high	90.4	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	119	169.9	-82.6	86.8	0	0	0	109.3	I164 L216 L229 I240 I241 L242 S243	I164-L166 HydrophobicContact CB-CD1 4.49Å; I164-L166 HydrophobicContact CG2-CD1 3.65Å; L166-L216 WeakPolarHBondContact CA-O 3.22Å; L166-L216 HydrophobicContact CD1-CD1 4.34Å; L166-L216 HydrophobicContact CG-CB 4.19Å; L166-L229 HydrophobicContact CD2-CD2 3.85Å; L166-I240 HydrophobicContact CD1-CG2 3.63Å; L166-I241 PolarHBondContact N-O 2.99Å; L166-L242 HydrophobicContact CB-CD1 3.9Å; L166-L242 WeakPolarHBondContact O-CA 3.48Å; L166-S243 PolarHBondContact O-N 2.81Å
167	V	95.4	Very high	90.8	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140.9	-178.8	-74.9	0	0	0	0	110.3	L165 Q177 V215 L216 Q217 F218	L165-V167 HydrophobicContact CD1-CG1 3.88Å; L165-V167 HydrophobicContact CD2-CG1 4.04Å; L165-V167 HydrophobicContact CG-CG1 3.8Å; V167-Q177 HydrophobicContact CG1-CB 4.47Å; V167-V215 HydrophobicContact CG2-CG1 4Å; V167-L216 PolarHBondContact N-O 3.42Å; V167-L216 VanDerWaalsContact N-O 3.09Å; V167-Q217 HydrophobicContact CG2-CG 3.79Å; V167-Q217 WeakPolarHBondContact O-CA 3.19Å; V167-F218 VanDerWaalsContact O-CD1 3.26Å; V167-F218 WeakPolarHBondContact O-CD1 3.3Å; V167-F218 PolarHBondContact O-N 3.14Å; V167-F218 VanDerWaalsContact O-N 3.15Å
168	S	94.4	Very high	91	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.014	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	143.6	165.6	44.7	0	0	0	0	110.5	D170 G173 F218 S243	S168-D170 WeakPolarHBondContact CB-OD1 3.32Å; S168-D170 PolarHBondContact O-N 3.46Å; S168-D170 PolarHBondContact OG-OD1 2.79Å; S168-G173 WeakPolarHBondContact O-CA 3.49Å; S168-F218 CarbonylContact C-O 3.59Å; S168-F218 WeakPolarHBondContact CA-O 3.47Å; S168-S243 PolarHBondContact N-O 3.07Å
169	D	93.9	Very high	91.2	Very high	65 Å²	65	38.9 Å²	38.9	35%	0.348	19%	0.188	S	C	.	.	S	Bend	trans	-78.6	57.9	172.8	-168.9	23.2	0	0	0	111.6	R174 F218	D169-R174 IonicContact OD1-NE 3.18Å; D169-F218 PolarHBondContact N-O 2.56Å
170	D	91.3	Very high	91.4	Very high	42 Å²	42	35 Å²	35	23%	0.225	16%	0.161	C	C	.	.	S	Bend	trans	-118.3	176	172	70.7	-26.1	0	0	0	110.4	S168 E172 G173 R174	S168-D170 WeakPolarHBondContact CB-OD1 3.32Å; S168-D170 PolarHBondContact O-N 3.46Å; S168-D170 PolarHBondContact OG-OD1 2.79Å; D170-E172 PolarHBondContact O-N 3.35Å; D170-E172 WeakPolarHBondContact OD2-CB 3.23Å; D170-G173 WeakPolarHBondContact OD1-CA 3.47Å; D170-G173 PolarHBondContact OD1-N 3.01Å; D170-R174 WeakPolarHBondContact O-CB 3.41Å; D170-R174 WeakPolarHBondContact O-CG 3.4Å; D170-R174 PolarHBondContact O-N 3.43Å; D170-R174 VanDerWaalsContact O-N 3.13Å; D170-R174 PolarHBondContact O-NE 2.95Å
171	H	90.1	Very high	91.5	Very high	73 Å²	73	38.2 Å²	38.2	34%	0.338	18%	0.177	S	C	.	.	H	α-helix	trans	-62.5	-32.2	177.6	-174.9	-69.5	0	0	0	111.4	I127 A175	I127-H171 VanDerWaalsContact CA-CE1 3.49Å; I127-H171 WeakPolarHBondContact CA-CE1 3.5Å; H171-A175 WeakPolarHBondContact O-CB 3.29Å; H171-A175 PolarHBondContact O-N 3.13Å
172	E	89.7	Confident	91.7	Very high	11 Å²	11	37.4 Å²	37.4	5%	0.051	17%	0.174	C	C	.	.	H	α-helix	trans	-69.8	-51.2	-179.9	-167.9	59.2	-123.6	0	0	111.7	S126 Y144 S145 D170 R174 A175 A176	S126-E172 WeakPolarHBondContact CB-OE1 3.18Å; S126-E172 VanDerWaalsContact CB-OE2 3.23Å; S126-E172 WeakPolarHBondContact CB-OE2 3.44Å; S126-E172 PolarHBondContact N-OE2 3.46Å; S126-E172 PolarHBondContact OG-OE1 3.13Å; S126-E172 PolarHBondContact OG-OE2 2.97Å; Y144-E172 VanDerWaalsContact CB-OE1 3.32Å; Y144-E172 WeakPolarHBondContact CB-OE1 3.43Å; S145-E172 PolarHBondContact N-OE1 2.86Å; D170-E172 PolarHBondContact O-N 3.35Å; D170-E172 WeakPolarHBondContact OD2-CB 3.23Å; E172-R174 PolarHBondContact O-N 3.29Å; E172-A175 PolarHBondContact O-N 3.05Å; E172-A176 WeakPolarHBondContact O-CB 3.3Å; E172-A176 PolarHBondContact O-N 3.02Å
173	G	91.4	Very high	91.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60	-43.5	178.1	0	0	0	0	0	112.4	S168 D170 A175 A176 Q177	S168-G173 WeakPolarHBondContact O-CA 3.49Å; D170-G173 WeakPolarHBondContact OD1-CA 3.47Å; D170-G173 PolarHBondContact OD1-N 3.01Å; G173-A175 PolarHBondContact O-N 3.46Å; G173-A176 PolarHBondContact O-N 3.43Å; G173-Q177 WeakPolarHBondContact O-CB 3.2Å; G173-Q177 PolarHBondContact O-N 2.95Å
174	R	91.9	Very high	91.4	Very high	136 Å²	136	36.7 Å²	36.7	51%	0.513	17%	0.172	S	C	.	.	H	α-helix	trans	-65.2	-37.5	175.2	-70	-175	-67.3	176.4	-4.7	113	D169 D170 E172 K178	D169-R174 IonicContact OD1-NE 3.18Å; D170-R174 WeakPolarHBondContact O-CB 3.41Å; D170-R174 WeakPolarHBondContact O-CG 3.4Å; D170-R174 PolarHBondContact O-N 3.43Å; D170-R174 VanDerWaalsContact O-N 3.13Å; D170-R174 PolarHBondContact O-NE 2.95Å; E172-R174 PolarHBondContact O-N 3.29Å; R174-K178 VanDerWaalsContact O-CB 3.28Å; R174-K178 WeakPolarHBondContact O-CB 3.37Å; R174-K178 PolarHBondContact O-N 3.29Å
175	A	92.4	Very high	90.6	Very high	22 Å²	22	42.9 Å²	42.9	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-67.2	-41	175.1	0	0	0	0	0	111.7	H171 E172 G173 R179	H171-A175 WeakPolarHBondContact O-CB 3.29Å; H171-A175 PolarHBondContact O-N 3.13Å; E172-A175 PolarHBondContact O-N 3.05Å; G173-A175 PolarHBondContact O-N 3.46Å; A175-R179 VanDerWaalsContact O-CB 3.28Å; A175-R179 WeakPolarHBondContact O-CB 3.46Å; A175-R179 PolarHBondContact O-N 3.24Å
176	A	92.3	Very high	89.4	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-44.4	175.2	0	0	0	0	0	111.9	E172 G173 R179 L180	E172-A176 WeakPolarHBondContact O-CB 3.3Å; E172-A176 PolarHBondContact O-N 3.02Å; G173-A176 PolarHBondContact O-N 3.43Å; A176-R179 PolarHBondContact O-N 3.36Å; A176-L180 WeakPolarHBondContact O-CB 3.24Å; A176-L180 PolarHBondContact O-N 3.47Å
177	Q	92.9	Very high	88.1	Confident	27 Å²	27	51.1 Å²	51.1	13%	0.126	24%	0.235	C	C	.	.	H	α-helix	trans	-57.3	-56.8	173.4	175.7	-175.8	-9.3	0	0	111	L165 V167 G173 R179 L180 E181 V215	L165-Q177 HydrophobicContact CD2-CB 3.97Å; L165-Q177 HydrophobicContact CD2-CG 3.98Å; V167-Q177 HydrophobicContact CG1-CB 4.47Å; G173-Q177 WeakPolarHBondContact O-CB 3.2Å; G173-Q177 PolarHBondContact O-N 2.95Å; Q177-R179 VanDerWaalsContact C-N 3.26Å; Q177-R179 PolarHBondContact O-N 3.38Å; Q177-L180 PolarHBondContact O-N 2.86Å; Q177-L180 VanDerWaalsContact O-N 3.11Å; Q177-E181 HydrophobicContact CG-CG 4.37Å; Q177-E181 VanDerWaalsContact CG-OE1 3.31Å; Q177-E181 WeakPolarHBondContact CG-OE1 3.49Å; Q177-E181 PolarHBondContact NE2-OE1 3.09Å; Q177-E181 WeakPolarHBondContact O-CG 3.36Å; Q177-E181 PolarHBondContact O-N 3.5Å; Q177-V215 HydrophobicContact CG-CG1 4.24Å
178	K	91.9	Very high	86.4	Confident	146 Å²	146	54.6 Å²	54.6	64%	0.635	25%	0.251	S	S	*	.	H	α-helix	trans	-55.6	-44	-179.6	-177.1	179.1	-179.7	-178	0	111	R174 E181 T182	R174-K178 VanDerWaalsContact O-CB 3.28Å; R174-K178 WeakPolarHBondContact O-CB 3.37Å; R174-K178 PolarHBondContact O-N 3.29Å; K178-E181 PolarHBondContact O-N 3.42Å; K178-T182 WeakPolarHBondContact O-CG2 3.4Å; K178-T182 PolarHBondContact O-N 3.15Å; K178-T182 PolarHBondContact O-OG1 3.25Å
179	R	91	Very high	84.4	Confident	81 Å²	81	57.3 Å²	57.3	31%	0.306	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-45.5	179.1	-173.4	65.1	179.4	165.7	3.3	111.4	S148 A175 A176 Q177 T182 L183	S148-R179 WeakPolarHBondContact OG-CB 3.21Å; S148-R179 WeakPolarHBondContact OG-CG 3.12Å; A175-R179 VanDerWaalsContact O-CB 3.28Å; A175-R179 WeakPolarHBondContact O-CB 3.46Å; A175-R179 PolarHBondContact O-N 3.24Å; A176-R179 PolarHBondContact O-N 3.36Å; Q177-R179 VanDerWaalsContact C-N 3.26Å; Q177-R179 PolarHBondContact O-N 3.38Å; R179-T182 PolarHBondContact O-N 3.47Å; R179-T182 PolarHBondContact O-OG1 2.93Å; R179-L183 WeakPolarHBondContact O-CG 3.46Å; R179-L183 PolarHBondContact O-N 2.87Å; R179-L183 VanDerWaalsContact O-N 3.17Å
180	L	91	Very high	82.6	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-62.8	-44.1	177.4	-173.5	59.9	0	0	0	111.5	F152 M155 I163 L165 A176 Q177 T182 L183 L184 I241	F152-L180 HydrophobicContact CB-CD1 4.36Å; M155-L180 HydrophobicContact CE-CD1 3.97Å; M155-L180 HydrophobicContact CE-CD2 4.46Å; I163-L180 HydrophobicContact CD1-CD2 3.95Å; L165-L180 HydrophobicContact CD1-CD2 4.13Å; L165-L180 HydrophobicContact CD2-CD2 4.23Å; A176-L180 WeakPolarHBondContact O-CB 3.24Å; A176-L180 PolarHBondContact O-N 3.47Å; Q177-L180 PolarHBondContact O-N 2.86Å; Q177-L180 VanDerWaalsContact O-N 3.11Å; L180-T182 PolarHBondContact O-N 3.13Å; L180-L183 WeakPolarHBondContact O-CB 3.39Å; L180-L183 PolarHBondContact O-N 3.41Å; L180-L183 VanDerWaalsContact O-N 3.16Å; L180-L184 HydrophobicContact CG-CD1 4.21Å; L180-L184 VanDerWaalsContact O-CG 3.27Å; L180-L184 WeakPolarHBondContact O-CG 3.09Å; L180-L184 PolarHBondContact O-N 3.15Å; L180-I241 HydrophobicContact CD2-CD1 4.3Å
181	E	88.8	Confident	80.7	Confident	71 Å²	71	61.7 Å²	61.7	33%	0.332	29%	0.292	S	S	.	.	H	α-helix	trans	-57.5	-47.1	175.6	-73	171	175.3	0	0	111.7	Q177 K178 L183 L184 E185	Q177-E181 HydrophobicContact CG-CG 4.37Å; Q177-E181 VanDerWaalsContact CG-OE1 3.31Å; Q177-E181 WeakPolarHBondContact CG-OE1 3.49Å; Q177-E181 PolarHBondContact NE2-OE1 3.09Å; Q177-E181 WeakPolarHBondContact O-CG 3.36Å; Q177-E181 PolarHBondContact O-N 3.5Å; K178-E181 PolarHBondContact O-N 3.42Å; E181-L183 VanDerWaalsContact C-N 3.28Å; E181-L183 PolarHBondContact O-N 3.09Å; E181-L184 PolarHBondContact O-N 2.76Å; E181-L184 VanDerWaalsContact O-N 3.08Å; E181-E185 WeakPolarHBondContact O-CG 3.3Å; E181-E185 PolarHBondContact O-N 2.53Å
182	T	89	Confident	78.8	Confident	42 Å²	42	64.8 Å²	64.8	26%	0.258	31%	0.305	S	S	.	.	H	α-helix	trans	-58.8	-38.1	176.6	57.4	0	0	0	0	112.8	K178 R179 L180 L184 E185 E186	K178-T182 WeakPolarHBondContact O-CG2 3.4Å; K178-T182 PolarHBondContact O-N 3.15Å; K178-T182 PolarHBondContact O-OG1 3.25Å; R179-T182 PolarHBondContact O-N 3.47Å; R179-T182 PolarHBondContact O-OG1 2.93Å; L180-T182 PolarHBondContact O-N 3.13Å; T182-L184 VanDerWaalsContact C-N 3.35Å; T182-E185 PolarHBondContact O-N 2.93Å; T182-E186 WeakPolarHBondContact O-CB 3.44Å; T182-E186 WeakPolarHBondContact O-CG 3.43Å; T182-E186 PolarHBondContact O-N 2.99Å
183	L	86.3	Confident	76.9	Confident	22 Å²	22	72.2 Å²	72.2	12%	0.115	34%	0.336	C	S	.	.	H	α-helix	trans	-68.1	-35	177.5	-67.1	171.2	0	0	0	112.3	F152 R179 L180 E181	F152-L183 HydrophobicContact CB-CD1 4.08Å; F152-L183 HydrophobicContact CD2-CB 4.05Å; F152-L183 HydrophobicContact CE2-CB 4.3Å; F152-L183 HydrophobicContact CG-CB 4.19Å; F152-L183 HydrophobicContact CG-CD1 4.4Å; R179-L183 WeakPolarHBondContact O-CG 3.46Å; R179-L183 PolarHBondContact O-N 2.87Å; R179-L183 VanDerWaalsContact O-N 3.17Å; L180-L183 WeakPolarHBondContact O-CB 3.39Å; L180-L183 PolarHBondContact O-N 3.41Å; L180-L183 VanDerWaalsContact O-N 3.16Å; E181-L183 VanDerWaalsContact C-N 3.28Å; E181-L183 PolarHBondContact O-N 3.09Å
184	L	82.7	Confident	74.9	Confident	22 Å²	22	81.3 Å²	81.3	12%	0.115	37%	0.371	C	S	.	.	H	α-helix	trans	-69.7	-43.3	176	-61	166.9	0	0	0	110.6	F152 L180 E181 T182 E188 P210 A212	F152-L184 HydrophobicContact CD2-CD2 4.09Å; F152-L184 HydrophobicContact CE2-CD2 3.99Å; L180-L184 HydrophobicContact CG-CD1 4.21Å; L180-L184 VanDerWaalsContact O-CG 3.27Å; L180-L184 WeakPolarHBondContact O-CG 3.09Å; L180-L184 PolarHBondContact O-N 3.15Å; E181-L184 PolarHBondContact O-N 2.76Å; E181-L184 VanDerWaalsContact O-N 3.08Å; T182-L184 VanDerWaalsContact C-N 3.35Å; L184-E188 PolarHBondContact O-N 2.98Å; L184-P210 HydrophobicContact CD2-CB 4.16Å; L184-P210 HydrophobicContact CD2-CG 3.97Å; L184-P210 WeakPolarHBondContact CD2-O 3.36Å; L184-A212 HydrophobicContact CD1-CB 4.36Å
185	E	76.8	Confident	72.6	Confident	129 Å²	129	78.8 Å²	78.8	60%	0.603	37%	0.368	S	S	*	.	H	α-helix	trans	-68.6	-43.7	179.8	-71.6	-178.7	172.9	0	0	114.1	E181 T182 R187 E188 S189	E181-E185 WeakPolarHBondContact O-CG 3.3Å; E181-E185 PolarHBondContact O-N 2.53Å; T182-E185 PolarHBondContact O-N 2.93Å; E185-R187 PolarHBondContact O-N 2.77Å; E185-E188 PolarHBondContact O-N 2.89Å; E185-S189 PolarHBondContact O-N 2.86Å; E185-S189 PolarHBondContact O-OG 3.49Å; E185-S189 VanDerWaalsContact O-OG 3.13Å
186	E	69.9	Low	70.5	Confident	93 Å²	93	87.3 Å²	87.3	44%	0.435	40%	0.396	S	S	.	.	H	α-helix	trans	-56.7	-33.2	178.7	-84	-171.3	-161.9	0	0	112	T182 S189 K190	T182-E186 WeakPolarHBondContact O-CB 3.44Å; T182-E186 WeakPolarHBondContact O-CG 3.43Å; T182-E186 PolarHBondContact O-N 2.99Å; E186-S189 WeakPolarHBondContact CA-OG 2.99Å; E186-S189 PolarHBondContact O-OG 2.83Å; E186-K190 WeakPolarHBondContact O-CB 3.13Å; E186-K190 WeakPolarHBondContact O-CG 2.91Å; E186-K190 PolarHBondContact O-N 2.85Å; E186-K190 VanDerWaalsContact O-N 3.13Å; E186-K190 IonicContact OE2-NZ 2.84Å
187	R	66.1	Low	68.4	Low	86 Å²	86	95 Å²	95	33%	0.325	43%	0.432	S	S	.	.	H	α-helix	trans	-78.2	-41.8	178.3	-172.2	172.7	176.7	-176.9	-4.6	112.1	F152 E185 S189 K190 S191	F152-R187 HydrophobicContact CZ-CB 4.48Å; E185-R187 PolarHBondContact O-N 2.77Å; R187-S189 VanDerWaalsContact C-N 3.27Å; R187-S189 PolarHBondContact O-N 2.84Å; R187-K190 PolarHBondContact O-N 2.65Å; R187-S191 WeakPolarHBondContact O-CB 3.45Å; R187-S191 PolarHBondContact O-N 2.81Å
188	E	60.1	Low	65.9	Low	73 Å²	73	99.6 Å²	99.6	34%	0.341	46%	0.458	S	S	.	.	H	α-helix	trans	-58.7	-42.6	174.4	-73	-158.3	165.3	0	0	111.4	L184 E185 S191 K192 K211	L184-E188 PolarHBondContact O-N 2.98Å; E185-E188 PolarHBondContact O-N 2.89Å; E188-S191 PolarHBondContact O-N 2.94Å; E188-K192 WeakPolarHBondContact O-CB 3.36Å; E188-K192 VanDerWaalsContact O-CG 3.31Å; E188-K192 WeakPolarHBondContact O-CG 3.46Å; E188-K192 PolarHBondContact O-N 2.94Å; E188-K192 IonicContact OE2-NZ 3.19Å; E188-K211 WeakPolarHBondContact OE1-CE 3.32Å; E188-K211 IonicContact OE1-NZ 2.82Å; E188-K211 PolarHBondContact OE1-NZ 2.9Å
189	S	53.2	Low	63.6	Low	60 Å²	60	99.4 Å²	99.4	42%	0.42	46%	0.463	S	S	.	.	H	α-helix	trans	-69.7	-40.8	179.8	60.2	0	0	0	0	113.2	E185 E186 R187 K192 K193	E185-S189 PolarHBondContact O-N 2.86Å; E185-S189 PolarHBondContact O-OG 3.49Å; E185-S189 VanDerWaalsContact O-OG 3.13Å; E186-S189 WeakPolarHBondContact CA-OG 2.99Å; E186-S189 PolarHBondContact O-OG 2.83Å; R187-S189 VanDerWaalsContact C-N 3.27Å; R187-S189 PolarHBondContact O-N 2.84Å; S189-K192 PolarHBondContact O-N 3.48Å; S189-K193 PolarHBondContact O-N 2.84Å
190	K	55.5	Low	61.1	Low	139 Å²	139	103.2 Å²	103.2	60%	0.604	49%	0.489	S	S	*	.	H	α-helix	trans	-64.3	-38.5	172.3	-76.5	172.4	-177.9	162	0	112.1	E186 R187 R194	E186-K190 WeakPolarHBondContact O-CB 3.13Å; E186-K190 WeakPolarHBondContact O-CG 2.91Å; E186-K190 PolarHBondContact O-N 2.85Å; E186-K190 VanDerWaalsContact O-N 3.13Å; E186-K190 IonicContact OE2-NZ 2.84Å; R187-K190 PolarHBondContact O-N 2.65Å; K190-R194 PolarHBondContact O-N 2.9Å; K190-R194 VanDerWaalsContact O-N 3.16Å
191	S	51.1	Low	58.6	Low	59 Å²	59	111.6 Å²	111.6	41%	0.413	53%	0.529	S	S	.	.	H	α-helix	trans	-63.7	-41.3	173.1	-166.8	0	0	0	0	111.5	R187 E188 N195	R187-S191 WeakPolarHBondContact O-CB 3.45Å; R187-S191 PolarHBondContact O-N 2.81Å; E188-S191 PolarHBondContact O-N 2.94Å; S191-N195 PolarHBondContact O-N 2.85Å; S191-N195 PolarHBondContact O-ND2 3.32Å; S191-N195 PolarHBondContact O-OD1 3.15Å
192	K	51.1	Low	56.4	Low	139 Å²	139	116.4 Å²	116.4	60%	0.604	56%	0.556	S	S	*	*	H	α-helix	trans	-67.4	-41.2	176.9	-75.8	170.5	-177.7	165.1	0	112.9	E188 S189 N195	E188-K192 WeakPolarHBondContact O-CB 3.36Å; E188-K192 VanDerWaalsContact O-CG 3.31Å; E188-K192 WeakPolarHBondContact O-CG 3.46Å; E188-K192 PolarHBondContact O-N 2.94Å; E188-K192 IonicContact OE2-NZ 3.19Å; S189-K192 PolarHBondContact O-N 3.48Å; K192-N195 WeakPolarHBondContact O-CB 3.49Å; K192-N195 PolarHBondContact O-N 3.18Å
193	K	49.4	Very low	53.8	Low	166 Å²	166	118.2 Å²	118.2	72%	0.722	57%	0.57	S	S	*	*	H	α-helix	trans	-65.2	-42	178	-83.9	-175.3	176.1	-179.6	0	112.8	S189 N195 Y196	S189-K193 PolarHBondContact O-N 2.84Å; K193-N195 PolarHBondContact O-N 2.64Å; K193-Y196 PolarHBondContact O-N 3.32Å
194	R	49	Very low	51.6	Low	192 Å²	192	126 Å²	126	73%	0.725	60%	0.599	S	S	*	*	H	α-helix	trans	-62.3	-26.3	176.6	-154.8	177.4	-171	-175.2	1.4	112.7	K190	K190-R194 PolarHBondContact O-N 2.9Å; K190-R194 VanDerWaalsContact O-N 3.16Å
195	N	45.1	Very low	49.3	Very low	83 Å²	83	131.8 Å²	131.8	44%	0.444	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.5	-14.7	179.8	-68.1	-9.7	0	0	0	114	S191 K192 K193	S191-N195 PolarHBondContact O-N 2.85Å; S191-N195 PolarHBondContact O-ND2 3.32Å; S191-N195 PolarHBondContact O-OD1 3.15Å; K192-N195 WeakPolarHBondContact O-CB 3.49Å; K192-N195 PolarHBondContact O-N 3.18Å; K193-N195 PolarHBondContact O-N 2.64Å
196	Y	46.5	Very low	47.9	Very low	200 Å²	200	130.6 Å²	130.6	78%	0.784	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-17.1	176.5	-159	-98	0	0	0	112.6	K193	K193-Y196 PolarHBondContact O-N 3.32Å
197	E	49	Very low	47	Very low	163 Å²	163	135.3 Å²	135.3	76%	0.762	65%	0.647	S	S	*	*	S	Bend	trans	-94.9	-12.1	-178.5	-71	178.3	166.5	0	0	114
198	N	40	Very low	46.6	Very low	124 Å²	124	138.1 Å²	138.1	66%	0.663	66%	0.657	S	S	*	*			trans	-131.9	87.4	177.8	-71.6	-70.5	0	0	0	110.2
199	L	44.4	Very low	46.7	Very low	142 Å²	142	135.8 Å²	135.8	74%	0.743	65%	0.652	S	S	*	*			trans	-80.6	-9.8	-174.6	-139.9	83.2	0	0	0	114.4
200	D	38.6	Very low	47.7	Very low	161 Å²	161	133.3 Å²	133.3	86%	0.861	64%	0.635	S	S	*	*	S	Bend	trans	-106.9	2.1	-164.3	-95.9	-8.5	0	0	0	117.2
201	Q	38.5	Very low	48.7	Very low	178 Å²	178	130 Å²	130	83%	0.832	62%	0.621	S	S	*	*			trans	-136.8	86.7	173.2	-96.9	162.6	-5.9	0	0	110.8	S203	Q201-S203 PolarHBondContact O-N 3.34Å
202	L	41.2	Very low	49.9	Very low	172 Å²	172	128.9 Å²	128.9	90%	0.901	62%	0.615	S	S	*	*			trans	-65.1	65.6	158.8	-96.5	141.9	0	0	0	109.5	Y204	L202-Y204 PolarHBondContact O-N 3.32Å
203	S	34.7	Very low	51.2	Low	79 Å²	79	124.7 Å²	124.7	55%	0.552	60%	0.598	S	S	*	*			trans	-71.6	122.8	166.6	167.8	0	0	0	0	108.3	Q201 D205	Q201-S203 PolarHBondContact O-N 3.34Å; S203-D205 PolarHBondContact O-N 3.03Å
204	Y	40.6	Very low	52.9	Low	187 Å²	187	119.8 Å²	119.8	73%	0.733	58%	0.576	S	S	*	*	S	Bend	trans	-65.2	3.7	-175.7	-134.5	-102.1	0	0	0	114.3	L202 N206 Q791	L202-Y204 PolarHBondContact O-N 3.32Å; Y204-N206 PolarHBondContact O-N 3.01Å; Y204-Q791 VanDerWaalsContact OH-CD 3.3Å; Y204-Q791 PolarHBondContact OH-NE2 3.32Å
205	D	34.5	Very low	54.9	Low	142 Å²	142	112.7 Å²	112.7	76%	0.759	55%	0.554	S	S	*	*			trans	-100	43.2	-173.6	-110.7	1.4	0	0	0	113	S203 K207	S203-D205 PolarHBondContact O-N 3.03Å; D205-K207 PolarHBondContact O-N 3.09Å
206	N	46.4	Very low	57.2	Low	105 Å²	105	109 Å²	109	56%	0.561	53%	0.534	S	S	*	.			trans	-68.8	95.8	165.5	-78.4	-40	0	0	0	108.4	Y204 R208	Y204-N206 PolarHBondContact O-N 3.01Å; N206-R208 VanDerWaalsContact C-N 3.26Å; N206-R208 PolarHBondContact O-N 3.14Å
207	K	51.2	Low	59.4	Low	191 Å²	191	104 Å²	104	83%	0.83	52%	0.518	S	S	*	.			trans	-56.5	93.7	165.8	-77.3	-177.3	180	177.7	0	108.3	D205 G209	D205-K207 PolarHBondContact O-N 3.09Å; K207-G209 PolarHBondContact O-N 2.99Å
208	R	58.8	Low	61.5	Low	146 Å²	146	96.9 Å²	96.9	55%	0.551	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-48.4	125.9	176	-72.1	-179.6	-179.1	174.9	-0.2	107.7	N161 N206	N161-R208 PolarHBondContact OD1-O 3.02Å; N206-R208 VanDerWaalsContact C-N 3.26Å; N206-R208 PolarHBondContact O-N 3.14Å
209	G	62.4	Low	64	Low	23 Å²	23	96 Å²	96	24%	0.237	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-64.6	158.1	171.5	0	0	0	0	0	110	K207	K207-G209 PolarHBondContact O-N 2.99Å
210	P	74	Confident	66.2	Low	8 Å²	8	92.7 Å²	92.7	5%	0.052	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-58.8	145.4	170.4	26.9	-32.9	0	0	0	110.3	F152 M155 L184	F152-P210 HydrophobicContact CD2-CG 4.24Å; F152-P210 HydrophobicContact CE2-CG 3.88Å; M155-P210 HydrophobicContact CB-CB 4.25Å; M155-P210 HydrophobicContact CB-CG 4.42Å; M155-P210 HydrophobicContact SD-CB 4.01Å; M155-P210 HydrophobicContact SD-CG 4.47Å; L184-P210 HydrophobicContact CD2-CB 4.16Å; L184-P210 HydrophobicContact CD2-CG 3.97Å; L184-P210 WeakPolarHBondContact CD2-O 3.36Å
211	K	75.1	Confident	68.6	Low	70 Å²	70	87.8 Å²	87.8	30%	0.304	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	145.1	174.3	-63.3	-167.4	-174.2	-165.8	0	109.7	N161 I163 E188 E213 D786	N161-K211 PolarHBondContact O-N 3.43Å; N161-K211 VanDerWaalsContact O-O 3.12Å; I163-K211 PolarHBondContact N-O 3.11Å; E188-K211 WeakPolarHBondContact OE1-CE 3.32Å; E188-K211 IonicContact OE1-NZ 2.82Å; E188-K211 PolarHBondContact OE1-NZ 2.9Å; K211-E213 PolarHBondContact O-N 3.27Å; K211-D786 IonicContact NZ-OD1 3.79Å; K211-D786 IonicContact NZ-OD2 2.83Å; K211-D786 PolarHBondContact NZ-OD2 3.31Å
212	A	77.3	Confident	71.1	Confident	36 Å²	36	81.8 Å²	81.8	30%	0.298	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	121.9	167.5	0	0	0	0	0	109	I163 L184	I163-A212 HydrophobicContact CD1-CB 4.42Å; I163-A212 HydrophobicContact CG1-CB 4.17Å; L184-A212 HydrophobicContact CD1-CB 4.36Å
213	E	78.8	Confident	73.2	Confident	51 Å²	51	82.4 Å²	82.4	24%	0.238	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	-44	174.4	-177.7	179	166.8	0	0	110	I163 K211 E236 A237	I163-E213 PolarHBondContact O-N 3.21Å; K211-E213 PolarHBondContact O-N 3.27Å; E213-E236 PolarHBondContact OE1-N 2.89Å; E213-E236 VanDerWaalsContact OE1-N 3.07Å; E213-A237 HydrophobicContact CB-CB 4.46Å; E213-A237 WeakPolarHBondContact OE2-CA 3.47Å; E213-A237 WeakPolarHBondContact OE2-CB 3.36Å; E213-A237 PolarHBondContact OE2-N 3.37Å
214	K	85.4	Confident	75.9	Confident	62 Å²	62	84.1 Å²	84.1	27%	0.27	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	146.2	176.9	-161.2	158.9	-179.1	170.2	0	111.2	L165 L216 E231 L235	L165-K214 PolarHBondContact N-O 3.37Å; L165-K214 VanDerWaalsContact N-O 3.12Å; K214-L216 HydrophobicContact CD-CD2 4.02Å; K214-L216 HydrophobicContact CG-CD2 3.97Å; K214-L216 HydrophobicContact CG-CG 4.41Å; K214-E231 VanDerWaalsContact CE-OE1 3.23Å; K214-E231 WeakPolarHBondContact CE-OE1 3.45Å; K214-E231 IonicContact NZ-OE1 3.81Å; K214-E231 PolarHBondContact NZ-OE1 3.12Å; K214-L235 HydrophobicContact CB-CD1 3.69Å; K214-L235 HydrophobicContact CD-CD1 4.05Å; K214-L235 HydrophobicContact CD-CD2 4.08Å; K214-L235 HydrophobicContact CG-CD1 4.42Å
215	V	90.3	Very high	78.3	Confident	43 Å²	43	75.7 Å²	75.7	26%	0.261	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124	169.4	-175	0	0	0	0	107.8	L165 V167 Q177 Q217	L165-V215 HydrophobicContact CB-CG1 4.4Å; L165-V215 HydrophobicContact CB-CG2 4.33Å; L165-V215 HydrophobicContact CD2-CG1 4.04Å; L165-V215 HydrophobicContact CD2-CG2 4.24Å; L165-V215 HydrophobicContact CG-CG1 4.34Å; L165-V215 WeakPolarHBondContact O-CA 3.35Å; V167-V215 HydrophobicContact CG2-CG1 4Å; Q177-V215 HydrophobicContact CG-CG1 4.24Å; V215-Q217 HydrophobicContact CG1-CG 4.49Å
216	L	92.4	Very high	81.1	Confident	5 Å²	5	70.7 Å²	70.7	3%	0.026	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	112.3	-178.5	-65.1	178.7	0	0	0	108.2	I164 L165 L166 V167 K214 L228 A232	I164-L216 HydrophobicContact CG2-CD1 3.91Å; I164-L216 HydrophobicContact CG2-CG 4.39Å; L165-L216 PolarHBondContact O-N 3.3Å; L166-L216 WeakPolarHBondContact CA-O 3.22Å; L166-L216 HydrophobicContact CD1-CD1 4.34Å; L166-L216 HydrophobicContact CG-CB 4.19Å; V167-L216 PolarHBondContact N-O 3.42Å; V167-L216 VanDerWaalsContact N-O 3.09Å; K214-L216 HydrophobicContact CD-CD2 4.02Å; K214-L216 HydrophobicContact CG-CD2 3.97Å; K214-L216 HydrophobicContact CG-CG 4.41Å; L216-L228 HydrophobicContact CB-CD1 3.97Å; L216-L228 HydrophobicContact CB-CD2 4.27Å; L216-L228 HydrophobicContact CB-CG 4.18Å; L216-L228 HydrophobicContact CD1-CD1 4.48Å; L216-L228 HydrophobicContact CD1-CG 4.37Å; L216-L228 HydrophobicContact CD2-CD1 3.96Å; L216-L228 HydrophobicContact CG-CD1 4.35Å; L216-A232 HydrophobicContact CD1-CB 3.53Å
217	Q	93	Very high	83.2	Confident	95 Å²	95	69.2 Å²	69.2	44%	0.444	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	140.6	178.2	-71.5	171	-8.2	0	0	109.6	V167 V215	V167-Q217 HydrophobicContact CG2-CG 3.79Å; V167-Q217 WeakPolarHBondContact O-CA 3.19Å; V215-Q217 HydrophobicContact CG1-CG 4.49Å
218	F	93.8	Very high	85.1	Confident	15 Å²	15	61.7 Å²	61.7	7%	0.066	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	145.5	174.4	69	-88.2	0	0	0	111.7	V167 S168 D169 L228 L242 A244 D248 V252	V167-F218 VanDerWaalsContact O-CD1 3.26Å; V167-F218 WeakPolarHBondContact O-CD1 3.3Å; V167-F218 PolarHBondContact O-N 3.14Å; V167-F218 VanDerWaalsContact O-N 3.15Å; S168-F218 CarbonylContact C-O 3.59Å; S168-F218 WeakPolarHBondContact CA-O 3.47Å; D169-F218 PolarHBondContact N-O 2.56Å; F218-L228 HydrophobicContact CB-CD2 3.81Å; F218-L228 HydrophobicContact CD1-CD2 4.48Å; F218-L242 HydrophobicContact CE1-CD1 4.31Å; F218-A244 HydrophobicContact CZ-CB 3.89Å; F218-D248 HydrophobicContact CE2-CB 3.91Å; F218-D248 HydrophobicContact CZ-CB 4.2Å; F218-V252 HydrophobicContact CZ-CG2 4.38Å
219	D	93.1	Very high	86.7	Confident	105 Å²	105	54.8 Å²	54.8	56%	0.561	32%	0.316	S	S	*	.			trans	-71.7	132.2	179.7	-64.3	-46.4	0	0	0	111	T222	D219-T222 VanDerWaalsContact O-CB 3.3Å; D219-T222 WeakPolarHBondContact O-CB 3.49Å; D219-T222 PolarHBondContact O-N 3.42Å; D219-T222 PolarHBondContact O-OG1 3.34Å
220	P	90.9	Very high	88.1	Confident	72 Å²	72	58.6 Å²	58.6	47%	0.468	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	142.6	-179.5	26.2	-34	0	0	0	111.7	T222	P220-T222 VanDerWaalsContact C-N 3.28Å; P220-T222 PolarHBondContact O-N 3.07Å
221	G	88.3	Confident	88.8	Confident	59 Å²	59	62 Å²	62	61%	0.608	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-0.7	-178.6	0	0	0	0	0	115.1	K223 D248	G221-K223 PolarHBondContact O-N 3.21Å; G221-D248 PolarHBondContact N-OD1 3.41Å
222	T	90.2	Very high	89.5	Confident	51 Å²	51	58.7 Å²	58.7	31%	0.313	33%	0.33	S	S	.	.			trans	-69	122.6	175.3	-58.8	0	0	0	0	111	D219 P220 N224 V225	D219-T222 VanDerWaalsContact O-CB 3.3Å; D219-T222 WeakPolarHBondContact O-CB 3.49Å; D219-T222 PolarHBondContact O-N 3.42Å; D219-T222 PolarHBondContact O-OG1 3.34Å; P220-T222 VanDerWaalsContact C-N 3.28Å; P220-T222 PolarHBondContact O-N 3.07Å; T222-N224 WeakPolarHBondContact CG2-O 3.42Å; T222-V225 HydrophobicContact CG2-CG1 4.38Å
223	K	87.1	Confident	90.1	Very high	185 Å²	185	61.2 Å²	61.2	80%	0.804	34%	0.335	S	S	*	.	S	Bend	trans	-80.1	-26.8	-179.9	-66.5	-174.4	-179.5	178.6	0	113.8	G221	G221-K223 PolarHBondContact O-N 3.21Å
224	N	89.6	Confident	90.5	Very high	115 Å²	115	65.6 Å²	65.6	62%	0.615	36%	0.355	S	S	*	.			trans	-114.7	101.7	-176.4	-168.5	12.4	0	0	0	111.2	T222 T226	T222-N224 WeakPolarHBondContact CG2-O 3.42Å; N224-T226 WeakPolarHBondContact OD1-CG2 3.45Å; N224-T226 PolarHBondContact OD1-N 3.22Å; N224-T226 PolarHBondContact OD1-OG1 2.85Å
225	V	92.1	Very high	90.5	Very high	10 Å²	10	63.5 Å²	63.5	6%	0.061	35%	0.347	C	S	.	.			trans	-110.4	13.6	179.3	-64.1	0	0	0	0	112.3	T222 A227 L228 L229 V252 A255	T222-V225 HydrophobicContact CG2-CG1 4.38Å; V225-A227 PolarHBondContact O-N 2.05Å; V225-L228 PolarHBondContact O-N 2.62Å; V225-L229 HydrophobicContact CG2-CD1 4.12Å; V225-L229 PolarHBondContact O-N 3.02Å; V225-V252 HydrophobicContact CG2-CG2 4.35Å; V225-A255 HydrophobicContact CG2-CB 3.7Å
226	T	92.1	Very high	90.2	Very high	37 Å²	37	63.1 Å²	63.1	23%	0.227	34%	0.342	C	S	.	.	H	α-helix	trans	-65.7	-38.4	-172.9	58.2	0	0	0	0	113.2	N224 L228 L229 M230 A255	N224-T226 WeakPolarHBondContact OD1-CG2 3.45Å; N224-T226 PolarHBondContact OD1-N 3.22Å; N224-T226 PolarHBondContact OD1-OG1 2.85Å; T226-L228 VanDerWaalsContact C-N 3.34Å; T226-L228 PolarHBondContact O-N 3.09Å; T226-L229 PolarHBondContact O-N 3.21Å; T226-M230 WeakPolarHBondContact O-CG 3.5Å; T226-M230 PolarHBondContact O-N 3.22Å; T226-A255 HydrophobicContact CG2-CB 4.31Å
227	A	90.5	Very high	90	Very high	75 Å²	75	62.9 Å²	62.9	62%	0.62	34%	0.341	S	S	*	.	H	α-helix	trans	-61.2	-43.9	179.2	0	0	0	0	0	111.5	V225 L229 M230 E231	V225-A227 PolarHBondContact O-N 2.05Å; A227-L229 VanDerWaalsContact C-N 3.33Å; A227-L229 PolarHBondContact O-N 2.78Å; A227-M230 PolarHBondContact O-N 2.97Å; A227-E231 PolarHBondContact O-N 3.09Å; A227-E231 VanDerWaalsContact O-N 3.09Å
228	L	92.1	Very high	89.9	Confident	32 Å²	32	60.3 Å²	60.3	17%	0.168	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-39.9	176.5	-170.3	73.4	0	0	0	112	L216 F218 V225 T226 E231 A232	L216-L228 HydrophobicContact CB-CD1 3.97Å; L216-L228 HydrophobicContact CB-CD2 4.27Å; L216-L228 HydrophobicContact CB-CG 4.18Å; L216-L228 HydrophobicContact CD1-CD1 4.48Å; L216-L228 HydrophobicContact CD1-CG 4.37Å; L216-L228 HydrophobicContact CD2-CD1 3.96Å; L216-L228 HydrophobicContact CG-CD1 4.35Å; F218-L228 HydrophobicContact CB-CD2 3.81Å; F218-L228 HydrophobicContact CD1-CD2 4.48Å; V225-L228 PolarHBondContact O-N 2.62Å; T226-L228 VanDerWaalsContact C-N 3.34Å; T226-L228 PolarHBondContact O-N 3.09Å; L228-E231 WeakPolarHBondContact O-CB 3.45Å; L228-E231 PolarHBondContact O-N 3.15Å; L228-A232 PolarHBondContact O-N 3.34Å
229	L	92.5	Very high	89.9	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-73.8	-29.3	177.8	-71	173.2	0	0	0	112.8	L166 V225 T226 A227 A232 K233 A255 A256 L259 M261	L166-L229 HydrophobicContact CD2-CD2 3.85Å; V225-L229 HydrophobicContact CG2-CD1 4.12Å; V225-L229 PolarHBondContact O-N 3.02Å; T226-L229 PolarHBondContact O-N 3.21Å; A227-L229 VanDerWaalsContact C-N 3.33Å; A227-L229 PolarHBondContact O-N 2.78Å; L229-A232 PolarHBondContact O-N 2.93Å; L229-K233 WeakPolarHBondContact O-CB 3.02Å; L229-K233 PolarHBondContact O-N 3.39Å; L229-A255 HydrophobicContact CD1-CB 3.53Å; L229-A256 HydrophobicContact CD1-CB 4.45Å; L229-L259 HydrophobicContact CB-CD1 3.3Å; L229-L259 HydrophobicContact CD1-CD1 4.15Å; L229-L259 HydrophobicContact CG-CD1 4.39Å; L229-M261 HydrophobicContact CB-SD 3.88Å; L229-M261 HydrophobicContact CD2-CE 4.05Å; L229-M261 HydrophobicContact CD2-SD 4.03Å; L229-M261 HydrophobicContact CG-SD 4.44Å
230	M	91.4	Very high	90	Very high	104 Å²	104	54.6 Å²	54.6	51%	0.512	30%	0.297	S	S	.	.	H	α-helix	trans	-63.9	-44.4	170	-73.7	-177.2	-167.2	0	0	110.7	T226 A227 A232 K233 E234 L259	T226-M230 WeakPolarHBondContact O-CG 3.5Å; T226-M230 PolarHBondContact O-N 3.22Å; A227-M230 PolarHBondContact O-N 2.97Å; M230-A232 VanDerWaalsContact C-N 3.33Å; M230-A232 PolarHBondContact O-N 3.25Å; M230-K233 WeakPolarHBondContact O-CB 3.47Å; M230-K233 PolarHBondContact O-N 3.17Å; M230-K233 VanDerWaalsContact O-N 3.14Å; M230-E234 PolarHBondContact O-N 3.12Å; M230-L259 HydrophobicContact CE-CD2 4.08Å; M230-L259 HydrophobicContact CG-CD1 4.41Å; M230-L259 HydrophobicContact CG-CD2 4.04Å
231	E	89.6	Confident	90.2	Very high	80 Å²	80	51.1 Å²	51.1	37%	0.374	28%	0.275	S	S	.	.	H	α-helix	trans	-59.6	-43.8	172.8	-177.3	179	-170.6	0	0	111.5	K214 A227 L228 K233 E234	K214-E231 VanDerWaalsContact CE-OE1 3.23Å; K214-E231 WeakPolarHBondContact CE-OE1 3.45Å; K214-E231 IonicContact NZ-OE1 3.81Å; K214-E231 PolarHBondContact NZ-OE1 3.12Å; A227-E231 PolarHBondContact O-N 3.09Å; A227-E231 VanDerWaalsContact O-N 3.09Å; L228-E231 WeakPolarHBondContact O-CB 3.45Å; L228-E231 PolarHBondContact O-N 3.15Å; E231-K233 VanDerWaalsContact C-N 3.27Å; E231-K233 PolarHBondContact O-N 2.92Å; E231-E234 PolarHBondContact O-N 2.81Å
232	A	89.8	Confident	90.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.8	-33.6	175.3	0	0	0	0	0	113.1	I164 L216 L228 L229 M230 L235 M261	I164-A232 HydrophobicContact CD1-CB 4.49Å; L216-A232 HydrophobicContact CD1-CB 3.53Å; L228-A232 PolarHBondContact O-N 3.34Å; L229-A232 PolarHBondContact O-N 2.93Å; M230-A232 VanDerWaalsContact C-N 3.33Å; M230-A232 PolarHBondContact O-N 3.25Å; A232-L235 WeakPolarHBondContact O-CB 3.34Å; A232-L235 PolarHBondContact O-N 2.91Å; A232-M261 HydrophobicContact CB-CE 4.07Å
233	K	89.9	Confident	90.9	Very high	89 Å²	89	46.2 Å²	46.2	39%	0.387	23%	0.233	S	C	.	.	H	α-helix	trans	-70.9	-31.2	-179.9	-175.9	173.2	-178.4	170	0	112.5	L229 M230 E231 L235 L259 M261	L229-K233 WeakPolarHBondContact O-CB 3.02Å; L229-K233 PolarHBondContact O-N 3.39Å; M230-K233 WeakPolarHBondContact O-CB 3.47Å; M230-K233 PolarHBondContact O-N 3.17Å; M230-K233 VanDerWaalsContact O-N 3.14Å; E231-K233 VanDerWaalsContact C-N 3.27Å; E231-K233 PolarHBondContact O-N 2.92Å; K233-L235 VanDerWaalsContact C-N 3.26Å; K233-L235 PolarHBondContact O-N 2.85Å; K233-L259 PolarHBondContact NZ-O 3.44Å; K233-M261 HydrophobicContact CB-SD 4.44Å
234	E	85.6	Confident	91.1	Very high	142 Å²	142	37.7 Å²	37.7	66%	0.664	20%	0.197	S	C	*	.	H	α-helix	trans	-71.1	-19.1	176	-69.6	-166.5	-167.4	0	0	113.4	M230 E231 K420	M230-E234 PolarHBondContact O-N 3.12Å; E231-E234 PolarHBondContact O-N 2.81Å; E234-K420 IonicContact OE2-NZ 3.2Å; E234-K420 PolarHBondContact OE2-NZ 3.35Å; E234-K420 VanDerWaalsContact OE2-NZ 3.11Å
235	L	85.4	Confident	91.2	Very high	18 Å²	18	33.4 Å²	33.4	9%	0.094	18%	0.176	C	C	.	.	S	Bend	trans	-68.7	162.7	177.5	-60.9	176.5	0	0	0	112.5	I164 K214 A232 K233 R238	I164-L235 HydrophobicContact CD1-CB 4.11Å; I164-L235 HydrophobicContact CD1-CD1 3.91Å; I164-L235 HydrophobicContact CG1-CD1 4.03Å; I164-L235 HydrophobicContact CG2-CD1 4.29Å; K214-L235 HydrophobicContact CB-CD1 3.69Å; K214-L235 HydrophobicContact CD-CD1 4.05Å; K214-L235 HydrophobicContact CD-CD2 4.08Å; K214-L235 HydrophobicContact CG-CD1 4.42Å; A232-L235 WeakPolarHBondContact O-CB 3.34Å; A232-L235 PolarHBondContact O-N 2.91Å; K233-L235 VanDerWaalsContact C-N 3.26Å; K233-L235 PolarHBondContact O-N 2.85Å; L235-R238 PolarHBondContact O-NH1 2.84Å; L235-R238 PolarHBondContact O-NH2 3.22Å
236	E	84.3	Confident	91.2	Very high	36 Å²	36	36.2 Å²	36.2	17%	0.168	19%	0.188	C	C	.	.	S	Bend	trans	-82.3	-32.5	-178.8	-64	-174.7	166.6	0	0	112.4	E213 Y413 Q414	E213-E236 PolarHBondContact OE1-N 2.89Å; E213-E236 VanDerWaalsContact OE1-N 3.07Å; E236-Y413 WeakPolarHBondContact O-CA 3.45Å; E236-Q414 PolarHBondContact O-N 2.95Å
237	A	89	Confident	91.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-63	145.4	176	0	0	0	0	0	112.5	H162 I164 E213	H162-A237 HydrophobicContact CB-CB 3.97Å; I164-A237 HydrophobicContact CD1-CB 4.14Å; I164-A237 HydrophobicContact CG1-CB 3.66Å; E213-A237 HydrophobicContact CB-CB 4.46Å; E213-A237 WeakPolarHBondContact OE2-CA 3.47Å; E213-A237 WeakPolarHBondContact OE2-CB 3.36Å; E213-A237 PolarHBondContact OE2-N 3.37Å
238	R	91.8	Very high	91.2	Very high	40 Å²	40	36.2 Å²	36.2	15%	0.151	18%	0.177	C	C	.	.			trans	-122.6	-4	176.3	-61.5	-69.9	172.7	-105.8	3.2	113.1	L235 G265 Y266 V267 G412 Q414	L235-R238 PolarHBondContact O-NH1 2.84Å; L235-R238 PolarHBondContact O-NH2 3.22Å; R238-G265 VanDerWaalsContact CB-O 3.28Å; R238-G265 WeakPolarHBondContact CB-O 3.34Å; R238-Y266 HydrophobicContact CB-CD1 4.46Å; R238-Y266 VanDerWaalsContact CD-CZ 3.49Å; R238-Y266 WeakPolarHBondContact O-CA 3.27Å; R238-V267 PolarHBondContact O-N 3.34Å; R238-G412 PolarHBondContact N-O 3.24Å; R238-Q414 HydrophobicContact CG-CB 4.06Å
239	V	93.5	Very high	91.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	117.9	171.4	-174.8	0	0	0	0	108.9	W160 I163 I164 V267 L269 G412	W160-V239 HydrophobicContact CB-CG2 4.05Å; W160-V239 HydrophobicContact CD2-CG1 4.45Å; W160-V239 HydrophobicContact CD2-CG2 3.79Å; W160-V239 HydrophobicContact CE3-CG1 4.04Å; W160-V239 HydrophobicContact CE3-CG2 4.22Å; W160-V239 HydrophobicContact CG-CG2 3.72Å; W160-V239 HydrophobicContact CZ3-CG1 4.5Å; I163-V239 WeakPolarHBondContact CA-O 3.35Å; I163-V239 HydrophobicContact CG2-CB 4.15Å; I163-V239 HydrophobicContact CG2-CG1 4.06Å; I164-V239 PolarHBondContact N-O 3.14Å; V239-V267 HydrophobicContact CG1-CB 4.43Å; V239-V267 HydrophobicContact CG1-CG1 4.46Å; V239-V267 HydrophobicContact CG2-CB 4.27Å; V239-L269 HydrophobicContact CG1-CD1 4.21Å; V239-L269 HydrophobicContact CG1-CG 4.38Å; V239-G412 PolarHBondContact N-O 3.35Å
240	I	95.1	Very high	91.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.7	-178.1	-62.5	169	0	0	0	108.6	I164 L166 M261 Y266 V267 W268 L269	I164-I240 HydrophobicContact CB-CG1 4.39Å; I164-I240 HydrophobicContact CD1-CG1 4.31Å; I164-I240 WeakPolarHBondContact O-CA 3.36Å; L166-I240 HydrophobicContact CD1-CG2 3.63Å; I240-M261 HydrophobicContact CD1-CE 3.57Å; I240-Y266 HydrophobicContact CD1-CD1 3.89Å; I240-Y266 HydrophobicContact CD1-CE1 4.24Å; I240-V267 PolarHBondContact N-O 2.84Å; I240-W268 HydrophobicContact CB-CD2 4.2Å; I240-W268 HydrophobicContact CB-CE3 4.15Å; I240-W268 HydrophobicContact CB-CZ3 4.36Å; I240-W268 HydrophobicContact CD1-CD2 4.48Å; I240-W268 HydrophobicContact CD1-CH2 3.98Å; I240-W268 HydrophobicContact CD1-CZ2 3.58Å; I240-W268 HydrophobicContact CG2-CD2 4.26Å; I240-W268 HydrophobicContact CG2-CE3 3.71Å; I240-W268 HydrophobicContact CG2-CH2 3.97Å; I240-W268 HydrophobicContact CG2-CZ2 4.48Å; I240-W268 HydrophobicContact CG2-CZ3 3.56Å; I240-W268 WeakPolarHBondContact O-CA 3.4Å; I240-L269 PolarHBondContact O-N 3.18Å
241	I	95.5	Very high	91.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122.8	173.7	-50.6	-173.3	0	0	0	108.1	W151 M155 I163 I164 L165 L166 L180 L269	W151-I241 HydrophobicContact CB-CD1 4.33Å; W151-I241 HydrophobicContact CD2-CG2 3.67Å; W151-I241 HydrophobicContact CE3-CG2 3.54Å; W151-I241 HydrophobicContact CG-CG2 4.25Å; W151-I241 HydrophobicContact CH2-CG2 4.28Å; W151-I241 HydrophobicContact CZ2-CG2 4.34Å; W151-I241 HydrophobicContact CZ3-CG2 3.88Å; M155-I241 HydrophobicContact CE-CD1 3.2Å; I163-I241 HydrophobicContact CB-CD1 4.47Å; I163-I241 HydrophobicContact CD1-CD1 3.66Å; I164-I241 PolarHBondContact O-N 3.41Å; L165-I241 HydrophobicContact CD1-CB 3.98Å; L165-I241 HydrophobicContact CD1-CG2 3.99Å; L166-I241 PolarHBondContact N-O 2.99Å; L180-I241 HydrophobicContact CD2-CD1 4.3Å; I241-L269 CarbonylContact C-O 3.52Å; I241-L269 VanDerWaalsContact CA-O 3.27Å; I241-L269 WeakPolarHBondContact CA-O 3.26Å; I241-L269 HydrophobicContact CD1-CD1 4.37Å; I241-L269 HydrophobicContact CG1-CB 4.21Å; I241-L269 HydrophobicContact CG1-CD1 4.29Å
242	L	95.9	Very high	91.8	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	126.3	178.2	179.4	66	0	0	0	110.2	L166 F218 A244 A249 V252 Y253 L269 V270	L166-L242 HydrophobicContact CB-CD1 3.9Å; L166-L242 WeakPolarHBondContact O-CA 3.48Å; F218-L242 HydrophobicContact CE1-CD1 4.31Å; L242-A244 HydrophobicContact CD1-CB 4.05Å; L242-A244 HydrophobicContact CG-CB 4.25Å; L242-A249 HydrophobicContact CD2-CB 4.38Å; L242-V252 HydrophobicContact CD1-CG1 4.23Å; L242-V252 HydrophobicContact CD1-CG2 4.34Å; L242-V252 HydrophobicContact CD2-CB 4.2Å; L242-V252 HydrophobicContact CD2-CG1 3.9Å; L242-Y253 HydrophobicContact CD2-CE1 4.02Å; L242-L269 PolarHBondContact N-O 3.02Å; L242-V270 HydrophobicContact CB-CG1 4.11Å
243	S	95.3	Very high	92	Very high	7 Å²	7	27 Å²	27	5%	0.049	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	111.7	168.4	-176.6	0	0	0	0	108.8	L166 S168 E274	L166-S243 PolarHBondContact O-N 2.81Å; S168-S243 PolarHBondContact N-O 3.07Å; S243-E274 VanDerWaalsContact CA-OE1 3.31Å; S243-E274 WeakPolarHBondContact CA-OE1 3.47Å
244	A	93.3	Very high	92.2	Very high	5 Å²	5	27.7 Å²	27.7	4%	0.041	13%	0.134	C	C	.	.			trans	-153.5	175.2	-171.5	0	0	0	0	0	112.6	F218 L242 D248 E274	F218-A244 HydrophobicContact CZ-CB 3.89Å; L242-A244 HydrophobicContact CD1-CB 4.05Å; L242-A244 HydrophobicContact CG-CB 4.25Å; A244-D248 HydrophobicContact CB-CB 4.1Å; A244-E274 PolarHBondContact N-OE1 3.48Å; A244-E274 VanDerWaalsContact O-OE1 3.11Å
245	S	91.6	Very high	92.6	Very high	25 Å²	25	21.4 Å²	21.4	18%	0.175	11%	0.106	C	C	.	.			trans	-72.8	166.6	167.4	81.7	0	0	0	0	111.6	D247 D248 A249	S245-D247 VanDerWaalsContact C-N 3.32Å; S245-D247 PolarHBondContact O-N 2.89Å; S245-D248 WeakPolarHBondContact CB-OD2 3.38Å; S245-D248 PolarHBondContact O-N 3.39Å; S245-D248 WeakPolarHBondContact OG-CB 3.36Å; S245-D248 PolarHBondContact OG-N 3.31Å; S245-D248 PolarHBondContact OG-OD2 3.12Å; S245-A249 WeakPolarHBondContact O-CB 3.47Å; S245-A249 PolarHBondContact O-N 3.48Å
246	E	90.9	Very high	93.1	Very high	69 Å²	69	20.5 Å²	20.5	32%	0.322	10%	0.101	S	C	.	.	H	α-helix	trans	-62.8	-38.7	-179.7	-55.4	-164.5	156.2	0	0	112.2	A250 R273 S276	E246-A250 PolarHBondContact O-N 3.04Å; E246-R273 HydrophobicContact CG-CB 4.18Å; E246-S276 PolarHBondContact OE1-OG 3.3Å
247	D	90.6	Very high	93.5	Very high	102 Å²	102	21 Å²	21	55%	0.545	11%	0.112	S	C	.	.	H	α-helix	trans	-76.7	-37.3	179.9	-72	-40.9	0	0	0	112.1	S245 A250 T251 N278	S245-D247 VanDerWaalsContact C-N 3.32Å; S245-D247 PolarHBondContact O-N 2.89Å; D247-A250 WeakPolarHBondContact O-CB 3.05Å; D247-A250 PolarHBondContact O-N 3.1Å; D247-T251 PolarHBondContact O-N 3.21Å; D247-N278 PolarHBondContact OD1-ND2 2.67Å
248	D	92.9	Very high	93.6	Very high	11 Å²	11	28.1 Å²	28.1	6%	0.059	15%	0.146	C	C	.	.	H	α-helix	trans	-68.2	-36.5	175.7	-64.4	-42	0	0	0	111.3	F218 G221 A244 S245 A250 T251 V252	F218-D248 HydrophobicContact CE2-CB 3.91Å; F218-D248 HydrophobicContact CZ-CB 4.2Å; G221-D248 PolarHBondContact N-OD1 3.41Å; A244-D248 HydrophobicContact CB-CB 4.1Å; S245-D248 WeakPolarHBondContact CB-OD2 3.38Å; S245-D248 PolarHBondContact O-N 3.39Å; S245-D248 WeakPolarHBondContact OG-CB 3.36Å; S245-D248 PolarHBondContact OG-N 3.31Å; S245-D248 PolarHBondContact OG-OD2 3.12Å; D248-A250 VanDerWaalsContact C-N 3.25Å; D248-A250 PolarHBondContact O-N 2.9Å; D248-T251 PolarHBondContact O-N 3.27Å; D248-T251 VanDerWaalsContact O-N 3.14Å; D248-T251 PolarHBondContact O-OG1 2.97Å; D248-V252 WeakPolarHBondContact O-CG2 3.41Å; D248-V252 PolarHBondContact O-N 3.28Å
249	A	94.2	Very high	93.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60	-38.9	172.9	0	0	0	0	0	111.6	L242 S245 T251 V252 Y253 E274 A279	L242-A249 HydrophobicContact CD2-CB 4.38Å; S245-A249 WeakPolarHBondContact O-CB 3.47Å; S245-A249 PolarHBondContact O-N 3.48Å; A249-T251 VanDerWaalsContact C-N 3.34Å; A249-T251 PolarHBondContact O-N 2.89Å; A249-V252 PolarHBondContact O-N 3.13Å; A249-Y253 HydrophobicContact CB-CE2 4.24Å; A249-Y253 WeakPolarHBondContact O-CD2 3.47Å; A249-Y253 PolarHBondContact O-N 3.4Å; A249-E274 HydrophobicContact CB-CB 3.98Å; A249-E274 HydrophobicContact CB-CG 3.9Å; A249-A279 HydrophobicContact CB-CB 3.84Å
250	A	94.1	Very high	93.6	Very high	3 Å²	3	33.1 Å²	33.1	3%	0.025	18%	0.176	C	C	.	.	H	α-helix	trans	-67.2	-30.6	176	0	0	0	0	0	113.4	E246 D247 D248 R254 Y282	E246-A250 PolarHBondContact O-N 3.04Å; D247-A250 WeakPolarHBondContact O-CB 3.05Å; D247-A250 PolarHBondContact O-N 3.1Å; D248-A250 VanDerWaalsContact C-N 3.25Å; D248-A250 PolarHBondContact O-N 2.9Å; A250-R254 WeakPolarHBondContact O-CG 3.48Å; A250-R254 PolarHBondContact O-NE 3.17Å; A250-Y282 HydrophobicContact CB-CD2 3.97Å
251	T	93.8	Very high	93.5	Very high	18 Å²	18	33.1 Å²	33.1	11%	0.11	18%	0.176	C	C	.	.	H	α-helix	trans	-73.1	-44.5	173.4	63.4	0	0	0	0	110.7	D247 D248 A249 R254 A255	D247-T251 PolarHBondContact O-N 3.21Å; D248-T251 PolarHBondContact O-N 3.27Å; D248-T251 VanDerWaalsContact O-N 3.14Å; D248-T251 PolarHBondContact O-OG1 2.97Å; A249-T251 VanDerWaalsContact C-N 3.34Å; A249-T251 PolarHBondContact O-N 2.89Å; T251-R254 PolarHBondContact O-N 2.87Å; T251-A255 PolarHBondContact O-N 2.93Å; T251-A255 VanDerWaalsContact O-N 3.1Å
252	V	95.3	Very high	93.3	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-46.9	178.8	173.8	0	0	0	0	111.2	F218 V225 L242 D248 A249 R254 A255 A256 W268	F218-V252 HydrophobicContact CZ-CG2 4.38Å; V225-V252 HydrophobicContact CG2-CG2 4.35Å; L242-V252 HydrophobicContact CD1-CG1 4.23Å; L242-V252 HydrophobicContact CD1-CG2 4.34Å; L242-V252 HydrophobicContact CD2-CB 4.2Å; L242-V252 HydrophobicContact CD2-CG1 3.9Å; D248-V252 WeakPolarHBondContact O-CG2 3.41Å; D248-V252 PolarHBondContact O-N 3.28Å; A249-V252 PolarHBondContact O-N 3.13Å; V252-R254 VanDerWaalsContact C-N 3.35Å; V252-R254 PolarHBondContact O-N 3.32Å; V252-A255 PolarHBondContact O-N 3.12Å; V252-A256 VanDerWaalsContact O-CB 3.27Å; V252-A256 WeakPolarHBondContact O-CB 3.39Å; V252-A256 PolarHBondContact O-N 2.82Å; V252-W268 HydrophobicContact CG1-CH2 4.29Å; V252-W268 HydrophobicContact CG1-CZ3 4.13Å
253	Y	94.9	Very high	92.9	Very high	1 Å²	1	36 Å²	36	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-40	179.5	-64.5	-32.9	0	0	0	113.1	L242 A249 A256 A257 V270 E274 A279 Y282 A283 P284	L242-Y253 HydrophobicContact CD2-CE1 4.02Å; A249-Y253 HydrophobicContact CB-CE2 4.24Å; A249-Y253 WeakPolarHBondContact O-CD2 3.47Å; A249-Y253 PolarHBondContact O-N 3.4Å; Y253-A256 PolarHBondContact O-N 2.95Å; Y253-A257 WeakPolarHBondContact O-CB 3.47Å; Y253-A257 PolarHBondContact O-N 2.63Å; Y253-V270 HydrophobicContact CE1-CG1 4.45Å; Y253-E274 WeakPolarHBondContact CE2-O 3.49Å; Y253-E274 PolarHBondContact OH-O 2.85Å; Y253-A279 HydrophobicContact CE2-CB 4.14Å; Y253-Y282 WeakPolarHBondContact CB-O 3.18Å; Y253-A283 HydrophobicContact CD2-CB 4.23Å; Y253-A283 HydrophobicContact CE2-CB 3.97Å; Y253-P284 HydrophobicContact CD1-CG 4.42Å
254	R	93.4	Very high	92.6	Very high	104 Å²	104	39.2 Å²	39.2	39%	0.392	22%	0.222	S	C	.	.	H	α-helix	trans	-63.2	-44.6	176.1	-74.2	-177.6	-67.7	122.3	-7.4	111.6	A250 T251 V252 A257 M258 Y282	A250-R254 WeakPolarHBondContact O-CG 3.48Å; A250-R254 PolarHBondContact O-NE 3.17Å; T251-R254 PolarHBondContact O-N 2.87Å; V252-R254 VanDerWaalsContact C-N 3.35Å; V252-R254 PolarHBondContact O-N 3.32Å; R254-A257 PolarHBondContact O-N 2.78Å; R254-M258 WeakPolarHBondContact O-CG 3.18Å; R254-M258 PolarHBondContact O-N 3.08Å; R254-M258 VanDerWaalsContact O-N 3.13Å; R254-Y282 HydrophobicContact CG-CD1 3.72Å; R254-Y282 HydrophobicContact CG-CE1 4.24Å; R254-Y282 HydrophobicContact CG-CG 4.02Å
255	A	94.5	Very high	92.3	Very high	9 Å²	9	40.3 Å²	40.3	7%	0.074	23%	0.234	C	C	.	.	H	α-helix	trans	-68.6	-39.2	178.5	0	0	0	0	0	112.2	V225 T226 L229 T251 V252 A257 M258 L259	V225-A255 HydrophobicContact CG2-CB 3.7Å; T226-A255 HydrophobicContact CG2-CB 4.31Å; L229-A255 HydrophobicContact CD1-CB 3.53Å; T251-A255 PolarHBondContact O-N 2.93Å; T251-A255 VanDerWaalsContact O-N 3.1Å; V252-A255 PolarHBondContact O-N 3.12Å; A255-A257 PolarHBondContact O-N 3.3Å; A255-M258 WeakPolarHBondContact O-CB 3.32Å; A255-M258 PolarHBondContact O-N 3.21Å; A255-L259 PolarHBondContact O-N 3.47Å; A255-L259 VanDerWaalsContact O-N 3.1Å
256	A	94.6	Very high	92.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-40.3	175.9	0	0	0	0	0	112	L229 V252 Y253 L259 N260 M261 T262 W268	L229-A256 HydrophobicContact CD1-CB 4.45Å; V252-A256 VanDerWaalsContact O-CB 3.27Å; V252-A256 WeakPolarHBondContact O-CB 3.39Å; V252-A256 PolarHBondContact O-N 2.82Å; Y253-A256 PolarHBondContact O-N 2.95Å; A256-L259 PolarHBondContact O-N 3.42Å; A256-N260 PolarHBondContact O-N 2.95Å; A256-M261 HydrophobicContact CB-CB 4.29Å; A256-M261 PolarHBondContact O-N 2.91Å; A256-T262 HydrophobicContact CB-CG2 4.19Å; A256-W268 HydrophobicContact CB-CH2 3.72Å; A256-W268 HydrophobicContact CB-CZ2 3.62Å
257	A	92.7	Very high	92.5	Very high	47 Å²	47	37 Å²	37	39%	0.388	22%	0.215	S	C	.	.	H	α-helix	trans	-63.4	-41.4	174	0	0	0	0	0	111.7	Y253 R254 A255 L259 N260 T262	Y253-A257 WeakPolarHBondContact O-CB 3.47Å; Y253-A257 PolarHBondContact O-N 2.63Å; R254-A257 PolarHBondContact O-N 2.78Å; A255-A257 PolarHBondContact O-N 3.3Å; A257-L259 VanDerWaalsContact C-N 3.28Å; A257-L259 PolarHBondContact O-N 3.31Å; A257-N260 PolarHBondContact O-N 2.9Å; A257-T262 HydrophobicContact CB-CG2 4.45Å
258	M	92.7	Very high	92.7	Very high	148 Å²	148	32.2 Å²	32.2	73%	0.729	19%	0.189	S	C	*	.	H	α-helix	trans	-62.5	-32.4	175.6	-70.9	175.2	-178.3	0	0	113.1	R254 A255 N260	R254-M258 WeakPolarHBondContact O-CG 3.18Å; R254-M258 PolarHBondContact O-N 3.08Å; R254-M258 VanDerWaalsContact O-N 3.13Å; A255-M258 WeakPolarHBondContact O-CB 3.32Å; A255-M258 PolarHBondContact O-N 3.21Å; M258-N260 VanDerWaalsContact C-N 3.34Å
259	L	92.2	Very high	92.8	Very high	24 Å²	24	31.7 Å²	31.7	13%	0.126	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	5.1	-179.8	-69	169.4	0	0	0	113.8	L229 M230 K233 A255 A256 A257 M261	L229-L259 HydrophobicContact CB-CD1 3.3Å; L229-L259 HydrophobicContact CD1-CD1 4.15Å; L229-L259 HydrophobicContact CG-CD1 4.39Å; M230-L259 HydrophobicContact CE-CD2 4.08Å; M230-L259 HydrophobicContact CG-CD1 4.41Å; M230-L259 HydrophobicContact CG-CD2 4.04Å; K233-L259 PolarHBondContact NZ-O 3.44Å; A255-L259 PolarHBondContact O-N 3.47Å; A255-L259 VanDerWaalsContact O-N 3.1Å; A256-L259 PolarHBondContact O-N 3.42Å; A257-L259 VanDerWaalsContact C-N 3.28Å; A257-L259 PolarHBondContact O-N 3.31Å; L259-M261 HydrophobicContact CB-CG 4.03Å; L259-M261 HydrophobicContact CB-SD 4.14Å; L259-M261 HydrophobicContact CD1-SD 4.33Å; L259-M261 PolarHBondContact O-N 3.42Å
260	N	92.3	Very high	92.9	Very high	121 Å²	121	31.7 Å²	31.7	65%	0.647	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	29.9	-174.1	-65.8	-26.2	0	0	0	114	A256 A257 M258 T262	A256-N260 PolarHBondContact O-N 2.95Å; A257-N260 PolarHBondContact O-N 2.9Å; M258-N260 VanDerWaalsContact C-N 3.34Å; N260-T262 PolarHBondContact O-N 3.37Å
261	M	92.3	Very high	92.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	2.8	176.3	-63.4	176.4	68.6	0	0	112.9	L229 A232 K233 I240 A256 L259 Y266 W268	L229-M261 HydrophobicContact CB-SD 3.88Å; L229-M261 HydrophobicContact CD2-CE 4.05Å; L229-M261 HydrophobicContact CD2-SD 4.03Å; L229-M261 HydrophobicContact CG-SD 4.44Å; A232-M261 HydrophobicContact CB-CE 4.07Å; K233-M261 HydrophobicContact CB-SD 4.44Å; I240-M261 HydrophobicContact CD1-CE 3.57Å; A256-M261 HydrophobicContact CB-CB 4.29Å; A256-M261 PolarHBondContact O-N 2.91Å; L259-M261 HydrophobicContact CB-CG 4.03Å; L259-M261 HydrophobicContact CB-SD 4.14Å; L259-M261 HydrophobicContact CD1-SD 4.33Å; L259-M261 PolarHBondContact O-N 3.42Å; M261-Y266 HydrophobicContact CB-CD1 4.48Å; M261-Y266 HydrophobicContact CB-CE1 4.4Å; M261-Y266 HydrophobicContact CE-CE1 4.28Å; M261-Y266 HydrophobicContact CG-CE1 4.4Å; M261-Y266 VanDerWaalsContact O-CB 3.27Å; M261-Y266 WeakPolarHBondContact O-CB 3.05Å; M261-W268 HydrophobicContact CB-CZ2 4.1Å; M261-W268 PolarHBondContact O-NE1 2.9Å
262	T	91.5	Very high	92.8	Very high	34 Å²	34	31.9 Å²	31.9	21%	0.209	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	6.1	174.5	63.3	0	0	0	0	112.3	A256 A257 N260 P284	A256-T262 HydrophobicContact CB-CG2 4.19Å; A257-T262 HydrophobicContact CB-CG2 4.45Å; N260-T262 PolarHBondContact O-N 3.37Å; T262-P284 HydrophobicContact CG2-CB 3.6Å; T262-P284 HydrophobicContact CG2-CG 3.67Å
263	G	87.9	Confident	92.6	Very high	28 Å²	28	33 Å²	33	29%	0.289	19%	0.189	S	C	.	.	S	Bend	trans	-79.5	-174.4	178.2	0	0	0	0	0	113.2	Y266	G263-Y266 PolarHBondContact O-N 3.21Å
264	S	88.7	Confident	92.5	Very high	74 Å²	74	33.2 Å²	33.2	52%	0.517	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	148.9	175.9	42.2	0	0	0	0	112.7	Y266 E406	S264-Y266 PolarHBondContact O-N 2.99Å; S264-E406 WeakPolarHBondContact CB-OE1 3.14Å
265	G	86.9	Confident	92.5	Very high	28 Å²	28	28.7 Å²	28.7	29%	0.289	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	-19.2	-179.4	0	0	0	0	0	115.8	R238	R238-G265 VanDerWaalsContact CB-O 3.28Å; R238-G265 WeakPolarHBondContact CB-O 3.34Å
266	Y	92.8	Very high	92.2	Very high	23 Å²	23	29.8 Å²	29.8	9%	0.09	18%	0.181	C	C	.	.			trans	-85.7	146.6	171.7	-76.9	-90.5	0	0	0	111.6	R238 I240 M261 G263 S264 P403	R238-Y266 HydrophobicContact CB-CD1 4.46Å; R238-Y266 VanDerWaalsContact CD-CZ 3.49Å; R238-Y266 WeakPolarHBondContact O-CA 3.27Å; I240-Y266 HydrophobicContact CD1-CD1 3.89Å; I240-Y266 HydrophobicContact CD1-CE1 4.24Å; M261-Y266 HydrophobicContact CB-CD1 4.48Å; M261-Y266 HydrophobicContact CB-CE1 4.4Å; M261-Y266 HydrophobicContact CE-CE1 4.28Å; M261-Y266 HydrophobicContact CG-CE1 4.4Å; M261-Y266 VanDerWaalsContact O-CB 3.27Å; M261-Y266 WeakPolarHBondContact O-CB 3.05Å; G263-Y266 PolarHBondContact O-N 3.21Å; S264-Y266 PolarHBondContact O-N 2.99Å; Y266-P403 WeakPolarHBondContact O-CD 3.23Å; Y266-P403 VanDerWaalsContact O-CG 3.25Å; Y266-P403 WeakPolarHBondContact O-CG 3.27Å
267	V	94.4	Very high	91.9	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	134.2	174.5	-179.9	0	0	0	0	109	W160 R238 V239 I240 L269 W402 P410	W160-V267 HydrophobicContact CH2-CG1 3.74Å; W160-V267 HydrophobicContact CZ2-CG1 4.11Å; W160-V267 HydrophobicContact CZ2-CG2 4.14Å; W160-V267 HydrophobicContact CZ3-CG1 4.2Å; R238-V267 PolarHBondContact O-N 3.34Å; V239-V267 HydrophobicContact CG1-CB 4.43Å; V239-V267 HydrophobicContact CG1-CG1 4.46Å; V239-V267 HydrophobicContact CG2-CB 4.27Å; I240-V267 PolarHBondContact N-O 2.84Å; V267-L269 HydrophobicContact CG1-CD2 4.21Å; V267-W402 HydrophobicContact CG1-CE3 4.27Å; V267-W402 HydrophobicContact CG1-CZ3 3.91Å; V267-W402 HydrophobicContact CG2-CE3 4.15Å; V267-W402 HydrophobicContact CG2-CZ3 4.3Å; V267-P410 HydrophobicContact CG2-CB 4.33Å; V267-P410 HydrophobicContact CG2-CG 3.23Å
268	W	94.8	Very high	91.6	Very high	1 Å²	1	32.8 Å²	32.8	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.3	176.7	-69.8	79.5	0	0	0	109.8	I240 V252 A256 M261 I287 L288	I240-W268 HydrophobicContact CB-CD2 4.2Å; I240-W268 HydrophobicContact CB-CE3 4.15Å; I240-W268 HydrophobicContact CB-CZ3 4.36Å; I240-W268 HydrophobicContact CD1-CD2 4.48Å; I240-W268 HydrophobicContact CD1-CH2 3.98Å; I240-W268 HydrophobicContact CD1-CZ2 3.58Å; I240-W268 HydrophobicContact CG2-CD2 4.26Å; I240-W268 HydrophobicContact CG2-CE3 3.71Å; I240-W268 HydrophobicContact CG2-CH2 3.97Å; I240-W268 HydrophobicContact CG2-CZ2 4.48Å; I240-W268 HydrophobicContact CG2-CZ3 3.56Å; I240-W268 WeakPolarHBondContact O-CA 3.4Å; V252-W268 HydrophobicContact CG1-CH2 4.29Å; V252-W268 HydrophobicContact CG1-CZ3 4.13Å; A256-W268 HydrophobicContact CB-CH2 3.72Å; A256-W268 HydrophobicContact CB-CZ2 3.62Å; M261-W268 HydrophobicContact CB-CZ2 4.1Å; M261-W268 PolarHBondContact O-NE1 2.9Å; W268-I287 HydrophobicContact CB-CB 4.38Å; W268-I287 HydrophobicContact CB-CG2 3.81Å; W268-I287 HydrophobicContact CG-CG2 4.4Å; W268-L288 PolarHBondContact O-N 3.13Å
269	L	95.4	Very high	91.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124.5	169.2	-55.4	-176.9	0	0	0	108	M154 W160 V239 I240 I241 L242 V267 L288	M154-L269 HydrophobicContact CE-CD2 3.68Å; W160-L269 HydrophobicContact CE3-CD1 4.48Å; W160-L269 HydrophobicContact CZ3-CD1 4.1Å; W160-L269 HydrophobicContact CZ3-CD2 4.11Å; W160-L269 HydrophobicContact CZ3-CG 4.48Å; V239-L269 HydrophobicContact CG1-CD1 4.21Å; V239-L269 HydrophobicContact CG1-CG 4.38Å; I240-L269 PolarHBondContact O-N 3.18Å; I241-L269 CarbonylContact C-O 3.52Å; I241-L269 VanDerWaalsContact CA-O 3.27Å; I241-L269 WeakPolarHBondContact CA-O 3.26Å; I241-L269 HydrophobicContact CD1-CD1 4.37Å; I241-L269 HydrophobicContact CG1-CB 4.21Å; I241-L269 HydrophobicContact CG1-CD1 4.29Å; L242-L269 PolarHBondContact N-O 3.02Å; V267-L269 HydrophobicContact CG1-CD2 4.21Å; L269-L288 WeakPolarHBondContact CA-O 3.47Å; L269-L288 HydrophobicContact CD2-CB 3.8Å; L269-L288 HydrophobicContact CD2-CD1 3.88Å; L269-L288 HydrophobicContact CD2-CG 4.41Å
270	V	96.1	Very high	91.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	159.7	-175	-53.6	0	0	0	0	110.9	W151 L242 Y253 E274 I275 I287 L288 L290	W151-V270 PolarHBondContact NE1-O 3.5Å; L242-V270 HydrophobicContact CB-CG1 4.11Å; Y253-V270 HydrophobicContact CE1-CG1 4.45Å; V270-E274 HydrophobicContact CB-CB 3.85Å; V270-E274 HydrophobicContact CB-CG 4.44Å; V270-E274 HydrophobicContact CG2-CB 4.16Å; V270-I275 HydrophobicContact CG2-CG2 3.52Å; V270-I287 HydrophobicContact CG2-CD1 4.3Å; V270-L288 PolarHBondContact N-O 3.35Å; V270-L290 PolarHBondContact O-N 3.34Å
271	G	93.9	Very high	91.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.183	C	C	.	.			trans	-77	-167.9	175.3	0	0	0	0	0	113	E274	G271-E274 WeakPolarHBondContact CA-OE2 3.48Å; G271-E274 PolarHBondContact N-OE2 3.31Å; G271-E274 VanDerWaalsContact N-OE2 3.17Å
272	E	91.8	Very high	91.5	Very high	25 Å²	25	36.9 Å²	36.9	12%	0.117	20%	0.204	C	C	.	.	S	Bend	trans	-78.4	-29.4	-179.5	-173.6	169.5	145	0	0	113.9	R124 E274 I275 S276 L290 L292	R124-E272 IonicContact CZ-OE2 3.78Å; R124-E272 IonicContact NH1-OE1 3.35Å; R124-E272 PolarHBondContact NH1-OE1 2.76Å; R124-E272 IonicContact NH1-OE2 2.74Å; R124-E272 PolarHBondContact NH1-OE2 2.98Å; R124-E272 IonicContact NH2-OE2 2.73Å; E272-E274 VanDerWaalsContact C-N 3.33Å; E272-E274 PolarHBondContact N-OE2 2.88Å; E272-I275 VanDerWaalsContact O-CG1 3.29Å; E272-I275 WeakPolarHBondContact O-CG1 3.21Å; E272-S276 PolarHBondContact O-OG 3.2Å; E272-L290 WeakPolarHBondContact CA-O 3.49Å; E272-L290 WeakPolarHBondContact CB-O 3.34Å; E272-L290 WeakPolarHBondContact CG-O 3.27Å; E272-L292 WeakPolarHBondContact OE2-CB 3.37Å; E272-L292 PolarHBondContact OE2-N 3.04Å
273	R	90.5	Very high	91.6	Very high	25 Å²	25	36 Å²	36	9%	0.094	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-76.5	-28.7	-177	-65.3	-178.6	68.3	-170	0.5	111.5	Y144 E246 I275 S276	Y144-R273 HydrophobicContact CD1-CG 4.44Å; Y144-R273 HydrophobicContact CE1-CG 3.96Å; Y144-R273 HydrophobicContact CE2-CG 4.3Å; E246-R273 HydrophobicContact CG-CB 4.18Å; R273-I275 PolarHBondContact O-N 3.19Å; R273-S276 PolarHBondContact O-N 3.44Å; R273-S276 PolarHBondContact O-OG 2.55Å
274	E	93.6	Very high	91.8	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.028	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-79.9	-9.4	-175.1	-59.1	82.5	172.7	0	0	112.3	S243 A244 A249 Y253 V270 G271 E272 A279	S243-E274 VanDerWaalsContact CA-OE1 3.31Å; S243-E274 WeakPolarHBondContact CA-OE1 3.47Å; A244-E274 PolarHBondContact N-OE1 3.48Å; A244-E274 VanDerWaalsContact O-OE1 3.11Å; A249-E274 HydrophobicContact CB-CB 3.98Å; A249-E274 HydrophobicContact CB-CG 3.9Å; Y253-E274 WeakPolarHBondContact CE2-O 3.49Å; Y253-E274 PolarHBondContact OH-O 2.85Å; V270-E274 HydrophobicContact CB-CB 3.85Å; V270-E274 HydrophobicContact CB-CG 4.44Å; V270-E274 HydrophobicContact CG2-CB 4.16Å; G271-E274 WeakPolarHBondContact CA-OE2 3.48Å; G271-E274 PolarHBondContact N-OE2 3.31Å; G271-E274 VanDerWaalsContact N-OE2 3.17Å; E272-E274 VanDerWaalsContact C-N 3.33Å; E272-E274 PolarHBondContact N-OE2 2.88Å; E274-A279 WeakPolarHBondContact O-CB 3.35Å
275	I	93.3	Very high	91.9	Very high	8 Å²	8	35.7 Å²	35.7	4%	0.041	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-110.7	7.3	173.2	62.7	169.2	0	0	0	113.2	V270 E272 R273 I287 L290 M375 L382	V270-I275 HydrophobicContact CG2-CG2 3.52Å; E272-I275 VanDerWaalsContact O-CG1 3.29Å; E272-I275 WeakPolarHBondContact O-CG1 3.21Å; R273-I275 PolarHBondContact O-N 3.19Å; I275-I287 HydrophobicContact CG2-CD1 3.94Å; I275-L290 WeakPolarHBondContact CD1-O 3.15Å; I275-M375 HydrophobicContact CD1-CB 4.37Å; I275-M375 HydrophobicContact CD1-CG 4.47Å; I275-L382 HydrophobicContact CB-CD2 4.4Å; I275-L382 HydrophobicContact CD1-CD1 4.4Å
276	S	88.7	Confident	92.1	Very high	33 Å²	33	34.3 Å²	34.3	23%	0.231	17%	0.173	C	C	.	.	S	Bend	trans	-112.2	171.5	177.3	56.2	0	0	0	0	112.7	E246 E272 R273 N278 A279 L280	E246-S276 PolarHBondContact OE1-OG 3.3Å; E272-S276 PolarHBondContact O-OG 3.2Å; R273-S276 PolarHBondContact O-N 3.44Å; R273-S276 PolarHBondContact O-OG 2.55Å; S276-N278 PolarHBondContact O-N 2.77Å; S276-A279 WeakPolarHBondContact O-CB 3.25Å; S276-A279 PolarHBondContact O-N 2.73Å; S276-L280 PolarHBondContact O-N 2.66Å
277	G	86.7	Confident	92.2	Very high	50 Å²	50	33.3 Å²	33.3	52%	0.515	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	-131.3	167.4	0	0	0	0	0	114.6
278	N	87.9	Confident	92.2	Very high	59 Å²	59	33.4 Å²	33.4	32%	0.316	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-31.9	-179.1	-167.2	19.1	0	0	0	112.4	D247 S276 L280 R281	D247-N278 PolarHBondContact OD1-ND2 2.67Å; S276-N278 PolarHBondContact O-N 2.77Å; N278-L280 VanDerWaalsContact C-N 3.34Å; N278-L280 PolarHBondContact O-N 2.78Å; N278-R281 WeakPolarHBondContact O-CB 3.4Å; N278-R281 PolarHBondContact O-N 2.76Å
279	A	91.5	Very high	92.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-60.2	-41	-178.6	0	0	0	0	0	112.5	A249 Y253 E274 S276 R281 Y282 A283	A249-A279 HydrophobicContact CB-CB 3.84Å; Y253-A279 HydrophobicContact CE2-CB 4.14Å; E274-A279 WeakPolarHBondContact O-CB 3.35Å; S276-A279 WeakPolarHBondContact O-CB 3.25Å; S276-A279 PolarHBondContact O-N 2.73Å; A279-R281 PolarHBondContact O-N 2.81Å; A279-R281 VanDerWaalsContact O-N 3.1Å; A279-Y282 PolarHBondContact O-N 3.01Å; A279-A283 PolarHBondContact O-N 2.87Å
280	L	92.1	Very high	92.2	Very high	65 Å²	65	33.5 Å²	33.5	34%	0.34	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-58.9	-26.3	-179.1	-174.1	62.4	0	0	0	113.4	S276 N278 Y282 L377 L382	S276-L280 PolarHBondContact O-N 2.66Å; N278-L280 VanDerWaalsContact C-N 3.34Å; N278-L280 PolarHBondContact O-N 2.78Å; L280-Y282 VanDerWaalsContact C-N 3.28Å; L280-Y282 PolarHBondContact O-N 3.1Å; L280-L377 HydrophobicContact CD1-CD1 3.86Å; L280-L382 HydrophobicContact CD1-CD1 4.36Å; L280-L382 HydrophobicContact CD1-CD2 4.41Å; L280-L382 HydrophobicContact CD1-CG 4.29Å
281	R	91	Very high	92.1	Very high	200 Å²	200	36.8 Å²	36.8	76%	0.755	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-69	-28.6	178.6	-62.7	-179.1	177.5	-173	-0.5	112.9	N278 A279	N278-R281 WeakPolarHBondContact O-CB 3.4Å; N278-R281 PolarHBondContact O-N 2.76Å; A279-R281 PolarHBondContact O-N 2.81Å; A279-R281 VanDerWaalsContact O-N 3.1Å
282	Y	92.7	Very high	92	Very high	115 Å²	115	37.3 Å²	37.3	45%	0.451	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-2.7	-177.3	-59	-75.7	0	0	0	112.9	A250 Y253 R254 A279 L280	A250-Y282 HydrophobicContact CB-CD2 3.97Å; Y253-Y282 WeakPolarHBondContact CB-O 3.18Å; R254-Y282 HydrophobicContact CG-CD1 3.72Å; R254-Y282 HydrophobicContact CG-CE1 4.24Å; R254-Y282 HydrophobicContact CG-CG 4.02Å; A279-Y282 PolarHBondContact O-N 3.01Å; L280-Y282 VanDerWaalsContact C-N 3.28Å; L280-Y282 PolarHBondContact O-N 3.1Å
283	A	92.9	Very high	92	Very high	14 Å²	14	39.3 Å²	39.3	12%	0.116	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-59.5	130.9	179.9	0	0	0	0	0	111.4	Y253 A279 I287 L377	Y253-A283 HydrophobicContact CD2-CB 4.23Å; Y253-A283 HydrophobicContact CE2-CB 3.97Å; A279-A283 PolarHBondContact O-N 2.87Å; A283-I287 HydrophobicContact CB-CD1 3.76Å; A283-L377 HydrophobicContact CB-CD2 3.74Å
284	P	92.6	Very high	91.8	Very high	17 Å²	17	41 Å²	41	11%	0.11	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-73.6	153.3	178	22.7	-22.6	0	0	0	111.8	Y253 T262 I287 L377	Y253-P284 HydrophobicContact CD1-CG 4.42Å; T262-P284 HydrophobicContact CG2-CB 3.6Å; T262-P284 HydrophobicContact CG2-CG 3.67Å; P284-I287 HydrophobicContact CB-CG2 4.36Å; P284-I287 HydrophobicContact CG-CG2 3.53Å; P284-I287 WeakPolarHBondContact O-CG2 3.41Å; P284-L377 VanDerWaalsContact O-CD2 3.27Å; P284-L377 WeakPolarHBondContact O-CD2 3.45Å
285	D	90.8	Very high	91.3	Very high	79 Å²	79	41.1 Å²	41.1	42%	0.422	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	145.7	175.2	-72.6	-44.1	0	0	0	111	R380	D285-R380 PolarHBondContact OD1-N 2.74Å
286	G	91.4	Very high	90.7	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	6.8	179.3	0	0	0	0	0	115.7	L377 I401 P403	G286-L377 PolarHBondContact N-O 3.4Å; G286-I401 VanDerWaalsContact CA-O 3.28Å; G286-I401 WeakPolarHBondContact CA-O 3.45Å; G286-P403 WeakPolarHBondContact O-CD 3.22Å
287	I	94.1	Very high	90.8	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.252	C	S	.	.			trans	-66	146.1	170.4	62.9	168	0	0	0	111.5	W268 V270 I275 A283 P284 N376 L377	W268-I287 HydrophobicContact CB-CB 4.38Å; W268-I287 HydrophobicContact CB-CG2 3.81Å; W268-I287 HydrophobicContact CG-CG2 4.4Å; V270-I287 HydrophobicContact CG2-CD1 4.3Å; I275-I287 HydrophobicContact CG2-CD1 3.94Å; A283-I287 HydrophobicContact CB-CD1 3.76Å; P284-I287 HydrophobicContact CB-CG2 4.36Å; P284-I287 HydrophobicContact CG-CG2 3.53Å; P284-I287 WeakPolarHBondContact O-CG2 3.41Å; I287-N376 WeakPolarHBondContact O-CA 3.45Å; I287-N376 PolarHBondContact O-OD1 3.07Å; I287-L377 HydrophobicContact CD1-CB 4.44Å; I287-L377 HydrophobicContact CD1-CD2 4.43Å; I287-L377 HydrophobicContact CG1-CB 3.67Å; I287-L377 HydrophobicContact CG1-CD2 4.29Å; I287-L377 PolarHBondContact O-N 3.27Å
288	L	94.6	Very high	90.9	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	111.7	172.2	-65.4	174.9	0	0	0	109.7	M154 W268 L269 V270 I374 M375 N376 V385 I400 W402	M154-L288 HydrophobicContact CE-CB 4.05Å; M154-L288 HydrophobicContact CE-CD1 3.61Å; M154-L288 HydrophobicContact CE-CG 4.4Å; W268-L288 PolarHBondContact O-N 3.13Å; L269-L288 WeakPolarHBondContact CA-O 3.47Å; L269-L288 HydrophobicContact CD2-CB 3.8Å; L269-L288 HydrophobicContact CD2-CD1 3.88Å; L269-L288 HydrophobicContact CD2-CG 4.41Å; V270-L288 PolarHBondContact N-O 3.35Å; L288-I374 HydrophobicContact CD2-CG2 4.48Å; L288-M375 CarbonylContact C-O 3.6Å; L288-M375 WeakPolarHBondContact CA-O 3.42Å; L288-N376 HydrophobicContact CD2-CB 3.92Å; L288-V385 HydrophobicContact CD2-CG2 4.22Å; L288-I400 HydrophobicContact CD2-CG2 4.2Å; L288-W402 HydrophobicContact CD1-CH2 3.88Å; L288-W402 HydrophobicContact CD1-CZ3 3.57Å; L288-W402 HydrophobicContact CG-CZ3 4.48Å
289	G	95	Very high	91.1	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	164	175.9	0	0	0	0	0	112.5	M375	G289-M375 PolarHBondContact N-O 3.47Å; G289-M375 PolarHBondContact O-N 3.02Å
290	L	94.9	Very high	91.1	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.9	177.3	-61.6	178.4	0	0	0	110.3	Q147 V150 W151 M154 V270 E272 I275 I374	Q147-L290 HydrophobicContact CB-CD1 3.79Å; Q147-L290 HydrophobicContact CG-CD1 4.34Å; V150-L290 HydrophobicContact CB-CD1 3.87Å; V150-L290 HydrophobicContact CB-CD2 4.2Å; V150-L290 HydrophobicContact CG1-CD1 4.19Å; V150-L290 HydrophobicContact CG1-CD2 3.56Å; V150-L290 HydrophobicContact CG2-CD1 4.43Å; W151-L290 VanDerWaalsContact NE1-CD1 3.3Å; M154-L290 HydrophobicContact SD-CD2 4.21Å; V270-L290 PolarHBondContact O-N 3.34Å; E272-L290 WeakPolarHBondContact CA-O 3.49Å; E272-L290 WeakPolarHBondContact CB-O 3.34Å; E272-L290 WeakPolarHBondContact CG-O 3.27Å; I275-L290 WeakPolarHBondContact CD1-O 3.15Å; L290-I374 HydrophobicContact CD2-CG1 4.29Å
291	Q	93.6	Very high	91.1	Very high	70 Å²	70	45.8 Å²	45.8	33%	0.327	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	127.7	172.8	179.1	174.7	14.1	0	0	110	Y372 S373 M375	Q291-Y372 CarbonylContact O-C 3.6Å; Q291-Y372 WeakPolarHBondContact O-CA 3.4Å; Q291-S373 WeakPolarHBondContact CB-OG 3.47Å; Q291-S373 PolarHBondContact N-O 2.96Å; Q291-S373 PolarHBondContact O-N 3.39Å; Q291-S373 PolarHBondContact O-OG 2.91Å; Q291-S373 VanDerWaalsContact O-OG 3.07Å; Q291-M375 HydrophobicContact CB-CG 3.88Å
292	L	92.6	Very high	91.3	Very high	11 Å²	11	36.3 Å²	36.3	6%	0.058	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	128	178.3	-178.3	68.3	0	0	0	110.9	V141 P142 E272 N294 G295 A370 N371 Y372	V141-L292 HydrophobicContact CB-CD2 4.23Å; V141-L292 HydrophobicContact CG1-CD2 4.1Å; P142-L292 HydrophobicContact CG-CD1 3.92Å; P142-L292 HydrophobicContact CG-CD2 4.26Å; E272-L292 WeakPolarHBondContact OE2-CB 3.37Å; E272-L292 PolarHBondContact OE2-N 3.04Å; L292-N294 PolarHBondContact O-N 3.23Å; L292-G295 PolarHBondContact O-N 3.05Å; L292-A370 HydrophobicContact CD1-CB 4.07Å; L292-N371 WeakPolarHBondContact CD1-O 3.3Å; L292-Y372 HydrophobicContact CB-CD1 4.14Å; L292-Y372 HydrophobicContact CB-CE1 3.97Å; L292-Y372 HydrophobicContact CD1-CD1 4.15Å; L292-Y372 HydrophobicContact CD1-CD2 4.37Å; L292-Y372 HydrophobicContact CD1-CE1 3.84Å; L292-Y372 HydrophobicContact CD1-CE2 4.08Å; L292-Y372 HydrophobicContact CD1-CG 4.42Å; L292-Y372 HydrophobicContact CG-CE1 4.49Å
293	I	90.8	Very high	91.3	Very high	66 Å²	66	32.7 Å²	32.7	34%	0.338	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	131.6	175.1	-59.1	-179.1	0	0	0	108.7	G295 N371 I387	I293-G295 PolarHBondContact O-N 2.91Å; I293-G295 VanDerWaalsContact O-N 3.15Å; I293-N371 HydrophobicContact CB-CB 4.47Å; I293-N371 WeakPolarHBondContact CB-O 3.33Å; I293-N371 HydrophobicContact CD1-CB 3.95Å; I293-N371 HydrophobicContact CG1-CB 4.49Å; I293-N371 PolarHBondContact N-O 3.18Å; I293-I387 HydrophobicContact CD1-CG2 4.23Å
294	N	87.8	Confident	91.2	Very high	60 Å²	60	32 Å²	32	32%	0.321	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	14.4	-175.5	-61.5	-39.8	0	0	0	115.4	L292 K296 N297 H301 T356	L292-N294 PolarHBondContact O-N 3.23Å; N294-K296 VanDerWaalsContact C-N 3.27Å; N294-K296 PolarHBondContact O-N 3.37Å; N294-N297 HydrophobicContact CB-CB 4.41Å; N294-N297 PolarHBondContact O-N 3.37Å; N294-N297 VanDerWaalsContact O-N 3.12Å; N294-H301 PolarHBondContact O-CD2 2.78Å; N294-H301 PolarHBondContact O-NE2 2.83Å; N294-T356 HydrophobicContact CB-CG2 4.21Å
295	G	81.7	Confident	91.3	Very high	9 Å²	9	31.2 Å²	31.2	9%	0.093	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-33	-177.1	0	0	0	0	0	114.7	L292 I293	L292-G295 PolarHBondContact O-N 3.05Å; I293-G295 PolarHBondContact O-N 2.91Å; I293-G295 VanDerWaalsContact O-N 3.15Å
296	K	81.6	Confident	91.4	Very high	174 Å²	174	27.5 Å²	27.5	76%	0.757	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-6.1	178.8	-61.6	-176.3	-179.7	-178.8	0	113.9	N294 E298	N294-K296 VanDerWaalsContact C-N 3.27Å; N294-K296 PolarHBondContact O-N 3.37Å; K296-E298 PolarHBondContact O-N 3Å
297	N	89.7	Confident	91.4	Very high	63 Å²	63	27.8 Å²	27.8	34%	0.337	15%	0.147	S	C	.	.			trans	-88.6	86.1	-174	-172	-7.9	0	0	0	111	N294 S299 A300 H301	N294-N297 HydrophobicContact CB-CB 4.41Å; N294-N297 PolarHBondContact O-N 3.37Å; N294-N297 VanDerWaalsContact O-N 3.12Å; N297-S299 VanDerWaalsContact C-N 3.26Å; N297-S299 PolarHBondContact O-N 2.9Å; N297-S299 PolarHBondContact OD1-N 2.91Å; N297-S299 PolarHBondContact OD1-OG 2.85Å; N297-A300 HydrophobicContact CB-CB 4.36Å; N297-A300 PolarHBondContact O-N 3.02Å; N297-A300 PolarHBondContact OD1-N 2.87Å; N297-H301 PolarHBondContact O-CD2 3.48Å; N297-H301 VanDerWaalsContact O-CD2 3.22Å; N297-H301 PolarHBondContact O-N 3.46Å
298	E	89.2	Confident	91.4	Very high	28 Å²	28	27.7 Å²	27.7	13%	0.131	15%	0.146	C	C	.	.	H	α-helix	trans	-57.1	-39.8	-179.3	-54.5	-163.1	145.1	0	0	112.4	S34 H38 T122 K296 A300 H301 I302	S34-E298 WeakPolarHBondContact CB-OE2 3.49Å; S34-E298 PolarHBondContact OG-OE2 2.78Å; H38-E298 IonicContact CE1-OE2 3.92Å; H38-E298 PolarHBondContact CE1-OE2 2.88Å; H38-E298 IonicContact CG-OE2 3.51Å; H38-E298 IonicContact ND1-OE2 2.64Å; H38-E298 PolarHBondContact ND1-OE2 3.1Å; H38-E298 VanDerWaalsContact ND1-OE2 3.16Å; H38-E298 IonicContact NE2-OE2 3.11Å; T122-E298 HydrophobicContact CG2-CG 3.74Å; K296-E298 PolarHBondContact O-N 3Å; E298-A300 VanDerWaalsContact C-N 3.34Å; E298-A300 PolarHBondContact O-N 3.49Å; E298-H301 PolarHBondContact O-N 2.71Å; E298-I302 VanDerWaalsContact O-CG1 3.23Å; E298-I302 WeakPolarHBondContact O-CG1 3.33Å; E298-I302 PolarHBondContact O-N 3.13Å
299	S	92	Very high	91.3	Very high	42 Å²	42	27.6 Å²	27.6	29%	0.294	15%	0.146	S	C	.	.	H	α-helix	trans	-61	-40.6	-176.9	69.3	0	0	0	0	113.3	N297 I302 S303	N297-S299 VanDerWaalsContact C-N 3.26Å; N297-S299 PolarHBondContact O-N 2.9Å; N297-S299 PolarHBondContact OD1-N 2.91Å; N297-S299 PolarHBondContact OD1-OG 2.85Å; S299-I302 PolarHBondContact O-N 3.45Å; S299-S303 PolarHBondContact O-N 3.17Å
300	A	92.3	Very high	91.1	Very high	5 Å²	5	27.6 Å²	27.6	4%	0.041	15%	0.146	C	C	.	.	H	α-helix	trans	-68.3	-42.8	177.6	0	0	0	0	0	111.4	N297 E298 I302 S303 D304 V355 T356	N297-A300 HydrophobicContact CB-CB 4.36Å; N297-A300 PolarHBondContact O-N 3.02Å; N297-A300 PolarHBondContact OD1-N 2.87Å; E298-A300 VanDerWaalsContact C-N 3.34Å; E298-A300 PolarHBondContact O-N 3.49Å; A300-I302 VanDerWaalsContact C-N 3.34Å; A300-I302 PolarHBondContact O-N 3.2Å; A300-S303 PolarHBondContact O-N 3.13Å; A300-D304 PolarHBondContact O-N 3.01Å; A300-D304 VanDerWaalsContact O-N 3.13Å; A300-V355 HydrophobicContact CB-CB 4.31Å; A300-V355 HydrophobicContact CB-CG1 3.84Å; A300-T356 HydrophobicContact CB-CG2 3.62Å
301	H	92.3	Very high	90.8	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.009	15%	0.154	C	C	.	.	H	α-helix	trans	-66.3	-34.3	176.4	-73.1	-71.3	0	0	0	112.6	L121 T140 V141 N294 N297 E298 A305	L121-H301 HydrophobicContact CB-CB 4.25Å; L121-H301 HydrophobicContact CD2-CB 4.21Å; T140-H301 PolarHBondContact OG1-ND1 3.06Å; T140-H301 VanDerWaalsContact OG1-ND1 3.13Å; V141-H301 WeakPolarHBondContact CG1-CE1 3.27Å; N294-H301 PolarHBondContact O-CD2 2.78Å; N294-H301 PolarHBondContact O-NE2 2.83Å; N297-H301 PolarHBondContact O-CD2 3.48Å; N297-H301 VanDerWaalsContact O-CD2 3.22Å; N297-H301 PolarHBondContact O-N 3.46Å; E298-H301 PolarHBondContact O-N 2.71Å; H301-A305 WeakPolarHBondContact O-CB 3.35Å; H301-A305 PolarHBondContact O-N 3.43Å
302	I	94	Very high	90.7	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-61.5	-49.4	174.5	-70.7	166	0	0	0	110.2	L33 H38 F42 A45 L121 E298 S299 A300 D304 A305 V306	L33-I302 HydrophobicContact CD1-CD1 4.36Å; L33-I302 HydrophobicContact CD2-CD1 4.04Å; L33-I302 HydrophobicContact CD2-CG1 4.37Å; H38-I302 HydrophobicContact CB-CD1 3.99Å; F42-I302 HydrophobicContact CB-CG2 3.96Å; F42-I302 HydrophobicContact CD2-CG2 4.1Å; A45-I302 HydrophobicContact CB-CG2 4.31Å; L121-I302 HydrophobicContact CD1-CG1 3.6Å; E298-I302 VanDerWaalsContact O-CG1 3.23Å; E298-I302 WeakPolarHBondContact O-CG1 3.33Å; E298-I302 PolarHBondContact O-N 3.13Å; S299-I302 PolarHBondContact O-N 3.45Å; A300-I302 VanDerWaalsContact C-N 3.34Å; A300-I302 PolarHBondContact O-N 3.2Å; I302-D304 VanDerWaalsContact C-N 3.34Å; I302-D304 PolarHBondContact O-N 3.38Å; I302-A305 PolarHBondContact O-N 3.08Å; I302-V306 HydrophobicContact CG2-CG2 4.43Å; I302-V306 WeakPolarHBondContact O-CB 3.3Å; I302-V306 VanDerWaalsContact O-CG2 3.26Å; I302-V306 WeakPolarHBondContact O-CG2 3.33Å; I302-V306 PolarHBondContact O-N 3.39Å
303	S	92.8	Very high	90.5	Very high	38 Å²	38	25.7 Å²	25.7	27%	0.266	14%	0.137	S	C	.	.	H	α-helix	trans	-57.9	-47.1	179.3	-176.7	0	0	0	0	111.6	S299 A300 G307	S299-S303 PolarHBondContact O-N 3.17Å; A300-S303 PolarHBondContact O-N 3.13Å; S303-G307 PolarHBondContact O-N 3.22Å
304	D	92.8	Very high	90.3	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-70	-42.4	-178.5	-68.8	-6.9	0	0	0	112.2	A300 I302 V306 G307 V308 G354 V355 T356 V359	A300-D304 PolarHBondContact O-N 3.01Å; A300-D304 VanDerWaalsContact O-N 3.13Å; I302-D304 VanDerWaalsContact C-N 3.34Å; I302-D304 PolarHBondContact O-N 3.38Å; D304-V306 VanDerWaalsContact C-N 3.34Å; D304-V306 PolarHBondContact O-N 3.46Å; D304-G307 PolarHBondContact O-N 3.42Å; D304-V308 WeakPolarHBondContact O-CG2 3.45Å; D304-V308 PolarHBondContact O-N 3.18Å; D304-G354 WeakPolarHBondContact OD1-CA 3.37Å; D304-V355 PolarHBondContact OD1-N 2.63Å; D304-V355 PolarHBondContact OD2-N 3.41Å; D304-T356 WeakPolarHBondContact OD2-CA 3.34Å; D304-T356 WeakPolarHBondContact OD2-CB 3.44Å; D304-T356 VanDerWaalsContact OD2-CG2 3.3Å; D304-T356 WeakPolarHBondContact OD2-CG2 3.49Å; D304-T356 PolarHBondContact OD2-N 2.64Å; D304-T356 PolarHBondContact OD2-OG1 3.05Å; D304-V359 HydrophobicContact CB-CG2 4.38Å
305	A	93.6	Very high	90.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.3	-41.9	177.6	0	0	0	0	0	111.7	L91 L119 L121 T140 H301 I302 V308 V309	L91-A305 HydrophobicContact CD2-CB 3.65Å; L91-A305 HydrophobicContact CG-CB 4.3Å; L119-A305 HydrophobicContact CD2-CB 4.2Å; L121-A305 HydrophobicContact CD2-CB 3.52Å; T140-A305 HydrophobicContact CG2-CB 3.93Å; H301-A305 WeakPolarHBondContact O-CB 3.35Å; H301-A305 PolarHBondContact O-N 3.43Å; I302-A305 PolarHBondContact O-N 3.08Å; A305-V308 PolarHBondContact O-N 3.13Å; A305-V309 VanDerWaalsContact O-CG2 3.25Å; A305-V309 WeakPolarHBondContact O-CG2 3.36Å; A305-V309 PolarHBondContact O-N 2.83Å
306	V	93.7	Very high	90.5	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-65.8	-39.6	175.3	173.1	0	0	0	0	110.9	F42 A45 V46 A49 L91 I302 D304 V309 A310	F42-V306 HydrophobicContact CD2-CG2 3.7Å; F42-V306 HydrophobicContact CE2-CG2 3.66Å; A45-V306 HydrophobicContact CB-CB 4.21Å; A45-V306 HydrophobicContact CB-CG1 4.3Å; A45-V306 HydrophobicContact CB-CG2 4.19Å; V46-V306 HydrophobicContact CB-CG1 4.42Å; V46-V306 HydrophobicContact CG2-CG1 3.77Å; V46-V306 HydrophobicContact CG2-CG2 4.15Å; A49-V306 HydrophobicContact CB-CG1 3.9Å; L91-V306 HydrophobicContact CD2-CG2 3.95Å; I302-V306 HydrophobicContact CG2-CG2 4.43Å; I302-V306 WeakPolarHBondContact O-CB 3.3Å; I302-V306 VanDerWaalsContact O-CG2 3.26Å; I302-V306 WeakPolarHBondContact O-CG2 3.33Å; I302-V306 PolarHBondContact O-N 3.39Å; D304-V306 VanDerWaalsContact C-N 3.34Å; D304-V306 PolarHBondContact O-N 3.46Å; V306-V309 PolarHBondContact O-N 3.11Å; V306-A310 VanDerWaalsContact O-CB 3.27Å; V306-A310 WeakPolarHBondContact O-CB 3.4Å; V306-A310 PolarHBondContact O-N 3.38Å
307	G	91.6	Very high	90.4	Very high	5 Å²	5	18 Å²	18	5%	0.052	10%	0.099	C	C	.	.	H	α-helix	trans	-59.2	-47.2	174	0	0	0	0	0	112.7	S303 D304 A310 Q311	S303-G307 PolarHBondContact O-N 3.22Å; D304-G307 PolarHBondContact O-N 3.42Å; G307-A310 PolarHBondContact O-N 2.87Å; G307-Q311 PolarHBondContact O-N 3.37Å
308	V	93	Very high	89.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.2	-46.5	175.8	168.3	0	0	0	0	111.5	D304 A305 Q311 A312 L346 S349 Y351 V359 F361	D304-V308 WeakPolarHBondContact O-CG2 3.45Å; D304-V308 PolarHBondContact O-N 3.18Å; A305-V308 PolarHBondContact O-N 3.13Å; V308-Q311 PolarHBondContact O-N 3.11Å; V308-A312 WeakPolarHBondContact O-CB 3.09Å; V308-A312 PolarHBondContact O-N 3.09Å; V308-L346 HydrophobicContact CG1-CD2 4.38Å; V308-L346 HydrophobicContact CG1-CG 4.29Å; V308-S349 WeakPolarHBondContact CG1-OG 3.35Å; V308-Y351 HydrophobicContact CG2-CD1 4.42Å; V308-Y351 HydrophobicContact CG2-CG 4.03Å; V308-V359 HydrophobicContact CG2-CB 4.21Å; V308-V359 HydrophobicContact CG2-CG1 4.04Å; V308-F361 HydrophobicContact CG1-CE2 3.96Å; V308-F361 HydrophobicContact CG1-CZ 4.36Å
309	V	93	Very high	89	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.9	-44.3	178.2	172.3	0	0	0	0	110.6	I29 A89 L119 A305 V306 Q311 A312 V313 L346	I29-V309 HydrophobicContact CD1-CG1 3.64Å; I29-V309 HydrophobicContact CG1-CG1 4.13Å; A89-V309 HydrophobicContact CB-CG1 4.31Å; A89-V309 HydrophobicContact CB-CG2 4.33Å; L119-V309 HydrophobicContact CD1-CG2 4.09Å; L119-V309 HydrophobicContact CD2-CG2 3.99Å; A305-V309 VanDerWaalsContact O-CG2 3.25Å; A305-V309 WeakPolarHBondContact O-CG2 3.36Å; A305-V309 PolarHBondContact O-N 2.83Å; V306-V309 PolarHBondContact O-N 3.11Å; V309-Q311 PolarHBondContact O-N 2.77Å; V309-A312 PolarHBondContact O-N 2.84Å; V309-V313 HydrophobicContact CG1-CG2 4.14Å; V309-V313 WeakPolarHBondContact O-CB 3.27Å; V309-V313 VanDerWaalsContact O-CG2 3.23Å; V309-V313 WeakPolarHBondContact O-CG2 3.35Å; V309-V313 PolarHBondContact O-N 2.79Å; V309-L346 HydrophobicContact CG2-CD1 4.03Å
310	A	90.4	Very high	88.2	Confident	2 Å²	2	30.5 Å²	30.5	2%	0.017	15%	0.148	C	C	.	.	H	α-helix	trans	-60.9	-44.3	179.3	0	0	0	0	0	112	A49 L60 V306 G307 V313 H314	A49-A310 HydrophobicContact CB-CB 3.81Å; L60-A310 HydrophobicContact CD1-CB 3.66Å; V306-A310 VanDerWaalsContact O-CB 3.27Å; V306-A310 WeakPolarHBondContact O-CB 3.4Å; V306-A310 PolarHBondContact O-N 3.38Å; G307-A310 PolarHBondContact O-N 2.87Å; A310-V313 PolarHBondContact O-N 3.11Å; A310-H314 WeakPolarHBondContact O-CB 3.43Å; A310-H314 PolarHBondContact O-N 2.82Å
311	Q	89.7	Confident	87.4	Confident	40 Å²	40	38.5 Å²	38.5	19%	0.187	19%	0.19	C	C	.	.	H	α-helix	trans	-62.2	-46.5	174.7	-179	175.7	-14.3	0	0	111.5	G307 V308 V309 V313 H314 E315	G307-Q311 PolarHBondContact O-N 3.37Å; V308-Q311 PolarHBondContact O-N 3.11Å; V309-Q311 PolarHBondContact O-N 2.77Å; Q311-V313 VanDerWaalsContact C-N 3.35Å; Q311-V313 PolarHBondContact O-N 2.9Å; Q311-H314 PolarHBondContact O-N 2.79Å; Q311-E315 WeakPolarHBondContact CG-OE1 3.32Å; Q311-E315 PolarHBondContact NE2-OE1 3.38Å; Q311-E315 WeakPolarHBondContact O-CG 3.48Å; Q311-E315 PolarHBondContact O-N 3.08Å
312	A	90.6	Very high	86.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.4	-37.4	179.9	0	0	0	0	0	112.8	V308 V309 L316 F342 V345 L346	V308-A312 WeakPolarHBondContact O-CB 3.09Å; V308-A312 PolarHBondContact O-N 3.09Å; V309-A312 PolarHBondContact O-N 2.84Å; A312-L316 VanDerWaalsContact O-CB 3.29Å; A312-L316 WeakPolarHBondContact O-CB 3.48Å; A312-L316 PolarHBondContact O-N 2.03Å; A312-F342 HydrophobicContact CB-CE2 4.01Å; A312-V345 HydrophobicContact CB-CG1 4.23Å; A312-L346 HydrophobicContact CB-CB 4.15Å; A312-L346 HydrophobicContact CB-CD1 4.29Å; A312-L346 HydrophobicContact CB-CG 4.22Å
313	V	89.1	Confident	86.6	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-46.1	175.2	169.2	0	0	0	0	110.1	V27 I58 L60 V309 A310 Q311 L316 L317 F342	V27-V313 HydrophobicContact CB-CG1 4.42Å; V27-V313 HydrophobicContact CG1-CG1 4.04Å; V27-V313 HydrophobicContact CG1-CG2 4.23Å; V27-V313 HydrophobicContact CG2-CG1 4.12Å; I58-V313 HydrophobicContact CG2-CG1 4.37Å; L60-V313 HydrophobicContact CD2-CB 4.45Å; L60-V313 HydrophobicContact CD2-CG1 4Å; V309-V313 HydrophobicContact CG1-CG2 4.14Å; V309-V313 WeakPolarHBondContact O-CB 3.27Å; V309-V313 VanDerWaalsContact O-CG2 3.23Å; V309-V313 WeakPolarHBondContact O-CG2 3.35Å; V309-V313 PolarHBondContact O-N 2.79Å; A310-V313 PolarHBondContact O-N 3.11Å; Q311-V313 VanDerWaalsContact C-N 3.35Å; Q311-V313 PolarHBondContact O-N 2.9Å; V313-L316 PolarHBondContact O-N 2.92Å; V313-L317 HydrophobicContact CG1-CD1 3.83Å; V313-L317 WeakPolarHBondContact O-CB 3.39Å; V313-L317 WeakPolarHBondContact O-CD1 3.25Å; V313-L317 PolarHBondContact O-N 3.41Å; V313-F342 HydrophobicContact CG2-CE2 3.84Å; V313-F342 HydrophobicContact CG2-CZ 3.66Å
314	H	86.3	Confident	86.3	Confident	55 Å²	55	44.8 Å²	44.8	26%	0.255	22%	0.223	S	C	.	.	H	α-helix	trans	-60.3	-48.9	177.9	-168.9	68.7	0	0	0	111.5	A310 Q311 L316 L317 E318	A310-H314 WeakPolarHBondContact O-CB 3.43Å; A310-H314 PolarHBondContact O-N 2.82Å; Q311-H314 PolarHBondContact O-N 2.79Å; H314-L316 VanDerWaalsContact C-N 3.31Å; H314-L316 PolarHBondContact O-N 2.79Å; H314-L317 PolarHBondContact O-N 2.87Å; H314-E318 IonicContact CE1-OE1 3.09Å; H314-E318 IonicContact NE2-OE1 3.79Å; H314-E318 PolarHBondContact NE2-OE1 3.17Å; H314-E318 WeakPolarHBondContact O-CG 2.98Å; H314-E318 PolarHBondContact O-N 3.49Å
315	E	86.7	Confident	86.1	Confident	50 Å²	50	44.8 Å²	44.8	23%	0.234	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-33.9	178.5	-72.7	-179.4	-160.3	0	0	113.5	Q311 K319 V345	Q311-E315 WeakPolarHBondContact CG-OE1 3.32Å; Q311-E315 PolarHBondContact NE2-OE1 3.38Å; Q311-E315 WeakPolarHBondContact O-CG 3.48Å; Q311-E315 PolarHBondContact O-N 3.08Å; E315-K319 WeakPolarHBondContact O-CD 3.4Å; E315-K319 WeakPolarHBondContact O-CG 3.3Å; E315-V345 HydrophobicContact CB-CG1 4.07Å
316	L	85.9	Confident	85.9	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-75.6	-45.1	-179.9	-173.6	73.2	0	0	0	111.5	A312 V313 H314 E318 K319 E320 I322 T338 L341 F342 V345	A312-L316 VanDerWaalsContact O-CB 3.29Å; A312-L316 WeakPolarHBondContact O-CB 3.48Å; A312-L316 PolarHBondContact O-N 2.03Å; V313-L316 PolarHBondContact O-N 2.92Å; H314-L316 VanDerWaalsContact C-N 3.31Å; H314-L316 PolarHBondContact O-N 2.79Å; L316-E318 VanDerWaalsContact C-N 3.28Å; L316-E318 PolarHBondContact O-N 3.43Å; L316-K319 PolarHBondContact O-N 2.83Å; L316-E320 PolarHBondContact O-N 2.03Å; L316-I322 HydrophobicContact CB-CD1 4.26Å; L316-I322 HydrophobicContact CD2-CD1 3.46Å; L316-I322 VanDerWaalsContact CD2-CD1 3.46Å; L316-I322 HydrophobicContact CD2-CG1 3.97Å; L316-I322 HydrophobicContact CG-CD1 3.51Å; L316-I322 HydrophobicContact CG-CG1 4.03Å; L316-T338 HydrophobicContact CD2-CG2 4.29Å; L316-L341 HydrophobicContact CD1-CD2 3.75Å; L316-L341 HydrophobicContact CD1-CG 3.84Å; L316-F342 HydrophobicContact CB-CD2 4.42Å; L316-F342 HydrophobicContact CD2-CB 3.81Å; L316-F342 HydrophobicContact CD2-CD2 3.51Å; L316-F342 HydrophobicContact CD2-CE2 4.41Å; L316-F342 HydrophobicContact CD2-CG 3.96Å; L316-F342 HydrophobicContact CG-CD2 4.48Å; L316-V345 HydrophobicContact CD1-CG2 3.76Å
317	L	80.5	Confident	85.5	Confident	38 Å²	38	54.4 Å²	54.4	20%	0.199	26%	0.261	C	S	.	.	H	α-helix	trans	-71.9	-21.2	-176.7	-89	78	0	0	0	113.1	K25 V27 I58 V313 H314 I322	K25-L317 HydrophobicContact CD-CD2 4.26Å; V27-L317 HydrophobicContact CG2-CD2 4.34Å; I58-L317 HydrophobicContact CD1-CB 3.61Å; I58-L317 HydrophobicContact CD1-CD2 3.6Å; I58-L317 HydrophobicContact CD1-CG 4.19Å; I58-L317 HydrophobicContact CG1-CD2 3.72Å; I58-L317 HydrophobicContact CG2-CD2 4.25Å; V313-L317 HydrophobicContact CG1-CD1 3.83Å; V313-L317 WeakPolarHBondContact O-CB 3.39Å; V313-L317 WeakPolarHBondContact O-CD1 3.25Å; V313-L317 PolarHBondContact O-N 3.41Å; H314-L317 PolarHBondContact O-N 2.87Å; L317-I322 HydrophobicContact CB-CD1 4.38Å; L317-I322 HydrophobicContact CD1-CD1 3.26Å; L317-I322 HydrophobicContact CG-CD1 3.6Å
318	E	76.4	Confident	85.2	Confident	137 Å²	137	54.7 Å²	54.7	64%	0.64	26%	0.264	S	S	*	.	H	α-helix	trans	-76.5	-26	172.8	-75.1	-169.7	153.7	0	0	113.4	H314 L316	H314-E318 IonicContact CE1-OE1 3.09Å; H314-E318 IonicContact NE2-OE1 3.79Å; H314-E318 PolarHBondContact NE2-OE1 3.17Å; H314-E318 WeakPolarHBondContact O-CG 2.98Å; H314-E318 PolarHBondContact O-N 3.49Å; L316-E318 VanDerWaalsContact C-N 3.28Å; L316-E318 PolarHBondContact O-N 3.43Å
319	K	73.1	Confident	84.9	Confident	154 Å²	154	56.5 Å²	56.5	67%	0.67	28%	0.276	S	S	*	.	H	α-helix	trans	-98.9	-32.4	-170.2	-70.2	176.5	-176.1	167.8	0	114.2	E315 L316	E315-K319 WeakPolarHBondContact O-CD 3.4Å; E315-K319 WeakPolarHBondContact O-CG 3.3Å; L316-K319 PolarHBondContact O-N 2.83Å
320	E	74.1	Confident	84.5	Confident	105 Å²	105	63.2 Å²	63.2	49%	0.491	32%	0.317	S	S	.	.	S	Bend	trans	-143.7	153.5	-172.1	-66.1	-171.3	-162.3	0	0	114	L316 I322 L341	L316-E320 PolarHBondContact O-N 2.03Å; E320-I322 PolarHBondContact O-N 2.99Å; E320-L341 WeakPolarHBondContact OE2-CD2 3.21Å
321	N	77	Confident	83.9	Confident	174 Å²	174	67.1 Å²	67.1	93%	0.93	36%	0.357	S	S	*	.			trans	-78.8	110.3	169	-80.4	-18.5	0	0	0	110.1
322	I	81.5	Confident	83.4	Confident	22 Å²	22	68 Å²	68	11%	0.113	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-94.2	138.8	-173.1	-60	157	0	0	0	111.3	Y88 L316 L317 E320 W336 T338	Y88-I322 HydrophobicContact CE1-CG2 4.12Å; L316-I322 HydrophobicContact CB-CD1 4.26Å; L316-I322 HydrophobicContact CD2-CD1 3.46Å; L316-I322 VanDerWaalsContact CD2-CD1 3.46Å; L316-I322 HydrophobicContact CD2-CG1 3.97Å; L316-I322 HydrophobicContact CG-CD1 3.51Å; L316-I322 HydrophobicContact CG-CG1 4.03Å; L317-I322 HydrophobicContact CB-CD1 4.38Å; L317-I322 HydrophobicContact CD1-CD1 3.26Å; L317-I322 HydrophobicContact CG-CD1 3.6Å; E320-I322 PolarHBondContact O-N 2.99Å; I322-W336 HydrophobicContact CG2-CZ2 4.31Å; I322-T338 HydrophobicContact CB-CG2 4.09Å; I322-T338 HydrophobicContact CG1-CG2 4.01Å; I322-T338 HydrophobicContact CG2-CG2 3.45Å; I322-T338 VanDerWaalsContact CG2-CG2 3.45Å
323	T	85.9	Confident	83	Confident	73 Å²	73	73.5 Å²	73.5	45%	0.448	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-77.1	142.3	165.8	58.4	0	0	0	0	110.8	W336 T338	T323-W336 PolarHBondContact O-NE1 3.11Å; T323-W336 PolarHBondContact OG1-NE1 3.17Å; T323-T338 PolarHBondContact N-OG1 2.93Å; T323-T338 PolarHBondContact OG1-OG1 3.19Å
324	D	86.7	Confident	82.9	Confident	77 Å²	77	79 Å²	79	41%	0.412	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-75.1	148.3	178.3	-58.3	-28.6	0	0	0	111	K25 Y88	K25-D324 WeakPolarHBondContact CE-OD1 3.12Å; K25-D324 IonicContact NZ-OD1 3.75Å; K25-D324 PolarHBondContact NZ-OD1 3.21Å; Y88-D324 PolarHBondContact OH-OD1 3.45Å
325	P	89.9	Confident	83.1	Confident	2 Å²	2	80.9 Å²	80.9	1%	0.013	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-64.8	158.9	176	25.7	-31.8	0	0	0	111.5	Q86 Y88 W336	Q86-P325 HydrophobicContact CB-CG 3.97Å; Q86-P325 PolarHBondContact NE2-O 2.88Å; Q86-P325 WeakPolarHBondContact O-CG 3.41Å; Y88-P325 HydrophobicContact CD2-CG 3.98Å; Y88-P325 HydrophobicContact CE2-CG 3.94Å; Y88-P325 HydrophobicContact CG-CG 4.45Å; P325-W336 HydrophobicContact CB-CD2 4.13Å; P325-W336 HydrophobicContact CB-CE3 4.38Å; P325-W336 HydrophobicContact CB-CG 4.47Å
326	P	89.6	Confident	83.4	Confident	10 Å²	10	79 Å²	79	7%	0.065	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-59.5	141.4	-174.9	25.6	-36.2	0	0	0	112.5	I83 Y114 G328 N332	I83-P326 HydrophobicContact CG2-CG 4.35Å; I83-P326 VanDerWaalsContact O-O 3.06Å; Y114-P326 HydrophobicContact CD1-CB 4.47Å; Y114-P326 HydrophobicContact CD1-CG 3.69Å; Y114-P326 HydrophobicContact CD2-CG 4.38Å; Y114-P326 HydrophobicContact CE1-CB 4.46Å; Y114-P326 HydrophobicContact CE1-CG 4.08Å; Y114-P326 HydrophobicContact CG-CG 3.85Å; P326-G328 PolarHBondContact O-N 3.42Å; P326-G328 VanDerWaalsContact O-N 3.13Å; P326-N332 HydrophobicContact CB-CB 4.48Å; P326-N332 WeakPolarHBondContact CB-ND2 3Å
327	R	85.4	Confident	83.5	Confident	193 Å²	193	87.3 Å²	87.3	73%	0.728	46%	0.464	S	S	*	.	S	Bend	trans	-81.9	83.5	174.1	-72.6	-176.3	176.5	173.3	1.6	109.9	Q86	Q86-R327 VanDerWaalsContact CD-NE 3.32Å; Q86-R327 HydrophobicContact CG-CB 4.48Å; Q86-R327 HydrophobicContact CG-CG 3.54Å; Q86-R327 VanDerWaalsContact NE2-CG 3.32Å
328	G	84.8	Confident	83.9	Confident	11 Å²	11	86.3 Å²	86.3	11%	0.113	46%	0.459	C	S	.	.	S	Bend	trans	80.6	172.4	179.9	0	0	0	0	0	114.3	I83 P326	I83-G328 PolarHBondContact O-N 2.99Å; P326-G328 PolarHBondContact O-N 3.42Å; P326-G328 VanDerWaalsContact O-N 3.13Å
329	C	86.6	Confident	84.5	Confident	37 Å²	37	79.8 Å²	79.8	25%	0.25	43%	0.429	C	S	.	.	S	Bend	trans	-88.1	-10.7	-175.4	-65.1	0	0	0	0	114.2	C79 Y114	C79-C329 WeakPolarHBondContact CA-SG 3.44Å; C79-C329 HydrophobicContact CB-CB 3.78Å; C79-C329 WeakPolarHBondContact CB-SG 3.27Å; C79-C329 WeakPolarHBondContact SG-CB 3.48Å; C79-C329 CovalentContact SG-SG 2.05Å; C79-C329 PolarHBondContact SG-SG 2.88Å; Y114-C329 WeakPolarHBondContact OH-CA 3.27Å; Y114-C329 PolarHBondContact OH-O 2.85Å
330	V	83.8	Confident	85.4	Confident	142 Å²	142	75.4 Å²	75.4	86%	0.861	42%	0.416	S	S	*	.	S	Bend	trans	-89	127.3	-176.4	-176.5	0	0	0	0	110.3	N332	V330-N332 VanDerWaalsContact C-N 3.35Å; V330-N332 PolarHBondContact O-N 3.46Å
331	G	78.4	Confident	86.1	Confident	83 Å²	83	72.1 Å²	72.1	86%	0.856	40%	0.402	S	S	*	.	S	Bend	trans	83.4	-2.4	171.9	0	0	0	0	0	116.1
332	N	79.8	Confident	86.8	Confident	58 Å²	58	63.9 Å²	63.9	31%	0.31	36%	0.358	S	S	.	.			trans	-118.2	108.6	175.6	-162.4	-6.2	0	0	0	112.2	Y114 P326 V330 N334	Y114-N332 WeakPolarHBondContact CE1-O 3.36Å; Y114-N332 PolarHBondContact OH-O 3.16Å; Y114-N332 VanDerWaalsContact OH-O 3.08Å; P326-N332 HydrophobicContact CB-CB 4.48Å; P326-N332 WeakPolarHBondContact CB-ND2 3Å; V330-N332 VanDerWaalsContact C-N 3.35Å; V330-N332 PolarHBondContact O-N 3.46Å; N332-N334 PolarHBondContact OD1-N 3.27Å; N332-N334 VanDerWaalsContact OD1-N 3.09Å
333	T	82.5	Confident	87.3	Confident	117 Å²	117	64.3 Å²	64.3	72%	0.718	36%	0.359	S	S	*	.			trans	-95.4	-7.4	177.2	53.6	0	0	0	0	113.2
334	N	86.8	Confident	87.5	Confident	116 Å²	116	69.1 Å²	69.1	62%	0.62	37%	0.369	S	S	*	.	S	Bend	trans	-87.1	147.3	-177.2	-72	-41.7	0	0	0	111.8	N332	N332-N334 PolarHBondContact OD1-N 3.27Å; N332-N334 VanDerWaalsContact OD1-N 3.09Å
335	I	89.9	Confident	87.8	Confident	95 Å²	95	66.4 Å²	66.4	49%	0.487	36%	0.355	S	S	.	.			trans	-71.4	149.2	172.9	63.5	173.2	0	0	0	111.2	R115 K337	R115-I335 HydrophobicContact CG-CB 4.32Å; I335-K337 PolarHBondContact O-N 2.71Å
336	W	92	Very high	87.8	Confident	10 Å²	10	66.3 Å²	66.3	4%	0.038	35%	0.354	C	S	.	.			trans	-74.2	108.6	170.8	178.7	40.9	0	0	0	109.9	Y88 Y114 I116 I322 T323 P325 T338 G339 P340 F342	Y88-W336 AromaticContact CD1-CH2 3.69Å; Y88-W336 HydrophobicContact CD1-CH2 3.69Å; Y88-W336 AromaticContact CD1-CZ2 3.89Å; Y88-W336 HydrophobicContact CD1-CZ2 3.89Å; Y88-W336 HydrophobicContact CE1-CH2 4.23Å; Y88-W336 AromaticContact CE1-CZ2 3.94Å; Y88-W336 HydrophobicContact CE1-CZ2 3.94Å; Y88-W336 HydrophobicContact CG-CH2 4.35Å; Y114-W336 VanDerWaalsContact O-CB 3.22Å; Y114-W336 WeakPolarHBondContact O-CB 3.47Å; Y114-W336 PolarHBondContact O-N 3.44Å; I116-W336 HydrophobicContact CG1-CE3 4.03Å; I116-W336 HydrophobicContact CG1-CZ3 4.45Å; I322-W336 HydrophobicContact CG2-CZ2 4.31Å; T323-W336 PolarHBondContact O-NE1 3.11Å; T323-W336 PolarHBondContact OG1-NE1 3.17Å; P325-W336 HydrophobicContact CB-CD2 4.13Å; P325-W336 HydrophobicContact CB-CE3 4.38Å; P325-W336 HydrophobicContact CB-CG 4.47Å; W336-T338 HydrophobicContact CZ2-CG2 4.37Å; W336-T338 PolarHBondContact O-N 3.37Å; W336-G339 VanDerWaalsContact CZ3-CA 3.49Å; W336-G339 PolarHBondContact O-N 3.44Å; W336-G339 VanDerWaalsContact O-N 3.1Å; W336-P340 WeakPolarHBondContact O-CD 3.06Å; W336-F342 HydrophobicContact CH2-CB 4.39Å; W336-F342 HydrophobicContact CH2-CD1 4.22Å; W336-F342 HydrophobicContact CZ3-CD1 4.49Å
337	K	88.1	Confident	87.9	Confident	180 Å²	180	67.9 Å²	67.9	78%	0.783	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-33.2	-174.7	-67.2	-175.4	-180	179.7	0	113.2	I335	I335-K337 PolarHBondContact O-N 2.71Å
338	T	89.7	Confident	88.2	Confident	16 Å²	16	62.2 Å²	62.2	10%	0.098	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-14.7	-179.5	-46.6	0	0	0	0	113.4	L316 I322 T323 W336 L341 F342	L316-T338 HydrophobicContact CD2-CG2 4.29Å; I322-T338 HydrophobicContact CB-CG2 4.09Å; I322-T338 HydrophobicContact CG1-CG2 4.01Å; I322-T338 HydrophobicContact CG2-CG2 3.45Å; I322-T338 VanDerWaalsContact CG2-CG2 3.45Å; T323-T338 PolarHBondContact N-OG1 2.93Å; T323-T338 PolarHBondContact OG1-OG1 3.19Å; W336-T338 HydrophobicContact CZ2-CG2 4.37Å; W336-T338 PolarHBondContact O-N 3.37Å; T338-L341 HydrophobicContact CG2-CD2 4.39Å; T338-L341 WeakPolarHBondContact O-CB 3.03Å; T338-L341 PolarHBondContact O-N 2.8Å; T338-L341 VanDerWaalsContact O-N 3.17Å; T338-F342 PolarHBondContact O-N 2.81Å
339	G	89.4	Confident	88.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-56.2	-49.7	-178.8	0	0	0	0	0	114.7	R115 W336 L341 F342 K343	R115-G339 CarbonylContact O-C 3.59Å; R115-G339 WeakPolarHBondContact O-CA 3.45Å; W336-G339 VanDerWaalsContact CZ3-CA 3.49Å; W336-G339 PolarHBondContact O-N 3.44Å; W336-G339 VanDerWaalsContact O-N 3.1Å; G339-L341 VanDerWaalsContact C-N 3.3Å; G339-L341 PolarHBondContact O-N 3.47Å; G339-F342 PolarHBondContact O-N 3.19Å; G339-K343 PolarHBondContact O-N 2.67Å
340	P	90.9	Very high	88.4	Confident	62 Å²	62	66.7 Å²	66.7	40%	0.403	36%	0.364	S	S	.	.	H	α-helix	trans	-61.7	-34.2	176.6	-25.6	35.5	0	0	0	114.2	R115 W336 R344	R115-P340 HydrophobicContact CB-CG 4.14Å; R115-P340 HydrophobicContact CG-CG 4.27Å; W336-P340 WeakPolarHBondContact O-CD 3.06Å; P340-R344 PolarHBondContact O-N 2.95Å; P340-R344 VanDerWaalsContact O-N 3.12Å
341	L	90.4	Very high	88.6	Confident	37 Å²	37	60.9 Å²	60.9	19%	0.194	33%	0.326	C	S	.	.	H	α-helix	trans	-68.3	-46.1	175.5	-179.8	69.2	0	0	0	110.4	L316 E320 T338 G339 K343 R344 V345	L316-L341 HydrophobicContact CD1-CD2 3.75Å; L316-L341 HydrophobicContact CD1-CG 3.84Å; E320-L341 WeakPolarHBondContact OE2-CD2 3.21Å; T338-L341 HydrophobicContact CG2-CD2 4.39Å; T338-L341 WeakPolarHBondContact O-CB 3.03Å; T338-L341 PolarHBondContact O-N 2.8Å; T338-L341 VanDerWaalsContact O-N 3.17Å; G339-L341 VanDerWaalsContact C-N 3.3Å; G339-L341 PolarHBondContact O-N 3.47Å; L341-K343 VanDerWaalsContact C-N 3.29Å; L341-K343 PolarHBondContact O-N 2.97Å; L341-R344 WeakPolarHBondContact O-CB 3.35Å; L341-R344 PolarHBondContact O-N 3.43Å; L341-V345 PolarHBondContact O-N 3.46Å
342	F	91.4	Very high	88.8	Confident	1 Å²	1	60 Å²	60	0%	0.004	31%	0.311	C	S	.	.	H	α-helix	trans	-60.3	-41.5	176.8	-175	-134.5	0	0	0	111.7	Y88 A89 P117 A312 V313 L316 W336 T338 G339 R344 V345 L346	Y88-F342 WeakPolarHBondContact O-CE1 3.41Å; A89-F342 HydrophobicContact CB-CE1 4.09Å; P117-F342 HydrophobicContact CG-CD1 3.73Å; P117-F342 HydrophobicContact CG-CE1 4.35Å; A312-F342 HydrophobicContact CB-CE2 4.01Å; V313-F342 HydrophobicContact CG2-CE2 3.84Å; V313-F342 HydrophobicContact CG2-CZ 3.66Å; L316-F342 HydrophobicContact CB-CD2 4.42Å; L316-F342 HydrophobicContact CD2-CB 3.81Å; L316-F342 HydrophobicContact CD2-CD2 3.51Å; L316-F342 HydrophobicContact CD2-CE2 4.41Å; L316-F342 HydrophobicContact CD2-CG 3.96Å; L316-F342 HydrophobicContact CG-CD2 4.48Å; W336-F342 HydrophobicContact CH2-CB 4.39Å; W336-F342 HydrophobicContact CH2-CD1 4.22Å; W336-F342 HydrophobicContact CZ3-CD1 4.49Å; T338-F342 PolarHBondContact O-N 2.81Å; G339-F342 PolarHBondContact O-N 3.19Å; F342-R344 VanDerWaalsContact C-N 3.3Å; F342-R344 PolarHBondContact O-N 3.39Å; F342-V345 PolarHBondContact O-N 3.47Å; F342-L346 HydrophobicContact CE1-CD1 4.45Å; F342-L346 HydrophobicContact CZ-CD1 4.2Å; F342-L346 WeakPolarHBondContact O-CB 3.46Å; F342-L346 PolarHBondContact O-N 3.06Å
343	K	91.4	Very high	88.9	Confident	30 Å²	30	64.2 Å²	64.2	13%	0.13	33%	0.333	C	S	.	.	H	α-helix	trans	-54.4	-46.1	171.5	-174.8	-173.1	173.5	-160.2	0	111.7	P117 L135 L138 G339 L341 L346 M347	P117-K343 HydrophobicContact CG-CB 4.13Å; L135-K343 VanDerWaalsContact O-CE 3.24Å; L135-K343 WeakPolarHBondContact O-CE 3.23Å; L135-K343 PolarHBondContact O-NZ 3.26Å; L138-K343 HydrophobicContact CD1-CG 4.19Å; G339-K343 PolarHBondContact O-N 2.67Å; L341-K343 VanDerWaalsContact C-N 3.29Å; L341-K343 PolarHBondContact O-N 2.97Å; K343-L346 PolarHBondContact O-N 3.47Å; K343-M347 HydrophobicContact CD-SD 4.45Å; K343-M347 HydrophobicContact CG-CG 4.5Å; K343-M347 HydrophobicContact CG-SD 4.19Å; K343-M347 WeakPolarHBondContact O-CG 3.28Å; K343-M347 PolarHBondContact O-N 2.79Å
344	R	91	Very high	89	Confident	174 Å²	174	59.3 Å²	59.3	66%	0.657	31%	0.306	S	S	*	.	H	α-helix	trans	-63.1	-45.1	-179.3	-171.8	-174.7	-63.8	161.1	-0.5	111.7	P340 L341 F342 L346 M347 S348	P340-R344 PolarHBondContact O-N 2.95Å; P340-R344 VanDerWaalsContact O-N 3.12Å; L341-R344 WeakPolarHBondContact O-CB 3.35Å; L341-R344 PolarHBondContact O-N 3.43Å; F342-R344 VanDerWaalsContact C-N 3.3Å; F342-R344 PolarHBondContact O-N 3.39Å; R344-L346 VanDerWaalsContact C-N 3.32Å; R344-L346 PolarHBondContact O-N 3.27Å; R344-M347 PolarHBondContact O-N 2.8Å; R344-S348 PolarHBondContact O-N 3.3Å; R344-S348 PolarHBondContact O-OG 3.43Å
345	V	91.6	Very high	89	Confident	20 Å²	20	58.4 Å²	58.4	12%	0.121	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-43.9	176.2	176.1	0	0	0	0	110.6	A312 E315 L316 L341 F342 M347 S348 S349	A312-V345 HydrophobicContact CB-CG1 4.23Å; E315-V345 HydrophobicContact CB-CG1 4.07Å; L316-V345 HydrophobicContact CD1-CG2 3.76Å; L341-V345 PolarHBondContact O-N 3.46Å; F342-V345 PolarHBondContact O-N 3.47Å; V345-M347 PolarHBondContact O-N 3.02Å; V345-S348 WeakPolarHBondContact CA-OG 3.5Å; V345-S348 PolarHBondContact O-N 3.01Å; V345-S348 VanDerWaalsContact O-N 3.14Å; V345-S348 PolarHBondContact O-OG 2.87Å; V345-S349 PolarHBondContact O-N 2.81Å
346	L	91.5	Very high	88.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64	-39.1	178.3	-161.1	142.1	0	0	0	112.1	L119 L138 V308 V309 A312 F342 K343 R344 S349 F361	L119-L346 HydrophobicContact CD1-CD1 3.98Å; L119-L346 HydrophobicContact CD1-CD2 4.09Å; L119-L346 HydrophobicContact CD2-CD2 4.25Å; L119-L346 HydrophobicContact CG-CD2 4.35Å; L138-L346 HydrophobicContact CD1-CD2 4.27Å; L138-L346 HydrophobicContact CD2-CD2 3.51Å; L138-L346 HydrophobicContact CG-CD2 4.38Å; V308-L346 HydrophobicContact CG1-CD2 4.38Å; V308-L346 HydrophobicContact CG1-CG 4.29Å; V309-L346 HydrophobicContact CG2-CD1 4.03Å; A312-L346 HydrophobicContact CB-CB 4.15Å; A312-L346 HydrophobicContact CB-CD1 4.29Å; A312-L346 HydrophobicContact CB-CG 4.22Å; F342-L346 HydrophobicContact CE1-CD1 4.45Å; F342-L346 HydrophobicContact CZ-CD1 4.2Å; F342-L346 WeakPolarHBondContact O-CB 3.46Å; F342-L346 PolarHBondContact O-N 3.06Å; K343-L346 PolarHBondContact O-N 3.47Å; R344-L346 VanDerWaalsContact C-N 3.32Å; R344-L346 PolarHBondContact O-N 3.27Å; L346-S349 WeakPolarHBondContact O-CB 3.41Å; L346-S349 PolarHBondContact O-N 3.29Å; L346-S349 PolarHBondContact O-OG 3.47Å; L346-F361 HydrophobicContact CD2-CE2 3.98Å; L346-F361 HydrophobicContact CD2-CZ 4.28Å; L346-F361 WeakPolarHBondContact O-CD2 3.38Å
347	M	90.9	Very high	88.6	Confident	44 Å²	44	55.4 Å²	55.4	22%	0.217	30%	0.297	C	S	.	.	H	α-helix	trans	-65.8	-34.6	173	-72.4	177.2	70.1	0	0	113.2	L138 K343 R344 V345 N362 E363	L138-M347 HydrophobicContact CD2-CG 3.48Å; L138-M347 VanDerWaalsContact CD2-CG 3.48Å; K343-M347 HydrophobicContact CD-SD 4.45Å; K343-M347 HydrophobicContact CG-CG 4.5Å; K343-M347 HydrophobicContact CG-SD 4.19Å; K343-M347 WeakPolarHBondContact O-CG 3.28Å; K343-M347 PolarHBondContact O-N 2.79Å; R344-M347 PolarHBondContact O-N 2.8Å; V345-M347 PolarHBondContact O-N 3.02Å; M347-N362 WeakPolarHBondContact CE-O 3.43Å; M347-E363 VanDerWaalsContact CE-O 3.23Å; M347-E363 WeakPolarHBondContact CE-O 3.43Å
348	S	90.8	Very high	88.7	Confident	73 Å²	73	52.9 Å²	52.9	51%	0.51	28%	0.282	S	S	.	.	H	α-helix	trans	-81.9	-12.5	178.6	59	0	0	0	0	114.3	R344 V345	R344-S348 PolarHBondContact O-N 3.3Å; R344-S348 PolarHBondContact O-OG 3.43Å; V345-S348 WeakPolarHBondContact CA-OG 3.5Å; V345-S348 PolarHBondContact O-N 3.01Å; V345-S348 VanDerWaalsContact O-N 3.14Å; V345-S348 PolarHBondContact O-OG 2.87Å
349	S	87.3	Confident	88.7	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.014	28%	0.278	C	S	.	.			trans	-62.6	135.7	179.8	70.7	0	0	0	0	110.9	V308 V345 L346	V308-S349 WeakPolarHBondContact CG1-OG 3.35Å; V345-S349 PolarHBondContact O-N 2.81Å; L346-S349 WeakPolarHBondContact O-CB 3.41Å; L346-S349 PolarHBondContact O-N 3.29Å; L346-S349 PolarHBondContact O-OG 3.47Å
350	K	88.5	Confident	88.8	Confident	141 Å²	141	53.2 Å²	53.2	61%	0.613	28%	0.283	S	S	*	.			trans	-118.5	103.5	179.3	-64.9	-177.9	-177.8	174.6	0	108.7	E360	K350-E360 HydrophobicContact CG-CG 4.33Å
351	Y	88.3	Confident	88.9	Confident	20 Å²	20	50.9 Å²	50.9	8%	0.078	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-104.5	101.8	180	-163.2	-103.6	0	0	0	109.6	V308 V359	V308-Y351 HydrophobicContact CG2-CD1 4.42Å; V308-Y351 HydrophobicContact CG2-CG 4.03Å; Y351-V359 PolarHBondContact N-O 2.94Å; Y351-V359 PolarHBondContact O-N 2.86Å
352	A	83.3	Confident	88.9	Confident	65 Å²	65	50 Å²	50	54%	0.537	26%	0.262	S	S	.	.			trans	-79.9	-39.7	-176	0	0	0	0	0	112.6	G354	A352-G354 VanDerWaalsContact C-N 3.31Å; A352-G354 PolarHBondContact O-N 2.92Å
353	D	81	Confident	88.8	Confident	145 Å²	145	58.1 Å²	58.1	78%	0.775	30%	0.3	S	S	*	.	S	Bend	trans	-92.7	43.3	-169	-57.3	-36	0	0	0	113.4
354	G	83.9	Confident	88.7	Confident	15 Å²	15	60 Å²	60	16%	0.155	31%	0.311	C	S	.	.			trans	-81.2	145.5	177.1	0	0	0	0	0	113.4	D304 A352 T356 G357	D304-G354 WeakPolarHBondContact OD1-CA 3.37Å; A352-G354 VanDerWaalsContact C-N 3.31Å; A352-G354 PolarHBondContact O-N 2.92Å; G354-T356 PolarHBondContact O-N 2.94Å; G354-G357 WeakPolarHBondContact O-CA 3.32Å; G354-G357 PolarHBondContact O-N 2.95Å
355	V	88.4	Confident	88.6	Confident	97 Å²	97	51.7 Å²	51.7	59%	0.588	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-35.6	173.2	-179.2	0	0	0	0	110.8	A300 D304 G357	A300-V355 HydrophobicContact CB-CB 4.31Å; A300-V355 HydrophobicContact CB-CG1 3.84Å; D304-V355 PolarHBondContact OD1-N 2.63Å; D304-V355 PolarHBondContact OD2-N 3.41Å; V355-G357 VanDerWaalsContact C-N 3.25Å; V355-G357 PolarHBondContact O-N 3.39Å
356	T	87.4	Confident	88.7	Confident	17 Å²	17	50.7 Å²	50.7	10%	0.104	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	6.2	176.1	69.3	0	0	0	0	112.9	N294 A300 D304 G354 R367	N294-T356 HydrophobicContact CB-CG2 4.21Å; A300-T356 HydrophobicContact CB-CG2 3.62Å; D304-T356 WeakPolarHBondContact OD2-CA 3.34Å; D304-T356 WeakPolarHBondContact OD2-CB 3.44Å; D304-T356 VanDerWaalsContact OD2-CG2 3.3Å; D304-T356 WeakPolarHBondContact OD2-CG2 3.49Å; D304-T356 PolarHBondContact OD2-N 2.64Å; D304-T356 PolarHBondContact OD2-OG1 3.05Å; G354-T356 PolarHBondContact O-N 2.94Å; T356-R367 PolarHBondContact O-NH2 3.13Å; T356-R367 PolarHBondContact OG1-NH1 2.63Å; T356-R367 PolarHBondContact OG1-NH2 2.71Å; T356-R367 VanDerWaalsContact OG1-NH2 3.16Å
357	G	86.4	Confident	88.6	Confident	25 Å²	25	51.2 Å²	51.2	26%	0.258	28%	0.276	S	S	.	.	S	Bend	trans	94.6	-171.1	-174.1	0	0	0	0	0	113	G354 V355 V359 R367	G354-G357 WeakPolarHBondContact O-CA 3.32Å; G354-G357 PolarHBondContact O-N 2.95Å; V355-G357 VanDerWaalsContact C-N 3.25Å; V355-G357 PolarHBondContact O-N 3.39Å; G357-V359 PolarHBondContact O-N 3.09Å; G357-R367 PolarHBondContact O-NH2 2.85Å
358	R	88.9	Confident	88.5	Confident	126 Å²	126	53.4 Å²	53.4	48%	0.475	28%	0.284	S	S	.	.			trans	-57	132.1	179.5	-175.2	176.1	178.2	-178.3	-1.4	111	E360 R367	R358-E360 HydrophobicContact CG-CG 4.28Å; R358-E360 IonicContact CZ-OE1 3.2Å; R358-E360 IonicContact CZ-OE2 2.78Å; R358-E360 VanDerWaalsContact NE-CD 3.33Å; R358-E360 IonicContact NE-OE1 3.57Å; R358-E360 PolarHBondContact NE-OE1 3.36Å; R358-E360 IonicContact NE-OE2 3.24Å; R358-E360 IonicContact NH2-OE1 2.66Å; R358-E360 PolarHBondContact NH2-OE1 2.95Å; R358-E360 IonicContact NH2-OE2 3.79Å; R358-R367 PolarHBondContact O-NE 3.41Å; R358-R367 PolarHBondContact O-NH2 2.88Å
359	V	90.6	Very high	88.3	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-115.4	116.4	177.3	-171.6	0	0	0	0	109.2	D304 V308 Y351 G357 F361	D304-V359 HydrophobicContact CB-CG2 4.38Å; V308-V359 HydrophobicContact CG2-CB 4.21Å; V308-V359 HydrophobicContact CG2-CG1 4.04Å; Y351-V359 PolarHBondContact N-O 2.94Å; Y351-V359 PolarHBondContact O-N 2.86Å; G357-V359 PolarHBondContact O-N 3.09Å; V359-F361 HydrophobicContact CG1-CZ 4.24Å
360	E	91.5	Very high	88.4	Confident	23 Å²	23	54.3 Å²	54.3	11%	0.107	28%	0.281	C	S	.	.			trans	-142.9	151	173.4	-66.8	-171.2	173.1	0	0	109.1	K350 R358 R367 K368	K350-E360 HydrophobicContact CG-CG 4.33Å; R358-E360 HydrophobicContact CG-CG 4.28Å; R358-E360 IonicContact CZ-OE1 3.2Å; R358-E360 IonicContact CZ-OE2 2.78Å; R358-E360 VanDerWaalsContact NE-CD 3.33Å; R358-E360 IonicContact NE-OE1 3.57Å; R358-E360 PolarHBondContact NE-OE1 3.36Å; R358-E360 IonicContact NE-OE2 3.24Å; R358-E360 IonicContact NH2-OE1 2.66Å; R358-E360 PolarHBondContact NH2-OE1 2.95Å; R358-E360 IonicContact NH2-OE2 3.79Å; E360-R367 CarbonylContact O-C 3.53Å; E360-R367 VanDerWaalsContact O-CA 3.32Å; E360-R367 WeakPolarHBondContact O-CA 3.45Å; E360-K368 HydrophobicContact CB-CB 4.49Å; E360-K368 PolarHBondContact O-N 3.37Å
361	F	92.7	Very high	88.5	Confident	13 Å²	13	50 Å²	50	6%	0.057	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-105.7	151.5	-178.9	-58.9	-77	0	0	0	112.5	L138 R139 V308 L346 V359 G365 D366	L138-F361 HydrophobicContact CB-CD1 4.46Å; L138-F361 HydrophobicContact CB-CE1 4.17Å; L138-F361 HydrophobicContact CD2-CD1 4.22Å; L138-F361 HydrophobicContact CD2-CD2 4.3Å; L138-F361 HydrophobicContact CD2-CE1 4.36Å; L138-F361 HydrophobicContact CD2-CE2 4.45Å; L138-F361 HydrophobicContact CD2-CG 4.18Å; L138-F361 HydrophobicContact CD2-CZ 4.48Å; R139-F361 WeakPolarHBondContact O-CE1 3.42Å; V308-F361 HydrophobicContact CG1-CE2 3.96Å; V308-F361 HydrophobicContact CG1-CZ 4.36Å; L346-F361 HydrophobicContact CD2-CE2 3.98Å; L346-F361 HydrophobicContact CD2-CZ 4.28Å; L346-F361 WeakPolarHBondContact O-CD2 3.38Å; V359-F361 HydrophobicContact CG1-CZ 4.24Å; F361-G365 VanDerWaalsContact CD1-O 3.32Å; F361-G365 WeakPolarHBondContact CD1-O 3.46Å; F361-D366 CarbonylContact C-O 3.4Å; F361-D366 WeakPolarHBondContact CA-O 3.42Å
362	N	90.2	Very high	88.8	Confident	18 Å²	18	49.3 Å²	49.3	10%	0.096	26%	0.262	C	S	.	.			trans	-87.1	-179.2	166.4	73.2	-4.7	0	0	0	111.7	M347 D364 G365 D366 K368	M347-N362 WeakPolarHBondContact CE-O 3.43Å; N362-D364 PolarHBondContact ND2-OD2 2.94Å; N362-D364 PolarHBondContact O-N 2.75Å; N362-D364 VanDerWaalsContact OD1-CA 3.3Å; N362-D364 WeakPolarHBondContact OD1-CA 3.48Å; N362-D364 WeakPolarHBondContact OD1-CB 3.36Å; N362-D364 PolarHBondContact OD1-N 3.36Å; N362-G365 PolarHBondContact O-N 3.5Å; N362-G365 PolarHBondContact OD1-N 3.48Å; N362-D366 PolarHBondContact N-O 3.14Å; N362-D366 WeakPolarHBondContact OD1-CA 3.45Å; N362-D366 WeakPolarHBondContact OD1-CB 3.44Å; N362-D366 PolarHBondContact OD1-N 3.16Å; N362-D366 PolarHBondContact OD1-O 2.86Å; N362-K368 HydrophobicContact CB-CD 4.32Å; N362-K368 HydrophobicContact CB-CG 4.02Å
363	E	89.1	Confident	89.3	Confident	173 Å²	173	46.6 Å²	46.6	81%	0.808	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.2	176.9	-61.7	-176.4	175.9	0	0	111.5	M347 G365	M347-E363 VanDerWaalsContact CE-O 3.23Å; M347-E363 WeakPolarHBondContact CE-O 3.43Å; E363-G365 VanDerWaalsContact C-N 3.25Å; E363-G365 PolarHBondContact O-N 3.01Å
364	D	89.1	Confident	89.9	Confident	68 Å²	68	40 Å²	40	36%	0.364	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	10.5	172.9	-48.5	-54.5	0	0	0	113.5	K131 N362 D366	K131-D364 WeakPolarHBondContact CE-O 3.36Å; K131-D364 PolarHBondContact NZ-O 3.32Å; N362-D364 PolarHBondContact ND2-OD2 2.94Å; N362-D364 PolarHBondContact O-N 2.75Å; N362-D364 VanDerWaalsContact OD1-CA 3.3Å; N362-D364 WeakPolarHBondContact OD1-CA 3.48Å; N362-D364 WeakPolarHBondContact OD1-CB 3.36Å; N362-D364 PolarHBondContact OD1-N 3.36Å; D364-D366 PolarHBondContact O-N 3.19Å; D364-D366 VanDerWaalsContact O-N 3.13Å
365	G	90.1	Very high	90.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	64.7	14.3	179.5	0	0	0	0	0	115.3	L138 R139 F361 N362 E363	L138-G365 CarbonylContact C-O 3.57Å; L138-G365 WeakPolarHBondContact CA-O 3.31Å; L138-G365 WeakPolarHBondContact CB-O 3.28Å; R139-G365 PolarHBondContact N-O 2.99Å; R139-G365 VanDerWaalsContact N-O 3.1Å; F361-G365 VanDerWaalsContact CD1-O 3.32Å; F361-G365 WeakPolarHBondContact CD1-O 3.46Å; N362-G365 PolarHBondContact O-N 3.5Å; N362-G365 PolarHBondContact OD1-N 3.48Å; E363-G365 VanDerWaalsContact C-N 3.25Å; E363-G365 PolarHBondContact O-N 3.01Å
366	D	92.1	Very high	90.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-93.8	147.6	176.6	-59.5	-27.9	0	0	0	110.9	S129 R139 H146 F361 N362 D364 K368	S129-D366 WeakPolarHBondContact CB-OD2 2.78Å; S129-D366 PolarHBondContact OG-OD2 2.7Å; R139-D366 IonicContact CZ-OD1 3.85Å; R139-D366 IonicContact NE-OD1 2.64Å; R139-D366 PolarHBondContact NE-OD1 3.19Å; R139-D366 VanDerWaalsContact NH2-CG 3.31Å; R139-D366 IonicContact NH2-OD1 3.59Å; R139-D366 PolarHBondContact NH2-OD1 3.38Å; R139-D366 IonicContact NH2-OD2 3.66Å; R139-D366 PolarHBondContact NH2-OD2 3.37Å; H146-D366 IonicContact NE2-OD2 3.11Å; F361-D366 CarbonylContact C-O 3.4Å; F361-D366 WeakPolarHBondContact CA-O 3.42Å; N362-D366 PolarHBondContact N-O 3.14Å; N362-D366 WeakPolarHBondContact OD1-CA 3.45Å; N362-D366 WeakPolarHBondContact OD1-CB 3.44Å; N362-D366 PolarHBondContact OD1-N 3.16Å; N362-D366 PolarHBondContact OD1-O 2.86Å; D364-D366 PolarHBondContact O-N 3.19Å; D364-D366 VanDerWaalsContact O-N 3.13Å; D366-K368 PolarHBondContact O-N 3.46Å
367	R	91.3	Very high	91	Very high	10 Å²	10	34.6 Å²	34.6	4%	0.038	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-65.7	132.7	-179	-178.1	172.7	179	179.4	4	113.3	R139 T140 T356 G357 R358 E360	R139-R367 PolarHBondContact O-N 3.31Å; T140-R367 WeakPolarHBondContact O-CD 3.48Å; T140-R367 PolarHBondContact O-NH1 3.21Å; T356-R367 PolarHBondContact O-NH2 3.13Å; T356-R367 PolarHBondContact OG1-NH1 2.63Å; T356-R367 PolarHBondContact OG1-NH2 2.71Å; T356-R367 VanDerWaalsContact OG1-NH2 3.16Å; G357-R367 PolarHBondContact O-NH2 2.85Å; R358-R367 PolarHBondContact O-NE 3.41Å; R358-R367 PolarHBondContact O-NH2 2.88Å; E360-R367 CarbonylContact O-C 3.53Å; E360-R367 VanDerWaalsContact O-CA 3.32Å; E360-R367 WeakPolarHBondContact O-CA 3.45Å
368	K	88.3	Confident	91.2	Very high	90 Å²	90	35.1 Å²	35.1	39%	0.391	16%	0.162	S	C	.	.	S	Bend	trans	-91.2	159.4	168.1	-66.8	-173.1	179.2	166.8	0	111.9	E360 N362 D366 A370	E360-K368 HydrophobicContact CB-CB 4.49Å; E360-K368 PolarHBondContact O-N 3.37Å; N362-K368 HydrophobicContact CB-CD 4.32Å; N362-K368 HydrophobicContact CB-CG 4.02Å; D366-K368 PolarHBondContact O-N 3.46Å; K368-A370 VanDerWaalsContact C-N 3.28Å; K368-A370 PolarHBondContact O-N 3.3Å
369	F	86.6	Confident	91.1	Very high	85 Å²	85	35.7 Å²	35.7	37%	0.373	18%	0.175	S	C	.	.	S	Bend	trans	56.5	36.4	173.3	-50.1	-63.9	0	0	0	114.7	T391	F369-T391 HydrophobicContact CD1-CG2 3.98Å; F369-T391 HydrophobicContact CE1-CG2 3.86Å
370	A	88.3	Confident	90.8	Very high	9 Å²	9	45.9 Å²	45.9	7%	0.074	21%	0.214	C	C	.	.			trans	-74.1	142.8	173.7	0	0	0	0	0	111.1	P142 L292 K368 Y372	P142-A370 HydrophobicContact CB-CB 4.29Å; P142-A370 HydrophobicContact CG-CB 3.52Å; L292-A370 HydrophobicContact CD1-CB 4.07Å; K368-A370 VanDerWaalsContact C-N 3.28Å; K368-A370 PolarHBondContact O-N 3.3Å; A370-Y372 HydrophobicContact CB-CE2 4.2Å
371	N	91.3	Very high	90.8	Very high	50 Å²	50	52.3 Å²	52.3	27%	0.267	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.8	-177	-66.4	-9.6	0	0	0	111.7	L292 I293 Y388 N389	L292-N371 WeakPolarHBondContact CD1-O 3.3Å; I293-N371 HydrophobicContact CB-CB 4.47Å; I293-N371 WeakPolarHBondContact CB-O 3.33Å; I293-N371 HydrophobicContact CD1-CB 3.95Å; I293-N371 HydrophobicContact CG1-CB 4.49Å; I293-N371 PolarHBondContact N-O 3.18Å; N371-Y388 CarbonylContact C-O 3.52Å; N371-Y388 WeakPolarHBondContact CA-O 3.45Å; N371-N389 PolarHBondContact ND2-OD1 3.14Å; N371-N389 VanDerWaalsContact ND2-OD1 3.15Å; N371-N389 VanDerWaalsContact OD1-C 3.26Å; N371-N389 WeakPolarHBondContact OD1-CA 3.44Å; N371-N389 PolarHBondContact OD1-OD1 3.21Å; N371-N389 VanDerWaalsContact OD1-OD1 3.12Å
372	Y	93.4	Very high	90.7	Very high	6 Å²	6	54.5 Å²	54.5	2%	0.024	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	137.9	179.5	-70.7	-96.1	0	0	0	110.6	R124 P142 Q147 V150 Q291 L292 A370 I387 Y388	R124-Y372 PolarHBondContact NH2-OH 3.47Å; P142-Y372 HydrophobicContact CG-CE2 4.26Å; P142-Y372 WeakPolarHBondContact CG-OH 3.2Å; Q147-Y372 HydrophobicContact CG-CE1 3.82Å; V150-Y372 HydrophobicContact CG2-CD2 3.78Å; V150-Y372 HydrophobicContact CG2-CE2 4.17Å; V150-Y372 HydrophobicContact CG2-CG 4.09Å; Q291-Y372 CarbonylContact O-C 3.6Å; Q291-Y372 WeakPolarHBondContact O-CA 3.4Å; L292-Y372 HydrophobicContact CB-CD1 4.14Å; L292-Y372 HydrophobicContact CB-CE1 3.97Å; L292-Y372 HydrophobicContact CD1-CD1 4.15Å; L292-Y372 HydrophobicContact CD1-CD2 4.37Å; L292-Y372 HydrophobicContact CD1-CE1 3.84Å; L292-Y372 HydrophobicContact CD1-CE2 4.08Å; L292-Y372 HydrophobicContact CD1-CG 4.42Å; L292-Y372 HydrophobicContact CG-CE1 4.49Å; A370-Y372 HydrophobicContact CB-CE2 4.2Å; Y372-I387 CarbonylContact O-C 3.59Å; Y372-I387 WeakPolarHBondContact O-CA 3.33Å; Y372-Y388 HydrophobicContact CD2-CD1 4.01Å; Y372-Y388 PolarHBondContact N-O 3.4Å; Y372-Y388 PolarHBondContact O-N 2.93Å
373	S	93.8	Very high	90.9	Very high	9 Å²	9	54.8 Å²	54.8	6%	0.063	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129.3	164.9	51.5	0	0	0	0	109.7	Q291	Q291-S373 WeakPolarHBondContact CB-OG 3.47Å; Q291-S373 PolarHBondContact N-O 2.96Å; Q291-S373 PolarHBondContact O-N 3.39Å; Q291-S373 PolarHBondContact O-OG 2.91Å; Q291-S373 VanDerWaalsContact O-OG 3.07Å
374	I	94.7	Very high	91.1	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	121.3	173.4	-55.9	175.2	0	0	0	107.4	M154 L288 L290 Q384 V385 G386 V393	M154-I374 HydrophobicContact CE-CG2 4.12Å; M154-I374 HydrophobicContact CG-CD1 4.25Å; M154-I374 HydrophobicContact SD-CD1 4.21Å; M154-I374 HydrophobicContact SD-CG2 4.45Å; L288-I374 HydrophobicContact CD2-CG2 4.48Å; L290-I374 HydrophobicContact CD2-CG1 4.29Å; I374-Q384 WeakPolarHBondContact O-CA 3.45Å; I374-V385 HydrophobicContact CB-CG2 4.28Å; I374-V385 HydrophobicContact CG2-CG2 3.82Å; I374-V385 WeakPolarHBondContact O-CG2 3.46Å; I374-V385 PolarHBondContact O-N 2.78Å; I374-G386 PolarHBondContact N-O 2.85Å; I374-G386 PolarHBondContact O-N 3.47Å; I374-V393 HydrophobicContact CD1-CB 4.42Å; I374-V393 HydrophobicContact CD1-CG1 3.39Å; I374-V393 HydrophobicContact CD1-CG2 4.15Å
375	M	94.1	Very high	91.3	Very high	15 Å²	15	46.7 Å²	46.7	7%	0.074	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.8	-175.7	-56	-58.8	-73.9	0	0	109.5	I275 L288 G289 Q291 L382 V383 Q384	I275-M375 HydrophobicContact CD1-CB 4.37Å; I275-M375 HydrophobicContact CD1-CG 4.47Å; L288-M375 CarbonylContact C-O 3.6Å; L288-M375 WeakPolarHBondContact CA-O 3.42Å; G289-M375 PolarHBondContact N-O 3.47Å; G289-M375 PolarHBondContact O-N 3.02Å; Q291-M375 HydrophobicContact CB-CG 3.88Å; M375-L382 HydrophobicContact CB-CD2 4.31Å; M375-L382 HydrophobicContact CE-CB 3.74Å; M375-V383 CarbonylContact C-O 3.59Å; M375-V383 WeakPolarHBondContact CA-O 3.23Å; M375-Q384 HydrophobicContact CE-CB 4.49Å; M375-Q384 HydrophobicContact SD-CB 3.87Å; M375-Q384 HydrophobicContact SD-CG 4.29Å
376	N	94.9	Very high	91.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135.4	171.5	-174.2	-6.8	0	0	0	109.2	I287 L288 Q378 V383 V385 I400 I401	I287-N376 WeakPolarHBondContact O-CA 3.45Å; I287-N376 PolarHBondContact O-OD1 3.07Å; L288-N376 HydrophobicContact CD2-CB 3.92Å; N376-Q378 HydrophobicContact CB-CG 4.35Å; N376-Q378 PolarHBondContact ND2-NE2 3.25Å; N376-Q378 PolarHBondContact O-N 3.13Å; N376-V383 PolarHBondContact N-O 3.49Å; N376-V383 PolarHBondContact O-N 3.12Å; N376-V385 HydrophobicContact CB-CB 4.43Å; N376-V385 HydrophobicContact CB-CG1 3.57Å; N376-V385 HydrophobicContact CB-CG2 3.97Å; N376-I400 WeakPolarHBondContact ND2-CG2 3.34Å; N376-I401 PolarHBondContact ND2-N 2.89Å; N376-I401 PolarHBondContact ND2-O 3.35Å; N376-I401 PolarHBondContact OD1-O 3.45Å
377	L	93.4	Very high	91.4	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	108.7	171.9	-167.4	68.9	0	0	0	110.5	L280 A283 P284 G286 I287 L382	L280-L377 HydrophobicContact CD1-CD1 3.86Å; A283-L377 HydrophobicContact CB-CD2 3.74Å; P284-L377 VanDerWaalsContact O-CD2 3.27Å; P284-L377 WeakPolarHBondContact O-CD2 3.45Å; G286-L377 PolarHBondContact N-O 3.4Å; I287-L377 HydrophobicContact CD1-CB 4.44Å; I287-L377 HydrophobicContact CD1-CD2 4.43Å; I287-L377 HydrophobicContact CG1-CB 3.67Å; I287-L377 HydrophobicContact CG1-CD2 4.29Å; I287-L377 PolarHBondContact O-N 3.27Å; L377-L382 HydrophobicContact CB-CD2 4.46Å; L377-L382 HydrophobicContact CD1-CD2 3.92Å; L377-L382 HydrophobicContact CD1-CG 4.26Å
378	Q	91.3	Very high	91.5	Very high	35 Å²	35	49.9 Å²	49.9	16%	0.164	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.1	179.4	-58.1	-177	-7.9	0	0	109.1	N376 R380 K381 V383 K399 I401	N376-Q378 HydrophobicContact CB-CG 4.35Å; N376-Q378 PolarHBondContact ND2-NE2 3.25Å; N376-Q378 PolarHBondContact O-N 3.13Å; Q378-R380 VanDerWaalsContact C-N 3.28Å; Q378-R380 PolarHBondContact O-N 2.96Å; Q378-K381 PolarHBondContact N-O 3.25Å; Q378-K381 PolarHBondContact O-N 3.08Å; Q378-V383 HydrophobicContact CB-CG2 4.1Å; Q378-V383 HydrophobicContact CG-CB 4.44Å; Q378-V383 HydrophobicContact CG-CG2 4.32Å; Q378-K399 PolarHBondContact NE2-O 3.41Å; Q378-I401 HydrophobicContact CB-CD1 4.18Å; Q378-I401 HydrophobicContact CG-CB 4.4Å; Q378-I401 HydrophobicContact CG-CD1 3.97Å; Q378-I401 HydrophobicContact CG-CG1 4.29Å
379	N	85.6	Confident	91.4	Very high	139 Å²	139	49.6 Å²	49.6	74%	0.743	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	48.2	-179.3	-61.3	-29	0	0	0	112.2	K381	N379-K381 PolarHBondContact O-N 3.4Å; N379-K381 VanDerWaalsContact O-N 3.17Å
380	R	85.5	Confident	91.1	Very high	214 Å²	214	46 Å²	46	81%	0.808	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	16.1	-175.7	-56.6	-176.8	172.1	178.2	-2.7	116.3	D285 Q378	D285-R380 PolarHBondContact OD1-N 2.74Å; Q378-R380 VanDerWaalsContact C-N 3.28Å; Q378-R380 PolarHBondContact O-N 2.96Å
381	K	90.7	Very high	90.8	Very high	158 Å²	158	48.9 Å²	48.9	69%	0.687	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.8	173.7	-67.3	-176.8	-179.2	178.6	0	110.4	Q378 N379 V383	Q378-K381 PolarHBondContact N-O 3.25Å; Q378-K381 PolarHBondContact O-N 3.08Å; N379-K381 PolarHBondContact O-N 3.4Å; N379-K381 VanDerWaalsContact O-N 3.17Å; K381-V383 PolarHBondContact O-N 3.1Å
382	L	91.9	Very high	90.6	Very high	58 Å²	58	51.2 Å²	51.2	30%	0.304	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	121.7	174.6	-67.8	171	0	0	0	109.5	I275 L280 M375 L377	I275-L382 HydrophobicContact CB-CD2 4.4Å; I275-L382 HydrophobicContact CD1-CD1 4.4Å; L280-L382 HydrophobicContact CD1-CD1 4.36Å; L280-L382 HydrophobicContact CD1-CD2 4.41Å; L280-L382 HydrophobicContact CD1-CG 4.29Å; M375-L382 HydrophobicContact CB-CD2 4.31Å; M375-L382 HydrophobicContact CE-CB 3.74Å; L377-L382 HydrophobicContact CB-CD2 4.46Å; L377-L382 HydrophobicContact CD1-CD2 3.92Å; L377-L382 HydrophobicContact CD1-CG 4.26Å
383	V	93.4	Very high	90.3	Very high	25 Å²	25	51.8 Å²	51.8	15%	0.152	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.7	-178.9	-178.6	0	0	0	0	108.8	M375 N376 Q378 K381 V385	M375-V383 CarbonylContact C-O 3.59Å; M375-V383 WeakPolarHBondContact CA-O 3.23Å; N376-V383 PolarHBondContact N-O 3.49Å; N376-V383 PolarHBondContact O-N 3.12Å; Q378-V383 HydrophobicContact CB-CG2 4.1Å; Q378-V383 HydrophobicContact CG-CB 4.44Å; Q378-V383 HydrophobicContact CG-CG2 4.32Å; K381-V383 PolarHBondContact O-N 3.1Å; V383-V385 PolarHBondContact O-N 2.93Å
384	Q	93.5	Very high	90.1	Very high	66 Å²	66	55.6 Å²	55.6	31%	0.308	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	120.7	176.1	-174.3	-178	-7.5	0	0	111.1	I374 M375	I374-Q384 WeakPolarHBondContact O-CA 3.45Å; M375-Q384 HydrophobicContact CE-CB 4.49Å; M375-Q384 HydrophobicContact SD-CB 3.87Å; M375-Q384 HydrophobicContact SD-CG 4.29Å
385	V	92.7	Very high	89.5	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.024	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-8.8	-177.8	-66.7	0	0	0	0	113.5	L288 I374 N376 V383 N396 I400	L288-V385 HydrophobicContact CD2-CG2 4.22Å; I374-V385 HydrophobicContact CB-CG2 4.28Å; I374-V385 HydrophobicContact CG2-CG2 3.82Å; I374-V385 WeakPolarHBondContact O-CG2 3.46Å; I374-V385 PolarHBondContact O-N 2.78Å; N376-V385 HydrophobicContact CB-CB 4.43Å; N376-V385 HydrophobicContact CB-CG1 3.57Å; N376-V385 HydrophobicContact CB-CG2 3.97Å; V383-V385 PolarHBondContact O-N 2.93Å; V385-N396 WeakPolarHBondContact O-CB 3.2Å; V385-N396 PolarHBondContact O-N 3.23Å; V385-I400 HydrophobicContact CB-CG1 3.96Å; V385-I400 HydrophobicContact CG1-CG1 4.12Å; V385-I400 HydrophobicContact CG2-CD1 4.45Å; V385-I400 HydrophobicContact CG2-CG1 4.25Å
386	G	92	Very high	89.1	Confident	2 Å²	2	61.9 Å²	61.9	2%	0.021	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	174.1	174.7	0	0	0	0	0	112.7	I374 I394	I374-G386 PolarHBondContact N-O 2.85Å; I374-G386 PolarHBondContact O-N 3.47Å; G386-I394 CarbonylContact C-O 3.48Å; G386-I394 VanDerWaalsContact CA-O 3.24Å; G386-I394 WeakPolarHBondContact CA-O 3.48Å
387	I	93	Very high	88.4	Confident	53 Å²	53	70.3 Å²	70.3	27%	0.272	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131.8	178	-59.6	172.1	0	0	0	108.7	I293 Y372 I394	I293-I387 HydrophobicContact CD1-CG2 4.23Å; Y372-I387 CarbonylContact O-C 3.59Å; Y372-I387 WeakPolarHBondContact O-CA 3.33Å; I387-I394 PolarHBondContact N-O 2.74Å; I387-I394 PolarHBondContact O-N 3.2Å
388	Y	92.1	Very high	88	Confident	22 Å²	22	77.4 Å²	77.4	9%	0.086	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	119.2	167.7	178.2	-103.7	0	0	0	109.3	V150 E153 N371 Y372 G390 H392 V393	V150-Y388 HydrophobicContact CG1-CD2 4.37Å; V150-Y388 HydrophobicContact CG1-CG 4.13Å; V150-Y388 HydrophobicContact CG2-CD1 3.72Å; V150-Y388 HydrophobicContact CG2-CE1 3.88Å; V150-Y388 HydrophobicContact CG2-CG 4.09Å; E153-Y388 HydrophobicContact CB-CE2 4.11Å; E153-Y388 HydrophobicContact CG-CE2 4.2Å; N371-Y388 CarbonylContact C-O 3.52Å; N371-Y388 WeakPolarHBondContact CA-O 3.45Å; Y372-Y388 HydrophobicContact CD2-CD1 4.01Å; Y372-Y388 PolarHBondContact N-O 3.4Å; Y372-Y388 PolarHBondContact O-N 2.93Å; Y388-G390 VanDerWaalsContact C-N 3.34Å; Y388-G390 VanDerWaalsContact CZ-C 3.45Å; Y388-G390 PolarHBondContact O-N 3.25Å; Y388-G390 PolarHBondContact OH-O 3Å; Y388-G390 VanDerWaalsContact OH-O 3.11Å; Y388-H392 WeakPolarHBondContact CA-O 3.28Å; Y388-H392 WeakPolarHBondContact CD2-O 3.29Å; Y388-V393 HydrophobicContact CD2-CG2 3.67Å; Y388-V393 HydrophobicContact CE2-CG2 4.46Å
389	N	87.2	Confident	87.8	Confident	85 Å²	85	84 Å²	84	46%	0.455	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	37	-176.2	-164.7	17.1	0	0	0	112.5	N371 T391 H392 I394	N371-N389 PolarHBondContact ND2-OD1 3.14Å; N371-N389 VanDerWaalsContact ND2-OD1 3.15Å; N371-N389 VanDerWaalsContact OD1-C 3.26Å; N371-N389 WeakPolarHBondContact OD1-CA 3.44Å; N371-N389 PolarHBondContact OD1-OD1 3.21Å; N371-N389 VanDerWaalsContact OD1-OD1 3.12Å; N389-T391 PolarHBondContact O-N 2.88Å; N389-T391 VanDerWaalsContact O-N 3.14Å; N389-H392 PolarHBondContact N-O 3.44Å; N389-H392 VanDerWaalsContact N-O 3.09Å; N389-I394 HydrophobicContact CB-CD1 4.28Å
390	G	80.8	Confident	88	Confident	10 Å²	10	78.7 Å²	78.7	10%	0.103	38%	0.381	C	S	.	.	S	Bend	trans	80.1	-15.6	179.3	0	0	0	0	0	116.1	Y388	Y388-G390 VanDerWaalsContact C-N 3.34Å; Y388-G390 VanDerWaalsContact CZ-C 3.45Å; Y388-G390 PolarHBondContact O-N 3.25Å; Y388-G390 PolarHBondContact OH-O 3Å; Y388-G390 VanDerWaalsContact OH-O 3.11Å
391	T	82.1	Confident	88.3	Confident	69 Å²	69	70.8 Å²	70.8	42%	0.423	35%	0.354	S	S	.	.	S	Bend	trans	-132.2	-47.5	178	53.9	0	0	0	0	112.7	F369 N389	F369-T391 HydrophobicContact CD1-CG2 3.98Å; F369-T391 HydrophobicContact CE1-CG2 3.86Å; N389-T391 PolarHBondContact O-N 2.88Å; N389-T391 VanDerWaalsContact O-N 3.14Å
392	H	86.2	Confident	88.3	Confident	99 Å²	99	63.6 Å²	63.6	46%	0.458	32%	0.323	S	S	.	.			trans	-124	150.3	-177.7	-63.8	-61.8	0	0	0	111.6	E153 Y388 N389	E153-H392 IonicContact OE1-ND1 2.61Å; E153-H392 PolarHBondContact OE1-ND1 2.84Å; E153-H392 VanDerWaalsContact OE1-ND1 3.09Å; Y388-H392 WeakPolarHBondContact CA-O 3.28Å; Y388-H392 WeakPolarHBondContact CD2-O 3.29Å; N389-H392 PolarHBondContact N-O 3.44Å; N389-H392 VanDerWaalsContact N-O 3.09Å
393	V	88.3	Confident	88.3	Confident	18 Å²	18	60.9 Å²	60.9	11%	0.109	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	125.3	169.6	174.2	0	0	0	0	108.9	E153 M154 V157 I374 Y388	E153-V393 HydrophobicContact CB-CG2 4.08Å; E153-V393 HydrophobicContact CG-CB 4.39Å; E153-V393 HydrophobicContact CG-CG2 3.77Å; M154-V393 HydrophobicContact CG-CG2 4.27Å; V157-V393 HydrophobicContact CG2-CB 4.1Å; I374-V393 HydrophobicContact CD1-CB 4.42Å; I374-V393 HydrophobicContact CD1-CG1 3.39Å; I374-V393 HydrophobicContact CD1-CG2 4.15Å; Y388-V393 HydrophobicContact CD2-CG2 3.67Å; Y388-V393 HydrophobicContact CE2-CG2 4.46Å
394	I	87.7	Confident	87.9	Confident	88 Å²	88	62.4 Å²	62.4	45%	0.451	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	112.7	175.6	-55.2	171.5	0	0	0	107	G386 I387 N389	G386-I394 CarbonylContact C-O 3.48Å; G386-I394 VanDerWaalsContact CA-O 3.24Å; G386-I394 WeakPolarHBondContact CA-O 3.48Å; I387-I394 PolarHBondContact N-O 2.74Å; I387-I394 PolarHBondContact O-N 3.2Å; N389-I394 HydrophobicContact CB-CD1 4.28Å
395	P	83.6	Confident	87.5	Confident	96 Å²	96	62 Å²	62	62%	0.623	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	145.7	175.7	29.5	-32.3	0	0	0	110.8
396	N	84.9	Confident	87.3	Confident	57 Å²	57	65.1 Å²	65.1	31%	0.305	36%	0.357	S	S	.	.			trans	-89.3	166.3	169.3	-72.8	-7	0	0	0	110.3	V385 R398	V385-N396 WeakPolarHBondContact O-CB 3.2Å; V385-N396 PolarHBondContact O-N 3.23Å; N396-R398 PolarHBondContact O-N 3.5Å
397	D	81.3	Confident	87.1	Confident	176 Å²	176	69.9 Å²	69.9	94%	0.941	39%	0.386	S	S	*	.	S	Bend	trans	-66.5	-8.1	176.8	-59.1	-36.6	0	0	0	114.4
398	R	85.1	Confident	86.8	Confident	151 Å²	151	74.9 Å²	74.9	57%	0.57	41%	0.408	S	S	*	.	S	Bend	trans	-76.7	129.2	179.9	-68.8	-171.2	178.9	174.7	-0.8	110.6	N396	N396-R398 PolarHBondContact O-N 3.5Å
399	K	85.6	Confident	86.5	Confident	173 Å²	173	78.5 Å²	78.5	75%	0.752	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-65.1	140.2	177.9	-64.9	-174.2	179.5	-176.8	0	111.5	Q378	Q378-K399 PolarHBondContact NE2-O 3.41Å
400	I	90.2	Very high	86.6	Confident	28 Å²	28	75 Å²	75	14%	0.144	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-88.2	125.4	174.2	-60.4	175.7	0	0	0	107.9	Y158 L288 N376 V385 W402	Y158-I400 WeakPolarHBondContact OH-CD1 3.37Å; L288-I400 HydrophobicContact CD2-CG2 4.2Å; N376-I400 WeakPolarHBondContact ND2-CG2 3.34Å; V385-I400 HydrophobicContact CB-CG1 3.96Å; V385-I400 HydrophobicContact CG1-CG1 4.12Å; V385-I400 HydrophobicContact CG2-CD1 4.45Å; V385-I400 HydrophobicContact CG2-CG1 4.25Å; I400-W402 HydrophobicContact CB-CZ2 4.38Å; I400-W402 HydrophobicContact CD1-CZ2 4.45Å; I400-W402 HydrophobicContact CG2-CD2 3.96Å; I400-W402 HydrophobicContact CG2-CE3 4.35Å; I400-W402 HydrophobicContact CG2-CG 4.5Å; I400-W402 HydrophobicContact CG2-CH2 4.15Å; I400-W402 HydrophobicContact CG2-CZ2 3.74Å; I400-W402 HydrophobicContact CG2-CZ3 4.43Å
401	I	91.4	Very high	86.7	Confident	49 Å²	49	84 Å²	84	25%	0.251	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-92	130.1	165.8	-57.6	177.2	0	0	0	106.9	G286 N376 Q378	G286-I401 VanDerWaalsContact CA-O 3.28Å; G286-I401 WeakPolarHBondContact CA-O 3.45Å; N376-I401 PolarHBondContact ND2-N 2.89Å; N376-I401 PolarHBondContact ND2-O 3.35Å; N376-I401 PolarHBondContact OD1-O 3.45Å; Q378-I401 HydrophobicContact CB-CD1 4.18Å; Q378-I401 HydrophobicContact CG-CB 4.4Å; Q378-I401 HydrophobicContact CG-CD1 3.97Å; Q378-I401 HydrophobicContact CG-CG1 4.29Å
402	W	91.8	Very high	86.7	Confident	7 Å²	7	80.9 Å²	80.9	3%	0.027	42%	0.419	C	S	.	.	B	Isolated β-bridge	trans	-99.1	162.4	176.6	-57.7	97.6	0	0	0	110.4	Y158 W160 V267 L288 I400 G404 G405 E406 E408 K409 P410	Y158-W402 HydrophobicContact CD1-CH2 4.29Å; Y158-W402 HydrophobicContact CD1-CZ2 4.47Å; Y158-W402 AromaticContact CE1-CH2 3.98Å; Y158-W402 HydrophobicContact CE1-CH2 3.98Å; Y158-W402 HydrophobicContact CE1-CZ2 4.01Å; Y158-W402 HydrophobicContact CE2-CH2 4.33Å; W160-W402 AromaticContact CH2-CH2 3.56Å; W160-W402 HydrophobicContact CH2-CH2 3.56Å; W160-W402 AromaticContact CH2-CZ3 3.55Å; W160-W402 HydrophobicContact CH2-CZ3 3.55Å; W160-W402 AromaticContact CZ2-CH2 3.65Å; W160-W402 HydrophobicContact CZ2-CH2 3.65Å; W160-W402 AromaticContact CZ2-CZ3 3.71Å; W160-W402 HydrophobicContact CZ2-CZ3 3.71Å; V267-W402 HydrophobicContact CG1-CE3 4.27Å; V267-W402 HydrophobicContact CG1-CZ3 3.91Å; V267-W402 HydrophobicContact CG2-CE3 4.15Å; V267-W402 HydrophobicContact CG2-CZ3 4.3Å; L288-W402 HydrophobicContact CD1-CH2 3.88Å; L288-W402 HydrophobicContact CD1-CZ3 3.57Å; L288-W402 HydrophobicContact CG-CZ3 4.48Å; I400-W402 HydrophobicContact CB-CZ2 4.38Å; I400-W402 HydrophobicContact CD1-CZ2 4.45Å; I400-W402 HydrophobicContact CG2-CD2 3.96Å; I400-W402 HydrophobicContact CG2-CE3 4.35Å; I400-W402 HydrophobicContact CG2-CG 4.5Å; I400-W402 HydrophobicContact CG2-CH2 4.15Å; I400-W402 HydrophobicContact CG2-CZ2 3.74Å; I400-W402 HydrophobicContact CG2-CZ3 4.43Å; W402-G404 PolarHBondContact O-N 2.86Å; W402-G405 PolarHBondContact O-N 3.41Å; W402-G405 VanDerWaalsContact O-N 3.09Å; W402-E406 HydrophobicContact CB-CB 4.24Å; W402-E406 PolarHBondContact N-O 3Å; W402-E406 PolarHBondContact O-N 3.47Å; W402-E408 PolarHBondContact NE1-O 3.44Å; W402-K409 HydrophobicContact CZ2-CB 4.06Å; W402-K409 HydrophobicContact CZ2-CG 4.13Å; W402-P410 HydrophobicContact CD2-CG 4.34Å; W402-P410 HydrophobicContact CE3-CG 4.3Å
403	P	90.6	Very high	86.6	Confident	1 Å²	1	81.4 Å²	81.4	1%	0.006	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-53	141.4	175.5	-27.5	38.5	0	0	0	111.8	Y266 G286 G405	Y266-P403 WeakPolarHBondContact O-CD 3.23Å; Y266-P403 VanDerWaalsContact O-CG 3.25Å; Y266-P403 WeakPolarHBondContact O-CG 3.27Å; G286-P403 WeakPolarHBondContact O-CD 3.22Å; P403-G405 VanDerWaalsContact C-N 3.34Å
404	G	85.4	Confident	86.4	Confident	56 Å²	56	86.3 Å²	86.3	58%	0.577	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	82.4	3.9	-171.9	0	0	0	0	0	115.4	W402	W402-G404 PolarHBondContact O-N 2.86Å
405	G	86.2	Confident	85.9	Confident	58 Å²	58	85 Å²	85	60%	0.598	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	81.4	15.7	177.2	0	0	0	0	0	114	W402 P403	W402-G405 PolarHBondContact O-N 3.41Å; W402-G405 VanDerWaalsContact O-N 3.09Å; P403-G405 VanDerWaalsContact C-N 3.34Å
406	E	87.7	Confident	85.7	Confident	70 Å²	70	82.8 Å²	82.8	33%	0.327	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-76.7	140.5	179.1	-64.1	-178.8	173.4	0	0	111	S264 W402	S264-E406 WeakPolarHBondContact CB-OE1 3.14Å; W402-E406 HydrophobicContact CB-CB 4.24Å; W402-E406 PolarHBondContact N-O 3Å; W402-E406 PolarHBondContact O-N 3.47Å
407	T	87.3	Confident	85.7	Confident	102 Å²	102	84.5 Å²	84.5	63%	0.626	43%	0.432	S	S	*	.			trans	-98.1	-20.3	171.7	54	0	0	0	0	112.4
408	E	87.6	Confident	86.1	Confident	157 Å²	157	82.5 Å²	82.5	73%	0.734	41%	0.411	S	S	*	.	S	Bend	trans	-82.5	142	175.8	-65.9	-167.7	176.6	0	0	110.3	W402 P410	W402-E408 PolarHBondContact NE1-O 3.44Å; E408-P410 WeakPolarHBondContact O-CD 3.46Å
409	K	86.3	Confident	86.4	Confident	99 Å²	99	75.5 Å²	75.5	43%	0.43	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-67	124.1	178.6	170.4	-152.4	164.9	-174.2	0	109.9	Y158 W160 W402	Y158-K409 VanDerWaalsContact C-NZ 3.29Å; Y158-K409 HydrophobicContact CD1-CD 3.83Å; Y158-K409 HydrophobicContact CD1-CG 4.03Å; Y158-K409 WeakPolarHBondContact O-CE 3.41Å; Y158-K409 PolarHBondContact O-NZ 2.92Å; W160-K409 HydrophobicContact CZ2-CG 4.49Å; W402-K409 HydrophobicContact CZ2-CB 4.06Å; W402-K409 HydrophobicContact CZ2-CG 4.13Å
410	P	87.9	Confident	86.8	Confident	12 Å²	12	70.7 Å²	70.7	8%	0.078	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-71.1	152.1	176.1	29.4	-35.3	0	0	0	111.7	W160 V267 W402 E408 G412	W160-P410 PolarHBondContact NE1-O 3.22Å; W160-P410 VanDerWaalsContact NE1-O 3.08Å; V267-P410 HydrophobicContact CG2-CB 4.33Å; V267-P410 HydrophobicContact CG2-CG 3.23Å; W402-P410 HydrophobicContact CD2-CG 4.34Å; W402-P410 HydrophobicContact CE3-CG 4.3Å; E408-P410 WeakPolarHBondContact O-CD 3.46Å; P410-G412 PolarHBondContact O-N 3.48Å
411	R	82.8	Confident	87.1	Confident	197 Å²	197	69.4 Å²	69.4	74%	0.743	36%	0.358	S	S	*	.			trans	-64.9	-25.3	179.6	-68.2	-174.8	178.1	-174.5	0.8	113.2	Y413	R411-Y413 VanDerWaalsContact C-N 3.34Å; R411-Y413 HydrophobicContact CB-CD1 4.38Å; R411-Y413 HydrophobicContact CB-CE1 4.26Å
412	G	82.4	Confident	87.4	Confident	5 Å²	5	67.1 Å²	67.1	5%	0.052	35%	0.346	C	S	.	.	S	Bend	trans	82.7	2	175.9	0	0	0	0	0	115.5	R238 V239 P410	R238-G412 PolarHBondContact N-O 3.24Å; V239-G412 PolarHBondContact N-O 3.35Å; P410-G412 PolarHBondContact O-N 3.48Å
413	Y	84.8	Confident	87.6	Confident	110 Å²	110	66.8 Å²	66.8	43%	0.431	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-143.5	150	171.1	70.5	-82	0	0	0	109.7	E236 R411	E236-Y413 WeakPolarHBondContact O-CA 3.45Å; R411-Y413 VanDerWaalsContact C-N 3.34Å; R411-Y413 HydrophobicContact CB-CD1 4.38Å; R411-Y413 HydrophobicContact CB-CE1 4.26Å
414	Q	83.8	Confident	87.7	Confident	121 Å²	121	67.1 Å²	67.1	57%	0.565	35%	0.346	S	S	*	.			trans	-128.5	106.8	173.8	-178.6	64.6	40.2	0	0	108.3	E236 R238 S416	E236-Q414 PolarHBondContact O-N 2.95Å; R238-Q414 HydrophobicContact CG-CB 4.06Å; Q414-S416 PolarHBondContact O-N 3.34Å
415	M	77.6	Confident	88	Confident	59 Å²	59	68.9 Å²	68.9	29%	0.291	34%	0.339	S	S	.	.			trans	-70.1	122.2	178.3	-168	165	172.5	0	0	109.5	P788 W789	M415-P788 HydrophobicContact CE-CB 3.81Å; M415-P788 HydrophobicContact CE-CG 3.59Å; M415-P788 HydrophobicContact CG-CG 4.41Å; M415-P788 HydrophobicContact SD-CB 4.11Å; M415-P788 HydrophobicContact SD-CG 3.93Å; M415-W789 HydrophobicContact CE-CD2 3.43Å; M415-W789 VanDerWaalsContact CE-CD2 3.43Å; M415-W789 HydrophobicContact CE-CE3 3.89Å; M415-W789 HydrophobicContact CE-CG 3.99Å; M415-W789 HydrophobicContact CE-CH2 3.77Å; M415-W789 HydrophobicContact CE-CZ2 3.3Å; M415-W789 HydrophobicContact CE-CZ3 4.04Å; M415-W789 HydrophobicContact CG-CZ2 4.39Å
416	S	78.4	Confident	88.3	Confident	51 Å²	51	67.1 Å²	67.1	36%	0.357	32%	0.315	S	S	.	.			trans	-70.2	135.1	173.5	-177.3	0	0	0	0	109.6	Q414 R418	Q414-S416 PolarHBondContact O-N 3.34Å; S416-R418 PolarHBondContact OG-N 3.18Å; S416-R418 VanDerWaalsContact OG-N 3.12Å; S416-R418 PolarHBondContact OG-O 3.25Å
417	T	85.2	Confident	88.4	Confident	93 Å²	93	66.5 Å²	66.5	57%	0.571	31%	0.312	S	S	*	.	S	Bend	trans	-86.3	-12.1	169.6	52.7	0	0	0	0	112.4	F493 T494	T417-F493 WeakPolarHBondContact O-CA 3.38Å; T417-F493 WeakPolarHBondContact O-CB 3.43Å; T417-T494 PolarHBondContact O-N 3.41Å; T417-T494 PolarHBondContact O-OG1 2.78Å
418	R	90.5	Very high	88.6	Confident	134 Å²	134	61.6 Å²	61.6	51%	0.506	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.2	176.5	-176.2	178	177.6	175.3	-2.6	109.2	S416 T494 E496	S416-R418 PolarHBondContact OG-N 3.18Å; S416-R418 VanDerWaalsContact OG-N 3.12Å; S416-R418 PolarHBondContact OG-O 3.25Å; R418-T494 WeakPolarHBondContact CA-O 3.37Å; R418-T494 WeakPolarHBondContact CA-OG1 3.33Å; R418-E496 IonicContact CZ-OE1 3.52Å; R418-E496 IonicContact CZ-OE2 3.85Å; R418-E496 VanDerWaalsContact CZ-OE2 3.24Å; R418-E496 VanDerWaalsContact NE-CD 3.28Å; R418-E496 IonicContact NE-OE1 3.84Å; R418-E496 IonicContact NE-OE2 3.16Å; R418-E496 PolarHBondContact NE-OE2 3.18Å; R418-E496 IonicContact NH2-OE1 2.81Å; R418-E496 PolarHBondContact NH2-OE1 3.38Å; R418-E496 IonicContact NH2-OE2 3.16Å; R418-E496 PolarHBondContact NH2-OE2 2.64Å
419	L	91.9	Very high	89	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.016	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	136	-179.4	-64.1	177.8	0	0	0	111.5	I421 F493 T494 Y495 E496 D532 M533	L419-I421 HydrophobicContact CB-CD1 3.96Å; L419-F493 HydrophobicContact CD1-CB 4.44Å; L419-F493 HydrophobicContact CD1-CD1 4.4Å; L419-F493 HydrophobicContact CD1-CD2 3.85Å; L419-F493 HydrophobicContact CD1-CE2 4.16Å; L419-F493 HydrophobicContact CD1-CG 3.99Å; L419-F493 HydrophobicContact CG-CD2 4.42Å; L419-T494 PolarHBondContact N-O 2.91Å; L419-Y495 VanDerWaalsContact O-CA 3.3Å; L419-Y495 WeakPolarHBondContact O-CA 3.4Å; L419-E496 PolarHBondContact O-N 3.12Å; L419-D532 HydrophobicContact CD2-CB 4.05Å; L419-M533 HydrophobicContact CD1-CE 4.11Å
420	K	93.8	Very high	89.4	Confident	73 Å²	73	49.4 Å²	49.4	32%	0.317	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	115	169.6	-61.4	176	-171.7	170.5	0	108.8	E234 Q530 D532 M533	E234-K420 IonicContact OE2-NZ 3.2Å; E234-K420 PolarHBondContact OE2-NZ 3.35Å; E234-K420 VanDerWaalsContact OE2-NZ 3.11Å; K420-Q530 WeakPolarHBondContact CD-O 3.49Å; K420-D532 PolarHBondContact N-OD2 3.47Å; K420-D532 VanDerWaalsContact N-OD2 3.08Å; K420-D532 PolarHBondContact O-N 2.73Å; K420-M533 PolarHBondContact O-N 3.16Å
421	I	96.7	Very high	89.7	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	121.3	-176.6	-51.5	-60.6	0	0	0	109.5	L419 L484 E496 V497 H498 M533 V535	L419-I421 HydrophobicContact CB-CD1 3.96Å; I421-L484 HydrophobicContact CD1-CD1 4.34Å; I421-L484 HydrophobicContact CG1-CD1 4.2Å; I421-L484 HydrophobicContact CG1-CD2 4.33Å; I421-L484 HydrophobicContact CG2-CD2 4.19Å; I421-E496 PolarHBondContact N-O 2.95Å; I421-V497 HydrophobicContact CB-CG2 4.39Å; I421-V497 WeakPolarHBondContact O-CA 3.37Å; I421-H498 PolarHBondContact O-N 3.32Å; I421-M533 WeakPolarHBondContact CA-O 3.49Å; I421-M533 HydrophobicContact CD1-CB 3.71Å; I421-M533 HydrophobicContact CD1-CG 4.26Å; I421-M533 HydrophobicContact CD1-SD 4.19Å; I421-V535 HydrophobicContact CG2-CB 3.94Å; I421-V535 HydrophobicContact CG2-CG2 3.82Å
422	V	96.8	Very high	90.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	140.3	171.8	67.3	0	0	0	0	110.7	H498 V500 M522 E525 A531 M533 I534 V535	V422-H498 WeakPolarHBondContact CA-O 3.35Å; V422-V500 HydrophobicContact CG2-CB 4.07Å; V422-M522 HydrophobicContact CG1-CB 4.33Å; V422-M522 HydrophobicContact CG1-CG 4.49Å; V422-M522 HydrophobicContact CG2-CG 4.01Å; V422-E525 WeakPolarHBondContact CG2-OE2 3.43Å; V422-A531 HydrophobicContact CB-CB 3.69Å; V422-A531 HydrophobicContact CG1-CB 3.53Å; V422-M533 PolarHBondContact N-O 3.17Å; V422-I534 HydrophobicContact CG1-CB 4.21Å; V422-I534 HydrophobicContact CG1-CG1 3.57Å; V422-I534 HydrophobicContact CG1-CG2 4.42Å; V422-V535 PolarHBondContact O-N 3.21Å; V422-V535 VanDerWaalsContact O-N 3.16Å
423	T	95.7	Very high	90.5	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	176.2	174.8	-160.2	0	0	0	0	111.7	V430 V497 H498 L499 V500 V535	T423-V430 HydrophobicContact CG2-CG1 4.26Å; T423-V497 HydrophobicContact CG2-CG1 3.81Å; T423-H498 PolarHBondContact N-O 2.98Å; T423-L499 HydrophobicContact CG2-CD2 3.68Å; T423-L499 WeakPolarHBondContact O-CA 3.32Å; T423-V500 PolarHBondContact O-N 3.18Å; T423-V535 WeakPolarHBondContact CB-O 3.5Å; T423-V535 PolarHBondContact OG1-O 2.79Å
424	I	92.9	Very high	90.8	Very high	8 Å²	8	46.7 Å²	46.7	4%	0.041	23%	0.233	C	C	.	.			trans	-133.4	146.4	-178.3	-171.1	169.3	0	0	0	109.7	Q426 V430 V500 G503 F505 M522 A536	I424-Q426 HydrophobicContact CG2-CB 4.4Å; I424-Q426 PolarHBondContact O-N 2.74Å; I424-V430 WeakPolarHBondContact O-CB 3.43Å; I424-V500 HydrophobicContact CB-CG1 4.11Å; I424-V500 HydrophobicContact CD1-CG1 4.29Å; I424-V500 HydrophobicContact CG1-CG1 3.97Å; I424-G503 WeakPolarHBondContact CD1-O 3.29Å; I424-F505 HydrophobicContact CD1-CD1 4.36Å; I424-F505 HydrophobicContact CD1-CD2 4.03Å; I424-F505 HydrophobicContact CD1-CE1 4.34Å; I424-F505 HydrophobicContact CD1-CE2 4.01Å; I424-F505 HydrophobicContact CD1-CG 4.21Å; I424-F505 HydrophobicContact CD1-CZ 4.16Å; I424-F505 HydrophobicContact CG2-CD1 4.35Å; I424-F505 HydrophobicContact CG2-CE1 3.85Å; I424-F505 HydrophobicContact CG2-CZ 4.25Å; I424-M522 HydrophobicContact CB-CE 3.78Å; I424-M522 HydrophobicContact CB-SD 3.75Å; I424-M522 HydrophobicContact CD1-CE 4.3Å; I424-M522 HydrophobicContact CG2-CE 3.51Å; I424-M522 HydrophobicContact CG2-SD 3.93Å; I424-A536 HydrophobicContact CG2-CB 3.94Å
425	H	91.4	Very high	91.1	Very high	92 Å²	92	42.8 Å²	42.8	43%	0.426	22%	0.217	S	C	.	.			trans	-67.4	112.7	171.6	177.9	-134.3	0	0	0	110.2	V430 V432	H425-V430 PolarHBondContact CD2-O 3.32Å; H425-V432 HydrophobicContact CB-CG2 3.91Å
426	Q	92	Very high	91.6	Very high	21 Å²	21	43.8 Å²	43.8	10%	0.098	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-157.4	102.2	-179.7	-177.1	61.6	64.1	0	0	110	I424 F429 V430 F505 P537 V756	I424-Q426 HydrophobicContact CG2-CB 4.4Å; I424-Q426 PolarHBondContact O-N 2.74Å; Q426-F429 WeakPolarHBondContact O-CA 3.44Å; Q426-F429 PolarHBondContact O-N 2.94Å; Q426-V430 CarbonylContact C-O 3.51Å; Q426-V430 PolarHBondContact N-O 3.08Å; Q426-V430 VanDerWaalsContact N-O 3.11Å; Q426-V430 PolarHBondContact O-N 3.44Å; Q426-F505 HydrophobicContact CG-CZ 4.49Å; Q426-P537 HydrophobicContact CB-CG 3.95Å; Q426-P537 HydrophobicContact CG-CG 3.7Å; Q426-V756 HydrophobicContact CG-CG2 4.38Å
427	E	91	Very high	91.9	Very high	57 Å²	57	47.1 Å²	47.1	27%	0.266	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	140.5	172	-53.9	-166.9	175.3	0	0	109.9	Y431	E427-Y431 HydrophobicContact CB-CE1 3.93Å; E427-Y431 HydrophobicContact CG-CD1 3.69Å; E427-Y431 HydrophobicContact CG-CE1 3.51Å; E427-Y431 WeakPolarHBondContact OE1-CD1 3.47Å
428	P	91.9	Very high	91.9	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	cis	-89.5	6.6	0.3	36.2	-37.4	0	0	0	115.4	Y431 F759 V814	P428-Y431 WeakPolarHBondContact CA-OH 3.43Å; P428-Y431 WeakPolarHBondContact O-CE2 3.35Å; P428-F759 HydrophobicContact CB-CD1 3.83Å; P428-F759 HydrophobicContact CB-CD2 3.74Å; P428-F759 HydrophobicContact CB-CE1 3.92Å; P428-F759 HydrophobicContact CB-CE2 3.82Å; P428-F759 HydrophobicContact CB-CG 3.74Å; P428-F759 HydrophobicContact CB-CZ 3.93Å; P428-F759 HydrophobicContact CG-CB 3.9Å; P428-F759 HydrophobicContact CG-CD1 3.98Å; P428-F759 HydrophobicContact CG-CD2 3.99Å; P428-F759 HydrophobicContact CG-CG 3.67Å; P428-V814 HydrophobicContact CG-CG2 4.02Å
429	F	95.3	Very high	91.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-38.7	-170.8	-67.3	-80.1	0	0	0	113.9	Q426 G478 F479 C480 P537 F554 A755 V756 F779	Q426-F429 WeakPolarHBondContact O-CA 3.44Å; Q426-F429 PolarHBondContact O-N 2.94Å; F429-G478 CarbonylContact O-C 3.54Å; F429-F479 HydrophobicContact CD1-CB 4.03Å; F429-F479 AromaticContact CD1-CD1 3.77Å; F429-F479 HydrophobicContact CD1-CD1 3.77Å; F429-F479 HydrophobicContact CD1-CE1 4.47Å; F429-F479 AromaticContact CD1-CG 3.98Å; F429-F479 HydrophobicContact CD1-CG 3.98Å; F429-F479 HydrophobicContact CE1-CD1 4.1Å; F429-F479 HydrophobicContact CE1-CE1 4.41Å; F429-F479 HydrophobicContact CE1-CG 4.3Å; F429-F479 PolarHBondContact O-N 2.93Å; F429-F479 VanDerWaalsContact O-N 3.09Å; F429-C480 PolarHBondContact O-N 2.68Å; F429-P537 HydrophobicContact CB-CB 4.41Å; F429-P537 HydrophobicContact CB-CG 3.99Å; F429-P537 HydrophobicContact CD1-CB 4.46Å; F429-P537 HydrophobicContact CD2-CB 3.73Å; F429-P537 HydrophobicContact CD2-CG 3.87Å; F429-P537 HydrophobicContact CE2-CB 4.08Å; F429-P537 HydrophobicContact CG-CB 3.94Å; F429-P537 HydrophobicContact CG-CG 4.02Å; F429-F554 HydrophobicContact CE1-CE2 4.44Å; F429-A755 HydrophobicContact CE2-CB 4.02Å; F429-A755 HydrophobicContact CZ-CB 3.78Å; F429-V756 HydrophobicContact CE2-CG2 4.3Å; F429-F779 HydrophobicContact CE1-CD2 4.35Å; F429-F779 HydrophobicContact CE1-CE2 4.43Å; F429-F779 HydrophobicContact CE2-CD2 4.49Å; F429-F779 AromaticContact CE2-CE2 3.83Å; F429-F779 HydrophobicContact CE2-CE2 3.83Å; F429-F779 AromaticContact CZ-CD2 3.98Å; F429-F779 HydrophobicContact CZ-CD2 3.98Å; F429-F779 AromaticContact CZ-CE2 3.64Å; F429-F779 HydrophobicContact CZ-CE2 3.64Å
430	V	95.7	Very high	91.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-143.9	114.5	179.9	-177.8	0	0	0	0	109.2	T423 I424 H425 Q426 Y477 C480	T423-V430 HydrophobicContact CG2-CG1 4.26Å; I424-V430 WeakPolarHBondContact O-CB 3.43Å; H425-V430 PolarHBondContact CD2-O 3.32Å; Q426-V430 CarbonylContact C-O 3.51Å; Q426-V430 PolarHBondContact N-O 3.08Å; Q426-V430 VanDerWaalsContact N-O 3.11Å; Q426-V430 PolarHBondContact O-N 3.44Å; V430-Y477 WeakPolarHBondContact CA-O 3.43Å; V430-C480 HydrophobicContact CG2-CB 3.84Å
431	Y	93.1	Very high	91.3	Very high	26 Å²	26	45.6 Å²	45.6	10%	0.102	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	143.2	170.3	-64.9	-87	0	0	0	110	E427 P428 C476 Y477 F759 W813	E427-Y431 HydrophobicContact CB-CE1 3.93Å; E427-Y431 HydrophobicContact CG-CD1 3.69Å; E427-Y431 HydrophobicContact CG-CE1 3.51Å; E427-Y431 WeakPolarHBondContact OE1-CD1 3.47Å; P428-Y431 WeakPolarHBondContact CA-OH 3.43Å; P428-Y431 WeakPolarHBondContact O-CE2 3.35Å; Y431-C476 WeakPolarHBondContact O-CA 3.3Å; Y431-Y477 VanDerWaalsContact CB-CZ 3.44Å; Y431-Y477 HydrophobicContact CD2-CD2 4.02Å; Y431-Y477 AromaticContact CD2-CE2 3.74Å; Y431-Y477 HydrophobicContact CD2-CE2 3.74Å; Y431-Y477 HydrophobicContact CG-CD2 4.29Å; Y431-Y477 AromaticContact CG-CE2 3.72Å; Y431-Y477 HydrophobicContact CG-CE2 3.72Å; Y431-Y477 AromaticContact CG-CZ 3.94Å; Y431-Y477 PolarHBondContact N-O 2.78Å; Y431-Y477 PolarHBondContact O-N 3.39Å; Y431-Y477 VanDerWaalsContact O-N 3.14Å; Y431-F759 VanDerWaalsContact OH-CZ 3.23Å; Y431-F759 WeakPolarHBondContact OH-CZ 3.37Å; Y431-W813 HydrophobicContact CD2-CE3 4.48Å; Y431-W813 HydrophobicContact CD2-CZ3 4.09Å; Y431-W813 AromaticContact CE2-CE3 3.9Å; Y431-W813 HydrophobicContact CE2-CE3 3.9Å; Y431-W813 AromaticContact CE2-CZ3 3.87Å; Y431-W813 HydrophobicContact CE2-CZ3 3.87Å
432	V	91.9	Very high	91	Very high	30 Å²	30	51.9 Å²	51.9	18%	0.182	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127	176.4	-177.7	0	0	0	0	109	H425 Q474 L499	H425-V432 HydrophobicContact CB-CG2 3.91Å; V432-Q474 HydrophobicContact CG1-CB 4.13Å; V432-Q474 HydrophobicContact CG1-CG 4.47Å; V432-Q474 VanDerWaalsContact CG1-OE1 3.29Å; V432-L499 HydrophobicContact CG1-CD1 3.93Å; V432-L499 HydrophobicContact CG2-CD1 3.76Å; V432-L499 HydrophobicContact CG2-CD2 4.05Å
433	K	90.9	Very high	90.6	Very high	102 Å²	102	59.7 Å²	59.7	44%	0.443	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	148.4	173.8	-66.2	-64.4	179	-164.4	0	110.3	C475 Y477	K433-C475 PolarHBondContact N-O 3Å; K433-C475 PolarHBondContact O-N 3.45Å; K433-Y477 HydrophobicContact CB-CE1 4.45Å; K433-Y477 HydrophobicContact CG-CE1 3.74Å
434	P	89.8	Confident	90.3	Very high	108 Å²	108	62.8 Å²	62.8	70%	0.701	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	151.1	172.8	27.6	-34	0	0	0	110.7
435	T	90.4	Very high	90.1	Very high	39 Å²	39	68.8 Å²	68.8	24%	0.239	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-68.5	156.2	169.6	42.3	0	0	0	0	110.5	P473	T435-P473 WeakPolarHBondContact CG2-O 3.28Å; T435-P473 PolarHBondContact OG1-O 3.29Å
436	L	89.1	Confident	89.8	Confident	80 Å²	80	66.1 Å²	66.1	42%	0.419	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-67.3	167.6	168	-68.7	164.5	0	0	0	110.1	D438 G439 T440 K442	L436-D438 PolarHBondContact O-N 3.06Å; L436-G439 PolarHBondContact O-N 3.14Å; L436-T440 WeakPolarHBondContact CB-O 3.27Å; L436-T440 PolarHBondContact N-O 2.7Å; L436-K442 HydrophobicContact CD1-CB 4.29Å
437	S	83.6	Confident	89.2	Confident	122 Å²	122	70 Å²	70	85%	0.853	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-30.2	174	49	0	0	0	0	113.2	G439	S437-G439 VanDerWaalsContact C-N 3.27Å; S437-G439 PolarHBondContact O-N 2.76Å
438	D	85.3	Confident	88.6	Confident	133 Å²	133	73.3 Å²	73.3	71%	0.711	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	2.4	-175.6	-52	-9.8	0	0	0	112.3	L436 T440	L436-D438 PolarHBondContact O-N 3.06Å; D438-T440 VanDerWaalsContact C-N 3.29Å; D438-T440 PolarHBondContact O-N 2.94Å
439	G	83.3	Confident	88.2	Confident	33 Å²	33	75.6 Å²	75.6	34%	0.34	42%	0.424	S	S	.	.	S	Bend	trans	78.9	4.8	-179.7	0	0	0	0	0	115	L436 S437	L436-G439 PolarHBondContact O-N 3.14Å; S437-G439 VanDerWaalsContact C-N 3.27Å; S437-G439 PolarHBondContact O-N 2.76Å
440	T	89.8	Confident	87.8	Confident	75 Å²	75	80.3 Å²	80.3	46%	0.46	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-101.5	168	-179.8	60.3	0	0	0	0	112.5	L436 D438	L436-T440 WeakPolarHBondContact CB-O 3.27Å; L436-T440 PolarHBondContact N-O 2.7Å; D438-T440 VanDerWaalsContact C-N 3.29Å; D438-T440 PolarHBondContact O-N 2.94Å
441	C	90.9	Very high	87.5	Confident	30 Å²	30	84.5 Å²	84.5	20%	0.203	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-94.4	138.7	177.7	-59	0	0	0	0	111.4	E443 K454 C475	C441-E443 PolarHBondContact O-N 3.07Å; C441-K454 HydrophobicContact CB-CB 4.08Å; C441-K454 HydrophobicContact CB-CD 4.02Å; C441-C475 WeakPolarHBondContact CA-SG 3.4Å; C441-C475 HydrophobicContact CB-CB 3.88Å; C441-C475 WeakPolarHBondContact CB-SG 3.4Å; C441-C475 WeakPolarHBondContact SG-CB 3.42Å; C441-C475 CovalentContact SG-SG 2.03Å; C441-C475 PolarHBondContact SG-SG 3.2Å
442	K	90.8	Very high	87.5	Confident	132 Å²	132	84.5 Å²	84.5	57%	0.574	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-63.6	128.5	173.9	-174.6	-175.7	177.6	-169.7	0	110.9	L436 K454	L436-K442 HydrophobicContact CD1-CB 4.29Å; K442-K454 WeakPolarHBondContact O-CD 3.34Å; K442-K454 WeakPolarHBondContact O-CE 3.47Å; K442-K454 PolarHBondContact O-NZ 3.36Å
443	E	88.4	Confident	87.5	Confident	165 Å²	165	87 Å²	87	77%	0.771	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-72.6	130.9	174.8	-63.6	-174.9	169.4	0	0	110.9	C441	C441-E443 PolarHBondContact O-N 3.07Å
444	E	89.5	Confident	87.6	Confident	66 Å²	66	84.2 Å²	84.2	31%	0.308	48%	0.475	S	S	.	.			trans	-138	151.2	179.8	-73.7	171.1	177.1	0	0	109	V452 K454	E444-V452 WeakPolarHBondContact O-CB 3.04Å; E444-V452 PolarHBondContact O-N 3.35Å; E444-K454 IonicContact OE1-NZ 3.11Å; E444-K454 IonicContact OE2-NZ 3.13Å; E444-K454 PolarHBondContact OE2-NZ 3.48Å
445	F	88.6	Confident	87.9	Confident	134 Å²	134	79.8 Å²	79.8	59%	0.588	45%	0.446	S	S	*	.	B	Isolated β-bridge	trans	-116.3	146.9	-179	-62.5	-88.1	0	0	0	110	D450 P451	F445-D450 CarbonylContact C-O 3.5Å; F445-D450 WeakPolarHBondContact CA-O 3.48Å; F445-P451 HydrophobicContact CD1-CB 4.28Å; F445-P451 HydrophobicContact CE1-CB 4.11Å
446	T	84.4	Confident	88	Confident	35 Å²	35	82.6 Å²	82.6	22%	0.215	46%	0.459	C	S	.	.			trans	-71.4	169.4	169.7	68.7	0	0	0	0	110.2	N448 G449 D450 V452 T812	T446-N448 PolarHBondContact O-N 2.95Å; T446-N448 PolarHBondContact OG1-N 3.28Å; T446-G449 PolarHBondContact O-N 3.38Å; T446-D450 HydrophobicContact CG2-CB 4.49Å; T446-D450 PolarHBondContact N-O 2.98Å; T446-D450 PolarHBondContact OG1-N 3.14Å; T446-D450 PolarHBondContact OG1-O 2.86Å; T446-V452 HydrophobicContact CG2-CG2 3.81Å; T446-T812 HydrophobicContact CG2-CG2 4.42Å
447	V	79.3	Confident	88.2	Confident	104 Å²	104	78.8 Å²	78.8	63%	0.63	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.2	173.6	173.4	0	0	0	0	112.6	G449 Y816	V447-G449 PolarHBondContact O-N 3.01Å; V447-Y816 HydrophobicContact CB-CE2 4.19Å; V447-Y816 HydrophobicContact CG2-CE2 3.49Å; V447-Y816 VanDerWaalsContact CG2-CE2 3.49Å; V447-Y816 WeakPolarHBondContact CG2-OH 3.34Å
448	N	78.7	Confident	88.6	Confident	126 Å²	126	76.3 Å²	76.3	67%	0.674	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.7	178.4	-60.3	-19.5	0	0	0	112.6	T446	T446-N448 PolarHBondContact O-N 2.95Å; T446-N448 PolarHBondContact OG1-N 3.28Å
449	G	82.9	Confident	88.6	Confident	48 Å²	48	70 Å²	70	50%	0.495	39%	0.385	S	S	.	.	S	Bend	trans	84.7	5.9	-178.8	0	0	0	0	0	114.6	T446 V447	T446-G449 PolarHBondContact O-N 3.38Å; V447-G449 PolarHBondContact O-N 3.01Å
450	D	86.5	Confident	88.5	Confident	99 Å²	99	69.2 Å²	69.2	53%	0.529	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-78.8	138.8	177.8	-64.8	-48.9	0	0	0	111.2	F445 T446 V452	F445-D450 CarbonylContact C-O 3.5Å; F445-D450 WeakPolarHBondContact CA-O 3.48Å; T446-D450 HydrophobicContact CG2-CB 4.49Å; T446-D450 PolarHBondContact N-O 2.98Å; T446-D450 PolarHBondContact OG1-N 3.14Å; T446-D450 PolarHBondContact OG1-O 2.86Å; D450-V452 PolarHBondContact O-N 2.96Å
451	P	90.5	Very high	87.6	Confident	87 Å²	87	68.9 Å²	68.9	57%	0.565	37%	0.37	S	S	*	.	B	Isolated β-bridge	trans	-68.9	128.5	177.1	27.7	-33.5	0	0	0	111	F445 K453	F445-P451 HydrophobicContact CD1-CB 4.28Å; F445-P451 HydrophobicContact CE1-CB 4.11Å; P451-K453 PolarHBondContact O-N 3.2Å
452	V	91.9	Very high	86.1	Confident	26 Å²	26	73.3 Å²	73.3	16%	0.158	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-72	120	176.3	177.8	0	0	0	0	109.4	E444 T446 D450 K454 Y477 W813	E444-V452 WeakPolarHBondContact O-CB 3.04Å; E444-V452 PolarHBondContact O-N 3.35Å; T446-V452 HydrophobicContact CG2-CG2 3.81Å; D450-V452 PolarHBondContact O-N 2.96Å; V452-K454 HydrophobicContact CG1-CG 4.35Å; V452-K454 PolarHBondContact O-N 2.91Å; V452-Y477 HydrophobicContact CG1-CD2 3.9Å; V452-Y477 HydrophobicContact CG1-CG 4.3Å; V452-W813 HydrophobicContact CG1-CH2 3.81Å; V452-W813 HydrophobicContact CG1-CZ2 4.31Å
453	K	92.9	Very high	84.5	Confident	82 Å²	82	72.5 Å²	72.5	36%	0.357	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-76.2	127.2	178.7	-54.6	-173.3	-152	99.3	0	110.1	P451 Y477 D482 I485	P451-K453 PolarHBondContact O-N 3.2Å; K453-Y477 WeakPolarHBondContact O-CB 3.45Å; K453-D482 WeakPolarHBondContact CD-OD1 3.49Å; K453-D482 IonicContact NZ-OD1 2.55Å; K453-D482 PolarHBondContact NZ-OD1 3.04Å; K453-I485 HydrophobicContact CB-CD1 3.66Å; K453-I485 HydrophobicContact CD-CD1 3.97Å; K453-I485 HydrophobicContact CD-CG2 4.29Å; K453-I485 HydrophobicContact CG-CD1 4.46Å
454	K	93.9	Very high	82.6	Confident	44 Å²	44	67.6 Å²	67.6	19%	0.191	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	147.7	180	-49.9	-168.1	173.1	177.5	0	110.3	C441 K442 E444 V452 Y477	C441-K454 HydrophobicContact CB-CB 4.08Å; C441-K454 HydrophobicContact CB-CD 4.02Å; K442-K454 WeakPolarHBondContact O-CD 3.34Å; K442-K454 WeakPolarHBondContact O-CE 3.47Å; K442-K454 PolarHBondContact O-NZ 3.36Å; E444-K454 IonicContact OE1-NZ 3.11Å; E444-K454 IonicContact OE2-NZ 3.13Å; E444-K454 PolarHBondContact OE2-NZ 3.48Å; V452-K454 HydrophobicContact CG1-CG 4.35Å; V452-K454 PolarHBondContact O-N 2.91Å; K454-Y477 HydrophobicContact CD-CD1 4.03Å; K454-Y477 HydrophobicContact CD-CG 4.4Å; K454-Y477 HydrophobicContact CG-CD1 4.26Å; K454-Y477 HydrophobicContact CG-CG 4.21Å
455	V	94.3	Very high	80.7	Confident	15 Å²	15	71.1 Å²	71.1	9%	0.091	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.2	175.2	-58.8	0	0	0	0	109.8	C476 I481 I485 Y495 V497	V455-C476 HydrophobicContact CG2-CB 4.12Å; V455-C476 PolarHBondContact N-O 3.48Å; V455-C476 PolarHBondContact O-N 3.35Å; V455-I481 HydrophobicContact CB-CG2 4.37Å; V455-I481 HydrophobicContact CG1-CG2 3.78Å; V455-I481 HydrophobicContact CG2-CD1 4.16Å; V455-I481 HydrophobicContact CG2-CG2 3.73Å; V455-I485 HydrophobicContact CG1-CD1 4.23Å; V455-I485 HydrophobicContact CG1-CG1 4.49Å; V455-Y495 HydrophobicContact CG1-CE2 4.08Å; V455-V497 HydrophobicContact CG2-CB 4.49Å; V455-V497 HydrophobicContact CG2-CG2 4.11Å
456	I	93.7	Very high	78.9	Confident	99 Å²	99	68.5 Å²	68.5	51%	0.508	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	127.7	171.3	-57.6	173.9	0	0	0	107.5	P473 Q474	I456-P473 HydrophobicContact CG2-CB 4.14Å; I456-Q474 CarbonylContact C-O 3.54Å; I456-Q474 WeakPolarHBondContact CA-O 3.47Å
457	C	93.2	Very high	77.5	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.1	175.7	55.6	0	0	0	0	109.8	Q474 C476 V497	C457-Q474 PolarHBondContact N-O 3Å; C457-Q474 PolarHBondContact O-N 3.02Å; C457-Q474 PolarHBondContact SG-O 3.35Å; C457-C476 HydrophobicContact CB-CB 3.76Å; C457-C476 WeakPolarHBondContact CB-SG 3.42Å; C457-C476 WeakPolarHBondContact SG-CB 3.44Å; C457-C476 PolarHBondContact SG-N 3.38Å; C457-C476 VanDerWaalsContact SG-N 3.41Å; C457-C476 CovalentContact SG-SG 2.03Å; C457-C476 PolarHBondContact SG-SG 3.18Å; C457-V497 WeakPolarHBondContact CA-O 3.39Å; C457-V497 HydrophobicContact CB-CB 4.19Å; C457-V497 HydrophobicContact CB-CG1 4.06Å
458	T	91.6	Very high	76.4	Confident	69 Å²	69	69.1 Å²	69.1	42%	0.423	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	133.4	172.5	51.6	0	0	0	0	109.4	V497 H498 L499	T458-V497 PolarHBondContact N-O 2.96Å; T458-H498 CarbonylContact O-C 3.49Å; T458-H498 VanDerWaalsContact O-CA 3.23Å; T458-H498 WeakPolarHBondContact O-CA 3.33Å; T458-H498 WeakPolarHBondContact O-CB 3.5Å; T458-H498 VanDerWaalsContact OG1-CB 3.27Å; T458-H498 WeakPolarHBondContact OG1-CB 3.36Å; T458-L499 PolarHBondContact O-N 2.82Å
459	G	84.9	Confident	75.6	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.01	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	164.4	-176.9	0	0	0	0	0	113.6	T471 V472	G459-T471 WeakPolarHBondContact O-CA 3.39Å; G459-V472 PolarHBondContact N-O 2.91Å; G459-V472 PolarHBondContact O-N 3.32Å
460	P	80.8	Confident	75	Confident	17 Å²	17	74.8 Å²	74.8	11%	0.11	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	144.8	172.8	28.1	-32.3	0	0	0	110.6	D462 R469 Q474	P460-D462 PolarHBondContact O-N 2.95Å; P460-R469 HydrophobicContact CB-CB 4.49Å; P460-Q474 PolarHBondContact O-NE2 3.34Å
461	N	71.1	Confident	74.7	Confident	68 Å²	68	75.5 Å²	75.5	36%	0.364	44%	0.44	S	S	.	.			trans	-82.8	112.7	173.9	-172.4	3.7	0	0	0	110.5	T463 V472	N461-T463 VanDerWaalsContact C-N 3.31Å; N461-T463 PolarHBondContact ND2-OG1 3.11Å; N461-T463 VanDerWaalsContact ND2-OG1 3.13Å; N461-T463 PolarHBondContact O-N 2.9Å; N461-T463 PolarHBondContact OD1-N 3.33Å; N461-T463 PolarHBondContact OD1-OG1 3.1Å; N461-V472 HydrophobicContact CB-CG1 4.49Å; N461-V472 HydrophobicContact CB-CG2 3.97Å
462	D	60.3	Low	74.5	Confident	123 Å²	123	73.5 Å²	73.5	66%	0.658	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-1.2	-176.3	-72.3	-30.8	0	0	0	114.7	P460 S464	P460-D462 PolarHBondContact O-N 2.95Å; D462-S464 PolarHBondContact O-N 3.14Å; D462-S464 VanDerWaalsContact O-N 3.11Å
463	T	57.3	Low	74.5	Confident	115 Å²	115	75.5 Å²	75.5	71%	0.706	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-4.6	-173.6	42.9	0	0	0	0	116.4	N461	N461-T463 VanDerWaalsContact C-N 3.31Å; N461-T463 PolarHBondContact ND2-OG1 3.11Å; N461-T463 VanDerWaalsContact ND2-OG1 3.13Å; N461-T463 PolarHBondContact O-N 2.9Å; N461-T463 PolarHBondContact OD1-N 3.33Å; N461-T463 PolarHBondContact OD1-OG1 3.1Å
464	S	49	Very low	74.4	Confident	61 Å²	61	72.7 Å²	72.7	43%	0.427	43%	0.427	S	S	.	.			trans	-161.6	122.9	167	38.3	0	0	0	0	114.2	D462 G466 S467	D462-S464 PolarHBondContact O-N 3.14Å; D462-S464 VanDerWaalsContact O-N 3.11Å; S464-G466 PolarHBondContact O-N 3.3Å; S464-S467 PolarHBondContact OG-OG 3.3Å
465	P	48.5	Very low	74.4	Confident	141 Å²	141	70.8 Å²	70.8	92%	0.916	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	98.6	171.1	28.2	-30.6	0	0	0	109.4
466	G	51.3	Low	74.4	Confident	79 Å²	79	70 Å²	70	81%	0.814	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	144.3	-11.4	174.2	0	0	0	0	0	116.5	S464	S464-G466 PolarHBondContact O-N 3.3Å
467	S	54.6	Low	74.5	Confident	59 Å²	59	66.4 Å²	66.4	41%	0.413	40%	0.395	S	S	.	.	S	Bend	trans	-86	150.7	169.4	62.2	0	0	0	0	110.7	S464 R469	S464-S467 PolarHBondContact OG-OG 3.3Å; S467-R469 PolarHBondContact O-N 2.88Å; S467-R469 VanDerWaalsContact O-N 3.1Å
468	P	56.6	Low	74.6	Confident	93 Å²	93	66.4 Å²	66.4	60%	0.604	40%	0.395	S	S	*	.			trans	-54.4	121.9	171.6	19.8	-29.1	0	0	0	108.7	H470	P468-H470 VanDerWaalsContact C-N 3.3Å; P468-H470 PolarHBondContact O-CD2 3.49Å; P468-H470 PolarHBondContact O-N 3.44Å
469	R	61.8	Low	74.8	Confident	161 Å²	161	63.1 Å²	63.1	61%	0.608	38%	0.375	S	S	*	.			trans	-63.3	90.5	-179.5	-72.3	-177.2	178.3	178.9	0.5	109.1	P460 S467 A501	P460-R469 HydrophobicContact CB-CB 4.49Å; S467-R469 PolarHBondContact O-N 2.88Å; S467-R469 VanDerWaalsContact O-N 3.1Å; R469-A501 PolarHBondContact NH1-O 3.18Å
470	H	69.8	Low	75.3	Confident	131 Å²	131	63 Å²	63	61%	0.606	37%	0.374	S	S	*	.			trans	-75.1	135.6	168.2	-66.4	-69	0	0	0	108.8	P468	P468-H470 VanDerWaalsContact C-N 3.3Å; P468-H470 PolarHBondContact O-CD2 3.49Å; P468-H470 PolarHBondContact O-N 3.44Å
471	T	81.1	Confident	76.1	Confident	115 Å²	115	62.3 Å²	62.3	71%	0.706	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	125.3	174.1	48.5	0	0	0	0	109	G459	G459-T471 WeakPolarHBondContact O-CA 3.39Å
472	V	86.7	Confident	77.3	Confident	44 Å²	44	59.7 Å²	59.7	27%	0.267	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	145.1	-179.5	-67.5	0	0	0	0	110.5	G459 N461 Q474	G459-V472 PolarHBondContact N-O 2.91Å; G459-V472 PolarHBondContact O-N 3.32Å; N461-V472 HydrophobicContact CB-CG1 4.49Å; N461-V472 HydrophobicContact CB-CG2 3.97Å; V472-Q474 HydrophobicContact CG2-CG 4.13Å; V472-Q474 PolarHBondContact O-N 3.36Å
473	P	90.2	Very high	79	Confident	69 Å²	69	53.9 Å²	53.9	45%	0.448	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	127.3	173.1	29.8	-32.9	0	0	0	110.5	T435 I456	T435-P473 WeakPolarHBondContact CG2-O 3.28Å; T435-P473 PolarHBondContact OG1-O 3.29Å; I456-P473 HydrophobicContact CG2-CB 4.14Å
474	Q	91.6	Very high	80.9	Confident	22 Å²	22	48.4 Å²	48.4	10%	0.103	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	166.6	-178.6	-67.1	172.1	-16.6	0	0	109.8	V432 I456 C457 P460 V472	V432-Q474 HydrophobicContact CG1-CB 4.13Å; V432-Q474 HydrophobicContact CG1-CG 4.47Å; V432-Q474 VanDerWaalsContact CG1-OE1 3.29Å; I456-Q474 CarbonylContact C-O 3.54Å; I456-Q474 WeakPolarHBondContact CA-O 3.47Å; C457-Q474 PolarHBondContact N-O 3Å; C457-Q474 PolarHBondContact O-N 3.02Å; C457-Q474 PolarHBondContact SG-O 3.35Å; P460-Q474 PolarHBondContact O-NE2 3.34Å; V472-Q474 HydrophobicContact CG2-CG 4.13Å; V472-Q474 PolarHBondContact O-N 3.36Å
475	C	94	Very high	83.2	Confident	4 Å²	4	46.2 Å²	46.2	3%	0.027	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	114.9	177.4	-69.6	0	0	0	0	110.1	K433 C441	K433-C475 PolarHBondContact N-O 3Å; K433-C475 PolarHBondContact O-N 3.45Å; C441-C475 WeakPolarHBondContact CA-SG 3.4Å; C441-C475 HydrophobicContact CB-CB 3.88Å; C441-C475 WeakPolarHBondContact CB-SG 3.4Å; C441-C475 WeakPolarHBondContact SG-CB 3.42Å; C441-C475 CovalentContact SG-SG 2.03Å; C441-C475 PolarHBondContact SG-SG 3.2Å
476	C	94.7	Very high	85.4	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136.3	176.5	-71.6	0	0	0	0	110.9	Y431 V455 C457 I481	Y431-C476 WeakPolarHBondContact O-CA 3.3Å; V455-C476 HydrophobicContact CG2-CB 4.12Å; V455-C476 PolarHBondContact N-O 3.48Å; V455-C476 PolarHBondContact O-N 3.35Å; C457-C476 HydrophobicContact CB-CB 3.76Å; C457-C476 WeakPolarHBondContact CB-SG 3.42Å; C457-C476 WeakPolarHBondContact SG-CB 3.44Å; C457-C476 PolarHBondContact SG-N 3.38Å; C457-C476 VanDerWaalsContact SG-N 3.41Å; C457-C476 CovalentContact SG-SG 2.03Å; C457-C476 PolarHBondContact SG-SG 3.18Å; C476-I481 HydrophobicContact CB-CD1 4.42Å
477	Y	95.3	Very high	87.6	Confident	22 Å²	22	39.3 Å²	39.3	9%	0.086	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	165.7	175.7	64	-86.6	0	0	0	111.1	V430 Y431 K433 V452 K453 K454 W813	V430-Y477 WeakPolarHBondContact CA-O 3.43Å; Y431-Y477 VanDerWaalsContact CB-CZ 3.44Å; Y431-Y477 HydrophobicContact CD2-CD2 4.02Å; Y431-Y477 AromaticContact CD2-CE2 3.74Å; Y431-Y477 HydrophobicContact CD2-CE2 3.74Å; Y431-Y477 HydrophobicContact CG-CD2 4.29Å; Y431-Y477 AromaticContact CG-CE2 3.72Å; Y431-Y477 HydrophobicContact CG-CE2 3.72Å; Y431-Y477 AromaticContact CG-CZ 3.94Å; Y431-Y477 PolarHBondContact N-O 2.78Å; Y431-Y477 PolarHBondContact O-N 3.39Å; Y431-Y477 VanDerWaalsContact O-N 3.14Å; K433-Y477 HydrophobicContact CB-CE1 4.45Å; K433-Y477 HydrophobicContact CG-CE1 3.74Å; V452-Y477 HydrophobicContact CG1-CD2 3.9Å; V452-Y477 HydrophobicContact CG1-CG 4.3Å; K453-Y477 WeakPolarHBondContact O-CB 3.45Å; K454-Y477 HydrophobicContact CD-CD1 4.03Å; K454-Y477 HydrophobicContact CD-CG 4.4Å; K454-Y477 HydrophobicContact CG-CD1 4.26Å; K454-Y477 HydrophobicContact CG-CG 4.21Å; Y477-W813 AromaticContact CD2-CH2 3.79Å; Y477-W813 HydrophobicContact CD2-CH2 3.79Å; Y477-W813 HydrophobicContact CD2-CZ3 4.05Å; Y477-W813 HydrophobicContact CE2-CH2 4.38Å; Y477-W813 HydrophobicContact CE2-CZ3 4.29Å
478	G	94.7	Very high	89.5	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.	S	Bend	trans	136.4	-175	179.3	0	0	0	0	0	112.9	F429 C480 I481 D482	F429-G478 CarbonylContact O-C 3.54Å; G478-C480 VanDerWaalsContact C-N 3.33Å; G478-C480 PolarHBondContact O-N 3.12Å; G478-I481 PolarHBondContact O-N 3.03Å; G478-D482 PolarHBondContact O-N 2.94Å
479	F	95.4	Very high	91.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-49.2	-49.6	-178.2	-177.8	-77.1	0	0	0	113.1	F429 I481 D482 L483 F554 M806 L809 W813	F429-F479 HydrophobicContact CD1-CB 4.03Å; F429-F479 AromaticContact CD1-CD1 3.77Å; F429-F479 HydrophobicContact CD1-CD1 3.77Å; F429-F479 HydrophobicContact CD1-CE1 4.47Å; F429-F479 AromaticContact CD1-CG 3.98Å; F429-F479 HydrophobicContact CD1-CG 3.98Å; F429-F479 HydrophobicContact CE1-CD1 4.1Å; F429-F479 HydrophobicContact CE1-CE1 4.41Å; F429-F479 HydrophobicContact CE1-CG 4.3Å; F429-F479 PolarHBondContact O-N 2.93Å; F429-F479 VanDerWaalsContact O-N 3.09Å; F479-I481 VanDerWaalsContact C-N 3.31Å; F479-I481 PolarHBondContact O-N 2.73Å; F479-D482 PolarHBondContact O-N 3.35Å; F479-L483 WeakPolarHBondContact O-CB 3.49Å; F479-L483 PolarHBondContact O-N 2.9Å; F479-L483 VanDerWaalsContact O-N 3.07Å; F479-F554 HydrophobicContact CD1-CE2 4.25Å; F479-F554 AromaticContact CE1-CD2 3.64Å; F479-F554 HydrophobicContact CE1-CD2 3.64Å; F479-F554 AromaticContact CE1-CE2 3.6Å; F479-F554 HydrophobicContact CE1-CE2 3.6Å; F479-F554 HydrophobicContact CZ-CD2 4.24Å; F479-F554 HydrophobicContact CZ-CE2 4.46Å; F479-M806 HydrophobicContact CE1-SD 4.01Å; F479-M806 HydrophobicContact CE2-SD 4.44Å; F479-M806 HydrophobicContact CZ-CG 4.45Å; F479-M806 HydrophobicContact CZ-SD 3.45Å; F479-M806 WeakPolarHBondContact CZ-SD 3.22Å; F479-L809 HydrophobicContact CD2-CB 3.64Å; F479-L809 HydrophobicContact CE2-CB 3.41Å; F479-L809 VanDerWaalsContact CE2-CB 3.41Å; F479-L809 HydrophobicContact CE2-CD1 4.38Å; F479-L809 HydrophobicContact CZ-CB 4.14Å; F479-L809 HydrophobicContact CZ-CD1 4.41Å; F479-W813 HydrophobicContact CB-CB 4.16Å; F479-W813 HydrophobicContact CB-CG 4.08Å; F479-W813 HydrophobicContact CD2-CB 4.32Å
480	C	97.2	Very high	92.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-69.9	-29.8	-176.5	-78.3	0	0	0	0	112.3	F429 V430 G478 L484 V535	F429-C480 PolarHBondContact O-N 2.68Å; V430-C480 HydrophobicContact CG2-CB 3.84Å; G478-C480 VanDerWaalsContact C-N 3.33Å; G478-C480 PolarHBondContact O-N 3.12Å; C480-L484 WeakPolarHBondContact O-CB 3.23Å; C480-L484 PolarHBondContact O-N 3.41Å; C480-V535 HydrophobicContact CB-CG1 4.16Å
481	I	96.9	Very high	93.9	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-74.5	-42.4	178.1	-57.3	-55.5	0	0	0	110.7	V455 C476 G478 F479 L483 L484 I485	V455-I481 HydrophobicContact CB-CG2 4.37Å; V455-I481 HydrophobicContact CG1-CG2 3.78Å; V455-I481 HydrophobicContact CG2-CD1 4.16Å; V455-I481 HydrophobicContact CG2-CG2 3.73Å; C476-I481 HydrophobicContact CB-CD1 4.42Å; G478-I481 PolarHBondContact O-N 3.03Å; F479-I481 VanDerWaalsContact C-N 3.31Å; F479-I481 PolarHBondContact O-N 2.73Å; I481-L483 VanDerWaalsContact C-N 3.3Å; I481-L483 PolarHBondContact O-N 3.39Å; I481-L484 WeakPolarHBondContact O-CB 3.32Å; I481-L484 PolarHBondContact O-N 2.9Å; I481-I485 HydrophobicContact CG2-CD1 4.05Å; I481-I485 VanDerWaalsContact O-CG1 3.3Å; I481-I485 WeakPolarHBondContact O-CG1 3.14Å; I481-I485 PolarHBondContact O-N 3.24Å
482	D	96.1	Very high	94.5	Very high	14 Å²	14	32.9 Å²	32.9	8%	0.075	17%	0.166	C	C	.	.	H	α-helix	trans	-61.2	-40.6	173.1	-92.8	-39	0	0	0	111.7	K453 G478 F479 I485 K486 L809 W813	K453-D482 WeakPolarHBondContact CD-OD1 3.49Å; K453-D482 IonicContact NZ-OD1 2.55Å; K453-D482 PolarHBondContact NZ-OD1 3.04Å; G478-D482 PolarHBondContact O-N 2.94Å; F479-D482 PolarHBondContact O-N 3.35Å; D482-I485 PolarHBondContact O-N 3.29Å; D482-K486 WeakPolarHBondContact O-CB 3.32Å; D482-K486 PolarHBondContact O-N 3.11Å; D482-L809 HydrophobicContact CB-CD2 3.75Å; D482-W813 PolarHBondContact OD2-NE1 2.85Å
483	L	96.7	Very high	94.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62	-45.1	173.7	-177.2	60.5	0	0	0	111.5	F479 I481 I485 K486 L487 F554 I797 F805 M806 L809	F479-L483 WeakPolarHBondContact O-CB 3.49Å; F479-L483 PolarHBondContact O-N 2.9Å; F479-L483 VanDerWaalsContact O-N 3.07Å; I481-L483 VanDerWaalsContact C-N 3.3Å; I481-L483 PolarHBondContact O-N 3.39Å; L483-I485 PolarHBondContact O-N 3.46Å; L483-K486 WeakPolarHBondContact O-CB 3.29Å; L483-K486 PolarHBondContact O-N 3.1Å; L483-L487 HydrophobicContact CD1-CG 4.48Å; L483-L487 HydrophobicContact CG-CD1 4.21Å; L483-L487 VanDerWaalsContact O-CG 3.28Å; L483-L487 WeakPolarHBondContact O-CG 3.25Å; L483-L487 PolarHBondContact O-N 3.45Å; L483-F554 HydrophobicContact CD2-CB 4.23Å; L483-F554 HydrophobicContact CD2-CD1 4.4Å; L483-F554 HydrophobicContact CD2-CD2 4.24Å; L483-F554 HydrophobicContact CD2-CG 4.05Å; L483-I797 HydrophobicContact CD1-CD1 3.83Å; L483-I797 HydrophobicContact CD2-CD1 4Å; L483-I797 HydrophobicContact CG-CD1 4.27Å; L483-F805 HydrophobicContact CD1-CE1 4.39Å; L483-M806 HydrophobicContact CD1-CE 3.96Å; L483-M806 HydrophobicContact CD2-CE 4.43Å; L483-L809 HydrophobicContact CB-CD1 4.4Å
484	L	97.3	Very high	95	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-58.9	-46.6	176	175.1	62.3	0	0	0	111.8	I421 C480 I481 K486 L487 A488 F493 Y495 V497 V535	I421-L484 HydrophobicContact CD1-CD1 4.34Å; I421-L484 HydrophobicContact CG1-CD1 4.2Å; I421-L484 HydrophobicContact CG1-CD2 4.33Å; I421-L484 HydrophobicContact CG2-CD2 4.19Å; C480-L484 WeakPolarHBondContact O-CB 3.23Å; C480-L484 PolarHBondContact O-N 3.41Å; I481-L484 WeakPolarHBondContact O-CB 3.32Å; I481-L484 PolarHBondContact O-N 2.9Å; L484-K486 VanDerWaalsContact C-N 3.3Å; L484-K486 PolarHBondContact O-N 3.23Å; L484-L487 PolarHBondContact O-N 2.78Å; L484-A488 WeakPolarHBondContact O-CB 3.49Å; L484-A488 PolarHBondContact O-N 2.91Å; L484-F493 HydrophobicContact CD1-CE2 4.09Å; L484-F493 HydrophobicContact CD1-CZ 4.11Å; L484-Y495 HydrophobicContact CD2-CD2 3.89Å; L484-Y495 HydrophobicContact CD2-CE2 4.01Å; L484-Y495 HydrophobicContact CD2-CG 4.26Å; L484-Y495 HydrophobicContact CG-CD1 4.44Å; L484-Y495 HydrophobicContact CG-CD2 4.45Å; L484-Y495 HydrophobicContact CG-CE1 4.47Å; L484-Y495 HydrophobicContact CG-CE2 4.49Å; L484-Y495 HydrophobicContact CG-CG 4.44Å; L484-V497 HydrophobicContact CD2-CG2 3.8Å; L484-V535 HydrophobicContact CB-CG1 4.36Å; L484-V535 HydrophobicContact CD1-CG2 4.28Å
485	I	96.6	Very high	95.2	Very high	14 Å²	14	34 Å²	34	7%	0.072	17%	0.165	C	C	.	.	H	α-helix	trans	-60.6	-41.7	178	-67.8	163.6	0	0	0	110.5	K453 V455 I481 D482 L483 A488 R489 Y495	K453-I485 HydrophobicContact CB-CD1 3.66Å; K453-I485 HydrophobicContact CD-CD1 3.97Å; K453-I485 HydrophobicContact CD-CG2 4.29Å; K453-I485 HydrophobicContact CG-CD1 4.46Å; V455-I485 HydrophobicContact CG1-CD1 4.23Å; V455-I485 HydrophobicContact CG1-CG1 4.49Å; I481-I485 HydrophobicContact CG2-CD1 4.05Å; I481-I485 VanDerWaalsContact O-CG1 3.3Å; I481-I485 WeakPolarHBondContact O-CG1 3.14Å; I481-I485 PolarHBondContact O-N 3.24Å; D482-I485 PolarHBondContact O-N 3.29Å; L483-I485 PolarHBondContact O-N 3.46Å; I485-A488 PolarHBondContact O-N 2.81Å; I485-R489 WeakPolarHBondContact O-CG 3.17Å; I485-R489 PolarHBondContact O-N 3.32Å; I485-R489 VanDerWaalsContact O-N 3.08Å; I485-Y495 WeakPolarHBondContact CG1-OH 3.35Å
486	K	95.6	Very high	95.3	Very high	75 Å²	75	38 Å²	38	33%	0.326	18%	0.184	S	C	.	.	H	α-helix	trans	-63	-43.5	176.4	178.4	63.4	177.4	-172.6	0	111.7	D482 L483 L484 T490 F805	D482-K486 WeakPolarHBondContact O-CB 3.32Å; D482-K486 PolarHBondContact O-N 3.11Å; L483-K486 WeakPolarHBondContact O-CB 3.29Å; L483-K486 PolarHBondContact O-N 3.1Å; L484-K486 VanDerWaalsContact C-N 3.3Å; L484-K486 PolarHBondContact O-N 3.23Å; K486-T490 WeakPolarHBondContact O-CB 3.13Å; K486-T490 PolarHBondContact O-N 2.99Å; K486-T490 VanDerWaalsContact O-N 3.1Å; K486-T490 PolarHBondContact O-OG1 2.95Å; K486-F805 HydrophobicContact CB-CE1 3.87Å; K486-F805 HydrophobicContact CB-CZ 3.88Å; K486-F805 HydrophobicContact CD-CZ 4.43Å; K486-F805 HydrophobicContact CG-CD1 4.26Å; K486-F805 HydrophobicContact CG-CE1 3.76Å; K486-F805 HydrophobicContact CG-CZ 3.99Å
487	L	96.1	Very high	95.3	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-64.4	-46	177.5	-69.9	172.9	0	0	0	111.3	L483 L484 R489 T490 M491 F493 I781 I797	L483-L487 HydrophobicContact CD1-CG 4.48Å; L483-L487 HydrophobicContact CG-CD1 4.21Å; L483-L487 VanDerWaalsContact O-CG 3.28Å; L483-L487 WeakPolarHBondContact O-CG 3.25Å; L483-L487 PolarHBondContact O-N 3.45Å; L484-L487 PolarHBondContact O-N 2.78Å; L487-R489 VanDerWaalsContact C-N 3.34Å; L487-R489 PolarHBondContact O-N 3.19Å; L487-T490 PolarHBondContact O-N 2.98Å; L487-T490 VanDerWaalsContact O-N 3.12Å; L487-M491 HydrophobicContact CB-CE 3.6Å; L487-M491 HydrophobicContact CD2-CE 3.65Å; L487-M491 HydrophobicContact CG-CE 4.13Å; L487-M491 WeakPolarHBondContact O-CB 3.34Å; L487-M491 PolarHBondContact O-N 3.21Å; L487-F493 HydrophobicContact CB-CE1 4.31Å; L487-F493 HydrophobicContact CB-CZ 4.23Å; L487-I781 HydrophobicContact CD1-CD1 3.5Å; L487-I781 VanDerWaalsContact CD1-CD1 3.5Å; L487-I797 HydrophobicContact CD1-CD1 4.32Å; L487-I797 HydrophobicContact CD2-CD1 4.2Å
488	A	96	Very high	95.3	Very high	9 Å²	9	39 Å²	39	7%	0.074	19%	0.19	C	C	.	.	H	α-helix	trans	-57.8	-44.3	178.1	0	0	0	0	0	112.2	L484 I485 T490 N492 F493 Y495	L484-A488 WeakPolarHBondContact O-CB 3.49Å; L484-A488 PolarHBondContact O-N 2.91Å; I485-A488 PolarHBondContact O-N 2.81Å; A488-T490 PolarHBondContact O-N 3.41Å; A488-N492 VanDerWaalsContact O-CA 3.32Å; A488-N492 WeakPolarHBondContact O-CA 3.24Å; A488-N492 PolarHBondContact O-N 3.35Å; A488-F493 HydrophobicContact CB-CD2 4.17Å; A488-F493 HydrophobicContact CB-CE1 4.4Å; A488-F493 HydrophobicContact CB-CE2 3.77Å; A488-F493 HydrophobicContact CB-CZ 3.89Å; A488-F493 PolarHBondContact O-N 2.93Å; A488-Y495 HydrophobicContact CB-CD1 3.65Å; A488-Y495 HydrophobicContact CB-CE1 3.53Å
489	R	94.5	Very high	95.3	Very high	172 Å²	172	39.8 Å²	39.8	65%	0.649	19%	0.194	S	C	*	.	H	α-helix	trans	-67.3	-33	176	-71	177.2	-175.2	179.7	0.8	113.7	I485 L487 N492	I485-R489 WeakPolarHBondContact O-CG 3.17Å; I485-R489 PolarHBondContact O-N 3.32Å; I485-R489 VanDerWaalsContact O-N 3.08Å; L487-R489 VanDerWaalsContact C-N 3.34Å; L487-R489 PolarHBondContact O-N 3.19Å; R489-N492 PolarHBondContact O-OD1 3.09Å
490	T	94.1	Very high	95.1	Very high	75 Å²	75	40 Å²	40	46%	0.46	20%	0.195	S	C	.	.	H	α-helix	trans	-79.9	-33.4	-177.4	-53.5	0	0	0	0	111.6	K486 L487 A488	K486-T490 WeakPolarHBondContact O-CB 3.13Å; K486-T490 PolarHBondContact O-N 2.99Å; K486-T490 VanDerWaalsContact O-N 3.1Å; K486-T490 PolarHBondContact O-OG1 2.95Å; L487-T490 PolarHBondContact O-N 2.98Å; L487-T490 VanDerWaalsContact O-N 3.12Å; A488-T490 PolarHBondContact O-N 3.41Å
491	M	91.6	Very high	94.6	Very high	27 Å²	27	42.7 Å²	42.7	13%	0.133	22%	0.218	C	C	.	.	H	α-helix	trans	-106.2	-0.7	-175.8	-70.7	-178.4	-82.9	0	0	114.3	L487 F493 W789 N792 V793	L487-M491 HydrophobicContact CB-CE 3.6Å; L487-M491 HydrophobicContact CD2-CE 3.65Å; L487-M491 HydrophobicContact CG-CE 4.13Å; L487-M491 WeakPolarHBondContact O-CB 3.34Å; L487-M491 PolarHBondContact O-N 3.21Å; M491-F493 HydrophobicContact CB-CD1 3.76Å; M491-F493 HydrophobicContact CB-CE1 4.07Å; M491-F493 HydrophobicContact CE-CD1 4.48Å; M491-F493 HydrophobicContact CE-CE1 3.71Å; M491-F493 PolarHBondContact O-N 2.74Å; M491-W789 HydrophobicContact CB-CZ3 4.22Å; M491-W789 HydrophobicContact SD-CE3 4.33Å; M491-N792 HydrophobicContact CG-CB 4.4Å; M491-N792 HydrophobicContact SD-CB 3.7Å; M491-V793 HydrophobicContact CE-CG2 3.8Å; M491-V793 HydrophobicContact SD-CG2 3.96Å
492	N	93.1	Very high	94	Very high	141 Å²	141	45.2 Å²	45.2	75%	0.754	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	46	179.3	-64.9	-23.6	0	0	0	114.5	A488 R489	A488-N492 VanDerWaalsContact O-CA 3.32Å; A488-N492 WeakPolarHBondContact O-CA 3.24Å; A488-N492 PolarHBondContact O-N 3.35Å; R489-N492 PolarHBondContact O-OD1 3.09Å
493	F	93.6	Very high	93.5	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.035	25%	0.252	C	S	.	.			trans	-109.9	153	170.5	68.7	-102.1	0	0	0	111.3	T417 L419 L484 L487 A488 M491 Y495 W789	T417-F493 WeakPolarHBondContact O-CA 3.38Å; T417-F493 WeakPolarHBondContact O-CB 3.43Å; L419-F493 HydrophobicContact CD1-CB 4.44Å; L419-F493 HydrophobicContact CD1-CD1 4.4Å; L419-F493 HydrophobicContact CD1-CD2 3.85Å; L419-F493 HydrophobicContact CD1-CE2 4.16Å; L419-F493 HydrophobicContact CD1-CG 3.99Å; L419-F493 HydrophobicContact CG-CD2 4.42Å; L484-F493 HydrophobicContact CD1-CE2 4.09Å; L484-F493 HydrophobicContact CD1-CZ 4.11Å; L487-F493 HydrophobicContact CB-CE1 4.31Å; L487-F493 HydrophobicContact CB-CZ 4.23Å; A488-F493 HydrophobicContact CB-CD2 4.17Å; A488-F493 HydrophobicContact CB-CE1 4.4Å; A488-F493 HydrophobicContact CB-CE2 3.77Å; A488-F493 HydrophobicContact CB-CZ 3.89Å; A488-F493 PolarHBondContact O-N 2.93Å; M491-F493 HydrophobicContact CB-CD1 3.76Å; M491-F493 HydrophobicContact CB-CE1 4.07Å; M491-F493 HydrophobicContact CE-CD1 4.48Å; M491-F493 HydrophobicContact CE-CE1 3.71Å; M491-F493 PolarHBondContact O-N 2.74Å; F493-Y495 HydrophobicContact CD2-CD1 4.34Å; F493-Y495 AromaticContact CE2-CD1 3.98Å; F493-Y495 HydrophobicContact CE2-CD1 3.98Å; F493-Y495 HydrophobicContact CE2-CG 4.47Å; F493-W789 HydrophobicContact CB-CH2 4.05Å; F493-W789 HydrophobicContact CB-CZ2 4.36Å; F493-W789 HydrophobicContact CD1-CZ3 4.37Å
494	T	95.1	Very high	93.2	Very high	83 Å²	83	49.5 Å²	49.5	51%	0.509	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	154.4	169.7	58.3	0	0	0	0	109.6	T417 R418 L419	T417-T494 PolarHBondContact O-N 3.41Å; T417-T494 PolarHBondContact O-OG1 2.78Å; R418-T494 WeakPolarHBondContact CA-O 3.37Å; R418-T494 WeakPolarHBondContact CA-OG1 3.33Å; L419-T494 PolarHBondContact N-O 2.91Å
495	Y	95.3	Very high	92.8	Very high	66 Å²	66	50.5 Å²	50.5	26%	0.259	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	154.4	-173.8	58.8	-94.9	0	0	0	111.8	L419 V455 L484 I485 A488 F493 V497	L419-Y495 VanDerWaalsContact O-CA 3.3Å; L419-Y495 WeakPolarHBondContact O-CA 3.4Å; V455-Y495 HydrophobicContact CG1-CE2 4.08Å; L484-Y495 HydrophobicContact CD2-CD2 3.89Å; L484-Y495 HydrophobicContact CD2-CE2 4.01Å; L484-Y495 HydrophobicContact CD2-CG 4.26Å; L484-Y495 HydrophobicContact CG-CD1 4.44Å; L484-Y495 HydrophobicContact CG-CD2 4.45Å; L484-Y495 HydrophobicContact CG-CE1 4.47Å; L484-Y495 HydrophobicContact CG-CE2 4.49Å; L484-Y495 HydrophobicContact CG-CG 4.44Å; I485-Y495 WeakPolarHBondContact CG1-OH 3.35Å; A488-Y495 HydrophobicContact CB-CD1 3.65Å; A488-Y495 HydrophobicContact CB-CE1 3.53Å; F493-Y495 HydrophobicContact CD2-CD1 4.34Å; F493-Y495 AromaticContact CE2-CD1 3.98Å; F493-Y495 HydrophobicContact CE2-CD1 3.98Å; F493-Y495 HydrophobicContact CE2-CG 4.47Å; Y495-V497 HydrophobicContact CD2-CG2 3.72Å; Y495-V497 HydrophobicContact CE2-CG2 4.02Å
496	E	94.8	Very high	92.4	Very high	89 Å²	89	49.9 Å²	49.9	42%	0.416	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.2	166.8	-65.6	-174.2	133	0	0	108.2	R418 L419 I421	R418-E496 IonicContact CZ-OE1 3.52Å; R418-E496 IonicContact CZ-OE2 3.85Å; R418-E496 VanDerWaalsContact CZ-OE2 3.24Å; R418-E496 VanDerWaalsContact NE-CD 3.28Å; R418-E496 IonicContact NE-OE1 3.84Å; R418-E496 IonicContact NE-OE2 3.16Å; R418-E496 PolarHBondContact NE-OE2 3.18Å; R418-E496 IonicContact NH2-OE1 2.81Å; R418-E496 PolarHBondContact NH2-OE1 3.38Å; R418-E496 IonicContact NH2-OE2 3.16Å; R418-E496 PolarHBondContact NH2-OE2 2.64Å; L419-E496 PolarHBondContact O-N 3.12Å; I421-E496 PolarHBondContact N-O 2.95Å
497	V	95.8	Very high	92	Very high	8 Å²	8	46.5 Å²	46.5	5%	0.048	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.5	-176.5	-172.3	0	0	0	0	109.1	I421 T423 V455 C457 T458 L484 Y495	I421-V497 HydrophobicContact CB-CG2 4.39Å; I421-V497 WeakPolarHBondContact O-CA 3.37Å; T423-V497 HydrophobicContact CG2-CG1 3.81Å; V455-V497 HydrophobicContact CG2-CB 4.49Å; V455-V497 HydrophobicContact CG2-CG2 4.11Å; C457-V497 WeakPolarHBondContact CA-O 3.39Å; C457-V497 HydrophobicContact CB-CB 4.19Å; C457-V497 HydrophobicContact CB-CG1 4.06Å; T458-V497 PolarHBondContact N-O 2.96Å; L484-V497 HydrophobicContact CD2-CG2 3.8Å; Y495-V497 HydrophobicContact CD2-CG2 3.72Å; Y495-V497 HydrophobicContact CE2-CG2 4.02Å
498	H	95.1	Very high	91.6	Very high	34 Å²	34	47.9 Å²	47.9	16%	0.157	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	150.5	168	70.5	-89.7	0	0	0	110.9	I421 V422 T423 T458 E525	I421-H498 PolarHBondContact O-N 3.32Å; V422-H498 WeakPolarHBondContact CA-O 3.35Å; T423-H498 PolarHBondContact N-O 2.98Å; T458-H498 CarbonylContact O-C 3.49Å; T458-H498 VanDerWaalsContact O-CA 3.23Å; T458-H498 WeakPolarHBondContact O-CA 3.33Å; T458-H498 WeakPolarHBondContact O-CB 3.5Å; T458-H498 VanDerWaalsContact OG1-CB 3.27Å; T458-H498 WeakPolarHBondContact OG1-CB 3.36Å; H498-E525 IonicContact CD2-OE2 2.67Å; H498-E525 IonicContact CE1-OE2 2.93Å; H498-E525 IonicContact NE2-OE2 2.75Å; H498-E525 PolarHBondContact NE2-OE2 3.41Å
499	L	93.9	Very high	90.9	Very high	17 Å²	17	50.9 Å²	50.9	9%	0.089	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	140.5	173.1	-68.6	167.8	0	0	0	109.1	T423 V432 T458	T423-L499 HydrophobicContact CG2-CD2 3.68Å; T423-L499 WeakPolarHBondContact O-CA 3.32Å; V432-L499 HydrophobicContact CG1-CD1 3.93Å; V432-L499 HydrophobicContact CG2-CD1 3.76Å; V432-L499 HydrophobicContact CG2-CD2 4.05Å; T458-L499 PolarHBondContact O-N 2.82Å
500	V	92.9	Very high	90.3	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.024	27%	0.27	C	S	.	.			trans	-54.5	137.3	176.2	63.6	0	0	0	0	111.7	V422 T423 I424 D502 M522 E525	V422-V500 HydrophobicContact CG2-CB 4.07Å; T423-V500 PolarHBondContact O-N 3.18Å; I424-V500 HydrophobicContact CB-CG1 4.11Å; I424-V500 HydrophobicContact CD1-CG1 4.29Å; I424-V500 HydrophobicContact CG1-CG1 3.97Å; V500-D502 WeakPolarHBondContact CG2-OD1 3.44Å; V500-D502 PolarHBondContact O-N 3.4Å; V500-M522 HydrophobicContact CB-CG 3.65Å; V500-M522 HydrophobicContact CG1-CG 4.04Å; V500-M522 HydrophobicContact CG2-CB 4.45Å; V500-M522 HydrophobicContact CG2-CG 3.78Å; V500-E525 WeakPolarHBondContact CA-OE1 3.31Å; V500-E525 WeakPolarHBondContact CG2-OE1 3.49Å
501	A	86.4	Confident	89.5	Confident	58 Å²	58	50 Å²	50	48%	0.479	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-31.3	-171.6	0	0	0	0	0	114.2	R469 E525	R469-A501 PolarHBondContact NH1-O 3.18Å; A501-E525 PolarHBondContact N-OE1 3.25Å
502	D	84.2	Confident	88.4	Confident	54 Å²	54	55.9 Å²	55.9	29%	0.289	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-6.5	-174.7	67.9	-0.6	0	0	0	114.3	V500 K504 G521	V500-D502 WeakPolarHBondContact CG2-OD1 3.44Å; V500-D502 PolarHBondContact O-N 3.4Å; D502-K504 VanDerWaalsContact C-N 3.33Å; D502-K504 PolarHBondContact OD1-N 3.07Å; D502-G521 WeakPolarHBondContact OD1-CA 3.39Å; D502-G521 WeakPolarHBondContact OD2-CA 3.46Å; D502-G521 PolarHBondContact OD2-N 3.42Å
503	G	85.8	Confident	87.4	Confident	49 Å²	49	57.3 Å²	57.3	51%	0.505	30%	0.302	S	S	.	.	S	Bend	trans	73	17.8	-177.4	0	0	0	0	0	114.6	I424	I424-G503 WeakPolarHBondContact CD1-O 3.29Å
504	K	88.8	Confident	86.5	Confident	54 Å²	54	59 Å²	59	24%	0.235	32%	0.315	C	S	.	.			trans	-119.8	151.3	-173.4	-63.2	-180	176.3	176.3	0	113.2	D502 G521 M522 Q707	D502-K504 VanDerWaalsContact C-N 3.33Å; D502-K504 PolarHBondContact OD1-N 3.07Å; K504-G521 VanDerWaalsContact O-CA 3.23Å; K504-G521 WeakPolarHBondContact O-CA 3.46Å; K504-M522 PolarHBondContact O-N 2.97Å; K504-M522 VanDerWaalsContact O-N 3.11Å; K504-Q707 VanDerWaalsContact CE-OE1 3.31Å; K504-Q707 VanDerWaalsContact NZ-CD 3.27Å
505	F	88.8	Confident	85.6	Confident	23 Å²	23	62.4 Å²	62.4	10%	0.101	33%	0.33	C	S	.	.			trans	-68.8	-34.9	177.7	-69.4	-87.9	0	0	0	113.2	I424 Q426 M522 P537 L538 W752	I424-F505 HydrophobicContact CD1-CD1 4.36Å; I424-F505 HydrophobicContact CD1-CD2 4.03Å; I424-F505 HydrophobicContact CD1-CE1 4.34Å; I424-F505 HydrophobicContact CD1-CE2 4.01Å; I424-F505 HydrophobicContact CD1-CG 4.21Å; I424-F505 HydrophobicContact CD1-CZ 4.16Å; I424-F505 HydrophobicContact CG2-CD1 4.35Å; I424-F505 HydrophobicContact CG2-CE1 3.85Å; I424-F505 HydrophobicContact CG2-CZ 4.25Å; Q426-F505 HydrophobicContact CG-CZ 4.49Å; F505-M522 HydrophobicContact CB-CE 4.32Å; F505-M522 HydrophobicContact CD1-CE 3.54Å; F505-M522 HydrophobicContact CE1-CE 4.19Å; F505-M522 HydrophobicContact CG-CE 4.2Å; F505-P537 HydrophobicContact CE1-CG 4.34Å; F505-P537 WeakPolarHBondContact CE1-O 3.46Å; F505-L538 HydrophobicContact CD1-CD1 4.49Å; F505-W752 HydrophobicContact CE2-CZ2 4.37Å
506	G	88.4	Confident	84.6	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.348	C	S	.	.			trans	111.3	121.2	178.9	0	0	0	0	0	113.8	N520 R544	G506-N520 WeakPolarHBondContact CA-O 3.5Å; G506-N520 WeakPolarHBondContact CA-OD1 3.39Å; G506-R544 PolarHBondContact O-NE 2.72Å; G506-R544 PolarHBondContact O-NH2 3.05Å
507	T	88.1	Confident	83.9	Confident	4 Å²	4	68 Å²	68	3%	0.025	35%	0.354	C	S	.	.			trans	-137.4	159.6	178.2	66	0	0	0	0	109.7	E509 N520 Q707 I712	T507-E509 PolarHBondContact O-N 2.91Å; T507-N520 PolarHBondContact N-OD1 3.17Å; T507-N520 PolarHBondContact O-N 2.97Å; T507-N520 PolarHBondContact O-OD1 2.97Å; T507-N520 VanDerWaalsContact O-OD1 3.11Å; T507-Q707 VanDerWaalsContact CG2-C 3.43Å; T507-Q707 HydrophobicContact CG2-CB 4.16Å; T507-Q707 WeakPolarHBondContact CG2-O 3.44Å; T507-I712 HydrophobicContact CG2-CD1 3.53Å; T507-I712 HydrophobicContact CG2-CG1 4.13Å
508	Q	86.6	Confident	83.5	Confident	30 Å²	30	72.6 Å²	72.6	14%	0.14	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	121.3	175.7	-68.8	-173	-7.1	0	0	110.4	E518 W519 Y547	Q508-E518 WeakPolarHBondContact CA-O 3.49Å; Q508-W519 HydrophobicContact CG-CD2 3.73Å; Q508-W519 HydrophobicContact CG-CE3 3.93Å; Q508-W519 HydrophobicContact CG-CG 4.44Å; Q508-W519 HydrophobicContact CG-CH2 3.75Å; Q508-W519 HydrophobicContact CG-CZ2 3.54Å; Q508-W519 HydrophobicContact CG-CZ3 3.94Å; Q508-Y547 VanDerWaalsContact NE2-CE2 3.27Å; Q508-Y547 PolarHBondContact NE2-OH 2.96Å
509	E	82.9	Confident	83.2	Confident	72 Å²	72	72.5 Å²	72.5	34%	0.336	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	151.1	174.1	-65	-168.2	135	0	0	110.8	T507 K517 E518 N520 Q707	T507-E509 PolarHBondContact O-N 2.91Å; E509-K517 WeakPolarHBondContact O-CA 3.42Å; E509-E518 PolarHBondContact N-O 3.2Å; E509-E518 PolarHBondContact O-N 3.44Å; E509-N520 PolarHBondContact OE2-ND2 3.18Å; E509-Q707 PolarHBondContact OE1-NE2 3.47Å; E509-Q707 PolarHBondContact OE1-OE1 2.84Å
510	R	80.8	Confident	83.1	Confident	181 Å²	181	72.8 Å²	72.8	68%	0.683	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	120.9	171.7	-70.6	-179	177.7	150.9	-2.4	108.3
511	V	77.8	Confident	83	Confident	47 Å²	47	72.8 Å²	72.8	29%	0.285	38%	0.376	S	S	.	.			trans	-94.1	134.1	-178.7	-177.1	0	0	0	0	109.9	N513 S514 K516 E518	V511-N513 PolarHBondContact O-N 3.41Å; V511-S514 WeakPolarHBondContact O-CB 3.4Å; V511-S514 PolarHBondContact O-N 3.06Å; V511-S514 PolarHBondContact O-OG 3.04Å; V511-K516 PolarHBondContact N-O 2.91Å; V511-E518 HydrophobicContact CG2-CB 3.81Å; V511-E518 HydrophobicContact CG2-CG 4.06Å
512	N	69.1	Low	83.3	Confident	152 Å²	152	70 Å²	70	81%	0.813	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	41.6	173.4	-63.4	-22.1	0	0	0	115.5	S514	N512-S514 PolarHBondContact O-N 3.27Å
513	N	70.7	Confident	83.7	Confident	171 Å²	171	67.5 Å²	67.5	91%	0.914	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	15.7	-175.7	-70.5	-19.8	0	0	0	114.5	V511	V511-N513 PolarHBondContact O-N 3.41Å
514	S	74.5	Confident	84	Confident	43 Å²	43	65.9 Å²	65.9	30%	0.301	32%	0.323	S	S	.	.	S	Bend	trans	-85.3	160.3	175.4	77.5	0	0	0	0	110	V511 N512 K516	V511-S514 WeakPolarHBondContact O-CB 3.4Å; V511-S514 PolarHBondContact O-N 3.06Å; V511-S514 PolarHBondContact O-OG 3.04Å; N512-S514 PolarHBondContact O-N 3.27Å; S514-K516 PolarHBondContact O-N 3.09Å; S514-K516 WeakPolarHBondContact OG-CB 3.44Å; S514-K516 PolarHBondContact OG-N 3.13Å
515	N	76.5	Confident	84.2	Confident	155 Å²	155	64.2 Å²	64.2	83%	0.829	32%	0.316	S	S	*	.	S	Bend	trans	-72.9	0	171.8	-75.4	-28	0	0	0	112.9	K517	N515-K517 PolarHBondContact O-N 2.89Å
516	K	75.7	Confident	84.4	Confident	147 Å²	147	63.1 Å²	63.1	64%	0.639	31%	0.311	S	S	*	.			trans	-74.9	123.6	176.8	-65.2	-175	177.5	-177.7	0	109.3	V511 S514	V511-K516 PolarHBondContact N-O 2.91Å; S514-K516 PolarHBondContact O-N 3.09Å; S514-K516 WeakPolarHBondContact OG-CB 3.44Å; S514-K516 PolarHBondContact OG-N 3.13Å
517	K	80.1	Confident	84.5	Confident	126 Å²	126	66.4 Å²	66.4	55%	0.548	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121.3	171.3	-64.4	-175.3	-179	-178.4	0	108	E509 N515	E509-K517 WeakPolarHBondContact O-CA 3.42Å; N515-K517 PolarHBondContact O-N 2.89Å
518	E	86.6	Confident	84.4	Confident	104 Å²	104	69 Å²	69	49%	0.486	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	152.6	174.4	-65.2	-178.3	-179.5	0	0	109.4	Q508 E509 V511	Q508-E518 WeakPolarHBondContact CA-O 3.49Å; E509-E518 PolarHBondContact N-O 3.2Å; E509-E518 PolarHBondContact O-N 3.44Å; V511-E518 HydrophobicContact CG2-CB 3.81Å; V511-E518 HydrophobicContact CG2-CG 4.06Å
519	W	89.6	Confident	84.3	Confident	32 Å²	32	68.8 Å²	68.8	12%	0.121	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	125.2	177.1	-75.2	98.7	0	0	0	109.1	Q508 M523 G524 L527 E543 R544 Y547	Q508-W519 HydrophobicContact CG-CD2 3.73Å; Q508-W519 HydrophobicContact CG-CE3 3.93Å; Q508-W519 HydrophobicContact CG-CG 4.44Å; Q508-W519 HydrophobicContact CG-CH2 3.75Å; Q508-W519 HydrophobicContact CG-CZ2 3.54Å; Q508-W519 HydrophobicContact CG-CZ3 3.94Å; W519-M523 HydrophobicContact CB-CB 4.4Å; W519-M523 HydrophobicContact CD2-CB 4.34Å; W519-M523 HydrophobicContact CD2-CE 4.45Å; W519-M523 HydrophobicContact CE3-CB 3.84Å; W519-M523 HydrophobicContact CE3-CE 4.34Å; W519-M523 HydrophobicContact CE3-CG 4.21Å; W519-M523 HydrophobicContact CH2-CE 4.45Å; W519-M523 HydrophobicContact CZ3-CB 4.48Å; W519-M523 HydrophobicContact CZ3-CE 4.35Å; W519-M523 HydrophobicContact CZ3-CG 4.36Å; W519-G524 VanDerWaalsContact O-CA 3.25Å; W519-G524 WeakPolarHBondContact O-CA 3.34Å; W519-L527 HydrophobicContact CB-CD1 4.06Å; W519-L527 HydrophobicContact CD2-CD1 4.42Å; W519-L527 HydrophobicContact CG-CD1 3.67Å; W519-E543 HydrophobicContact CH2-CB 4.46Å; W519-R544 HydrophobicContact CH2-CB 4.49Å; W519-R544 HydrophobicContact CH2-CG 3.74Å; W519-R544 HydrophobicContact CZ3-CG 3.94Å; W519-Y547 AromaticContact CE2-CD2 3.92Å; W519-Y547 AromaticContact CZ2-CD2 3.55Å; W519-Y547 HydrophobicContact CZ2-CD2 3.55Å; W519-Y547 AromaticContact CZ2-CE2 3.83Å; W519-Y547 HydrophobicContact CZ2-CE2 3.83Å; W519-Y547 HydrophobicContact CZ2-CG 4.26Å; W519-Y547 AromaticContact NE1-CD1 3.81Å; W519-Y547 AromaticContact NE1-CD2 3.71Å; W519-Y547 AromaticContact NE1-CE2 3.93Å; W519-Y547 AromaticContact NE1-CG 3.65Å
520	N	90	Very high	84.6	Confident	23 Å²	23	70.9 Å²	70.9	12%	0.123	36%	0.362	C	S	.	.			trans	-91.3	-176.6	167.9	71.2	7	0	0	0	111.1	G506 T507 E509 G524 Q707	G506-N520 WeakPolarHBondContact CA-O 3.5Å; G506-N520 WeakPolarHBondContact CA-OD1 3.39Å; T507-N520 PolarHBondContact N-OD1 3.17Å; T507-N520 PolarHBondContact O-N 2.97Å; T507-N520 PolarHBondContact O-OD1 2.97Å; T507-N520 VanDerWaalsContact O-OD1 3.11Å; E509-N520 PolarHBondContact OE2-ND2 3.18Å; N520-G524 PolarHBondContact O-N 3.11Å; N520-G524 VanDerWaalsContact O-N 3.11Å; N520-Q707 PolarHBondContact ND2-OE1 3.21Å
521	G	90.8	Very high	85.1	Confident	4 Å²	4	62.2 Å²	62.2	4%	0.041	33%	0.33	C	S	.	.	H	α-helix	trans	64.9	-161.3	174.6	0	0	0	0	0	115.7	D502 K504 M523 G524 E525	D502-G521 WeakPolarHBondContact OD1-CA 3.39Å; D502-G521 WeakPolarHBondContact OD2-CA 3.46Å; D502-G521 PolarHBondContact OD2-N 3.42Å; K504-G521 VanDerWaalsContact O-CA 3.23Å; K504-G521 WeakPolarHBondContact O-CA 3.46Å; G521-M523 PolarHBondContact O-N 3.13Å; G521-M523 VanDerWaalsContact O-N 3.14Å; G521-G524 PolarHBondContact O-N 3.49Å; G521-E525 PolarHBondContact O-N 2.89Å
522	M	93.1	Very high	85.8	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-54.4	-34	175.9	-67.7	-171.7	-73.2	0	0	112.6	V422 I424 V500 K504 F505 E525 L526 I534 A536	V422-M522 HydrophobicContact CG1-CB 4.33Å; V422-M522 HydrophobicContact CG1-CG 4.49Å; V422-M522 HydrophobicContact CG2-CG 4.01Å; I424-M522 HydrophobicContact CB-CE 3.78Å; I424-M522 HydrophobicContact CB-SD 3.75Å; I424-M522 HydrophobicContact CD1-CE 4.3Å; I424-M522 HydrophobicContact CG2-CE 3.51Å; I424-M522 HydrophobicContact CG2-SD 3.93Å; V500-M522 HydrophobicContact CB-CG 3.65Å; V500-M522 HydrophobicContact CG1-CG 4.04Å; V500-M522 HydrophobicContact CG2-CB 4.45Å; V500-M522 HydrophobicContact CG2-CG 3.78Å; K504-M522 PolarHBondContact O-N 2.97Å; K504-M522 VanDerWaalsContact O-N 3.11Å; F505-M522 HydrophobicContact CB-CE 4.32Å; F505-M522 HydrophobicContact CD1-CE 3.54Å; F505-M522 HydrophobicContact CE1-CE 4.19Å; F505-M522 HydrophobicContact CG-CE 4.2Å; M522-E525 PolarHBondContact O-N 2.92Å; M522-L526 WeakPolarHBondContact O-CB 3.44Å; M522-L526 PolarHBondContact O-N 2.63Å; M522-I534 HydrophobicContact CB-CD1 4.17Å; M522-I534 HydrophobicContact CB-CG2 4.47Å; M522-I534 HydrophobicContact CE-CG2 4.47Å; M522-I534 HydrophobicContact SD-CG2 3.91Å; M522-A536 HydrophobicContact CE-CB 3.88Å; M522-A536 HydrophobicContact SD-CB 3.85Å
523	M	93.5	Very high	87	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.1	-41.5	175.6	-73.8	-68	-53.4	0	0	112.4	W519 G521 L527 I534 L538 R544 I548	W519-M523 HydrophobicContact CB-CB 4.4Å; W519-M523 HydrophobicContact CD2-CB 4.34Å; W519-M523 HydrophobicContact CD2-CE 4.45Å; W519-M523 HydrophobicContact CE3-CB 3.84Å; W519-M523 HydrophobicContact CE3-CE 4.34Å; W519-M523 HydrophobicContact CE3-CG 4.21Å; W519-M523 HydrophobicContact CH2-CE 4.45Å; W519-M523 HydrophobicContact CZ3-CB 4.48Å; W519-M523 HydrophobicContact CZ3-CE 4.35Å; W519-M523 HydrophobicContact CZ3-CG 4.36Å; G521-M523 PolarHBondContact O-N 3.13Å; G521-M523 VanDerWaalsContact O-N 3.14Å; M523-L527 WeakPolarHBondContact O-CG 3.38Å; M523-L527 PolarHBondContact O-N 3.49Å; M523-L527 VanDerWaalsContact O-N 3.1Å; M523-I534 HydrophobicContact SD-CD1 4.32Å; M523-L538 HydrophobicContact SD-CD2 4.35Å; M523-R544 HydrophobicContact CE-CB 3.82Å; M523-R544 HydrophobicContact CE-CG 3.78Å; M523-R544 HydrophobicContact CG-CG 4.31Å; M523-R544 HydrophobicContact SD-CB 4.13Å; M523-R544 HydrophobicContact SD-CG 3.84Å; M523-I548 HydrophobicContact CE-CB 4.37Å; M523-I548 HydrophobicContact CE-CD1 3.85Å; M523-I548 HydrophobicContact CE-CG1 3.88Å; M523-I548 HydrophobicContact CE-CG2 3.6Å; M523-I548 HydrophobicContact SD-CD1 3.51Å; M523-I548 VanDerWaalsContact SD-CD1 3.51Å; M523-I548 HydrophobicContact SD-CG1 4.22Å; M523-I548 HydrophobicContact SD-CG2 4.42Å
524	G	92.3	Very high	88.3	Confident	16 Å²	16	46.2 Å²	46.2	17%	0.165	24%	0.242	C	C	.	.	H	α-helix	trans	-65.9	-42.6	176.6	0	0	0	0	0	112.5	W519 N520 G521 L526 L527 S528	W519-G524 VanDerWaalsContact O-CA 3.25Å; W519-G524 WeakPolarHBondContact O-CA 3.34Å; N520-G524 PolarHBondContact O-N 3.11Å; N520-G524 VanDerWaalsContact O-N 3.11Å; G521-G524 PolarHBondContact O-N 3.49Å; G524-L526 PolarHBondContact O-N 3.23Å; G524-L527 PolarHBondContact O-N 3.28Å; G524-S528 WeakPolarHBondContact O-CB 3.39Å; G524-S528 PolarHBondContact O-N 2.79Å; G524-S528 PolarHBondContact O-OG 3.11Å
525	E	92.7	Very high	89.4	Confident	18 Å²	18	44.2 Å²	44.2	8%	0.084	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-39	176.7	-68.4	-170.1	-157.1	0	0	112.5	V422 H498 V500 A501 G521 M522 S528 G529 Q530 A531	V422-E525 WeakPolarHBondContact CG2-OE2 3.43Å; H498-E525 IonicContact CD2-OE2 2.67Å; H498-E525 IonicContact CE1-OE2 2.93Å; H498-E525 IonicContact NE2-OE2 2.75Å; H498-E525 PolarHBondContact NE2-OE2 3.41Å; V500-E525 WeakPolarHBondContact CA-OE1 3.31Å; V500-E525 WeakPolarHBondContact CG2-OE1 3.49Å; A501-E525 PolarHBondContact N-OE1 3.25Å; G521-E525 PolarHBondContact O-N 2.89Å; M522-E525 PolarHBondContact O-N 2.92Å; E525-S528 WeakPolarHBondContact CA-OG 3.41Å; E525-S528 PolarHBondContact O-OG 3.21Å; E525-G529 PolarHBondContact O-N 3.11Å; E525-Q530 HydrophobicContact CB-CB 4.35Å; E525-Q530 PolarHBondContact O-N 3.25Å; E525-A531 PolarHBondContact O-N 2.95Å
526	L	93.3	Very high	90.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.1	-42.2	175.2	-179.9	66.6	0	0	0	112	M522 G524 G529 A531 D532 I534 I548 R784	M522-L526 WeakPolarHBondContact O-CB 3.44Å; M522-L526 PolarHBondContact O-N 2.63Å; G524-L526 PolarHBondContact O-N 3.23Å; L526-G529 PolarHBondContact O-N 3.15Å; L526-A531 WeakPolarHBondContact CD1-O 3.49Å; L526-D532 WeakPolarHBondContact CD1-O 3.23Å; L526-I534 HydrophobicContact CB-CD1 3.85Å; L526-I534 HydrophobicContact CB-CG1 4.07Å; L526-I534 HydrophobicContact CD1-CG1 4.42Å; L526-I534 HydrophobicContact CD2-CD1 3.48Å; L526-I534 VanDerWaalsContact CD2-CD1 3.48Å; L526-I534 HydrophobicContact CD2-CG1 3.86Å; L526-I534 HydrophobicContact CG-CD1 4.21Å; L526-I534 HydrophobicContact CG-CG1 4.34Å; L526-I548 HydrophobicContact CD2-CB 4.17Å; L526-I548 HydrophobicContact CD2-CD1 4.22Å; L526-I548 HydrophobicContact CD2-CG2 3.68Å; L526-R784 HydrophobicContact CD1-CG 3.87Å; L526-R784 HydrophobicContact CG-CG 4.08Å; L526-R784 WeakPolarHBondContact O-CD 3.36Å; L526-R784 WeakPolarHBondContact O-CG 3.39Å
527	L	90.6	Very high	91.3	Very high	69 Å²	69	30 Å²	30	36%	0.361	16%	0.159	S	C	.	.	H	α-helix	trans	-74.7	-31	-178.7	-70.8	174.3	0	0	0	113	W519 M523 G524 G529 I548	W519-L527 HydrophobicContact CB-CD1 4.06Å; W519-L527 HydrophobicContact CD2-CD1 4.42Å; W519-L527 HydrophobicContact CG-CD1 3.67Å; M523-L527 WeakPolarHBondContact O-CG 3.38Å; M523-L527 PolarHBondContact O-N 3.49Å; M523-L527 VanDerWaalsContact O-N 3.1Å; G524-L527 PolarHBondContact O-N 3.28Å; L527-G529 PolarHBondContact O-N 3.22Å; L527-I548 HydrophobicContact CD2-CG2 3.88Å; L527-I548 HydrophobicContact CG-CG2 4.33Å
528	S	85.6	Confident	92	Very high	59 Å²	59	24 Å²	24	41%	0.413	13%	0.133	S	C	.	.	H	α-helix	trans	-73.7	-13.3	173.5	56.8	0	0	0	0	113.3	G524 E525 Q530	G524-S528 WeakPolarHBondContact O-CB 3.39Å; G524-S528 PolarHBondContact O-N 2.79Å; G524-S528 PolarHBondContact O-OG 3.11Å; E525-S528 WeakPolarHBondContact CA-OG 3.41Å; E525-S528 PolarHBondContact O-OG 3.21Å; S528-Q530 VanDerWaalsContact C-N 3.34Å
529	G	84.9	Confident	92.4	Very high	25 Å²	25	19.1 Å²	19.1	26%	0.258	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	12.6	-177.5	0	0	0	0	0	113.9	E525 L526 L527 A531	E525-G529 PolarHBondContact O-N 3.11Å; L526-G529 PolarHBondContact O-N 3.15Å; L527-G529 PolarHBondContact O-N 3.22Å; G529-A531 VanDerWaalsContact C-N 3.28Å
530	Q	87.6	Confident	92.7	Very high	116 Å²	116	20 Å²	20	54%	0.542	12%	0.117	S	C	.	.	S	Bend	trans	-70	-30.4	170.8	-66.2	-178.8	7.7	0	0	111.4	K420 E525 S528	K420-Q530 WeakPolarHBondContact CD-O 3.49Å; E525-Q530 HydrophobicContact CB-CB 4.35Å; E525-Q530 PolarHBondContact O-N 3.25Å; S528-Q530 VanDerWaalsContact C-N 3.34Å
531	A	92.3	Very high	92.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.116	C	C	.	.			trans	-121.4	148.2	171.6	0	0	0	0	0	111.2	V422 E525 L526 G529	V422-A531 HydrophobicContact CB-CB 3.69Å; V422-A531 HydrophobicContact CG1-CB 3.53Å; E525-A531 PolarHBondContact O-N 2.95Å; L526-A531 WeakPolarHBondContact CD1-O 3.49Å; G529-A531 VanDerWaalsContact C-N 3.28Å
532	D	91.9	Very high	92.7	Very high	30 Å²	30	24.7 Å²	24.7	16%	0.16	14%	0.141	C	C	.	.	S	Bend	trans	-96.4	-30.1	176.9	-64.1	-51.2	0	0	0	112.4	L419 K420 L526 R784	L419-D532 HydrophobicContact CD2-CB 4.05Å; K420-D532 PolarHBondContact N-OD2 3.47Å; K420-D532 VanDerWaalsContact N-OD2 3.08Å; K420-D532 PolarHBondContact O-N 2.73Å; L526-D532 WeakPolarHBondContact CD1-O 3.23Å; D532-R784 IonicContact OD1-CZ 2.76Å; D532-R784 IonicContact OD1-NH2 2.82Å; D532-R784 PolarHBondContact OD1-NH2 2.84Å
533	M	95.3	Very high	92.5	Very high	3 Å²	3	27 Å²	27	2%	0.015	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	140.7	-177.3	-176.8	-176.7	-60.9	0	0	110.8	L419 K420 I421 V422 V535 I781 G782 M783 W789 V793	L419-M533 HydrophobicContact CD1-CE 4.11Å; K420-M533 PolarHBondContact O-N 3.16Å; I421-M533 WeakPolarHBondContact CA-O 3.49Å; I421-M533 HydrophobicContact CD1-CB 3.71Å; I421-M533 HydrophobicContact CD1-CG 4.26Å; I421-M533 HydrophobicContact CD1-SD 4.19Å; V422-M533 PolarHBondContact N-O 3.17Å; M533-V535 HydrophobicContact CG-CG2 4.04Å; M533-V535 HydrophobicContact SD-CG2 3.97Å; M533-I781 HydrophobicContact CG-CG2 3.48Å; M533-I781 VanDerWaalsContact CG-CG2 3.48Å; M533-I781 HydrophobicContact SD-CG2 3.66Å; M533-G782 CarbonylContact C-O 3.51Å; M533-G782 WeakPolarHBondContact CA-O 3.35Å; M533-M783 HydrophobicContact CB-CG 4.34Å; M533-M783 HydrophobicContact CE-CG 4.04Å; M533-M783 HydrophobicContact CE-SD 3.93Å; M533-M783 HydrophobicContact CG-CG 3.95Å; M533-W789 HydrophobicContact CE-CB 4.35Å; M533-V793 HydrophobicContact CE-CG2 3.94Å
534	I	97.8	Very high	92.4	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	119.6	173.5	-57.4	171.2	0	0	0	108.4	V422 M522 M523 L526 A536 L538 I781 G782	V422-I534 HydrophobicContact CG1-CB 4.21Å; V422-I534 HydrophobicContact CG1-CG1 3.57Å; V422-I534 HydrophobicContact CG1-CG2 4.42Å; M522-I534 HydrophobicContact CB-CD1 4.17Å; M522-I534 HydrophobicContact CB-CG2 4.47Å; M522-I534 HydrophobicContact CE-CG2 4.47Å; M522-I534 HydrophobicContact SD-CG2 3.91Å; M523-I534 HydrophobicContact SD-CD1 4.32Å; L526-I534 HydrophobicContact CB-CD1 3.85Å; L526-I534 HydrophobicContact CB-CG1 4.07Å; L526-I534 HydrophobicContact CD1-CG1 4.42Å; L526-I534 HydrophobicContact CD2-CD1 3.48Å; L526-I534 VanDerWaalsContact CD2-CD1 3.48Å; L526-I534 HydrophobicContact CD2-CG1 3.86Å; L526-I534 HydrophobicContact CG-CD1 4.21Å; L526-I534 HydrophobicContact CG-CG1 4.34Å; I534-A536 HydrophobicContact CG2-CB 4.06Å; I534-L538 HydrophobicContact CB-CD2 4.38Å; I534-L538 HydrophobicContact CD1-CD2 3.89Å; I534-L538 HydrophobicContact CG2-CB 4.47Å; I534-L538 HydrophobicContact CG2-CD2 4.04Å; I534-I781 WeakPolarHBondContact O-CG2 3.02Å; I534-G782 PolarHBondContact N-O 3.39Å; I534-G782 PolarHBondContact O-N 3.2Å; I534-G782 VanDerWaalsContact O-N 3.13Å
535	V	97.6	Very high	92.3	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.012	16%	0.16	C	C	.	.			trans	-120.4	92.9	172.3	-173.4	0	0	0	0	109	I421 V422 T423 C480 L484 M533 I781	I421-V535 HydrophobicContact CG2-CB 3.94Å; I421-V535 HydrophobicContact CG2-CG2 3.82Å; V422-V535 PolarHBondContact O-N 3.21Å; V422-V535 VanDerWaalsContact O-N 3.16Å; T423-V535 WeakPolarHBondContact CB-O 3.5Å; T423-V535 PolarHBondContact OG1-O 2.79Å; C480-V535 HydrophobicContact CB-CG1 4.16Å; L484-V535 HydrophobicContact CB-CG1 4.36Å; L484-V535 HydrophobicContact CD1-CG2 4.28Å; M533-V535 HydrophobicContact CG-CG2 4.04Å; M533-V535 HydrophobicContact SD-CG2 3.97Å; V535-I781 HydrophobicContact CG2-CG2 4.28Å
536	A	96.3	Very high	92.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-156.3	170.6	-175	0	0	0	0	0	109	I424 M522 I534 L538	I424-A536 HydrophobicContact CG2-CB 3.94Å; M522-A536 HydrophobicContact CE-CB 3.88Å; M522-A536 HydrophobicContact SD-CB 3.85Å; I534-A536 HydrophobicContact CG2-CB 4.06Å; A536-L538 PolarHBondContact O-N 3.45Å
537	P	95.4	Very high	91.9	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.013	20%	0.199	C	C	.	.			trans	-69.6	64.3	166.6	29.7	-34.6	0	0	0	111	Q426 F429 F505 F779	Q426-P537 HydrophobicContact CB-CG 3.95Å; Q426-P537 HydrophobicContact CG-CG 3.7Å; F429-P537 HydrophobicContact CB-CB 4.41Å; F429-P537 HydrophobicContact CB-CG 3.99Å; F429-P537 HydrophobicContact CD1-CB 4.46Å; F429-P537 HydrophobicContact CD2-CB 3.73Å; F429-P537 HydrophobicContact CD2-CG 3.87Å; F429-P537 HydrophobicContact CE2-CB 4.08Å; F429-P537 HydrophobicContact CG-CB 3.94Å; F429-P537 HydrophobicContact CG-CG 4.02Å; F505-P537 HydrophobicContact CE1-CG 4.34Å; F505-P537 WeakPolarHBondContact CE1-O 3.46Å; P537-F779 VanDerWaalsContact C-CD1 3.47Å; P537-F779 HydrophobicContact CB-CD1 4.13Å; P537-F779 HydrophobicContact CB-CD2 3.95Å; P537-F779 HydrophobicContact CB-CE1 4.02Å; P537-F779 HydrophobicContact CB-CE2 3.83Å; P537-F779 HydrophobicContact CB-CG 4.11Å; P537-F779 HydrophobicContact CB-CZ 3.88Å; P537-F779 WeakPolarHBondContact O-CE1 3.48Å
538	L	95.7	Very high	92	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.			trans	-89.2	112.8	-178.5	-176.5	68.3	0	0	0	110.1	F505 M523 I534 A536 I540 I548 F550 F779 G780	F505-L538 HydrophobicContact CD1-CD1 4.49Å; M523-L538 HydrophobicContact SD-CD2 4.35Å; I534-L538 HydrophobicContact CB-CD2 4.38Å; I534-L538 HydrophobicContact CD1-CD2 3.89Å; I534-L538 HydrophobicContact CG2-CB 4.47Å; I534-L538 HydrophobicContact CG2-CD2 4.04Å; A536-L538 PolarHBondContact O-N 3.45Å; L538-I540 PolarHBondContact O-N 3.34Å; L538-I548 HydrophobicContact CD2-CD1 4.28Å; L538-F550 HydrophobicContact CD2-CE1 3.7Å; L538-F550 HydrophobicContact CD2-CZ 4.3Å; L538-F550 HydrophobicContact CG-CE1 4.08Å; L538-F779 WeakPolarHBondContact O-CA 3.48Å; L538-G780 PolarHBondContact O-N 2.78Å; L538-G780 VanDerWaalsContact O-N 3.1Å
539	T	95.2	Very high	92.4	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.012	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-66.1	125.3	178.8	-48.4	0	0	0	0	111.8	N541 R544 S709 S777 F779	T539-N541 PolarHBondContact O-N 3Å; T539-R544 PolarHBondContact O-NH1 2.9Å; T539-R544 VanDerWaalsContact O-NH1 3.1Å; T539-S709 PolarHBondContact OG1-OG 2.94Å; T539-S777 WeakPolarHBondContact CG2-OG 2.97Å; T539-F779 WeakPolarHBondContact OG1-CE1 3.49Å
540	I	94.6	Very high	92.9	Very high	51 Å²	51	33.9 Å²	33.9	26%	0.262	17%	0.168	S	C	.	.			trans	-70.8	118.6	173.3	-61.6	161.5	0	0	0	108.7	L538 F550 P553 G778	L538-I540 PolarHBondContact O-N 3.34Å; I540-F550 HydrophobicContact CB-CG 4.5Å; I540-F550 HydrophobicContact CG1-CB 4.19Å; I540-F550 HydrophobicContact CG1-CD1 3.69Å; I540-F550 HydrophobicContact CG1-CD2 4.4Å; I540-F550 HydrophobicContact CG1-CE1 4.07Å; I540-F550 HydrophobicContact CG1-CG 3.86Å; I540-F550 HydrophobicContact CG2-CD2 4.01Å; I540-F550 HydrophobicContact CG2-CE2 4.31Å; I540-F550 HydrophobicContact CG2-CG 4.23Å; I540-P553 HydrophobicContact CD1-CB 3.98Å; I540-G778 WeakPolarHBondContact CG1-O 3.48Å; I540-G778 PolarHBondContact N-O 2.79Å
541	N	90.9	Very high	93.3	Very high	19 Å²	19	28.7 Å²	28.7	10%	0.102	15%	0.145	C	C	.	.			trans	-135.5	163.2	176.5	70.2	16.7	0	0	0	111.1	T539 E543 R544 A545	T539-N541 PolarHBondContact O-N 3Å; N541-E543 PolarHBondContact O-N 3.44Å; N541-R544 WeakPolarHBondContact OD1-CA 3.35Å; N541-R544 WeakPolarHBondContact OD1-CB 3.46Å; N541-R544 WeakPolarHBondContact OD1-CD 3.27Å; N541-R544 WeakPolarHBondContact OD1-CG 3.41Å; N541-R544 PolarHBondContact OD1-N 3.4Å; N541-A545 VanDerWaalsContact O-CB 3.27Å; N541-A545 WeakPolarHBondContact O-CB 3.15Å; N541-A545 PolarHBondContact O-N 2.88Å; N541-A545 VanDerWaalsContact O-N 3.1Å
542	N	90.1	Very high	93.5	Very high	107 Å²	107	34.2 Å²	34.2	57%	0.572	17%	0.169	S	C	*	.	H	α-helix	trans	-66.4	-37.1	-178.6	-169.3	20.3	0	0	0	112.3	A545 Q546	N542-A545 PolarHBondContact O-N 3.29Å; N542-Q546 WeakPolarHBondContact O-CG 3.44Å; N542-Q546 PolarHBondContact O-N 3.4Å
543	E	87.9	Confident	93.7	Very high	48 Å²	48	34 Å²	34	22%	0.224	17%	0.169	C	C	.	.	H	α-helix	trans	-64.5	-43.9	-178.4	-66.1	-177.4	-177.6	0	0	112.3	W519 N541 Y547 I712	W519-E543 HydrophobicContact CH2-CB 4.46Å; N541-E543 PolarHBondContact O-N 3.44Å; E543-Y547 VanDerWaalsContact O-CD2 3.26Å; E543-Y547 WeakPolarHBondContact O-CD2 3.36Å; E543-I712 WeakPolarHBondContact OE2-CG2 3.41Å
544	R	91.8	Very high	93.7	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-72.9	-38.2	177.1	-63.9	169.3	178.3	160.5	-5	111.2	G506 W519 M523 T539 N541 Q546 Y547 I548 F550	G506-R544 PolarHBondContact O-NE 2.72Å; G506-R544 PolarHBondContact O-NH2 3.05Å; W519-R544 HydrophobicContact CH2-CB 4.49Å; W519-R544 HydrophobicContact CH2-CG 3.74Å; W519-R544 HydrophobicContact CZ3-CG 3.94Å; M523-R544 HydrophobicContact CE-CB 3.82Å; M523-R544 HydrophobicContact CE-CG 3.78Å; M523-R544 HydrophobicContact CG-CG 4.31Å; M523-R544 HydrophobicContact SD-CB 4.13Å; M523-R544 HydrophobicContact SD-CG 3.84Å; T539-R544 PolarHBondContact O-NH1 2.9Å; T539-R544 VanDerWaalsContact O-NH1 3.1Å; N541-R544 WeakPolarHBondContact OD1-CA 3.35Å; N541-R544 WeakPolarHBondContact OD1-CB 3.46Å; N541-R544 WeakPolarHBondContact OD1-CD 3.27Å; N541-R544 WeakPolarHBondContact OD1-CG 3.41Å; N541-R544 PolarHBondContact OD1-N 3.4Å; R544-Q546 PolarHBondContact O-N 3.3Å; R544-Q546 VanDerWaalsContact O-N 3.11Å; R544-Y547 PolarHBondContact O-N 3.22Å; R544-I548 HydrophobicContact CB-CD1 4.48Å; R544-I548 HydrophobicContact CB-CG1 4.28Å; R544-I548 WeakPolarHBondContact O-CG1 3.47Å; R544-I548 PolarHBondContact O-N 3.22Å; R544-F550 HydrophobicContact CB-CE2 3.85Å; R544-F550 HydrophobicContact CB-CZ 3.78Å
545	A	90.8	Very high	93.6	Very high	41 Å²	41	35.6 Å²	35.6	34%	0.339	18%	0.176	S	C	.	.	H	α-helix	trans	-61.7	-20.3	179.3	0	0	0	0	0	113.4	N541 N542 Y547 F550	N541-A545 VanDerWaalsContact O-CB 3.27Å; N541-A545 WeakPolarHBondContact O-CB 3.15Å; N541-A545 PolarHBondContact O-N 2.88Å; N541-A545 VanDerWaalsContact O-N 3.1Å; N542-A545 PolarHBondContact O-N 3.29Å; A545-Y547 VanDerWaalsContact C-N 3.27Å; A545-Y547 PolarHBondContact O-N 3.19Å; A545-F550 HydrophobicContact CB-CD2 4.21Å; A545-F550 HydrophobicContact CB-CE2 4.21Å
546	Q	89	Confident	93.4	Very high	109 Å²	109	43.3 Å²	43.3	51%	0.509	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-20.3	171.4	-71.6	175.5	12.6	0	0	113.7	N542 R544 K785	N542-Q546 WeakPolarHBondContact O-CG 3.44Å; N542-Q546 PolarHBondContact O-N 3.4Å; R544-Q546 PolarHBondContact O-N 3.3Å; R544-Q546 VanDerWaalsContact O-N 3.11Å; Q546-K785 VanDerWaalsContact C-NZ 3.33Å; Q546-K785 VanDerWaalsContact O-CE 3.31Å; Q546-K785 WeakPolarHBondContact O-CE 3.45Å; Q546-K785 PolarHBondContact O-NZ 2.89Å
547	Y	89.1	Confident	93.3	Very high	100 Å²	100	43.8 Å²	43.8	39%	0.392	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-30.9	-175.2	-62.6	-92.3	0	0	0	113.2	Q508 W519 E543 R544 A545 K785	Q508-Y547 VanDerWaalsContact NE2-CE2 3.27Å; Q508-Y547 PolarHBondContact NE2-OH 2.96Å; W519-Y547 AromaticContact CE2-CD2 3.92Å; W519-Y547 AromaticContact CZ2-CD2 3.55Å; W519-Y547 HydrophobicContact CZ2-CD2 3.55Å; W519-Y547 AromaticContact CZ2-CE2 3.83Å; W519-Y547 HydrophobicContact CZ2-CE2 3.83Å; W519-Y547 HydrophobicContact CZ2-CG 4.26Å; W519-Y547 AromaticContact NE1-CD1 3.81Å; W519-Y547 AromaticContact NE1-CD2 3.71Å; W519-Y547 AromaticContact NE1-CE2 3.93Å; W519-Y547 AromaticContact NE1-CG 3.65Å; E543-Y547 VanDerWaalsContact O-CD2 3.26Å; E543-Y547 WeakPolarHBondContact O-CD2 3.36Å; R544-Y547 PolarHBondContact O-N 3.22Å; A545-Y547 VanDerWaalsContact C-N 3.27Å; A545-Y547 PolarHBondContact O-N 3.19Å; Y547-K785 WeakPolarHBondContact O-CD 3.4Å; Y547-K785 WeakPolarHBondContact O-CG 3.38Å
548	I	93.1	Very high	93.3	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	164.2	-178.9	68.4	160.4	0	0	0	111	M523 L526 L527 L538 R544 F550 M783	M523-I548 HydrophobicContact CE-CB 4.37Å; M523-I548 HydrophobicContact CE-CD1 3.85Å; M523-I548 HydrophobicContact CE-CG1 3.88Å; M523-I548 HydrophobicContact CE-CG2 3.6Å; M523-I548 HydrophobicContact SD-CD1 3.51Å; M523-I548 VanDerWaalsContact SD-CD1 3.51Å; M523-I548 HydrophobicContact SD-CG1 4.22Å; M523-I548 HydrophobicContact SD-CG2 4.42Å; L526-I548 HydrophobicContact CD2-CB 4.17Å; L526-I548 HydrophobicContact CD2-CD1 4.22Å; L526-I548 HydrophobicContact CD2-CG2 3.68Å; L527-I548 HydrophobicContact CD2-CG2 3.88Å; L527-I548 HydrophobicContact CG-CG2 4.33Å; L538-I548 HydrophobicContact CD2-CD1 4.28Å; R544-I548 HydrophobicContact CB-CD1 4.48Å; R544-I548 HydrophobicContact CB-CG1 4.28Å; R544-I548 WeakPolarHBondContact O-CG1 3.47Å; R544-I548 PolarHBondContact O-N 3.22Å; I548-F550 HydrophobicContact CD1-CD1 4.37Å; I548-F550 HydrophobicContact CD1-CE1 3.81Å; I548-F550 HydrophobicContact CD1-CE2 3.96Å; I548-F550 HydrophobicContact CD1-CZ 3.58Å; I548-F550 HydrophobicContact CG1-CD2 4.4Å; I548-F550 HydrophobicContact CG1-CE2 3.94Å; I548-F550 HydrophobicContact CG1-CZ 4.08Å; I548-M783 WeakPolarHBondContact CB-O 3.37Å
549	E	92.1	Very high	93.2	Very high	62 Å²	62	43.7 Å²	43.7	29%	0.29	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	129.1	174.8	-166.3	69	-161.9	0	0	109.7	M783 K790	E549-M783 PolarHBondContact N-O 2.88Å; E549-M783 PolarHBondContact O-N 3.38Å; E549-K790 HydrophobicContact CG-CD 3.66Å; E549-K790 HydrophobicContact CG-CG 3.67Å; E549-K790 VanDerWaalsContact OE1-CE 3.25Å; E549-K790 WeakPolarHBondContact OE1-CE 3.3Å; E549-K790 IonicContact OE1-NZ 3.84Å; E549-K790 PolarHBondContact OE1-NZ 2.84Å
550	F	95.9	Very high	93.2	Very high	19 Å²	19	43.8 Å²	43.8	8%	0.083	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	148.3	176.5	-72.9	-78.5	0	0	0	111.8	L538 I540 R544 A545 I548 I781	L538-F550 HydrophobicContact CD2-CE1 3.7Å; L538-F550 HydrophobicContact CD2-CZ 4.3Å; L538-F550 HydrophobicContact CG-CE1 4.08Å; I540-F550 HydrophobicContact CB-CG 4.5Å; I540-F550 HydrophobicContact CG1-CB 4.19Å; I540-F550 HydrophobicContact CG1-CD1 3.69Å; I540-F550 HydrophobicContact CG1-CD2 4.4Å; I540-F550 HydrophobicContact CG1-CE1 4.07Å; I540-F550 HydrophobicContact CG1-CG 3.86Å; I540-F550 HydrophobicContact CG2-CD2 4.01Å; I540-F550 HydrophobicContact CG2-CE2 4.31Å; I540-F550 HydrophobicContact CG2-CG 4.23Å; R544-F550 HydrophobicContact CB-CE2 3.85Å; R544-F550 HydrophobicContact CB-CZ 3.78Å; A545-F550 HydrophobicContact CB-CD2 4.21Å; A545-F550 HydrophobicContact CB-CE2 4.21Å; I548-F550 HydrophobicContact CD1-CD1 4.37Å; I548-F550 HydrophobicContact CD1-CE1 3.81Å; I548-F550 HydrophobicContact CD1-CE2 3.96Å; I548-F550 HydrophobicContact CD1-CZ 3.58Å; I548-F550 HydrophobicContact CG1-CD2 4.4Å; I548-F550 HydrophobicContact CG1-CE2 3.94Å; I548-F550 HydrophobicContact CG1-CZ 4.08Å; F550-I781 WeakPolarHBondContact CA-O 3.44Å
551	S	96.2	Very high	93.3	Very high	7 Å²	7	41.4 Å²	41.4	5%	0.049	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-67.1	173.7	162.1	73.3	0	0	0	0	111.4	I781	S551-I781 PolarHBondContact N-O 2.97Å; S551-I781 PolarHBondContact OG-N 3.37Å
552	K	95.9	Very high	93.4	Very high	116 Å²	116	40.5 Å²	40.5	50%	0.504	19%	0.191	S	C	.	.	S	Bend	trans	-60.1	144.9	159.7	-66.1	-61.2	-175.9	180	0	110.1	F554 L798	K552-F554 PolarHBondContact O-N 3.05Å; K552-L798 HydrophobicContact CB-CD2 4.37Å; K552-L798 HydrophobicContact CB-CG 4.5Å; K552-L798 HydrophobicContact CG-CD1 4.35Å; K552-L798 HydrophobicContact CG-CD2 4.38Å; K552-L798 HydrophobicContact CG-CG 4.36Å
553	P	96.9	Very high	93.6	Very high	26 Å²	26	36.1 Å²	36.1	17%	0.169	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-63.8	131.4	-176.8	20.8	-28.4	0	0	0	110.8	I540 Y556 F779 H801	I540-P553 HydrophobicContact CD1-CB 3.98Å; P553-Y556 HydrophobicContact CB-CE1 4.32Å; P553-Y556 HydrophobicContact CG-CE1 3.74Å; P553-F779 CarbonylContact C-O 3.52Å; P553-F779 WeakPolarHBondContact CA-O 3.43Å; P553-H801 PolarHBondContact O-NE2 3.34Å
554	F	96.2	Very high	93.7	Very high	1 Å²	1	37.2 Å²	37.2	0%	0.004	17%	0.172	C	C	.	.	S	Bend	trans	-90.2	-23.3	177.5	68.2	-99.8	0	0	0	112	F429 F479 L483 K552 F779 I781 I797 H801 M806	F429-F554 HydrophobicContact CE1-CE2 4.44Å; F479-F554 HydrophobicContact CD1-CE2 4.25Å; F479-F554 AromaticContact CE1-CD2 3.64Å; F479-F554 HydrophobicContact CE1-CD2 3.64Å; F479-F554 AromaticContact CE1-CE2 3.6Å; F479-F554 HydrophobicContact CE1-CE2 3.6Å; F479-F554 HydrophobicContact CZ-CD2 4.24Å; F479-F554 HydrophobicContact CZ-CE2 4.46Å; L483-F554 HydrophobicContact CD2-CB 4.23Å; L483-F554 HydrophobicContact CD2-CD1 4.4Å; L483-F554 HydrophobicContact CD2-CD2 4.24Å; L483-F554 HydrophobicContact CD2-CG 4.05Å; K552-F554 PolarHBondContact O-N 3.05Å; F554-F779 HydrophobicContact CD1-CB 4.3Å; F554-F779 VanDerWaalsContact CD1-O 3.31Å; F554-F779 WeakPolarHBondContact CD1-O 3.37Å; F554-F779 HydrophobicContact CE1-CB 3.59Å; F554-F779 HydrophobicContact CE2-CB 3.95Å; F554-F779 HydrophobicContact CZ-CB 3.39Å; F554-F779 HydrophobicContact CZ-CD2 4.47Å; F554-F779 HydrophobicContact CZ-CG 4.32Å; F554-F779 PolarHBondContact N-O 3.4Å; F554-I781 HydrophobicContact CD1-CG1 4.46Å; F554-I797 HydrophobicContact CB-CD1 4.26Å; F554-I797 HydrophobicContact CB-CG2 4Å; F554-H801 PolarHBondContact O-CE1 2.91Å; F554-H801 PolarHBondContact O-NE2 3.37Å; F554-M806 HydrophobicContact CB-CE 3.79Å; F554-M806 HydrophobicContact CB-SD 4.24Å; F554-M806 HydrophobicContact CD2-SD 4.4Å; F554-M806 WeakPolarHBondContact O-CG 3.46Å
555	K	94.8	Very high	93.4	Very high	34 Å²	34	41 Å²	41	15%	0.148	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	129.8	174.5	-179	74.7	-177.5	-169.6	0	109.4	G778 F779 D810	K555-G778 CarbonylContact O-C 3.4Å; K555-G778 WeakPolarHBondContact O-CA 3.43Å; K555-F779 HydrophobicContact CB-CD2 4.15Å; K555-F779 HydrophobicContact CG-CD2 4.31Å; K555-F779 PolarHBondContact O-N 3.34Å; K555-D810 IonicContact NZ-OD1 2.72Å; K555-D810 PolarHBondContact NZ-OD1 3.05Å; K555-D810 IonicContact NZ-OD2 3.21Å; K555-D810 PolarHBondContact NZ-OD2 3.47Å
556	Y	94.3	Very high	92.6	Very high	165 Å²	165	47 Å²	47	65%	0.647	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	138.4	170.6	-66.2	-81.1	0	0	0	109.7	P553	P553-Y556 HydrophobicContact CB-CE1 4.32Å; P553-Y556 HydrophobicContact CG-CE1 3.74Å
557	Q	93.6	Very high	91.7	Very high	10 Å²	10	48.2 Å²	48.2	5%	0.047	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	162.6	-175.3	73.8	92.5	10.2	0	0	110.6	D753 S754 A755 S777 F779	Q557-D753 PolarHBondContact NE2-OD1 3.01Å; Q557-D753 PolarHBondContact OE1-OD1 3.48Å; Q557-S754 PolarHBondContact OE1-OG 3.28Å; Q557-A755 HydrophobicContact CB-CB 4.46Å; Q557-S777 PolarHBondContact N-O 3.11Å; Q557-S777 PolarHBondContact NE2-OG 3.24Å; Q557-S777 CarbonylContact O-C 3.58Å; Q557-S777 PolarHBondContact O-N 3.31Å; Q557-F779 HydrophobicContact CG-CD1 4.5Å; Q557-F779 HydrophobicContact CG-CD2 4.47Å; Q557-F779 HydrophobicContact CG-CE1 4.11Å; Q557-F779 HydrophobicContact CG-CE2 4.07Å; Q557-F779 HydrophobicContact CG-CZ 3.88Å
558	G	94.6	Very high	90.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	175.8	167.8	0	0	0	0	0	111.7	S754	G558-S754 PolarHBondContact N-OG 3.35Å; G558-S754 WeakPolarHBondContact O-CA 3.01Å; G558-S754 WeakPolarHBondContact O-CB 3.48Å; G558-S754 PolarHBondContact O-N 3.34Å; G558-S754 PolarHBondContact O-OG 2.93Å
559	L	95.2	Very high	88.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	139.4	171.4	-56.9	-179.4	0	0	0	110.1	V710 Y713 W752 D753 L773 F774 F775	L559-V710 HydrophobicContact CD1-CG1 4.11Å; L559-V710 HydrophobicContact CD1-CG2 4.41Å; L559-V710 HydrophobicContact CD2-CG2 3.65Å; L559-Y713 HydrophobicContact CD1-CD1 4.17Å; L559-W752 WeakPolarHBondContact CA-O 3.21Å; L559-D753 WeakPolarHBondContact CD2-OD1 3.48Å; L559-L773 WeakPolarHBondContact O-CA 3.48Å; L559-F774 HydrophobicContact CB-CD1 4.31Å; L559-F774 HydrophobicContact CB-CD2 3.92Å; L559-F774 HydrophobicContact CB-CE1 3.98Å; L559-F774 HydrophobicContact CB-CE2 3.56Å; L559-F774 HydrophobicContact CB-CG 4.29Å; L559-F774 HydrophobicContact CB-CZ 3.59Å; L559-F774 HydrophobicContact CD1-CD2 4.25Å; L559-F774 HydrophobicContact CD1-CE2 3.71Å; L559-F774 HydrophobicContact CD1-CZ 4.37Å; L559-F774 HydrophobicContact CG-CE2 4.25Å; L559-F774 PolarHBondContact N-O 2.98Å; L559-F774 VanDerWaalsContact O-CD1 3.29Å; L559-F774 WeakPolarHBondContact O-CD1 3.2Å; L559-F774 PolarHBondContact O-N 3.45Å; L559-F774 VanDerWaalsContact O-N 3.12Å; L559-F775 HydrophobicContact CD1-CB 3.86Å; L559-F775 HydrophobicContact CD1-CD1 3.75Å; L559-F775 HydrophobicContact CD1-CG 4.15Å; L559-F775 HydrophobicContact CD2-CD1 4.46Å; L559-F775 HydrophobicContact CG-CB 4.02Å; L559-F775 HydrophobicContact CG-CD1 3.85Å; L559-F775 HydrophobicContact CG-CG 4.41Å
560	T	95.1	Very high	87.3	Confident	4 Å²	4	58.7 Å²	58.7	3%	0.025	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	174	171.5	-167.6	0	0	0	0	109.5	W752 L757 T769 T770	T560-W752 PolarHBondContact N-O 2.85Å; T560-W752 PolarHBondContact O-N 3.42Å; T560-L757 HydrophobicContact CG2-CB 3.9Å; T560-L757 HydrophobicContact CG2-CD1 3.58Å; T560-L757 HydrophobicContact CG2-CG 4.29Å; T560-L757 WeakPolarHBondContact O-CD1 3.5Å; T560-T769 HydrophobicContact CG2-CG2 3.89Å; T560-T770 PolarHBondContact OG1-O 2.98Å
561	I	95.6	Very high	85.9	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124	-175.3	-47.9	-175.1	0	0	0	107.9	V563 I685 L693 A749 F750 I751 T769 T770 F774	I561-V563 HydrophobicContact CG2-CG1 4.2Å; I561-I685 HydrophobicContact CD1-CG2 4.16Å; I561-I685 HydrophobicContact CG2-CD1 4.31Å; I561-L693 HydrophobicContact CD1-CD1 3.45Å; I561-L693 VanDerWaalsContact CD1-CD1 3.45Å; I561-A749 HydrophobicContact CG2-CB 3.75Å; I561-F750 CarbonylContact C-O 3.59Å; I561-F750 WeakPolarHBondContact CA-O 3.32Å; I561-I751 HydrophobicContact CG1-CG1 4.33Å; I561-T769 CarbonylContact O-C 3.54Å; I561-T769 WeakPolarHBondContact O-CA 3.48Å; I561-T770 PolarHBondContact O-N 3.3Å; I561-T770 PolarHBondContact O-OG1 3.05Å; I561-F774 HydrophobicContact CD1-CE1 4.49Å; I561-F774 HydrophobicContact CG1-CE1 4.12Å
562	L	94.3	Very high	84.4	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.3	173.5	-167.9	73.6	0	0	0	109.4	I739 A749 F750 L757 A761 L767 T769	L562-I739 HydrophobicContact CD2-CG1 4.2Å; L562-I739 HydrophobicContact CD2-CG2 4.49Å; L562-A749 WeakPolarHBondContact O-CA 3.49Å; L562-F750 HydrophobicContact CB-CB 4.31Å; L562-F750 HydrophobicContact CB-CD1 4.48Å; L562-F750 HydrophobicContact CD2-CD1 4.37Å; L562-F750 PolarHBondContact N-O 3.37Å; L562-F750 PolarHBondContact O-N 3.27Å; L562-L757 HydrophobicContact CB-CD1 3.91Å; L562-L757 HydrophobicContact CB-CD2 3.92Å; L562-L757 HydrophobicContact CB-CG 4.38Å; L562-L757 HydrophobicContact CD1-CB 4.36Å; L562-L757 HydrophobicContact CD1-CD2 4.41Å; L562-L757 HydrophobicContact CD2-CD2 3.85Å; L562-L757 HydrophobicContact CG-CD2 4.28Å; L562-A761 HydrophobicContact CD1-CB 4.34Å; L562-L767 HydrophobicContact CD1-CB 3.87Å; L562-L767 HydrophobicContact CD2-CD1 3.73Å; L562-L767 HydrophobicContact CG-CB 4.23Å; L562-L767 HydrophobicContact CG-CD1 4.33Å; L562-T769 HydrophobicContact CD1-CG2 4.06Å
563	V	92.8	Very high	83.1	Confident	15 Å²	15	64.8 Å²	64.8	9%	0.091	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	157.3	174.6	-59.9	0	0	0	0	109.8	I561 I685 A749 L767 V768 T770	I561-V563 HydrophobicContact CG2-CG1 4.2Å; V563-I685 HydrophobicContact CG1-CD1 3.71Å; V563-A749 HydrophobicContact CG1-CB 4.03Å; V563-L767 WeakPolarHBondContact O-CA 3.43Å; V563-V768 HydrophobicContact CG2-CG2 3.68Å; V563-V768 PolarHBondContact N-O 3.08Å; V563-V768 PolarHBondContact O-N 2.89Å; V563-T770 HydrophobicContact CG2-CG2 3.62Å
564	K	90.6	Very high	81.9	Confident	71 Å²	71	64.4 Å²	64.4	31%	0.309	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	138.9	173.3	-167.6	179.1	-177.2	168.3	0	110.7	E566 V742 R743 N745 L767	K564-E566 PolarHBondContact O-N 3.4Å; K564-V742 HydrophobicContact CB-CG1 4.32Å; K564-R743 PolarHBondContact NZ-O 2.56Å; K564-N745 WeakPolarHBondContact CD-OD1 3.26Å; K564-N745 WeakPolarHBondContact CE-OD1 3.48Å; K564-N745 PolarHBondContact NZ-ND2 3.48Å; K564-N745 PolarHBondContact NZ-OD1 2.77Å; K564-L767 HydrophobicContact CB-CD2 4.24Å; K564-L767 HydrophobicContact CG-CD2 4.38Å
565	K	84.4	Confident	81.1	Confident	78 Å²	78	66.7 Å²	66.7	34%	0.339	32%	0.323	S	S	.	.			trans	-75.7	106.9	172.1	-171.9	178.8	176.8	179.8	0	109.2	D766 V768	K565-D766 VanDerWaalsContact CB-O 3.27Å; K565-D766 WeakPolarHBondContact CB-O 3.05Å; K565-D766 PolarHBondContact N-O 3.1Å; K565-V768 HydrophobicContact CB-CG1 4.12Å; K565-V768 HydrophobicContact CD-CG1 4.22Å; K565-V768 HydrophobicContact CG-CG1 4.36Å
566	E	74.4	Confident	80.5	Confident	167 Å²	167	69.4 Å²	69.4	78%	0.78	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-74.3	126.9	171.8	-63.5	-170.9	171.2	0	0	110.3	K564	K564-E566 PolarHBondContact O-N 3.4Å
567	I	70.5	Confident	79.8	Confident	136 Å²	136	65.1 Å²	65.1	70%	0.697	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-94.3	120.8	173.3	-55	169	0	0	0	106.4	R569	I567-R569 PolarHBondContact O-N 2.69Å
568	P	62	Low	79.4	Confident	86 Å²	86	65.1 Å²	65.1	56%	0.558	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-62.3	128.1	179.1	26	-32.6	0	0	0	109.3
569	R	58.9	Low	79.1	Confident	239 Å²	239	66.4 Å²	66.4	90%	0.902	33%	0.329	S	S	*	.			trans	-111.5	126.6	170.3	-70.8	-175.5	179.7	167.1	-0.2	108.1	I567	I567-R569 PolarHBondContact O-N 2.69Å
570	S	60.9	Low	78.8	Confident	57 Å²	57	73 Å²	73	40%	0.399	36%	0.36	S	S	.	.			trans	-100.1	150.4	-177.7	22	0	0	0	0	110.4	N833	S570-N833 VanDerWaalsContact CB-CG 3.41Å; S570-N833 VanDerWaalsContact CB-ND2 3.34Å; S570-N833 WeakPolarHBondContact CB-ND2 3.4Å; S570-N833 WeakPolarHBondContact CB-OD1 3.26Å; S570-N833 PolarHBondContact OG-ND2 3.08Å; S570-N833 PolarHBondContact OG-OD1 3.39Å
571	T	66.3	Low	78.4	Confident	73 Å²	73	76.7 Å²	76.7	45%	0.448	39%	0.386	S	S	.	.			trans	-94.1	152	-172.5	54.1	0	0	0	0	111.3	D573 S574 Q577	T571-D573 WeakPolarHBondContact CB-OD1 3.43Å; T571-D573 PolarHBondContact O-N 2.97Å; T571-D573 VanDerWaalsContact O-N 3.16Å; T571-D573 PolarHBondContact OG1-OD1 3.13Å; T571-S574 PolarHBondContact O-N 3.09Å; T571-S574 PolarHBondContact O-OG 3.2Å; T571-Q577 PolarHBondContact OG1-NE2 3.44Å
572	L	64.9	Low	78.2	Confident	117 Å²	117	80.2 Å²	80.2	61%	0.613	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-11.9	-175.6	-68.2	171.3	0	0	0	114.2	A835	L572-A835 HydrophobicContact CD2-CB 4.1Å
573	D	69.8	Low	78	Confident	80 Å²	80	83.2 Å²	83.2	43%	0.428	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	0.4	179.7	67.3	-31.9	0	0	0	113.6	T571 F575 M576 Q577	T571-D573 WeakPolarHBondContact CB-OD1 3.43Å; T571-D573 PolarHBondContact O-N 2.97Å; T571-D573 VanDerWaalsContact O-N 3.16Å; T571-D573 PolarHBondContact OG1-OD1 3.13Å; D573-F575 PolarHBondContact O-N 3.02Å; D573-M576 PolarHBondContact O-N 3.04Å; D573-Q577 PolarHBondContact O-N 3.07Å; D573-Q577 PolarHBondContact OD1-NE2 3.42Å; D573-Q577 PolarHBondContact OD2-NE2 3.46Å
574	S	71.6	Confident	77.9	Confident	18 Å²	18	87.2 Å²	87.2	13%	0.126	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-28.4	-175.5	-66.4	0	0	0	0	114.6	T571	T571-S574 PolarHBondContact O-N 3.09Å; T571-S574 PolarHBondContact O-OG 3.2Å
575	F	78.4	Confident	77.9	Confident	50 Å²	50	90.1 Å²	90.1	22%	0.219	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-23.6	178.8	81.4	-86	0	0	0	114.3	D573 P578 Y668 V837 L840	D573-F575 PolarHBondContact O-N 3.02Å; F575-P578 WeakPolarHBondContact O-CD 3.43Å; F575-Y668 PolarHBondContact O-OH 3.03Å; F575-V837 HydrophobicContact CB-CG2 3.86Å; F575-V837 HydrophobicContact CD1-CG2 3.99Å; F575-V837 HydrophobicContact CD2-CG2 3.86Å; F575-V837 HydrophobicContact CE2-CG2 4.39Å; F575-V837 HydrophobicContact CG-CG2 3.62Å; F575-L840 HydrophobicContact CZ-CD1 4.47Å
576	M	82.1	Confident	78.2	Confident	90 Å²	90	91.8 Å²	91.8	44%	0.443	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-23.9	177.5	-65.6	-173.2	72.9	0	0	112.3	D573 P578 F579 W584	D573-M576 PolarHBondContact O-N 3.04Å; M576-P578 VanDerWaalsContact C-N 3.34Å; M576-F579 PolarHBondContact O-N 3.21Å; M576-W584 PolarHBondContact O-NE1 2.95Å
577	Q	79.4	Confident	79	Confident	76 Å²	76	84.3 Å²	84.3	36%	0.355	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-33.2	-178.3	-74.1	177.6	-7.2	0	0	116.1	T571 D573 F579	T571-Q577 PolarHBondContact OG1-NE2 3.44Å; D573-Q577 PolarHBondContact O-N 3.07Å; D573-Q577 PolarHBondContact OD1-NE2 3.42Å; D573-Q577 PolarHBondContact OD2-NE2 3.46Å; Q577-F579 PolarHBondContact O-N 3.33Å; Q577-F579 VanDerWaalsContact O-N 3.1Å
578	P	85.8	Confident	80	Confident	10 Å²	10	78.9 Å²	78.9	7%	0.065	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.1	179.7	-26	35.4	0	0	0	114.4	F575 M576 Y668 N671 L672	F575-P578 WeakPolarHBondContact O-CD 3.43Å; M576-P578 VanDerWaalsContact C-N 3.34Å; P578-Y668 HydrophobicContact CB-CD2 3.91Å; P578-Y668 HydrophobicContact CB-CE2 3.84Å; P578-Y668 HydrophobicContact CG-CD2 4.38Å; P578-Y668 HydrophobicContact CG-CE2 3.83Å; P578-N671 HydrophobicContact CB-CB 4.36Å; P578-N671 PolarHBondContact O-ND2 3.28Å; P578-L672 HydrophobicContact CG-CB 4.19Å; P578-L672 HydrophobicContact CG-CD1 4.02Å
579	F	88.4	Confident	81.4	Confident	26 Å²	26	80.2 Å²	80.2	11%	0.114	41%	0.413	C	S	.	.	S	Bend	trans	-129	140.1	173.9	-73	-27	0	0	0	110.7	M576 Q577 L583 W584 I664 Y668	M576-F579 PolarHBondContact O-N 3.21Å; Q577-F579 PolarHBondContact O-N 3.33Å; Q577-F579 VanDerWaalsContact O-N 3.1Å; F579-L583 HydrophobicContact CB-CD2 4.06Å; F579-L583 HydrophobicContact CD1-CD2 3.55Å; F579-L583 HydrophobicContact CD2-CD2 4.23Å; F579-L583 HydrophobicContact CE1-CD2 3.99Å; F579-L583 HydrophobicContact CG-CD2 3.7Å; F579-L583 HydrophobicContact CZ-CD2 4.49Å; F579-W584 HydrophobicContact CB-CZ2 4.4Å; F579-W584 HydrophobicContact CD2-CH2 4.28Å; F579-W584 AromaticContact CD2-CZ2 3.91Å; F579-W584 HydrophobicContact CD2-CZ2 3.91Å; F579-I664 HydrophobicContact CE2-CG2 4.08Å; F579-I664 HydrophobicContact CZ-CG2 4.41Å; F579-Y668 HydrophobicContact CD2-CD2 4.06Å; F579-Y668 HydrophobicContact CE2-CD2 4.01Å; F579-Y668 HydrophobicContact CE2-CG 4.38Å; F579-Y668 HydrophobicContact CZ-CD2 4.49Å
580	Q	88.8	Confident	82.9	Confident	139 Å²	139	70.1 Å²	70.1	65%	0.65	38%	0.378	S	S	*	.			trans	-61	144.5	173	-163.2	177.1	5.1	0	0	110	T582 L583 W584	Q580-T582 VanDerWaalsContact CD-OG1 3.26Å; Q580-T582 WeakPolarHBondContact CG-OG1 2.84Å; Q580-T582 PolarHBondContact O-N 2.95Å; Q580-T582 VanDerWaalsContact O-N 3.08Å; Q580-T582 PolarHBondContact OE1-OG1 3.07Å; Q580-L583 WeakPolarHBondContact O-CB 3.36Å; Q580-L583 PolarHBondContact O-N 3.33Å; Q580-W584 PolarHBondContact O-N 3.49Å
581	S	86.3	Confident	84.4	Confident	81 Å²	81	67.4 Å²	67.4	57%	0.566	36%	0.36	S	S	*	.	H	α-helix	trans	-54.3	-30.9	178.7	53.6	0	0	0	0	113.3	L585	S581-L585 PolarHBondContact O-N 2.92Å
582	T	91.3	Very high	85.5	Confident	76 Å²	76	68 Å²	68	47%	0.466	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-39.6	173.7	50.6	0	0	0	0	112.9	Q580 L585 L586	Q580-T582 VanDerWaalsContact CD-OG1 3.26Å; Q580-T582 WeakPolarHBondContact CG-OG1 2.84Å; Q580-T582 PolarHBondContact O-N 2.95Å; Q580-T582 VanDerWaalsContact O-N 3.08Å; Q580-T582 PolarHBondContact OE1-OG1 3.07Å; T582-L585 PolarHBondContact O-N 2.61Å; T582-L586 WeakPolarHBondContact O-CB 3.46Å; T582-L586 PolarHBondContact O-N 2.92Å
583	L	91.1	Very high	86.9	Confident	63 Å²	63	66.2 Å²	66.2	33%	0.33	35%	0.351	S	S	.	.	H	α-helix	trans	-69.4	-39.6	179.7	-172	67.2	0	0	0	111.1	F579 Q580 L585 L586 V587	F579-L583 HydrophobicContact CB-CD2 4.06Å; F579-L583 HydrophobicContact CD1-CD2 3.55Å; F579-L583 HydrophobicContact CD2-CD2 4.23Å; F579-L583 HydrophobicContact CE1-CD2 3.99Å; F579-L583 HydrophobicContact CG-CD2 3.7Å; F579-L583 HydrophobicContact CZ-CD2 4.49Å; Q580-L583 WeakPolarHBondContact O-CB 3.36Å; Q580-L583 PolarHBondContact O-N 3.33Å; L583-L585 VanDerWaalsContact C-N 3.31Å; L583-L585 PolarHBondContact O-N 2.91Å; L583-L586 PolarHBondContact O-N 2.93Å; L583-L586 VanDerWaalsContact O-N 3.15Å; L583-V587 HydrophobicContact CG-CG2 4.39Å; L583-V587 WeakPolarHBondContact O-CG2 3.34Å; L583-V587 PolarHBondContact O-N 3.41Å
584	W	89.9	Confident	87.9	Confident	98 Å²	98	63.6 Å²	63.6	37%	0.371	34%	0.338	S	S	.	.	H	α-helix	trans	-56.8	-44.2	174.1	-78.3	111.7	0	0	0	112.4	M576 F579 Q580 G588 Y668	M576-W584 PolarHBondContact O-NE1 2.95Å; F579-W584 HydrophobicContact CB-CZ2 4.4Å; F579-W584 HydrophobicContact CD2-CH2 4.28Å; F579-W584 AromaticContact CD2-CZ2 3.91Å; F579-W584 HydrophobicContact CD2-CZ2 3.91Å; Q580-W584 PolarHBondContact O-N 3.49Å; W584-G588 PolarHBondContact O-N 3.13Å; W584-Y668 HydrophobicContact CH2-CD2 4.5Å; W584-Y668 HydrophobicContact CH2-CE2 4.42Å; W584-Y668 HydrophobicContact CZ2-CD2 4.27Å; W584-Y668 HydrophobicContact CZ2-CE2 4.03Å
585	L	90.4	Very high	88.7	Confident	133 Å²	133	62.8 Å²	62.8	70%	0.696	33%	0.332	S	S	*	.	H	α-helix	trans	-66.6	-39.7	176.2	-67.5	173.5	0	0	0	112	S581 T582 L583 G588 L589	S581-L585 PolarHBondContact O-N 2.92Å; T582-L585 PolarHBondContact O-N 2.61Å; L583-L585 VanDerWaalsContact C-N 3.31Å; L583-L585 PolarHBondContact O-N 2.91Å; L585-G588 PolarHBondContact O-N 3.1Å; L585-L589 WeakPolarHBondContact O-CB 3.45Å; L585-L589 PolarHBondContact O-N 3.28Å
586	L	91.6	Very high	89.3	Confident	112 Å²	112	63.5 Å²	63.5	59%	0.586	34%	0.341	S	S	*	.	H	α-helix	trans	-68.6	-40.7	-179.4	-159.7	154.8	0	0	0	111.8	T582 L583 L589 S590	T582-L586 WeakPolarHBondContact O-CB 3.46Å; T582-L586 PolarHBondContact O-N 2.92Å; L583-L586 PolarHBondContact O-N 2.93Å; L583-L586 VanDerWaalsContact O-N 3.15Å; L586-L589 PolarHBondContact O-N 3.42Å; L586-S590 WeakPolarHBondContact O-CB 3.47Å; L586-S590 PolarHBondContact O-N 2.75Å
587	V	91.3	Very high	89.6	Confident	11 Å²	11	63.9 Å²	63.9	7%	0.067	34%	0.343	C	S	.	.	H	α-helix	trans	-63.7	-44.2	172	173.9	0	0	0	0	110.4	L583 L589 S590 V591 L635 I664	L583-V587 HydrophobicContact CG-CG2 4.39Å; L583-V587 WeakPolarHBondContact O-CG2 3.34Å; L583-V587 PolarHBondContact O-N 3.41Å; V587-L589 VanDerWaalsContact C-N 3.32Å; V587-L589 PolarHBondContact O-N 3.16Å; V587-S590 PolarHBondContact O-N 3.38Å; V587-S590 PolarHBondContact O-OG 3.1Å; V587-V591 VanDerWaalsContact O-CG2 3.26Å; V587-V591 WeakPolarHBondContact O-CG2 3.5Å; V587-V591 PolarHBondContact O-N 3.42Å; V587-L635 HydrophobicContact CG1-CD1 4.45Å; V587-L635 HydrophobicContact CG1-CD2 3.95Å; V587-I664 HydrophobicContact CG2-CD1 4.31Å
588	G	90.1	Very high	89.9	Confident	22 Å²	22	60.7 Å²	60.7	23%	0.227	33%	0.328	C	S	.	.	H	α-helix	trans	-59	-41.7	174.9	0	0	0	0	0	112.8	W584 L585 H592	W584-G588 PolarHBondContact O-N 3.13Å; L585-G588 PolarHBondContact O-N 3.1Å; G588-H592 PolarHBondContact O-ND1 2.86Å
589	L	92	Very high	89.9	Confident	114 Å²	114	63.7 Å²	63.7	60%	0.597	34%	0.338	S	S	*	.	H	α-helix	trans	-68.3	-41.1	176.9	-176.5	65.5	0	0	0	112.2	L585 L586 V587 V591 H592 V593	L585-L589 WeakPolarHBondContact O-CB 3.45Å; L585-L589 PolarHBondContact O-N 3.28Å; L586-L589 PolarHBondContact O-N 3.42Å; V587-L589 VanDerWaalsContact C-N 3.32Å; V587-L589 PolarHBondContact O-N 3.16Å; L589-V591 VanDerWaalsContact C-N 3.32Å; L589-V591 PolarHBondContact O-N 2.88Å; L589-H592 PolarHBondContact O-N 3.11Å; L589-H592 VanDerWaalsContact O-N 3.15Å; L589-V593 WeakPolarHBondContact O-CG2 3.25Å; L589-V593 PolarHBondContact O-N 3.39Å; L589-V593 VanDerWaalsContact O-N 3.08Å
590	S	91.4	Very high	89.7	Confident	26 Å²	26	65.3 Å²	65.3	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-36.1	-178.4	72.4	0	0	0	0	112.4	L586 V587 H592 V593 V594	L586-S590 WeakPolarHBondContact O-CB 3.47Å; L586-S590 PolarHBondContact O-N 2.75Å; V587-S590 PolarHBondContact O-N 3.38Å; V587-S590 PolarHBondContact O-OG 3.1Å; S590-H592 VanDerWaalsContact C-N 3.32Å; S590-H592 PolarHBondContact O-N 2.65Å; S590-V593 PolarHBondContact O-N 3.1Å; S590-V594 WeakPolarHBondContact O-CB 3.37Å; S590-V594 WeakPolarHBondContact O-CG2 3.38Å; S590-V594 PolarHBondContact O-N 3.3Å
591	V	91.6	Very high	89.4	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.006	33%	0.333	C	S	.	.	H	α-helix	trans	-54.1	-47.8	171.9	174.8	0	0	0	0	111.1	V587 L589 V594 A595 S631 W632 L635 W657	V587-V591 VanDerWaalsContact O-CG2 3.26Å; V587-V591 WeakPolarHBondContact O-CG2 3.5Å; V587-V591 PolarHBondContact O-N 3.42Å; L589-V591 VanDerWaalsContact C-N 3.32Å; L589-V591 PolarHBondContact O-N 2.88Å; V591-V594 PolarHBondContact O-N 2.88Å; V591-A595 WeakPolarHBondContact O-CB 3.31Å; V591-A595 PolarHBondContact O-N 2.76Å; V591-S631 PolarHBondContact O-OG 3.06Å; V591-W632 HydrophobicContact CG1-CD2 4.01Å; V591-W632 HydrophobicContact CG1-CG 3.91Å; V591-L635 HydrophobicContact CG2-CD2 3.49Å; V591-L635 VanDerWaalsContact CG2-CD2 3.49Å; V591-W657 HydrophobicContact CB-CH2 4.25Å; V591-W657 HydrophobicContact CB-CZ2 4.27Å; V591-W657 HydrophobicContact CG2-CH2 3.63Å; V591-W657 HydrophobicContact CG2-CZ2 3.69Å
592	H	90.3	Very high	89	Confident	85 Å²	85	58.9 Å²	58.9	39%	0.394	31%	0.311	S	S	.	.	H	α-helix	trans	-69.5	-38.7	-178.7	-66.3	84.2	0	0	0	112	G588 L589 S590 A595 V596 W632	G588-H592 PolarHBondContact O-ND1 2.86Å; L589-H592 PolarHBondContact O-N 3.11Å; L589-H592 VanDerWaalsContact O-N 3.15Å; S590-H592 VanDerWaalsContact C-N 3.32Å; S590-H592 PolarHBondContact O-N 2.65Å; H592-A595 PolarHBondContact O-N 3.39Å; H592-V596 WeakPolarHBondContact O-CG2 3.23Å; H592-V596 PolarHBondContact O-N 3.49Å; H592-W632 AromaticContact CE1-NE1 3.89Å; H592-W632 AromaticContact NE2-NE1 3.97Å
593	V	92.9	Very high	88.3	Confident	80 Å²	80	61.6 Å²	61.6	49%	0.485	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-44.3	175.7	173.5	0	0	0	0	110.9	L589 S590 V596 M597	L589-V593 WeakPolarHBondContact O-CG2 3.25Å; L589-V593 PolarHBondContact O-N 3.39Å; L589-V593 VanDerWaalsContact O-N 3.08Å; S590-V593 PolarHBondContact O-N 3.1Å; V593-V596 PolarHBondContact O-N 3.13Å; V593-M597 PolarHBondContact O-N 3.45Å
594	V	91	Very high	87.5	Confident	25 Å²	25	66.2 Å²	66.2	15%	0.152	33%	0.331	C	S	.	.	H	α-helix	trans	-66.9	-41.2	178	172.4	0	0	0	0	111.2	S590 V591 V596 M597 L598 W657	S590-V594 WeakPolarHBondContact O-CB 3.37Å; S590-V594 WeakPolarHBondContact O-CG2 3.38Å; S590-V594 PolarHBondContact O-N 3.3Å; V591-V594 PolarHBondContact O-N 2.88Å; V594-V596 PolarHBondContact O-N 3.34Å; V594-M597 PolarHBondContact O-N 3.42Å; V594-L598 HydrophobicContact CG1-CD1 3.95Å; V594-L598 HydrophobicContact CG1-CG 4.27Å; V594-L598 WeakPolarHBondContact O-CB 3.47Å; V594-L598 WeakPolarHBondContact O-CG 3.27Å; V594-L598 PolarHBondContact O-N 2.83Å; V594-W657 HydrophobicContact CB-CD2 4.39Å; V594-W657 HydrophobicContact CB-CE3 4.21Å; V594-W657 HydrophobicContact CB-CZ3 4.45Å; V594-W657 HydrophobicContact CG1-CB 4.24Å; V594-W657 HydrophobicContact CG1-CD2 3.9Å; V594-W657 HydrophobicContact CG1-CE3 4.09Å; V594-W657 HydrophobicContact CG1-CG 3.96Å; V594-W657 HydrophobicContact CG2-CD2 4.38Å; V594-W657 HydrophobicContact CG2-CE3 3.73Å; V594-W657 HydrophobicContact CG2-CZ3 3.91Å
595	A	89.2	Confident	86.5	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.008	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-44.6	175.5	0	0	0	0	0	112.6	V591 H592 Y599 M628	V591-A595 WeakPolarHBondContact O-CB 3.31Å; V591-A595 PolarHBondContact O-N 2.76Å; H592-A595 PolarHBondContact O-N 3.39Å; A595-Y599 WeakPolarHBondContact O-CB 3.31Å; A595-Y599 PolarHBondContact O-N 3.09Å; A595-M628 HydrophobicContact CB-CB 4.42Å; A595-M628 HydrophobicContact CB-CG 3.89Å
596	V	90.4	Very high	85.1	Confident	65 Å²	65	60.7 Å²	60.7	39%	0.394	32%	0.316	S	S	.	.	H	α-helix	trans	-64.7	-42.2	175.8	172.7	0	0	0	0	110.8	H592 V593 V594 Y599 L600 L624	H592-V596 WeakPolarHBondContact O-CG2 3.23Å; H592-V596 PolarHBondContact O-N 3.49Å; V593-V596 PolarHBondContact O-N 3.13Å; V594-V596 PolarHBondContact O-N 3.34Å; V596-Y599 WeakPolarHBondContact O-CB 3.44Å; V596-Y599 PolarHBondContact O-N 2.63Å; V596-L600 HydrophobicContact CG1-CD1 3.91Å; V596-L600 HydrophobicContact CG1-CG 4.27Å; V596-L600 VanDerWaalsContact O-CG 3.3Å; V596-L600 WeakPolarHBondContact O-CG 3.06Å; V596-L600 PolarHBondContact O-N 2.89Å; V596-L624 HydrophobicContact CG2-CD1 4.29Å
597	M	88.5	Confident	83.4	Confident	98 Å²	98	62.3 Å²	62.3	48%	0.483	32%	0.318	S	S	.	.	H	α-helix	trans	-67.6	-39.2	178.2	-81.9	-54.8	-171.4	0	0	113.5	V593 V594 Y599 L600 L601 L653	V593-M597 PolarHBondContact O-N 3.45Å; V594-M597 PolarHBondContact O-N 3.42Å; M597-Y599 VanDerWaalsContact C-N 3.31Å; M597-Y599 PolarHBondContact O-N 2.76Å; M597-L600 PolarHBondContact O-N 3.4Å; M597-L600 HydrophobicContact SD-CD1 4.15Å; M597-L601 VanDerWaalsContact O-CB 3.3Å; M597-L601 WeakPolarHBondContact O-CB 3.47Å; M597-L601 VanDerWaalsContact O-CG 3.25Å; M597-L601 WeakPolarHBondContact O-CG 3.46Å; M597-L601 PolarHBondContact O-N 3.34Å; M597-L653 HydrophobicContact CB-CD2 4.15Å
598	L	86.6	Confident	81.7	Confident	8 Å²	8	62.9 Å²	62.9	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-59.6	-44.1	171.9	-75.8	170.4	0	0	0	110.8	V594 D602 F630 A650 L653	V594-L598 HydrophobicContact CG1-CD1 3.95Å; V594-L598 HydrophobicContact CG1-CG 4.27Å; V594-L598 WeakPolarHBondContact O-CB 3.47Å; V594-L598 WeakPolarHBondContact O-CG 3.27Å; V594-L598 PolarHBondContact O-N 2.83Å; L598-D602 WeakPolarHBondContact O-CB 3.48Å; L598-D602 PolarHBondContact O-N 3.22Å; L598-F630 HydrophobicContact CD1-CD1 3.73Å; L598-F630 HydrophobicContact CD1-CE1 3.88Å; L598-A650 HydrophobicContact CD2-CB 3.93Å; L598-A650 WeakPolarHBondContact CD2-O 3.02Å; L598-L653 HydrophobicContact CD2-CB 4.1Å; L598-L653 HydrophobicContact CD2-CD2 3.84Å; L598-L653 HydrophobicContact CD2-CG 4.1Å; L598-L653 HydrophobicContact CG-CD2 4.02Å
599	Y	85.8	Confident	80	Confident	73 Å²	73	70 Å²	70	29%	0.286	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-47.2	175.5	170.5	-106.4	0	0	0	112.5	A595 V596 M597 R603 L624	A595-Y599 WeakPolarHBondContact O-CB 3.31Å; A595-Y599 PolarHBondContact O-N 3.09Å; V596-Y599 WeakPolarHBondContact O-CB 3.44Å; V596-Y599 PolarHBondContact O-N 2.63Å; M597-Y599 VanDerWaalsContact C-N 3.31Å; M597-Y599 PolarHBondContact O-N 2.76Å; Y599-R603 WeakPolarHBondContact O-CB 3.44Å; Y599-R603 PolarHBondContact O-N 3.24Å; Y599-L624 HydrophobicContact CD1-CD1 3.99Å; Y599-L624 HydrophobicContact CD2-CB 4.19Å; Y599-L624 HydrophobicContact CE2-CB 4.35Å; Y599-L624 HydrophobicContact CG-CB 4.32Å; Y599-L624 HydrophobicContact CG-CD1 3.96Å
600	L	83.8	Confident	77.9	Confident	60 Å²	60	71.2 Å²	71.2	31%	0.314	35%	0.347	S	S	.	.	H	α-helix	trans	-66.6	-44.4	-179.8	-66.3	173.2	0	0	0	111.9	V596 M597 D602 R603 F604	V596-L600 HydrophobicContact CG1-CD1 3.91Å; V596-L600 HydrophobicContact CG1-CG 4.27Å; V596-L600 VanDerWaalsContact O-CG 3.3Å; V596-L600 WeakPolarHBondContact O-CG 3.06Å; V596-L600 PolarHBondContact O-N 2.89Å; M597-L600 PolarHBondContact O-N 3.4Å; M597-L600 HydrophobicContact SD-CD1 4.15Å; L600-D602 PolarHBondContact O-N 3.17Å; L600-R603 PolarHBondContact O-N 3.28Å; L600-F604 HydrophobicContact CB-CD2 4.28Å; L600-F604 HydrophobicContact CB-CE2 4.46Å; L600-F604 HydrophobicContact CD2-CD2 4.49Å; L600-F604 HydrophobicContact CD2-CE2 3.86Å; L600-F604 WeakPolarHBondContact O-CB 3.41Å; L600-F604 WeakPolarHBondContact O-CD2 3.47Å; L600-F604 PolarHBondContact O-N 3.27Å
601	L	82.7	Confident	75.6	Confident	66 Å²	66	79.1 Å²	79.1	35%	0.346	38%	0.378	S	S	.	.	H	α-helix	trans	-64	-40.5	179.5	-73.1	173.3	0	0	0	112	M597 S605 L653	M597-L601 VanDerWaalsContact O-CB 3.3Å; M597-L601 WeakPolarHBondContact O-CB 3.47Å; M597-L601 VanDerWaalsContact O-CG 3.25Å; M597-L601 WeakPolarHBondContact O-CG 3.46Å; M597-L601 PolarHBondContact O-N 3.34Å; L601-S605 WeakPolarHBondContact O-CB 3.26Å; L601-S605 PolarHBondContact O-N 3.16Å; L601-L653 HydrophobicContact CD1-CD2 3.67Å
602	D	78.2	Confident	73.2	Confident	20 Å²	20	85.4 Å²	85.4	11%	0.107	42%	0.416	C	S	.	.	H	α-helix	trans	-73.6	-32.1	177.8	-150.1	57.8	0	0	0	111.9	L598 L600 L622 R646 S647	L598-D602 WeakPolarHBondContact O-CB 3.48Å; L598-D602 PolarHBondContact O-N 3.22Å; L600-D602 PolarHBondContact O-N 3.17Å; D602-L622 HydrophobicContact CB-CD1 4.49Å; D602-L622 VanDerWaalsContact OD2-CD1 3.28Å; D602-L622 WeakPolarHBondContact OD2-CD1 3.2Å; D602-R646 PolarHBondContact OD1-N 3.19Å; D602-S647 VanDerWaalsContact OD1-CB 3.26Å; D602-S647 WeakPolarHBondContact OD1-CB 3.38Å; D602-S647 PolarHBondContact OD1-N 3.17Å; D602-S647 PolarHBondContact OD1-OG 3.03Å
603	R	75.5	Confident	71	Confident	132 Å²	132	88.8 Å²	88.8	50%	0.498	44%	0.437	S	S	.	.	H	α-helix	trans	-71.6	-37.1	176.5	-177.2	60.6	174.2	172.7	-3.3	114	Y599 L600	Y599-R603 WeakPolarHBondContact O-CB 3.44Å; Y599-R603 PolarHBondContact O-N 3.24Å; L600-R603 PolarHBondContact O-N 3.28Å
604	F	74.2	Confident	68.5	Low	161 Å²	161	89.7 Å²	89.7	71%	0.706	45%	0.447	S	S	*	.	H	α-helix	trans	-96.6	-11.6	-176.2	-70.3	-62.7	0	0	0	114.2	L600	L600-F604 HydrophobicContact CB-CD2 4.28Å; L600-F604 HydrophobicContact CB-CE2 4.46Å; L600-F604 HydrophobicContact CD2-CD2 4.49Å; L600-F604 HydrophobicContact CD2-CE2 3.86Å; L600-F604 WeakPolarHBondContact O-CB 3.41Å; L600-F604 WeakPolarHBondContact O-CD2 3.47Å; L600-F604 PolarHBondContact O-N 3.27Å
605	S	69.4	Low	66.4	Low	18 Å²	18	98.4 Å²	98.4	13%	0.126	49%	0.486	C	S	.	.			trans	-68.9	126	177.5	-178.5	0	0	0	0	111.8	L601 F607 G608	L601-S605 WeakPolarHBondContact O-CB 3.26Å; L601-S605 PolarHBondContact O-N 3.16Å; S605-F607 PolarHBondContact O-N 3.22Å; S605-G608 PolarHBondContact O-N 3.28Å; S605-G608 VanDerWaalsContact O-N 3.17Å
606	P	61	Low	64.2	Low	97 Å²	97	106.8 Å²	106.8	63%	0.63	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-64.6	-19.4	178.6	23.7	-31.2	0	0	0	113.1
607	F	56.3	Low	62.1	Low	146 Å²	146	112.4 Å²	112.4	64%	0.64	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-86.4	-12.1	177.9	-66.7	-78.2	0	0	0	114.3	S605 R609 F610	S605-F607 PolarHBondContact O-N 3.22Å; F607-R609 PolarHBondContact O-N 3.45Å; F607-F610 HydrophobicContact CD1-CD2 4.26Å; F607-F610 HydrophobicContact CD1-CE2 4.42Å
608	G	56	Low	60.1	Low	23 Å²	23	116.7 Å²	116.7	24%	0.237	57%	0.566	C	S	.	*	G	3₁₀ helix	trans	-70.8	-11.6	172.8	0	0	0	0	0	113.7	S605	S605-G608 PolarHBondContact O-N 3.28Å; S605-G608 VanDerWaalsContact O-N 3.17Å
609	R	54.3	Low	58.5	Low	171 Å²	171	124.8 Å²	124.8	65%	0.645	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-112.1	6.5	-175.6	-79.3	-166.9	174.1	106.6	-4.6	115.8	F607 K611	F607-R609 PolarHBondContact O-N 3.45Å; R609-K611 PolarHBondContact O-N 2.94Å; R609-K611 VanDerWaalsContact O-N 3.13Å
610	F	46.2	Very low	57.1	Low	139 Å²	139	128.3 Å²	128.3	61%	0.61	63%	0.628	S	S	*	*			trans	-76.5	103.2	176.2	-91.8	-87.4	0	0	0	111.4	F607 R646	F607-F610 HydrophobicContact CD1-CD2 4.26Å; F607-F610 HydrophobicContact CD1-CE2 4.42Å; F610-R646 PolarHBondContact O-NH2 3.4Å
611	K	44.3	Very low	55.9	Low	193 Å²	193	129.1 Å²	129.1	84%	0.839	64%	0.643	S	S	*	*			trans	-76.3	113.2	164.5	-92.3	-176.5	170.1	-176.7	0	109.1	R609	R609-K611 PolarHBondContact O-N 2.94Å; R609-K611 VanDerWaalsContact O-N 3.13Å
612	V	41.6	Very low	55.1	Low	132 Å²	132	127.3 Å²	127.3	80%	0.8	63%	0.634	S	S	*	*			trans	-96.1	125.1	155.6	177.2	0	0	0	0	105.9	S614	V612-S614 PolarHBondContact O-N 2.86Å
613	N	43.5	Very low	54.9	Low	157 Å²	157	129.7 Å²	129.7	84%	0.84	65%	0.649	S	S	*	*			trans	-59.9	117.4	-178.1	-77.2	-15	0	0	0	111.8
614	S	41.1	Very low	55.1	Low	99 Å²	99	126.7 Å²	126.7	69%	0.692	64%	0.642	S	S	*	*			trans	-160	134.9	150.5	50.4	0	0	0	0	109.2	V612 E616	V612-S614 PolarHBondContact O-N 2.86Å; S614-E616 VanDerWaalsContact C-N 3.26Å; S614-E616 PolarHBondContact O-N 2.75Å
615	E	46	Very low	55.5	Low	207 Å²	207	122.2 Å²	122.2	97%	0.967	63%	0.631	S	S	*	*			trans	-74.5	55	-173.8	-65.6	176	138.8	0	0	114.1
616	E	43.8	Very low	56.1	Low	177 Å²	177	122.3 Å²	122.3	83%	0.827	63%	0.631	S	S	*	*	S	Bend	trans	-124.3	128.6	170.1	-73.9	-179.6	165.7	0	0	110.2	S614	S614-E616 VanDerWaalsContact C-N 3.26Å; S614-E616 PolarHBondContact O-N 2.75Å
617	E	44.5	Very low	57.3	Low	184 Å²	184	117.7 Å²	117.7	86%	0.86	60%	0.602	S	S	*	*			trans	15.9	122.3	176	-65.8	177.7	165.2	0	0	119.2	E619	E617-E619 PolarHBondContact O-N 3.18Å
618	E	47.4	Very low	58.7	Low	188 Å²	188	114 Å²	114	88%	0.879	59%	0.587	S	S	*	*			trans	-58.4	92.6	172.2	-78.6	-178.6	141.4	0	0	111.6	D620	E618-D620 PolarHBondContact O-N 2.67Å
619	E	52.1	Low	60.2	Low	178 Å²	178	120.6 Å²	120.6	83%	0.832	61%	0.605	S	S	*	*			trans	-77.1	102.5	161.3	-70.9	-170.7	170.1	0	0	109.1	E617	E617-E619 PolarHBondContact O-N 3.18Å
620	D	56.3	Low	61.8	Low	147 Å²	147	114.3 Å²	114.3	79%	0.786	58%	0.583	S	S	*	*			trans	-60.1	146.9	179.6	-86.6	-32.9	0	0	0	112.7	E618	E618-D620 PolarHBondContact O-N 2.67Å
621	A	58.9	Low	63.8	Low	77 Å²	77	107.7 Å²	107.7	64%	0.636	55%	0.554	S	S	*	*			trans	-59.9	147.6	174.5	0	0	0	0	0	111.9	T623	A621-T623 PolarHBondContact O-N 3.43Å
622	L	65.6	Low	65.9	Low	28 Å²	28	103 Å²	103	15%	0.147	53%	0.531	C	S	.	.			trans	-52.3	111.8	-179.9	-95.8	139.9	0	0	0	112	D602 A627 A644 P645	D602-L622 HydrophobicContact CB-CD1 4.49Å; D602-L622 VanDerWaalsContact OD2-CD1 3.28Å; D602-L622 WeakPolarHBondContact OD2-CD1 3.2Å; L622-A627 HydrophobicContact CD2-CB 4.26Å; L622-A644 WeakPolarHBondContact CD1-O 3.34Å; L622-P645 HydrophobicContact CD1-CB 4.43Å
623	T	74.5	Confident	68.1	Low	69 Å²	69	97.1 Å²	97.1	42%	0.423	50%	0.496	S	S	.	.			trans	-77.8	154.6	169.8	63.7	0	0	0	0	110.3	A621 S625 S626 A627	A621-T623 PolarHBondContact O-N 3.43Å; T623-S625 PolarHBondContact O-N 2.98Å; T623-S625 PolarHBondContact OG1-OG 3.46Å; T623-S625 VanDerWaalsContact OG1-OG 3.04Å; T623-S626 WeakPolarHBondContact CA-OG 3.08Å; T623-S626 PolarHBondContact N-OG 3.07Å; T623-S626 PolarHBondContact O-N 2.7Å; T623-S626 PolarHBondContact O-OG 3.4Å; T623-S626 PolarHBondContact OG1-N 2.9Å; T623-S626 PolarHBondContact OG1-OG 3.44Å; T623-A627 PolarHBondContact O-N 3.17Å
624	L	79.9	Confident	70.3	Confident	69 Å²	69	91.3 Å²	91.3	36%	0.361	47%	0.467	S	S	.	.	H	α-helix	trans	-54.7	-36.5	177.2	-178.8	67.4	0	0	0	111.9	V596 Y599 A627 M628	V596-L624 HydrophobicContact CG2-CD1 4.29Å; Y599-L624 HydrophobicContact CD1-CD1 3.99Å; Y599-L624 HydrophobicContact CD2-CB 4.19Å; Y599-L624 HydrophobicContact CE2-CB 4.35Å; Y599-L624 HydrophobicContact CG-CB 4.32Å; Y599-L624 HydrophobicContact CG-CD1 3.96Å; L624-A627 PolarHBondContact O-N 3.42Å; L624-M628 HydrophobicContact CD1-CE 4.13Å; L624-M628 HydrophobicContact CD2-CE 3.72Å; L624-M628 HydrophobicContact CG-CE 3.51Å; L624-M628 WeakPolarHBondContact O-CG 3.29Å; L624-M628 PolarHBondContact O-N 3.15Å
625	S	82.4	Confident	72.5	Confident	67 Å²	67	87.6 Å²	87.6	47%	0.469	44%	0.439	S	S	.	.	H	α-helix	trans	-65.9	-43.4	174.1	40.7	0	0	0	0	112.9	T623 A627 M628 W629	T623-S625 PolarHBondContact O-N 2.98Å; T623-S625 PolarHBondContact OG1-OG 3.46Å; T623-S625 VanDerWaalsContact OG1-OG 3.04Å; S625-A627 VanDerWaalsContact C-N 3.32Å; S625-A627 PolarHBondContact O-N 3.41Å; S625-M628 PolarHBondContact O-N 3.02Å; S625-W629 PolarHBondContact O-N 2.77Å
626	S	83.3	Confident	74.6	Confident	20 Å²	20	83.2 Å²	83.2	14%	0.14	42%	0.421	C	S	.	.	H	α-helix	trans	-65.2	-34.5	175.9	51.1	0	0	0	0	112.5	T623 F630	T623-S626 WeakPolarHBondContact CA-OG 3.08Å; T623-S626 PolarHBondContact N-OG 3.07Å; T623-S626 PolarHBondContact O-N 2.7Å; T623-S626 PolarHBondContact O-OG 3.4Å; T623-S626 PolarHBondContact OG1-N 2.9Å; T623-S626 PolarHBondContact OG1-OG 3.44Å; S626-F630 VanDerWaalsContact O-CB 3.3Å; S626-F630 WeakPolarHBondContact O-CB 3.3Å; S626-F630 PolarHBondContact O-N 3.5Å
627	A	84.8	Confident	76.7	Confident	1 Å²	1	79.7 Å²	79.7	1%	0.008	41%	0.409	C	S	.	.	H	α-helix	trans	-70	-36	174.7	0	0	0	0	0	112.7	L622 T623 L624 S625 S631	L622-A627 HydrophobicContact CD2-CB 4.26Å; T623-A627 PolarHBondContact O-N 3.17Å; L624-A627 PolarHBondContact O-N 3.42Å; S625-A627 VanDerWaalsContact C-N 3.32Å; S625-A627 PolarHBondContact O-N 3.41Å; A627-S631 PolarHBondContact O-N 2.83Å
628	M	86.9	Confident	78.7	Confident	68 Å²	68	73.2 Å²	73.2	34%	0.335	38%	0.384	S	S	.	.	H	α-helix	trans	-65.8	-46.3	172.3	-74.7	-168.3	-128.4	0	0	112	A595 L624 S625 F630 S631 W632	A595-M628 HydrophobicContact CB-CB 4.42Å; A595-M628 HydrophobicContact CB-CG 3.89Å; L624-M628 HydrophobicContact CD1-CE 4.13Å; L624-M628 HydrophobicContact CD2-CE 3.72Å; L624-M628 HydrophobicContact CG-CE 3.51Å; L624-M628 WeakPolarHBondContact O-CG 3.29Å; L624-M628 PolarHBondContact O-N 3.15Å; S625-M628 PolarHBondContact O-N 3.02Å; M628-F630 VanDerWaalsContact C-N 3.33Å; M628-F630 PolarHBondContact O-N 3.49Å; M628-S631 PolarHBondContact O-N 3.13Å; M628-W632 PolarHBondContact O-N 2.92Å
629	W	87.5	Confident	80.2	Confident	161 Å²	161	68.4 Å²	68.4	61%	0.61	38%	0.384	S	S	*	.	H	α-helix	trans	-62	-40.2	175.7	-79.3	115.7	0	0	0	112	S625 G633	S625-W629 PolarHBondContact O-N 2.77Å; W629-G633 WeakPolarHBondContact O-CA 3.44Å; W629-G633 PolarHBondContact O-N 3.46Å
630	F	86.6	Confident	81.4	Confident	40 Å²	40	65.3 Å²	65.3	18%	0.175	37%	0.372	C	S	.	.	H	α-helix	trans	-60.1	-47.7	173.7	178	-95.2	0	0	0	112.2	L598 S626 M628 G633 V634 P645	L598-F630 HydrophobicContact CD1-CD1 3.73Å; L598-F630 HydrophobicContact CD1-CE1 3.88Å; S626-F630 VanDerWaalsContact O-CB 3.3Å; S626-F630 WeakPolarHBondContact O-CB 3.3Å; S626-F630 PolarHBondContact O-N 3.5Å; M628-F630 VanDerWaalsContact C-N 3.33Å; M628-F630 PolarHBondContact O-N 3.49Å; F630-G633 PolarHBondContact O-N 3.19Å; F630-V634 HydrophobicContact CE1-CG2 4.34Å; F630-V634 HydrophobicContact CE2-CG2 4.31Å; F630-V634 HydrophobicContact CZ-CG2 4.15Å; F630-V634 WeakPolarHBondContact O-CG2 3.31Å; F630-V634 PolarHBondContact O-N 3.28Å; F630-P645 HydrophobicContact CZ-CG 4.16Å
631	S	87.9	Confident	82	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-66.5	-42.6	-178.8	-172.4	0	0	0	0	112.9	V591 A627 M628 L635 W657	V591-S631 PolarHBondContact O-OG 3.06Å; A627-S631 PolarHBondContact O-N 2.83Å; M628-S631 PolarHBondContact O-N 3.13Å; S631-L635 PolarHBondContact O-N 3.49Å; S631-W657 PolarHBondContact O-NE1 3.19Å; S631-W657 VanDerWaalsContact O-NE1 3.11Å; S631-W657 WeakPolarHBondContact OG-CZ2 3.39Å; S631-W657 PolarHBondContact OG-NE1 3.45Å
632	W	89.6	Confident	82.2	Confident	94 Å²	94	66.4 Å²	66.4	36%	0.356	37%	0.37	S	S	.	.	H	α-helix	trans	-67.1	-39.9	174	-88.5	103.7	0	0	0	112.9	V591 H592 M628 L635 L636	V591-W632 HydrophobicContact CG1-CD2 4.01Å; V591-W632 HydrophobicContact CG1-CG 3.91Å; H592-W632 AromaticContact CE1-NE1 3.89Å; H592-W632 AromaticContact NE2-NE1 3.97Å; M628-W632 PolarHBondContact O-N 2.92Å; W632-L635 PolarHBondContact O-N 3.12Å; W632-L636 HydrophobicContact CE3-CD1 3.83Å; W632-L636 HydrophobicContact CE3-CG 4.13Å; W632-L636 HydrophobicContact CZ3-CD1 4.37Å; W632-L636 WeakPolarHBondContact O-CB 3.12Å; W632-L636 WeakPolarHBondContact O-CG 3.46Å; W632-L636 PolarHBondContact O-N 3.24Å
633	G	88.1	Confident	82.3	Confident	8 Å²	8	65.9 Å²	65.9	8%	0.082	37%	0.372	C	S	.	.	H	α-helix	trans	-60.5	-45.8	178.3	0	0	0	0	0	111.9	W629 F630 L635 L636 N637 S638	W629-G633 WeakPolarHBondContact O-CA 3.44Å; W629-G633 PolarHBondContact O-N 3.46Å; F630-G633 PolarHBondContact O-N 3.19Å; G633-L635 PolarHBondContact O-N 2.93Å; G633-L636 PolarHBondContact O-N 3.47Å; G633-N637 PolarHBondContact O-N 3.07Å; G633-N637 VanDerWaalsContact O-N 3.11Å; G633-S638 CarbonylContact C-O 3.51Å; G633-S638 WeakPolarHBondContact CA-O 3.49Å; G633-S638 PolarHBondContact O-N 3.36Å
634	V	88.6	Confident	82.3	Confident	35 Å²	35	66.3 Å²	66.3	21%	0.212	38%	0.383	C	S	.	.	H	α-helix	trans	-63.7	-40.9	176.5	173.2	0	0	0	0	112.1	F630 N637 A658 A661	F630-V634 HydrophobicContact CE1-CG2 4.34Å; F630-V634 HydrophobicContact CE2-CG2 4.31Å; F630-V634 HydrophobicContact CZ-CG2 4.15Å; F630-V634 WeakPolarHBondContact O-CG2 3.31Å; F630-V634 PolarHBondContact O-N 3.28Å; V634-N637 PolarHBondContact O-N 3.38Å; V634-A658 HydrophobicContact CG1-CB 3.84Å; V634-A661 HydrophobicContact CG1-CB 4.1Å
635	L	88.6	Confident	82.1	Confident	22 Å²	22	63.7 Å²	63.7	12%	0.115	37%	0.37	C	S	.	.	H	α-helix	trans	-67.4	-40.4	178.6	-179.1	64.9	0	0	0	112.5	V587 V591 S631 W632 G633 N637 W657 A661	V587-L635 HydrophobicContact CG1-CD1 4.45Å; V587-L635 HydrophobicContact CG1-CD2 3.95Å; V591-L635 HydrophobicContact CG2-CD2 3.49Å; V591-L635 VanDerWaalsContact CG2-CD2 3.49Å; S631-L635 PolarHBondContact O-N 3.49Å; W632-L635 PolarHBondContact O-N 3.12Å; G633-L635 PolarHBondContact O-N 2.93Å; L635-N637 VanDerWaalsContact C-N 3.27Å; L635-N637 PolarHBondContact O-N 3.33Å; L635-W657 HydrophobicContact CB-CZ2 4.27Å; L635-A661 HydrophobicContact CD1-CB 4.15Å
636	L	89.4	Confident	81.7	Confident	114 Å²	114	67.1 Å²	67.1	60%	0.597	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	3.1	-177.7	-65.5	175.6	0	0	0	113.3	W632 G633 S638	W632-L636 HydrophobicContact CE3-CD1 3.83Å; W632-L636 HydrophobicContact CE3-CG 4.13Å; W632-L636 HydrophobicContact CZ3-CD1 4.37Å; W632-L636 WeakPolarHBondContact O-CB 3.12Å; W632-L636 WeakPolarHBondContact O-CG 3.46Å; W632-L636 PolarHBondContact O-N 3.24Å; G633-L636 PolarHBondContact O-N 3.47Å; L636-S638 PolarHBondContact O-N 2.68Å
637	N	87.4	Confident	81.5	Confident	104 Å²	104	66.2 Å²	66.2	56%	0.556	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	34.8	-169.5	-68.4	-44.5	0	0	0	112.5	G633 V634 L635	G633-N637 PolarHBondContact O-N 3.07Å; G633-N637 VanDerWaalsContact O-N 3.11Å; V634-N637 PolarHBondContact O-N 3.38Å; L635-N637 VanDerWaalsContact C-N 3.27Å; L635-N637 PolarHBondContact O-N 3.33Å
638	S	86.8	Confident	81.3	Confident	48 Å²	48	73.9 Å²	73.9	34%	0.336	40%	0.4	S	S	.	.			trans	-99.5	128.2	179.5	-177.2	0	0	0	0	109.9	G633 L636 I640	G633-S638 CarbonylContact C-O 3.51Å; G633-S638 WeakPolarHBondContact CA-O 3.49Å; G633-S638 PolarHBondContact O-N 3.36Å; L636-S638 PolarHBondContact O-N 2.68Å; S638-I640 PolarHBondContact O-N 3.47Å; S638-I640 VanDerWaalsContact O-N 3.08Å
639	G	79	Confident	81.2	Confident	87 Å²	87	73 Å²	73	90%	0.897	40%	0.4	S	S	*	.			trans	-74.8	13.3	179.3	0	0	0	0	0	115	G641	G639-G641 PolarHBondContact O-N 3.13Å
640	I	76.5	Confident	81	Confident	112 Å²	112	65.4 Å²	65.4	57%	0.574	37%	0.371	S	S	*	.			trans	-86.7	93	-178.2	-59.4	170	0	0	0	108.4	S638	S638-I640 PolarHBondContact O-N 3.47Å; S638-I640 VanDerWaalsContact O-N 3.08Å
641	G	70	Confident	81	Confident	41 Å²	41	69.9 Å²	69.9	42%	0.423	39%	0.387	S	S	.	.			trans	-158.4	101.9	174.4	0	0	0	0	0	111.1	G639 G643	G639-G641 PolarHBondContact O-N 3.13Å; G641-G643 PolarHBondContact O-N 3.02Å; G641-G643 VanDerWaalsContact O-N 3.15Å
642	E	62	Low	81	Confident	206 Å²	206	73.8 Å²	73.8	96%	0.963	41%	0.407	S	S	*	.	S	Bend	trans	-79.3	19	178.6	-64	-177.7	169.3	0	0	113.1
643	G	67.6	Low	81	Confident	17 Å²	17	71.8 Å²	71.8	18%	0.175	40%	0.403	C	S	.	.			trans	-157.6	120.8	-179.3	0	0	0	0	0	113.2	G641	G641-G643 PolarHBondContact O-N 3.02Å; G641-G643 VanDerWaalsContact O-N 3.15Å
644	A	74.4	Confident	80.9	Confident	79 Å²	79	71.8 Å²	71.8	65%	0.653	40%	0.403	S	S	*	.			trans	-104.8	141.2	175.8	0	0	0	0	0	111.1	L622 R646	L622-A644 WeakPolarHBondContact CD1-O 3.34Å; A644-R646 PolarHBondContact O-N 2.93Å
645	P	77.3	Confident	80.9	Confident	14 Å²	14	76.4 Å²	76.4	9%	0.091	42%	0.424	C	S	.	.			trans	-60.3	124.7	179.9	22.3	-31.3	0	0	0	112.2	L622 F630 A650 R651	L622-P645 HydrophobicContact CD1-CB 4.43Å; F630-P645 HydrophobicContact CZ-CG 4.16Å; P645-A650 HydrophobicContact CB-CB 3.53Å; P645-R651 HydrophobicContact CB-CG 4.39Å; P645-R651 HydrophobicContact CG-CG 4.29Å; P645-R651 VanDerWaalsContact O-CG 3.25Å; P645-R651 WeakPolarHBondContact O-CG 3.3Å; P645-R651 PolarHBondContact O-NE 2.95Å
646	R	73	Confident	81.1	Confident	138 Å²	138	80 Å²	80	52%	0.521	45%	0.446	S	S	.	.			trans	-87	-39.3	-179.8	-168.7	176.6	176.6	145.4	-1.7	111.7	D602 F610 A644	D602-R646 PolarHBondContact OD1-N 3.19Å; F610-R646 PolarHBondContact O-NH2 3.4Å; A644-R646 PolarHBondContact O-N 2.93Å
647	S	79.3	Confident	81.2	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.007	42%	0.42	C	S	.	.	S	Bend	trans	-68.3	141.4	179.7	58.8	0	0	0	0	112.7	D602 S649 A650 R651	D602-S647 VanDerWaalsContact OD1-CB 3.26Å; D602-S647 WeakPolarHBondContact OD1-CB 3.38Å; D602-S647 PolarHBondContact OD1-N 3.17Å; D602-S647 PolarHBondContact OD1-OG 3.03Å; S647-S649 VanDerWaalsContact C-N 3.28Å; S647-S649 PolarHBondContact O-N 2.92Å; S647-A650 PolarHBondContact O-N 3.43Å; S647-A650 VanDerWaalsContact O-N 3.17Å; S647-A650 WeakPolarHBondContact OG-CB 3.28Å; S647-A650 PolarHBondContact OG-N 3.01Å; S647-R651 WeakPolarHBondContact O-CG 3.18Å; S647-R651 PolarHBondContact O-N 3.36Å
648	F	81.5	Confident	81.3	Confident	163 Å²	163	71.9 Å²	71.9	72%	0.715	41%	0.408	S	S	*	.	H	α-helix	trans	-58.6	-40.5	179.2	-175.3	-99.6	0	0	0	112	R651 I652	F648-R651 PolarHBondContact O-N 3.21Å; F648-I652 HydrophobicContact CD1-CG1 4.44Å; F648-I652 HydrophobicContact CE1-CG1 4.09Å; F648-I652 HydrophobicContact CZ-CD1 4.29Å; F648-I652 HydrophobicContact CZ-CG1 4.28Å; F648-I652 WeakPolarHBondContact O-CG1 3.41Å; F648-I652 PolarHBondContact O-N 3.01Å; F648-I652 VanDerWaalsContact O-N 3.11Å
649	S	84.3	Confident	81.6	Confident	50 Å²	50	71.3 Å²	71.3	35%	0.35	41%	0.409	S	S	.	.	H	α-helix	trans	-61.3	-44.2	174.9	47.3	0	0	0	0	112.7	S647 I652 L653	S647-S649 VanDerWaalsContact C-N 3.28Å; S647-S649 PolarHBondContact O-N 2.92Å; S649-I652 PolarHBondContact O-N 2.03Å; S649-L653 PolarHBondContact O-N 3.37Å
650	A	83	Confident	82.2	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-70.8	-30.5	177.9	0	0	0	0	0	112.6	L598 P645 S647 L653 G654	L598-A650 HydrophobicContact CD2-CB 3.93Å; L598-A650 WeakPolarHBondContact CD2-O 3.02Å; P645-A650 HydrophobicContact CB-CB 3.53Å; S647-A650 PolarHBondContact O-N 3.43Å; S647-A650 VanDerWaalsContact O-N 3.17Å; S647-A650 WeakPolarHBondContact OG-CB 3.28Å; S647-A650 PolarHBondContact OG-N 3.01Å; A650-L653 PolarHBondContact O-N 2.96Å; A650-G654 PolarHBondContact O-N 3.2Å
651	R	86.1	Confident	82.8	Confident	135 Å²	135	65.6 Å²	65.6	51%	0.509	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-44.3	172.7	-73.4	-178.3	-178.7	178.2	-0.7	112.3	P645 S647 F648 G654 M655	P645-R651 HydrophobicContact CB-CG 4.39Å; P645-R651 HydrophobicContact CG-CG 4.29Å; P645-R651 VanDerWaalsContact O-CG 3.25Å; P645-R651 WeakPolarHBondContact O-CG 3.3Å; P645-R651 PolarHBondContact O-NE 2.95Å; S647-R651 WeakPolarHBondContact O-CG 3.18Å; S647-R651 PolarHBondContact O-N 3.36Å; F648-R651 PolarHBondContact O-N 3.21Å; R651-G654 PolarHBondContact O-N 2.84Å; R651-M655 WeakPolarHBondContact O-CG 3.44Å; R651-M655 PolarHBondContact O-N 2.79Å
652	I	89.2	Confident	83.7	Confident	82 Å²	82	69 Å²	69	42%	0.421	36%	0.362	S	S	.	.	H	α-helix	trans	-63.6	-45.3	175.5	-63.9	-62.7	0	0	0	110.6	F648 S649 G654 M655 V656	F648-I652 HydrophobicContact CD1-CG1 4.44Å; F648-I652 HydrophobicContact CE1-CG1 4.09Å; F648-I652 HydrophobicContact CZ-CD1 4.29Å; F648-I652 HydrophobicContact CZ-CG1 4.28Å; F648-I652 WeakPolarHBondContact O-CG1 3.41Å; F648-I652 PolarHBondContact O-N 3.01Å; F648-I652 VanDerWaalsContact O-N 3.11Å; S649-I652 PolarHBondContact O-N 2.03Å; I652-G654 VanDerWaalsContact C-N 3.3Å; I652-G654 PolarHBondContact O-N 3.21Å; I652-M655 HydrophobicContact CD1-SD 4.44Å; I652-M655 PolarHBondContact O-N 3.28Å; I652-V656 WeakPolarHBondContact O-CG2 3.19Å; I652-V656 PolarHBondContact O-N 3.12Å
653	L	88.8	Confident	85.2	Confident	52 Å²	52	64.1 Å²	64.1	27%	0.272	34%	0.342	S	S	.	.	H	α-helix	trans	-60.6	-40.5	175.5	-174.7	64.8	0	0	0	111.8	M597 L598 L601 S649 A650 V656 W657	M597-L653 HydrophobicContact CB-CD2 4.15Å; L598-L653 HydrophobicContact CD2-CB 4.1Å; L598-L653 HydrophobicContact CD2-CD2 3.84Å; L598-L653 HydrophobicContact CD2-CG 4.1Å; L598-L653 HydrophobicContact CG-CD2 4.02Å; L601-L653 HydrophobicContact CD1-CD2 3.67Å; S649-L653 PolarHBondContact O-N 3.37Å; A650-L653 PolarHBondContact O-N 2.96Å; L653-V656 PolarHBondContact O-N 2.67Å; L653-W657 WeakPolarHBondContact O-CB 3.49Å; L653-W657 PolarHBondContact O-N 3.01Å
654	G	86.9	Confident	86.3	Confident	7 Å²	7	64.7 Å²	64.7	7%	0.072	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-39	175.5	0	0	0	0	0	113.6	A650 R651 I652 W657 A658	A650-G654 PolarHBondContact O-N 3.2Å; R651-G654 PolarHBondContact O-N 2.84Å; I652-G654 VanDerWaalsContact C-N 3.3Å; I652-G654 PolarHBondContact O-N 3.21Å; G654-W657 PolarHBondContact O-N 3.47Å; G654-A658 WeakPolarHBondContact O-CB 3.15Å; G654-A658 PolarHBondContact O-N 2.77Å
655	M	88.1	Confident	87.1	Confident	133 Å²	133	63.3 Å²	63.3	66%	0.655	32%	0.324	S	S	*	.	H	α-helix	trans	-64.5	-43.9	173.9	-74.1	176.8	177.5	0	0	111.8	R651 I652 A658 G659	R651-M655 WeakPolarHBondContact O-CG 3.44Å; R651-M655 PolarHBondContact O-N 2.79Å; I652-M655 HydrophobicContact CD1-SD 4.44Å; I652-M655 PolarHBondContact O-N 3.28Å; M655-A658 PolarHBondContact O-N 3.29Å; M655-G659 PolarHBondContact O-N 2.78Å
656	V	92.5	Very high	87.7	Confident	97 Å²	97	65 Å²	65	59%	0.588	34%	0.339	S	S	*	.	H	α-helix	trans	-65.5	-40.8	176.5	174.6	0	0	0	0	111	I652 L653 G659 F660	I652-V656 WeakPolarHBondContact O-CG2 3.19Å; I652-V656 PolarHBondContact O-N 3.12Å; L653-V656 PolarHBondContact O-N 2.67Å; V656-G659 PolarHBondContact O-N 2.79Å; V656-F660 PolarHBondContact O-N 3.04Å
657	W	91.6	Very high	88.6	Confident	11 Å²	11	61 Å²	61	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-61	-43.3	174.8	176.2	-113.4	0	0	0	112.3	V591 V594 S631 L635 L653 G654 G659 F660 A661	V591-W657 HydrophobicContact CB-CH2 4.25Å; V591-W657 HydrophobicContact CB-CZ2 4.27Å; V591-W657 HydrophobicContact CG2-CH2 3.63Å; V591-W657 HydrophobicContact CG2-CZ2 3.69Å; V594-W657 HydrophobicContact CB-CD2 4.39Å; V594-W657 HydrophobicContact CB-CE3 4.21Å; V594-W657 HydrophobicContact CB-CZ3 4.45Å; V594-W657 HydrophobicContact CG1-CB 4.24Å; V594-W657 HydrophobicContact CG1-CD2 3.9Å; V594-W657 HydrophobicContact CG1-CE3 4.09Å; V594-W657 HydrophobicContact CG1-CG 3.96Å; V594-W657 HydrophobicContact CG2-CD2 4.38Å; V594-W657 HydrophobicContact CG2-CE3 3.73Å; V594-W657 HydrophobicContact CG2-CZ3 3.91Å; S631-W657 PolarHBondContact O-NE1 3.19Å; S631-W657 VanDerWaalsContact O-NE1 3.11Å; S631-W657 WeakPolarHBondContact OG-CZ2 3.39Å; S631-W657 PolarHBondContact OG-NE1 3.45Å; L635-W657 HydrophobicContact CB-CZ2 4.27Å; L653-W657 WeakPolarHBondContact O-CB 3.49Å; L653-W657 PolarHBondContact O-N 3.01Å; G654-W657 PolarHBondContact O-N 3.47Å; W657-G659 VanDerWaalsContact C-N 3.35Å; W657-G659 PolarHBondContact O-N 2.91Å; W657-F660 AromaticContact CE3-CD1 3.83Å; W657-F660 HydrophobicContact CE3-CD1 3.83Å; W657-F660 HydrophobicContact CH2-CD1 4.23Å; W657-F660 HydrophobicContact CH2-CE1 4.31Å; W657-F660 AromaticContact CZ3-CD1 3.5Å; W657-F660 HydrophobicContact CZ3-CD1 3.5Å; W657-F660 VanDerWaalsContact CZ3-CD1 3.5Å; W657-F660 AromaticContact CZ3-CE1 3.79Å; W657-F660 HydrophobicContact CZ3-CE1 3.79Å; W657-F660 PolarHBondContact O-N 3.46Å; W657-A661 WeakPolarHBondContact O-CB 3.36Å; W657-A661 PolarHBondContact O-N 2.82Å
658	A	89.9	Confident	89.1	Confident	37 Å²	37	63.6 Å²	63.6	31%	0.306	34%	0.342	S	S	.	.	H	α-helix	trans	-62.8	-40.5	175.1	0	0	0	0	0	112.3	V634 G654 M655 A661 M662	V634-A658 HydrophobicContact CG1-CB 3.84Å; G654-A658 WeakPolarHBondContact O-CB 3.15Å; G654-A658 PolarHBondContact O-N 2.77Å; M655-A658 PolarHBondContact O-N 3.29Å; A658-A661 PolarHBondContact O-N 3.27Å; A658-M662 WeakPolarHBondContact O-CG 3.48Å; A658-M662 PolarHBondContact O-N 3.18Å
659	G	91.9	Very high	89.5	Confident	35 Å²	35	59.6 Å²	59.6	36%	0.361	33%	0.331	S	S	.	.	H	α-helix	trans	-60.7	-45.4	172.3	0	0	0	0	0	112.5	M655 V656 W657 M662 I663	M655-G659 PolarHBondContact O-N 2.78Å; V656-G659 PolarHBondContact O-N 2.79Å; W657-G659 VanDerWaalsContact C-N 3.35Å; W657-G659 PolarHBondContact O-N 2.91Å; G659-M662 PolarHBondContact O-N 2.81Å; G659-I663 VanDerWaalsContact O-CG1 3.29Å; G659-I663 WeakPolarHBondContact O-CG1 3.35Å; G659-I663 PolarHBondContact O-N 3.11Å
660	F	91.6	Very high	89.8	Confident	79 Å²	79	60.1 Å²	60.1	35%	0.346	34%	0.338	S	S	.	.	H	α-helix	trans	-62.2	-44.1	175.9	176.3	-100.4	0	0	0	112.5	V656 W657 M662 I663 I664	V656-F660 PolarHBondContact O-N 3.04Å; W657-F660 AromaticContact CE3-CD1 3.83Å; W657-F660 HydrophobicContact CE3-CD1 3.83Å; W657-F660 HydrophobicContact CH2-CD1 4.23Å; W657-F660 HydrophobicContact CH2-CE1 4.31Å; W657-F660 AromaticContact CZ3-CD1 3.5Å; W657-F660 HydrophobicContact CZ3-CD1 3.5Å; W657-F660 VanDerWaalsContact CZ3-CD1 3.5Å; W657-F660 AromaticContact CZ3-CE1 3.79Å; W657-F660 HydrophobicContact CZ3-CE1 3.79Å; W657-F660 PolarHBondContact O-N 3.46Å; F660-M662 PolarHBondContact O-N 2.94Å; F660-I663 WeakPolarHBondContact O-CB 3.44Å; F660-I663 PolarHBondContact O-N 3.03Å; F660-I664 HydrophobicContact CD1-CG1 4.3Å; F660-I664 HydrophobicContact CE1-CD1 4.41Å; F660-I664 HydrophobicContact CE1-CG1 3.82Å; F660-I664 HydrophobicContact CE2-CD1 4.12Å; F660-I664 HydrophobicContact CE2-CG1 4.09Å; F660-I664 HydrophobicContact CZ-CD1 3.82Å; F660-I664 HydrophobicContact CZ-CG1 3.7Å; F660-I664 WeakPolarHBondContact O-CG1 3.29Å; F660-I664 PolarHBondContact O-N 3.37Å
661	A	89.9	Confident	90	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.008	36%	0.358	C	S	.	.	H	α-helix	trans	-59.1	-45.7	176.5	0	0	0	0	0	112.1	V634 L635 W657 A658 I663 I664 V665	V634-A661 HydrophobicContact CG1-CB 4.1Å; L635-A661 HydrophobicContact CD1-CB 4.15Å; W657-A661 WeakPolarHBondContact O-CB 3.36Å; W657-A661 PolarHBondContact O-N 2.82Å; A658-A661 PolarHBondContact O-N 3.27Å; A661-I663 VanDerWaalsContact C-N 3.33Å; A661-I663 PolarHBondContact O-N 3.13Å; A661-I664 PolarHBondContact O-N 3.48Å; A661-V665 WeakPolarHBondContact O-CG2 3.28Å; A661-V665 PolarHBondContact O-N 3.35Å
662	M	89.5	Confident	89.8	Confident	111 Å²	111	59.3 Å²	59.3	55%	0.547	34%	0.344	S	S	.	.	H	α-helix	trans	-61.3	-39.7	175.2	-75.7	-61.4	-63	0	0	112.4	A658 G659 F660 V665 A666	A658-M662 WeakPolarHBondContact O-CG 3.48Å; A658-M662 PolarHBondContact O-N 3.18Å; G659-M662 PolarHBondContact O-N 2.81Å; F660-M662 PolarHBondContact O-N 2.94Å; M662-V665 PolarHBondContact O-N 2.8Å; M662-A666 WeakPolarHBondContact O-CB 3.27Å; M662-A666 PolarHBondContact O-N 3.27Å
663	I	92.6	Very high	89.4	Confident	105 Å²	105	58.1 Å²	58.1	54%	0.538	35%	0.346	S	S	.	.	H	α-helix	trans	-63.3	-42.3	175.8	-69.5	165.2	0	0	0	111	G659 F660 A661 A666 S667	G659-I663 VanDerWaalsContact O-CG1 3.29Å; G659-I663 WeakPolarHBondContact O-CG1 3.35Å; G659-I663 PolarHBondContact O-N 3.11Å; F660-I663 WeakPolarHBondContact O-CB 3.44Å; F660-I663 PolarHBondContact O-N 3.03Å; A661-I663 VanDerWaalsContact C-N 3.33Å; A661-I663 PolarHBondContact O-N 3.13Å; I663-A666 PolarHBondContact O-N 3.15Å; I663-S667 VanDerWaalsContact O-CB 3.25Å; I663-S667 WeakPolarHBondContact O-CB 3.49Å; I663-S667 PolarHBondContact O-N 3.37Å; I663-S667 PolarHBondContact O-OG 3.49Å
664	I	91.2	Very high	89.1	Confident	28 Å²	28	57.7 Å²	57.7	14%	0.144	35%	0.35	C	S	.	.	H	α-helix	trans	-64.2	-46.7	178.4	-69	-65.7	0	0	0	111.2	F579 V587 F660 A661 S667 Y668	F579-I664 HydrophobicContact CE2-CG2 4.08Å; F579-I664 HydrophobicContact CZ-CG2 4.41Å; V587-I664 HydrophobicContact CG2-CD1 4.31Å; F660-I664 HydrophobicContact CD1-CG1 4.3Å; F660-I664 HydrophobicContact CE1-CD1 4.41Å; F660-I664 HydrophobicContact CE1-CG1 3.82Å; F660-I664 HydrophobicContact CE2-CD1 4.12Å; F660-I664 HydrophobicContact CE2-CG1 4.09Å; F660-I664 HydrophobicContact CZ-CD1 3.82Å; F660-I664 HydrophobicContact CZ-CG1 3.7Å; F660-I664 WeakPolarHBondContact O-CG1 3.29Å; F660-I664 PolarHBondContact O-N 3.37Å; A661-I664 PolarHBondContact O-N 3.48Å; I664-S667 PolarHBondContact O-N 3.13Å; I664-Y668 PolarHBondContact O-N 3.26Å
665	V	90.1	Very high	88.5	Confident	50 Å²	50	61 Å²	61	30%	0.303	36%	0.363	S	S	.	.	H	α-helix	trans	-63.1	-46.6	177.3	174.9	0	0	0	0	110.9	A661 M662 S667 Y668 T669	A661-V665 WeakPolarHBondContact O-CG2 3.28Å; A661-V665 PolarHBondContact O-N 3.35Å; M662-V665 PolarHBondContact O-N 2.8Å; V665-S667 VanDerWaalsContact C-N 3.31Å; V665-S667 PolarHBondContact O-N 3.44Å; V665-Y668 PolarHBondContact O-N 3.03Å; V665-T669 WeakPolarHBondContact O-CG2 3.46Å; V665-T669 PolarHBondContact O-N 2.94Å; V665-T669 PolarHBondContact O-OG1 3.45Å
666	A	90.8	Very high	87.9	Confident	51 Å²	51	58 Å²	58	42%	0.421	35%	0.349	S	S	.	.	H	α-helix	trans	-58.2	-44.3	176.1	0	0	0	0	0	111.5	M662 I663 Y668 T669 A670	M662-A666 WeakPolarHBondContact O-CB 3.27Å; M662-A666 PolarHBondContact O-N 3.27Å; I663-A666 PolarHBondContact O-N 3.15Å; A666-Y668 PolarHBondContact O-N 3.4Å; A666-T669 PolarHBondContact O-N 2.77Å; A666-T669 PolarHBondContact O-OG1 3.42Å; A666-A670 VanDerWaalsContact O-CB 3.29Å; A666-A670 WeakPolarHBondContact O-CB 3.38Å; A666-A670 PolarHBondContact O-N 3.11Å
667	S	91.8	Very high	87.1	Confident	52 Å²	52	58 Å²	58	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-64.7	-39.1	178.4	-58.5	0	0	0	0	112.4	I663 I664 V665 N671	I663-S667 VanDerWaalsContact O-CB 3.25Å; I663-S667 WeakPolarHBondContact O-CB 3.49Å; I663-S667 PolarHBondContact O-N 3.37Å; I663-S667 PolarHBondContact O-OG 3.49Å; I664-S667 PolarHBondContact O-N 3.13Å; V665-S667 VanDerWaalsContact C-N 3.31Å; V665-S667 PolarHBondContact O-N 3.44Å; S667-N671 WeakPolarHBondContact O-CB 3.47Å; S667-N671 PolarHBondContact O-N 3Å
668	Y	90.2	Very high	86	Confident	57 Å²	57	64.3 Å²	64.3	22%	0.224	38%	0.383	C	S	.	.	H	α-helix	trans	-61.6	-49.5	174.1	177.8	-97.6	0	0	0	111.2	F575 P578 F579 W584 I664 V665 A666 A670 N671 L672	F575-Y668 PolarHBondContact O-OH 3.03Å; P578-Y668 HydrophobicContact CB-CD2 3.91Å; P578-Y668 HydrophobicContact CB-CE2 3.84Å; P578-Y668 HydrophobicContact CG-CD2 4.38Å; P578-Y668 HydrophobicContact CG-CE2 3.83Å; F579-Y668 HydrophobicContact CD2-CD2 4.06Å; F579-Y668 HydrophobicContact CE2-CD2 4.01Å; F579-Y668 HydrophobicContact CE2-CG 4.38Å; F579-Y668 HydrophobicContact CZ-CD2 4.49Å; W584-Y668 HydrophobicContact CH2-CD2 4.5Å; W584-Y668 HydrophobicContact CH2-CE2 4.42Å; W584-Y668 HydrophobicContact CZ2-CD2 4.27Å; W584-Y668 HydrophobicContact CZ2-CE2 4.03Å; I664-Y668 PolarHBondContact O-N 3.26Å; V665-Y668 PolarHBondContact O-N 3.03Å; A666-Y668 PolarHBondContact O-N 3.4Å; Y668-A670 PolarHBondContact O-N 2.94Å; Y668-N671 PolarHBondContact O-N 2.99Å; Y668-L672 HydrophobicContact CE1-CD2 4.41Å; Y668-L672 WeakPolarHBondContact O-CB 3.38Å; Y668-L672 PolarHBondContact O-N 2.78Å
669	T	89.4	Confident	84.9	Confident	78 Å²	78	67.2 Å²	67.2	48%	0.479	39%	0.393	S	S	.	.	H	α-helix	trans	-65.4	-37.6	-180	59.2	0	0	0	0	112.6	V665 A666 A673	V665-T669 WeakPolarHBondContact O-CG2 3.46Å; V665-T669 PolarHBondContact O-N 2.94Å; V665-T669 PolarHBondContact O-OG1 3.45Å; A666-T669 PolarHBondContact O-N 2.77Å; A666-T669 PolarHBondContact O-OG1 3.42Å; T669-A673 WeakPolarHBondContact O-CB 3.45Å; T669-A673 PolarHBondContact O-N 2.87Å
670	A	90.1	Very high	83.6	Confident	61 Å²	61	74.9 Å²	74.9	50%	0.504	41%	0.411	S	S	.	.	H	α-helix	trans	-67	-43.3	176.4	0	0	0	0	0	111.8	A666 Y668 A673 A674	A666-A670 VanDerWaalsContact O-CB 3.29Å; A666-A670 WeakPolarHBondContact O-CB 3.38Å; A666-A670 PolarHBondContact O-N 3.11Å; Y668-A670 PolarHBondContact O-N 2.94Å; A670-A673 PolarHBondContact O-N 3.23Å; A670-A674 WeakPolarHBondContact O-CB 3.45Å; A670-A674 PolarHBondContact O-N 3.02Å
671	N	87.8	Confident	82.3	Confident	76 Å²	76	75.1 Å²	75.1	41%	0.406	42%	0.421	S	S	.	.	H	α-helix	trans	-72	-36.4	180	-160	27.3	0	0	0	112.3	P578 S667 Y668 A674 F675	P578-N671 HydrophobicContact CB-CB 4.36Å; P578-N671 PolarHBondContact O-ND2 3.28Å; S667-N671 WeakPolarHBondContact O-CB 3.47Å; S667-N671 PolarHBondContact O-N 3Å; Y668-N671 PolarHBondContact O-N 2.99Å; N671-A674 PolarHBondContact O-N 2.84Å; N671-F675 WeakPolarHBondContact O-CB 3.36Å; N671-F675 PolarHBondContact O-N 3.01Å
672	L	82.1	Confident	81.1	Confident	42 Å²	42	81.8 Å²	81.8	22%	0.22	45%	0.452	C	S	.	.	H	α-helix	trans	-60.5	-45.3	171.8	-179.8	65.1	0	0	0	111.3	P578 Y668 F675 L676	P578-L672 HydrophobicContact CG-CB 4.19Å; P578-L672 HydrophobicContact CG-CD1 4.02Å; Y668-L672 HydrophobicContact CE1-CD2 4.41Å; Y668-L672 WeakPolarHBondContact O-CB 3.38Å; Y668-L672 PolarHBondContact O-N 2.78Å; L672-F675 PolarHBondContact O-N 2.85Å; L672-L676 WeakPolarHBondContact O-CG 3.24Å; L672-L676 PolarHBondContact O-N 3.29Å; L672-L676 VanDerWaalsContact O-N 3.13Å
673	A	80.6	Confident	80.1	Confident	57 Å²	57	84 Å²	84	47%	0.471	46%	0.461	S	S	.	.	H	α-helix	trans	-63.3	-42.5	176.9	0	0	0	0	0	112	T669 A670 F675 V677	T669-A673 WeakPolarHBondContact O-CB 3.45Å; T669-A673 PolarHBondContact O-N 2.87Å; A670-A673 PolarHBondContact O-N 3.23Å; A673-F675 PolarHBondContact O-N 3.27Å; A673-V677 WeakPolarHBondContact O-CG2 3.41Å; A673-V677 PolarHBondContact O-N 2.94Å
674	A	82.3	Confident	79.4	Confident	43 Å²	43	84.6 Å²	84.6	36%	0.355	46%	0.456	S	S	.	.	H	α-helix	trans	-62.5	-41.5	176.2	0	0	0	0	0	112.1	A670 N671 V677 L678	A670-A674 WeakPolarHBondContact O-CB 3.45Å; A670-A674 PolarHBondContact O-N 3.02Å; N671-A674 PolarHBondContact O-N 2.84Å; A674-V677 PolarHBondContact O-N 3.48Å; A674-L678 WeakPolarHBondContact O-CG 3.34Å; A674-L678 PolarHBondContact O-N 3.12Å; A674-L678 VanDerWaalsContact O-N 3.09Å
675	F	75.6	Confident	79.1	Confident	77 Å²	77	83.8 Å²	83.8	34%	0.338	45%	0.452	S	S	.	.	H	α-helix	trans	-62.8	-46.1	179	-175.1	-96.7	0	0	0	112.4	N671 L672 A673 V677 L678 D679	N671-F675 WeakPolarHBondContact O-CB 3.36Å; N671-F675 PolarHBondContact O-N 3.01Å; L672-F675 PolarHBondContact O-N 2.85Å; A673-F675 PolarHBondContact O-N 3.27Å; F675-V677 PolarHBondContact O-N 3.08Å; F675-L678 PolarHBondContact O-N 2.92Å; F675-L678 VanDerWaalsContact O-N 3.08Å; F675-D679 HydrophobicContact CE1-CB 4.23Å; F675-D679 HydrophobicContact CZ-CB 4.41Å; F675-D679 WeakPolarHBondContact O-CB 3.38Å; F675-D679 PolarHBondContact O-N 2.99Å
676	L	74.8	Confident	78.9	Confident	70 Å²	70	85.8 Å²	85.8	37%	0.366	47%	0.465	S	S	.	.	H	α-helix	trans	-62.6	-25.3	178.3	-69.4	172.4	0	0	0	113.5	L672 L829	L672-L676 WeakPolarHBondContact O-CG 3.24Å; L672-L676 PolarHBondContact O-N 3.29Å; L672-L676 VanDerWaalsContact O-N 3.13Å; L676-L829 HydrophobicContact CD1-CD1 4Å; L676-L829 HydrophobicContact CD1-CG 4.45Å; L676-L829 HydrophobicContact CD2-CD1 4.34Å; L676-L829 HydrophobicContact CD2-CD2 4.14Å; L676-L829 HydrophobicContact CD2-CG 4.03Å
677	V	75.3	Confident	78.9	Confident	98 Å²	98	83.8 Å²	83.8	59%	0.594	45%	0.449	S	S	*	.	H	α-helix	trans	-80.9	-34.7	175.6	174.1	0	0	0	0	111.5	A673 A674 F675	A673-V677 WeakPolarHBondContact O-CG2 3.41Å; A673-V677 PolarHBondContact O-N 2.94Å; A674-V677 PolarHBondContact O-N 3.48Å; F675-V677 PolarHBondContact O-N 3.08Å
678	L	69.5	Low	78.8	Confident	142 Å²	142	82.6 Å²	82.6	74%	0.743	44%	0.438	S	S	*	.	H	α-helix	trans	-85.5	-25.6	-176.3	-72.9	171.3	0	0	0	113.9	A674 F675 R680	A674-L678 WeakPolarHBondContact O-CG 3.34Å; A674-L678 PolarHBondContact O-N 3.12Å; A674-L678 VanDerWaalsContact O-N 3.09Å; F675-L678 PolarHBondContact O-N 2.92Å; F675-L678 VanDerWaalsContact O-N 3.08Å; L678-R680 PolarHBondContact O-N 2.86Å
679	D	65.6	Low	78.8	Confident	99 Å²	99	86.1 Å²	86.1	53%	0.529	46%	0.461	S	S	.	.			trans	-76.6	49.1	176.5	-162.6	31.6	0	0	0	111.8	F675	F675-D679 HydrophobicContact CE1-CB 4.23Å; F675-D679 HydrophobicContact CZ-CB 4.41Å; F675-D679 WeakPolarHBondContact O-CB 3.38Å; F675-D679 PolarHBondContact O-N 2.99Å
680	R	65.2	Low	78.9	Confident	196 Å²	196	83 Å²	83	74%	0.74	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-76.6	129.6	166.4	-73.2	-174.2	-179.8	-179.2	0.2	107.5	L678	L678-R680 PolarHBondContact O-N 2.86Å
681	P	64.3	Low	78.9	Confident	83 Å²	83	84.4 Å²	84.4	54%	0.539	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-56.6	151.4	172.4	26	-33.7	0	0	0	109.5	E683	P681-E683 PolarHBondContact O-N 3.34Å
682	E	65.6	Low	79	Confident	142 Å²	142	85.7 Å²	85.7	66%	0.664	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-47.7	135.9	177.6	-64.4	-166.5	164.2	0	0	110.6	R684 R692	E682-R684 PolarHBondContact O-N 3.31Å; E682-R692 IonicContact OE1-NH2 3.5Å; E682-R692 IonicContact OE2-CZ 3.92Å; E682-R692 IonicContact OE2-NH1 2.78Å; E682-R692 PolarHBondContact OE2-NH1 3.07Å; E682-R692 IonicContact OE2-NH2 2.8Å; E682-R692 PolarHBondContact OE2-NH2 3.36Å
683	E	66.7	Low	79.4	Confident	158 Å²	158	83.7 Å²	83.7	74%	0.738	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-59.3	135.9	178.7	-66.3	-173.6	171.6	0	0	109.7	P681	P681-E683 PolarHBondContact O-N 3.34Å
684	R	77.8	Confident	79.9	Confident	117 Å²	117	84.8 Å²	84.8	44%	0.442	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-60.2	156.6	174.3	-62.8	-178.9	-168	168.7	5.9	109.3	E682 T686 T770	E682-R684 PolarHBondContact O-N 3.31Å; R684-T686 PolarHBondContact O-N 3.26Å; R684-T686 VanDerWaalsContact O-N 3.1Å; R684-T770 HydrophobicContact CB-CG2 3.96Å; R684-T770 HydrophobicContact CG-CG2 4.47Å
685	I	86.1	Confident	80.3	Confident	11 Å²	11	88.5 Å²	88.5	6%	0.056	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-50.7	121.8	174.8	-57.3	171	0	0	0	109.2	I561 V563 G687 D690 L693 F700 A749 T770	I561-I685 HydrophobicContact CD1-CG2 4.16Å; I561-I685 HydrophobicContact CG2-CD1 4.31Å; V563-I685 HydrophobicContact CG1-CD1 3.71Å; I685-G687 VanDerWaalsContact C-N 3.3Å; I685-G687 PolarHBondContact O-N 2.84Å; I685-D690 WeakPolarHBondContact CA-OD2 3.26Å; I685-D690 HydrophobicContact CG2-CB 3.77Å; I685-L693 HydrophobicContact CG2-CD1 3.77Å; I685-L693 HydrophobicContact CG2-CG 4.37Å; I685-F700 HydrophobicContact CD1-CE1 4.18Å; I685-F700 HydrophobicContact CD1-CE2 4.45Å; I685-F700 HydrophobicContact CD1-CZ 3.53Å; I685-F700 HydrophobicContact CG1-CZ 4.34Å; I685-A749 HydrophobicContact CD1-CB 3.9Å; I685-T770 WeakPolarHBondContact O-CB 3.48Å
686	T	86.2	Confident	81	Confident	92 Å²	92	87.1 Å²	87.1	56%	0.564	44%	0.439	S	S	*	.			trans	-73	-26.7	-175.2	52.3	0	0	0	0	112.3	R684 D690 G771	R684-T686 PolarHBondContact O-N 3.26Å; R684-T686 VanDerWaalsContact O-N 3.1Å; T686-D690 PolarHBondContact N-OD2 2.96Å; T686-D690 VanDerWaalsContact N-OD2 3.09Å; T686-D690 PolarHBondContact OG1-OD2 2.94Å; T686-G771 WeakPolarHBondContact O-CA 3.38Å
687	G	89.7	Confident	81.6	Confident	9 Å²	9	86.3 Å²	86.3	9%	0.093	44%	0.438	C	S	.	.	S	Bend	trans	156.9	-157.3	176.3	0	0	0	0	0	111.7	I685 N689 D690 L693	I685-G687 VanDerWaalsContact C-N 3.3Å; I685-G687 PolarHBondContact O-N 2.84Å; G687-N689 PolarHBondContact O-N 3.25Å; G687-D690 VanDerWaalsContact O-CB 3.26Å; G687-D690 WeakPolarHBondContact O-CB 3.09Å; G687-D690 PolarHBondContact O-N 2.96Å; G687-L693 WeakPolarHBondContact O-CD1 3.3Å
688	I	90.4	Very high	82.2	Confident	26 Å²	26	88.3 Å²	88.3	13%	0.133	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.3	-176.1	-169.6	58.4	0	0	0	114.1	D690 F714 L720 M723 F774	I688-D690 VanDerWaalsContact C-N 3.27Å; I688-D690 PolarHBondContact O-N 3.41Å; I688-F714 HydrophobicContact CD1-CE1 4.33Å; I688-F714 HydrophobicContact CD1-CZ 4.06Å; I688-L720 HydrophobicContact CD1-CD2 4.49Å; I688-L720 HydrophobicContact CG1-CD2 4.4Å; I688-M723 HydrophobicContact CD1-CE 3.76Å; I688-M723 HydrophobicContact CD1-SD 4.28Å; I688-F774 HydrophobicContact CB-CD1 4.05Å; I688-F774 HydrophobicContact CB-CD2 4.44Å; I688-F774 HydrophobicContact CB-CE1 4.2Å; I688-F774 HydrophobicContact CB-CG 4.17Å; I688-F774 HydrophobicContact CB-CZ 4.46Å; I688-F774 HydrophobicContact CD1-CE1 4.44Å; I688-F774 HydrophobicContact CD1-CE2 4.02Å; I688-F774 HydrophobicContact CD1-CZ 3.94Å; I688-F774 HydrophobicContact CG1-CD2 4.32Å; I688-F774 HydrophobicContact CG1-CE2 4.25Å; I688-F774 HydrophobicContact CG1-CZ 4.4Å; I688-F774 HydrophobicContact CG2-CB 4.34Å; I688-F774 HydrophobicContact CG2-CD1 4.48Å; I688-F774 HydrophobicContact CG2-CG 4.32Å
689	N	90.2	Very high	83.1	Confident	131 Å²	131	90.3 Å²	90.3	70%	0.701	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	5.6	-179.4	-66.9	-28.8	0	0	0	113.3	G687	G687-N689 PolarHBondContact O-N 3.25Å
690	D	91.9	Very high	84.3	Confident	13 Å²	13	87.2 Å²	87.2	7%	0.07	43%	0.43	C	S	.	.			trans	-60.9	132.3	179.4	-164.7	-66.8	0	0	0	110.9	I685 T686 G687 I688 R692 L693 R694	I685-D690 WeakPolarHBondContact CA-OD2 3.26Å; I685-D690 HydrophobicContact CG2-CB 3.77Å; T686-D690 PolarHBondContact N-OD2 2.96Å; T686-D690 VanDerWaalsContact N-OD2 3.09Å; T686-D690 PolarHBondContact OG1-OD2 2.94Å; G687-D690 VanDerWaalsContact O-CB 3.26Å; G687-D690 WeakPolarHBondContact O-CB 3.09Å; G687-D690 PolarHBondContact O-N 2.96Å; I688-D690 VanDerWaalsContact C-N 3.27Å; I688-D690 PolarHBondContact O-N 3.41Å; D690-R692 PolarHBondContact O-N 3.34Å; D690-R692 VanDerWaalsContact O-N 3.14Å; D690-R692 VanDerWaalsContact OD1-CB 3.28Å; D690-R692 WeakPolarHBondContact OD1-CB 3.08Å; D690-R692 WeakPolarHBondContact OD1-CG 3.43Å; D690-R692 PolarHBondContact OD1-N 3.49Å; D690-L693 HydrophobicContact CB-CD1 4.39Å; D690-L693 HydrophobicContact CB-CG 4.49Å; D690-L693 PolarHBondContact O-N 3.47Å; D690-R694 PolarHBondContact O-N 3.22Å
691	P	90.2	Very high	85.7	Confident	90 Å²	90	79.8 Å²	79.8	58%	0.584	41%	0.405	S	S	*	.	H	α-helix	trans	-54.2	-32.7	178.2	-27.1	35	0	0	0	113.9	L693 R694 N695	P691-L693 VanDerWaalsContact C-N 3.26Å; P691-L693 PolarHBondContact O-N 3.23Å; P691-R694 PolarHBondContact O-N 3.49Å; P691-N695 WeakPolarHBondContact O-CB 3.25Å; P691-N695 PolarHBondContact O-N 3.08Å
692	R	88.4	Confident	87.2	Confident	103 Å²	103	75.9 Å²	75.9	39%	0.389	38%	0.38	S	S	.	.	H	α-helix	trans	-66	-29.8	179.4	-62.2	176	178.3	-157.1	-8	112.4	E682 D690 F700	E682-R692 IonicContact OE1-NH2 3.5Å; E682-R692 IonicContact OE2-CZ 3.92Å; E682-R692 IonicContact OE2-NH1 2.78Å; E682-R692 PolarHBondContact OE2-NH1 3.07Å; E682-R692 IonicContact OE2-NH2 2.8Å; E682-R692 PolarHBondContact OE2-NH2 3.36Å; D690-R692 PolarHBondContact O-N 3.34Å; D690-R692 VanDerWaalsContact O-N 3.14Å; D690-R692 VanDerWaalsContact OD1-CB 3.28Å; D690-R692 WeakPolarHBondContact OD1-CB 3.08Å; D690-R692 WeakPolarHBondContact OD1-CG 3.43Å; D690-R692 PolarHBondContact OD1-N 3.49Å; R692-F700 HydrophobicContact CB-CD1 4.46Å
693	L	90.9	Very high	88.6	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-85.9	-45.2	174.3	-68.4	175.4	0	0	0	111.2	I561 I685 G687 D690 P691 N695 F700 Y702 M723	I561-L693 HydrophobicContact CD1-CD1 3.45Å; I561-L693 VanDerWaalsContact CD1-CD1 3.45Å; I685-L693 HydrophobicContact CG2-CD1 3.77Å; I685-L693 HydrophobicContact CG2-CG 4.37Å; G687-L693 WeakPolarHBondContact O-CD1 3.3Å; D690-L693 HydrophobicContact CB-CD1 4.39Å; D690-L693 HydrophobicContact CB-CG 4.49Å; D690-L693 PolarHBondContact O-N 3.47Å; P691-L693 VanDerWaalsContact C-N 3.26Å; P691-L693 PolarHBondContact O-N 3.23Å; L693-N695 VanDerWaalsContact C-N 3.32Å; L693-N695 PolarHBondContact O-N 3.04Å; L693-F700 HydrophobicContact CD2-CE1 3.84Å; L693-Y702 HydrophobicContact CD2-CD1 3.68Å; L693-Y702 HydrophobicContact CD2-CD2 4.13Å; L693-Y702 HydrophobicContact CD2-CE1 3.98Å; L693-Y702 HydrophobicContact CD2-CE2 4.43Å; L693-Y702 HydrophobicContact CD2-CG 3.75Å; L693-Y702 PolarHBondContact O-OH 3.25Å; L693-M723 HydrophobicContact CB-CE 3.84Å; L693-M723 WeakPolarHBondContact O-CG 3.49Å
694	R	90.6	Very high	90	Very high	81 Å²	81	61.6 Å²	61.6	31%	0.306	31%	0.313	S	S	.	.	H	α-helix	trans	-64.2	-37.3	-174.6	-158	71.3	175.4	144.2	6.6	112.8	D690 P691 P696 E719	D690-R694 PolarHBondContact O-N 3.22Å; P691-R694 PolarHBondContact O-N 3.49Å; R694-P696 VanDerWaalsContact O-CD 3.25Å; R694-P696 WeakPolarHBondContact O-CD 3.32Å; R694-E719 PolarHBondContact NH1-O 3.44Å; R694-E719 PolarHBondContact NH2-O 3.36Å
695	N	90.8	Very high	90.8	Very high	121 Å²	121	56.5 Å²	56.5	65%	0.647	30%	0.295	S	S	*	.	S	Bend	trans	-109.9	85.3	175.6	-66.6	-21.1	0	0	0	108.9	P691 L693 S697	P691-N695 WeakPolarHBondContact O-CB 3.25Å; P691-N695 PolarHBondContact O-N 3.08Å; L693-N695 VanDerWaalsContact C-N 3.32Å; L693-N695 PolarHBondContact O-N 3.04Å; N695-S697 PolarHBondContact O-N 3.48Å
696	P	90.3	Very high	91	Very high	48 Å²	48	59.9 Å²	59.9	31%	0.312	31%	0.309	S	S	.	.			trans	-60.5	136.7	-176.1	22.3	-31.7	0	0	0	111.3	R694 Y702 H726	R694-P696 VanDerWaalsContact O-CD 3.25Å; R694-P696 WeakPolarHBondContact O-CD 3.32Å; P696-Y702 HydrophobicContact CB-CE1 4.22Å; P696-H726 HydrophobicContact CB-CB 3.66Å; P696-H726 VanDerWaalsContact CB-CD2 3.47Å; P696-H726 WeakPolarHBondContact CB-CD2 3.27Å; P696-H726 VanDerWaalsContact CB-CG 3.48Å; P696-H726 HydrophobicContact CG-CB 4.06Å
697	S	88.4	Confident	91	Very high	52 Å²	52	57.3 Å²	57.3	36%	0.364	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-127.1	152.7	172.8	70.7	0	0	0	0	109.7	N695 K699 F700 H726	N695-S697 PolarHBondContact O-N 3.48Å; S697-K699 PolarHBondContact O-N 3.13Å; S697-F700 CarbonylContact O-C 3.44Å; S697-F700 PolarHBondContact O-N 2.95Å; S697-F700 VanDerWaalsContact O-N 3.15Å; S697-F700 PolarHBondContact OG-N 2.75Å; S697-H726 PolarHBondContact O-NE2 2.82Å
698	D	86.9	Confident	91	Very high	140 Å²	140	57 Å²	57	75%	0.749	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.6	177.9	-62.7	-29.3	0	0	0	112.6
699	K	88.3	Confident	91	Very high	185 Å²	185	56.1 Å²	56.1	80%	0.804	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-28.8	174	-64.6	-177.3	-179	-179.5	0	112.5	S697 H748	S697-K699 PolarHBondContact O-N 3.13Å; K699-H748 PolarHBondContact O-CE1 3.09Å; K699-H748 VanDerWaalsContact O-CE1 3.25Å
700	F	91.9	Very high	91.1	Very high	33 Å²	33	50 Å²	50	15%	0.145	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-119.5	90.9	-176	-169.9	-95.8	0	0	0	110.1	I685 R692 L693 S697 Y702 H726 H748 A749	I685-F700 HydrophobicContact CD1-CE1 4.18Å; I685-F700 HydrophobicContact CD1-CE2 4.45Å; I685-F700 HydrophobicContact CD1-CZ 3.53Å; I685-F700 HydrophobicContact CG1-CZ 4.34Å; R692-F700 HydrophobicContact CB-CD1 4.46Å; L693-F700 HydrophobicContact CD2-CE1 3.84Å; S697-F700 CarbonylContact O-C 3.44Å; S697-F700 PolarHBondContact O-N 2.95Å; S697-F700 VanDerWaalsContact O-N 3.15Å; S697-F700 PolarHBondContact OG-N 2.75Å; F700-Y702 AromaticContact CD1-CD1 3.93Å; F700-Y702 HydrophobicContact CD1-CD1 3.93Å; F700-Y702 HydrophobicContact CE1-CD1 4.08Å; F700-H726 PolarHBondContact O-CE1 3.15Å; F700-H748 HydrophobicContact CD2-CB 3.77Å; F700-H748 HydrophobicContact CE2-CB 3.44Å; F700-H748 VanDerWaalsContact CE2-CB 3.44Å; F700-H748 HydrophobicContact CG-CB 4.47Å; F700-H748 HydrophobicContact CZ-CB 3.89Å; F700-A749 HydrophobicContact CE1-CB 4.11Å; F700-A749 HydrophobicContact CZ-CB 3.81Å
701	I	94.5	Very high	91.1	Very high	41 Å²	41	50.1 Å²	50.1	21%	0.21	25%	0.251	C	S	.	.			trans	-86.9	125.2	-176.9	-52.2	176.1	0	0	0	109.8	H730 L747 H748 A749	I701-H730 HydrophobicContact CG2-CB 4.02Å; I701-L747 HydrophobicContact CG2-CD1 3.93Å; I701-L747 WeakPolarHBondContact O-CD1 3.25Å; I701-H748 PolarHBondContact N-ND1 3.08Å; I701-H748 WeakPolarHBondContact O-CB 3.4Å; I701-H748 PolarHBondContact O-N 2.9Å; I701-A749 PolarHBondContact O-N 3.19Å
702	Y	94.6	Very high	91.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	149	172.8	62.2	-91.1	0	0	0	110.7	L693 P696 F700 M723 H726 M727 A749 I751	L693-Y702 HydrophobicContact CD2-CD1 3.68Å; L693-Y702 HydrophobicContact CD2-CD2 4.13Å; L693-Y702 HydrophobicContact CD2-CE1 3.98Å; L693-Y702 HydrophobicContact CD2-CE2 4.43Å; L693-Y702 HydrophobicContact CD2-CG 3.75Å; L693-Y702 PolarHBondContact O-OH 3.25Å; P696-Y702 HydrophobicContact CB-CE1 4.22Å; F700-Y702 AromaticContact CD1-CD1 3.93Å; F700-Y702 HydrophobicContact CD1-CD1 3.93Å; F700-Y702 HydrophobicContact CE1-CD1 4.08Å; Y702-M723 HydrophobicContact CE2-CB 4.22Å; Y702-M723 HydrophobicContact CE2-CE 3.92Å; Y702-M723 WeakPolarHBondContact OH-CA 3.31Å; Y702-M723 WeakPolarHBondContact OH-CB 3.49Å; Y702-M723 WeakPolarHBondContact OH-CG 3.42Å; Y702-H726 AromaticContact CD1-CE1 3.77Å; Y702-H726 AromaticContact CD1-ND1 3.79Å; Y702-H726 AromaticContact CE1-CE1 3.7Å; Y702-H726 AromaticContact CE1-ND1 3.46Å; Y702-H726 WeakPolarHBondContact CE1-ND1 3.49Å; Y702-H726 AromaticContact CE2-ND1 3.96Å; Y702-H726 AromaticContact CZ-ND1 3.54Å; Y702-M727 HydrophobicContact CD2-CG 3.51Å; Y702-M727 HydrophobicContact CD2-SD 3.99Å; Y702-M727 HydrophobicContact CE2-CG 3.37Å; Y702-M727 HydrophobicContact CE2-SD 3.76Å; Y702-A749 WeakPolarHBondContact CA-O 3.34Å; Y702-A749 WeakPolarHBondContact CB-O 3.38Å; Y702-I751 HydrophobicContact CD2-CD1 4.32Å
703	A	96.2	Very high	91.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	170.3	-171.2	0	0	0	0	0	112	H730 Y732 L747 A749 F750 I751	A703-H730 HydrophobicContact CB-CB 4.12Å; A703-H730 WeakPolarHBondContact CB-O 3.07Å; A703-Y732 HydrophobicContact CB-CD2 4.14Å; A703-Y732 HydrophobicContact CB-CE2 4.17Å; A703-L747 HydrophobicContact CB-CD1 3.77Å; A703-L747 HydrophobicContact CB-CD2 4.2Å; A703-A749 PolarHBondContact N-O 3.47Å; A703-F750 WeakPolarHBondContact O-CD2 3.28Å; A703-I751 PolarHBondContact O-N 2.84Å; A703-I751 VanDerWaalsContact O-N 3.11Å
704	T	95.8	Very high	91.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.			trans	-135.1	-173.8	169	-163	0	0	0	0	110.4	V710 M727 N731 Y732 I751	T704-V710 HydrophobicContact CG2-CB 4.42Å; T704-V710 HydrophobicContact CG2-CG1 4.16Å; T704-V710 WeakPolarHBondContact OG1-CB 3.3Å; T704-V710 WeakPolarHBondContact OG1-CG1 3.49Å; T704-M727 HydrophobicContact CG2-CE 3.34Å; T704-N731 WeakPolarHBondContact CG2-OD1 3.41Å; T704-N731 PolarHBondContact N-OD1 3.07Å; T704-N731 VanDerWaalsContact O-CA 3.24Å; T704-N731 WeakPolarHBondContact O-CA 3.49Å; T704-N731 WeakPolarHBondContact O-CB 2.89Å; T704-N731 PolarHBondContact O-OD1 3.19Å; T704-Y732 PolarHBondContact O-N 3.29Å; T704-I751 PolarHBondContact OG1-O 2.99Å
705	V	93.9	Very high	91.4	Very high	10 Å²	10	44.8 Å²	44.8	6%	0.061	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-87.2	135.3	175.3	-172.9	0	0	0	0	110	S708 Y732 E733 A735 F750 W752	V705-S708 VanDerWaalsContact O-CB 3.28Å; V705-S708 WeakPolarHBondContact O-CB 3.45Å; V705-S708 PolarHBondContact O-OG 3.42Å; V705-Y732 CarbonylContact C-O 3.52Å; V705-Y732 VanDerWaalsContact CA-O 3.3Å; V705-Y732 WeakPolarHBondContact CA-O 3.19Å; V705-E733 WeakPolarHBondContact CG1-O 3.46Å; V705-A735 HydrophobicContact CG2-CB 4.28Å; V705-F750 HydrophobicContact CG2-CE2 4.07Å; V705-F750 HydrophobicContact CG2-CZ 3.95Å; V705-W752 HydrophobicContact CB-CE3 4.13Å; V705-W752 HydrophobicContact CB-CH2 3.34Å; V705-W752 HydrophobicContact CB-CZ2 4.23Å; V705-W752 HydrophobicContact CB-CZ3 3.29Å; V705-W752 HydrophobicContact CG1-CH2 4.11Å; V705-W752 HydrophobicContact CG1-CZ3 4.48Å; V705-W752 HydrophobicContact CG2-CD2 4.13Å; V705-W752 HydrophobicContact CG2-CE3 3.68Å; V705-W752 HydrophobicContact CG2-CH2 3.41Å; V705-W752 VanDerWaalsContact CG2-CH2 3.41Å; V705-W752 HydrophobicContact CG2-CZ2 3.86Å; V705-W752 HydrophobicContact CG2-CZ3 3.33Å
706	K	90.4	Very high	91.3	Very high	82 Å²	82	44.5 Å²	44.5	36%	0.357	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	148	177.4	-65.2	-172.2	-160.8	159.1	0	111.5	S708 N731 Y732 E733	K706-S708 PolarHBondContact O-N 3.28Å; K706-S708 VanDerWaalsContact O-N 3.13Å; K706-N731 HydrophobicContact CD-CB 4.39Å; K706-N731 WeakPolarHBondContact CE-O 3.38Å; K706-N731 HydrophobicContact CG-CB 3.43Å; K706-N731 VanDerWaalsContact CG-CB 3.43Å; K706-Y732 PolarHBondContact N-O 3.01Å; K706-E733 VanDerWaalsContact CD-OE1 3.31Å; K706-E733 WeakPolarHBondContact CD-OE1 3.32Å; K706-E733 WeakPolarHBondContact CE-OE1 3.44Å; K706-E733 IonicContact NZ-OE1 3.65Å; K706-E733 PolarHBondContact NZ-OE1 2.99Å
707	Q	86.1	Confident	91.3	Very high	39 Å²	39	45.2 Å²	45.2	18%	0.182	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	37.7	173.8	-53.2	-178.2	6.4	0	0	112.6	K504 T507 E509 N520 D711	K504-Q707 VanDerWaalsContact CE-OE1 3.31Å; K504-Q707 VanDerWaalsContact NZ-CD 3.27Å; T507-Q707 VanDerWaalsContact CG2-C 3.43Å; T507-Q707 HydrophobicContact CG2-CB 4.16Å; T507-Q707 WeakPolarHBondContact CG2-O 3.44Å; E509-Q707 PolarHBondContact OE1-NE2 3.47Å; E509-Q707 PolarHBondContact OE1-OE1 2.84Å; N520-Q707 PolarHBondContact ND2-OE1 3.21Å; Q707-D711 PolarHBondContact N-OD2 3.25Å
708	S	90	Very high	91.4	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.007	23%	0.227	C	C	.	.	S	Bend	trans	-105.4	172	177.8	66.7	0	0	0	0	111.1	V705 K706 V710 D711 I712 W752	V705-S708 VanDerWaalsContact O-CB 3.28Å; V705-S708 WeakPolarHBondContact O-CB 3.45Å; V705-S708 PolarHBondContact O-OG 3.42Å; K706-S708 PolarHBondContact O-N 3.28Å; K706-S708 VanDerWaalsContact O-N 3.13Å; S708-V710 PolarHBondContact O-N 3.4Å; S708-V710 PolarHBondContact OG-N 2.83Å; S708-D711 PolarHBondContact O-N 3.37Å; S708-D711 PolarHBondContact OG-N 2.87Å; S708-D711 VanDerWaalsContact OG-N 3.07Å; S708-I712 WeakPolarHBondContact O-CG1 3.3Å; S708-I712 PolarHBondContact O-N 3.15Å; S708-I712 VanDerWaalsContact O-N 3.13Å; S708-W752 WeakPolarHBondContact OG-CZ3 3.12Å
709	S	90.3	Very high	91.6	Very high	9 Å²	9	48 Å²	48	6%	0.063	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-29.8	168.9	39.4	0	0	0	0	112.6	T539 Y713	T539-S709 PolarHBondContact OG1-OG 2.94Å; S709-Y713 WeakPolarHBondContact O-CB 3.33Å; S709-Y713 PolarHBondContact O-N 2.94Å
710	V	93.3	Very high	91.8	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-69.3	-45.3	177.8	-172.5	0	0	0	0	110.3	L559 T704 S708 I712 Y713 F714 I751 W752	L559-V710 HydrophobicContact CD1-CG1 4.11Å; L559-V710 HydrophobicContact CD1-CG2 4.41Å; L559-V710 HydrophobicContact CD2-CG2 3.65Å; T704-V710 HydrophobicContact CG2-CB 4.42Å; T704-V710 HydrophobicContact CG2-CG1 4.16Å; T704-V710 WeakPolarHBondContact OG1-CB 3.3Å; T704-V710 WeakPolarHBondContact OG1-CG1 3.49Å; S708-V710 PolarHBondContact O-N 3.4Å; S708-V710 PolarHBondContact OG-N 2.83Å; V710-I712 PolarHBondContact O-N 3.22Å; V710-Y713 WeakPolarHBondContact O-CB 3.45Å; V710-Y713 PolarHBondContact O-N 3.4Å; V710-Y713 VanDerWaalsContact O-N 3.13Å; V710-F714 HydrophobicContact CG1-CD2 3.84Å; V710-F714 HydrophobicContact CG1-CE2 3.8Å; V710-F714 WeakPolarHBondContact O-CD2 3.44Å; V710-F714 PolarHBondContact O-N 3.02Å; V710-I751 HydrophobicContact CG1-CG2 4.13Å; V710-W752 HydrophobicContact CB-CE3 4.42Å; V710-W752 HydrophobicContact CB-CZ3 4.25Å; V710-W752 HydrophobicContact CG2-CE3 3.75Å; V710-W752 HydrophobicContact CG2-CZ3 3.8Å
711	D	91.4	Very high	91.8	Very high	17 Å²	17	40.5 Å²	40.5	9%	0.091	19%	0.194	C	C	.	.	H	α-helix	trans	-58.3	-47.5	175.7	-174.5	44.8	0	0	0	111.8	Q707 S708 Y713 F714 R715 Y724	Q707-D711 PolarHBondContact N-OD2 3.25Å; S708-D711 PolarHBondContact O-N 3.37Å; S708-D711 PolarHBondContact OG-N 2.87Å; S708-D711 VanDerWaalsContact OG-N 3.07Å; D711-Y713 VanDerWaalsContact C-N 3.3Å; D711-Y713 PolarHBondContact O-N 2.81Å; D711-F714 PolarHBondContact O-N 3.4Å; D711-R715 VanDerWaalsContact O-CB 3.3Å; D711-R715 WeakPolarHBondContact O-CB 3.48Å; D711-R715 PolarHBondContact O-N 3.46Å; D711-Y724 WeakPolarHBondContact OD1-CE2 3.38Å
712	I	89.4	Confident	91.7	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-58	-42.7	174.3	-68.3	170.7	0	0	0	111.4	T507 E543 S708 V710 R715 R716	T507-I712 HydrophobicContact CG2-CD1 3.53Å; T507-I712 HydrophobicContact CG2-CG1 4.13Å; E543-I712 WeakPolarHBondContact OE2-CG2 3.41Å; S708-I712 WeakPolarHBondContact O-CG1 3.3Å; S708-I712 PolarHBondContact O-N 3.15Å; S708-I712 VanDerWaalsContact O-N 3.13Å; V710-I712 PolarHBondContact O-N 3.22Å; I712-R715 PolarHBondContact O-N 3.44Å; I712-R716 WeakPolarHBondContact O-CB 3.36Å; I712-R716 PolarHBondContact O-N 2.72Å
713	Y	92.1	Very high	91.7	Very high	31 Å²	31	41.7 Å²	41.7	12%	0.122	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-51	-179.7	169.2	-100.6	0	0	0	111.7	L559 S709 V710 D711 R715 R716 Q717 L720 F774 F775	L559-Y713 HydrophobicContact CD1-CD1 4.17Å; S709-Y713 WeakPolarHBondContact O-CB 3.33Å; S709-Y713 PolarHBondContact O-N 2.94Å; V710-Y713 WeakPolarHBondContact O-CB 3.45Å; V710-Y713 PolarHBondContact O-N 3.4Å; V710-Y713 VanDerWaalsContact O-N 3.13Å; D711-Y713 VanDerWaalsContact C-N 3.3Å; D711-Y713 PolarHBondContact O-N 2.81Å; Y713-R715 VanDerWaalsContact C-N 3.35Å; Y713-R715 PolarHBondContact O-N 3.18Å; Y713-R716 PolarHBondContact O-N 3.17Å; Y713-Q717 PolarHBondContact O-N 3.07Å; Y713-Q717 VanDerWaalsContact O-N 3.13Å; Y713-L720 HydrophobicContact CE1-CD1 3.84Å; Y713-F774 HydrophobicContact CE1-CE2 4.46Å; Y713-F775 HydrophobicContact CD2-CB 4.46Å; Y713-F775 HydrophobicContact CD2-CD1 4.38Å; Y713-F775 AromaticContact CD2-CD2 3.34Å; Y713-F775 HydrophobicContact CD2-CD2 3.34Å; Y713-F775 AromaticContact CD2-CE2 3.53Å; Y713-F775 HydrophobicContact CD2-CE2 3.53Å; Y713-F775 AromaticContact CD2-CG 3.81Å; Y713-F775 HydrophobicContact CD2-CG 3.81Å; Y713-F775 HydrophobicContact CD2-CZ 4.13Å; Y713-F775 HydrophobicContact CE1-CB 4.47Å; Y713-F775 HydrophobicContact CE2-CB 4.08Å; Y713-F775 AromaticContact CE2-CD2 3.34Å; Y713-F775 HydrophobicContact CE2-CD2 3.34Å; Y713-F775 AromaticContact CE2-CE2 3.95Å; Y713-F775 HydrophobicContact CE2-CE2 3.95Å; Y713-F775 AromaticContact CE2-CG 3.85Å; Y713-F775 HydrophobicContact CE2-CG 3.85Å; Y713-F775 HydrophobicContact CG-CD1 4.5Å; Y713-F775 HydrophobicContact CG-CD2 4.2Å; Y713-F775 HydrophobicContact CG-CE2 4.39Å; Y713-F775 HydrophobicContact CG-CG 4.25Å
714	F	93.5	Very high	91.6	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.009	21%	0.209	C	C	.	.	H	α-helix	trans	-66.7	-35.1	178.9	-83	-83.5	0	0	0	112.6	I688 V710 D711 R716 L720 M723 Y724 M727 I751 F774	I688-F714 HydrophobicContact CD1-CE1 4.33Å; I688-F714 HydrophobicContact CD1-CZ 4.06Å; V710-F714 HydrophobicContact CG1-CD2 3.84Å; V710-F714 HydrophobicContact CG1-CE2 3.8Å; V710-F714 WeakPolarHBondContact O-CD2 3.44Å; V710-F714 PolarHBondContact O-N 3.02Å; D711-F714 PolarHBondContact O-N 3.4Å; F714-R716 VanDerWaalsContact C-N 3.31Å; F714-R716 PolarHBondContact O-N 3.44Å; F714-L720 HydrophobicContact CD1-CB 3.83Å; F714-L720 HydrophobicContact CD1-CD1 4.07Å; F714-L720 HydrophobicContact CD1-CG 4.45Å; F714-L720 HydrophobicContact CE1-CB 4.15Å; F714-L720 HydrophobicContact CE1-CD1 3.9Å; F714-L720 HydrophobicContact CE1-CD2 4.27Å; F714-L720 HydrophobicContact CE1-CG 4.35Å; F714-M723 HydrophobicContact CD1-CB 4.44Å; F714-M723 HydrophobicContact CE1-CB 4.33Å; F714-M723 HydrophobicContact CE1-CE 3.98Å; F714-M723 HydrophobicContact CE1-SD 4.38Å; F714-M723 HydrophobicContact CZ-CE 4.45Å; F714-Y724 HydrophobicContact CB-CD2 3.79Å; F714-Y724 HydrophobicContact CB-CG 4.44Å; F714-M727 HydrophobicContact CD1-SD 4.13Å; F714-M727 HydrophobicContact CD2-CE 3.96Å; F714-M727 HydrophobicContact CD2-SD 4.33Å; F714-M727 HydrophobicContact CE1-SD 4.14Å; F714-M727 HydrophobicContact CE2-CE 4.07Å; F714-M727 HydrophobicContact CE2-SD 4.35Å; F714-M727 HydrophobicContact CG-CE 4.34Å; F714-M727 HydrophobicContact CG-SD 4.24Å; F714-M727 HydrophobicContact CZ-SD 4.26Å; F714-I751 HydrophobicContact CE2-CD1 4.4Å; F714-I751 HydrophobicContact CE2-CG2 4.19Å; F714-I751 HydrophobicContact CZ-CD1 4Å; F714-F774 HydrophobicContact CZ-CE2 4.43Å
715	R	90.7	Very high	91.5	Very high	122 Å²	122	51.3 Å²	51.3	46%	0.46	24%	0.24	S	C	.	.	H	α-helix	trans	-64.7	-34.1	174.9	-170.7	172.6	68	-177.8	0.6	112.8	D711 I712 Y713 Y724	D711-R715 VanDerWaalsContact O-CB 3.3Å; D711-R715 WeakPolarHBondContact O-CB 3.48Å; D711-R715 PolarHBondContact O-N 3.46Å; I712-R715 PolarHBondContact O-N 3.44Å; Y713-R715 VanDerWaalsContact C-N 3.35Å; Y713-R715 PolarHBondContact O-N 3.18Å; R715-Y724 HydrophobicContact CB-CD2 4.17Å; R715-Y724 HydrophobicContact CB-CE2 3.69Å; R715-Y724 HydrophobicContact CG-CE1 4.46Å; R715-Y724 HydrophobicContact CG-CE2 4.23Å
716	R	89.4	Confident	91.6	Very high	116 Å²	116	51.5 Å²	51.5	44%	0.438	24%	0.24	S	C	.	.	H	α-helix	trans	-79.3	-35.5	-178.6	-173.2	179.8	69.5	-168.4	1	112.8	I712 Y713 F714 V718	I712-R716 WeakPolarHBondContact O-CB 3.36Å; I712-R716 PolarHBondContact O-N 2.72Å; Y713-R716 PolarHBondContact O-N 3.17Å; F714-R716 VanDerWaalsContact C-N 3.31Å; F714-R716 PolarHBondContact O-N 3.44Å; R716-V718 PolarHBondContact O-N 3.01Å
717	Q	89.8	Confident	91.8	Very high	62 Å²	62	47.7 Å²	47.7	29%	0.29	22%	0.223	S	C	.	.			trans	-81.2	105.6	-171.9	-155.5	79.9	-6.2	0	0	110.9	Y713 E719 L720 S721	Y713-Q717 PolarHBondContact O-N 3.07Å; Y713-Q717 VanDerWaalsContact O-N 3.13Å; Q717-E719 HydrophobicContact CG-CB 4.5Å; Q717-E719 PolarHBondContact O-N 2.84Å; Q717-L720 HydrophobicContact CB-CB 4.25Å; Q717-L720 HydrophobicContact CB-CD1 4.02Å; Q717-L720 HydrophobicContact CB-CG 4.38Å; Q717-L720 HydrophobicContact CG-CD1 3.89Å; Q717-L720 HydrophobicContact CG-CG 4.19Å; Q717-L720 PolarHBondContact O-N 3.41Å; Q717-S721 PolarHBondContact O-N 3.34Å
718	V	91	Very high	92.1	Very high	122 Å²	122	50.8 Å²	50.8	74%	0.739	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-58.2	-34.6	-179.1	-68.4	0	0	0	0	113.1	R716 L720 S721	R716-V718 PolarHBondContact O-N 3.01Å; V718-L720 VanDerWaalsContact C-N 3.28Å; V718-L720 PolarHBondContact O-N 3.09Å; V718-S721 WeakPolarHBondContact O-CB 3.22Å; V718-S721 PolarHBondContact O-N 3.09Å; V718-S721 PolarHBondContact O-OG 3.21Å
719	E	90.3	Very high	92.2	Very high	130 Å²	130	58.8 Å²	58.8	61%	0.607	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-66.2	-26.7	178.1	-64.6	176.4	175.9	0	0	113.2	R694 Q717	R694-E719 PolarHBondContact NH1-O 3.44Å; R694-E719 PolarHBondContact NH2-O 3.36Å; Q717-E719 HydrophobicContact CG-CB 4.5Å; Q717-E719 PolarHBondContact O-N 2.84Å
720	L	92.3	Very high	92.4	Very high	10 Å²	10	61.4 Å²	61.4	5%	0.052	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-102.7	11.8	-177.4	-63.9	165	0	0	0	112.1	I688 Y713 F714 Q717 V718 T722 M723 Y724	I688-L720 HydrophobicContact CD1-CD2 4.49Å; I688-L720 HydrophobicContact CG1-CD2 4.4Å; Y713-L720 HydrophobicContact CE1-CD1 3.84Å; F714-L720 HydrophobicContact CD1-CB 3.83Å; F714-L720 HydrophobicContact CD1-CD1 4.07Å; F714-L720 HydrophobicContact CD1-CG 4.45Å; F714-L720 HydrophobicContact CE1-CB 4.15Å; F714-L720 HydrophobicContact CE1-CD1 3.9Å; F714-L720 HydrophobicContact CE1-CD2 4.27Å; F714-L720 HydrophobicContact CE1-CG 4.35Å; Q717-L720 HydrophobicContact CB-CB 4.25Å; Q717-L720 HydrophobicContact CB-CD1 4.02Å; Q717-L720 HydrophobicContact CB-CG 4.38Å; Q717-L720 HydrophobicContact CG-CD1 3.89Å; Q717-L720 HydrophobicContact CG-CG 4.19Å; Q717-L720 PolarHBondContact O-N 3.41Å; V718-L720 VanDerWaalsContact C-N 3.28Å; V718-L720 PolarHBondContact O-N 3.09Å; L720-T722 VanDerWaalsContact C-N 3.27Å; L720-T722 PolarHBondContact O-N 3.36Å; L720-M723 HydrophobicContact CD2-SD 3.48Å; L720-M723 WeakPolarHBondContact CD2-SD 3.48Å; L720-M723 WeakPolarHBondContact O-CB 3.33Å; L720-M723 PolarHBondContact O-N 3.1Å; L720-Y724 PolarHBondContact O-N 2.49Å
721	S	93.1	Very high	92.5	Very high	49 Å²	49	62 Å²	62	34%	0.343	29%	0.287	S	S	.	.	H	α-helix	trans	-60.2	-31.9	-174.7	56.2	0	0	0	0	114.2	Q717 V718 Y724 R725	Q717-S721 PolarHBondContact O-N 3.34Å; V718-S721 WeakPolarHBondContact O-CB 3.22Å; V718-S721 PolarHBondContact O-N 3.09Å; V718-S721 PolarHBondContact O-OG 3.21Å; S721-Y724 PolarHBondContact O-N 2.72Å; S721-R725 WeakPolarHBondContact O-CG 3.29Å; S721-R725 PolarHBondContact O-N 3.25Å; S721-R725 VanDerWaalsContact O-N 3.13Å
722	T	92.8	Very high	92.7	Very high	66 Å²	66	64 Å²	64	41%	0.405	29%	0.294	S	S	.	.	H	α-helix	trans	-65.2	-43.7	174.2	51.2	0	0	0	0	111.7	L720 R725 H726	L720-T722 VanDerWaalsContact C-N 3.27Å; L720-T722 PolarHBondContact O-N 3.36Å; T722-R725 PolarHBondContact O-N 2.88Å; T722-H726 PolarHBondContact O-N 2.68Å
723	M	94.3	Very high	92.6	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-44.9	175.5	-60.9	-177.4	58.5	0	0	111	I688 L693 Y702 F714 L720 R725 H726 M727	I688-M723 HydrophobicContact CD1-CE 3.76Å; I688-M723 HydrophobicContact CD1-SD 4.28Å; L693-M723 HydrophobicContact CB-CE 3.84Å; L693-M723 WeakPolarHBondContact O-CG 3.49Å; Y702-M723 HydrophobicContact CE2-CB 4.22Å; Y702-M723 HydrophobicContact CE2-CE 3.92Å; Y702-M723 WeakPolarHBondContact OH-CA 3.31Å; Y702-M723 WeakPolarHBondContact OH-CB 3.49Å; Y702-M723 WeakPolarHBondContact OH-CG 3.42Å; F714-M723 HydrophobicContact CD1-CB 4.44Å; F714-M723 HydrophobicContact CE1-CB 4.33Å; F714-M723 HydrophobicContact CE1-CE 3.98Å; F714-M723 HydrophobicContact CE1-SD 4.38Å; F714-M723 HydrophobicContact CZ-CE 4.45Å; L720-M723 HydrophobicContact CD2-SD 3.48Å; L720-M723 WeakPolarHBondContact CD2-SD 3.48Å; L720-M723 WeakPolarHBondContact O-CB 3.33Å; L720-M723 PolarHBondContact O-N 3.1Å; M723-R725 VanDerWaalsContact C-N 3.33Å; M723-R725 PolarHBondContact O-N 2.76Å; M723-H726 PolarHBondContact O-N 3.24Å; M723-H726 VanDerWaalsContact O-N 3.08Å; M723-M727 VanDerWaalsContact O-CG 3.32Å; M723-M727 WeakPolarHBondContact O-CG 3.45Å; M723-M727 PolarHBondContact O-N 3.46Å
724	Y	94.7	Very high	92.5	Very high	34 Å²	34	68.7 Å²	68.7	13%	0.133	32%	0.321	C	S	.	.	H	α-helix	trans	-54.9	-47	177.6	176.2	-100.2	0	0	0	112	D711 F714 R715 L720 S721 H726 M727 E728	D711-Y724 WeakPolarHBondContact OD1-CE2 3.38Å; F714-Y724 HydrophobicContact CB-CD2 3.79Å; F714-Y724 HydrophobicContact CB-CG 4.44Å; R715-Y724 HydrophobicContact CB-CD2 4.17Å; R715-Y724 HydrophobicContact CB-CE2 3.69Å; R715-Y724 HydrophobicContact CG-CE1 4.46Å; R715-Y724 HydrophobicContact CG-CE2 4.23Å; L720-Y724 PolarHBondContact O-N 2.49Å; S721-Y724 PolarHBondContact O-N 2.72Å; Y724-H726 VanDerWaalsContact C-N 3.26Å; Y724-H726 PolarHBondContact O-N 2.8Å; Y724-M727 PolarHBondContact O-N 3.14Å; Y724-E728 VanDerWaalsContact O-CB 3.31Å; Y724-E728 WeakPolarHBondContact O-CB 3.45Å; Y724-E728 PolarHBondContact O-N 3.31Å; Y724-E728 PolarHBondContact OH-OE1 2.96Å
725	R	93.8	Very high	92.3	Very high	169 Å²	169	69 Å²	69	64%	0.638	32%	0.324	S	S	*	.	H	α-helix	trans	-63.3	-29.2	178.7	-73.7	176.8	179.3	158.9	1.2	114	S721 T722 M723	S721-R725 WeakPolarHBondContact O-CG 3.29Å; S721-R725 PolarHBondContact O-N 3.25Å; S721-R725 VanDerWaalsContact O-N 3.13Å; T722-R725 PolarHBondContact O-N 2.88Å; M723-R725 VanDerWaalsContact C-N 3.33Å; M723-R725 PolarHBondContact O-N 2.76Å
726	H	94.3	Very high	92.3	Very high	14 Å²	14	66.5 Å²	66.5	7%	0.065	33%	0.329	C	S	.	.	H	α-helix	trans	-77.4	-44	176.2	178.5	-94.7	0	0	0	111.2	P696 S697 F700 Y702 T722 M723 Y724 H730	P696-H726 HydrophobicContact CB-CB 3.66Å; P696-H726 VanDerWaalsContact CB-CD2 3.47Å; P696-H726 WeakPolarHBondContact CB-CD2 3.27Å; P696-H726 VanDerWaalsContact CB-CG 3.48Å; P696-H726 HydrophobicContact CG-CB 4.06Å; S697-H726 PolarHBondContact O-NE2 2.82Å; F700-H726 PolarHBondContact O-CE1 3.15Å; Y702-H726 AromaticContact CD1-CE1 3.77Å; Y702-H726 AromaticContact CD1-ND1 3.79Å; Y702-H726 AromaticContact CE1-CE1 3.7Å; Y702-H726 AromaticContact CE1-ND1 3.46Å; Y702-H726 WeakPolarHBondContact CE1-ND1 3.49Å; Y702-H726 AromaticContact CE2-ND1 3.96Å; Y702-H726 AromaticContact CZ-ND1 3.54Å; T722-H726 PolarHBondContact O-N 2.68Å; M723-H726 PolarHBondContact O-N 3.24Å; M723-H726 VanDerWaalsContact O-N 3.08Å; Y724-H726 VanDerWaalsContact C-N 3.26Å; Y724-H726 PolarHBondContact O-N 2.8Å; H726-H730 PolarHBondContact O-ND1 3.22Å
727	M	94.8	Very high	92.4	Very high	2 Å²	2	65.8 Å²	65.8	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-63.7	-41.7	176.7	-67.7	169.9	59.8	0	0	112.4	Y702 T704 F714 M723 Y724 K729 H730 N731 I751	Y702-M727 HydrophobicContact CD2-CG 3.51Å; Y702-M727 HydrophobicContact CD2-SD 3.99Å; Y702-M727 HydrophobicContact CE2-CG 3.37Å; Y702-M727 HydrophobicContact CE2-SD 3.76Å; T704-M727 HydrophobicContact CG2-CE 3.34Å; F714-M727 HydrophobicContact CD1-SD 4.13Å; F714-M727 HydrophobicContact CD2-CE 3.96Å; F714-M727 HydrophobicContact CD2-SD 4.33Å; F714-M727 HydrophobicContact CE1-SD 4.14Å; F714-M727 HydrophobicContact CE2-CE 4.07Å; F714-M727 HydrophobicContact CE2-SD 4.35Å; F714-M727 HydrophobicContact CG-CE 4.34Å; F714-M727 HydrophobicContact CG-SD 4.24Å; F714-M727 HydrophobicContact CZ-SD 4.26Å; M723-M727 VanDerWaalsContact O-CG 3.32Å; M723-M727 WeakPolarHBondContact O-CG 3.45Å; M723-M727 PolarHBondContact O-N 3.46Å; Y724-M727 PolarHBondContact O-N 3.14Å; M727-K729 PolarHBondContact O-N 2.92Å; M727-H730 CarbonylContact O-C 3.54Å; M727-H730 PolarHBondContact O-N 3.47Å; M727-N731 PolarHBondContact O-N 3.48Å; M727-N731 PolarHBondContact O-OD1 3.23Å; M727-I751 HydrophobicContact CE-CD1 4.43Å; M727-I751 HydrophobicContact SD-CD1 4.33Å
728	E	93.2	Very high	92.7	Very high	104 Å²	104	62.9 Å²	62.9	49%	0.486	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-29.4	-176.9	-173.1	169.4	-128.9	0	0	113	Y724	Y724-E728 VanDerWaalsContact O-CB 3.31Å; Y724-E728 WeakPolarHBondContact O-CB 3.45Å; Y724-E728 PolarHBondContact O-N 3.31Å; Y724-E728 PolarHBondContact OH-OE1 2.96Å
729	K	93.1	Very high	92.8	Very high	169 Å²	169	57.3 Å²	57.3	74%	0.735	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-24.4	177	-60.2	178.3	-174	179.5	0	114.1	M727	M727-K729 PolarHBondContact O-N 2.92Å
730	H	94.4	Very high	93	Very high	63 Å²	63	55.2 Å²	55.2	29%	0.292	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	4.8	-169.3	-56.6	100.6	0	0	0	113.5	I701 A703 H726 M727 Y732	I701-H730 HydrophobicContact CG2-CB 4.02Å; A703-H730 HydrophobicContact CB-CB 4.12Å; A703-H730 WeakPolarHBondContact CB-O 3.07Å; H726-H730 PolarHBondContact O-ND1 3.22Å; M727-H730 CarbonylContact O-C 3.54Å; M727-H730 PolarHBondContact O-N 3.47Å; H730-Y732 WeakPolarHBondContact O-CD2 3.42Å; H730-Y732 WeakPolarHBondContact O-CE2 3.46Å
731	N	94.9	Very high	93.1	Very high	15 Å²	15	55 Å²	55	8%	0.08	27%	0.273	C	S	.	.			trans	-64.3	143.5	-178.9	-75.5	-19.8	0	0	0	112.3	T704 K706 M727	T704-N731 WeakPolarHBondContact CG2-OD1 3.41Å; T704-N731 PolarHBondContact N-OD1 3.07Å; T704-N731 VanDerWaalsContact O-CA 3.24Å; T704-N731 WeakPolarHBondContact O-CA 3.49Å; T704-N731 WeakPolarHBondContact O-CB 2.89Å; T704-N731 PolarHBondContact O-OD1 3.19Å; K706-N731 HydrophobicContact CD-CB 4.39Å; K706-N731 WeakPolarHBondContact CE-O 3.38Å; K706-N731 HydrophobicContact CG-CB 3.43Å; K706-N731 VanDerWaalsContact CG-CB 3.43Å; M727-N731 PolarHBondContact O-N 3.48Å; M727-N731 PolarHBondContact O-OD1 3.23Å
732	Y	94.3	Very high	93.2	Very high	59 Å²	59	52.7 Å²	52.7	23%	0.231	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-98.5	161.3	-179.9	-70.5	-94.4	0	0	0	111.4	A703 T704 V705 K706 H730 E737 A738 A741 L747	A703-Y732 HydrophobicContact CB-CD2 4.14Å; A703-Y732 HydrophobicContact CB-CE2 4.17Å; T704-Y732 PolarHBondContact O-N 3.29Å; V705-Y732 CarbonylContact C-O 3.52Å; V705-Y732 VanDerWaalsContact CA-O 3.3Å; V705-Y732 WeakPolarHBondContact CA-O 3.19Å; K706-Y732 PolarHBondContact N-O 3.01Å; H730-Y732 WeakPolarHBondContact O-CD2 3.42Å; H730-Y732 WeakPolarHBondContact O-CE2 3.46Å; Y732-E737 HydrophobicContact CD1-CB 4.07Å; Y732-A738 HydrophobicContact CD2-CB 4.01Å; Y732-A738 HydrophobicContact CG-CB 4.02Å; Y732-A741 HydrophobicContact CE1-CB 3.98Å; Y732-A741 HydrophobicContact CE2-CB 4.45Å; Y732-A741 WeakPolarHBondContact OH-CB 3.21Å; Y732-L747 HydrophobicContact CD2-CD2 4.47Å; Y732-L747 HydrophobicContact CE2-CD1 4.4Å; Y732-L747 HydrophobicContact CE2-CD2 3.93Å
733	E	89	Confident	93.2	Very high	96 Å²	96	51 Å²	51	45%	0.449	24%	0.243	S	C	.	.	S	Bend	trans	-82.4	-30.7	178	-63.3	-61.8	151.6	0	0	112.4	V705 K706	V705-E733 WeakPolarHBondContact CG1-O 3.46Å; K706-E733 VanDerWaalsContact CD-OE1 3.31Å; K706-E733 WeakPolarHBondContact CD-OE1 3.32Å; K706-E733 WeakPolarHBondContact CE-OE1 3.44Å; K706-E733 IonicContact NZ-OE1 3.65Å; K706-E733 PolarHBondContact NZ-OE1 2.99Å
734	S	88.6	Confident	93.2	Very high	39 Å²	39	54.4 Å²	54.4	27%	0.273	26%	0.261	S	S	.	.	S	Bend	trans	-132.1	154.5	-179.8	72.7	0	0	0	0	112.7	A736 E737 A738	S734-A736 VanDerWaalsContact C-N 3.31Å; S734-A736 PolarHBondContact O-N 2.93Å; S734-E737 VanDerWaalsContact OG-CG 3.29Å; S734-E737 WeakPolarHBondContact OG-CG 3.42Å; S734-E737 PolarHBondContact OG-N 3.1Å; S734-E737 PolarHBondContact OG-OE1 3.34Å; S734-A738 PolarHBondContact O-N 3.17Å
735	A	90.7	Very high	93	Very high	9 Å²	9	57.6 Å²	57.6	7%	0.074	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-36.5	175.5	0	0	0	0	0	111.9	V705 E737 A738 I739 F750	V705-A735 HydrophobicContact CG2-CB 4.28Å; A735-E737 PolarHBondContact O-N 2.92Å; A735-A738 PolarHBondContact O-N 3.15Å; A735-I739 WeakPolarHBondContact O-CD1 3.47Å; A735-I739 VanDerWaalsContact O-CG1 3.27Å; A735-I739 WeakPolarHBondContact O-CG1 3.35Å; A735-I739 PolarHBondContact O-N 2.96Å; A735-F750 HydrophobicContact CB-CZ 4.41Å
736	A	89.5	Confident	93	Very high	69 Å²	69	55.9 Å²	55.9	57%	0.57	28%	0.278	S	S	*	.	H	α-helix	trans	-61.7	-43.2	-180	0	0	0	0	0	112.3	S734 Q740	S734-A736 VanDerWaalsContact C-N 3.31Å; S734-A736 PolarHBondContact O-N 2.93Å; A736-Q740 PolarHBondContact O-N 3.47Å; A736-Q740 VanDerWaalsContact O-N 3.09Å
737	E	92.5	Very high	93.1	Very high	101 Å²	101	55.3 Å²	55.3	47%	0.472	28%	0.275	S	S	.	.	H	α-helix	trans	-62.2	-44	174.6	-75.2	167.5	-152.9	0	0	112	Y732 S734 A735 Q740 A741	Y732-E737 HydrophobicContact CD1-CB 4.07Å; S734-E737 VanDerWaalsContact OG-CG 3.29Å; S734-E737 WeakPolarHBondContact OG-CG 3.42Å; S734-E737 PolarHBondContact OG-N 3.1Å; S734-E737 PolarHBondContact OG-OE1 3.34Å; A735-E737 PolarHBondContact O-N 2.92Å; E737-Q740 PolarHBondContact O-N 3.45Å; E737-A741 WeakPolarHBondContact O-CB 3.48Å; E737-A741 PolarHBondContact O-N 3.11Å
738	A	94.6	Very high	93	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.9	-44.3	-179.7	0	0	0	0	0	112	Y732 S734 A735 Q740 A741 V742 F750	Y732-A738 HydrophobicContact CD2-CB 4.01Å; Y732-A738 HydrophobicContact CG-CB 4.02Å; S734-A738 PolarHBondContact O-N 3.17Å; A735-A738 PolarHBondContact O-N 3.15Å; A738-Q740 VanDerWaalsContact C-N 3.31Å; A738-Q740 PolarHBondContact O-N 3.25Å; A738-A741 WeakPolarHBondContact O-CB 3.48Å; A738-A741 PolarHBondContact O-N 3.29Å; A738-A741 VanDerWaalsContact O-N 3.17Å; A738-V742 WeakPolarHBondContact O-CG2 3.34Å; A738-V742 PolarHBondContact O-N 3.26Å; A738-F750 HydrophobicContact CB-CD1 4.33Å; A738-F750 HydrophobicContact CB-CD2 3.59Å; A738-F750 HydrophobicContact CB-CE1 4.12Å; A738-F750 HydrophobicContact CB-CE2 3.36Å; A738-F750 HydrophobicContact CB-CG 4.09Å; A738-F750 HydrophobicContact CB-CZ 3.65Å
739	I	94.3	Very high	93.1	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-42.7	176.8	-67.3	156.9	0	0	0	110.6	L562 A735 A741 V742 R743 F750 E760 L767	L562-I739 HydrophobicContact CD2-CG1 4.2Å; L562-I739 HydrophobicContact CD2-CG2 4.49Å; A735-I739 WeakPolarHBondContact O-CD1 3.47Å; A735-I739 VanDerWaalsContact O-CG1 3.27Å; A735-I739 WeakPolarHBondContact O-CG1 3.35Å; A735-I739 PolarHBondContact O-N 2.96Å; I739-A741 VanDerWaalsContact C-N 3.34Å; I739-A741 PolarHBondContact O-N 3.43Å; I739-V742 PolarHBondContact O-N 3.1Å; I739-R743 PolarHBondContact O-N 2.86Å; I739-R743 VanDerWaalsContact O-N 3.12Å; I739-F750 HydrophobicContact CG1-CD1 4.24Å; I739-F750 HydrophobicContact CG1-CE1 4.06Å; I739-E760 HydrophobicContact CD1-CG 3.75Å; I739-L767 HydrophobicContact CG2-CD1 3.91Å
740	Q	93.7	Very high	93.2	Very high	87 Å²	87	46.1 Å²	46.1	41%	0.407	24%	0.235	S	C	.	.	H	α-helix	trans	-64.7	-39	176.3	-171	59.3	32.2	0	0	111.8	A736 E737 A738 V742 R743 D744	A736-Q740 PolarHBondContact O-N 3.47Å; A736-Q740 VanDerWaalsContact O-N 3.09Å; E737-Q740 PolarHBondContact O-N 3.45Å; A738-Q740 VanDerWaalsContact C-N 3.31Å; A738-Q740 PolarHBondContact O-N 3.25Å; Q740-V742 VanDerWaalsContact C-N 3.3Å; Q740-V742 PolarHBondContact O-N 2.94Å; Q740-R743 PolarHBondContact O-N 3.48Å; Q740-D744 PolarHBondContact NE2-OD1 3.18Å; Q740-D744 WeakPolarHBondContact O-CB 3.42Å; Q740-D744 PolarHBondContact O-N 3.42Å
741	A	95.5	Very high	93.3	Very high	5 Å²	5	43.1 Å²	43.1	4%	0.041	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-33.9	175.7	0	0	0	0	0	113.1	Y732 E737 A738 I739 D744 N745 K746 L747	Y732-A741 HydrophobicContact CE1-CB 3.98Å; Y732-A741 HydrophobicContact CE2-CB 4.45Å; Y732-A741 WeakPolarHBondContact OH-CB 3.21Å; E737-A741 WeakPolarHBondContact O-CB 3.48Å; E737-A741 PolarHBondContact O-N 3.11Å; A738-A741 WeakPolarHBondContact O-CB 3.48Å; A738-A741 PolarHBondContact O-N 3.29Å; A738-A741 VanDerWaalsContact O-N 3.17Å; I739-A741 VanDerWaalsContact C-N 3.34Å; I739-A741 PolarHBondContact O-N 3.43Å; A741-D744 PolarHBondContact O-N 3.45Å; A741-N745 PolarHBondContact O-N 3.32Å; A741-K746 HydrophobicContact CB-CB 4.34Å; A741-K746 PolarHBondContact O-N 3.32Å; A741-L747 HydrophobicContact CB-CB 4.02Å; A741-L747 PolarHBondContact O-N 3.3Å; A741-L747 VanDerWaalsContact O-N 3.11Å
742	V	94.7	Very high	93.4	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-66.6	-44.6	172.4	179.9	0	0	0	0	111	K564 A738 I739 Q740 D744 N745 L747 F750 L767	K564-V742 HydrophobicContact CB-CG1 4.32Å; A738-V742 WeakPolarHBondContact O-CG2 3.34Å; A738-V742 PolarHBondContact O-N 3.26Å; I739-V742 PolarHBondContact O-N 3.1Å; Q740-V742 VanDerWaalsContact C-N 3.3Å; Q740-V742 PolarHBondContact O-N 2.94Å; V742-D744 VanDerWaalsContact C-N 3.28Å; V742-D744 PolarHBondContact O-N 3.08Å; V742-N745 PolarHBondContact O-N 3.47Å; V742-N745 VanDerWaalsContact O-N 3.15Å; V742-L747 WeakPolarHBondContact CA-O 3.47Å; V742-L747 HydrophobicContact CG2-CB 4.05Å; V742-L747 HydrophobicContact CG2-CD2 3.82Å; V742-L747 HydrophobicContact CG2-CG 4.06Å; V742-F750 HydrophobicContact CG2-CB 3.64Å; V742-L767 HydrophobicContact CB-CD2 4.42Å; V742-L767 HydrophobicContact CG1-CD2 3.71Å
743	R	92.9	Very high	93.4	Very high	30 Å²	30	40 Å²	40	11%	0.113	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-38.4	176.1	-69.8	-171.7	178.7	119.5	9	112.2	K564 I739 Q740 N745 E760 K764 D766 L767	K564-R743 PolarHBondContact NZ-O 2.56Å; I739-R743 PolarHBondContact O-N 2.86Å; I739-R743 VanDerWaalsContact O-N 3.12Å; Q740-R743 PolarHBondContact O-N 3.48Å; R743-N745 PolarHBondContact O-N 2.91Å; R743-E760 IonicContact CZ-OE2 3.77Å; R743-E760 IonicContact NH1-OE2 2.8Å; R743-E760 IonicContact NH2-OE2 2.79Å; R743-E760 PolarHBondContact NH2-OE2 3.41Å; R743-K764 VanDerWaalsContact CZ-CD 3.43Å; R743-K764 VanDerWaalsContact NH2-CD 3.32Å; R743-D766 VanDerWaalsContact CD-OD2 3.29Å; R743-D766 WeakPolarHBondContact CD-OD2 3.41Å; R743-D766 WeakPolarHBondContact CG-OD2 3.45Å; R743-D766 IonicContact NE-OD1 2.92Å; R743-D766 IonicContact NE-OD2 3.81Å; R743-D766 PolarHBondContact NE-OD2 3.16Å; R743-L767 HydrophobicContact CG-CD1 3.92Å; R743-L767 HydrophobicContact CG-CD2 3.95Å; R743-L767 HydrophobicContact CG-CG 4.13Å
744	D	93.6	Very high	93.7	Very high	72 Å²	72	35.6 Å²	35.6	39%	0.385	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-0	178.8	-71.9	1.3	0	0	0	114	Q740 A741 V742 K746	Q740-D744 PolarHBondContact NE2-OD1 3.18Å; Q740-D744 WeakPolarHBondContact O-CB 3.42Å; Q740-D744 PolarHBondContact O-N 3.42Å; A741-D744 PolarHBondContact O-N 3.45Å; V742-D744 VanDerWaalsContact C-N 3.28Å; V742-D744 PolarHBondContact O-N 3.08Å; D744-K746 HydrophobicContact CB-CD 4.06Å; D744-K746 HydrophobicContact CB-CG 4.07Å; D744-K746 PolarHBondContact O-N 3.4Å; D744-K746 IonicContact OD2-NZ 3.95Å; D744-K746 PolarHBondContact OD2-NZ 3.13Å
745	N	91.1	Very high	93.8	Very high	101 Å²	101	33.9 Å²	33.9	54%	0.54	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	17.8	-171.3	-62.5	-20.9	0	0	0	114.6	K564 A741 V742 R743	K564-N745 WeakPolarHBondContact CD-OD1 3.26Å; K564-N745 WeakPolarHBondContact CE-OD1 3.48Å; K564-N745 PolarHBondContact NZ-ND2 3.48Å; K564-N745 PolarHBondContact NZ-OD1 2.77Å; A741-N745 PolarHBondContact O-N 3.32Å; V742-N745 PolarHBondContact O-N 3.47Å; V742-N745 VanDerWaalsContact O-N 3.15Å; R743-N745 PolarHBondContact O-N 2.91Å
746	K	93.9	Very high	94	Very high	133 Å²	133	33.6 Å²	33.6	58%	0.578	17%	0.173	S	C	*	.	S	Bend	trans	-79	-33.7	174.1	-67.8	170.2	-176	147.9	0	111.2	A741 D744	A741-K746 HydrophobicContact CB-CB 4.34Å; A741-K746 PolarHBondContact O-N 3.32Å; D744-K746 HydrophobicContact CB-CD 4.06Å; D744-K746 HydrophobicContact CB-CG 4.07Å; D744-K746 PolarHBondContact O-N 3.4Å; D744-K746 IonicContact OD2-NZ 3.95Å; D744-K746 PolarHBondContact OD2-NZ 3.13Å
747	L	94.9	Very high	94.1	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	15%	0.146	C	C	.	.			trans	-115.7	129.4	176.9	-174.1	65.4	0	0	0	108.9	I701 A703 Y732 A741 V742 A749 F750	I701-L747 HydrophobicContact CG2-CD1 3.93Å; I701-L747 WeakPolarHBondContact O-CD1 3.25Å; A703-L747 HydrophobicContact CB-CD1 3.77Å; A703-L747 HydrophobicContact CB-CD2 4.2Å; Y732-L747 HydrophobicContact CD2-CD2 4.47Å; Y732-L747 HydrophobicContact CE2-CD1 4.4Å; Y732-L747 HydrophobicContact CE2-CD2 3.93Å; A741-L747 HydrophobicContact CB-CB 4.02Å; A741-L747 PolarHBondContact O-N 3.3Å; A741-L747 VanDerWaalsContact O-N 3.11Å; V742-L747 WeakPolarHBondContact CA-O 3.47Å; V742-L747 HydrophobicContact CG2-CB 4.05Å; V742-L747 HydrophobicContact CG2-CD2 3.82Å; V742-L747 HydrophobicContact CG2-CG 4.06Å; L747-A749 WeakPolarHBondContact CG-O 3.4Å; L747-F750 HydrophobicContact CD2-CB 3.88Å; L747-F750 HydrophobicContact CD2-CD2 4.29Å; L747-F750 HydrophobicContact CD2-CG 4.45Å
748	H	93.4	Very high	94	Very high	82 Å²	82	29 Å²	29	38%	0.38	14%	0.14	S	C	.	.	S	Bend	trans	-84.8	-35.7	-176.8	-60.1	84	0	0	0	111.9	K699 F700 I701	K699-H748 PolarHBondContact O-CE1 3.09Å; K699-H748 VanDerWaalsContact O-CE1 3.25Å; F700-H748 HydrophobicContact CD2-CB 3.77Å; F700-H748 HydrophobicContact CE2-CB 3.44Å; F700-H748 VanDerWaalsContact CE2-CB 3.44Å; F700-H748 HydrophobicContact CG-CB 4.47Å; F700-H748 HydrophobicContact CZ-CB 3.89Å; I701-H748 PolarHBondContact N-ND1 3.08Å; I701-H748 WeakPolarHBondContact O-CB 3.4Å; I701-H748 PolarHBondContact O-N 2.9Å
749	A	94.6	Very high	93.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	138.8	177.3	0	0	0	0	0	112	I561 L562 V563 I685 F700 I701 Y702 A703 L747	I561-A749 HydrophobicContact CG2-CB 3.75Å; L562-A749 WeakPolarHBondContact O-CA 3.49Å; V563-A749 HydrophobicContact CG1-CB 4.03Å; I685-A749 HydrophobicContact CD1-CB 3.9Å; F700-A749 HydrophobicContact CE1-CB 4.11Å; F700-A749 HydrophobicContact CZ-CB 3.81Å; I701-A749 PolarHBondContact O-N 3.19Å; Y702-A749 WeakPolarHBondContact CA-O 3.34Å; Y702-A749 WeakPolarHBondContact CB-O 3.38Å; A703-A749 PolarHBondContact N-O 3.47Å; L747-A749 WeakPolarHBondContact CG-O 3.4Å
750	F	96.8	Very high	93.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.4	176.7	175.5	-127.4	0	0	0	110.4	I561 L562 A703 V705 A735 A738 I739 V742 L747 W752 L757	I561-F750 CarbonylContact C-O 3.59Å; I561-F750 WeakPolarHBondContact CA-O 3.32Å; L562-F750 HydrophobicContact CB-CB 4.31Å; L562-F750 HydrophobicContact CB-CD1 4.48Å; L562-F750 HydrophobicContact CD2-CD1 4.37Å; L562-F750 PolarHBondContact N-O 3.37Å; L562-F750 PolarHBondContact O-N 3.27Å; A703-F750 WeakPolarHBondContact O-CD2 3.28Å; V705-F750 HydrophobicContact CG2-CE2 4.07Å; V705-F750 HydrophobicContact CG2-CZ 3.95Å; A735-F750 HydrophobicContact CB-CZ 4.41Å; A738-F750 HydrophobicContact CB-CD1 4.33Å; A738-F750 HydrophobicContact CB-CD2 3.59Å; A738-F750 HydrophobicContact CB-CE1 4.12Å; A738-F750 HydrophobicContact CB-CE2 3.36Å; A738-F750 HydrophobicContact CB-CG 4.09Å; A738-F750 HydrophobicContact CB-CZ 3.65Å; I739-F750 HydrophobicContact CG1-CD1 4.24Å; I739-F750 HydrophobicContact CG1-CE1 4.06Å; V742-F750 HydrophobicContact CG2-CB 3.64Å; L747-F750 HydrophobicContact CD2-CB 3.88Å; L747-F750 HydrophobicContact CD2-CD2 4.29Å; L747-F750 HydrophobicContact CD2-CG 4.45Å; F750-W752 HydrophobicContact CD1-CB 4.12Å; F750-W752 HydrophobicContact CE1-CB 3.49Å; F750-W752 VanDerWaalsContact CE1-CB 3.49Å; F750-W752 HydrophobicContact CE1-CD2 4.45Å; F750-W752 AromaticContact CE1-CG 3.8Å; F750-W752 HydrophobicContact CE1-CG 3.8Å; F750-W752 HydrophobicContact CE2-CB 4.34Å; F750-W752 HydrophobicContact CE2-CE3 4.38Å; F750-W752 HydrophobicContact CZ-CB 3.62Å; F750-W752 AromaticContact CZ-CD2 3.83Å; F750-W752 HydrophobicContact CZ-CD2 3.83Å; F750-W752 HydrophobicContact CZ-CE3 4.05Å; F750-W752 AromaticContact CZ-CG 3.66Å; F750-W752 HydrophobicContact CZ-CG 3.66Å; F750-L757 HydrophobicContact CD1-CD2 3.78Å; F750-L757 HydrophobicContact CE1-CD2 3.82Å
751	I	96.8	Very high	93.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	118.4	-178.9	-56.2	176.8	0	0	0	109.1	I561 Y702 A703 T704 V710 F714 M727 F774	I561-I751 HydrophobicContact CG1-CG1 4.33Å; Y702-I751 HydrophobicContact CD2-CD1 4.32Å; A703-I751 PolarHBondContact O-N 2.84Å; A703-I751 VanDerWaalsContact O-N 3.11Å; T704-I751 PolarHBondContact OG1-O 2.99Å; V710-I751 HydrophobicContact CG1-CG2 4.13Å; F714-I751 HydrophobicContact CE2-CD1 4.4Å; F714-I751 HydrophobicContact CE2-CG2 4.19Å; F714-I751 HydrophobicContact CZ-CD1 4Å; M727-I751 HydrophobicContact CE-CD1 4.43Å; M727-I751 HydrophobicContact SD-CD1 4.33Å; I751-F774 HydrophobicContact CG2-CE2 4.49Å; I751-F774 HydrophobicContact CG2-CZ 3.76Å
752	W	95.9	Very high	93.1	Very high	3 Å²	3	27.3 Å²	27.3	1%	0.011	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	177.9	-177.5	-156.1	-117.1	0	0	0	113.1	F505 L559 T560 V705 S708 V710 F750 S754 L757	F505-W752 HydrophobicContact CE2-CZ2 4.37Å; L559-W752 WeakPolarHBondContact CA-O 3.21Å; T560-W752 PolarHBondContact N-O 2.85Å; T560-W752 PolarHBondContact O-N 3.42Å; V705-W752 HydrophobicContact CB-CE3 4.13Å; V705-W752 HydrophobicContact CB-CH2 3.34Å; V705-W752 HydrophobicContact CB-CZ2 4.23Å; V705-W752 HydrophobicContact CB-CZ3 3.29Å; V705-W752 HydrophobicContact CG1-CH2 4.11Å; V705-W752 HydrophobicContact CG1-CZ3 4.48Å; V705-W752 HydrophobicContact CG2-CD2 4.13Å; V705-W752 HydrophobicContact CG2-CE3 3.68Å; V705-W752 HydrophobicContact CG2-CH2 3.41Å; V705-W752 VanDerWaalsContact CG2-CH2 3.41Å; V705-W752 HydrophobicContact CG2-CZ2 3.86Å; V705-W752 HydrophobicContact CG2-CZ3 3.33Å; S708-W752 WeakPolarHBondContact OG-CZ3 3.12Å; V710-W752 HydrophobicContact CB-CE3 4.42Å; V710-W752 HydrophobicContact CB-CZ3 4.25Å; V710-W752 HydrophobicContact CG2-CE3 3.75Å; V710-W752 HydrophobicContact CG2-CZ3 3.8Å; F750-W752 HydrophobicContact CD1-CB 4.12Å; F750-W752 HydrophobicContact CE1-CB 3.49Å; F750-W752 VanDerWaalsContact CE1-CB 3.49Å; F750-W752 HydrophobicContact CE1-CD2 4.45Å; F750-W752 AromaticContact CE1-CG 3.8Å; F750-W752 HydrophobicContact CE1-CG 3.8Å; F750-W752 HydrophobicContact CE2-CB 4.34Å; F750-W752 HydrophobicContact CE2-CE3 4.38Å; F750-W752 HydrophobicContact CZ-CB 3.62Å; F750-W752 AromaticContact CZ-CD2 3.83Å; F750-W752 HydrophobicContact CZ-CD2 3.83Å; F750-W752 HydrophobicContact CZ-CE3 4.05Å; F750-W752 AromaticContact CZ-CG 3.66Å; F750-W752 HydrophobicContact CZ-CG 3.66Å; W752-S754 PolarHBondContact O-N 2.94Å; W752-L757 HydrophobicContact CB-CD1 3.7Å; W752-L757 HydrophobicContact CB-CD2 3.94Å; W752-L757 HydrophobicContact CB-CG 3.84Å
753	D	94.9	Very high	92.6	Very high	5 Å²	5	31 Å²	31	3%	0.027	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	128.5	177.3	-69.8	-36.7	0	0	0	111.1	Q557 L559 A755 V756 L757 F779	Q557-D753 PolarHBondContact NE2-OD1 3.01Å; Q557-D753 PolarHBondContact OE1-OD1 3.48Å; L559-D753 WeakPolarHBondContact CD2-OD1 3.48Å; D753-A755 VanDerWaalsContact C-N 3.32Å; D753-A755 PolarHBondContact O-N 3.5Å; D753-V756 PolarHBondContact O-N 2.96Å; D753-V756 VanDerWaalsContact O-N 3.13Å; D753-L757 PolarHBondContact O-N 3.17Å; D753-F779 HydrophobicContact CB-CZ 4.18Å
754	S	94.3	Very high	92	Very high	4 Å²	4	34.8 Å²	34.8	3%	0.028	17%	0.169	C	C	.	.	H	α-helix	trans	-54.5	-42	-177.1	45.9	0	0	0	0	114	Q557 G558 W752 V756 L757 E758	Q557-S754 PolarHBondContact OE1-OG 3.28Å; G558-S754 PolarHBondContact N-OG 3.35Å; G558-S754 WeakPolarHBondContact O-CA 3.01Å; G558-S754 WeakPolarHBondContact O-CB 3.48Å; G558-S754 PolarHBondContact O-N 3.34Å; G558-S754 PolarHBondContact O-OG 2.93Å; W752-S754 PolarHBondContact O-N 2.94Å; S754-V756 PolarHBondContact O-N 2.8Å; S754-V756 VanDerWaalsContact O-N 3.15Å; S754-L757 PolarHBondContact O-N 3.44Å; S754-L757 VanDerWaalsContact O-N 3.12Å; S754-E758 VanDerWaalsContact O-CB 3.3Å; S754-E758 WeakPolarHBondContact O-CB 3.46Å; S754-E758 VanDerWaalsContact O-CG 3.32Å; S754-E758 WeakPolarHBondContact O-CG 3.47Å; S754-E758 PolarHBondContact O-N 3.23Å
755	A	92.2	Very high	91.6	Very high	2 Å²	2	34 Å²	34	2%	0.017	17%	0.169	C	C	.	.	H	α-helix	trans	-60.3	-29.7	-178	0	0	0	0	0	113.2	F429 Q557 D753 F779	F429-A755 HydrophobicContact CE2-CB 4.02Å; F429-A755 HydrophobicContact CZ-CB 3.78Å; Q557-A755 HydrophobicContact CB-CB 4.46Å; D753-A755 VanDerWaalsContact C-N 3.32Å; D753-A755 PolarHBondContact O-N 3.5Å; A755-F779 HydrophobicContact CB-CE2 4.04Å
756	V	93.3	Very high	91.4	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.018	16%	0.157	C	C	.	.	H	α-helix	trans	-81.6	-44.5	175.4	177.5	0	0	0	0	110.4	Q426 F429 D753 S754 F759 E760	Q426-V756 HydrophobicContact CG-CG2 4.38Å; F429-V756 HydrophobicContact CE2-CG2 4.3Å; D753-V756 PolarHBondContact O-N 2.96Å; D753-V756 VanDerWaalsContact O-N 3.13Å; S754-V756 PolarHBondContact O-N 2.8Å; S754-V756 VanDerWaalsContact O-N 3.15Å; V756-F759 PolarHBondContact O-N 2.98Å; V756-E760 PolarHBondContact O-N 3.13Å
757	L	93.3	Very high	91.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-70.6	-37.8	-175.7	-65.1	-172.9	0	0	0	113.5	T560 L562 F750 W752 D753 S754 F759 E760 A761 T769	T560-L757 HydrophobicContact CG2-CB 3.9Å; T560-L757 HydrophobicContact CG2-CD1 3.58Å; T560-L757 HydrophobicContact CG2-CG 4.29Å; T560-L757 WeakPolarHBondContact O-CD1 3.5Å; L562-L757 HydrophobicContact CB-CD1 3.91Å; L562-L757 HydrophobicContact CB-CD2 3.92Å; L562-L757 HydrophobicContact CB-CG 4.38Å; L562-L757 HydrophobicContact CD1-CB 4.36Å; L562-L757 HydrophobicContact CD1-CD2 4.41Å; L562-L757 HydrophobicContact CD2-CD2 3.85Å; L562-L757 HydrophobicContact CG-CD2 4.28Å; F750-L757 HydrophobicContact CD1-CD2 3.78Å; F750-L757 HydrophobicContact CE1-CD2 3.82Å; W752-L757 HydrophobicContact CB-CD1 3.7Å; W752-L757 HydrophobicContact CB-CD2 3.94Å; W752-L757 HydrophobicContact CB-CG 3.84Å; D753-L757 PolarHBondContact O-N 3.17Å; S754-L757 PolarHBondContact O-N 3.44Å; S754-L757 VanDerWaalsContact O-N 3.12Å; L757-F759 VanDerWaalsContact C-N 3.34Å; L757-E760 PolarHBondContact O-N 3.04Å; L757-A761 VanDerWaalsContact O-CB 3.3Å; L757-A761 WeakPolarHBondContact O-CB 3.44Å; L757-A761 PolarHBondContact O-N 3.5Å; L757-T769 HydrophobicContact CB-CG2 3.77Å
758	E	89.9	Confident	91	Very high	75 Å²	75	26.6 Å²	26.6	35%	0.35	14%	0.136	S	C	.	.	H	α-helix	trans	-63.3	-42.5	174.7	-73	176.9	-173.4	0	0	110.7	S754 A761 S762 T769	S754-E758 VanDerWaalsContact O-CB 3.3Å; S754-E758 WeakPolarHBondContact O-CB 3.46Å; S754-E758 VanDerWaalsContact O-CG 3.32Å; S754-E758 WeakPolarHBondContact O-CG 3.47Å; S754-E758 PolarHBondContact O-N 3.23Å; E758-A761 PolarHBondContact O-N 2.83Å; E758-S762 VanDerWaalsContact O-CB 3.25Å; E758-S762 WeakPolarHBondContact O-CB 3.43Å; E758-S762 PolarHBondContact O-N 2.91Å; E758-S762 PolarHBondContact O-OG 2.95Å; E758-T769 HydrophobicContact CG-CG2 4.45Å
759	F	91.6	Very high	90.9	Very high	10 Å²	10	25 Å²	25	4%	0.044	13%	0.132	C	C	.	.	H	α-helix	trans	-59	-50.8	174	171.2	-101.8	0	0	0	111.4	P428 Y431 V756 L757 A761 S762 Q763 W813 V814	P428-F759 HydrophobicContact CB-CD1 3.83Å; P428-F759 HydrophobicContact CB-CD2 3.74Å; P428-F759 HydrophobicContact CB-CE1 3.92Å; P428-F759 HydrophobicContact CB-CE2 3.82Å; P428-F759 HydrophobicContact CB-CG 3.74Å; P428-F759 HydrophobicContact CB-CZ 3.93Å; P428-F759 HydrophobicContact CG-CB 3.9Å; P428-F759 HydrophobicContact CG-CD1 3.98Å; P428-F759 HydrophobicContact CG-CD2 3.99Å; P428-F759 HydrophobicContact CG-CG 3.67Å; Y431-F759 VanDerWaalsContact OH-CZ 3.23Å; Y431-F759 WeakPolarHBondContact OH-CZ 3.37Å; V756-F759 PolarHBondContact O-N 2.98Å; L757-F759 VanDerWaalsContact C-N 3.34Å; F759-A761 PolarHBondContact O-N 3.46Å; F759-S762 PolarHBondContact O-N 3.26Å; F759-S762 PolarHBondContact O-OG 3.36Å; F759-Q763 PolarHBondContact O-N 3.4Å; F759-W813 WeakPolarHBondContact CD2-O 3.46Å; F759-W813 WeakPolarHBondContact CE2-O 3.45Å; F759-V814 HydrophobicContact CB-CG1 4.37Å
760	E	91.3	Very high	90.6	Very high	18 Å²	18	25.5 Å²	25.5	8%	0.084	14%	0.136	C	C	.	.	H	α-helix	trans	-63.3	-40	180	-79	-75.2	168.1	0	0	113.6	I739 R743 V756 L757 S762 Q763 K764	I739-E760 HydrophobicContact CD1-CG 3.75Å; R743-E760 IonicContact CZ-OE2 3.77Å; R743-E760 IonicContact NH1-OE2 2.8Å; R743-E760 IonicContact NH2-OE2 2.79Å; R743-E760 PolarHBondContact NH2-OE2 3.41Å; V756-E760 PolarHBondContact O-N 3.13Å; L757-E760 PolarHBondContact O-N 3.04Å; E760-S762 VanDerWaalsContact C-N 3.3Å; E760-Q763 PolarHBondContact O-N 2.94Å; E760-K764 PolarHBondContact O-N 2.71Å
761	A	89.4	Confident	89.9	Confident	12 Å²	12	27.2 Å²	27.2	10%	0.099	15%	0.154	C	C	.	.	H	α-helix	trans	-64.2	-38.5	175.4	0	0	0	0	0	111.3	L562 L757 E758 F759 C765 T769 C819	L562-A761 HydrophobicContact CD1-CB 4.34Å; L757-A761 VanDerWaalsContact O-CB 3.3Å; L757-A761 WeakPolarHBondContact O-CB 3.44Å; L757-A761 PolarHBondContact O-N 3.5Å; E758-A761 PolarHBondContact O-N 2.83Å; F759-A761 PolarHBondContact O-N 3.46Å; A761-C765 WeakPolarHBondContact O-CA 3.4Å; A761-C765 PolarHBondContact O-N 3.36Å; A761-T769 HydrophobicContact CB-CG2 4.37Å; A761-C819 PolarHBondContact O-SG 2.91Å; A761-C819 VanDerWaalsContact O-SG 3.37Å
762	S	86.2	Confident	89.5	Confident	20 Å²	20	35.1 Å²	35.1	14%	0.14	19%	0.191	C	C	.	.	H	α-helix	trans	-70.9	-29.1	179.1	83.9	0	0	0	0	113.6	E758 F759 E760 Q817 C819	E758-S762 VanDerWaalsContact O-CB 3.25Å; E758-S762 WeakPolarHBondContact O-CB 3.43Å; E758-S762 PolarHBondContact O-N 2.91Å; E758-S762 PolarHBondContact O-OG 2.95Å; F759-S762 PolarHBondContact O-N 3.26Å; F759-S762 PolarHBondContact O-OG 3.36Å; E760-S762 VanDerWaalsContact C-N 3.3Å; S762-Q817 VanDerWaalsContact CB-O 3.26Å; S762-Q817 WeakPolarHBondContact CB-O 3.25Å; S762-C819 PolarHBondContact O-SG 2.8Å
763	Q	84.6	Confident	89.3	Confident	78 Å²	78	38.2 Å²	38.2	36%	0.364	21%	0.207	S	C	.	.	H	α-helix	trans	-77.6	-43.6	-174.9	-167.8	-175.8	40.8	0	0	112.9	F759 E760	F759-Q763 PolarHBondContact O-N 3.4Å; E760-Q763 PolarHBondContact O-N 2.94Å
764	K	80	Confident	89.2	Confident	110 Å²	110	39.1 Å²	39.1	48%	0.478	21%	0.211	S	C	.	.	H	α-helix	trans	-114.4	-6	-170.9	-57.1	-160.1	-155.6	169.3	0	114.8	R743 E760 D766	R743-K764 VanDerWaalsContact CZ-CD 3.43Å; R743-K764 VanDerWaalsContact NH2-CD 3.32Å; E760-K764 PolarHBondContact O-N 2.71Å; K764-D766 WeakPolarHBondContact CB-OD1 3.45Å; K764-D766 PolarHBondContact O-N 3.23Å
765	C	85.2	Confident	89	Confident	57 Å²	57	41.5 Å²	41.5	39%	0.385	22%	0.221	S	C	.	.	S	Bend	trans	50.5	5	175.9	-52.4	0	0	0	0	117	A761 C819	A761-C765 WeakPolarHBondContact O-CA 3.4Å; A761-C765 PolarHBondContact O-N 3.36Å; C765-C819 WeakPolarHBondContact CA-SG 3.48Å; C765-C819 HydrophobicContact CB-CB 3.97Å; C765-C819 WeakPolarHBondContact CB-SG 3.48Å; C765-C819 WeakPolarHBondContact SG-CB 3.11Å; C765-C819 CovalentContact SG-SG 2.03Å; C765-C819 PolarHBondContact SG-SG 3.49Å
766	D	87.8	Confident	89.1	Confident	51 Å²	51	51.3 Å²	51.3	27%	0.273	26%	0.257	S	S	.	.	S	Bend	trans	-90	-19.6	176.3	62.5	-28.7	0	0	0	112	K565 R743 K764	K565-D766 VanDerWaalsContact CB-O 3.27Å; K565-D766 WeakPolarHBondContact CB-O 3.05Å; K565-D766 PolarHBondContact N-O 3.1Å; R743-D766 VanDerWaalsContact CD-OD2 3.29Å; R743-D766 WeakPolarHBondContact CD-OD2 3.41Å; R743-D766 WeakPolarHBondContact CG-OD2 3.45Å; R743-D766 IonicContact NE-OD1 2.92Å; R743-D766 IonicContact NE-OD2 3.81Å; R743-D766 PolarHBondContact NE-OD2 3.16Å; K764-D766 WeakPolarHBondContact CB-OD1 3.45Å; K764-D766 PolarHBondContact O-N 3.23Å
767	L	90.1	Very high	89	Confident	3 Å²	3	52 Å²	52	2%	0.016	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	151.1	177.2	-57.3	174.3	0	0	0	109.9	L562 V563 K564 I739 V742 R743	L562-L767 HydrophobicContact CD1-CB 3.87Å; L562-L767 HydrophobicContact CD2-CD1 3.73Å; L562-L767 HydrophobicContact CG-CB 4.23Å; L562-L767 HydrophobicContact CG-CD1 4.33Å; V563-L767 WeakPolarHBondContact O-CA 3.43Å; K564-L767 HydrophobicContact CB-CD2 4.24Å; K564-L767 HydrophobicContact CG-CD2 4.38Å; I739-L767 HydrophobicContact CG2-CD1 3.91Å; V742-L767 HydrophobicContact CB-CD2 4.42Å; V742-L767 HydrophobicContact CG1-CD2 3.71Å; R743-L767 HydrophobicContact CG-CD1 3.92Å; R743-L767 HydrophobicContact CG-CD2 3.95Å; R743-L767 HydrophobicContact CG-CG 4.13Å
768	V	89.4	Confident	89.1	Confident	25 Å²	25	52.3 Å²	52.3	15%	0.152	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	143.3	175.2	-63	0	0	0	0	109.7	V563 K565 T770	V563-V768 HydrophobicContact CG2-CG2 3.68Å; V563-V768 PolarHBondContact N-O 3.08Å; V563-V768 PolarHBondContact O-N 2.89Å; K565-V768 HydrophobicContact CB-CG1 4.12Å; K565-V768 HydrophobicContact CD-CG1 4.22Å; K565-V768 HydrophobicContact CG-CG1 4.36Å; V768-T770 HydrophobicContact CG2-CG2 4.21Å
769	T	91.3	Very high	89.4	Confident	48 Å²	48	48.7 Å²	48.7	29%	0.294	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	143.5	167.5	52.9	0	0	0	0	109.6	T560 I561 L562 L757 E758 A761	T560-T769 HydrophobicContact CG2-CG2 3.89Å; I561-T769 CarbonylContact O-C 3.54Å; I561-T769 WeakPolarHBondContact O-CA 3.48Å; L562-T769 HydrophobicContact CD1-CG2 4.06Å; L757-T769 HydrophobicContact CB-CG2 3.77Å; E758-T769 HydrophobicContact CG-CG2 4.45Å; A761-T769 HydrophobicContact CB-CG2 4.37Å
770	T	87.6	Confident	89.6	Confident	11 Å²	11	48.2 Å²	48.2	7%	0.067	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	147.5	-176.1	53.8	0	0	0	0	112	T560 I561 V563 R684 I685 V768	T560-T770 PolarHBondContact OG1-O 2.98Å; I561-T770 PolarHBondContact O-N 3.3Å; I561-T770 PolarHBondContact O-OG1 3.05Å; V563-T770 HydrophobicContact CG2-CG2 3.62Å; R684-T770 HydrophobicContact CB-CG2 3.96Å; R684-T770 HydrophobicContact CG-CG2 4.47Å; I685-T770 WeakPolarHBondContact O-CB 3.48Å; V768-T770 HydrophobicContact CG2-CG2 4.21Å
771	G	83.5	Confident	89.9	Confident	37 Å²	37	47.4 Å²	47.4	38%	0.381	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	80.6	170.4	179	0	0	0	0	0	114.7	T686	T686-G771 WeakPolarHBondContact O-CA 3.38Å
772	E	88.4	Confident	90.3	Very high	166 Å²	166	46.8 Å²	46.8	78%	0.776	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	149.7	174.9	-65.4	-172.5	172.7	0	0	111.8	F774	E772-F774 PolarHBondContact O-N 2.89Å; E772-F774 VanDerWaalsContact O-N 3.08Å
773	L	92.1	Very high	90.7	Very high	67 Å²	67	45.9 Å²	45.9	35%	0.351	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	111.3	172.5	-65.6	172.7	0	0	0	110.3	L559	L559-L773 WeakPolarHBondContact O-CA 3.48Å
774	F	91.8	Very high	90.9	Very high	25 Å²	25	45.4 Å²	45.4	11%	0.11	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	162.3	172.7	65.4	-85	0	0	0	110.2	L559 I561 I688 Y713 F714 I751 E772 R776	L559-F774 HydrophobicContact CB-CD1 4.31Å; L559-F774 HydrophobicContact CB-CD2 3.92Å; L559-F774 HydrophobicContact CB-CE1 3.98Å; L559-F774 HydrophobicContact CB-CE2 3.56Å; L559-F774 HydrophobicContact CB-CG 4.29Å; L559-F774 HydrophobicContact CB-CZ 3.59Å; L559-F774 HydrophobicContact CD1-CD2 4.25Å; L559-F774 HydrophobicContact CD1-CE2 3.71Å; L559-F774 HydrophobicContact CD1-CZ 4.37Å; L559-F774 HydrophobicContact CG-CE2 4.25Å; L559-F774 PolarHBondContact N-O 2.98Å; L559-F774 VanDerWaalsContact O-CD1 3.29Å; L559-F774 WeakPolarHBondContact O-CD1 3.2Å; L559-F774 PolarHBondContact O-N 3.45Å; L559-F774 VanDerWaalsContact O-N 3.12Å; I561-F774 HydrophobicContact CD1-CE1 4.49Å; I561-F774 HydrophobicContact CG1-CE1 4.12Å; I688-F774 HydrophobicContact CB-CD1 4.05Å; I688-F774 HydrophobicContact CB-CD2 4.44Å; I688-F774 HydrophobicContact CB-CE1 4.2Å; I688-F774 HydrophobicContact CB-CG 4.17Å; I688-F774 HydrophobicContact CB-CZ 4.46Å; I688-F774 HydrophobicContact CD1-CE1 4.44Å; I688-F774 HydrophobicContact CD1-CE2 4.02Å; I688-F774 HydrophobicContact CD1-CZ 3.94Å; I688-F774 HydrophobicContact CG1-CD2 4.32Å; I688-F774 HydrophobicContact CG1-CE2 4.25Å; I688-F774 HydrophobicContact CG1-CZ 4.4Å; I688-F774 HydrophobicContact CG2-CB 4.34Å; I688-F774 HydrophobicContact CG2-CD1 4.48Å; I688-F774 HydrophobicContact CG2-CG 4.32Å; Y713-F774 HydrophobicContact CE1-CE2 4.46Å; F714-F774 HydrophobicContact CZ-CE2 4.43Å; I751-F774 HydrophobicContact CG2-CE2 4.49Å; I751-F774 HydrophobicContact CG2-CZ 3.76Å; E772-F774 PolarHBondContact O-N 2.89Å; E772-F774 VanDerWaalsContact O-N 3.08Å; F774-R776 PolarHBondContact O-N 2.82Å
775	F	90.9	Very high	91.1	Very high	54 Å²	54	44.8 Å²	44.8	24%	0.237	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	49.8	60.7	-174.7	-174.2	-112.2	0	0	0	112.6	L559 Y713 S777	L559-F775 HydrophobicContact CD1-CB 3.86Å; L559-F775 HydrophobicContact CD1-CD1 3.75Å; L559-F775 HydrophobicContact CD1-CG 4.15Å; L559-F775 HydrophobicContact CD2-CD1 4.46Å; L559-F775 HydrophobicContact CG-CB 4.02Å; L559-F775 HydrophobicContact CG-CD1 3.85Å; L559-F775 HydrophobicContact CG-CG 4.41Å; Y713-F775 HydrophobicContact CD2-CB 4.46Å; Y713-F775 HydrophobicContact CD2-CD1 4.38Å; Y713-F775 AromaticContact CD2-CD2 3.34Å; Y713-F775 HydrophobicContact CD2-CD2 3.34Å; Y713-F775 AromaticContact CD2-CE2 3.53Å; Y713-F775 HydrophobicContact CD2-CE2 3.53Å; Y713-F775 AromaticContact CD2-CG 3.81Å; Y713-F775 HydrophobicContact CD2-CG 3.81Å; Y713-F775 HydrophobicContact CD2-CZ 4.13Å; Y713-F775 HydrophobicContact CE1-CB 4.47Å; Y713-F775 HydrophobicContact CE2-CB 4.08Å; Y713-F775 AromaticContact CE2-CD2 3.34Å; Y713-F775 HydrophobicContact CE2-CD2 3.34Å; Y713-F775 AromaticContact CE2-CE2 3.95Å; Y713-F775 HydrophobicContact CE2-CE2 3.95Å; Y713-F775 AromaticContact CE2-CG 3.85Å; Y713-F775 HydrophobicContact CE2-CG 3.85Å; Y713-F775 HydrophobicContact CG-CD1 4.5Å; Y713-F775 HydrophobicContact CG-CD2 4.2Å; Y713-F775 HydrophobicContact CG-CE2 4.39Å; Y713-F775 HydrophobicContact CG-CG 4.25Å; F775-S777 PolarHBondContact O-N 3.42Å
776	R	92.5	Very high	90.7	Very high	207 Å²	207	45.3 Å²	45.3	78%	0.781	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61.4	125.4	177	-63.4	-175.2	-175.7	-179.1	1	110	F774	F774-R776 PolarHBondContact O-N 2.82Å
777	S	92.5	Very high	90.5	Very high	18 Å²	18	44 Å²	44	13%	0.126	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	-167.7	-179.4	71.3	0	0	0	0	110	T539 Q557 F775	T539-S777 WeakPolarHBondContact CG2-OG 2.97Å; Q557-S777 PolarHBondContact N-O 3.11Å; Q557-S777 PolarHBondContact NE2-OG 3.24Å; Q557-S777 CarbonylContact O-C 3.58Å; Q557-S777 PolarHBondContact O-N 3.31Å; F775-S777 PolarHBondContact O-N 3.42Å
778	G	94.6	Very high	90.2	Very high	6 Å²	6	46.4 Å²	46.4	6%	0.062	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	154.8	175.5	0	0	0	0	0	111.3	I540 K555	I540-G778 WeakPolarHBondContact CG1-O 3.48Å; I540-G778 PolarHBondContact N-O 2.79Å; K555-G778 CarbonylContact O-C 3.4Å; K555-G778 WeakPolarHBondContact O-CA 3.43Å
779	F	96.5	Very high	90.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	136.4	171.6	-59.5	-42.9	0	0	0	110.2	F429 P537 L538 T539 P553 F554 K555 Q557 D753 A755	F429-F779 HydrophobicContact CE1-CD2 4.35Å; F429-F779 HydrophobicContact CE1-CE2 4.43Å; F429-F779 HydrophobicContact CE2-CD2 4.49Å; F429-F779 AromaticContact CE2-CE2 3.83Å; F429-F779 HydrophobicContact CE2-CE2 3.83Å; F429-F779 AromaticContact CZ-CD2 3.98Å; F429-F779 HydrophobicContact CZ-CD2 3.98Å; F429-F779 AromaticContact CZ-CE2 3.64Å; F429-F779 HydrophobicContact CZ-CE2 3.64Å; P537-F779 VanDerWaalsContact C-CD1 3.47Å; P537-F779 HydrophobicContact CB-CD1 4.13Å; P537-F779 HydrophobicContact CB-CD2 3.95Å; P537-F779 HydrophobicContact CB-CE1 4.02Å; P537-F779 HydrophobicContact CB-CE2 3.83Å; P537-F779 HydrophobicContact CB-CG 4.11Å; P537-F779 HydrophobicContact CB-CZ 3.88Å; P537-F779 WeakPolarHBondContact O-CE1 3.48Å; L538-F779 WeakPolarHBondContact O-CA 3.48Å; T539-F779 WeakPolarHBondContact OG1-CE1 3.49Å; P553-F779 CarbonylContact C-O 3.52Å; P553-F779 WeakPolarHBondContact CA-O 3.43Å; F554-F779 HydrophobicContact CD1-CB 4.3Å; F554-F779 VanDerWaalsContact CD1-O 3.31Å; F554-F779 WeakPolarHBondContact CD1-O 3.37Å; F554-F779 HydrophobicContact CE1-CB 3.59Å; F554-F779 HydrophobicContact CE2-CB 3.95Å; F554-F779 HydrophobicContact CZ-CB 3.39Å; F554-F779 HydrophobicContact CZ-CD2 4.47Å; F554-F779 HydrophobicContact CZ-CG 4.32Å; F554-F779 PolarHBondContact N-O 3.4Å; K555-F779 HydrophobicContact CB-CD2 4.15Å; K555-F779 HydrophobicContact CG-CD2 4.31Å; K555-F779 PolarHBondContact O-N 3.34Å; Q557-F779 HydrophobicContact CG-CD1 4.5Å; Q557-F779 HydrophobicContact CG-CD2 4.47Å; Q557-F779 HydrophobicContact CG-CE1 4.11Å; Q557-F779 HydrophobicContact CG-CE2 4.07Å; Q557-F779 HydrophobicContact CG-CZ 3.88Å; D753-F779 HydrophobicContact CB-CZ 4.18Å; A755-F779 HydrophobicContact CB-CE2 4.04Å
780	G	96.5	Very high	90.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.23	C	C	.	.			trans	-136.9	156	178.8	0	0	0	0	0	111.6	L538	L538-G780 PolarHBondContact O-N 2.78Å; L538-G780 VanDerWaalsContact O-N 3.1Å
781	I	97.7	Very high	90.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.246	C	C	.	.			trans	-76.7	127.5	171.6	-63.9	173.5	0	0	0	107.6	L487 M533 I534 V535 F550 S551 F554 M783 V793 I797	L487-I781 HydrophobicContact CD1-CD1 3.5Å; L487-I781 VanDerWaalsContact CD1-CD1 3.5Å; M533-I781 HydrophobicContact CG-CG2 3.48Å; M533-I781 VanDerWaalsContact CG-CG2 3.48Å; M533-I781 HydrophobicContact SD-CG2 3.66Å; I534-I781 WeakPolarHBondContact O-CG2 3.02Å; V535-I781 HydrophobicContact CG2-CG2 4.28Å; F550-I781 WeakPolarHBondContact CA-O 3.44Å; S551-I781 PolarHBondContact N-O 2.97Å; S551-I781 PolarHBondContact OG-N 3.37Å; F554-I781 HydrophobicContact CD1-CG1 4.46Å; I781-M783 HydrophobicContact CG2-CE 4.37Å; I781-V793 HydrophobicContact CB-CG1 4.42Å; I781-V793 HydrophobicContact CD1-CG1 3.83Å; I781-V793 HydrophobicContact CG2-CG1 4.39Å; I781-I797 HydrophobicContact CD1-CD1 4.1Å; I781-I797 HydrophobicContact CD1-CG1 4.44Å
782	G	96.3	Very high	90.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.4	178.4	0	0	0	0	0	111.1	M533 I534	M533-G782 CarbonylContact C-O 3.51Å; M533-G782 WeakPolarHBondContact CA-O 3.35Å; I534-G782 PolarHBondContact N-O 3.39Å; I534-G782 PolarHBondContact O-N 3.2Å; I534-G782 VanDerWaalsContact O-N 3.13Å
783	M	94.8	Very high	91.1	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	157.1	173.5	-70.5	160.5	-76.5	0	0	109.5	M533 I548 E549 I781 W789 K790 V793	M533-M783 HydrophobicContact CB-CG 4.34Å; M533-M783 HydrophobicContact CE-CG 4.04Å; M533-M783 HydrophobicContact CE-SD 3.93Å; M533-M783 HydrophobicContact CG-CG 3.95Å; I548-M783 WeakPolarHBondContact CB-O 3.37Å; E549-M783 PolarHBondContact N-O 2.88Å; E549-M783 PolarHBondContact O-N 3.38Å; I781-M783 HydrophobicContact CG2-CE 4.37Å; M783-W789 HydrophobicContact SD-CB 4.3Å; M783-K790 HydrophobicContact CE-CB 3.96Å; M783-K790 HydrophobicContact CE-CG 3.95Å; M783-K790 HydrophobicContact SD-CB 4.09Å; M783-V793 HydrophobicContact CE-CB 4.37Å; M783-V793 HydrophobicContact CE-CG1 4.29Å; M783-V793 HydrophobicContact SD-CB 4.44Å; M783-V793 HydrophobicContact SD-CG2 4.14Å
784	R	90.1	Very high	91.2	Very high	68 Å²	68	42.4 Å²	42.4	26%	0.257	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	148.1	169	-71.9	-173.9	-78.4	159.4	-3.4	110.1	L526 D532 S787	L526-R784 HydrophobicContact CD1-CG 3.87Å; L526-R784 HydrophobicContact CG-CG 4.08Å; L526-R784 WeakPolarHBondContact O-CD 3.36Å; L526-R784 WeakPolarHBondContact O-CG 3.39Å; D532-R784 IonicContact OD1-CZ 2.76Å; D532-R784 IonicContact OD1-NH2 2.82Å; D532-R784 PolarHBondContact OD1-NH2 2.84Å; R784-S787 VanDerWaalsContact O-CB 3.27Å; R784-S787 WeakPolarHBondContact O-CB 3.42Å; R784-S787 PolarHBondContact O-N 2.87Å
785	K	82.9	Confident	91.4	Very high	98 Å²	98	45.2 Å²	45.2	43%	0.426	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	143.5	175.2	-82.6	-176.6	167.2	-168.1	0	110.5	Q546 Y547 S787	Q546-K785 VanDerWaalsContact C-NZ 3.33Å; Q546-K785 VanDerWaalsContact O-CE 3.31Å; Q546-K785 WeakPolarHBondContact O-CE 3.45Å; Q546-K785 PolarHBondContact O-NZ 2.89Å; Y547-K785 WeakPolarHBondContact O-CD 3.4Å; Y547-K785 WeakPolarHBondContact O-CG 3.38Å; K785-S787 PolarHBondContact O-N 2.84Å
786	D	77.6	Confident	91.7	Very high	68 Å²	68	43.2 Å²	43.2	36%	0.364	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	10.1	-178.2	-57.4	-45.3	0	0	0	115.9	K211	K211-D786 IonicContact NZ-OD1 3.79Å; K211-D786 IonicContact NZ-OD2 2.83Å; K211-D786 PolarHBondContact NZ-OD2 3.31Å
787	S	84.3	Confident	91.9	Very high	24 Å²	24	33.4 Å²	33.4	17%	0.168	17%	0.17	C	C	.	.			trans	-54.3	130.7	174.9	179.1	0	0	0	0	111.6	R784 K785 W789 K790	R784-S787 VanDerWaalsContact O-CB 3.27Å; R784-S787 WeakPolarHBondContact O-CB 3.42Å; R784-S787 PolarHBondContact O-N 2.87Å; K785-S787 PolarHBondContact O-N 2.84Å; S787-W789 PolarHBondContact O-N 3.39Å; S787-K790 PolarHBondContact O-N 2.86Å
788	P	83.9	Confident	92.1	Very high	52 Å²	52	35.9 Å²	35.9	34%	0.338	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-23.3	-179.4	26.8	-35.1	0	0	0	112.7	M415 K790	M415-P788 HydrophobicContact CE-CB 3.81Å; M415-P788 HydrophobicContact CE-CG 3.59Å; M415-P788 HydrophobicContact CG-CG 4.41Å; M415-P788 HydrophobicContact SD-CB 4.11Å; M415-P788 HydrophobicContact SD-CG 3.93Å; P788-K790 VanDerWaalsContact C-N 3.32Å; P788-K790 PolarHBondContact O-N 3.18Å
789	W	89.2	Confident	92.2	Very high	22 Å²	22	41.9 Å²	41.9	8%	0.083	21%	0.206	C	C	.	.	H	α-helix	trans	-73.4	-21.7	-178.2	-65	107.4	0	0	0	113.8	M415 M491 F493 M533 M783 S787 Q791 N792 V793	M415-W789 HydrophobicContact CE-CD2 3.43Å; M415-W789 VanDerWaalsContact CE-CD2 3.43Å; M415-W789 HydrophobicContact CE-CE3 3.89Å; M415-W789 HydrophobicContact CE-CG 3.99Å; M415-W789 HydrophobicContact CE-CH2 3.77Å; M415-W789 HydrophobicContact CE-CZ2 3.3Å; M415-W789 HydrophobicContact CE-CZ3 4.04Å; M415-W789 HydrophobicContact CG-CZ2 4.39Å; M491-W789 HydrophobicContact CB-CZ3 4.22Å; M491-W789 HydrophobicContact SD-CE3 4.33Å; F493-W789 HydrophobicContact CB-CH2 4.05Å; F493-W789 HydrophobicContact CB-CZ2 4.36Å; F493-W789 HydrophobicContact CD1-CZ3 4.37Å; M533-W789 HydrophobicContact CE-CB 4.35Å; M783-W789 HydrophobicContact SD-CB 4.3Å; S787-W789 PolarHBondContact O-N 3.39Å; W789-Q791 VanDerWaalsContact C-N 3.34Å; W789-Q791 PolarHBondContact O-N 3.24Å; W789-N792 PolarHBondContact O-N 3.29Å; W789-N792 VanDerWaalsContact O-N 3.14Å; W789-V793 HydrophobicContact CB-CG2 4.26Å; W789-V793 VanDerWaalsContact O-CG2 3.29Å; W789-V793 WeakPolarHBondContact O-CG2 3.34Å; W789-V793 PolarHBondContact O-N 2.99Å
790	K	90.3	Very high	92.1	Very high	69 Å²	69	42.1 Å²	42.1	30%	0.3	21%	0.208	S	C	.	.	H	α-helix	trans	-55.1	-44.5	-169.3	179.6	-118.6	172.4	154.7	0	114	E549 M783 S787 P788 S794	E549-K790 HydrophobicContact CG-CD 3.66Å; E549-K790 HydrophobicContact CG-CG 3.67Å; E549-K790 VanDerWaalsContact OE1-CE 3.25Å; E549-K790 WeakPolarHBondContact OE1-CE 3.3Å; E549-K790 IonicContact OE1-NZ 3.84Å; E549-K790 PolarHBondContact OE1-NZ 2.84Å; M783-K790 HydrophobicContact CE-CB 3.96Å; M783-K790 HydrophobicContact CE-CG 3.95Å; M783-K790 HydrophobicContact SD-CB 4.09Å; S787-K790 PolarHBondContact O-N 2.86Å; P788-K790 VanDerWaalsContact C-N 3.32Å; P788-K790 PolarHBondContact O-N 3.18Å; K790-S794 WeakPolarHBondContact O-CB 3.1Å; K790-S794 PolarHBondContact O-N 3.48Å; K790-S794 PolarHBondContact O-OG 3.46Å
791	Q	90.4	Very high	92.1	Very high	87 Å²	87	45.5 Å²	45.5	41%	0.407	22%	0.224	S	C	.	.	H	α-helix	trans	-66.6	-46.7	-179	-175.6	173.3	-12.2	0	0	111	Y204 W789 S794 L795	Y204-Q791 VanDerWaalsContact OH-CD 3.3Å; Y204-Q791 PolarHBondContact OH-NE2 3.32Å; W789-Q791 VanDerWaalsContact C-N 3.34Å; W789-Q791 PolarHBondContact O-N 3.24Å; Q791-S794 PolarHBondContact O-N 2.95Å; Q791-L795 HydrophobicContact CG-CD1 4.15Å; Q791-L795 WeakPolarHBondContact O-CG 3.27Å; Q791-L795 PolarHBondContact O-N 3.37Å
792	N	92.6	Very high	92	Very high	78 Å²	78	53.2 Å²	53.2	42%	0.417	26%	0.26	S	S	.	.	H	α-helix	trans	-65.9	-40.4	-179.7	-67.7	-4.7	0	0	0	112	M491 W789 S796	M491-N792 HydrophobicContact CG-CB 4.4Å; M491-N792 HydrophobicContact SD-CB 3.7Å; W789-N792 PolarHBondContact O-N 3.29Å; W789-N792 VanDerWaalsContact O-N 3.14Å; N792-S796 WeakPolarHBondContact O-CB 3.23Å; N792-S796 PolarHBondContact O-N 3.32Å; N792-S796 PolarHBondContact O-OG 3.34Å
793	V	95.3	Very high	92	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-60.8	-50.7	173.8	171.8	0	0	0	0	109.9	M491 M533 I781 M783 W789 L795 S796 I797	M491-V793 HydrophobicContact CE-CG2 3.8Å; M491-V793 HydrophobicContact SD-CG2 3.96Å; M533-V793 HydrophobicContact CE-CG2 3.94Å; I781-V793 HydrophobicContact CB-CG1 4.42Å; I781-V793 HydrophobicContact CD1-CG1 3.83Å; I781-V793 HydrophobicContact CG2-CG1 4.39Å; M783-V793 HydrophobicContact CE-CB 4.37Å; M783-V793 HydrophobicContact CE-CG1 4.29Å; M783-V793 HydrophobicContact SD-CB 4.44Å; M783-V793 HydrophobicContact SD-CG2 4.14Å; W789-V793 HydrophobicContact CB-CG2 4.26Å; W789-V793 VanDerWaalsContact O-CG2 3.29Å; W789-V793 WeakPolarHBondContact O-CG2 3.34Å; W789-V793 PolarHBondContact O-N 2.99Å; V793-L795 PolarHBondContact O-N 3.42Å; V793-S796 PolarHBondContact O-N 2.92Å; V793-S796 VanDerWaalsContact O-N 3.12Å; V793-I797 HydrophobicContact CG1-CG1 4.41Å; V793-I797 WeakPolarHBondContact O-CG1 3.22Å; V793-I797 PolarHBondContact O-N 3Å
794	S	95.5	Very high	92	Very high	13 Å²	13	59 Å²	59	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-42.9	-178.7	-61.7	0	0	0	0	112.5	K790 Q791 S796 I797 L798	K790-S794 WeakPolarHBondContact O-CB 3.1Å; K790-S794 PolarHBondContact O-N 3.48Å; K790-S794 PolarHBondContact O-OG 3.46Å; Q791-S794 PolarHBondContact O-N 2.95Å; S794-S796 VanDerWaalsContact C-N 3.35Å; S794-I797 PolarHBondContact O-N 3.39Å; S794-L798 WeakPolarHBondContact O-CG 3.29Å; S794-L798 PolarHBondContact O-N 3.41Å
795	L	95.9	Very high	92.2	Very high	85 Å²	85	57.7 Å²	57.7	45%	0.445	29%	0.293	S	S	.	.	H	α-helix	trans	-64.7	-38.6	175.5	-71.3	172.6	0	0	0	112	Q791 V793 L798 K799	Q791-L795 HydrophobicContact CG-CD1 4.15Å; Q791-L795 WeakPolarHBondContact O-CG 3.27Å; Q791-L795 PolarHBondContact O-N 3.37Å; V793-L795 PolarHBondContact O-N 3.42Å; L795-L798 PolarHBondContact O-N 2.98Å; L795-K799 WeakPolarHBondContact O-CG 3.42Å; L795-K799 PolarHBondContact O-N 3.34Å
796	S	96.1	Very high	92.8	Very high	12 Å²	12	53.5 Å²	53.5	8%	0.084	27%	0.274	C	S	.	.	H	α-helix	trans	-68.2	-36.6	177.9	-58.8	0	0	0	0	112.2	N792 V793 S794 S800	N792-S796 WeakPolarHBondContact O-CB 3.23Å; N792-S796 PolarHBondContact O-N 3.32Å; N792-S796 PolarHBondContact O-OG 3.34Å; V793-S796 PolarHBondContact O-N 2.92Å; V793-S796 VanDerWaalsContact O-N 3.12Å; S794-S796 VanDerWaalsContact C-N 3.35Å; S796-S800 WeakPolarHBondContact O-CB 3.32Å; S796-S800 PolarHBondContact O-N 3.34Å; S796-S800 PolarHBondContact O-OG 2.95Å
797	I	96.8	Very high	93.5	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.7	-45.1	173.1	-66.1	-60	0	0	0	110.9	L483 L487 F554 I781 V793 S794 S800 H801 M806	L483-I797 HydrophobicContact CD1-CD1 3.83Å; L483-I797 HydrophobicContact CD2-CD1 4Å; L483-I797 HydrophobicContact CG-CD1 4.27Å; L487-I797 HydrophobicContact CD1-CD1 4.32Å; L487-I797 HydrophobicContact CD2-CD1 4.2Å; F554-I797 HydrophobicContact CB-CD1 4.26Å; F554-I797 HydrophobicContact CB-CG2 4Å; I781-I797 HydrophobicContact CD1-CD1 4.1Å; I781-I797 HydrophobicContact CD1-CG1 4.44Å; V793-I797 HydrophobicContact CG1-CG1 4.41Å; V793-I797 WeakPolarHBondContact O-CG1 3.22Å; V793-I797 PolarHBondContact O-N 3Å; S794-I797 PolarHBondContact O-N 3.39Å; I797-S800 WeakPolarHBondContact O-CB 3.43Å; I797-S800 PolarHBondContact O-N 3.04Å; I797-S800 VanDerWaalsContact O-N 3.11Å; I797-H801 PolarHBondContact O-CD2 3.36Å; I797-H801 PolarHBondContact O-N 3.41Å; I797-M806 HydrophobicContact CD1-CE 4.48Å
798	L	96.4	Very high	93.9	Very high	71 Å²	71	59.1 Å²	59.1	37%	0.372	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-46.5	177	-69.4	172.3	0	0	0	111.8	K552 S794 L795 S800 H801 E802	K552-L798 HydrophobicContact CB-CD2 4.37Å; K552-L798 HydrophobicContact CB-CG 4.5Å; K552-L798 HydrophobicContact CG-CD1 4.35Å; K552-L798 HydrophobicContact CG-CD2 4.38Å; K552-L798 HydrophobicContact CG-CG 4.36Å; S794-L798 WeakPolarHBondContact O-CG 3.29Å; S794-L798 PolarHBondContact O-N 3.41Å; L795-L798 PolarHBondContact O-N 2.98Å; L798-S800 PolarHBondContact O-N 2.88Å; L798-H801 WeakPolarHBondContact O-CB 3.34Å; L798-H801 PolarHBondContact O-N 2.85Å; L798-E802 WeakPolarHBondContact O-CG 3.43Å; L798-E802 PolarHBondContact O-N 3.15Å
799	K	96.6	Very high	94.3	Very high	131 Å²	131	57 Å²	57	57%	0.57	29%	0.285	S	S	*	.	H	α-helix	trans	-58.5	-33.4	173.8	-73.8	178.1	179.3	-176.7	0	112.9	L795 H801 E802 N803	L795-K799 WeakPolarHBondContact O-CG 3.42Å; L795-K799 PolarHBondContact O-N 3.34Å; K799-H801 VanDerWaalsContact C-N 3.34Å; K799-E802 PolarHBondContact O-N 2.92Å; K799-N803 WeakPolarHBondContact O-CB 3.48Å; K799-N803 PolarHBondContact O-N 2.87Å; K799-N803 PolarHBondContact O-ND2 2.85Å; K799-N803 PolarHBondContact O-OD1 3.37Å
800	S	96.1	Very high	94.4	Very high	5 Å²	5	56.3 Å²	56.3	4%	0.035	28%	0.283	C	S	.	.	H	α-helix	trans	-75	-22.9	178	-58.1	0	0	0	0	113.3	S796 I797 L798 N803 F805 M806	S796-S800 WeakPolarHBondContact O-CB 3.32Å; S796-S800 PolarHBondContact O-N 3.34Å; S796-S800 PolarHBondContact O-OG 2.95Å; I797-S800 WeakPolarHBondContact O-CB 3.43Å; I797-S800 PolarHBondContact O-N 3.04Å; I797-S800 VanDerWaalsContact O-N 3.11Å; L798-S800 PolarHBondContact O-N 2.88Å; S800-N803 VanDerWaalsContact CA-OD1 3.27Å; S800-N803 WeakPolarHBondContact CA-OD1 3.37Å; S800-N803 PolarHBondContact O-OD1 2.95Å; S800-F805 PolarHBondContact O-N 2.89Å; S800-M806 PolarHBondContact O-N 3.08Å
801	H	95.8	Very high	94.4	Very high	72 Å²	72	60 Å²	60	33%	0.333	30%	0.299	S	S	.	.	H	α-helix	trans	-76.7	-46.3	167.3	-82.8	-71.2	0	0	0	110.9	P553 F554 I797 L798 K799 N803 G804	P553-H801 PolarHBondContact O-NE2 3.34Å; F554-H801 PolarHBondContact O-CE1 2.91Å; F554-H801 PolarHBondContact O-NE2 3.37Å; I797-H801 PolarHBondContact O-CD2 3.36Å; I797-H801 PolarHBondContact O-N 3.41Å; L798-H801 WeakPolarHBondContact O-CB 3.34Å; L798-H801 PolarHBondContact O-N 2.85Å; K799-H801 VanDerWaalsContact C-N 3.34Å; H801-N803 VanDerWaalsContact C-N 3.34Å; H801-N803 PolarHBondContact O-N 3.4Å; H801-G804 PolarHBondContact O-N 2.88Å
802	E	95.8	Very high	94.3	Very high	162 Å²	162	58.3 Å²	58.3	76%	0.757	29%	0.294	S	S	*	.	H	α-helix	trans	-62.4	-37.8	-177.8	-71.8	171.4	-179.3	0	0	113.2	L798 K799 G804	L798-E802 WeakPolarHBondContact O-CG 3.43Å; L798-E802 PolarHBondContact O-N 3.15Å; K799-E802 PolarHBondContact O-N 2.92Å; E802-G804 VanDerWaalsContact C-N 3.32Å
803	N	95.3	Very high	94.1	Very high	95 Å²	95	55.9 Å²	55.9	51%	0.508	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	2.3	-179.1	71.7	5.5	0	0	0	114.3	K799 S800 H801 F805	K799-N803 WeakPolarHBondContact O-CB 3.48Å; K799-N803 PolarHBondContact O-N 2.87Å; K799-N803 PolarHBondContact O-ND2 2.85Å; K799-N803 PolarHBondContact O-OD1 3.37Å; S800-N803 VanDerWaalsContact CA-OD1 3.27Å; S800-N803 WeakPolarHBondContact CA-OD1 3.37Å; S800-N803 PolarHBondContact O-OD1 2.95Å; H801-N803 VanDerWaalsContact C-N 3.34Å; H801-N803 PolarHBondContact O-N 3.4Å; N803-F805 VanDerWaalsContact C-N 3.3Å; N803-F805 PolarHBondContact O-N 3.5Å; N803-F805 WeakPolarHBondContact OD1-CB 3.43Å; N803-F805 PolarHBondContact OD1-N 3.49Å
804	G	94.6	Very high	93.7	Very high	25 Å²	25	56 Å²	56	26%	0.258	28%	0.281	S	S	.	.	S	Bend	trans	79.8	-2.5	180	0	0	0	0	0	116	H801 E802 M806 E807 D808	H801-G804 PolarHBondContact O-N 2.88Å; E802-G804 VanDerWaalsContact C-N 3.32Å; G804-M806 PolarHBondContact O-N 3.48Å; G804-E807 WeakPolarHBondContact O-CB 3.47Å; G804-E807 PolarHBondContact O-N 3.27Å; G804-D808 PolarHBondContact O-N 3.49Å; G804-D808 VanDerWaalsContact O-N 3.09Å
805	F	95.4	Very high	92.9	Very high	42 Å²	42	62.5 Å²	62.5	18%	0.184	30%	0.303	C	S	.	.	H	α-helix	trans	-58.7	-35.2	-178.8	178	-104.1	0	0	0	113	L483 K486 S800 N803 E807 D808 L809	L483-F805 HydrophobicContact CD1-CE1 4.39Å; K486-F805 HydrophobicContact CB-CE1 3.87Å; K486-F805 HydrophobicContact CB-CZ 3.88Å; K486-F805 HydrophobicContact CD-CZ 4.43Å; K486-F805 HydrophobicContact CG-CD1 4.26Å; K486-F805 HydrophobicContact CG-CE1 3.76Å; K486-F805 HydrophobicContact CG-CZ 3.99Å; S800-F805 PolarHBondContact O-N 2.89Å; N803-F805 VanDerWaalsContact C-N 3.3Å; N803-F805 PolarHBondContact O-N 3.5Å; N803-F805 WeakPolarHBondContact OD1-CB 3.43Å; N803-F805 PolarHBondContact OD1-N 3.49Å; F805-E807 VanDerWaalsContact C-N 3.34Å; F805-D808 PolarHBondContact O-N 3.32Å; F805-L809 HydrophobicContact CD1-CD1 4.07Å; F805-L809 HydrophobicContact CD1-CG 4.46Å; F805-L809 HydrophobicContact CE1-CD1 3.44Å; F805-L809 VanDerWaalsContact CE1-CD1 3.44Å; F805-L809 HydrophobicContact CE1-CG 4.01Å; F805-L809 HydrophobicContact CE2-CG 4.41Å; F805-L809 HydrophobicContact CZ-CD1 3.78Å; F805-L809 HydrophobicContact CZ-CD2 4.13Å; F805-L809 HydrophobicContact CZ-CG 3.98Å; F805-L809 WeakPolarHBondContact O-CG 3.3Å; F805-L809 PolarHBondContact O-N 3.03Å; F805-L809 VanDerWaalsContact O-N 3.13Å
806	M	94.6	Very high	91.8	Very high	9 Å²	9	64.9 Å²	64.9	4%	0.044	31%	0.307	C	S	.	.	H	α-helix	trans	-67.3	-35.3	177.4	-159.9	64.6	62.4	0	0	112.6	F479 L483 F554 I797 S800 G804 D810	F479-M806 HydrophobicContact CE1-SD 4.01Å; F479-M806 HydrophobicContact CE2-SD 4.44Å; F479-M806 HydrophobicContact CZ-CG 4.45Å; F479-M806 HydrophobicContact CZ-SD 3.45Å; F479-M806 WeakPolarHBondContact CZ-SD 3.22Å; L483-M806 HydrophobicContact CD1-CE 3.96Å; L483-M806 HydrophobicContact CD2-CE 4.43Å; F554-M806 HydrophobicContact CB-CE 3.79Å; F554-M806 HydrophobicContact CB-SD 4.24Å; F554-M806 HydrophobicContact CD2-SD 4.4Å; F554-M806 WeakPolarHBondContact O-CG 3.46Å; I797-M806 HydrophobicContact CD1-CE 4.48Å; S800-M806 PolarHBondContact O-N 3.08Å; G804-M806 PolarHBondContact O-N 3.48Å; M806-D810 PolarHBondContact O-N 2.98Å
807	E	92.9	Very high	90.7	Very high	112 Å²	112	69 Å²	69	52%	0.523	33%	0.325	S	S	.	.	H	α-helix	trans	-69.6	-40.9	176.4	-174.3	65.6	-164.5	0	0	110.6	G804 F805 L809 D810 K811	G804-E807 WeakPolarHBondContact O-CB 3.47Å; G804-E807 PolarHBondContact O-N 3.27Å; F805-E807 VanDerWaalsContact C-N 3.34Å; E807-L809 VanDerWaalsContact C-N 3.33Å; E807-L809 PolarHBondContact O-N 3.23Å; E807-D810 PolarHBondContact O-N 3.11Å; E807-D810 VanDerWaalsContact O-N 3.16Å; E807-K811 WeakPolarHBondContact O-CB 3.29Å; E807-K811 PolarHBondContact O-N 3.45Å
808	D	92.6	Very high	89.7	Confident	98 Å²	98	78.1 Å²	78.1	52%	0.524	37%	0.368	S	S	.	.	H	α-helix	trans	-60.1	-43.2	175.9	-67	-25.8	0	0	0	111.6	G804 F805 T812	G804-D808 PolarHBondContact O-N 3.49Å; G804-D808 VanDerWaalsContact O-N 3.09Å; F805-D808 PolarHBondContact O-N 3.32Å; D808-T812 WeakPolarHBondContact O-CB 3.39Å; D808-T812 PolarHBondContact O-N 3.29Å; D808-T812 PolarHBondContact O-OG1 3.07Å
809	L	92.6	Very high	88.7	Confident	9 Å²	9	76.8 Å²	76.8	5%	0.047	36%	0.363	C	S	.	.	H	α-helix	trans	-64.2	-41.1	174.9	-71.9	-177.8	0	0	0	111.9	F479 D482 L483 F805 E807 T812 W813	F479-L809 HydrophobicContact CD2-CB 3.64Å; F479-L809 HydrophobicContact CE2-CB 3.41Å; F479-L809 VanDerWaalsContact CE2-CB 3.41Å; F479-L809 HydrophobicContact CE2-CD1 4.38Å; F479-L809 HydrophobicContact CZ-CB 4.14Å; F479-L809 HydrophobicContact CZ-CD1 4.41Å; D482-L809 HydrophobicContact CB-CD2 3.75Å; L483-L809 HydrophobicContact CB-CD1 4.4Å; F805-L809 HydrophobicContact CD1-CD1 4.07Å; F805-L809 HydrophobicContact CD1-CG 4.46Å; F805-L809 HydrophobicContact CE1-CD1 3.44Å; F805-L809 VanDerWaalsContact CE1-CD1 3.44Å; F805-L809 HydrophobicContact CE1-CG 4.01Å; F805-L809 HydrophobicContact CE2-CG 4.41Å; F805-L809 HydrophobicContact CZ-CD1 3.78Å; F805-L809 HydrophobicContact CZ-CD2 4.13Å; F805-L809 HydrophobicContact CZ-CG 3.98Å; F805-L809 WeakPolarHBondContact O-CG 3.3Å; F805-L809 PolarHBondContact O-N 3.03Å; F805-L809 VanDerWaalsContact O-N 3.13Å; E807-L809 VanDerWaalsContact C-N 3.33Å; E807-L809 PolarHBondContact O-N 3.23Å; L809-T812 PolarHBondContact O-N 3.41Å; L809-W813 WeakPolarHBondContact O-CB 3.5Å; L809-W813 PolarHBondContact O-N 2.69Å
810	D	91.1	Very high	87.3	Confident	6 Å²	6	77 Å²	77	3%	0.032	37%	0.371	C	S	.	.	H	α-helix	trans	-64.5	-43.3	179.3	-162.6	48.7	0	0	0	111.7	K555 M806 E807 T812 V814 R815	K555-D810 IonicContact NZ-OD1 2.72Å; K555-D810 PolarHBondContact NZ-OD1 3.05Å; K555-D810 IonicContact NZ-OD2 3.21Å; K555-D810 PolarHBondContact NZ-OD2 3.47Å; M806-D810 PolarHBondContact O-N 2.98Å; E807-D810 PolarHBondContact O-N 3.11Å; E807-D810 VanDerWaalsContact O-N 3.16Å; D810-T812 VanDerWaalsContact C-N 3.34Å; D810-T812 PolarHBondContact O-N 3.04Å; D810-V814 WeakPolarHBondContact O-CA 3.47Å; D810-V814 WeakPolarHBondContact O-CB 3.4Å; D810-V814 PolarHBondContact O-N 3.43Å; D810-V814 VanDerWaalsContact OD1-CB 3.3Å; D810-V814 WeakPolarHBondContact OD1-CB 3.21Å; D810-V814 VanDerWaalsContact OD1-CG2 3.28Å; D810-V814 WeakPolarHBondContact OD1-CG2 3.45Å; D810-R815 PolarHBondContact O-N 3.19Å
811	K	89.3	Confident	85.7	Confident	146 Å²	146	82.3 Å²	82.3	64%	0.635	41%	0.408	S	S	*	.	H	α-helix	trans	-64.1	-39.3	175.2	-172.4	177.2	-179.9	-179.5	0	112.2	E807 R815	E807-K811 WeakPolarHBondContact O-CB 3.29Å; E807-K811 PolarHBondContact O-N 3.45Å; K811-R815 CarbonylContact O-C 3.6Å
812	T	88.4	Confident	83.9	Confident	52 Å²	52	88.9 Å²	88.9	32%	0.319	43%	0.43	S	S	.	.	H	α-helix	trans	-71.4	-43.1	-178.1	-56.9	0	0	0	0	112.2	T446 D808 L809 D810	T446-T812 HydrophobicContact CG2-CG2 4.42Å; D808-T812 WeakPolarHBondContact O-CB 3.39Å; D808-T812 PolarHBondContact O-N 3.29Å; D808-T812 PolarHBondContact O-OG1 3.07Å; L809-T812 PolarHBondContact O-N 3.41Å; D810-T812 VanDerWaalsContact C-N 3.34Å; D810-T812 PolarHBondContact O-N 3.04Å
813	W	89.3	Confident	81.8	Confident	28 Å²	28	86.2 Å²	86.2	11%	0.106	43%	0.429	C	S	.	.	H	α-helix	trans	-104.7	-33.7	-169.6	-67.7	103.7	0	0	0	114.6	Y431 V452 Y477 F479 D482 F759 L809	Y431-W813 HydrophobicContact CD2-CE3 4.48Å; Y431-W813 HydrophobicContact CD2-CZ3 4.09Å; Y431-W813 AromaticContact CE2-CE3 3.9Å; Y431-W813 HydrophobicContact CE2-CE3 3.9Å; Y431-W813 AromaticContact CE2-CZ3 3.87Å; Y431-W813 HydrophobicContact CE2-CZ3 3.87Å; V452-W813 HydrophobicContact CG1-CH2 3.81Å; V452-W813 HydrophobicContact CG1-CZ2 4.31Å; Y477-W813 AromaticContact CD2-CH2 3.79Å; Y477-W813 HydrophobicContact CD2-CH2 3.79Å; Y477-W813 HydrophobicContact CD2-CZ3 4.05Å; Y477-W813 HydrophobicContact CE2-CH2 4.38Å; Y477-W813 HydrophobicContact CE2-CZ3 4.29Å; F479-W813 HydrophobicContact CB-CB 4.16Å; F479-W813 HydrophobicContact CB-CG 4.08Å; F479-W813 HydrophobicContact CD2-CB 4.32Å; D482-W813 PolarHBondContact OD2-NE1 2.85Å; F759-W813 WeakPolarHBondContact CD2-O 3.46Å; F759-W813 WeakPolarHBondContact CE2-O 3.45Å; L809-W813 WeakPolarHBondContact O-CB 3.5Å; L809-W813 PolarHBondContact O-N 2.69Å
814	V	86.1	Confident	79.9	Confident	4 Å²	4	86.5 Å²	86.5	2%	0.024	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-47.7	-170.4	-174.5	0	0	0	0	111.6	P428 F759 D810 Y816	P428-V814 HydrophobicContact CG-CG2 4.02Å; F759-V814 HydrophobicContact CB-CG1 4.37Å; D810-V814 WeakPolarHBondContact O-CA 3.47Å; D810-V814 WeakPolarHBondContact O-CB 3.4Å; D810-V814 PolarHBondContact O-N 3.43Å; D810-V814 VanDerWaalsContact OD1-CB 3.3Å; D810-V814 WeakPolarHBondContact OD1-CB 3.21Å; D810-V814 VanDerWaalsContact OD1-CG2 3.28Å; D810-V814 WeakPolarHBondContact OD1-CG2 3.45Å; V814-Y816 PolarHBondContact O-N 3.48Å
815	R	79.6	Confident	78.1	Confident	149 Å²	149	88.5 Å²	88.5	56%	0.562	45%	0.445	S	S	*	.	S	Bend	trans	-99.9	47.8	178.5	-65.5	-175.5	-177.2	153.8	1	112.2	D810 K811	D810-R815 PolarHBondContact O-N 3.19Å; K811-R815 CarbonylContact O-C 3.6Å
816	Y	71.9	Confident	76.2	Confident	134 Å²	134	91.6 Å²	91.6	53%	0.525	47%	0.469	S	S	.	.	S	Bend	trans	-72.3	-33.1	-177	173.1	-97.4	0	0	0	112.8	V447 V814	V447-Y816 HydrophobicContact CB-CE2 4.19Å; V447-Y816 HydrophobicContact CG2-CE2 3.49Å; V447-Y816 VanDerWaalsContact CG2-CE2 3.49Å; V447-Y816 WeakPolarHBondContact CG2-OH 3.34Å; V814-Y816 PolarHBondContact O-N 3.48Å
817	Q	74.4	Confident	74.3	Confident	99 Å²	99	94 Å²	94	46%	0.463	49%	0.49	S	S	.	.			trans	-134.3	131.4	-174.6	-165	148.7	-6	0	0	110.3	S762	S762-Q817 VanDerWaalsContact CB-O 3.26Å; S762-Q817 WeakPolarHBondContact CB-O 3.25Å
818	E	74.8	Confident	72.6	Confident	192 Å²	192	93.3 Å²	93.3	90%	0.897	49%	0.494	S	S	*	.			trans	-102.3	117.4	176	-111.9	168.2	175.1	0	0	109.1
819	C	76.6	Confident	71.1	Confident	42 Å²	42	91.6 Å²	91.6	28%	0.284	48%	0.484	S	S	.	.			trans	-74.5	126.1	169	-65	0	0	0	0	108.6	A761 S762 C765 S821	A761-C819 PolarHBondContact O-SG 2.91Å; A761-C819 VanDerWaalsContact O-SG 3.37Å; S762-C819 PolarHBondContact O-SG 2.8Å; C765-C819 WeakPolarHBondContact CA-SG 3.48Å; C765-C819 HydrophobicContact CB-CB 3.97Å; C765-C819 WeakPolarHBondContact CB-SG 3.48Å; C765-C819 WeakPolarHBondContact SG-CB 3.11Å; C765-C819 CovalentContact SG-SG 2.03Å; C765-C819 PolarHBondContact SG-SG 3.49Å; C819-S821 PolarHBondContact O-N 2.96Å
820	D	66.6	Low	69.9	Low	136 Å²	136	94 Å²	94	73%	0.727	50%	0.5	S	S	*	.			trans	-59.6	106.8	178.3	-122.5	-1.9	0	0	0	109.8	R822	D820-R822 PolarHBondContact O-N 3Å
821	S	62.7	Low	68.8	Low	116 Å²	116	101.1 Å²	101.1	81%	0.811	53%	0.531	S	S	*	.			trans	-80.2	44.6	177.9	58.4	0	0	0	0	110.6	C819 S823	C819-S821 PolarHBondContact O-N 2.96Å; S821-S823 VanDerWaalsContact C-N 3.3Å; S821-S823 PolarHBondContact O-N 3.29Å
822	R	57.7	Low	67.9	Low	210 Å²	210	101.1 Å²	101.1	79%	0.792	53%	0.533	S	S	*	.			trans	-59.1	102.5	168.8	-83.2	-174.3	177.7	-175.2	-0.6	107	D820 N824	D820-R822 PolarHBondContact O-N 3Å; R822-N824 PolarHBondContact O-N 3.42Å; R822-N824 VanDerWaalsContact O-N 3.15Å
823	S	51.7	Low	67.1	Low	106 Å²	106	99.2 Å²	99.2	74%	0.741	52%	0.52	S	S	*	.			trans	-43.1	123.8	174.8	60.1	0	0	0	0	106.7	S821 A825	S821-S823 VanDerWaalsContact C-N 3.3Å; S821-S823 PolarHBondContact O-N 3.29Å; S823-A825 VanDerWaalsContact C-N 3.32Å; S823-A825 PolarHBondContact O-N 3.11Å
824	N	55.7	Low	66.5	Low	101 Å²	101	102.1 Å²	102.1	54%	0.54	54%	0.536	S	S	.	.			trans	-43.4	102	177.7	-64.8	-14	0	0	0	108	R822	R822-N824 PolarHBondContact O-N 3.42Å; R822-N824 VanDerWaalsContact O-N 3.15Å
825	A	56.3	Low	66.2	Low	67 Å²	67	103 Å²	103	55%	0.554	54%	0.544	S	S	*	.			trans	-55.3	139	167.5	0	0	0	0	0	105.2	S823 A827	S823-A825 VanDerWaalsContact C-N 3.32Å; S823-A825 PolarHBondContact O-N 3.11Å; A825-A827 PolarHBondContact O-N 3.04Å
826	P	54.5	Low	66.3	Low	107 Å²	107	96.7 Å²	96.7	70%	0.695	53%	0.526	S	S	*	.	S	Bend	trans	-47.5	132.8	174.4	21.4	-32	0	0	0	107.2	T828	P826-T828 VanDerWaalsContact C-N 3.32Å; P826-T828 PolarHBondContact O-N 3.46Å
827	A	54.8	Low	67	Low	59 Å²	59	93.2 Å²	93.2	49%	0.488	52%	0.518	S	S	.	.			trans	-44.7	98.3	-168.8	0	0	0	0	0	109.6	A825 L829	A825-A827 PolarHBondContact O-N 3.04Å; A827-L829 PolarHBondContact O-N 3.4Å
828	T	57.4	Low	67.6	Low	99 Å²	99	94.1 Å²	94.1	61%	0.607	52%	0.521	S	S	*	.			trans	-67.8	127.5	-179	50.9	0	0	0	0	104.9	P826 T830	P826-T828 VanDerWaalsContact C-N 3.32Å; P826-T828 PolarHBondContact O-N 3.46Å; T828-T830 WeakPolarHBondContact O-CG2 3.35Å; T828-T830 PolarHBondContact O-N 3.3Å
829	L	62.6	Low	68.1	Low	61 Å²	61	91.8 Å²	91.8	32%	0.319	51%	0.511	S	S	.	.			trans	-51.2	106.6	175.6	-77.5	167	0	0	0	108.4	L676 A827 N833 M834	L676-L829 HydrophobicContact CD1-CD1 4Å; L676-L829 HydrophobicContact CD1-CG 4.45Å; L676-L829 HydrophobicContact CD2-CD1 4.34Å; L676-L829 HydrophobicContact CD2-CD2 4.14Å; L676-L829 HydrophobicContact CD2-CG 4.03Å; A827-L829 PolarHBondContact O-N 3.4Å; L829-N833 HydrophobicContact CD2-CB 3.91Å; L829-M834 HydrophobicContact CB-CE 4.02Å; L829-M834 HydrophobicContact CD1-CE 3.68Å; L829-M834 HydrophobicContact CG-CE 4.43Å
830	T	66.3	Low	68.7	Low	60 Å²	60	95.2 Å²	95.2	37%	0.368	53%	0.527	S	S	.	.			trans	-77	164.5	-179.4	59.3	0	0	0	0	108.9	T828 E832 N833 M834	T828-T830 WeakPolarHBondContact O-CG2 3.35Å; T828-T830 PolarHBondContact O-N 3.3Å; T830-E832 PolarHBondContact O-N 2.76Å; T830-N833 PolarHBondContact O-N 3.15Å; T830-N833 VanDerWaalsContact OG1-CG 3.28Å; T830-N833 PolarHBondContact OG1-OD1 3.4Å; T830-N833 VanDerWaalsContact OG1-OD1 3.09Å; T830-M834 PolarHBondContact O-N 3.19Å
831	F	68	Low	69.8	Low	156 Å²	156	92.7 Å²	92.7	68%	0.684	52%	0.516	S	S	*	.	H	α-helix	trans	-53.3	-34.7	172.6	178.8	-98.5	0	0	0	112	N833 M834 A835 F838	F831-N833 VanDerWaalsContact C-N 3.33Å; F831-N833 PolarHBondContact O-N 2.92Å; F831-M834 PolarHBondContact O-N 3.28Å; F831-A835 PolarHBondContact O-N 2.88Å; F831-A835 VanDerWaalsContact O-N 3.07Å; F831-F838 HydrophobicContact CD2-CE2 4.3Å; F831-F838 HydrophobicContact CE2-CD2 4.15Å; F831-F838 AromaticContact CE2-CE2 3.92Å; F831-F838 HydrophobicContact CE2-CE2 3.92Å
832	E	69.9	Low	71.2	Confident	146 Å²	146	89.5 Å²	89.5	68%	0.682	50%	0.496	S	S	*	.	H	α-helix	trans	-63.1	-37.3	177.3	-63.1	-177	166.9	0	0	112.3	T830 M834 A835	T830-E832 PolarHBondContact O-N 2.76Å; E832-M834 VanDerWaalsContact C-N 3.34Å; E832-M834 PolarHBondContact O-N 3.39Å; E832-A835 WeakPolarHBondContact O-CB 3.46Å; E832-A835 PolarHBondContact O-N 3.35Å
833	N	71.5	Confident	72.9	Confident	11 Å²	11	81.4 Å²	81.4	6%	0.059	48%	0.479	C	S	.	.	H	α-helix	trans	-72.9	-29.2	-177.5	-59.3	-2.6	0	0	0	112.5	S570 L829 T830 F831	S570-N833 VanDerWaalsContact CB-CG 3.41Å; S570-N833 VanDerWaalsContact CB-ND2 3.34Å; S570-N833 WeakPolarHBondContact CB-ND2 3.4Å; S570-N833 WeakPolarHBondContact CB-OD1 3.26Å; S570-N833 PolarHBondContact OG-ND2 3.08Å; S570-N833 PolarHBondContact OG-OD1 3.39Å; L829-N833 HydrophobicContact CD2-CB 3.91Å; T830-N833 PolarHBondContact O-N 3.15Å; T830-N833 VanDerWaalsContact OG1-CG 3.28Å; T830-N833 PolarHBondContact OG1-OD1 3.4Å; T830-N833 VanDerWaalsContact OG1-OD1 3.09Å; F831-N833 VanDerWaalsContact C-N 3.33Å; F831-N833 PolarHBondContact O-N 2.92Å
834	M	76.7	Confident	74.9	Confident	89 Å²	89	78.5 Å²	78.5	44%	0.438	47%	0.465	S	S	.	.	H	α-helix	trans	-93.1	-1.9	175.5	-67	-168.5	174.2	0	0	113	L829 T830 F831 E832 G836 V837 F838	L829-M834 HydrophobicContact CB-CE 4.02Å; L829-M834 HydrophobicContact CD1-CE 3.68Å; L829-M834 HydrophobicContact CG-CE 4.43Å; T830-M834 PolarHBondContact O-N 3.19Å; F831-M834 PolarHBondContact O-N 3.28Å; E832-M834 VanDerWaalsContact C-N 3.34Å; E832-M834 PolarHBondContact O-N 3.39Å; M834-G836 PolarHBondContact O-N 3.37Å; M834-G836 VanDerWaalsContact O-N 3.17Å; M834-V837 WeakPolarHBondContact O-CB 3.44Å; M834-V837 PolarHBondContact O-N 2.87Å; M834-F838 HydrophobicContact CB-CE2 4.37Å; M834-F838 WeakPolarHBondContact O-CD2 3.44Å
835	A	80.4	Confident	76.7	Confident	23 Å²	23	78.7 Å²	78.7	19%	0.19	47%	0.465	C	S	.	.	H	α-helix	trans	-57.4	-34.2	-177	0	0	0	0	0	112.7	L572 F831 E832 V837 F838 M839	L572-A835 HydrophobicContact CD2-CB 4.1Å; F831-A835 PolarHBondContact O-N 2.88Å; F831-A835 VanDerWaalsContact O-N 3.07Å; E832-A835 WeakPolarHBondContact O-CB 3.46Å; E832-A835 PolarHBondContact O-N 3.35Å; A835-V837 VanDerWaalsContact C-N 3.26Å; A835-V837 PolarHBondContact O-N 3.29Å; A835-F838 PolarHBondContact O-N 2.95Å; A835-M839 WeakPolarHBondContact O-CG 3.35Å; A835-M839 PolarHBondContact O-N 2.88Å
836	G	82.8	Confident	78.5	Confident	17 Å²	17	80.3 Å²	80.3	18%	0.175	47%	0.468	C	S	.	.	H	α-helix	trans	-57.4	-35.8	175.6	0	0	0	0	0	113.8	M834 L840	M834-G836 PolarHBondContact O-N 3.37Å; M834-G836 VanDerWaalsContact O-N 3.17Å; G836-L840 PolarHBondContact O-N 3.42Å; G836-L840 VanDerWaalsContact O-N 3.11Å
837	V	85.9	Confident	80.3	Confident	60 Å²	60	77.5 Å²	77.5	36%	0.364	45%	0.454	S	S	.	.	H	α-helix	trans	-68.7	-44.8	177.8	-177.7	0	0	0	0	110.8	F575 M834 A835 M839 L840 V841	F575-V837 HydrophobicContact CB-CG2 3.86Å; F575-V837 HydrophobicContact CD1-CG2 3.99Å; F575-V837 HydrophobicContact CD2-CG2 3.86Å; F575-V837 HydrophobicContact CE2-CG2 4.39Å; F575-V837 HydrophobicContact CG-CG2 3.62Å; M834-V837 WeakPolarHBondContact O-CB 3.44Å; M834-V837 PolarHBondContact O-N 2.87Å; A835-V837 VanDerWaalsContact C-N 3.26Å; A835-V837 PolarHBondContact O-N 3.29Å; V837-M839 VanDerWaalsContact C-N 3.34Å; V837-M839 PolarHBondContact O-N 3.5Å; V837-L840 WeakPolarHBondContact O-CB 3.33Å; V837-L840 PolarHBondContact O-N 3.43Å; V837-V841 WeakPolarHBondContact O-CG2 3.44Å; V837-V841 PolarHBondContact O-N 3.04Å; V837-V841 VanDerWaalsContact O-N 3.07Å
838	F	86.1	Confident	82.1	Confident	119 Å²	119	76.4 Å²	76.4	52%	0.522	45%	0.448	S	S	.	.	H	α-helix	trans	-65.4	-37.8	177.9	-67.4	-68.1	0	0	0	112.4	F831 M834 A835 L840 V841 A842	F831-F838 HydrophobicContact CD2-CE2 4.3Å; F831-F838 HydrophobicContact CE2-CD2 4.15Å; F831-F838 AromaticContact CE2-CE2 3.92Å; F831-F838 HydrophobicContact CE2-CE2 3.92Å; M834-F838 HydrophobicContact CB-CE2 4.37Å; M834-F838 WeakPolarHBondContact O-CD2 3.44Å; A835-F838 PolarHBondContact O-N 2.95Å; F838-L840 VanDerWaalsContact C-N 3.32Å; F838-L840 PolarHBondContact O-N 3.44Å; F838-V841 PolarHBondContact O-N 3.26Å; F838-A842 WeakPolarHBondContact O-CB 3.37Å; F838-A842 PolarHBondContact O-N 2.98Å
839	M	86.6	Confident	83.8	Confident	142 Å²	142	76.2 Å²	76.2	70%	0.7	44%	0.443	S	S	*	.	H	α-helix	trans	-62.7	-38.4	174.2	-72.1	-66.5	-72.8	0	0	111.9	A835 V837 A842 G843	A835-M839 WeakPolarHBondContact O-CG 3.35Å; A835-M839 PolarHBondContact O-N 2.88Å; V837-M839 VanDerWaalsContact C-N 3.34Å; V837-M839 PolarHBondContact O-N 3.5Å; M839-A842 PolarHBondContact O-N 3.48Å; M839-G843 PolarHBondContact O-N 3.15Å
840	L	88.1	Confident	85.2	Confident	115 Å²	115	80 Å²	80	60%	0.602	46%	0.456	S	S	*	.	H	α-helix	trans	-64.5	-44.9	175	-168.5	159.5	0	0	0	111.2	F575 G836 V837 F838 A842 G843 G844	F575-L840 HydrophobicContact CZ-CD1 4.47Å; G836-L840 PolarHBondContact O-N 3.42Å; G836-L840 VanDerWaalsContact O-N 3.11Å; V837-L840 WeakPolarHBondContact O-CB 3.33Å; V837-L840 PolarHBondContact O-N 3.43Å; F838-L840 VanDerWaalsContact C-N 3.32Å; F838-L840 PolarHBondContact O-N 3.44Å; L840-A842 PolarHBondContact O-N 2.98Å; L840-G843 PolarHBondContact O-N 3.49Å; L840-G844 PolarHBondContact O-N 3.26Å
841	V	90.8	Very high	86.5	Confident	82 Å²	82	82.2 Å²	82.2	50%	0.497	47%	0.466	S	S	.	.	H	α-helix	trans	-60.8	-44.8	175.9	174.9	0	0	0	0	111	V837 F838 G843 G844 I845	V837-V841 WeakPolarHBondContact O-CG2 3.44Å; V837-V841 PolarHBondContact O-N 3.04Å; V837-V841 VanDerWaalsContact O-N 3.07Å; F838-V841 PolarHBondContact O-N 3.26Å; V841-G843 VanDerWaalsContact C-N 3.34Å; V841-G843 PolarHBondContact O-N 2.98Å; V841-G844 WeakPolarHBondContact O-CA 3.29Å; V841-G844 PolarHBondContact O-N 3.02Å; V841-G844 VanDerWaalsContact O-N 3.1Å; V841-I845 HydrophobicContact CG1-CD1 4.26Å; V841-I845 WeakPolarHBondContact O-CG1 3.34Å; V841-I845 PolarHBondContact O-N 2.86Å
842	A	90.9	Very high	87.6	Confident	49 Å²	49	78.6 Å²	78.6	41%	0.405	45%	0.453	S	S	.	.	H	α-helix	trans	-59.4	-44.7	175.9	0	0	0	0	0	111.8	F838 M839 L840 G844 I845 V846	F838-A842 WeakPolarHBondContact O-CB 3.37Å; F838-A842 PolarHBondContact O-N 2.98Å; M839-A842 PolarHBondContact O-N 3.48Å; L840-A842 PolarHBondContact O-N 2.98Å; A842-G844 VanDerWaalsContact C-N 3.31Å; A842-G844 PolarHBondContact O-N 3.42Å; A842-I845 PolarHBondContact O-N 3.25Å; A842-V846 WeakPolarHBondContact O-CG2 3.48Å; A842-V846 PolarHBondContact O-N 2.98Å; A842-V846 VanDerWaalsContact O-N 3.1Å
843	G	93.6	Very high	88.6	Confident	41 Å²	41	78.3 Å²	78.3	42%	0.423	45%	0.449	S	S	.	.	H	α-helix	trans	-59.2	-40	172.5	0	0	0	0	0	113	M839 L840 V841 V846 A847	M839-G843 PolarHBondContact O-N 3.15Å; L840-G843 PolarHBondContact O-N 3.49Å; V841-G843 VanDerWaalsContact C-N 3.34Å; V841-G843 PolarHBondContact O-N 2.98Å; G843-V846 PolarHBondContact O-N 3.03Å; G843-A847 WeakPolarHBondContact O-CB 3.47Å; G843-A847 PolarHBondContact O-N 3.17Å
844	G	93.3	Very high	89.5	Confident	44 Å²	44	81.5 Å²	81.5	45%	0.454	47%	0.466	S	S	.	.	H	α-helix	trans	-62.4	-40	175.1	0	0	0	0	0	113.4	L840 V841 A842 A847 G848	L840-G844 PolarHBondContact O-N 3.26Å; V841-G844 WeakPolarHBondContact O-CA 3.29Å; V841-G844 PolarHBondContact O-N 3.02Å; V841-G844 VanDerWaalsContact O-N 3.1Å; A842-G844 VanDerWaalsContact C-N 3.31Å; A842-G844 PolarHBondContact O-N 3.42Å; G844-A847 PolarHBondContact O-N 3.38Å; G844-G848 PolarHBondContact O-N 2.94Å
845	I	94.1	Very high	90.1	Very high	105 Å²	105	82.8 Å²	82.8	54%	0.538	47%	0.471	S	S	.	.	H	α-helix	trans	-64.7	-45.2	175.2	-64.8	166.2	0	0	0	110.4	V841 A842 A847 G848 I849	V841-I845 HydrophobicContact CG1-CD1 4.26Å; V841-I845 WeakPolarHBondContact O-CG1 3.34Å; V841-I845 PolarHBondContact O-N 2.86Å; A842-I845 PolarHBondContact O-N 3.25Å; I845-A847 VanDerWaalsContact C-N 3.35Å; I845-A847 PolarHBondContact O-N 2.9Å; I845-G848 PolarHBondContact O-N 2.83Å; I845-G848 VanDerWaalsContact O-N 3.15Å; I845-I849 HydrophobicContact CG2-CD1 4.26Å; I845-I849 WeakPolarHBondContact O-CG1 3.5Å; I845-I849 PolarHBondContact O-N 2.71Å
846	V	93.6	Very high	90.6	Very high	101 Å²	101	86.3 Å²	86.3	61%	0.612	49%	0.485	S	S	*	.	H	α-helix	trans	-61.1	-44.2	177	174.3	0	0	0	0	111	A842 G843 G848 I849 F850	A842-V846 WeakPolarHBondContact O-CG2 3.48Å; A842-V846 PolarHBondContact O-N 2.98Å; A842-V846 VanDerWaalsContact O-N 3.1Å; G843-V846 PolarHBondContact O-N 3.03Å; V846-G848 VanDerWaalsContact C-N 3.32Å; V846-G848 PolarHBondContact O-N 3.42Å; V846-I849 PolarHBondContact O-N 3.25Å; V846-F850 PolarHBondContact O-N 3.46Å; V846-F850 VanDerWaalsContact O-N 3.08Å
847	A	92.6	Very high	90.7	Very high	49 Å²	49	88.3 Å²	88.3	41%	0.405	50%	0.5	S	S	.	.	H	α-helix	trans	-62.9	-38.5	174.4	0	0	0	0	0	112	G843 G844 I845 F850 L851	G843-A847 WeakPolarHBondContact O-CB 3.47Å; G843-A847 PolarHBondContact O-N 3.17Å; G844-A847 PolarHBondContact O-N 3.38Å; I845-A847 VanDerWaalsContact C-N 3.35Å; I845-A847 PolarHBondContact O-N 2.9Å; A847-F850 WeakPolarHBondContact O-CB 3.45Å; A847-F850 PolarHBondContact O-N 3.01Å; A847-L851 WeakPolarHBondContact O-CB 3.29Å; A847-L851 WeakPolarHBondContact O-CG 3.35Å; A847-L851 PolarHBondContact O-N 3.02Å
848	G	93.1	Very high	90.9	Very high	36 Å²	36	92.8 Å²	92.8	37%	0.371	51%	0.512	S	S	.	.	H	α-helix	trans	-61.4	-43.7	174.5	0	0	0	0	0	112.8	G844 I845 V846 F850 L851 I852	G844-G848 PolarHBondContact O-N 2.94Å; I845-G848 PolarHBondContact O-N 2.83Å; I845-G848 VanDerWaalsContact O-N 3.15Å; V846-G848 VanDerWaalsContact C-N 3.32Å; V846-G848 PolarHBondContact O-N 3.42Å; G848-F850 VanDerWaalsContact C-N 3.27Å; G848-F850 PolarHBondContact O-N 3.18Å; G848-L851 PolarHBondContact O-N 3.04Å; G848-I852 PolarHBondContact O-N 3.02Å
849	I	92.9	Very high	90.9	Very high	95 Å²	95	93.1 Å²	93.1	49%	0.487	51%	0.513	S	S	.	.	H	α-helix	trans	-59.5	-40.7	173.3	-65.7	166.4	0	0	0	110.3	I845 V846 I852 F853	I845-I849 HydrophobicContact CG2-CD1 4.26Å; I845-I849 WeakPolarHBondContact O-CG1 3.5Å; I845-I849 PolarHBondContact O-N 2.71Å; V846-I849 PolarHBondContact O-N 3.25Å; I849-I852 WeakPolarHBondContact O-CG2 3.45Å; I849-F853 HydrophobicContact CG2-CD2 4.27Å; I849-F853 HydrophobicContact CG2-CE2 3.94Å; I849-F853 WeakPolarHBondContact O-CD2 3.47Å; I849-F853 PolarHBondContact O-N 2.98Å
850	F	92.1	Very high	90.8	Very high	139 Å²	139	95.7 Å²	95.7	61%	0.61	52%	0.515	S	S	*	.	H	α-helix	trans	-67.9	-42.1	176.4	-172.4	-110	0	0	0	112.6	V846 A847 G848 I852 F853 I854	V846-F850 PolarHBondContact O-N 3.46Å; V846-F850 VanDerWaalsContact O-N 3.08Å; A847-F850 WeakPolarHBondContact O-CB 3.45Å; A847-F850 PolarHBondContact O-N 3.01Å; G848-F850 VanDerWaalsContact C-N 3.27Å; G848-F850 PolarHBondContact O-N 3.18Å; F850-I852 PolarHBondContact O-N 2.93Å; F850-F853 PolarHBondContact O-N 2.91Å; F850-I854 HydrophobicContact CD1-CD1 3.62Å; F850-I854 HydrophobicContact CE1-CD1 3.33Å; F850-I854 HydrophobicContact CE1-CG1 4.3Å; F850-I854 HydrophobicContact CG-CD1 4.48Å; F850-I854 HydrophobicContact CZ-CD1 3.97Å; F850-I854 PolarHBondContact O-N 2.97Å; F850-I854 VanDerWaalsContact O-N 3.13Å
851	L	92.5	Very high	90.4	Very high	108 Å²	108	96.1 Å²	96.1	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-65.1	-37.7	178.9	-75.8	172.8	0	0	0	112.7	A847 G848 F853 I854 E855	A847-L851 WeakPolarHBondContact O-CB 3.29Å; A847-L851 WeakPolarHBondContact O-CG 3.35Å; A847-L851 PolarHBondContact O-N 3.02Å; G848-L851 PolarHBondContact O-N 3.04Å; L851-F853 VanDerWaalsContact C-N 3.32Å; L851-F853 PolarHBondContact O-N 3.27Å; L851-I854 HydrophobicContact CD2-CD1 4.45Å; L851-I854 CarbonylContact O-C 3.58Å; L851-I854 WeakPolarHBondContact O-CB 3.46Å; L851-I854 PolarHBondContact O-N 3.47Å; L851-I854 VanDerWaalsContact O-N 3.17Å; L851-E855 WeakPolarHBondContact O-CB 3.3Å; L851-E855 PolarHBondContact O-N 3.44Å
852	I	92.3	Very high	89.9	Confident	79 Å²	79	96.8 Å²	96.8	41%	0.405	51%	0.51	S	S	.	.	H	α-helix	trans	-65.2	-36.4	176.4	-173.8	62	0	0	0	111.6	G848 I849 F850 I854 E855 I856	G848-I852 PolarHBondContact O-N 3.02Å; I849-I852 WeakPolarHBondContact O-CG2 3.45Å; F850-I852 PolarHBondContact O-N 2.93Å; I852-I854 VanDerWaalsContact C-N 3.35Å; I852-E855 PolarHBondContact O-N 3.41Å; I852-I856 HydrophobicContact CD1-CD1 4.29Å; I852-I856 HydrophobicContact CD1-CG1 4.3Å; I852-I856 HydrophobicContact CG1-CD1 3.93Å; I852-I856 HydrophobicContact CG1-CG1 4.4Å; I852-I856 WeakPolarHBondContact O-CB 3.39Å; I852-I856 WeakPolarHBondContact O-CD1 3.5Å; I852-I856 WeakPolarHBondContact O-CG1 3.32Å; I852-I856 PolarHBondContact O-N 3.43Å
853	F	90.5	Very high	89.2	Confident	140 Å²	140	97 Å²	97	61%	0.614	50%	0.504	S	S	*	.	H	α-helix	trans	-62.6	-43	172.1	-80.7	-66.6	0	0	0	111.7	I849 F850 L851 A857	I849-F853 HydrophobicContact CG2-CD2 4.27Å; I849-F853 HydrophobicContact CG2-CE2 3.94Å; I849-F853 WeakPolarHBondContact O-CD2 3.47Å; I849-F853 PolarHBondContact O-N 2.98Å; F850-F853 PolarHBondContact O-N 2.91Å; L851-F853 VanDerWaalsContact C-N 3.32Å; L851-F853 PolarHBondContact O-N 3.27Å; F853-A857 WeakPolarHBondContact O-CB 3.36Å; F853-A857 PolarHBondContact O-N 3.07Å
854	I	89.6	Confident	88.3	Confident	79 Å²	79	97.3 Å²	97.3	41%	0.405	50%	0.502	S	S	.	.	H	α-helix	trans	-62.5	-44.7	175.4	-67.6	169.3	0	0	0	110.9	F850 L851 I852 A857 Y858	F850-I854 HydrophobicContact CD1-CD1 3.62Å; F850-I854 HydrophobicContact CE1-CD1 3.33Å; F850-I854 HydrophobicContact CE1-CG1 4.3Å; F850-I854 HydrophobicContact CG-CD1 4.48Å; F850-I854 HydrophobicContact CZ-CD1 3.97Å; F850-I854 PolarHBondContact O-N 2.97Å; F850-I854 VanDerWaalsContact O-N 3.13Å; L851-I854 HydrophobicContact CD2-CD1 4.45Å; L851-I854 CarbonylContact O-C 3.58Å; L851-I854 WeakPolarHBondContact O-CB 3.46Å; L851-I854 PolarHBondContact O-N 3.47Å; L851-I854 VanDerWaalsContact O-N 3.17Å; I852-I854 VanDerWaalsContact C-N 3.35Å; I854-A857 PolarHBondContact O-N 3.49Å; I854-Y858 VanDerWaalsContact O-CB 3.27Å; I854-Y858 WeakPolarHBondContact O-CB 3.43Å; I854-Y858 PolarHBondContact O-N 3.4Å
855	E	90.3	Very high	87.4	Confident	116 Å²	116	103.5 Å²	103.5	54%	0.542	51%	0.512	S	S	.	.	H	α-helix	trans	-64.1	-44.1	-179.1	-169	-173.4	166.7	0	0	111.3	L851 I852 A857 Y858 K859	L851-E855 WeakPolarHBondContact O-CB 3.3Å; L851-E855 PolarHBondContact O-N 3.44Å; I852-E855 PolarHBondContact O-N 3.41Å; E855-A857 VanDerWaalsContact C-N 3.33Å; E855-A857 PolarHBondContact O-N 3.22Å; E855-Y858 PolarHBondContact O-N 3.43Å; E855-K859 WeakPolarHBondContact O-CB 3.28Å; E855-K859 PolarHBondContact O-N 3.17Å
856	I	89.9	Confident	86.4	Confident	97 Å²	97	104.6 Å²	104.6	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-60.6	-45	175	-68.3	166.4	0	0	0	110.2	I852 R860	I852-I856 HydrophobicContact CD1-CD1 4.29Å; I852-I856 HydrophobicContact CD1-CG1 4.3Å; I852-I856 HydrophobicContact CG1-CD1 3.93Å; I852-I856 HydrophobicContact CG1-CG1 4.4Å; I852-I856 WeakPolarHBondContact O-CB 3.39Å; I852-I856 WeakPolarHBondContact O-CD1 3.5Å; I852-I856 WeakPolarHBondContact O-CG1 3.32Å; I852-I856 PolarHBondContact O-N 3.43Å; I856-R860 WeakPolarHBondContact O-CB 3.37Å; I856-R860 PolarHBondContact O-N 2.97Å
857	A	86.9	Confident	85.3	Confident	59 Å²	59	106.5 Å²	106.5	49%	0.488	51%	0.51	S	S	.	.	H	α-helix	trans	-64	-45	177.5	0	0	0	0	0	112	F853 I854 E855 R860 H861	F853-A857 WeakPolarHBondContact O-CB 3.36Å; F853-A857 PolarHBondContact O-N 3.07Å; I854-A857 PolarHBondContact O-N 3.49Å; E855-A857 VanDerWaalsContact C-N 3.33Å; E855-A857 PolarHBondContact O-N 3.22Å; A857-R860 PolarHBondContact O-N 3.27Å; A857-H861 VanDerWaalsContact O-CB 3.32Å; A857-H861 WeakPolarHBondContact O-CB 3.13Å; A857-H861 PolarHBondContact O-N 3.45Å
858	Y	88.3	Confident	84.3	Confident	153 Å²	153	110.7 Å²	110.7	60%	0.6	52%	0.521	S	S	*	.	H	α-helix	trans	-64.1	-47.1	178.9	-179.9	-97.2	0	0	0	111.7	I854 E855 H861 K862	I854-Y858 VanDerWaalsContact O-CB 3.27Å; I854-Y858 WeakPolarHBondContact O-CB 3.43Å; I854-Y858 PolarHBondContact O-N 3.4Å; E855-Y858 PolarHBondContact O-N 3.43Å; Y858-H861 PolarHBondContact O-N 2.85Å; Y858-K862 HydrophobicContact CE1-CD 4.22Å; Y858-K862 WeakPolarHBondContact O-CB 3.38Å; Y858-K862 PolarHBondContact O-N 3.28Å
859	K	86.8	Confident	83	Confident	126 Å²	126	115.5 Å²	115.5	55%	0.548	54%	0.535	S	S	.	.	H	α-helix	trans	-63.2	-44.8	176.8	-171.9	173.3	-177.5	175.4	0	110.9	E855 H861 K862 D863	E855-K859 WeakPolarHBondContact O-CB 3.28Å; E855-K859 PolarHBondContact O-N 3.17Å; K859-H861 VanDerWaalsContact C-N 3.33Å; K859-H861 PolarHBondContact O-N 3Å; K859-K862 PolarHBondContact O-N 3.08Å; K859-D863 VanDerWaalsContact O-CB 3.3Å; K859-D863 WeakPolarHBondContact O-CB 3.41Å; K859-D863 VanDerWaalsContact O-CG 3.26Å; K859-D863 PolarHBondContact O-N 3.45Å
860	R	83.8	Confident	81.9	Confident	197 Å²	197	117.3 Å²	117.3	74%	0.743	54%	0.542	S	S	*	.	H	α-helix	trans	-61.3	-40.2	175.9	-171.1	175.3	-178.3	174.6	0.3	112	I856 A857 A864	I856-R860 WeakPolarHBondContact O-CB 3.37Å; I856-R860 PolarHBondContact O-N 2.97Å; A857-R860 PolarHBondContact O-N 3.27Å; R860-A864 VanDerWaalsContact O-CB 3.23Å; R860-A864 WeakPolarHBondContact O-CB 3.33Å; R860-A864 PolarHBondContact O-N 3.25Å
861	H	81	Confident	80.8	Confident	124 Å²	124	116.7 Å²	116.7	57%	0.574	54%	0.544	S	S	*	.	H	α-helix	trans	-70.5	-41.8	176.8	-168.8	-98.6	0	0	0	112.3	A857 Y858 K859 A864 R865	A857-H861 VanDerWaalsContact O-CB 3.32Å; A857-H861 WeakPolarHBondContact O-CB 3.13Å; A857-H861 PolarHBondContact O-N 3.45Å; Y858-H861 PolarHBondContact O-N 2.85Å; K859-H861 VanDerWaalsContact C-N 3.33Å; K859-H861 PolarHBondContact O-N 3Å; H861-A864 PolarHBondContact O-N 3.44Å; H861-R865 PolarHBondContact O-N 3.28Å
862	K	79.4	Confident	79.6	Confident	95 Å²	95	114.2 Å²	114.2	41%	0.413	54%	0.539	S	S	.	.	H	α-helix	trans	-63.8	-41.3	175.1	-173	176.1	179.8	175.9	0	111.6	Y858 K859 R865 R866	Y858-K862 HydrophobicContact CE1-CD 4.22Å; Y858-K862 WeakPolarHBondContact O-CB 3.38Å; Y858-K862 PolarHBondContact O-N 3.28Å; K859-K862 PolarHBondContact O-N 3.08Å; K862-R865 PolarHBondContact O-N 3.01Å; K862-R866 WeakPolarHBondContact O-CG 3.47Å; K862-R866 PolarHBondContact O-N 3.42Å
863	D	76.3	Confident	78.5	Confident	53 Å²	53	116.9 Å²	116.9	28%	0.283	55%	0.548	S	S	.	.	H	α-helix	trans	-74	-32.4	178	-68.3	-15.1	0	0	0	111.7	K859 R866 K867	K859-D863 VanDerWaalsContact O-CB 3.3Å; K859-D863 WeakPolarHBondContact O-CB 3.41Å; K859-D863 VanDerWaalsContact O-CG 3.26Å; K859-D863 PolarHBondContact O-N 3.45Å; D863-R866 PolarHBondContact O-N 2.82Å; D863-R866 IonicContact OD1-CZ 3.52Å; D863-R866 IonicContact OD1-NE 3.34Å; D863-R866 PolarHBondContact OD1-NE 2.88Å; D863-R866 IonicContact OD1-NH2 3.99Å; D863-R866 PolarHBondContact OD1-NH2 3Å; D863-K867 WeakPolarHBondContact O-CB 3.25Å; D863-K867 VanDerWaalsContact O-CG 3.29Å; D863-K867 WeakPolarHBondContact O-CG 3.3Å; D863-K867 PolarHBondContact O-N 2.96Å
864	A	74.9	Confident	77.5	Confident	48 Å²	48	112.6 Å²	112.6	40%	0.397	54%	0.539	S	S	.	.	H	α-helix	trans	-62.9	-44	167.9	0	0	0	0	0	111.8	R860 H861 K867 Q868	R860-A864 VanDerWaalsContact O-CB 3.23Å; R860-A864 WeakPolarHBondContact O-CB 3.33Å; R860-A864 PolarHBondContact O-N 3.25Å; H861-A864 PolarHBondContact O-N 3.44Å; A864-K867 PolarHBondContact O-N 3.29Å; A864-Q868 PolarHBondContact O-N 2.82Å
865	R	74.1	Confident	76.4	Confident	175 Å²	175	112 Å²	112	66%	0.66	55%	0.545	S	S	*	.	H	α-helix	trans	-62	-42.6	172.7	-109.3	-171.4	-179.4	-175.7	1.4	112.3	H861 K862 Q868 M869	H861-R865 PolarHBondContact O-N 3.28Å; K862-R865 PolarHBondContact O-N 3.01Å; R865-Q868 PolarHBondContact O-N 2.87Å; R865-M869 WeakPolarHBondContact O-CB 3.45Å; R865-M869 PolarHBondContact O-N 3.25Å
866	R	73.1	Confident	75.6	Confident	128 Å²	128	109.9 Å²	109.9	48%	0.483	54%	0.541	S	S	.	.	H	α-helix	trans	-64.2	-41.2	176.1	-80.2	-167.8	-88.6	-158.3	1.6	111.9	K862 D863 M869 Q870	K862-R866 WeakPolarHBondContact O-CG 3.47Å; K862-R866 PolarHBondContact O-N 3.42Å; D863-R866 PolarHBondContact O-N 2.82Å; D863-R866 IonicContact OD1-CZ 3.52Å; D863-R866 IonicContact OD1-NE 3.34Å; D863-R866 PolarHBondContact OD1-NE 2.88Å; D863-R866 IonicContact OD1-NH2 3.99Å; D863-R866 PolarHBondContact OD1-NH2 3Å; R866-M869 PolarHBondContact O-N 2.89Å; R866-Q870 WeakPolarHBondContact O-CB 3.47Å; R866-Q870 WeakPolarHBondContact O-CG 3.34Å; R866-Q870 PolarHBondContact O-N 2.9Å
867	K	71.6	Confident	74.5	Confident	140 Å²	140	108.8 Å²	108.8	61%	0.609	54%	0.536	S	S	*	.	H	α-helix	trans	-63.8	-41.3	173.6	-74.5	176.7	-179	-177.1	0	112	D863 A864 Q870 L871	D863-K867 WeakPolarHBondContact O-CB 3.25Å; D863-K867 VanDerWaalsContact O-CG 3.29Å; D863-K867 WeakPolarHBondContact O-CG 3.3Å; D863-K867 PolarHBondContact O-N 2.96Å; A864-K867 PolarHBondContact O-N 3.29Å; K867-Q870 PolarHBondContact O-N 3.47Å; K867-L871 WeakPolarHBondContact O-CB 3.3Å; K867-L871 VanDerWaalsContact O-CG 3.3Å; K867-L871 WeakPolarHBondContact O-CG 3.07Å; K867-L871 PolarHBondContact O-N 3.01Å
868	Q	70	Confident	73.6	Confident	137 Å²	137	110.2 Å²	110.2	64%	0.64	54%	0.538	S	S	*	.	H	α-helix	trans	-61.7	-42.9	172	-79.2	-178.8	-22.5	0	0	112.3	A864 R865 L871 A872	A864-Q868 PolarHBondContact O-N 2.82Å; R865-Q868 PolarHBondContact O-N 2.87Å; Q868-L871 PolarHBondContact O-N 3.27Å; Q868-A872 WeakPolarHBondContact O-CB 3.25Å; Q868-A872 PolarHBondContact O-N 3.34Å
869	M	67.1	Low	72.5	Confident	137 Å²	137	111.9 Å²	111.9	68%	0.675	54%	0.543	S	S	*	.	H	α-helix	trans	-66.7	-37.3	178.3	-156.8	117.6	169.6	0	0	112.2	R865 R866 A872 F873	R865-M869 WeakPolarHBondContact O-CB 3.45Å; R865-M869 PolarHBondContact O-N 3.25Å; R866-M869 PolarHBondContact O-N 2.89Å; M869-A872 PolarHBondContact O-N 3.17Å; M869-F873 PolarHBondContact O-N 3.06Å
870	Q	70.1	Confident	71.5	Confident	134 Å²	134	112.4 Å²	112.4	63%	0.626	54%	0.542	S	S	*	.	H	α-helix	trans	-69.4	-38.9	174.8	-75.8	176.6	-16.3	0	0	112.4	R866 K867 F873 A874	R866-Q870 WeakPolarHBondContact O-CB 3.47Å; R866-Q870 WeakPolarHBondContact O-CG 3.34Å; R866-Q870 PolarHBondContact O-N 2.9Å; K867-Q870 PolarHBondContact O-N 3.47Å; Q870-F873 PolarHBondContact O-N 3.43Å; Q870-A874 WeakPolarHBondContact O-CB 3.17Å; Q870-A874 PolarHBondContact O-N 3.19Å
871	L	68.6	Low	70.3	Confident	125 Å²	125	109.7 Å²	109.7	65%	0.654	54%	0.536	S	S	*	.	H	α-helix	trans	-65.8	-38.4	173.2	-73	166.5	0	0	0	111.8	K867 Q868 A874 A875	K867-L871 WeakPolarHBondContact O-CB 3.3Å; K867-L871 VanDerWaalsContact O-CG 3.3Å; K867-L871 WeakPolarHBondContact O-CG 3.07Å; K867-L871 PolarHBondContact O-N 3.01Å; Q868-L871 PolarHBondContact O-N 3.27Å; L871-A874 PolarHBondContact O-N 3.41Å; L871-A875 WeakPolarHBondContact O-CB 3.42Å; L871-A875 PolarHBondContact O-N 2.96Å
872	A	67.4	Low	69.3	Low	57 Å²	57	108.9 Å²	108.9	47%	0.471	54%	0.535	S	S	.	.	H	α-helix	trans	-64.2	-42.4	172.8	0	0	0	0	0	112.1	Q868 M869 A875 V876	Q868-A872 WeakPolarHBondContact O-CB 3.25Å; Q868-A872 PolarHBondContact O-N 3.34Å; M869-A872 PolarHBondContact O-N 3.17Å; A872-A875 PolarHBondContact O-N 3.06Å; A872-V876 VanDerWaalsContact O-CG2 3.29Å; A872-V876 WeakPolarHBondContact O-CG2 3.26Å; A872-V876 PolarHBondContact O-N 3.47Å
873	F	69.3	Low	68.3	Low	134 Å²	134	108.8 Å²	108.8	59%	0.588	54%	0.539	S	S	*	.	H	α-helix	trans	-66.3	-38	175.1	-117.8	-83.1	0	0	0	112.8	M869 Q870 V876 N877	M869-F873 PolarHBondContact O-N 3.06Å; Q870-F873 PolarHBondContact O-N 3.43Å; F873-V876 PolarHBondContact O-N 3.3Å; F873-N877 PolarHBondContact O-N 3.43Å
874	A	68.1	Low	67.4	Low	51 Å²	51	112.6 Å²	112.6	42%	0.421	56%	0.555	S	S	.	*	H	α-helix	trans	-66	-42	175.4	0	0	0	0	0	111.8	Q870 L871 V876 N877 V878	Q870-A874 WeakPolarHBondContact O-CB 3.17Å; Q870-A874 PolarHBondContact O-N 3.19Å; L871-A874 PolarHBondContact O-N 3.41Å; A874-V876 PolarHBondContact O-N 3.4Å; A874-N877 PolarHBondContact O-N 3.29Å; A874-V878 WeakPolarHBondContact O-CG2 3.45Å; A874-V878 PolarHBondContact O-N 3.49Å
875	A	68.1	Low	66.3	Low	65 Å²	65	116.2 Å²	116.2	54%	0.537	57%	0.568	S	S	.	*	H	α-helix	trans	-62.6	-40.3	174.2	0	0	0	0	0	112.4	L871 A872 V878 W879	L871-A875 WeakPolarHBondContact O-CB 3.42Å; L871-A875 PolarHBondContact O-N 2.96Å; A872-A875 PolarHBondContact O-N 3.06Å; A875-V878 PolarHBondContact O-N 3.34Å; A875-W879 WeakPolarHBondContact O-CB 3.16Å; A875-W879 PolarHBondContact O-N 3.11Å
876	V	72.9	Confident	65.1	Low	73 Å²	73	119 Å²	119	44%	0.442	58%	0.578	S	S	.	*	H	α-helix	trans	-64	-39	174.4	168.6	0	0	0	0	111.9	A872 F873 A874 W879 R880	A872-V876 VanDerWaalsContact O-CG2 3.29Å; A872-V876 WeakPolarHBondContact O-CG2 3.26Å; A872-V876 PolarHBondContact O-N 3.47Å; F873-V876 PolarHBondContact O-N 3.3Å; A874-V876 PolarHBondContact O-N 3.4Å; V876-W879 PolarHBondContact O-N 2.95Å; V876-R880 WeakPolarHBondContact O-CB 3.43Å; V876-R880 PolarHBondContact O-N 2.93Å
877	N	66.3	Low	64	Low	74 Å²	74	122.2 Å²	122.2	40%	0.396	60%	0.596	S	S	.	*	H	α-helix	trans	-71.7	-33.8	177.8	-75.8	-20.4	0	0	0	112.8	F873 A874 R880 K881	F873-N877 PolarHBondContact O-N 3.43Å; A874-N877 PolarHBondContact O-N 3.29Å; N877-R880 PolarHBondContact O-N 2.75Å; N877-R880 PolarHBondContact OD1-NH1 3.45Å; N877-K881 PolarHBondContact O-N 3.06Å
878	V	68.1	Low	62.7	Low	89 Å²	89	121 Å²	121	54%	0.539	61%	0.605	S	S	.	*	H	α-helix	trans	-68.1	-40.8	172.2	172.5	0	0	0	0	111.1	A874 A875 R880 K881 N882	A874-V878 WeakPolarHBondContact O-CG2 3.45Å; A874-V878 PolarHBondContact O-N 3.49Å; A875-V878 PolarHBondContact O-N 3.34Å; V878-R880 VanDerWaalsContact C-N 3.33Å; V878-R880 PolarHBondContact O-N 3.48Å; V878-K881 PolarHBondContact O-N 3.33Å; V878-N882 PolarHBondContact O-N 3.48Å; V878-N882 VanDerWaalsContact O-N 3.08Å
879	W	64.8	Low	61.1	Low	187 Å²	187	117.9 Å²	117.9	71%	0.708	61%	0.61	S	S	*	*	H	α-helix	trans	-62	-39.4	173.4	-167.2	79.6	0	0	0	112.1	A875 V876 K881 L883	A875-W879 WeakPolarHBondContact O-CB 3.16Å; A875-W879 PolarHBondContact O-N 3.11Å; V876-W879 PolarHBondContact O-N 2.95Å; W879-K881 PolarHBondContact O-N 3.3Å; W879-L883 HydrophobicContact CD2-CD1 3.96Å; W879-L883 HydrophobicContact CE3-CD1 3.67Å; W879-L883 HydrophobicContact CH2-CD1 3.62Å; W879-L883 HydrophobicContact CZ2-CD1 3.9Å; W879-L883 HydrophobicContact CZ3-CD1 3.49Å; W879-L883 VanDerWaalsContact CZ3-CD1 3.49Å; W879-L883 PolarHBondContact O-N 3.17Å
880	R	65.7	Low	59.6	Low	137 Å²	137	123.2 Å²	123.2	52%	0.517	62%	0.622	S	S	.	*	H	α-helix	trans	-64.1	-36.3	174.5	-169.8	-178.3	-67.5	153.1	-0.5	112.8	V876 N877 V878 L883 Q884	V876-R880 WeakPolarHBondContact O-CB 3.43Å; V876-R880 PolarHBondContact O-N 2.93Å; N877-R880 PolarHBondContact O-N 2.75Å; N877-R880 PolarHBondContact OD1-NH1 3.45Å; V878-R880 VanDerWaalsContact C-N 3.33Å; V878-R880 PolarHBondContact O-N 3.48Å; R880-L883 PolarHBondContact O-N 3.07Å; R880-Q884 PolarHBondContact O-N 3.27Å
881	K	59.1	Low	57.9	Low	141 Å²	141	121.8 Å²	121.8	61%	0.613	63%	0.634	S	S	*	*	H	α-helix	trans	-71.5	-41.5	178.8	-146.3	178.1	-177	-176.7	0	112.2	N877 V878 W879 L883 Q884 D885	N877-K881 PolarHBondContact O-N 3.06Å; V878-K881 PolarHBondContact O-N 3.33Å; W879-K881 PolarHBondContact O-N 3.3Å; K881-L883 PolarHBondContact O-N 2.93Å; K881-Q884 PolarHBondContact O-N 3.34Å; K881-D885 PolarHBondContact O-N 3.13Å
882	N	60.6	Low	56.1	Low	106 Å²	106	124.3 Å²	124.3	57%	0.567	64%	0.642	S	S	*	*	H	α-helix	trans	-66.2	-23.2	175.4	-74.4	-12.2	0	0	0	113.7	V878	V878-N882 PolarHBondContact O-N 3.48Å; V878-N882 VanDerWaalsContact O-N 3.08Å
883	L	57.8	Low	54.9	Low	93 Å²	93	126.9 Å²	126.9	49%	0.487	65%	0.654	S	S	.	*	H	α-helix	trans	-77	-27	171.5	-95.5	154.1	0	0	0	113.2	W879 R880 K881	W879-L883 HydrophobicContact CD2-CD1 3.96Å; W879-L883 HydrophobicContact CE3-CD1 3.67Å; W879-L883 HydrophobicContact CH2-CD1 3.62Å; W879-L883 HydrophobicContact CZ2-CD1 3.9Å; W879-L883 HydrophobicContact CZ3-CD1 3.49Å; W879-L883 VanDerWaalsContact CZ3-CD1 3.49Å; W879-L883 PolarHBondContact O-N 3.17Å; R880-L883 PolarHBondContact O-N 3.07Å; K881-L883 PolarHBondContact O-N 2.93Å
884	Q	57.5	Low	53.2	Low	133 Å²	133	127.3 Å²	127.3	62%	0.621	66%	0.663	S	S	*	*	H	α-helix	trans	-80.4	-36.7	177.2	-81	175.8	-30.9	0	0	112.4	R880 K881 R886 K887	R880-Q884 PolarHBondContact O-N 3.27Å; K881-Q884 PolarHBondContact O-N 3.34Å; Q884-R886 PolarHBondContact O-N 3.32Å; Q884-K887 PolarHBondContact O-N 3.17Å
885	D	51	Low	52.3	Low	125 Å²	125	129.4 Å²	129.4	67%	0.668	67%	0.672	S	S	*	*	H	α-helix	trans	-68.9	-18.3	177	-75.7	-19.6	0	0	0	113.5	K881 K887	K881-D885 PolarHBondContact O-N 3.13Å; D885-K887 VanDerWaalsContact C-N 3.29Å; D885-K887 PolarHBondContact O-N 3.18Å
886	R	50	Low	50.6	Low	232 Å²	232	134.6 Å²	134.6	88%	0.875	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-6.7	174.9	-123.7	177.1	161.9	-177.7	-6	114.2	Q884	Q884-R886 PolarHBondContact O-N 3.32Å
887	K	50.9	Low	48.6	Very low	196 Å²	196	139.4 Å²	139.4	85%	0.852	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	-5.3	-172.9	-118.7	-179	-179	-177.2	0	115.3	Q884 D885	Q884-K887 PolarHBondContact O-N 3.17Å; D885-K887 VanDerWaalsContact C-N 3.29Å; D885-K887 PolarHBondContact O-N 3.18Å
888	S	43.8	Very low	46.9	Very low	114 Å²	114	145.3 Å²	145.3	80%	0.797	72%	0.719	S	S	*	*			trans	-128.4	53.8	-172	-167.9	0	0	0	0	113.8
889	G	36.3	Very low	45.1	Very low	73 Å²	73	146 Å²	146	75%	0.753	74%	0.735	S	S	*	*			trans	-140.1	69.5	178.6	0	0	0	0	0	113.2
890	R	36.3	Very low	43.7	Very low	248 Å²	248	143.3 Å²	143.3	94%	0.936	74%	0.739	S	S	*	*			trans	-168	99.5	156.7	-112.8	176.9	-175	159.5	1.8	110.2
891	A	32.4	Very low	42.1	Very low	104 Å²	104	144.5 Å²	144.5	86%	0.86	75%	0.748	S	S	*	*			trans	152.6	98.3	138.7	0	0	0	0	0	111.3
892	E	31.9	Very low	40.9	Very low	178 Å²	178	148.2 Å²	148.2	83%	0.832	76%	0.758	S	S	*	*			trans	-78.6	172.9	145.5	-114.1	-166.4	133.2	0	0	108.7
893	P	43	Very low	39.5	Very low	112 Å²	112	147 Å²	147	73%	0.727	76%	0.762	S	S	*	*			cis	-136.7	166.5	12.9	27.3	-2.5	0	0	0	117.2
894	D	31.7	Very low	38.4	Very low	143 Å²	143	149.7 Å²	149.7	77%	0.765	78%	0.776	S	S	*	*			trans	-49.3	-179.1	155.8	-115.3	-6.4	0	0	0	113.6
895	P	50.6	Low	37.2	Very low	95 Å²	95	148.8 Å²	148.8	62%	0.617	78%	0.78	S	S	*	*			cis	-151.7	-175.8	21.6	28.5	-0.9	0	0	0	118.2
896	K	31.6	Very low	36.5	Very low	173 Å²	173	147.3 Å²	147.3	75%	0.752	78%	0.779	S	S	*	*			trans	102.1	135.3	151	-59.9	176.3	-176.4	168.3	0	115.1
897	K	31.3	Very low	35.8	Very low	174 Å²	174	141.9 Å²	141.9	76%	0.757	77%	0.772	S	S	*	*			cis	-168.1	143.8	6.3	-116.7	173.2	-177.6	-177.6	0	109
898	K	29.8	Very low	34.9	Very low	198 Å²	198	140.1 Å²	140.1	86%	0.861	77%	0.771	S	S	*	*			trans	30.5	126.4	142.8	-64.8	-177.8	175.3	-174.3	0	121
899	A	30.6	Very low	34.4	Very low	104 Å²	104	138.9 Å²	138.9	86%	0.86	77%	0.768	S	S	*	*				162.6	146.7	95.8	0	0	0	0	0	112.1
900	T	35.9	Very low	34.3	Very low	131 Å²	131	140.2 Å²	140.2	80%	0.804	77%	0.765	S	S	*	*			trans	-94.3	143.2	-173.9	-16.3	0	0	0	0	111.9
901	F	31.5	Very low	34.1	Very low	161 Å²	161	133.1 Å²	133.1	71%	0.706	75%	0.754	S	S	*	*				169.5	135.8	128.9	-116.9	-113.4	0	0	0	113.4
902	R	34.7	Very low	34.1	Very low	220 Å²	220	137.3 Å²	137.3	83%	0.83	75%	0.753	S	S	*	*			trans	40.6	147.3	147.1	-73.5	-175.1	-178.1	162.9	-1.8	119.9
903	A	31.6	Very low	33.9	Very low	79 Å²	79	137.4 Å²	137.4	65%	0.653	75%	0.751	S	S	*	*			cis	-178.7	-177.8	-3.7	0	0	0	0	0	106.8
904	I	34.6	Very low	33.3	Very low	151 Å²	151	142.5 Å²	142.5	77%	0.774	76%	0.756	S	S	*	*			trans	103.8	108.9	149	-63.9	167.3	0	0	0	118.9
905	T	32.3	Very low	33.2	Very low	113 Å²	113	146.6 Å²	146.6	69%	0.693	76%	0.76	S	S	*	*			trans	60.9	125.8	143.9	48.8	0	0	0	0	121.6
906	S	35	Very low	32.1	Very low	95 Å²	95	153.3 Å²	153.3	66%	0.664	77%	0.773	S	S	*	*				70	140.1	76.3	101.2	0	0	0	0	111.1
907	T	35.2	Very low	31.9	Very low	117 Å²	117	150.5 Å²	150.5	72%	0.718	78%	0.776	S	S	*	*			cis	177.3	156.9	26.1	3.1	0	0	0	0	106.8
908	L	33.7	Very low	31.8	Very low	159 Å²	159	147 Å²	147	83%	0.832	77%	0.773	S	S	*	*			trans	153.3	103	135.8	-84.4	151.2	0	0	0	108.1
909	A	33.3	Very low	31.6	Very low	88 Å²	88	147.1 Å²	147.1	73%	0.727	77%	0.774	S	S	*	*				73.4	135.6	73.5	0	0	0	0	0	111.3
910	S	33.2	Very low	31.4	Very low	101 Å²	101	149 Å²	149	71%	0.706	77%	0.769	S	S	*	*			cis	-174	154.4	22.2	43.5	0	0	0	0	113.2
911	S	32.3	Very low	31.1	Very low	100 Å²	100	148.8 Å²	148.8	70%	0.699	77%	0.768	S	S	*	*			trans	72.8	144.6	136.7	75	0	0	0	0	120.6
912	F	31.8	Very low	31	Very low	192 Å²	192	145.6 Å²	145.6	84%	0.842	77%	0.765	S	S	*	*			cis	-172	170.3	-2.2	-134	-95.8	0	0	0	110.8
913	K	29.3	Very low	30.7	Very low	180 Å²	180	141.6 Å²	141.6	78%	0.783	77%	0.765	S	S	*	*			trans	98.4	104.2	164	-85.7	173.9	170	170.8	0	117.2
914	R	29.9	Very low	30.5	Very low	219 Å²	219	141.9 Å²	141.9	83%	0.826	78%	0.776	S	S	*	*				67.3	123.7	88.6	-90.6	-173.9	-176.9	173.3	3.2	111.8
915	R	28.3	Very low	30.1	Very low	229 Å²	229	139 Å²	139	86%	0.864	78%	0.784	S	S	*	*			cis	-161.9	141	45.2	-105.2	171.5	171.9	167.3	-4.4	111
916	R	29	Very low	29.9	Very low	236 Å²	236	137.4 Å²	137.4	89%	0.891	79%	0.79	S	S	*	*			trans	23.8	119.1	135.2	-83.4	-179.9	178.5	172.7	-1.2	118.9
917	S	27.3	Very low	29.6	Very low	114 Å²	114	145.1 Å²	145.1	80%	0.797	81%	0.805	S	S	*	*				83.8	135.4	72.4	178.3	0	0	0	0	111.2
918	S	29	Very low	29.2	Very low	100 Å²	100	143.3 Å²	143.3	70%	0.699	81%	0.809	S	S	*	*			cis	-177	153	0.2	158	0	0	0	0	106.1
919	K	25.1	Very low	28.9	Very low	201 Å²	201	139.9 Å²	139.9	87%	0.874	80%	0.803	S	S	*	*			trans	-151.7	116.7	151.5	-142.7	175.4	-173.5	177.8	0	110.5
920	D	26.6	Very low	28.7	Very low	143 Å²	143	143.1 Å²	143.1	77%	0.765	81%	0.808	S	S	*	*			trans	176.9	144.2	154.7	-88.2	-17.5	0	0	0	103
921	T	29	Very low	28.5	Very low	127 Å²	127	145 Å²	145	78%	0.779	81%	0.805	S	S	*	*			cis	-165	172.3	30.5	-22.3	0	0	0	0	108.7
922	S	29.5	Very low	28.2	Very low	93 Å²	93	146 Å²	146	65%	0.65	80%	0.803	S	S	*	*			trans	-67.3	180	174.1	51.8	0	0	0	0	116.1
923	T	29.3	Very low	28	Very low	136 Å²	136	143.2 Å²	143.2	83%	0.834	79%	0.792	S	S	*	*			trans	100.7	98.7	155.8	62.7	0	0	0	0	119.9
924	G	27.3	Very low	27.9	Very low	86 Å²	86	142.5 Å²	142.5	89%	0.887	79%	0.789	S	S	*	*				49.7	115.2	110	0	0	0	0	0	122.6
925	G	26.4	Very low	27.9	Very low	90 Å²	90	138.2 Å²	138.2	93%	0.928	78%	0.783	S	S	*	*			trans	127.4	118.8	133	0	0	0	0	0	118.1
926	G	28.3	Very low	27.9	Very low	80 Å²	80	133.3 Å²	133.3	83%	0.825	78%	0.779	S	S	*	*			trans	134.3	86.7	148.5	0	0	0	0	0	120.4
927	R	27.3	Very low	27.9	Very low	257 Å²	257	128.5 Å²	128.5	97%	0.97	78%	0.775	S	S	*	*			trans	29	131.5	144.1	-80.1	179.3	173.8	170.8	-1.9	124.4
928	G	27.5	Very low	28.1	Very low	79 Å²	79	130.5 Å²	130.5	81%	0.814	78%	0.776	S	S	*	*			trans	97.4	139.8	130.8	0	0	0	0	0	116.4
929	A	27.8	Very low	29	Very low	86 Å²	86	130.8 Å²	130.8	71%	0.711	78%	0.776	S	S	*	*			cis	-168.6	170.6	-4	0	0	0	0	0	107.8
930	L	29.3	Very low	29	Very low	157 Å²	157	130.7 Å²	130.7	82%	0.822	77%	0.77	S	S	*	*			trans	76.9	139.3	173.8	-67.4	114	0	0	0	117.2
931	Q	28.5	Very low	29.1	Very low	140 Å²	140	133.9 Å²	133.9	65%	0.654	77%	0.771	S	S	*	*			cis	-173.5	145.6	-15.2	-174.9	107.5	3.4	0	0	105.8
932	N	26	Very low	29	Very low	122 Å²	122	131.4 Å²	131.4	65%	0.652	76%	0.763	S	S	*	*			trans	74.3	137.2	151.3	-78.6	-3.7	0	0	0	117.8
933	Q	27.7	Very low	29	Very low	132 Å²	132	134.3 Å²	134.3	62%	0.617	77%	0.77	S	S	*	*			cis	178.1	143.9	9.1	172.3	166.4	26	0	0	110
934	K	27.5	Very low	28.9	Very low	165 Å²	165	136.7 Å²	136.7	72%	0.717	77%	0.772	S	S	*	*			trans	66.9	153.3	152.3	-78.2	172.3	-174.8	171.4	0	119.1
935	D	28.2	Very low	29	Very low	129 Å²	129	143.6 Å²	143.6	69%	0.69	77%	0.771	S	S	*	*			cis	175.5	167.2	-24.1	-107.3	-16.6	0	0	0	104.8
936	T	29.3	Very low	29	Very low	126 Å²	126	148.6 Å²	148.6	77%	0.773	77%	0.77	S	S	*	*			trans	76.7	115.3	151.1	28.1	0	0	0	0	119.1
937	V	29	Very low	29	Very low	135 Å²	135	153.7 Å²	153.7	82%	0.818	77%	0.772	S	S	*	*				89.5	129.2	76.9	167.7	0	0	0	0	113.4
938	L	30.8	Very low	29	Very low	156 Å²	156	144.6 Å²	144.6	82%	0.817	76%	0.759	S	S	*	*			trans	-35.5	176.9	162.1	-82.4	154.3	0	0	0	115.6
939	P	48.3	Very low	29	Very low	106 Å²	106	149.8 Å²	149.8	69%	0.688	76%	0.762	S	S	*	*			cis	-144.4	-166	-2.1	28.9	-2	0	0	0	115.7
940	R	26.3	Very low	29	Very low	200 Å²	200	154 Å²	154	76%	0.755	77%	0.772	S	S	*	*			trans	93.4	125.9	140.7	-91.8	-173.5	-175.8	-170.9	3.6	122.4
941	R	26.9	Very low	29	Very low	210 Å²	210	154.4 Å²	154.4	79%	0.792	77%	0.769	S	S	*	*			trans	60.4	152.6	133.5	-77.7	-176.4	179.9	178	-1.9	118
942	A	27.8	Very low	29	Very low	74 Å²	74	154.5 Å²	154.5	61%	0.612	77%	0.774	S	S	*	*			cis	-176.1	154.4	-5.5	0	0	0	0	0	107.6
943	I	28.8	Very low	28.9	Very low	154 Å²	154	154.3 Å²	154.3	79%	0.79	78%	0.781	S	S	*	*			trans	56.3	122.4	142.6	-57.4	159.4	0	0	0	120.8
944	E	28.3	Very low	29	Very low	187 Å²	187	153.6 Å²	153.6	87%	0.874	79%	0.79	S	S	*	*				178.9	112.6	128.3	-100.1	172.9	173.5	0	0	105.7
945	R	28	Very low	29.1	Very low	230 Å²	230	156.1 Å²	156.1	87%	0.868	80%	0.795	S	S	*	*				62.6	103.5	62.5	-149.4	-170.5	-138.1	-176.3	5.7	113.6
946	E	27	Very low	29.2	Very low	195 Å²	195	156.9 Å²	156.9	91%	0.911	79%	0.794	S	S	*	*				-160.4	140.5	128.1	-118	-174.6	174.1	0	0	112.6
947	E	28.8	Very low	29.2	Very low	187 Å²	187	160.5 Å²	160.5	87%	0.874	79%	0.794	S	S	*	*			trans	-89.4	168.2	177.6	-64	173.6	137.2	0	0	110.9
948	G	27.6	Very low	29.3	Very low	67 Å²	67	161.2 Å²	161.2	69%	0.691	79%	0.788	S	S	*	*			trans	155.4	87.6	160	0	0	0	0	0	112.9
949	Q	27.5	Very low	29.6	Very low	187 Å²	187	162.9 Å²	162.9	87%	0.874	81%	0.813	S	S	*	*				75.8	115	105.5	-88.3	-174.4	-12.6	0	0	115.6
950	L	28.4	Very low	28.6	Very low	176 Å²	176	165.8 Å²	165.8	92%	0.921	82%	0.819	S	S	*	*				-175.4	138.6	105.7	-102.9	147.2	0	0	0	113.3
951	Q	28.4	Very low	28.7	Very low	164 Å²	164	163.9 Å²	163.9	77%	0.766	82%	0.823	S	S	*	*			trans	-81.5	160.1	-178.1	-93.1	175.7	-53.3	0	0	114
952	L	27.8	Very low	28.9	Very low	143 Å²	143	161.4 Å²	161.4	75%	0.749	82%	0.824	S	S	*	*			trans	50.3	122.7	142.3	-83.8	93.5	0	0	0	120.2
953	C	25.5	Very low	28.9	Very low	118 Å²	118	166.5 Å²	166.5	80%	0.797	84%	0.837	S	S	*	*				172.3	125.2	103	-105.2	0	0	0	0	111
954	S	28.8	Very low	28.9	Very low	117 Å²	117	167.3 Å²	167.3	82%	0.818	84%	0.84	S	S	*	*				160.9	115.2	114.2	63.2	0	0	0	0	112.8
955	R	30.4	Very low	29	Very low	218 Å²	218	166 Å²	166	82%	0.823	84%	0.837	S	S	*	*			trans	-47.8	146.9	152.6	-89.1	171.7	163.6	167.7	-4.8	112.3
956	H	28.6	Very low	29	Very low	144 Å²	144	161.4 Å²	161.4	67%	0.667	84%	0.835	S	S	*	*				149.5	136.8	99	-110.8	-38.4	0	0	0	113.5
957	R	31.2	Very low	29.2	Very low	203 Å²	203	158.8 Å²	158.8	77%	0.766	83%	0.829	S	S	*	*			trans	63.1	149.8	147.3	-81.1	179.6	158.7	172	0.2	116.7
958	E	31.2	Very low	29.2	Very low	150 Å²	150	156.5 Å²	156.5	70%	0.701	83%	0.826	S	S	*	*			cis	-159.2	147	7.5	-105.5	150.5	-171.3	0	0	102
959	S	35.2	Very low	29.4	Very low	191 Å²	191	164.6 Å²	164.6	100%	1.336	84%	0.838	S	S	*	*				179.5	0	65.6	51.7	0	0	0	0	108.4

Retrieved 959 of 959 residues in 559.7 ms (Link to these results)

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