A0A087X307_POEFO Loading...

Diacylglycerol kinase

AlphaFold DB , UniProt , Accession A0A087X307, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 928 aa.

						>A0A087X307_POEFO|A0A087X307
SLSYCFLLECRKAISRSGLHYLGPPQPSLPPASNGPNKDLRTCVDWTENAGNGDHLWTETSCSGELCYLGEDACLLKTAKSAPRRKCAACKIVVHTGCIEQLEKINFRCKPTFKEGGSRCLRDNVLRHHWVHRRRQEGKCKQCGKSFQQKFFHSKEIIAISCSWCKQAFHNKVTCFMLHQIEEPCSLGAHAGVIVPPSWIIKVRKPQSSLKNSARRKKRTSFKRRASKKGLEQDSKWRPFILKPLPSPLMKPVLVFVNPKSGGNQGAKLLHMFMWILNPRQVFDLSQGGLREALELYRKVPNLRILACGGDGTVGWILSALDELQMNPQPPVAVLPLGTGNDLARTLNWGGGYTDEPVSKVLCHVEDGSVVQLDRWNLLVEKTAVQPEEGTQKLPLNVFNNYFSLGFDAHVTLEFHESREANPEKFNSRFRNKMFYAGAAFSDFLQRSSRDLSKHVRVVCDGTDLTPKIQELKFQCIVFLNIPRYCAGTMPWGNTGDHRDFEPQRHDDGCIEVIGFTMASLAALQVGGHGERLHQCREVVLTTYKTVPVQVMSPTLRLAPSTLRISLRNQANMVQKSKRRTSVPLLNDPHAVPDRLRLRVNRISLQEYDRLQYDKERLRDISIPVGIVVVRGDCDLETCRLYIDRLQEDLHQAPSTGHRVHYQQDEIRGVPITSSTSRLSPNWSFLDSTSADRFYRIDKAQEHLHFVTEICQDEVFILDHEGPVGSQASSAGMPDLVVEPAAGLQNQGNDLMKRSEYIEVLNVAAVASVHHQMSLDDGFILQMINAPLTPDEQALLTAASTGDLLLLMDGVRRGVSLLVRDSGGCSALHLAAQNGHTDLVSFILQQGSKVLLDLTDRDKGETALHKAASEKQHAVCRMLVEAGASLEKTNFQGKTAADQAAGDSELAVFLSSQQQTSSGTNEDLETAV
					

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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	S	32.6	Very low	36.9	Very low	135 Å²	135	96 Å²	96	94%	0.944	50%	0.5	S	S	*	.				0	-48.2	0	53.1	0	0	0	0	112.2	S3 Y4 C5	S1-S3 PolarHBondContact O-N 3.4Å; S1-Y4 PolarHBondContact O-N 3.04Å; S1-Y4 VanDerWaalsContact O-N 3.09Å; S1-C5 PolarHBondContact O-N 2.81Å; S1-C5 VanDerWaalsContact O-N 3.07Å
2	L	28.5	Very low	37.4	Very low	147 Å²	147	97.3 Å²	97.3	77%	0.77	50%	0.498	S	S	*	.	H	α-helix	trans	-55	-44.2	180	-79.9	153.5	0	0	0	114.9	Y4 C5 F6	L2-Y4 VanDerWaalsContact C-N 3.29Å; L2-Y4 PolarHBondContact O-N 3.41Å; L2-C5 PolarHBondContact O-N 3.21Å; L2-F6 WeakPolarHBondContact O-CB 3.32Å; L2-F6 PolarHBondContact O-N 3.44Å
3	S	31.2	Very low	37.7	Very low	82 Å²	82	91.4 Å²	91.4	57%	0.573	47%	0.473	S	S	*	.	H	α-helix	trans	-65.3	-29.5	176.6	-53.2	0	0	0	0	113.8	S1 L7	S1-S3 PolarHBondContact O-N 3.4Å; S3-L7 WeakPolarHBondContact O-CB 3.2Å; S3-L7 WeakPolarHBondContact O-CD1 3.3Å; S3-L7 VanDerWaalsContact O-CG 3.27Å; S3-L7 WeakPolarHBondContact O-CG 3.12Å; S3-L7 PolarHBondContact O-N 2.89Å; S3-L7 VanDerWaalsContact O-N 3.11Å
4	Y	32.6	Very low	38.4	Very low	170 Å²	170	85.6 Å²	85.6	67%	0.667	44%	0.444	S	S	*	.	H	α-helix	trans	-78	-41.4	178.7	-163.6	-92.8	0	0	0	111	S1 L2 L7 L8	S1-Y4 PolarHBondContact O-N 3.04Å; S1-Y4 VanDerWaalsContact O-N 3.09Å; L2-Y4 VanDerWaalsContact C-N 3.29Å; L2-Y4 PolarHBondContact O-N 3.41Å; Y4-L7 PolarHBondContact O-N 2.83Å; Y4-L8 HydrophobicContact CD1-CD1 3.82Å; Y4-L8 HydrophobicContact CE1-CD1 3.43Å; Y4-L8 VanDerWaalsContact CE1-CD1 3.43Å; Y4-L8 WeakPolarHBondContact O-CB 3.39Å; Y4-L8 PolarHBondContact O-N 3.04Å
5	C	33.9	Very low	38.6	Very low	75 Å²	75	83 Å²	83	51%	0.507	44%	0.435	S	S	.	.	H	α-helix	trans	-60.4	-45.2	170.9	-80.6	0	0	0	0	111.8	S1 L2 L7 L8 E9	S1-C5 PolarHBondContact O-N 2.81Å; S1-C5 VanDerWaalsContact O-N 3.07Å; L2-C5 PolarHBondContact O-N 3.21Å; C5-L7 PolarHBondContact O-N 3.02Å; C5-L8 PolarHBondContact O-N 2.9Å; C5-E9 WeakPolarHBondContact O-CB 3.31Å; C5-E9 WeakPolarHBondContact O-CG 3.05Å; C5-E9 PolarHBondContact O-N 3Å
6	F	40.4	Very low	38.6	Very low	46 Å²	46	88.4 Å²	88.4	20%	0.202	45%	0.448	C	S	.	.	H	α-helix	trans	-63.7	-41.4	177.9	-171	-84.5	0	0	0	112.5	L2 L8 E9 C10 V173 L178	L2-F6 WeakPolarHBondContact O-CB 3.32Å; L2-F6 PolarHBondContact O-N 3.44Å; F6-L8 VanDerWaalsContact C-N 3.34Å; F6-L8 PolarHBondContact O-N 2.78Å; F6-E9 PolarHBondContact O-N 3.22Å; F6-C10 WeakPolarHBondContact CE1-SG 3.45Å; F6-C10 WeakPolarHBondContact O-CB 3.4Å; F6-C10 PolarHBondContact O-N 2.88Å; F6-V173 HydrophobicContact CB-CG2 4.42Å; F6-V173 HydrophobicContact CD1-CB 4.04Å; F6-V173 HydrophobicContact CD1-CG1 3.83Å; F6-V173 HydrophobicContact CD1-CG2 3.23Å; F6-V173 HydrophobicContact CD2-CG1 4.37Å; F6-V173 HydrophobicContact CE1-CB 3.87Å; F6-V173 HydrophobicContact CE1-CG1 3.45Å; F6-V173 VanDerWaalsContact CE1-CG1 3.45Å; F6-V173 HydrophobicContact CE1-CG2 3.56Å; F6-V173 HydrophobicContact CE2-CG1 4.04Å; F6-V173 HydrophobicContact CG-CG1 4.25Å; F6-V173 HydrophobicContact CG-CG2 3.95Å; F6-V173 HydrophobicContact CZ-CB 4.47Å; F6-V173 HydrophobicContact CZ-CG1 3.57Å; F6-V173 HydrophobicContact CZ-CG2 4.49Å; F6-L178 HydrophobicContact CD2-CD1 4.21Å; F6-L178 HydrophobicContact CE2-CD1 3.34Å; F6-L178 HydrophobicContact CZ-CD1 3.59Å
7	L	41.3	Very low	38.5	Very low	64 Å²	64	86.2 Å²	86.2	34%	0.335	44%	0.443	S	S	.	.	H	α-helix	trans	-66	-35.6	175.2	-77.6	166.8	0	0	0	112.5	S3 Y4 C5 R11	S3-L7 WeakPolarHBondContact O-CB 3.2Å; S3-L7 WeakPolarHBondContact O-CD1 3.3Å; S3-L7 VanDerWaalsContact O-CG 3.27Å; S3-L7 WeakPolarHBondContact O-CG 3.12Å; S3-L7 PolarHBondContact O-N 2.89Å; S3-L7 VanDerWaalsContact O-N 3.11Å; Y4-L7 PolarHBondContact O-N 2.83Å; C5-L7 PolarHBondContact O-N 3.02Å; L7-R11 WeakPolarHBondContact O-CB 3.47Å; L7-R11 WeakPolarHBondContact O-CG 3.28Å; L7-R11 PolarHBondContact O-N 3.41Å
8	L	41.9	Very low	38.6	Very low	73 Å²	73	83.6 Å²	83.6	38%	0.382	44%	0.441	S	S	.	.	H	α-helix	trans	-69.3	-39.4	173.1	-119.5	109.4	0	0	0	111.9	Y4 C5 F6 R11 K12	Y4-L8 HydrophobicContact CD1-CD1 3.82Å; Y4-L8 HydrophobicContact CE1-CD1 3.43Å; Y4-L8 VanDerWaalsContact CE1-CD1 3.43Å; Y4-L8 WeakPolarHBondContact O-CB 3.39Å; Y4-L8 PolarHBondContact O-N 3.04Å; C5-L8 PolarHBondContact O-N 2.9Å; F6-L8 VanDerWaalsContact C-N 3.34Å; F6-L8 PolarHBondContact O-N 2.78Å; L8-R11 PolarHBondContact O-N 2.85Å; L8-K12 WeakPolarHBondContact O-CB 3.37Å; L8-K12 VanDerWaalsContact O-CG 3.3Å; L8-K12 WeakPolarHBondContact O-CG 3.47Å; L8-K12 PolarHBondContact O-N 2.99Å
9	E	39.6	Very low	38.4	Very low	116 Å²	116	83.3 Å²	83.3	54%	0.542	44%	0.439	S	S	.	.	H	α-helix	trans	-67.7	-40.7	175	-80	-176.9	161.1	0	0	111.9	C5 F6 K12 A13	C5-E9 WeakPolarHBondContact O-CB 3.31Å; C5-E9 WeakPolarHBondContact O-CG 3.05Å; C5-E9 PolarHBondContact O-N 3Å; F6-E9 PolarHBondContact O-N 3.22Å; E9-K12 CarbonylContact O-C 3.54Å; E9-K12 PolarHBondContact O-N 2.88Å; E9-A13 WeakPolarHBondContact O-CA 3.4Å; E9-A13 WeakPolarHBondContact O-CB 3.33Å; E9-A13 PolarHBondContact O-N 2.98Å
10	C	42.7	Very low	38	Very low	6 Å²	6	87.5 Å²	87.5	4%	0.041	46%	0.456	C	S	.	.	H	α-helix	trans	-65.3	-41.7	171.9	-80.6	0	0	0	0	112.1	F6 K12 A13 I14	F6-C10 WeakPolarHBondContact CE1-SG 3.45Å; F6-C10 WeakPolarHBondContact O-CB 3.4Å; F6-C10 PolarHBondContact O-N 2.88Å; C10-K12 VanDerWaalsContact C-N 3.34Å; C10-K12 PolarHBondContact O-N 2.84Å; C10-A13 PolarHBondContact O-N 2.57Å; C10-I14 WeakPolarHBondContact O-CB 3.45Å; C10-I14 VanDerWaalsContact O-CG1 3.24Å; C10-I14 WeakPolarHBondContact O-CG1 3.28Å; C10-I14 PolarHBondContact O-N 2.97Å
11	R	41.2	Very low	37.6	Very low	142 Å²	142	93.6 Å²	93.6	54%	0.536	47%	0.474	S	S	.	.	H	α-helix	trans	-59	-45.3	171	-87.5	179.5	179.3	-163.1	3.1	111.5	L7 L8 S15	L7-R11 WeakPolarHBondContact O-CB 3.47Å; L7-R11 WeakPolarHBondContact O-CG 3.28Å; L7-R11 PolarHBondContact O-N 3.41Å; L8-R11 PolarHBondContact O-N 2.85Å; R11-S15 VanDerWaalsContact O-CB 3.3Å; R11-S15 WeakPolarHBondContact O-CB 3.47Å; R11-S15 PolarHBondContact O-N 2.92Å
12	K	43	Very low	37.4	Very low	111 Å²	111	94.8 Å²	94.8	48%	0.483	47%	0.469	S	S	.	.	H	α-helix	trans	-66.9	-35.9	175.5	-77	175.1	178.9	175.4	0	111.8	L8 E9 C10 R16	L8-K12 WeakPolarHBondContact O-CB 3.37Å; L8-K12 VanDerWaalsContact O-CG 3.3Å; L8-K12 WeakPolarHBondContact O-CG 3.47Å; L8-K12 PolarHBondContact O-N 2.99Å; E9-K12 CarbonylContact O-C 3.54Å; E9-K12 PolarHBondContact O-N 2.88Å; C10-K12 VanDerWaalsContact C-N 3.34Å; C10-K12 PolarHBondContact O-N 2.84Å; K12-R16 WeakPolarHBondContact O-CA 3.43Å; K12-R16 WeakPolarHBondContact O-CB 3.47Å; K12-R16 WeakPolarHBondContact O-CD 3.41Å; K12-R16 WeakPolarHBondContact O-CG 3.34Å; K12-R16 PolarHBondContact O-N 2.85Å
13	A	41.2	Very low	37.5	Very low	21 Å²	21	91 Å²	91	17%	0.174	47%	0.465	C	S	.	.	H	α-helix	trans	-74.2	-40.5	-179.4	0	0	0	0	0	112	E9 C10 S15 R16 S17 I181	E9-A13 WeakPolarHBondContact O-CA 3.4Å; E9-A13 WeakPolarHBondContact O-CB 3.33Å; E9-A13 PolarHBondContact O-N 2.98Å; C10-A13 PolarHBondContact O-N 2.57Å; A13-S15 VanDerWaalsContact C-N 3.34Å; A13-R16 CarbonylContact O-C 3.58Å; A13-R16 PolarHBondContact O-N 2.84Å; A13-S17 PolarHBondContact O-N 2.87Å; A13-I181 HydrophobicContact CB-CD1 3.78Å
14	I	48.3	Very low	37.6	Very low	11 Å²	11	92.9 Å²	92.9	6%	0.056	48%	0.476	C	S	.	.	H	α-helix	trans	-64.5	-40.6	172.5	-68	166.5	0	0	0	110	C10 S17 W130 H132 I160 F176	C10-I14 WeakPolarHBondContact O-CB 3.45Å; C10-I14 VanDerWaalsContact O-CG1 3.24Å; C10-I14 WeakPolarHBondContact O-CG1 3.28Å; C10-I14 PolarHBondContact O-N 2.97Å; I14-S17 PolarHBondContact O-OG 3.12Å; I14-W130 HydrophobicContact CD1-CB 4.39Å; I14-W130 HydrophobicContact CG1-CB 4.23Å; I14-W130 HydrophobicContact CG2-CB 4.16Å; I14-H132 WeakPolarHBondContact CD1-NE2 3.43Å; I14-I160 HydrophobicContact CD1-CD1 4.29Å; I14-I160 HydrophobicContact CD1-CG2 4.22Å; I14-F176 HydrophobicContact CD1-CE1 4.2Å
15	S	41.4	Very low	37.5	Very low	46 Å²	46	90.8 Å²	90.8	32%	0.322	48%	0.483	S	S	.	.	H	α-helix	trans	-68.3	-37.3	171.4	173.8	0	0	0	0	113.2	R11 A13 G18	R11-S15 VanDerWaalsContact O-CB 3.3Å; R11-S15 WeakPolarHBondContact O-CB 3.47Å; R11-S15 PolarHBondContact O-N 2.92Å; A13-S15 VanDerWaalsContact C-N 3.34Å; S15-G18 PolarHBondContact O-N 2.83Å
16	R	38	Very low	37.3	Very low	169 Å²	169	95.8 Å²	95.8	64%	0.638	50%	0.499	S	S	*	.	H	α-helix	trans	-75.8	-21.4	178.8	-79	169.7	175.4	-167.1	-2.8	113.8	K12 A13 G18 L19	K12-R16 WeakPolarHBondContact O-CA 3.43Å; K12-R16 WeakPolarHBondContact O-CB 3.47Å; K12-R16 WeakPolarHBondContact O-CD 3.41Å; K12-R16 WeakPolarHBondContact O-CG 3.34Å; K12-R16 PolarHBondContact O-N 2.85Å; A13-R16 CarbonylContact O-C 3.58Å; A13-R16 PolarHBondContact O-N 2.84Å; R16-G18 PolarHBondContact O-N 3.03Å; R16-L19 PolarHBondContact O-N 2.79Å; R16-L19 VanDerWaalsContact O-N 3.11Å
17	S	37.6	Very low	36.9	Very low	52 Å²	52	98.7 Å²	98.7	36%	0.364	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-10.7	172.6	72.3	0	0	0	0	113	A13 I14	A13-S17 PolarHBondContact O-N 2.87Å; I14-S17 PolarHBondContact O-OG 3.12Å
18	G	39.1	Very low	36.7	Very low	39 Å²	39	101.2 Å²	101.2	40%	0.402	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	24	173.2	0	0	0	0	0	117	S15 R16 N106	S15-G18 PolarHBondContact O-N 2.83Å; R16-G18 PolarHBondContact O-N 3.03Å; G18-N106 PolarHBondContact O-ND2 3.29Å
19	L	35.3	Very low	36.1	Very low	77 Å²	77	105.7 Å²	105.7	40%	0.403	57%	0.569	S	S	.	*			trans	-144.8	116.2	177.3	-109.9	159.7	0	0	0	114.6	R16 Y21 N106	R16-L19 PolarHBondContact O-N 2.79Å; R16-L19 VanDerWaalsContact O-N 3.11Å; L19-Y21 WeakPolarHBondContact CD2-O 3.35Å; L19-N106 HydrophobicContact CD1-CB 3.54Å; L19-N106 WeakPolarHBondContact CD1-ND2 3.36Å; L19-N106 HydrophobicContact CG-CB 4.47Å; L19-N106 WeakPolarHBondContact CG-ND2 3.38Å
20	H	30.5	Very low	35.8	Very low	168 Å²	168	105.1 Å²	105.1	78%	0.778	58%	0.576	S	S	*	*	S	Bend	trans	-96.4	135.6	145.7	-83.8	-87.6	0	0	0	108.1
21	Y	29.5	Very low	35.4	Very low	215 Å²	215	110.9 Å²	110.9	84%	0.843	61%	0.613	S	S	*	*			trans	88.2	110.1	175	-60	-82	0	0	0	117.6	L19	L19-Y21 WeakPolarHBondContact CD2-O 3.35Å
22	L	28.9	Very low	35	Very low	160 Å²	160	108.9 Å²	108.9	84%	0.838	63%	0.627	S	S	*	*			trans	-104.4	135.9	170.9	-74.8	164.2	0	0	0	109.7
23	G	30.4	Very low	34.5	Very low	67 Å²	67	108.6 Å²	108.6	69%	0.691	64%	0.639	S	S	*	*			trans	-121.5	158.8	160.4	0	0	0	0	0	110.2
24	P	32.1	Very low	34.5	Very low	123 Å²	123	116 Å²	116	80%	0.799	68%	0.675	S	S	*	*			trans	-77.9	159.8	-163.9	31.9	-34.9	0	0	0	114.1
25	P	31.1	Very low	33.7	Very low	126 Å²	126	117.4 Å²	117.4	82%	0.818	69%	0.693	S	S	*	*			trans	-80.8	146.2	-172.5	33	-32.7	0	0	0	112.6
26	Q	29.1	Very low	33.3	Very low	179 Å²	179	121.4 Å²	121.4	84%	0.836	72%	0.717	S	S	*	*			trans	-119.9	153.9	170.4	-82	-76.7	-32.2	0	0	110.5
27	P	32.8	Very low	33.5	Very low	108 Å²	108	120.2 Å²	120.2	70%	0.701	72%	0.724	S	S	*	*			trans	-87.2	172.4	-164.4	35	-31.6	0	0	0	114.7
28	S	37.9	Very low	34.1	Very low	117 Å²	117	124.8 Å²	124.8	82%	0.818	74%	0.737	S	S	*	*			trans	-43	145.2	-168	49.6	0	0	0	0	119.2
29	L	29.3	Very low	35	Very low	167 Å²	167	130.2 Å²	130.2	87%	0.874	76%	0.757	S	S	*	*			trans	-134.8	163.6	171.9	-87.4	171.3	0	0	0	111.5
30	P	33.3	Very low	37.1	Very low	104 Å²	104	129 Å²	129	68%	0.675	75%	0.751	S	S	*	*			trans	-97.8	-168.5	-139.5	45.8	-41.7	0	0	0	112.8
31	P	32.9	Very low	39.5	Very low	126 Å²	126	125.2 Å²	125.2	82%	0.818	73%	0.729	S	S	*	*			trans	-70.5	143.5	-161.9	30.4	-30.4	0	0	0	112.2	S33	P31-S33 PolarHBondContact O-N 2.73Å; P31-S33 VanDerWaalsContact O-N 3.12Å
32	A	34.2	Very low	42	Very low	101 Å²	101	118.9 Å²	118.9	84%	0.835	71%	0.713	S	S	*	*			trans	-55.9	109.9	-171.5	0	0	0	0	0	112.7
33	S	31.3	Very low	44.6	Very low	104 Å²	104	113.5 Å²	113.5	73%	0.727	69%	0.689	S	S	*	*			trans	-82.2	146.1	153.9	65.6	0	0	0	0	108.6	P31 G35	P31-S33 PolarHBondContact O-N 2.73Å; P31-S33 VanDerWaalsContact O-N 3.12Å; S33-G35 PolarHBondContact O-N 3.01Å
34	N	42.3	Very low	47.5	Very low	177 Å²	177	111.4 Å²	111.4	95%	0.947	66%	0.663	S	S	*	*			trans	-64.4	85.3	165.2	-76.6	-26.5	0	0	0	108
35	G	31.6	Very low	50.2	Low	41 Å²	41	107 Å²	107	42%	0.423	63%	0.632	S	S	.	*			trans	-65.6	163.7	173	0	0	0	0	0	111.9	S33 N37	S33-G35 PolarHBondContact O-N 3.01Å; G35-N37 PolarHBondContact O-N 3.33Å
36	P	32.6	Very low	53	Low	129 Å²	129	104.1 Å²	104.1	84%	0.838	61%	0.605	S	S	*	*			trans	-62.2	131.9	-168.2	25.8	-31.8	0	0	0	111	K38	P36-K38 PolarHBondContact O-N 2.89Å
37	N	40.7	Very low	55.8	Low	145 Å²	145	98.8 Å²	98.8	78%	0.775	59%	0.585	S	S	*	*			trans	-49.4	99	175.1	-86.6	-40.7	0	0	0	110.5	G35 D39	G35-N37 PolarHBondContact O-N 3.33Å; N37-D39 PolarHBondContact O-N 3.3Å; N37-D39 VanDerWaalsContact O-N 3.15Å
38	K	50.3	Low	58.3	Low	147 Å²	147	98.2 Å²	98.2	64%	0.639	57%	0.573	S	S	*	*			trans	-65.3	110.4	157.6	-153	-178.1	-174.8	-172.8	0	104.8	P36 L40 E103	P36-K38 PolarHBondContact O-N 2.89Å; K38-L40 PolarHBondContact O-N 3.15Å; K38-E103 IonicContact NZ-OE1 3.61Å; K38-E103 IonicContact NZ-OE2 3.89Å; K38-E103 PolarHBondContact NZ-OE2 3.17Å
39	D	59.3	Low	60.6	Low	153 Å²	153	98.2 Å²	98.2	82%	0.818	56%	0.563	S	S	*	*			trans	-49.3	112.5	-175.2	-73	-39	0	0	0	110.4	N37 R41	N37-D39 PolarHBondContact O-N 3.3Å; N37-D39 VanDerWaalsContact O-N 3.15Å; D39-R41 PolarHBondContact O-N 3.48Å
40	L	77.9	Confident	63.5	Low	52 Å²	52	90.3 Å²	90.3	27%	0.272	52%	0.522	S	S	.	.			trans	-68.9	121.1	-176.9	-69.2	174.1	0	0	0	108.5	K38 T42 R85 T96 I99	K38-L40 PolarHBondContact O-N 3.15Å; L40-T42 PolarHBondContact O-N 3.49Å; L40-T42 VanDerWaalsContact O-N 3.14Å; L40-R85 HydrophobicContact CD1-CG 4.48Å; L40-T96 HydrophobicContact CD1-CG2 4.11Å; L40-I99 HydrophobicContact CD1-CD1 3.93Å; L40-I99 HydrophobicContact CD2-CD1 3.54Å; L40-I99 HydrophobicContact CD2-CG2 4.24Å; L40-I99 HydrophobicContact CG-CD1 4.41Å
41	R	81.2	Confident	66	Low	88 Å²	88	86.5 Å²	86.5	33%	0.332	50%	0.502	S	S	.	.			trans	-65.8	114.9	-179.7	-66	-179	178.5	-140.8	-17.8	110.2	D39 D45 D54 L56 W57	D39-R41 PolarHBondContact O-N 3.48Å; R41-D45 IonicContact CZ-OD2 3.31Å; R41-D45 IonicContact NH1-OD2 2.77Å; R41-D45 PolarHBondContact NH1-OD2 3.41Å; R41-D45 IonicContact NH2-OD2 3.32Å; R41-D45 PolarHBondContact NH2-OD2 2.76Å; R41-D54 IonicContact CZ-OD2 3.43Å; R41-D54 IonicContact NE-OD2 2.63Å; R41-D54 IonicContact NH1-OD2 3.62Å; R41-D54 PolarHBondContact NH1-OD2 2.77Å; R41-L56 CarbonylContact O-C 3.56Å; R41-L56 WeakPolarHBondContact O-CA 3.47Å; R41-W57 PolarHBondContact O-N 2.81Å
42	T	82.3	Confident	68.5	Low	82 Å²	82	82.6 Å²	82.6	50%	0.503	47%	0.474	S	S	.	.			trans	-98.8	-25.6	173.7	57.6	0	0	0	0	111.7	L40 W57	L40-T42 PolarHBondContact O-N 3.49Å; L40-T42 VanDerWaalsContact O-N 3.14Å; T42-W57 WeakPolarHBondContact CG2-O 3.11Å
43	C	84.8	Confident	71.1	Confident	48 Å²	48	78.1 Å²	78.1	32%	0.324	44%	0.438	S	S	.	.	S	Bend	trans	-118.8	165.1	-178.8	67.3	0	0	0	0	112.7	L56	C43-L56 VanDerWaalsContact O-CD2 3.3Å; C43-L56 WeakPolarHBondContact O-CD2 3.37Å
44	V	89.9	Confident	73.9	Confident	23 Å²	23	76 Å²	76	14%	0.139	42%	0.419	C	S	.	.			trans	-76.6	124.8	-179.7	175.4	0	0	0	0	110.4	L56 P279 R280	V44-L56 HydrophobicContact CG2-CD1 3.75Å; V44-L56 HydrophobicContact CG2-CD2 4.32Å; V44-P279 HydrophobicContact CG2-CB 3.79Å; V44-R280 HydrophobicContact CG1-CG 3.61Å
45	D	89.1	Confident	76.3	Confident	29 Å²	29	68.6 Å²	68.6	16%	0.155	38%	0.378	C	S	.	.			trans	-80.1	119.2	177.4	-175	1.6	0	0	0	111.5	R41 T47 A50 R280	R41-D45 IonicContact CZ-OD2 3.31Å; R41-D45 IonicContact NH1-OD2 2.77Å; R41-D45 PolarHBondContact NH1-OD2 3.41Å; R41-D45 IonicContact NH2-OD2 3.32Å; R41-D45 PolarHBondContact NH2-OD2 2.76Å; D45-T47 WeakPolarHBondContact OD1-CA 3.4Å; D45-T47 VanDerWaalsContact OD1-CB 3.25Å; D45-T47 WeakPolarHBondContact OD1-CB 3.25Å; D45-T47 WeakPolarHBondContact OD1-CG2 3.36Å; D45-T47 PolarHBondContact OD1-N 2.98Å; D45-T47 PolarHBondContact OD1-OG1 2.75Å; D45-T47 PolarHBondContact OD2-OG1 2.92Å; D45-A50 HydrophobicContact CB-CB 4.12Å; D45-A50 WeakPolarHBondContact O-CB 3.31Å; D45-A50 VanDerWaalsContact OD2-CA 3.24Å; D45-A50 WeakPolarHBondContact OD2-CA 3.2Å; D45-A50 PolarHBondContact OD2-N 3.36Å; D45-A50 VanDerWaalsContact OD2-N 3.17Å; D45-R280 VanDerWaalsContact O-CZ 3.29Å; D45-R280 PolarHBondContact O-NH1 2.79Å; D45-R280 PolarHBondContact O-NH2 3.37Å
46	W	89.6	Confident	79.3	Confident	66 Å²	66	67.2 Å²	67.2	25%	0.25	36%	0.361	C	S	.	.			trans	-103.5	8.7	175.8	-71.2	102.8	0	0	0	113.5	I200 F240 R280 F283 L296 Y297	W46-I200 HydrophobicContact CZ3-CG2 4.4Å; W46-F240 HydrophobicContact CE3-CB 4.16Å; W46-F240 HydrophobicContact CE3-CD1 4.42Å; W46-F240 AromaticContact CE3-CD2 3.74Å; W46-F240 HydrophobicContact CE3-CD2 3.74Å; W46-F240 HydrophobicContact CE3-CE2 4.25Å; W46-F240 AromaticContact CE3-CG 3.84Å; W46-F240 HydrophobicContact CE3-CG 3.84Å; W46-F240 HydrophobicContact CZ3-CB 4.17Å; W46-F240 HydrophobicContact CZ3-CD1 4.35Å; W46-F240 HydrophobicContact CZ3-CD2 4.42Å; W46-F240 HydrophobicContact CZ3-CG 4.06Å; W46-F240 VanDerWaalsContact O-CD2 3.32Å; W46-F240 WeakPolarHBondContact O-CD2 3.12Å; W46-F240 WeakPolarHBondContact O-CE2 3.21Å; W46-R280 VanDerWaalsContact CE3-NH1 3.29Å; W46-R280 HydrophobicContact CH2-CB 3.57Å; W46-R280 HydrophobicContact CH2-CG 3.73Å; W46-R280 HydrophobicContact CZ2-CB 3.61Å; W46-R280 HydrophobicContact CZ2-CG 3.72Å; W46-R280 VanDerWaalsContact CZ2-O 3.26Å; W46-R280 WeakPolarHBondContact CZ2-O 3.32Å; W46-R280 HydrophobicContact CZ3-CG 4.34Å; W46-F283 HydrophobicContact CZ2-CE1 4.13Å; W46-F283 AromaticContact CZ2-CZ 3.66Å; W46-F283 HydrophobicContact CZ2-CZ 3.66Å; W46-F283 AromaticContact NE1-CE1 3.86Å; W46-L296 HydrophobicContact CE3-CD2 3.93Å; W46-L296 HydrophobicContact CH2-CD2 3.56Å; W46-L296 HydrophobicContact CZ2-CD2 4.34Å; W46-L296 HydrophobicContact CZ3-CD2 3.35Å; W46-Y297 HydrophobicContact CH2-CE2 4.4Å
47	T	88.8	Confident	82.2	Confident	67 Å²	67	61.6 Å²	61.6	41%	0.411	32%	0.323	S	S	.	.	S	Bend	trans	-88	176.3	179.5	75.1	0	0	0	0	112.2	D45 N49 A50	D45-T47 WeakPolarHBondContact OD1-CA 3.4Å; D45-T47 VanDerWaalsContact OD1-CB 3.25Å; D45-T47 WeakPolarHBondContact OD1-CB 3.25Å; D45-T47 WeakPolarHBondContact OD1-CG2 3.36Å; D45-T47 PolarHBondContact OD1-N 2.98Å; D45-T47 PolarHBondContact OD1-OG1 2.75Å; D45-T47 PolarHBondContact OD2-OG1 2.92Å; T47-N49 PolarHBondContact O-N 2.79Å; T47-N49 PolarHBondContact OG1-N 2.97Å; T47-A50 VanDerWaalsContact O-CB 3.32Å; T47-A50 WeakPolarHBondContact O-CB 3.46Å; T47-A50 PolarHBondContact O-N 3.36Å
48	E	85	Confident	84.5	Confident	96 Å²	96	55.6 Å²	55.6	45%	0.449	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.5	173.6	68.2	-171.8	166.2	0	0	113.8	A50 K202 W237	E48-A50 VanDerWaalsContact C-N 3.31Å; E48-K202 WeakPolarHBondContact O-CE 3.34Å; E48-K202 PolarHBondContact O-NZ 2.88Å; E48-W237 HydrophobicContact CB-CH2 3.94Å; E48-W237 WeakPolarHBondContact OE2-CH2 3.4Å
49	N	87.3	Confident	86.2	Confident	117 Å²	117	55.5 Å²	55.5	63%	0.626	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-1.5	178.6	-62.4	-34.4	0	0	0	113.4	T47 G51	T47-N49 PolarHBondContact O-N 2.79Å; T47-N49 PolarHBondContact OG1-N 2.97Å; N49-G51 PolarHBondContact O-N 3.49Å
50	A	88.5	Confident	87.2	Confident	1 Å²	1	50 Å²	50	1%	0.008	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-59.3	123.5	-178.7	0	0	0	0	0	112	D45 T47 E48 F113 K202 F240	D45-A50 HydrophobicContact CB-CB 4.12Å; D45-A50 WeakPolarHBondContact O-CB 3.31Å; D45-A50 VanDerWaalsContact OD2-CA 3.24Å; D45-A50 WeakPolarHBondContact OD2-CA 3.2Å; D45-A50 PolarHBondContact OD2-N 3.36Å; D45-A50 VanDerWaalsContact OD2-N 3.17Å; T47-A50 VanDerWaalsContact O-CB 3.32Å; T47-A50 WeakPolarHBondContact O-CB 3.46Å; T47-A50 PolarHBondContact O-N 3.36Å; E48-A50 VanDerWaalsContact C-N 3.31Å; A50-F113 HydrophobicContact CB-CE1 4.41Å; A50-F113 HydrophobicContact CB-CZ 4.39Å; A50-F113 WeakPolarHBondContact O-CZ 3.35Å; A50-K202 PolarHBondContact O-NZ 3.22Å; A50-F240 HydrophobicContact CB-CE2 4.05Å; A50-F240 HydrophobicContact CB-CZ 3.65Å
51	G	86	Confident	86.9	Confident	24 Å²	24	50.8 Å²	50.8	25%	0.247	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-94.4	145.2	175.8	0	0	0	0	0	111.8	N49 D54 F113	N49-G51 PolarHBondContact O-N 3.49Å; G51-D54 WeakPolarHBondContact CA-OD2 3.45Å; G51-D54 PolarHBondContact N-OD2 3.33Å; G51-F113 WeakPolarHBondContact O-CE1 3.27Å
52	N	86.8	Confident	86	Confident	44 Å²	44	49.3 Å²	49.3	24%	0.235	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	131.3	170.5	-148.6	11.1	0	0	0	110.2	R108 P111 T112 F113	N52-R108 PolarHBondContact O-NH1 2.74Å; N52-P111 VanDerWaalsContact ND2-CB 3.31Å; N52-P111 WeakPolarHBondContact ND2-CB 3.48Å; N52-P111 WeakPolarHBondContact OD1-CA 3.44Å; N52-P111 VanDerWaalsContact OD1-CB 3.25Å; N52-P111 WeakPolarHBondContact OD1-CB 3.21Å; N52-T112 PolarHBondContact OD1-N 3.34Å; N52-F113 HydrophobicContact CB-CE1 4.19Å; N52-F113 HydrophobicContact CB-CE2 4.37Å; N52-F113 HydrophobicContact CB-CZ 3.94Å; N52-F113 PolarHBondContact ND2-O 3.39Å
53	G	87.9	Confident	84.7	Confident	7 Å²	7	49.5 Å²	49.5	7%	0.072	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	18	-176.9	0	0	0	0	0	115.1	C109	G53-C109 VanDerWaalsContact CA-O 3.29Å; G53-C109 WeakPolarHBondContact CA-O 3.33Å; G53-C109 WeakPolarHBondContact O-CB 3.41Å; G53-C109 PolarHBondContact O-N 2.99Å
54	D	90.9	Very high	83.7	Confident	61 Å²	61	48.9 Å²	48.9	33%	0.326	28%	0.284	S	S	.	.			trans	-65.7	140.3	171.1	-65.7	-13.8	0	0	0	111	R41 G51 C109	R41-D54 IonicContact CZ-OD2 3.43Å; R41-D54 IonicContact NE-OD2 2.63Å; R41-D54 IonicContact NH1-OD2 3.62Å; R41-D54 PolarHBondContact NH1-OD2 2.77Å; G51-D54 WeakPolarHBondContact CA-OD2 3.45Å; G51-D54 PolarHBondContact N-OD2 3.33Å; D54-C109 VanDerWaalsContact O-CB 3.25Å; D54-C109 WeakPolarHBondContact O-CB 3.3Å
55	H	93	Very high	82.8	Confident	20 Å²	20	50.6 Å²	50.6	9%	0.093	29%	0.291	C	S	.	.			trans	-86.8	140.4	173.4	-67.1	-82.9	0	0	0	110.4	W57 C87 I92 F107 C109	H55-W57 HydrophobicContact CB-CD2 4.07Å; H55-W57 VanDerWaalsContact CB-CE2 3.4Å; H55-W57 HydrophobicContact CB-CH2 4.08Å; H55-W57 HydrophobicContact CB-CZ2 3.42Å; H55-W57 VanDerWaalsContact CB-CZ2 3.42Å; H55-W57 AromaticContact CD2-CZ2 3.99Å; H55-W57 AromaticContact CG-CZ2 3.66Å; H55-C87 HydrophobicContact CB-CB 4.41Å; H55-C87 PolarHBondContact ND1-SG 3.26Å; H55-I92 VanDerWaalsContact CE1-CD1 3.47Å; H55-I92 WeakPolarHBondContact CE1-CD1 3.47Å; H55-F107 AromaticContact CE1-CD1 3.99Å; H55-F107 PolarHBondContact NE2-O 3.16Å; H55-C109 PolarHBondContact CE1-N 2.84Å; H55-C109 WeakPolarHBondContact ND1-CB 3.25Å; H55-C109 PolarHBondContact NE2-N 3.04Å
56	L	93.2	Very high	82.3	Confident	12 Å²	12	52.5 Å²	52.5	6%	0.063	30%	0.301	C	S	.	.			trans	-102.3	99	176.5	-60.2	177.1	0	0	0	108.6	R41 C43 V44 C87 A88 M274 P279	R41-L56 CarbonylContact O-C 3.56Å; R41-L56 WeakPolarHBondContact O-CA 3.47Å; C43-L56 VanDerWaalsContact O-CD2 3.3Å; C43-L56 WeakPolarHBondContact O-CD2 3.37Å; V44-L56 HydrophobicContact CG2-CD1 3.75Å; V44-L56 HydrophobicContact CG2-CD2 4.32Å; L56-C87 CarbonylContact O-C 3.58Å; L56-C87 VanDerWaalsContact O-CA 3.25Å; L56-C87 WeakPolarHBondContact O-CA 3.38Å; L56-A88 HydrophobicContact CB-CB 4.25Å; L56-A88 PolarHBondContact O-N 3.13Å; L56-M274 HydrophobicContact CD1-SD 4Å; L56-P279 HydrophobicContact CD1-CB 3.74Å; L56-P279 HydrophobicContact CD1-CG 4.21Å
57	W	92.9	Very high	82.2	Confident	12 Å²	12	49.9 Å²	49.9	5%	0.045	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	133.6	-168.5	-64	114.7	0	0	0	112.5	R41 T42 H55 R85 C87 I92 V94 I99 L102	R41-W57 PolarHBondContact O-N 2.81Å; T42-W57 WeakPolarHBondContact CG2-O 3.11Å; H55-W57 HydrophobicContact CB-CD2 4.07Å; H55-W57 VanDerWaalsContact CB-CE2 3.4Å; H55-W57 HydrophobicContact CB-CH2 4.08Å; H55-W57 HydrophobicContact CB-CZ2 3.42Å; H55-W57 VanDerWaalsContact CB-CZ2 3.42Å; H55-W57 AromaticContact CD2-CZ2 3.99Å; H55-W57 AromaticContact CG-CZ2 3.66Å; W57-R85 HydrophobicContact CB-CB 4.25Å; W57-R85 HydrophobicContact CD2-CB 4.18Å; W57-R85 HydrophobicContact CE3-CB 3.68Å; W57-R85 HydrophobicContact CG-CB 4.45Å; W57-R85 HydrophobicContact CZ3-CB 4.38Å; W57-C87 HydrophobicContact CE3-CB 4.19Å; W57-C87 HydrophobicContact CZ3-CB 3.97Å; W57-I92 HydrophobicContact CH2-CD1 3.83Å; W57-I92 HydrophobicContact CH2-CG1 4.1Å; W57-I92 HydrophobicContact CZ3-CD1 4.42Å; W57-I92 HydrophobicContact CZ3-CG1 4.19Å; W57-V94 HydrophobicContact CH2-CB 4.18Å; W57-V94 HydrophobicContact CH2-CG2 3.86Å; W57-V94 HydrophobicContact CZ3-CB 4.36Å; W57-V94 HydrophobicContact CZ3-CG2 4.23Å; W57-I99 HydrophobicContact CD2-CD1 4.21Å; W57-I99 HydrophobicContact CG-CD1 4.39Å; W57-I99 HydrophobicContact CZ2-CD1 4.45Å; W57-I99 HydrophobicContact CZ2-CG1 4.2Å; W57-I99 HydrophobicContact CZ2-CG2 4.28Å; W57-L102 HydrophobicContact CH2-CD2 3.89Å; W57-L102 HydrophobicContact CZ2-CD2 3.92Å
58	T	89.3	Confident	82.1	Confident	18 Å²	18	48.6 Å²	48.6	11%	0.11	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	149	175.8	72.6	0	0	0	0	108.8	R85 K86 A88 H271	T58-R85 CarbonylContact O-C 3.57Å; T58-R85 VanDerWaalsContact O-CA 3.26Å; T58-R85 WeakPolarHBondContact O-CA 3.35Å; T58-K86 PolarHBondContact N-O 2.77Å; T58-K86 PolarHBondContact O-N 3.08Å; T58-K86 PolarHBondContact OG1-O 2.74Å; T58-A88 HydrophobicContact CG2-CB 4.25Å; T58-H271 WeakPolarHBondContact CG2-CE1 3.26Å; T58-H271 VanDerWaalsContact CG2-NE2 3.28Å; T58-H271 WeakPolarHBondContact CG2-NE2 3.39Å
59	E	85.8	Confident	82	Confident	145 Å²	145	45 Å²	45	68%	0.678	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.8	146.9	173.7	-63.5	-172.8	173.6	0	0	110.3	R85	E59-R85 VanDerWaalsContact CG-CZ 3.45Å; E59-R85 IonicContact OE1-CZ 3.78Å; E59-R85 VanDerWaalsContact OE1-CZ 3.31Å; E59-R85 IonicContact OE1-NH1 3.43Å; E59-R85 PolarHBondContact OE1-NH1 3.1Å; E59-R85 IonicContact OE1-NH2 3.58Å; E59-R85 PolarHBondContact OE1-NH2 2.91Å
60	T	82.1	Confident	81.5	Confident	38 Å²	38	40.3 Å²	40.3	23%	0.233	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	157	178.1	-162.2	0	0	0	0	110	R84 K86 V93	T60-R84 HydrophobicContact CG2-CB 3.84Å; T60-R84 PolarHBondContact N-O 2.98Å; T60-K86 HydrophobicContact CG2-CB 4.1Å; T60-V93 HydrophobicContact CG2-CG1 4.16Å
61	S	71.8	Confident	80.6	Confident	69 Å²	69	45.3 Å²	45.3	48%	0.483	27%	0.266	S	S	.	.			trans	-64.1	151.6	-176.2	56.7	0	0	0	0	112	S63	S61-S63 PolarHBondContact O-N 3.04Å
62	C	61	Low	79.8	Confident	56 Å²	56	51.9 Å²	51.9	38%	0.378	30%	0.295	S	S	.	.	S	Bend	trans	-77.6	2.1	178.1	-62.1	0	0	0	0	113.4	S81 R84	C62-S81 PolarHBondContact SG-O 3.39Å; C62-S81 VanDerWaalsContact SG-O 3.4Å; C62-R84 PolarHBondContact O-NH1 2.9Å
63	S	55.9	Low	79.4	Confident	87 Å²	87	51.4 Å²	51.4	61%	0.608	30%	0.297	S	S	*	.	S	Bend	trans	-109.9	133.8	-175.7	53.2	0	0	0	0	112	S61 E65	S61-S63 PolarHBondContact O-N 3.04Å; S63-E65 PolarHBondContact O-N 3.29Å
64	G	62.2	Low	79.1	Confident	35 Å²	35	51.5 Å²	51.5	36%	0.361	30%	0.297	S	S	.	.	S	Bend	trans	87.8	-24.2	167.5	0	0	0	0	0	118.2	R135	G64-R135 PolarHBondContact O-NH2 3.05Å
65	E	71	Confident	78.6	Confident	59 Å²	59	53.8 Å²	53.8	28%	0.276	31%	0.308	S	S	.	.			trans	-107.3	129.2	-179.1	-61.7	-166.5	146.5	0	0	113.2	S63 R84 K86 V93	S63-E65 PolarHBondContact O-N 3.29Å; E65-R84 PolarHBondContact O-NE 3.47Å; E65-K86 IonicContact OE1-NZ 3.36Å; E65-K86 PolarHBondContact OE1-NZ 3.05Å; E65-K86 IonicContact OE2-NZ 2.95Å; E65-K86 PolarHBondContact OE2-NZ 3.04Å; E65-V93 HydrophobicContact CB-CB 4.44Å; E65-V93 HydrophobicContact CB-CG1 4.1Å; E65-V93 HydrophobicContact CB-CG2 4.14Å; E65-V93 WeakPolarHBondContact OE2-CG2 3.33Å
66	L	80.5	Confident	77.9	Confident	69 Å²	69	55.5 Å²	55.5	36%	0.361	32%	0.318	S	S	.	.			trans	-92.8	142.8	-178.1	-68	172.6	0	0	0	112	Y68 R134 K155	L66-Y68 PolarHBondContact O-N 3.49Å; L66-R134 PolarHBondContact O-NH1 3.07Å; L66-K155 HydrophobicContact CD1-CB 4.47Å; L66-K155 HydrophobicContact CD1-CG 4.19Å
67	C	86.6	Confident	76.9	Confident	10 Å²	10	61.8 Å²	61.8	7%	0.068	35%	0.345	C	S	.	.			trans	-57.6	133.3	175.1	-175.1	0	0	0	0	111.8	L69 G70 V93 H95 R134	C67-L69 VanDerWaalsContact C-N 3.29Å; C67-L69 PolarHBondContact O-N 3.04Å; C67-G70 PolarHBondContact O-N 3.19Å; C67-V93 CarbonylContact C-O 3.59Å; C67-V93 WeakPolarHBondContact CA-O 3.41Å; C67-H95 WeakPolarHBondContact CB-ND1 3.47Å; C67-R134 PolarHBondContact O-NH1 2.94Å; C67-R134 PolarHBondContact O-NH2 3.42Å
68	Y	87.1	Confident	75.6	Confident	40 Å²	40	67.4 Å²	67.4	16%	0.157	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-37.5	-174.2	-179.6	-106.2	0	0	0	112.7	L66 G70 I92 V93 L102 F107 V131 H132	L66-Y68 PolarHBondContact O-N 3.49Å; Y68-G70 PolarHBondContact O-N 2.89Å; Y68-I92 HydrophobicContact CD2-CB 4.25Å; Y68-I92 HydrophobicContact CD2-CG2 3.86Å; Y68-I92 HydrophobicContact CE2-CG2 4.07Å; Y68-I92 HydrophobicContact CG-CB 4.23Å; Y68-I92 HydrophobicContact CG-CG2 4.19Å; Y68-V93 WeakPolarHBondContact CB-O 3.13Å; Y68-V93 PolarHBondContact N-O 3.29Å; Y68-L102 HydrophobicContact CD1-CD1 3.82Å; Y68-L102 HydrophobicContact CE1-CD1 4.33Å; Y68-F107 HydrophobicContact CD1-CD1 4.46Å; Y68-F107 AromaticContact CE1-CD1 3.91Å; Y68-F107 HydrophobicContact CE1-CD1 3.91Å; Y68-F107 AromaticContact CE1-CD2 3.95Å; Y68-F107 HydrophobicContact CE1-CD2 3.95Å; Y68-F107 HydrophobicContact CE1-CE1 4.02Å; Y68-F107 HydrophobicContact CE1-CE2 4.06Å; Y68-F107 AromaticContact CE1-CG 3.87Å; Y68-F107 HydrophobicContact CE1-CG 3.87Å; Y68-F107 HydrophobicContact CE1-CZ 4.09Å; Y68-F107 AromaticContact CZ-CE2 3.85Å; Y68-F107 AromaticContact CZ-CZ 3.83Å; Y68-F107 WeakPolarHBondContact OH-CE2 3.15Å; Y68-F107 WeakPolarHBondContact OH-CZ 3.44Å; Y68-V131 HydrophobicContact CE2-CG1 4.15Å; Y68-H132 HydrophobicContact CE2-CB 4.15Å
69	L	82.9	Confident	74.7	Confident	22 Å²	22	68.2 Å²	68.2	12%	0.115	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-19.5	-179	-62	179.3	0	0	0	113.7	C67 A73 C98 Q101 L102 I105	C67-L69 VanDerWaalsContact C-N 3.29Å; C67-L69 PolarHBondContact O-N 3.04Å; L69-A73 HydrophobicContact CB-CB 4.02Å; L69-A73 WeakPolarHBondContact CD1-O 3.3Å; L69-C98 HydrophobicContact CD1-CB 3.69Å; L69-Q101 HydrophobicContact CD1-CB 3.68Å; L69-Q101 HydrophobicContact CD1-CG 3.75Å; L69-L102 HydrophobicContact CD2-CD1 3.94Å; L69-I105 HydrophobicContact CD2-CD1 3.53Å; L69-I105 HydrophobicContact CD2-CG1 4.33Å
70	G	76.1	Confident	73.7	Confident	17 Å²	17	69.7 Å²	69.7	18%	0.175	39%	0.393	C	S	.	.	H	α-helix	trans	73.8	-178.9	-175.9	0	0	0	0	0	112.6	C67 Y68 D72 C74 R134	C67-G70 PolarHBondContact O-N 3.19Å; Y68-G70 PolarHBondContact O-N 2.89Å; G70-D72 VanDerWaalsContact C-N 3.35Å; G70-D72 PolarHBondContact O-N 3.25Å; G70-C74 WeakPolarHBondContact O-CB 3.47Å; G70-C74 PolarHBondContact O-N 3.49Å; G70-C74 VanDerWaalsContact O-N 3.08Å; G70-R134 VanDerWaalsContact CA-NH2 3.32Å
71	E	70.4	Confident	73.3	Confident	106 Å²	106	72.6 Å²	72.6	50%	0.495	42%	0.415	S	S	.	.	H	α-helix	trans	-70.1	-30.6	-169	-59.1	-168	142.8	0	0	113.5	K77 K155	E71-K77 VanDerWaalsContact O-CD 3.27Å; E71-K77 WeakPolarHBondContact O-CD 3.49Å; E71-K155 VanDerWaalsContact OE1-CD 3.23Å; E71-K155 WeakPolarHBondContact OE1-CD 3.33Å; E71-K155 WeakPolarHBondContact OE1-CE 3.2Å; E71-K155 IonicContact OE1-NZ 3.77Å; E71-K155 PolarHBondContact OE1-NZ 3.44Å; E71-K155 IonicContact OE2-NZ 3.61Å
72	D	69.3	Low	73.7	Confident	163 Å²	163	69.9 Å²	69.9	87%	0.872	40%	0.397	S	S	*	.	H	α-helix	trans	-77.4	-33	-174.9	-55.9	-38.8	0	0	0	113	G70	G70-D72 VanDerWaalsContact C-N 3.35Å; G70-D72 PolarHBondContact O-N 3.25Å
73	A	77.2	Confident	74.9	Confident	33 Å²	33	71.1 Å²	71.1	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-109.3	-2.8	-176.2	0	0	0	0	0	113.6	L69	L69-A73 HydrophobicContact CB-CB 4.02Å; L69-A73 WeakPolarHBondContact CD1-O 3.3Å
74	C	82.1	Confident	76.4	Confident	9 Å²	9	68 Å²	68	6%	0.061	38%	0.379	C	S	.	.			trans	-82.9	117.7	175.7	179.8	0	0	0	0	111	G70 L76 K77 H95	G70-C74 WeakPolarHBondContact O-CB 3.47Å; G70-C74 PolarHBondContact O-N 3.49Å; G70-C74 VanDerWaalsContact O-N 3.08Å; C74-L76 PolarHBondContact O-N 3.13Å; C74-L76 PolarHBondContact SG-N 2.97Å; C74-K77 HydrophobicContact CB-CB 4.31Å; C74-H95 VanDerWaalsContact SG-CE1 3.58Å; C74-H95 PolarHBondContact SG-ND1 3.39Å
75	L	80.5	Confident	77.7	Confident	109 Å²	109	68.5 Å²	68.5	57%	0.571	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.5	177.5	-59.8	176.7	0	0	0	112.9	C98	L75-C98 PolarHBondContact N-SG 3.21Å; L75-C98 VanDerWaalsContact N-SG 3.41Å
76	L	79	Confident	78.8	Confident	57 Å²	57	68 Å²	68	30%	0.298	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	31.4	-173.2	-64.5	170.7	0	0	0	112.3	C74 T78 A79 A82 H95	C74-L76 PolarHBondContact O-N 3.13Å; C74-L76 PolarHBondContact SG-N 2.97Å; L76-T78 VanDerWaalsContact C-N 3.26Å; L76-T78 PolarHBondContact O-N 2.73Å; L76-A79 HydrophobicContact CB-CB 4.43Å; L76-A79 PolarHBondContact O-N 3.27Å; L76-A79 VanDerWaalsContact O-N 3.13Å; L76-A82 HydrophobicContact CB-CB 4.36Å; L76-A82 HydrophobicContact CD1-CB 4.1Å; L76-H95 HydrophobicContact CB-CB 4.49Å; L76-H95 HydrophobicContact CD1-CB 3.87Å
77	K	70.6	Confident	79.4	Confident	143 Å²	143	64.7 Å²	64.7	62%	0.622	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.1	-173.8	63.5	-171.3	179.6	-177.5	0	115	E71 C74	E71-K77 VanDerWaalsContact O-CD 3.27Å; E71-K77 WeakPolarHBondContact O-CD 3.49Å; C74-K77 HydrophobicContact CB-CB 4.31Å
78	T	66.1	Low	79.8	Confident	131 Å²	131	64.3 Å²	64.3	80%	0.804	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-17.5	178.6	47.3	0	0	0	0	113.5	L76 K80	L76-T78 VanDerWaalsContact C-N 3.26Å; L76-T78 PolarHBondContact O-N 2.73Å; T78-K80 PolarHBondContact O-N 2.84Å
79	A	70.1	Confident	80.1	Confident	34 Å²	34	62.5 Å²	62.5	28%	0.281	34%	0.341	S	S	.	.			trans	-89.6	83.5	-177.4	0	0	0	0	0	111	L76 S81 A82	L76-A79 HydrophobicContact CB-CB 4.43Å; L76-A79 PolarHBondContact O-N 3.27Å; L76-A79 VanDerWaalsContact O-N 3.13Å; A79-S81 PolarHBondContact O-N 2.79Å; A79-A82 HydrophobicContact CB-CB 3.89Å; A79-A82 WeakPolarHBondContact O-CB 3.34Å; A79-A82 PolarHBondContact O-N 3.27Å; A79-A82 VanDerWaalsContact O-N 3.15Å
80	K	66	Low	80.6	Confident	176 Å²	176	61.5 Å²	61.5	77%	0.765	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-32.6	-177.4	-72.2	-177	-179.7	175.9	0	113.5	T78 R84	T78-K80 PolarHBondContact O-N 2.84Å; K80-R84 PolarHBondContact O-NH2 2.99Å; K80-R84 VanDerWaalsContact O-NH2 3.1Å
81	S	72.2	Confident	81.4	Confident	100 Å²	100	63 Å²	63	70%	0.699	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-3.2	-179.4	53.4	0	0	0	0	114.8	C62 A79	C62-S81 PolarHBondContact SG-O 3.39Å; C62-S81 VanDerWaalsContact SG-O 3.4Å; A79-S81 PolarHBondContact O-N 2.79Å
82	A	80.8	Confident	82.4	Confident	11 Å²	11	58.1 Å²	58.1	9%	0.091	31%	0.314	C	S	.	.	S	Bend	trans	-61.2	140.4	-177.5	0	0	0	0	0	111.7	L76 A79 R84	L76-A82 HydrophobicContact CB-CB 4.36Å; L76-A82 HydrophobicContact CD1-CB 4.1Å; A79-A82 HydrophobicContact CB-CB 3.89Å; A79-A82 WeakPolarHBondContact O-CB 3.34Å; A79-A82 PolarHBondContact O-N 3.27Å; A79-A82 VanDerWaalsContact O-N 3.15Å; A82-R84 PolarHBondContact O-N 2.87Å
83	P	85.6	Confident	83.4	Confident	83 Å²	83	50.9 Å²	50.9	54%	0.539	28%	0.276	S	S	.	.			trans	-61.7	137.3	-175.3	25	-34.2	0	0	0	111.3	H95 T96	P83-H95 WeakPolarHBondContact O-CA 3.39Å; P83-T96 PolarHBondContact O-N 3.37Å; P83-T96 PolarHBondContact O-OG1 3.4Å
84	R	87.8	Confident	84.1	Confident	22 Å²	22	49.3 Å²	49.3	8%	0.083	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	150.5	179.5	-64.1	-169.5	-174.1	93.4	4.2	111.2	T60 C62 E65 K80 A82 V93 V94 H95	T60-R84 HydrophobicContact CG2-CB 3.84Å; T60-R84 PolarHBondContact N-O 2.98Å; C62-R84 PolarHBondContact O-NH1 2.9Å; E65-R84 PolarHBondContact O-NE 3.47Å; K80-R84 PolarHBondContact O-NH2 2.99Å; K80-R84 VanDerWaalsContact O-NH2 3.1Å; A82-R84 PolarHBondContact O-N 2.87Å; R84-V93 HydrophobicContact CB-CG1 4.08Å; R84-V94 WeakPolarHBondContact CA-O 3.35Å; R84-H95 PolarHBondContact NE-NE2 3.07Å; R84-H95 PolarHBondContact NH2-NE2 2.91Å
85	R	90.9	Very high	84.4	Confident	45 Å²	45	49.2 Å²	49.2	17%	0.17	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139	176.1	-62.4	-72.6	-176	166.5	-16.6	109.1	L40 W57 T58 E59 V93 V94 I99	L40-R85 HydrophobicContact CD1-CG 4.48Å; W57-R85 HydrophobicContact CB-CB 4.25Å; W57-R85 HydrophobicContact CD2-CB 4.18Å; W57-R85 HydrophobicContact CE3-CB 3.68Å; W57-R85 HydrophobicContact CG-CB 4.45Å; W57-R85 HydrophobicContact CZ3-CB 4.38Å; T58-R85 CarbonylContact O-C 3.57Å; T58-R85 VanDerWaalsContact O-CA 3.26Å; T58-R85 WeakPolarHBondContact O-CA 3.35Å; E59-R85 VanDerWaalsContact CG-CZ 3.45Å; E59-R85 IonicContact OE1-CZ 3.78Å; E59-R85 VanDerWaalsContact OE1-CZ 3.31Å; E59-R85 IonicContact OE1-NH1 3.43Å; E59-R85 PolarHBondContact OE1-NH1 3.1Å; E59-R85 IonicContact OE1-NH2 3.58Å; E59-R85 PolarHBondContact OE1-NH2 2.91Å; R85-V93 CarbonylContact O-C 3.49Å; R85-V93 WeakPolarHBondContact O-CA 3.42Å; R85-V94 PolarHBondContact N-O 2.82Å; R85-V94 PolarHBondContact O-N 2.77Å; R85-I99 HydrophobicContact CB-CD1 4.41Å; R85-I99 HydrophobicContact CG-CD1 4.21Å
86	K	92.6	Very high	84.8	Confident	48 Å²	48	46 Å²	46	21%	0.209	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135	176.4	-172.7	168.3	-172.4	162.3	0	109.6	T58 T60 E65 I92 V93	T58-K86 PolarHBondContact N-O 2.77Å; T58-K86 PolarHBondContact O-N 3.08Å; T58-K86 PolarHBondContact OG1-O 2.74Å; T60-K86 HydrophobicContact CG2-CB 4.1Å; E65-K86 IonicContact OE1-NZ 3.36Å; E65-K86 PolarHBondContact OE1-NZ 3.05Å; E65-K86 IonicContact OE2-NZ 2.95Å; E65-K86 PolarHBondContact OE2-NZ 3.04Å; K86-I92 CarbonylContact C-O 3.6Å; K86-I92 WeakPolarHBondContact CA-O 3.44Å; K86-V93 HydrophobicContact CB-CG2 4.27Å; K86-V93 HydrophobicContact CD-CG2 4.16Å; K86-V93 HydrophobicContact CG-CG2 3.95Å
87	C	94	Very high	85.2	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	123.4	176.1	180	0	0	0	0	110.3	H55 L56 W57 A89 C90 K91 I92 C109	H55-C87 HydrophobicContact CB-CB 4.41Å; H55-C87 PolarHBondContact ND1-SG 3.26Å; L56-C87 CarbonylContact O-C 3.58Å; L56-C87 VanDerWaalsContact O-CA 3.25Å; L56-C87 WeakPolarHBondContact O-CA 3.38Å; W57-C87 HydrophobicContact CE3-CB 4.19Å; W57-C87 HydrophobicContact CZ3-CB 3.97Å; C87-A89 VanDerWaalsContact C-N 3.28Å; C87-A89 PolarHBondContact O-N 2.83Å; C87-C90 PolarHBondContact SG-SG 3Å; C87-K91 WeakPolarHBondContact O-CA 3.35Å; C87-K91 PolarHBondContact O-N 3Å; C87-I92 HydrophobicContact CB-CG1 3.88Å; C87-I92 PolarHBondContact N-O 3.26Å; C87-C109 VanDerWaalsContact SG-SG 3.68Å
88	A	93.8	Very high	86.1	Confident	2 Å²	2	38.7 Å²	38.7	2%	0.017	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-34.9	179.5	0	0	0	0	0	112.6	L56 T58 K91 H271 M274 W275	L56-A88 HydrophobicContact CB-CB 4.25Å; L56-A88 PolarHBondContact O-N 3.13Å; T58-A88 HydrophobicContact CG2-CB 4.25Å; A88-K91 WeakPolarHBondContact O-CE 3.2Å; A88-H271 HydrophobicContact CB-CB 4.25Å; A88-M274 HydrophobicContact CB-CB 4.21Å; A88-M274 HydrophobicContact CB-SD 4.03Å; A88-W275 WeakPolarHBondContact O-CA 3.42Å; A88-W275 PolarHBondContact O-N 3.4Å
89	A	94.2	Very high	87.2	Confident	2 Å²	2	33.1 Å²	33.1	2%	0.017	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-35.3	-172.6	0	0	0	0	0	114.7	C87 K110 W275 P279	C87-A89 VanDerWaalsContact C-N 3.28Å; C87-A89 PolarHBondContact O-N 2.83Å; A89-K110 HydrophobicContact CB-CG 4.46Å; A89-K110 WeakPolarHBondContact O-CE 3.19Å; A89-W275 VanDerWaalsContact O-CE3 3.23Å; A89-P279 HydrophobicContact CB-CG 3.75Å
90	C	93.5	Very high	88	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-6.4	-179.4	72.2	0	0	0	0	114.6	C87 I92 R133	C87-C90 PolarHBondContact SG-SG 3Å; C90-I92 PolarHBondContact O-N 2.77Å; C90-R133 PolarHBondContact O-NH1 3Å; C90-R133 PolarHBondContact O-NH2 2.64Å
91	K	92.1	Very high	89	Confident	49 Å²	49	31.1 Å²	31.1	21%	0.213	18%	0.178	C	C	.	.			trans	59.5	24.7	177.1	-58.5	-76.4	174.4	-178.7	0	114.7	C87 A88 R133 H271 W275	C87-K91 WeakPolarHBondContact O-CA 3.35Å; C87-K91 PolarHBondContact O-N 3Å; A88-K91 WeakPolarHBondContact O-CE 3.2Å; K91-R133 PolarHBondContact O-NH1 3.28Å; K91-H271 PolarHBondContact NZ-O 3.08Å; K91-W275 HydrophobicContact CB-CE3 4.22Å; K91-W275 HydrophobicContact CB-CZ3 4.27Å; K91-W275 VanDerWaalsContact CE-CB 3.45Å; K91-W275 HydrophobicContact CG-CD2 3.61Å; K91-W275 HydrophobicContact CG-CE3 3.43Å; K91-W275 VanDerWaalsContact CG-CE3 3.43Å; K91-W275 HydrophobicContact CG-CG 4.1Å; K91-W275 HydrophobicContact CG-CZ3 3.96Å
92	I	92	Very high	89.6	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.021	15%	0.145	C	C	.	.			trans	-73.2	154.7	164.5	69	172.4	0	0	0	109.7	H55 W57 Y68 K86 C87 C90 V94 L102 F107 V131	H55-I92 VanDerWaalsContact CE1-CD1 3.47Å; H55-I92 WeakPolarHBondContact CE1-CD1 3.47Å; W57-I92 HydrophobicContact CH2-CD1 3.83Å; W57-I92 HydrophobicContact CH2-CG1 4.1Å; W57-I92 HydrophobicContact CZ3-CD1 4.42Å; W57-I92 HydrophobicContact CZ3-CG1 4.19Å; Y68-I92 HydrophobicContact CD2-CB 4.25Å; Y68-I92 HydrophobicContact CD2-CG2 3.86Å; Y68-I92 HydrophobicContact CE2-CG2 4.07Å; Y68-I92 HydrophobicContact CG-CB 4.23Å; Y68-I92 HydrophobicContact CG-CG2 4.19Å; K86-I92 CarbonylContact C-O 3.6Å; K86-I92 WeakPolarHBondContact CA-O 3.44Å; C87-I92 HydrophobicContact CB-CG1 3.88Å; C87-I92 PolarHBondContact N-O 3.26Å; C90-I92 PolarHBondContact O-N 2.77Å; I92-V94 HydrophobicContact CD1-CG2 4.03Å; I92-V94 HydrophobicContact CG1-CG2 4.36Å; I92-L102 HydrophobicContact CD1-CD1 4.28Å; I92-L102 HydrophobicContact CD1-CD2 3.61Å; I92-F107 HydrophobicContact CD1-CD1 4.02Å; I92-F107 HydrophobicContact CD1-CE1 3.89Å; I92-F107 HydrophobicContact CG2-CE1 3.93Å; I92-F107 HydrophobicContact CG2-CZ 4.39Å; I92-V131 HydrophobicContact CG2-CG1 3.69Å
93	V	91.2	Very high	89.7	Confident	11 Å²	11	31.2 Å²	31.2	7%	0.067	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	128.8	178	-178.3	0	0	0	0	107.7	T60 E65 C67 Y68 R84 R85 K86	T60-V93 HydrophobicContact CG2-CG1 4.16Å; E65-V93 HydrophobicContact CB-CB 4.44Å; E65-V93 HydrophobicContact CB-CG1 4.1Å; E65-V93 HydrophobicContact CB-CG2 4.14Å; E65-V93 WeakPolarHBondContact OE2-CG2 3.33Å; C67-V93 CarbonylContact C-O 3.59Å; C67-V93 WeakPolarHBondContact CA-O 3.41Å; Y68-V93 WeakPolarHBondContact CB-O 3.13Å; Y68-V93 PolarHBondContact N-O 3.29Å; R84-V93 HydrophobicContact CB-CG1 4.08Å; R85-V93 CarbonylContact O-C 3.49Å; R85-V93 WeakPolarHBondContact O-CA 3.42Å; K86-V93 HydrophobicContact CB-CG2 4.27Å; K86-V93 HydrophobicContact CD-CG2 4.16Å; K86-V93 HydrophobicContact CG-CG2 3.95Å
94	V	90.4	Very high	89.7	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	144.6	-177	-171	0	0	0	0	108.4	W57 R84 R85 I92 C98 I99 L102	W57-V94 HydrophobicContact CH2-CB 4.18Å; W57-V94 HydrophobicContact CH2-CG2 3.86Å; W57-V94 HydrophobicContact CZ3-CB 4.36Å; W57-V94 HydrophobicContact CZ3-CG2 4.23Å; R84-V94 WeakPolarHBondContact CA-O 3.35Å; R85-V94 PolarHBondContact N-O 2.82Å; R85-V94 PolarHBondContact O-N 2.77Å; I92-V94 HydrophobicContact CD1-CG2 4.03Å; I92-V94 HydrophobicContact CG1-CG2 4.36Å; V94-C98 HydrophobicContact CG1-CB 3.47Å; V94-C98 VanDerWaalsContact CG1-CB 3.47Å; V94-I99 HydrophobicContact CG1-CG1 4.41Å; V94-L102 HydrophobicContact CG2-CD1 4.49Å; V94-L102 HydrophobicContact CG2-CD2 4.35Å
95	H	89.6	Confident	89.5	Confident	6 Å²	6	36.6 Å²	36.6	3%	0.028	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	147.4	169	-65.4	111	0	0	0	110.4	C67 C74 L76 P83 R84 G97 C98 I99	C67-H95 WeakPolarHBondContact CB-ND1 3.47Å; C74-H95 VanDerWaalsContact SG-CE1 3.58Å; C74-H95 PolarHBondContact SG-ND1 3.39Å; L76-H95 HydrophobicContact CB-CB 4.49Å; L76-H95 HydrophobicContact CD1-CB 3.87Å; P83-H95 WeakPolarHBondContact O-CA 3.39Å; R84-H95 PolarHBondContact NE-NE2 3.07Å; R84-H95 PolarHBondContact NH2-NE2 2.91Å; H95-G97 VanDerWaalsContact C-N 3.28Å; H95-G97 PolarHBondContact O-N 3.12Å; H95-C98 HydrophobicContact CB-CB 4Å; H95-C98 WeakPolarHBondContact O-CA 3.36Å; H95-C98 WeakPolarHBondContact O-CB 3.42Å; H95-C98 PolarHBondContact O-N 3.39Å; H95-I99 PolarHBondContact O-N 3Å
96	T	89.3	Confident	89.2	Confident	43 Å²	43	35.8 Å²	35.8	26%	0.264	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-53.1	-46.5	179.3	-54.5	0	0	0	0	111.7	L40 P83 C98 I99	L40-T96 HydrophobicContact CD1-CG2 4.11Å; P83-T96 PolarHBondContact O-N 3.37Å; P83-T96 PolarHBondContact O-OG1 3.4Å; T96-C98 PolarHBondContact O-N 3.38Å; T96-I99 WeakPolarHBondContact O-CG1 3.3Å; T96-I99 PolarHBondContact O-N 3.34Å
97	G	86.8	Confident	89	Confident	45 Å²	45	34.5 Å²	34.5	46%	0.464	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-71.8	-5.4	176.8	0	0	0	0	0	115.4	H95	H95-G97 VanDerWaalsContact C-N 3.28Å; H95-G97 PolarHBondContact O-N 3.12Å
98	C	89.1	Confident	88.9	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-100.5	-2	177.4	-75.2	0	0	0	0	113	L69 L75 V94 H95 T96 E100 Q101 L102	L69-C98 HydrophobicContact CD1-CB 3.69Å; L75-C98 PolarHBondContact N-SG 3.21Å; L75-C98 VanDerWaalsContact N-SG 3.41Å; V94-C98 HydrophobicContact CG1-CB 3.47Å; V94-C98 VanDerWaalsContact CG1-CB 3.47Å; H95-C98 HydrophobicContact CB-CB 4Å; H95-C98 WeakPolarHBondContact O-CA 3.36Å; H95-C98 WeakPolarHBondContact O-CB 3.42Å; H95-C98 PolarHBondContact O-N 3.39Å; T96-C98 PolarHBondContact O-N 3.38Å; C98-E100 PolarHBondContact O-N 2.76Å; C98-Q101 PolarHBondContact O-N 2.97Å; C98-L102 PolarHBondContact O-N 2.82Å
99	I	89.1	Confident	88.9	Confident	15 Å²	15	41.2 Å²	41.2	8%	0.077	20%	0.203	C	C	.	.	H	α-helix	trans	-63.2	-41.3	-179.2	-67.9	175	0	0	0	111.1	L40 W57 R85 V94 H95 T96 Q101 L102 E103	L40-I99 HydrophobicContact CD1-CD1 3.93Å; L40-I99 HydrophobicContact CD2-CD1 3.54Å; L40-I99 HydrophobicContact CD2-CG2 4.24Å; L40-I99 HydrophobicContact CG-CD1 4.41Å; W57-I99 HydrophobicContact CD2-CD1 4.21Å; W57-I99 HydrophobicContact CG-CD1 4.39Å; W57-I99 HydrophobicContact CZ2-CD1 4.45Å; W57-I99 HydrophobicContact CZ2-CG1 4.2Å; W57-I99 HydrophobicContact CZ2-CG2 4.28Å; R85-I99 HydrophobicContact CB-CD1 4.41Å; R85-I99 HydrophobicContact CG-CD1 4.21Å; V94-I99 HydrophobicContact CG1-CG1 4.41Å; H95-I99 PolarHBondContact O-N 3Å; T96-I99 WeakPolarHBondContact O-CG1 3.3Å; T96-I99 PolarHBondContact O-N 3.34Å; I99-Q101 VanDerWaalsContact C-N 3.28Å; I99-Q101 PolarHBondContact O-N 2.92Å; I99-L102 WeakPolarHBondContact O-CB 3.46Å; I99-L102 PolarHBondContact O-N 2.76Å; I99-L102 VanDerWaalsContact O-N 3.1Å; I99-E103 PolarHBondContact O-N 2.88Å
100	E	86.4	Confident	88.8	Confident	121 Å²	121	41.1 Å²	41.1	57%	0.565	20%	0.202	S	C	*	.	H	α-helix	trans	-63.3	-35.2	176.3	-63.3	-173.6	170.5	0	0	112.6	C98 L102 E103 K104	C98-E100 PolarHBondContact O-N 2.76Å; E100-L102 VanDerWaalsContact C-N 3.26Å; E100-L102 PolarHBondContact O-N 2.81Å; E100-E103 WeakPolarHBondContact O-CB 3.41Å; E100-E103 PolarHBondContact O-N 2.72Å; E100-E103 VanDerWaalsContact O-N 3.17Å; E100-K104 WeakPolarHBondContact O-CG 3.39Å; E100-K104 PolarHBondContact O-N 2.78Å
101	Q	86.8	Confident	88.7	Confident	46 Å²	46	43.2 Å²	43.2	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-68.1	-30.2	177.2	-168.4	66.9	20.5	0	0	111.5	L69 C98 I99 E103 K104 I105	L69-Q101 HydrophobicContact CD1-CB 3.68Å; L69-Q101 HydrophobicContact CD1-CG 3.75Å; C98-Q101 PolarHBondContact O-N 2.97Å; I99-Q101 VanDerWaalsContact C-N 3.28Å; I99-Q101 PolarHBondContact O-N 2.92Å; Q101-E103 VanDerWaalsContact C-N 3.35Å; Q101-K104 PolarHBondContact O-N 2.93Å; Q101-I105 PolarHBondContact O-N 2.82Å
102	L	86.3	Confident	88.8	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-39.5	171.5	-166	75.9	0	0	0	111.7	W57 Y68 L69 I92 V94 C98 I99 E100 I105 N106 F107	W57-L102 HydrophobicContact CH2-CD2 3.89Å; W57-L102 HydrophobicContact CZ2-CD2 3.92Å; Y68-L102 HydrophobicContact CD1-CD1 3.82Å; Y68-L102 HydrophobicContact CE1-CD1 4.33Å; L69-L102 HydrophobicContact CD2-CD1 3.94Å; I92-L102 HydrophobicContact CD1-CD1 4.28Å; I92-L102 HydrophobicContact CD1-CD2 3.61Å; V94-L102 HydrophobicContact CG2-CD1 4.49Å; V94-L102 HydrophobicContact CG2-CD2 4.35Å; C98-L102 PolarHBondContact O-N 2.82Å; I99-L102 WeakPolarHBondContact O-CB 3.46Å; I99-L102 PolarHBondContact O-N 2.76Å; I99-L102 VanDerWaalsContact O-N 3.1Å; E100-L102 VanDerWaalsContact C-N 3.26Å; E100-L102 PolarHBondContact O-N 2.81Å; L102-I105 HydrophobicContact CD1-CD1 4.3Å; L102-I105 VanDerWaalsContact O-CG1 3.27Å; L102-I105 WeakPolarHBondContact O-CG1 3.49Å; L102-I105 PolarHBondContact O-N 2.82Å; L102-N106 PolarHBondContact O-N 3.32Å; L102-F107 HydrophobicContact CD1-CB 3.77Å; L102-F107 HydrophobicContact CD1-CD1 3.89Å; L102-F107 HydrophobicContact CD1-CG 4.16Å; L102-F107 HydrophobicContact CD2-CD1 4.43Å; L102-F107 HydrophobicContact CG-CB 4.07Å; L102-F107 HydrophobicContact CG-CD1 4.35Å; L102-F107 PolarHBondContact O-N 2.9Å; L102-F107 VanDerWaalsContact O-N 3.15Å
103	E	82	Confident	88.9	Confident	111 Å²	111	41.7 Å²	41.7	52%	0.519	21%	0.211	S	C	.	.	H	α-helix	trans	-65.1	-40.6	174.1	-63.9	-174.7	173	0	0	111.1	K38 I99 E100 Q101 I105 N106	K38-E103 IonicContact NZ-OE1 3.61Å; K38-E103 IonicContact NZ-OE2 3.89Å; K38-E103 PolarHBondContact NZ-OE2 3.17Å; I99-E103 PolarHBondContact O-N 2.88Å; E100-E103 WeakPolarHBondContact O-CB 3.41Å; E100-E103 PolarHBondContact O-N 2.72Å; E100-E103 VanDerWaalsContact O-N 3.17Å; Q101-E103 VanDerWaalsContact C-N 3.35Å; E103-I105 VanDerWaalsContact C-N 3.32Å; E103-I105 PolarHBondContact O-N 2.79Å; E103-N106 WeakPolarHBondContact O-CA 3.48Å; E103-N106 PolarHBondContact O-N 2.88Å
104	K	85.4	Confident	88.8	Confident	148 Å²	148	43.6 Å²	43.6	64%	0.643	22%	0.218	S	C	*	.	H	α-helix	trans	-62.4	-34.6	177.6	-70.3	175.4	-169.5	169.4	0	113.6	E100 Q101 N106	E100-K104 WeakPolarHBondContact O-CG 3.39Å; E100-K104 PolarHBondContact O-N 2.78Å; Q101-K104 PolarHBondContact O-N 2.93Å; K104-N106 PolarHBondContact O-N 3.48Å
105	I	83.7	Confident	88.6	Confident	70 Å²	70	47.2 Å²	47.2	36%	0.359	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	6	173.3	68.1	166.9	0	0	0	113.1	L69 Q101 L102 E103 F107	L69-I105 HydrophobicContact CD2-CD1 3.53Å; L69-I105 HydrophobicContact CD2-CG1 4.33Å; Q101-I105 PolarHBondContact O-N 2.82Å; L102-I105 HydrophobicContact CD1-CD1 4.3Å; L102-I105 VanDerWaalsContact O-CG1 3.27Å; L102-I105 WeakPolarHBondContact O-CG1 3.49Å; L102-I105 PolarHBondContact O-N 2.82Å; E103-I105 VanDerWaalsContact C-N 3.32Å; E103-I105 PolarHBondContact O-N 2.79Å; I105-F107 HydrophobicContact CD1-CB 4.18Å; I105-F107 HydrophobicContact CG1-CB 4.12Å; I105-F107 PolarHBondContact O-N 3.28Å
106	N	85.1	Confident	87.7	Confident	27 Å²	27	47.9 Å²	47.9	14%	0.144	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.3	43.3	-176.8	-170.3	70.9	0	0	0	113.4	G18 L19 L102 E103 K104 R108	G18-N106 PolarHBondContact O-ND2 3.29Å; L19-N106 HydrophobicContact CD1-CB 3.54Å; L19-N106 WeakPolarHBondContact CD1-ND2 3.36Å; L19-N106 HydrophobicContact CG-CB 4.47Å; L19-N106 WeakPolarHBondContact CG-ND2 3.38Å; L102-N106 PolarHBondContact O-N 3.32Å; E103-N106 WeakPolarHBondContact O-CA 3.48Å; E103-N106 PolarHBondContact O-N 2.88Å; K104-N106 PolarHBondContact O-N 3.48Å; N106-R108 PolarHBondContact O-N 3.47Å; N106-R108 PolarHBondContact OD1-NE 2.86Å; N106-R108 VanDerWaalsContact OD1-NE 3.09Å
107	F	89.2	Confident	86.4	Confident	22 Å²	22	49.1 Å²	49.1	10%	0.096	27%	0.265	C	S	.	.			trans	-85.7	93.7	171.7	-172.8	-93.5	0	0	0	109.9	H55 Y68 I92 L102 I105 V131	H55-F107 AromaticContact CE1-CD1 3.99Å; H55-F107 PolarHBondContact NE2-O 3.16Å; Y68-F107 HydrophobicContact CD1-CD1 4.46Å; Y68-F107 AromaticContact CE1-CD1 3.91Å; Y68-F107 HydrophobicContact CE1-CD1 3.91Å; Y68-F107 AromaticContact CE1-CD2 3.95Å; Y68-F107 HydrophobicContact CE1-CD2 3.95Å; Y68-F107 HydrophobicContact CE1-CE1 4.02Å; Y68-F107 HydrophobicContact CE1-CE2 4.06Å; Y68-F107 AromaticContact CE1-CG 3.87Å; Y68-F107 HydrophobicContact CE1-CG 3.87Å; Y68-F107 HydrophobicContact CE1-CZ 4.09Å; Y68-F107 AromaticContact CZ-CE2 3.85Å; Y68-F107 AromaticContact CZ-CZ 3.83Å; Y68-F107 WeakPolarHBondContact OH-CE2 3.15Å; Y68-F107 WeakPolarHBondContact OH-CZ 3.44Å; I92-F107 HydrophobicContact CD1-CD1 4.02Å; I92-F107 HydrophobicContact CD1-CE1 3.89Å; I92-F107 HydrophobicContact CG2-CE1 3.93Å; I92-F107 HydrophobicContact CG2-CZ 4.39Å; L102-F107 HydrophobicContact CD1-CB 3.77Å; L102-F107 HydrophobicContact CD1-CD1 3.89Å; L102-F107 HydrophobicContact CD1-CG 4.16Å; L102-F107 HydrophobicContact CD2-CD1 4.43Å; L102-F107 HydrophobicContact CG-CB 4.07Å; L102-F107 HydrophobicContact CG-CD1 4.35Å; L102-F107 PolarHBondContact O-N 2.9Å; L102-F107 VanDerWaalsContact O-N 3.15Å; I105-F107 HydrophobicContact CD1-CB 4.18Å; I105-F107 HydrophobicContact CG1-CB 4.12Å; I105-F107 PolarHBondContact O-N 3.28Å; F107-V131 HydrophobicContact CZ-CG1 4.39Å; F107-V131 HydrophobicContact CZ-CG2 4.38Å
108	R	91.1	Very high	84.9	Confident	137 Å²	137	49.5 Å²	49.5	52%	0.517	26%	0.26	S	S	.	.			trans	-87.4	153.4	178	-63	-170.7	-178.4	-144.6	0.7	111.6	N52 N106 H129	N52-R108 PolarHBondContact O-NH1 2.74Å; N106-R108 PolarHBondContact O-N 3.47Å; N106-R108 PolarHBondContact OD1-NE 2.86Å; N106-R108 VanDerWaalsContact OD1-NE 3.09Å; R108-H129 PolarHBondContact O-NE2 3.47Å
109	C	93.6	Very high	82.8	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.034	31%	0.305	C	S	.	.			trans	-73.3	176.1	174.2	-160	0	0	0	0	112.1	G53 D54 H55 C87 H129	G53-C109 VanDerWaalsContact CA-O 3.29Å; G53-C109 WeakPolarHBondContact CA-O 3.33Å; G53-C109 WeakPolarHBondContact O-CB 3.41Å; G53-C109 PolarHBondContact O-N 2.99Å; D54-C109 VanDerWaalsContact O-CB 3.25Å; D54-C109 WeakPolarHBondContact O-CB 3.3Å; H55-C109 PolarHBondContact CE1-N 2.84Å; H55-C109 WeakPolarHBondContact ND1-CB 3.25Å; H55-C109 PolarHBondContact NE2-N 3.04Å; C87-C109 VanDerWaalsContact SG-SG 3.68Å; C109-H129 VanDerWaalsContact C-NE2 3.3Å
110	K	92.4	Very high	80.5	Confident	1 Å²	1	63.9 Å²	63.9	0%	0.004	32%	0.323	C	S	.	.			trans	-61.7	131.5	177.6	69.7	-179	-175.9	172.7	0	110.7	A89 H129 S163 W164 M274 W275 L277	A89-K110 HydrophobicContact CB-CG 4.46Å; A89-K110 WeakPolarHBondContact O-CE 3.19Å; K110-H129 HydrophobicContact CB-CB 4.05Å; K110-H129 PolarHBondContact N-CD2 2.86Å; K110-H129 PolarHBondContact N-NE2 2.78Å; K110-S163 WeakPolarHBondContact CB-OG 3.49Å; K110-W164 HydrophobicContact CB-CZ2 4.39Å; K110-W164 HydrophobicContact CD-CD2 4.01Å; K110-W164 HydrophobicContact CD-CE3 4.37Å; K110-W164 HydrophobicContact CD-CH2 4.26Å; K110-W164 HydrophobicContact CD-CZ2 3.85Å; K110-W164 HydrophobicContact CD-CZ3 4.5Å; K110-W164 HydrophobicContact CG-CZ2 4.06Å; K110-M274 PolarHBondContact NZ-O 2.87Å; K110-W275 PolarHBondContact NZ-O 2.89Å; K110-L277 PolarHBondContact NZ-O 3.33Å
111	P	92	Very high	78.5	Confident	44 Å²	44	65.4 Å²	65.4	29%	0.286	34%	0.335	S	S	.	.			trans	-67.1	135.6	-178.3	26.4	-34.2	0	0	0	110.6	N52 W164 P197	N52-P111 VanDerWaalsContact ND2-CB 3.31Å; N52-P111 WeakPolarHBondContact ND2-CB 3.48Å; N52-P111 WeakPolarHBondContact OD1-CA 3.44Å; N52-P111 VanDerWaalsContact OD1-CB 3.25Å; N52-P111 WeakPolarHBondContact OD1-CB 3.21Å; P111-W164 VanDerWaalsContact O-CZ2 3.29Å; P111-W164 WeakPolarHBondContact O-CZ2 3.11Å; P111-P197 WeakPolarHBondContact O-CG 3.49Å
112	T	93.9	Very high	76.4	Confident	18 Å²	18	74 Å²	74	11%	0.11	37%	0.365	C	S	.	.			trans	-108.6	-11.7	-174.3	58.7	0	0	0	0	114.1	N52 N278 P279 R280	N52-T112 PolarHBondContact OD1-N 3.34Å; T112-N278 WeakPolarHBondContact CB-OD1 3.45Å; T112-N278 PolarHBondContact O-ND2 3.21Å; T112-P279 HydrophobicContact CG2-CB 4.43Å; T112-P279 HydrophobicContact CG2-CG 3.99Å; T112-R280 PolarHBondContact OG1-NE 3.07Å
113	F	92.9	Very high	74.8	Confident	3 Å²	3	78.5 Å²	78.5	1%	0.013	39%	0.389	C	S	.	.	S	Bend	trans	-152	170.9	179.2	63.8	-87	0	0	0	111.1	A50 G51 N52 E115 P197 I200 K202 F240	A50-F113 HydrophobicContact CB-CE1 4.41Å; A50-F113 HydrophobicContact CB-CZ 4.39Å; A50-F113 WeakPolarHBondContact O-CZ 3.35Å; G51-F113 WeakPolarHBondContact O-CE1 3.27Å; N52-F113 HydrophobicContact CB-CE1 4.19Å; N52-F113 HydrophobicContact CB-CE2 4.37Å; N52-F113 HydrophobicContact CB-CZ 3.94Å; N52-F113 PolarHBondContact ND2-O 3.39Å; F113-E115 HydrophobicContact CE2-CG 4.43Å; F113-P197 CarbonylContact C-O 3.59Å; F113-P197 WeakPolarHBondContact CA-O 3.35Å; F113-I200 CarbonylContact C-O 3.51Å; F113-I200 WeakPolarHBondContact CA-O 3.43Å; F113-I200 HydrophobicContact CB-CB 3.95Å; F113-I200 HydrophobicContact CB-CG2 3.73Å; F113-I200 WeakPolarHBondContact CB-O 3.19Å; F113-K202 HydrophobicContact CD2-CB 3.6Å; F113-K202 HydrophobicContact CD2-CD 4.36Å; F113-K202 HydrophobicContact CE2-CB 3.65Å; F113-K202 HydrophobicContact CE2-CD 3.56Å; F113-K202 HydrophobicContact CE2-CG 4.23Å; F113-K202 HydrophobicContact CZ-CD 4.04Å; F113-F240 HydrophobicContact CB-CE1 4.09Å; F113-F240 HydrophobicContact CD1-CE1 4.09Å; F113-F240 AromaticContact CD2-CE1 3.94Å; F113-F240 HydrophobicContact CD2-CE1 3.94Å; F113-F240 HydrophobicContact CE2-CE1 4.38Å; F113-F240 AromaticContact CG-CE1 3.77Å; F113-F240 HydrophobicContact CG-CE1 3.77Å
114	K	89.6	Confident	73.7	Confident	50 Å²	50	77.2 Å²	77.2	22%	0.217	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	138.2	172.1	-175.9	177.1	-178.9	178.6	0	111.1	N124 P197 I200 I201 K202	K114-N124 PolarHBondContact NZ-OD1 2.96Å; K114-P197 PolarHBondContact N-O 3.39Å; K114-I200 PolarHBondContact N-O 3.05Å; K114-I201 WeakPolarHBondContact O-CA 3.43Å; K114-K202 PolarHBondContact O-N 2.86Å
115	E	86.6	Confident	73.1	Confident	76 Å²	76	74.1 Å²	74.1	36%	0.355	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	131.6	173.1	-73.1	-69.6	173.4	0	0	111.5	F113 G117	F113-E115 HydrophobicContact CE2-CG 4.43Å; E115-G117 PolarHBondContact O-N 2.78Å
116	G	69.8	Low	73.2	Confident	21 Å²	21	72.3 Å²	72.3	22%	0.216	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	120.4	177.7	0	0	0	0	0	112	K202	G116-K202 WeakPolarHBondContact CA-O 3.36Å; G116-K202 PolarHBondContact N-O 3.36Å
117	G	62.9	Low	73.4	Confident	69 Å²	69	78 Å²	78	71%	0.711	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.5	-5.4	175.5	0	0	0	0	0	115.9	E115 R119	E115-G117 PolarHBondContact O-N 2.78Å; G117-R119 PolarHBondContact O-N 2.96Å
118	S	54.6	Low	73.5	Confident	52 Å²	52	77.6 Å²	77.6	36%	0.364	39%	0.388	S	S	.	.			trans	-68.7	104.6	173.8	-169.2	0	0	0	0	110.1	C120 D123	S118-C120 PolarHBondContact O-N 2.64Å; S118-D123 PolarHBondContact OG-OD2 3.05Å
119	R	45.4	Very low	73.6	Confident	250 Å²	250	72 Å²	72	94%	0.943	37%	0.368	S	S	*	.			trans	-75.2	0.1	177.4	-63	-176.8	-173.1	178.2	2.1	113	G117 L121	G117-R119 PolarHBondContact O-N 2.96Å; R119-L121 PolarHBondContact O-N 3.44Å
120	C	41.3	Very low	73.6	Confident	68 Å²	68	72.1 Å²	72.1	46%	0.459	37%	0.367	S	S	.	.			trans	-88.5	110.4	-174.6	-147.3	0	0	0	0	110.6	S118 R122 D123	S118-C120 PolarHBondContact O-N 2.64Å; C120-R122 PolarHBondContact O-N 3.12Å; C120-D123 PolarHBondContact O-N 3Å
121	L	43.1	Very low	73.6	Confident	153 Å²	153	72.1 Å²	72.1	80%	0.801	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-59.7	-22.6	174.5	-84.7	154	0	0	0	113	R119 D123	R119-L121 PolarHBondContact O-N 3.44Å; L121-D123 VanDerWaalsContact C-N 3.31Å; L121-D123 PolarHBondContact O-N 3.27Å
122	R	44	Very low	73.6	Confident	227 Å²	227	71.1 Å²	71.1	86%	0.857	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-72.9	-14.2	178.4	-72.5	-168.3	-172	-163.3	3.3	114.7	C120	C120-R122 PolarHBondContact O-N 3.12Å
123	D	51.6	Low	73.3	Confident	97 Å²	97	71.5 Å²	71.5	52%	0.519	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-88.9	7.6	-178	-96	-10.6	0	0	0	114.3	S118 C120 L121 V125	S118-D123 PolarHBondContact OG-OD2 3.05Å; C120-D123 PolarHBondContact O-N 3Å; L121-D123 VanDerWaalsContact C-N 3.31Å; L121-D123 PolarHBondContact O-N 3.27Å; D123-V125 VanDerWaalsContact C-N 3.28Å
124	N	59.4	Low	72.9	Confident	84 Å²	84	73.8 Å²	73.8	45%	0.449	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-83.2	-5.4	179.7	-76	-16	0	0	0	113.8	K114	K114-N124 PolarHBondContact NZ-OD1 2.96Å
125	V	73	Confident	72.6	Confident	83 Å²	83	79 Å²	79	50%	0.503	39%	0.385	S	S	.	.	S	Bend	trans	-85.5	115.8	-178.8	-178.1	0	0	0	0	109.7	D123 R127 P184	D123-V125 VanDerWaalsContact C-N 3.28Å; V125-R127 PolarHBondContact O-N 3.41Å; V125-P184 HydrophobicContact CG1-CB 3.43Å; V125-P184 VanDerWaalsContact CG1-CB 3.43Å
126	L	85.4	Confident	72.7	Confident	32 Å²	32	77.1 Å²	77.1	17%	0.168	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-65.8	120.6	174.2	-177.1	71	0	0	0	109.2	C185 L187 P197	L126-C185 HydrophobicContact CD2-CB 4.18Å; L126-C185 HydrophobicContact CG-CB 4.19Å; L126-C185 PolarHBondContact O-N 2.97Å; L126-L187 HydrophobicContact CD2-CD1 4.22Å; L126-L187 HydrophobicContact CD2-CD2 3.22Å; L126-L187 HydrophobicContact CD2-CG 3.59Å; L126-P197 HydrophobicContact CD1-CG 3.92Å
127	R	89	Confident	73.5	Confident	146 Å²	146	83.7 Å²	83.7	55%	0.551	40%	0.401	S	S	*	.	B	Isolated β-bridge	trans	-88.8	155.4	175.7	-66.1	-173.1	-178.6	171.8	0.3	111.9	V125	V125-R127 PolarHBondContact O-N 3.41Å
128	H	91.9	Very high	74.7	Confident	13 Å²	13	82.9 Å²	82.9	6%	0.06	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-63.6	143.9	170.2	-74.7	-108	0	0	0	110.9	W130 C162 C165 E183 P184 C185	H128-W130 HydrophobicContact CB-CD2 4.09Å; H128-W130 VanDerWaalsContact CB-CE2 3.43Å; H128-W130 HydrophobicContact CB-CG 4.35Å; H128-W130 HydrophobicContact CB-CZ2 3.68Å; H128-W130 VanDerWaalsContact CB-NE1 3.34Å; H128-W130 AromaticContact CE1-CH2 3.86Å; H128-W130 AromaticContact CE1-CZ2 3.75Å; H128-W130 AromaticContact CG-CE2 3.77Å; H128-W130 AromaticContact CG-CZ2 3.44Å; H128-W130 VanDerWaalsContact CG-CZ2 3.44Å; H128-W130 AromaticContact ND1-CE2 3.85Å; H128-W130 AromaticContact ND1-CH2 3.36Å; H128-W130 WeakPolarHBondContact ND1-CH2 3.36Å; H128-W130 AromaticContact ND1-CZ2 3.16Å; H128-W130 WeakPolarHBondContact ND1-CZ2 3.14Å; H128-C162 PolarHBondContact ND1-SG 2.89Å; H128-C162 VanDerWaalsContact ND1-SG 3.39Å; H128-C165 PolarHBondContact CE1-SG 3.23Å; H128-C165 PolarHBondContact ND1-SG 3.35Å; H128-C165 VanDerWaalsContact ND1-SG 3.43Å; H128-E183 PolarHBondContact CD2-O 3.42Å; H128-P184 PolarHBondContact NE2-O 3.02Å; H128-C185 WeakPolarHBondContact NE2-CA 3.5Å
129	H	93.8	Very high	76.5	Confident	21 Å²	21	87.7 Å²	87.7	10%	0.097	41%	0.407	C	S	.	.			trans	-108.6	90.6	168.3	172.2	-79.5	0	0	0	108.5	R108 C109 K110 V131 C162 S163	R108-H129 PolarHBondContact O-NE2 3.47Å; C109-H129 VanDerWaalsContact C-NE2 3.3Å; K110-H129 HydrophobicContact CB-CB 4.05Å; K110-H129 PolarHBondContact N-CD2 2.86Å; K110-H129 PolarHBondContact N-NE2 2.78Å; H129-V131 WeakPolarHBondContact CE1-CG2 3.23Å; H129-V131 WeakPolarHBondContact ND1-CG2 3.3Å; H129-C162 WeakPolarHBondContact O-CA 3.06Å; H129-S163 WeakPolarHBondContact CB-OG 3.43Å; H129-S163 VanDerWaalsContact CG-OG 3.3Å; H129-S163 WeakPolarHBondContact ND1-CB 3.32Å; H129-S163 PolarHBondContact ND1-OG 3.03Å; H129-S163 PolarHBondContact O-N 3.2Å
130	W	93.6	Very high	78.8	Confident	7 Å²	7	75.9 Å²	75.9	3%	0.027	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	131.1	-177.3	-64.7	117.3	0	0	0	111.8	I14 H128 I160 C162 F169 F176 Q180	I14-W130 HydrophobicContact CD1-CB 4.39Å; I14-W130 HydrophobicContact CG1-CB 4.23Å; I14-W130 HydrophobicContact CG2-CB 4.16Å; H128-W130 HydrophobicContact CB-CD2 4.09Å; H128-W130 VanDerWaalsContact CB-CE2 3.43Å; H128-W130 HydrophobicContact CB-CG 4.35Å; H128-W130 HydrophobicContact CB-CZ2 3.68Å; H128-W130 VanDerWaalsContact CB-NE1 3.34Å; H128-W130 AromaticContact CE1-CH2 3.86Å; H128-W130 AromaticContact CE1-CZ2 3.75Å; H128-W130 AromaticContact CG-CE2 3.77Å; H128-W130 AromaticContact CG-CZ2 3.44Å; H128-W130 VanDerWaalsContact CG-CZ2 3.44Å; H128-W130 AromaticContact ND1-CE2 3.85Å; H128-W130 AromaticContact ND1-CH2 3.36Å; H128-W130 WeakPolarHBondContact ND1-CH2 3.36Å; H128-W130 AromaticContact ND1-CZ2 3.16Å; H128-W130 WeakPolarHBondContact ND1-CZ2 3.14Å; W130-I160 HydrophobicContact CB-CG2 3.97Å; W130-I160 HydrophobicContact CD2-CG2 4.27Å; W130-I160 HydrophobicContact CE3-CG2 3.92Å; W130-I160 HydrophobicContact CG-CG2 4.33Å; W130-C162 HydrophobicContact CD2-CB 4.42Å; W130-C162 HydrophobicContact CE3-CB 3.77Å; W130-C162 HydrophobicContact CH2-CB 3.94Å; W130-C162 HydrophobicContact CZ3-CB 3.52Å; W130-F169 HydrophobicContact CH2-CD2 4.05Å; W130-F169 AromaticContact CH2-CE2 3.62Å; W130-F169 HydrophobicContact CH2-CE2 3.62Å; W130-F169 AromaticContact CZ3-CD2 3.98Å; W130-F169 HydrophobicContact CZ3-CD2 3.98Å; W130-F169 HydrophobicContact CZ3-CE2 4Å; W130-F176 AromaticContact CD1-CZ 3.97Å; W130-F176 AromaticContact CD2-CE2 3.76Å; W130-F176 HydrophobicContact CD2-CE2 3.76Å; W130-F176 AromaticContact CD2-CZ 3.88Å; W130-F176 HydrophobicContact CD2-CZ 3.88Å; W130-F176 AromaticContact CE2-CE2 3.74Å; W130-F176 AromaticContact CE2-CZ 3.89Å; W130-F176 AromaticContact CE3-CE2 3.94Å; W130-F176 HydrophobicContact CE3-CE2 3.94Å; W130-F176 HydrophobicContact CE3-CZ 4.45Å; W130-F176 HydrophobicContact CG-CE2 4.34Å; W130-F176 AromaticContact CG-CZ 3.97Å; W130-F176 HydrophobicContact CG-CZ 3.97Å; W130-F176 HydrophobicContact CH2-CE2 4.22Å; W130-F176 AromaticContact CZ2-CE2 3.99Å; W130-F176 HydrophobicContact CZ2-CE2 3.99Å; W130-F176 HydrophobicContact CZ3-CE2 4.15Å; W130-F176 AromaticContact NE1-CZ 3.89Å; W130-Q180 HydrophobicContact CZ2-CB 4.49Å; W130-Q180 PolarHBondContact NE1-O 3.16Å
131	V	92.6	Very high	81.3	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.6	-179.5	-172.7	0	0	0	0	109.5	Y68 I92 F107 H129 I160 S161	Y68-V131 HydrophobicContact CE2-CG1 4.15Å; I92-V131 HydrophobicContact CG2-CG1 3.69Å; F107-V131 HydrophobicContact CZ-CG1 4.39Å; F107-V131 HydrophobicContact CZ-CG2 4.38Å; H129-V131 WeakPolarHBondContact CE1-CG2 3.23Å; H129-V131 WeakPolarHBondContact ND1-CG2 3.3Å; V131-I160 WeakPolarHBondContact O-CA 3.23Å; V131-S161 PolarHBondContact N-O 2.92Å; V131-S161 PolarHBondContact O-N 2.95Å
132	H	90.4	Very high	83.6	Confident	24 Å²	24	75.8 Å²	75.8	11%	0.111	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	131.9	172.8	-71.4	179.1	0	0	0	111.4	I14 Y68 I157	I14-H132 WeakPolarHBondContact CD1-NE2 3.43Å; Y68-H132 HydrophobicContact CE2-CB 4.15Å; H132-I157 HydrophobicContact CB-CD1 3.96Å; H132-I157 HydrophobicContact CB-CG1 4.4Å; H132-I157 HydrophobicContact CB-CG2 3.75Å
133	R	88.3	Confident	85.9	Confident	26 Å²	26	67.4 Å²	67.4	10%	0.098	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132	-174.2	-58.6	-70.2	-178.7	-170	-8.8	111	C90 K91 Q136 I158 A159 S161	C90-R133 PolarHBondContact O-NH1 3Å; C90-R133 PolarHBondContact O-NH2 2.64Å; K91-R133 PolarHBondContact O-NH1 3.28Å; R133-Q136 HydrophobicContact CB-CB 4.39Å; R133-I158 PolarHBondContact O-N 3.17Å; R133-A159 HydrophobicContact CB-CB 4.17Å; R133-A159 PolarHBondContact N-O 3.38Å; R133-A159 PolarHBondContact O-N 3.03Å; R133-A159 VanDerWaalsContact O-N 3.11Å; R133-S161 VanDerWaalsContact CG-OG 3.23Å; R133-S161 WeakPolarHBondContact CG-OG 3.4Å; R133-S161 PolarHBondContact NE-OG 3Å
134	R	84.4	Confident	87.9	Confident	50 Å²	50	64.9 Å²	64.9	19%	0.189	32%	0.323	C	S	.	.	S	Bend	trans	-88.2	-19.2	168	-59.9	-173.4	-178.8	102.7	3.5	112.6	L66 C67 G70 K155 I157 I158	L66-R134 PolarHBondContact O-NH1 3.07Å; C67-R134 PolarHBondContact O-NH1 2.94Å; C67-R134 PolarHBondContact O-NH2 3.42Å; G70-R134 VanDerWaalsContact CA-NH2 3.32Å; R134-K155 WeakPolarHBondContact CD-O 3.49Å; R134-K155 PolarHBondContact NE-O 3.31Å; R134-K155 VanDerWaalsContact NE-O 3.09Å; R134-I157 HydrophobicContact CG-CG1 4.33Å; R134-I158 WeakPolarHBondContact O-CD1 3.42Å
135	R	83.8	Confident	89.4	Confident	159 Å²	159	68 Å²	68	60%	0.6	33%	0.332	S	S	*	.	S	Bend	trans	-133.4	129.7	173.4	-63.1	-173.8	-174.5	-158.6	4.7	108.4	G64	G64-R135 PolarHBondContact O-NH2 3.05Å
136	Q	87.9	Confident	90.3	Very high	37 Å²	37	67.7 Å²	67.7	17%	0.173	33%	0.334	C	S	.	.			trans	-146.7	133	178.3	-179.9	61.4	57.3	0	0	107.9	R133 F147 A159 S161 A168	R133-Q136 HydrophobicContact CB-CB 4.39Å; Q136-F147 HydrophobicContact CB-CB 4.39Å; Q136-F147 HydrophobicContact CB-CD1 4.3Å; Q136-F147 HydrophobicContact CB-CD2 3.98Å; Q136-F147 HydrophobicContact CB-CE2 4.38Å; Q136-F147 HydrophobicContact CB-CG 3.95Å; Q136-F147 HydrophobicContact CG-CD1 4.29Å; Q136-F147 HydrophobicContact CG-CD2 3.52Å; Q136-F147 HydrophobicContact CG-CE1 4.25Å; Q136-F147 HydrophobicContact CG-CE2 3.48Å; Q136-F147 VanDerWaalsContact CG-CE2 3.48Å; Q136-F147 HydrophobicContact CG-CG 3.95Å; Q136-F147 HydrophobicContact CG-CZ 3.87Å; Q136-F147 WeakPolarHBondContact O-CB 3.33Å; Q136-A159 HydrophobicContact CB-CB 3.64Å; Q136-A159 HydrophobicContact CG-CB 3.9Å; Q136-S161 VanDerWaalsContact OE1-CB 3.29Å; Q136-S161 PolarHBondContact OE1-OG 3.44Å; Q136-A168 HydrophobicContact CG-CB 3.86Å
137	E	87.3	Confident	90.4	Very high	159 Å²	159	66.7 Å²	66.7	74%	0.743	33%	0.328	S	S	*	.			trans	-94.7	161.1	174.1	-69.4	168.8	-166.4	0	0	110.3
138	G	88.6	Confident	89.9	Confident	52 Å²	52	67 Å²	67	54%	0.536	34%	0.336	S	S	.	.	S	Bend	trans	85.3	-155.6	179.8	0	0	0	0	0	114.1	F147	G138-F147 WeakPolarHBondContact O-CD2 3.4Å
139	K	92.6	Very high	88.7	Confident	154 Å²	154	72 Å²	72	67%	0.67	36%	0.359	S	S	*	.	B	Isolated β-bridge	trans	-118.9	147.2	-173	-67.1	175	178.1	-178.8	0	110.8	K141 G144	K139-K141 PolarHBondContact O-N 3.49Å; K139-G144 WeakPolarHBondContact CD-O 3.37Å; K139-G144 WeakPolarHBondContact CG-O 3.32Å
140	C	93.3	Very high	87.1	Confident	2 Å²	2	77.1 Å²	77.1	1%	0.014	38%	0.381	C	S	.	.			trans	-65.6	129.3	173	173.6	0	0	0	0	110.1	Q142 C143 G144 K145 F147 A168 H170	C140-Q142 VanDerWaalsContact C-N 3.28Å; C140-Q142 PolarHBondContact O-N 2.7Å; C140-C143 VanDerWaalsContact CB-SG 3.58Å; C140-C143 VanDerWaalsContact SG-SG 3.6Å; C140-G144 VanDerWaalsContact O-CA 3.27Å; C140-G144 WeakPolarHBondContact O-CA 3.29Å; C140-G144 PolarHBondContact O-N 2.83Å; C140-K145 WeakPolarHBondContact CB-O 3.43Å; C140-K145 PolarHBondContact N-O 2.96Å; C140-F147 HydrophobicContact CB-CE1 4.32Å; C140-F147 HydrophobicContact CB-CZ 4.03Å; C140-A168 WeakPolarHBondContact CA-O 3.39Å; C140-H170 WeakPolarHBondContact CB-CE1 2.82Å; C140-H170 VanDerWaalsContact CB-ND1 3.33Å; C140-H170 WeakPolarHBondContact CB-ND1 3.31Å; C140-H170 PolarHBondContact SG-N 3.4Å; C140-H170 VanDerWaalsContact SG-N 3.41Å
141	K	92.7	Very high	84.9	Confident	119 Å²	119	86.1 Å²	86.1	52%	0.517	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-33.1	-178.5	-177.2	177.8	175.7	-164.7	0	113	K139 Q167 A168 F169	K139-K141 PolarHBondContact O-N 3.49Å; K141-Q167 HydrophobicContact CD-CB 4.28Å; K141-Q167 HydrophobicContact CD-CG 3.88Å; K141-A168 PolarHBondContact N-O 3.25Å; K141-F169 HydrophobicContact CB-CD1 4.28Å; K141-F169 HydrophobicContact CB-CE1 3.76Å; K141-F169 HydrophobicContact CB-CZ 3.92Å; K141-F169 HydrophobicContact CD-CE1 4.43Å; K141-F169 HydrophobicContact CD-CZ 3.92Å; K141-F169 HydrophobicContact CG-CE1 4.28Å; K141-F169 HydrophobicContact CG-CZ 4.25Å
142	Q	92.4	Very high	82.9	Confident	99 Å²	99	94.6 Å²	94.6	46%	0.463	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-46.9	-177.2	-175	64.6	19.6	0	0	113.3	C140 F169 C175	C140-Q142 VanDerWaalsContact C-N 3.28Å; C140-Q142 PolarHBondContact O-N 2.7Å; Q142-F169 HydrophobicContact CB-CD1 3.86Å; Q142-F169 HydrophobicContact CB-CE1 4Å; Q142-C175 HydrophobicContact CB-CB 4.39Å; Q142-C175 WeakPolarHBondContact CB-O 3.23Å
143	C	92.3	Very high	81.2	Confident	52 Å²	52	99.5 Å²	99.5	35%	0.351	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-4.9	-171.4	72.7	0	0	0	0	114.1	C140 K145 H170	C140-C143 VanDerWaalsContact CB-SG 3.58Å; C140-C143 VanDerWaalsContact SG-SG 3.6Å; C143-K145 PolarHBondContact O-N 2.9Å; C143-H170 PolarHBondContact SG-CE1 3Å; C143-H170 PolarHBondContact SG-ND1 3.31Å
144	G	92.4	Very high	79.8	Confident	44 Å²	44	99.8 Å²	99.8	45%	0.454	49%	0.487	S	S	.	.			trans	69.8	-8.1	-178.9	0	0	0	0	0	115.5	K139 C140	K139-G144 WeakPolarHBondContact CD-O 3.37Å; K139-G144 WeakPolarHBondContact CG-O 3.32Å; C140-G144 VanDerWaalsContact O-CA 3.27Å; C140-G144 WeakPolarHBondContact O-CA 3.29Å; C140-G144 PolarHBondContact O-N 2.83Å
145	K	92.7	Very high	79	Confident	150 Å²	150	103.4 Å²	103.4	65%	0.652	50%	0.503	S	S	*	.			trans	-77	147.1	-178.5	-60.5	-178.3	-178.5	-176.4	0	111.3	C140 C143 H170	C140-K145 WeakPolarHBondContact CB-O 3.43Å; C140-K145 PolarHBondContact N-O 2.96Å; C143-K145 PolarHBondContact O-N 2.9Å; K145-H170 PolarHBondContact O-CE1 3.05Å
146	S	90.8	Very high	78.7	Confident	76 Å²	76	101.2 Å²	101.2	53%	0.531	50%	0.5	S	S	.	.	B	Isolated β-bridge	trans	-65.8	158.1	174.6	55.4	0	0	0	0	111.8	Q148 H170	S146-Q148 PolarHBondContact O-N 2.91Å; S146-H170 PolarHBondContact O-NE2 3.07Å
147	F	88.4	Confident	78.5	Confident	10 Å²	10	100.7 Å²	100.7	4%	0.044	50%	0.498	C	S	.	.			trans	-77.8	115	170.9	-61.8	-79.8	0	0	0	108.6	Q136 G138 C140 Q149 I158 A159 A168 H170	Q136-F147 HydrophobicContact CB-CB 4.39Å; Q136-F147 HydrophobicContact CB-CD1 4.3Å; Q136-F147 HydrophobicContact CB-CD2 3.98Å; Q136-F147 HydrophobicContact CB-CE2 4.38Å; Q136-F147 HydrophobicContact CB-CG 3.95Å; Q136-F147 HydrophobicContact CG-CD1 4.29Å; Q136-F147 HydrophobicContact CG-CD2 3.52Å; Q136-F147 HydrophobicContact CG-CE1 4.25Å; Q136-F147 HydrophobicContact CG-CE2 3.48Å; Q136-F147 VanDerWaalsContact CG-CE2 3.48Å; Q136-F147 HydrophobicContact CG-CG 3.95Å; Q136-F147 HydrophobicContact CG-CZ 3.87Å; Q136-F147 WeakPolarHBondContact O-CB 3.33Å; G138-F147 WeakPolarHBondContact O-CD2 3.4Å; C140-F147 HydrophobicContact CB-CE1 4.32Å; C140-F147 HydrophobicContact CB-CZ 4.03Å; F147-Q149 PolarHBondContact O-N 3.4Å; F147-I158 HydrophobicContact CB-CD1 4.16Å; F147-A159 HydrophobicContact CD1-CB 3.58Å; F147-A159 HydrophobicContact CE1-CB 3.4Å; F147-A159 HydrophobicContact CG-CB 4.45Å; F147-A159 HydrophobicContact CZ-CB 4.17Å; F147-A168 HydrophobicContact CE2-CB 3.86Å; F147-A168 HydrophobicContact CZ-CB 3.55Å; F147-H170 AromaticContact CD1-CD2 3.47Å; F147-H170 VanDerWaalsContact CD1-CD2 3.47Å; F147-H170 WeakPolarHBondContact CD1-CD2 3.42Å; F147-H170 AromaticContact CD1-NE2 3.71Å; F147-H170 AromaticContact CE1-CD2 3.73Å
148	Q	78.4	Confident	78.6	Confident	154 Å²	154	94.5 Å²	94.5	72%	0.72	47%	0.47	S	S	*	.			trans	-64.3	107.2	177.9	-72.7	179.5	-20	0	0	109.5	S146 K150	S146-Q148 PolarHBondContact O-N 2.91Å; Q148-K150 PolarHBondContact O-N 3.25Å
149	Q	66.3	Low	78.7	Confident	117 Å²	117	92 Å²	92	55%	0.547	44%	0.444	S	S	.	.			trans	-83.4	101	169.4	-60.8	-170.9	11.4	0	0	107	F147 F151	F147-Q149 PolarHBondContact O-N 3.4Å; Q149-F151 PolarHBondContact O-N 3.23Å
150	K	59.1	Low	78.7	Confident	128 Å²	128	84.8 Å²	84.8	56%	0.557	41%	0.413	S	S	*	.			trans	-62.4	126	169.3	-68.9	177.8	179.5	168.1	0	107.5	Q148 F152 E156	Q148-K150 PolarHBondContact O-N 3.25Å; K150-F152 PolarHBondContact O-N 3.27Å; K150-E156 IonicContact NZ-OE2 3.76Å; K150-E156 PolarHBondContact NZ-OE2 2.89Å
151	F	47.5	Very low	78.8	Confident	196 Å²	196	84.9 Å²	84.9	86%	0.86	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	130.3	170.4	-69.4	-84.7	0	0	0	108.1	Q149	Q149-F151 PolarHBondContact O-N 3.23Å
152	F	51.4	Low	78.9	Confident	179 Å²	179	79.2 Å²	79.2	79%	0.785	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	117.3	-174.7	-54.5	-86	0	0	0	116.9	K150 S154	K150-F152 PolarHBondContact O-N 3.27Å; F152-S154 VanDerWaalsContact C-N 3.26Å; F152-S154 PolarHBondContact O-N 3.1Å
153	H	54.9	Low	79	Confident	126 Å²	126	74.5 Å²	74.5	58%	0.583	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	31.8	40.7	154.6	-58.8	77.3	0	0	0	118.6	K155	H153-K155 PolarHBondContact O-N 3.22Å; H153-K155 VanDerWaalsContact O-N 3.09Å
154	S	57.9	Low	79	Confident	33 Å²	33	72 Å²	72	23%	0.231	35%	0.35	C	S	.	.			trans	-60.6	118.9	174.7	-177.8	0	0	0	0	110.1	F152 E156	F152-S154 VanDerWaalsContact C-N 3.26Å; F152-S154 PolarHBondContact O-N 3.1Å; S154-E156 PolarHBondContact O-N 2.87Å; S154-E156 PolarHBondContact OG-N 2.82Å
155	K	67.9	Low	79.1	Confident	125 Å²	125	70.4 Å²	70.4	54%	0.543	33%	0.332	S	S	.	.			trans	-77.9	-10.7	178.5	-62.8	176.3	176.7	-175.5	0	112.4	L66 E71 R134 H153	L66-K155 HydrophobicContact CD1-CB 4.47Å; L66-K155 HydrophobicContact CD1-CG 4.19Å; E71-K155 VanDerWaalsContact OE1-CD 3.23Å; E71-K155 WeakPolarHBondContact OE1-CD 3.33Å; E71-K155 WeakPolarHBondContact OE1-CE 3.2Å; E71-K155 IonicContact OE1-NZ 3.77Å; E71-K155 PolarHBondContact OE1-NZ 3.44Å; E71-K155 IonicContact OE2-NZ 3.61Å; R134-K155 WeakPolarHBondContact CD-O 3.49Å; R134-K155 PolarHBondContact NE-O 3.31Å; R134-K155 VanDerWaalsContact NE-O 3.09Å; H153-K155 PolarHBondContact O-N 3.22Å; H153-K155 VanDerWaalsContact O-N 3.09Å
156	E	78.1	Confident	79.1	Confident	114 Å²	114	66.4 Å²	66.4	53%	0.533	31%	0.314	S	S	.	.	S	Bend	trans	-76.4	141.5	-174	-165.7	178.6	-179.6	0	0	112.3	K150 S154 I158	K150-E156 IonicContact NZ-OE2 3.76Å; K150-E156 PolarHBondContact NZ-OE2 2.89Å; S154-E156 PolarHBondContact O-N 2.87Å; S154-E156 PolarHBondContact OG-N 2.82Å; E156-I158 PolarHBondContact O-N 3.19Å
157	I	84	Confident	79.2	Confident	25 Å²	25	64.6 Å²	64.6	13%	0.128	30%	0.297	C	S	.	.			trans	-79.6	112.6	171	-63.4	166.1	0	0	0	107.7	H132 R134 N171	H132-I157 HydrophobicContact CB-CD1 3.96Å; H132-I157 HydrophobicContact CB-CG1 4.4Å; H132-I157 HydrophobicContact CB-CG2 3.75Å; R134-I157 HydrophobicContact CG-CG1 4.33Å; I157-N171 HydrophobicContact CG2-CB 4.25Å; I157-N171 WeakPolarHBondContact O-CB 3.29Å; I157-N171 PolarHBondContact O-ND2 3.19Å
158	I	88.4	Confident	79.5	Confident	29 Å²	29	64.4 Å²	64.4	15%	0.149	30%	0.298	C	S	.	.			trans	-95.9	-22.1	-175.9	66.3	175.4	0	0	0	112.9	R133 R134 F147 E156 N171	R133-I158 PolarHBondContact O-N 3.17Å; R134-I158 WeakPolarHBondContact O-CD1 3.42Å; F147-I158 HydrophobicContact CB-CD1 4.16Å; E156-I158 PolarHBondContact O-N 3.19Å; I158-N171 PolarHBondContact O-N 3.49Å
159	A	91.3	Very high	80.3	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	156.9	-173.6	0	0	0	0	0	113.8	R133 Q136 F147 F169	R133-A159 HydrophobicContact CB-CB 4.17Å; R133-A159 PolarHBondContact N-O 3.38Å; R133-A159 PolarHBondContact O-N 3.03Å; R133-A159 VanDerWaalsContact O-N 3.11Å; Q136-A159 HydrophobicContact CB-CB 3.64Å; Q136-A159 HydrophobicContact CG-CB 3.9Å; F147-A159 HydrophobicContact CD1-CB 3.58Å; F147-A159 HydrophobicContact CE1-CB 3.4Å; F147-A159 HydrophobicContact CG-CB 4.45Å; F147-A159 HydrophobicContact CZ-CB 4.17Å; A159-F169 CarbonylContact C-O 3.48Å; A159-F169 WeakPolarHBondContact CA-O 3.4Å; A159-F169 WeakPolarHBondContact CB-O 3.41Å
160	I	92.9	Very high	81.5	Confident	3 Å²	3	53 Å²	53	2%	0.015	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.5	169.5	-55.4	177.8	0	0	0	106.3	I14 W130 V131 A168 F169 N171 F176	I14-I160 HydrophobicContact CD1-CD1 4.29Å; I14-I160 HydrophobicContact CD1-CG2 4.22Å; W130-I160 HydrophobicContact CB-CG2 3.97Å; W130-I160 HydrophobicContact CD2-CG2 4.27Å; W130-I160 HydrophobicContact CE3-CG2 3.92Å; W130-I160 HydrophobicContact CG-CG2 4.33Å; V131-I160 WeakPolarHBondContact O-CA 3.23Å; I160-A168 WeakPolarHBondContact O-CA 3.39Å; I160-F169 PolarHBondContact N-O 2.93Å; I160-F169 PolarHBondContact O-N 2.82Å; I160-N171 HydrophobicContact CG1-CB 4.29Å; I160-F176 HydrophobicContact CB-CD2 4.27Å; I160-F176 HydrophobicContact CB-CE2 4.45Å; I160-F176 HydrophobicContact CD1-CB 4.17Å; I160-F176 HydrophobicContact CD1-CD1 3.59Å; I160-F176 HydrophobicContact CD1-CD2 4.36Å; I160-F176 HydrophobicContact CD1-CE1 4.05Å; I160-F176 HydrophobicContact CD1-CG 3.77Å; I160-F176 HydrophobicContact CG2-CD2 4.17Å; I160-F176 HydrophobicContact CG2-CE1 4.36Å; I160-F176 HydrophobicContact CG2-CE2 3.85Å; I160-F176 HydrophobicContact CG2-CZ 3.96Å
161	S	94.5	Very high	83	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.9	-178.2	67.5	0	0	0	0	113.8	V131 R133 Q136 Q167	V131-S161 PolarHBondContact N-O 2.92Å; V131-S161 PolarHBondContact O-N 2.95Å; R133-S161 VanDerWaalsContact CG-OG 3.23Å; R133-S161 WeakPolarHBondContact CG-OG 3.4Å; R133-S161 PolarHBondContact NE-OG 3Å; Q136-S161 VanDerWaalsContact OE1-CB 3.29Å; Q136-S161 PolarHBondContact OE1-OG 3.44Å; S161-Q167 CarbonylContact C-O 3.53Å; S161-Q167 VanDerWaalsContact CA-O 3.26Å; S161-Q167 WeakPolarHBondContact CA-O 3.31Å
162	C	94.4	Very high	84.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.5	179.4	-177.3	0	0	0	0	110.5	H128 H129 W130 W164 C165 K166 Q167	H128-C162 PolarHBondContact ND1-SG 2.89Å; H128-C162 VanDerWaalsContact ND1-SG 3.39Å; H129-C162 WeakPolarHBondContact O-CA 3.06Å; W130-C162 HydrophobicContact CD2-CB 4.42Å; W130-C162 HydrophobicContact CE3-CB 3.77Å; W130-C162 HydrophobicContact CH2-CB 3.94Å; W130-C162 HydrophobicContact CZ3-CB 3.52Å; C162-W164 VanDerWaalsContact C-N 3.26Å; C162-W164 PolarHBondContact O-N 2.81Å; C162-W164 PolarHBondContact SG-N 2.94Å; C162-W164 VanDerWaalsContact SG-N 3.43Å; C162-C165 VanDerWaalsContact CB-SG 3.58Å; C162-C165 VanDerWaalsContact SG-SG 3.68Å; C162-K166 VanDerWaalsContact O-CA 3.27Å; C162-K166 WeakPolarHBondContact O-CA 3.38Å; C162-K166 PolarHBondContact O-N 2.95Å; C162-K166 VanDerWaalsContact O-N 3.16Å; C162-Q167 PolarHBondContact N-O 2.85Å
163	S	94.4	Very high	86.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-14.2	177.7	68.3	0	0	0	0	114.1	K110 H129 K166	K110-S163 WeakPolarHBondContact CB-OG 3.49Å; H129-S163 WeakPolarHBondContact CB-OG 3.43Å; H129-S163 VanDerWaalsContact CG-OG 3.3Å; H129-S163 WeakPolarHBondContact ND1-CB 3.32Å; H129-S163 PolarHBondContact ND1-OG 3.03Å; H129-S163 PolarHBondContact O-N 3.2Å; S163-K166 PolarHBondContact O-NZ 2.88Å
164	W	94.1	Very high	88.1	Confident	1 Å²	1	39.2 Å²	39.2	0%	0.004	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-79	172.8	-78.7	121	0	0	0	110.9	K110 P111 C162 K166 L187 I194 P197 N278	K110-W164 HydrophobicContact CB-CZ2 4.39Å; K110-W164 HydrophobicContact CD-CD2 4.01Å; K110-W164 HydrophobicContact CD-CE3 4.37Å; K110-W164 HydrophobicContact CD-CH2 4.26Å; K110-W164 HydrophobicContact CD-CZ2 3.85Å; K110-W164 HydrophobicContact CD-CZ3 4.5Å; K110-W164 HydrophobicContact CG-CZ2 4.06Å; P111-W164 VanDerWaalsContact O-CZ2 3.29Å; P111-W164 WeakPolarHBondContact O-CZ2 3.11Å; C162-W164 VanDerWaalsContact C-N 3.26Å; C162-W164 PolarHBondContact O-N 2.81Å; C162-W164 PolarHBondContact SG-N 2.94Å; C162-W164 VanDerWaalsContact SG-N 3.43Å; W164-K166 PolarHBondContact O-N 3.01Å; W164-L187 HydrophobicContact CB-CD2 4.16Å; W164-L187 HydrophobicContact CD2-CD2 3.87Å; W164-L187 HydrophobicContact CE3-CD2 3.57Å; W164-L187 HydrophobicContact CG-CD2 4.15Å; W164-L187 HydrophobicContact CZ3-CD2 4.23Å; W164-I194 HydrophobicContact CZ3-CG2 3.93Å; W164-P197 HydrophobicContact CH2-CG 4.08Å; W164-P197 HydrophobicContact CZ2-CG 3.59Å; W164-N278 HydrophobicContact CH2-CB 3.74Å; W164-N278 HydrophobicContact CZ3-CB 4.12Å
165	C	92.9	Very high	89.5	Confident	9 Å²	9	37.9 Å²	37.9	6%	0.061	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-1.1	-173.1	67.3	0	0	0	0	115.9	H128 C162 Q167	H128-C165 PolarHBondContact CE1-SG 3.23Å; H128-C165 PolarHBondContact ND1-SG 3.35Å; H128-C165 VanDerWaalsContact ND1-SG 3.43Å; C162-C165 VanDerWaalsContact CB-SG 3.58Å; C162-C165 VanDerWaalsContact SG-SG 3.68Å; C165-Q167 HydrophobicContact CB-CG 4.44Å; C165-Q167 PolarHBondContact O-N 2.83Å
166	K	93.6	Very high	90.7	Very high	66 Å²	66	32.1 Å²	32.1	29%	0.287	16%	0.163	S	C	.	.			trans	61	5.5	178.5	-47.1	-52.3	-178.2	-173.6	0	116.1	C162 S163 W164 A168 W275	C162-K166 VanDerWaalsContact O-CA 3.27Å; C162-K166 WeakPolarHBondContact O-CA 3.38Å; C162-K166 PolarHBondContact O-N 2.95Å; C162-K166 VanDerWaalsContact O-N 3.16Å; S163-K166 PolarHBondContact O-NZ 2.88Å; W164-K166 PolarHBondContact O-N 3.01Å; K166-A168 PolarHBondContact O-N 3.37Å; K166-W275 HydrophobicContact CD-CH2 4.31Å; K166-W275 HydrophobicContact CD-CZ2 3.78Å; K166-W275 VanDerWaalsContact NZ-CZ2 3.31Å; K166-W275 PolarHBondContact NZ-O 2.97Å
167	Q	93.4	Very high	91	Very high	38 Å²	38	29.9 Å²	29.9	18%	0.178	15%	0.154	C	C	.	.			trans	-59.4	138.1	171.5	-66	178.4	14	0	0	110.1	K141 S161 C162 C165 F169	K141-Q167 HydrophobicContact CD-CB 4.28Å; K141-Q167 HydrophobicContact CD-CG 3.88Å; S161-Q167 CarbonylContact C-O 3.53Å; S161-Q167 VanDerWaalsContact CA-O 3.26Å; S161-Q167 WeakPolarHBondContact CA-O 3.31Å; C162-Q167 PolarHBondContact N-O 2.85Å; C165-Q167 HydrophobicContact CB-CG 4.44Å; C165-Q167 PolarHBondContact O-N 2.83Å; Q167-F169 HydrophobicContact CB-CE2 4.28Å
168	A	94.3	Very high	90.8	Very high	7 Å²	7	32.4 Å²	32.4	6%	0.058	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	142.5	-179.3	0	0	0	0	0	110.6	Q136 C140 K141 F147 I160 K166	Q136-A168 HydrophobicContact CG-CB 3.86Å; C140-A168 WeakPolarHBondContact CA-O 3.39Å; K141-A168 PolarHBondContact N-O 3.25Å; F147-A168 HydrophobicContact CE2-CB 3.86Å; F147-A168 HydrophobicContact CZ-CB 3.55Å; I160-A168 WeakPolarHBondContact O-CA 3.39Å; K166-A168 PolarHBondContact O-N 3.37Å
169	F	94.4	Very high	90.4	Very high	6 Å²	6	35 Å²	35	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	150	178.5	-62.3	-90.4	0	0	0	109.6	W130 K141 Q142 A159 I160 Q167 C175 F176	W130-F169 HydrophobicContact CH2-CD2 4.05Å; W130-F169 AromaticContact CH2-CE2 3.62Å; W130-F169 HydrophobicContact CH2-CE2 3.62Å; W130-F169 AromaticContact CZ3-CD2 3.98Å; W130-F169 HydrophobicContact CZ3-CD2 3.98Å; W130-F169 HydrophobicContact CZ3-CE2 4Å; K141-F169 HydrophobicContact CB-CD1 4.28Å; K141-F169 HydrophobicContact CB-CE1 3.76Å; K141-F169 HydrophobicContact CB-CZ 3.92Å; K141-F169 HydrophobicContact CD-CE1 4.43Å; K141-F169 HydrophobicContact CD-CZ 3.92Å; K141-F169 HydrophobicContact CG-CE1 4.28Å; K141-F169 HydrophobicContact CG-CZ 4.25Å; Q142-F169 HydrophobicContact CB-CD1 3.86Å; Q142-F169 HydrophobicContact CB-CE1 4Å; A159-F169 CarbonylContact C-O 3.48Å; A159-F169 WeakPolarHBondContact CA-O 3.4Å; A159-F169 WeakPolarHBondContact CB-O 3.41Å; I160-F169 PolarHBondContact N-O 2.93Å; I160-F169 PolarHBondContact O-N 2.82Å; Q167-F169 HydrophobicContact CB-CE2 4.28Å; F169-C175 WeakPolarHBondContact CD1-O 3.5Å; F169-F176 HydrophobicContact CB-CB 4.07Å; F169-F176 HydrophobicContact CB-CD2 3.9Å; F169-F176 HydrophobicContact CB-CG 4.46Å; F169-F176 AromaticContact CD2-CD2 3.78Å; F169-F176 HydrophobicContact CD2-CD2 3.78Å; F169-F176 HydrophobicContact CD2-CE2 4.21Å; F169-F176 AromaticContact CG-CD2 3.92Å; F169-F176 HydrophobicContact CG-CD2 3.92Å
170	H	92.6	Very high	90	Very high	26 Å²	26	35.4 Å²	35.4	12%	0.12	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	145.9	168.4	-67.5	112.3	0	0	0	109.5	C140 C143 K145 S146 F147 K172 C175	C140-H170 WeakPolarHBondContact CB-CE1 2.82Å; C140-H170 VanDerWaalsContact CB-ND1 3.33Å; C140-H170 WeakPolarHBondContact CB-ND1 3.31Å; C140-H170 PolarHBondContact SG-N 3.4Å; C140-H170 VanDerWaalsContact SG-N 3.41Å; C143-H170 PolarHBondContact SG-CE1 3Å; C143-H170 PolarHBondContact SG-ND1 3.31Å; K145-H170 PolarHBondContact O-CE1 3.05Å; S146-H170 PolarHBondContact O-NE2 3.07Å; F147-H170 AromaticContact CD1-CD2 3.47Å; F147-H170 VanDerWaalsContact CD1-CD2 3.47Å; F147-H170 WeakPolarHBondContact CD1-CD2 3.42Å; F147-H170 AromaticContact CD1-NE2 3.71Å; F147-H170 AromaticContact CE1-CD2 3.73Å; H170-K172 HydrophobicContact CB-CB 4.48Å; H170-K172 HydrophobicContact CB-CG 4.37Å; H170-K172 PolarHBondContact O-N 3.32Å; H170-C175 HydrophobicContact CB-CB 3.91Å
171	N	89.3	Confident	89.4	Confident	36 Å²	36	36.5 Å²	36.5	19%	0.193	19%	0.186	C	C	.	.	S	Bend	trans	-74.1	61.9	173	-176.8	30.2	0	0	0	110.8	I157 I158 I160	I157-N171 HydrophobicContact CG2-CB 4.25Å; I157-N171 WeakPolarHBondContact O-CB 3.29Å; I157-N171 PolarHBondContact O-ND2 3.19Å; I158-N171 PolarHBondContact O-N 3.49Å; I160-N171 HydrophobicContact CG1-CB 4.29Å
172	K	87.5	Confident	88.8	Confident	135 Å²	135	44.2 Å²	44.2	59%	0.587	22%	0.222	S	C	*	.	S	Bend	trans	-141.4	141.2	-179.5	-65.8	-177	-180	-179.8	0	108.4	H170 T174 C175 F176	H170-K172 HydrophobicContact CB-CB 4.48Å; H170-K172 HydrophobicContact CB-CG 4.37Å; H170-K172 PolarHBondContact O-N 3.32Å; K172-T174 PolarHBondContact O-N 3.01Å; K172-C175 PolarHBondContact O-N 3.4Å; K172-F176 PolarHBondContact O-N 3.4Å
173	V	85.5	Confident	88.5	Confident	54 Å²	54	48.4 Å²	48.4	33%	0.327	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-34.3	-179.6	-176.1	0	0	0	0	112.6	F6 C175	F6-V173 HydrophobicContact CB-CG2 4.42Å; F6-V173 HydrophobicContact CD1-CB 4.04Å; F6-V173 HydrophobicContact CD1-CG1 3.83Å; F6-V173 HydrophobicContact CD1-CG2 3.23Å; F6-V173 HydrophobicContact CD2-CG1 4.37Å; F6-V173 HydrophobicContact CE1-CB 3.87Å; F6-V173 HydrophobicContact CE1-CG1 3.45Å; F6-V173 VanDerWaalsContact CE1-CG1 3.45Å; F6-V173 HydrophobicContact CE1-CG2 3.56Å; F6-V173 HydrophobicContact CE2-CG1 4.04Å; F6-V173 HydrophobicContact CG-CG1 4.25Å; F6-V173 HydrophobicContact CG-CG2 3.95Å; F6-V173 HydrophobicContact CZ-CB 4.47Å; F6-V173 HydrophobicContact CZ-CG1 3.57Å; F6-V173 HydrophobicContact CZ-CG2 4.49Å; V173-C175 PolarHBondContact O-N 2.92Å
174	T	87.9	Confident	88.2	Confident	113 Å²	113	52.4 Å²	52.4	69%	0.693	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-17.7	177.2	53.9	0	0	0	0	113.8	K172	K172-T174 PolarHBondContact O-N 3.01Å
175	C	89.1	Confident	88	Confident	6 Å²	6	52.9 Å²	52.9	4%	0.041	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-35.4	-179	-67.2	0	0	0	0	112.4	Q142 F169 H170 K172 V173 Q180	Q142-C175 HydrophobicContact CB-CB 4.39Å; Q142-C175 WeakPolarHBondContact CB-O 3.23Å; F169-C175 WeakPolarHBondContact CD1-O 3.5Å; H170-C175 HydrophobicContact CB-CB 3.91Å; K172-C175 PolarHBondContact O-N 3.4Å; V173-C175 PolarHBondContact O-N 2.92Å; C175-Q180 PolarHBondContact O-NE2 3.26Å
176	F	91.9	Very high	87.9	Confident	3 Å²	3	55.9 Å²	55.9	1%	0.013	29%	0.292	C	S	.	.	S	Bend	trans	-121.6	106.2	-177.9	-169.2	-97	0	0	0	110.6	I14 W130 I160 F169 K172 Q180 I181	I14-F176 HydrophobicContact CD1-CE1 4.2Å; W130-F176 AromaticContact CD1-CZ 3.97Å; W130-F176 AromaticContact CD2-CE2 3.76Å; W130-F176 HydrophobicContact CD2-CE2 3.76Å; W130-F176 AromaticContact CD2-CZ 3.88Å; W130-F176 HydrophobicContact CD2-CZ 3.88Å; W130-F176 AromaticContact CE2-CE2 3.74Å; W130-F176 AromaticContact CE2-CZ 3.89Å; W130-F176 AromaticContact CE3-CE2 3.94Å; W130-F176 HydrophobicContact CE3-CE2 3.94Å; W130-F176 HydrophobicContact CE3-CZ 4.45Å; W130-F176 HydrophobicContact CG-CE2 4.34Å; W130-F176 AromaticContact CG-CZ 3.97Å; W130-F176 HydrophobicContact CG-CZ 3.97Å; W130-F176 HydrophobicContact CH2-CE2 4.22Å; W130-F176 AromaticContact CZ2-CE2 3.99Å; W130-F176 HydrophobicContact CZ2-CE2 3.99Å; W130-F176 HydrophobicContact CZ3-CE2 4.15Å; W130-F176 AromaticContact NE1-CZ 3.89Å; I160-F176 HydrophobicContact CB-CD2 4.27Å; I160-F176 HydrophobicContact CB-CE2 4.45Å; I160-F176 HydrophobicContact CD1-CB 4.17Å; I160-F176 HydrophobicContact CD1-CD1 3.59Å; I160-F176 HydrophobicContact CD1-CD2 4.36Å; I160-F176 HydrophobicContact CD1-CE1 4.05Å; I160-F176 HydrophobicContact CD1-CG 3.77Å; I160-F176 HydrophobicContact CG2-CD2 4.17Å; I160-F176 HydrophobicContact CG2-CE1 4.36Å; I160-F176 HydrophobicContact CG2-CE2 3.85Å; I160-F176 HydrophobicContact CG2-CZ 3.96Å; F169-F176 HydrophobicContact CB-CB 4.07Å; F169-F176 HydrophobicContact CB-CD2 3.9Å; F169-F176 HydrophobicContact CB-CG 4.46Å; F169-F176 AromaticContact CD2-CD2 3.78Å; F169-F176 HydrophobicContact CD2-CD2 3.78Å; F169-F176 HydrophobicContact CD2-CE2 4.21Å; F169-F176 AromaticContact CG-CD2 3.92Å; F169-F176 HydrophobicContact CG-CD2 3.92Å; K172-F176 PolarHBondContact O-N 3.4Å; F176-Q180 HydrophobicContact CE2-CB 4.22Å; F176-I181 HydrophobicContact CE1-CD1 4.32Å; F176-I181 HydrophobicContact CE1-CG1 4.14Å; F176-I181 HydrophobicContact CZ-CG1 4.1Å
177	M	85.4	Confident	87.7	Confident	67 Å²	67	53.6 Å²	53.6	33%	0.33	28%	0.283	S	S	.	.			trans	-102.5	154.7	-177.6	-69.5	179.7	-87.4	0	0	111.4	H179 Q180	M177-H179 VanDerWaalsContact C-N 3.28Å; M177-H179 VanDerWaalsContact CE-CE1 3.42Å; M177-H179 WeakPolarHBondContact CE-CE1 3.31Å; M177-H179 PolarHBondContact O-N 2.98Å; M177-Q180 WeakPolarHBondContact O-CB 3.42Å; M177-Q180 PolarHBondContact O-N 3.49Å; M177-Q180 VanDerWaalsContact O-N 3.12Å
178	L	79	Confident	87.6	Confident	79 Å²	79	52.8 Å²	52.8	41%	0.414	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-33.7	-177.7	-92.3	113.7	0	0	0	114.3	F6 Q180 I181	F6-L178 HydrophobicContact CD2-CD1 4.21Å; F6-L178 HydrophobicContact CE2-CD1 3.34Å; F6-L178 HydrophobicContact CZ-CD1 3.59Å; L178-Q180 PolarHBondContact O-N 2.99Å; L178-Q180 VanDerWaalsContact O-N 3.16Å; L178-I181 VanDerWaalsContact O-CB 3.31Å; L178-I181 WeakPolarHBondContact O-CB 3.3Å; L178-I181 PolarHBondContact O-N 3.47Å
179	H	80.7	Confident	87.3	Confident	84 Å²	84	57 Å²	57	39%	0.389	32%	0.319	S	S	.	.	H	α-helix	trans	-59.6	-28.7	179.6	69.7	-102	0	0	0	112.6	M177 I181 E182 E183	M177-H179 VanDerWaalsContact C-N 3.28Å; M177-H179 VanDerWaalsContact CE-CE1 3.42Å; M177-H179 WeakPolarHBondContact CE-CE1 3.31Å; M177-H179 PolarHBondContact O-N 2.98Å; H179-I181 PolarHBondContact O-N 3.39Å; H179-I181 VanDerWaalsContact O-N 3.12Å; H179-E182 PolarHBondContact O-N 2.97Å; H179-E183 IonicContact CD2-OE1 2.64Å; H179-E183 PolarHBondContact O-N 3.34Å; H179-E183 VanDerWaalsContact O-N 3.16Å
180	Q	81.7	Confident	87.2	Confident	7 Å²	7	57.5 Å²	57.5	3%	0.033	32%	0.322	C	S	.	.	H	α-helix	trans	-65.6	-15.1	177.7	-60	176	-4.9	0	0	112.8	W130 C175 F176 M177 L178	W130-Q180 HydrophobicContact CZ2-CB 4.49Å; W130-Q180 PolarHBondContact NE1-O 3.16Å; C175-Q180 PolarHBondContact O-NE2 3.26Å; F176-Q180 HydrophobicContact CE2-CB 4.22Å; M177-Q180 WeakPolarHBondContact O-CB 3.42Å; M177-Q180 PolarHBondContact O-N 3.49Å; M177-Q180 VanDerWaalsContact O-N 3.12Å; L178-Q180 PolarHBondContact O-N 2.99Å; L178-Q180 VanDerWaalsContact O-N 3.16Å
181	I	81.6	Confident	87.1	Confident	26 Å²	26	57.7 Å²	57.7	13%	0.133	33%	0.328	C	S	.	.	H	α-helix	trans	-80	-32.7	174.7	-57.9	176.5	0	0	0	110.7	A13 F176 L178 H179	A13-I181 HydrophobicContact CB-CD1 3.78Å; F176-I181 HydrophobicContact CE1-CD1 4.32Å; F176-I181 HydrophobicContact CE1-CG1 4.14Å; F176-I181 HydrophobicContact CZ-CG1 4.1Å; L178-I181 VanDerWaalsContact O-CB 3.31Å; L178-I181 WeakPolarHBondContact O-CB 3.3Å; L178-I181 PolarHBondContact O-N 3.47Å; H179-I181 PolarHBondContact O-N 3.39Å; H179-I181 VanDerWaalsContact O-N 3.12Å
182	E	82	Confident	87.2	Confident	166 Å²	166	56.8 Å²	56.8	78%	0.776	33%	0.327	S	S	*	.	H	α-helix	trans	-87.7	-22.4	-176.8	-61.5	-174.9	169.5	0	0	112.6	H179	H179-E182 PolarHBondContact O-N 2.97Å
183	E	86.7	Confident	87.5	Confident	88 Å²	88	50.3 Å²	50.3	41%	0.411	30%	0.299	S	S	.	.	S	Bend	trans	-60.5	144.4	177.5	-77.8	-175.6	175.5	0	0	113.3	H128 H179	H128-E183 PolarHBondContact CD2-O 3.42Å; H179-E183 IonicContact CD2-OE1 2.64Å; H179-E183 PolarHBondContact O-N 3.34Å; H179-E183 VanDerWaalsContact O-N 3.16Å
184	P	88.9	Confident	88	Confident	83 Å²	83	47.9 Å²	47.9	54%	0.539	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-69.2	137.2	173.3	30.1	-36	0	0	0	111.5	V125 H128 S186	V125-P184 HydrophobicContact CG1-CB 3.43Å; V125-P184 VanDerWaalsContact CG1-CB 3.43Å; H128-P184 PolarHBondContact NE2-O 3.02Å; P184-S186 PolarHBondContact O-N 3.06Å
185	C	90.4	Very high	88.3	Confident	11 Å²	11	42.5 Å²	42.5	7%	0.074	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-75.6	122.1	173.6	-167.6	0	0	0	0	111.3	L126 H128 L187	L126-C185 HydrophobicContact CD2-CB 4.18Å; L126-C185 HydrophobicContact CG-CB 4.19Å; L126-C185 PolarHBondContact O-N 2.97Å; H128-C185 WeakPolarHBondContact NE2-CA 3.5Å; C185-L187 PolarHBondContact O-N 3.02Å
186	S	90.1	Very high	88.5	Confident	73 Å²	73	42.9 Å²	42.9	51%	0.51	25%	0.253	S	S	.	.			trans	-78	3.1	177.7	66.2	0	0	0	0	114.9	P184 G188 A191	P184-S186 PolarHBondContact O-N 3.06Å; S186-G188 PolarHBondContact O-N 3.07Å; S186-G188 PolarHBondContact OG-N 3.44Å; S186-A191 WeakPolarHBondContact O-CB 3.45Å
187	L	89.5	Confident	88.5	Confident	17 Å²	17	43 Å²	43	9%	0.089	26%	0.255	C	S	.	.			trans	60.5	-6.1	-170.2	-65.1	170.1	0	0	0	115.8	L126 W164 C185 A191 I194 P196	L126-L187 HydrophobicContact CD2-CD1 4.22Å; L126-L187 HydrophobicContact CD2-CD2 3.22Å; L126-L187 HydrophobicContact CD2-CG 3.59Å; W164-L187 HydrophobicContact CB-CD2 4.16Å; W164-L187 HydrophobicContact CD2-CD2 3.87Å; W164-L187 HydrophobicContact CE3-CD2 3.57Å; W164-L187 HydrophobicContact CG-CD2 4.15Å; W164-L187 HydrophobicContact CZ3-CD2 4.23Å; C185-L187 PolarHBondContact O-N 3.02Å; L187-A191 HydrophobicContact CB-CB 3.83Å; L187-I194 HydrophobicContact CB-CD1 4.25Å; L187-I194 HydrophobicContact CD1-CB 4.39Å; L187-I194 HydrophobicContact CD1-CG2 4.06Å; L187-I194 HydrophobicContact CD2-CD1 4.47Å; L187-I194 HydrophobicContact CD2-CG2 4.08Å; L187-P196 HydrophobicContact CD1-CB 4.2Å; L187-P196 HydrophobicContact CD1-CG 3.9Å
188	G	90.8	Very high	88.6	Confident	21 Å²	21	42 Å²	42	22%	0.216	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	77	-157	172.9	0	0	0	0	0	113.3	S186 H190 A191	S186-G188 PolarHBondContact O-N 3.07Å; S186-G188 PolarHBondContact OG-N 3.44Å; G188-H190 PolarHBondContact O-N 3.18Å; G188-H190 VanDerWaalsContact O-N 3.14Å; G188-A191 WeakPolarHBondContact O-CB 3.35Å; G188-A191 PolarHBondContact O-N 2.98Å; G188-A191 VanDerWaalsContact O-N 3.15Å
189	A	88.5	Confident	89.1	Confident	96 Å²	96	38.7 Å²	38.7	79%	0.793	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-60.1	-25.8	-172.9	0	0	0	0	0	114.2
190	H	91.6	Very high	89.7	Confident	16 Å²	16	34.7 Å²	34.7	7%	0.074	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-101.2	20.1	-177.8	-60.7	-57	0	0	0	113	G188 G192 V193 I194 I276 S359	G188-H190 PolarHBondContact O-N 3.18Å; G188-H190 VanDerWaalsContact O-N 3.14Å; H190-G192 PolarHBondContact O-N 2.74Å; H190-V193 HydrophobicContact CB-CG2 3.75Å; H190-V193 VanDerWaalsContact O-CG2 3.24Å; H190-V193 WeakPolarHBondContact O-CG2 3.48Å; H190-V193 PolarHBondContact O-N 3.19Å; H190-V193 VanDerWaalsContact O-N 3.14Å; H190-I194 HydrophobicContact CB-CD1 4.08Å; H190-I194 HydrophobicContact CB-CG1 4.42Å; H190-I194 WeakPolarHBondContact O-CD1 3.46Å; H190-I194 VanDerWaalsContact O-CG1 3.23Å; H190-I194 WeakPolarHBondContact O-CG1 3.37Å; H190-I194 PolarHBondContact O-N 2.91Å; H190-I194 VanDerWaalsContact O-N 3.17Å; H190-I276 HydrophobicContact CB-CG2 4.28Å; H190-S359 PolarHBondContact CE1-O 3.43Å; H190-S359 VanDerWaalsContact CE1-O 3.32Å; H190-S359 PolarHBondContact CE1-OG 2.99Å; H190-S359 WeakPolarHBondContact NE2-CB 3.36Å; H190-S359 PolarHBondContact NE2-OG 3.25Å
191	A	90.9	Very high	90.2	Very high	31 Å²	31	35.9 Å²	35.9	26%	0.256	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-34.5	-179.9	0	0	0	0	0	112.9	S186 L187 G188 V193	S186-A191 WeakPolarHBondContact O-CB 3.45Å; L187-A191 HydrophobicContact CB-CB 3.83Å; G188-A191 WeakPolarHBondContact O-CB 3.35Å; G188-A191 PolarHBondContact O-N 2.98Å; G188-A191 VanDerWaalsContact O-N 3.15Å; A191-V193 VanDerWaalsContact C-N 3.29Å; A191-V193 PolarHBondContact O-N 3.41Å
192	G	90.6	Very high	90.7	Very high	16 Å²	16	36 Å²	36	17%	0.165	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-28.3	179.1	0	0	0	0	0	114.4	H190 K251	H190-G192 PolarHBondContact O-N 2.74Å; G192-K251 CarbonylContact O-C 3.54Å; G192-K251 VanDerWaalsContact O-C 3.29Å; G192-K251 PolarHBondContact O-N 3.31Å
193	V	95.3	Very high	90.9	Very high	0 Å²	0	30 Å²	30	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-12.6	-176.9	-59.7	0	0	0	0	114.1	H190 A191 V253 L277 Q281 E366	H190-V193 HydrophobicContact CB-CG2 3.75Å; H190-V193 VanDerWaalsContact O-CG2 3.24Å; H190-V193 WeakPolarHBondContact O-CG2 3.48Å; H190-V193 PolarHBondContact O-N 3.19Å; H190-V193 VanDerWaalsContact O-N 3.14Å; A191-V193 VanDerWaalsContact C-N 3.29Å; A191-V193 PolarHBondContact O-N 3.41Å; V193-V253 HydrophobicContact CB-CB 4.25Å; V193-V253 HydrophobicContact CB-CG2 3.74Å; V193-V253 HydrophobicContact CG1-CG2 3.71Å; V193-V253 PolarHBondContact O-N 2.89Å; V193-L277 HydrophobicContact CG2-CD2 3.98Å; V193-Q281 PolarHBondContact O-NE2 3.48Å; V193-E366 HydrophobicContact CG1-CB 3.81Å; V193-E366 HydrophobicContact CG1-CG 3.94Å
194	I	95	Very high	90.7	Very high	2 Å²	2	35 Å²	35	1%	0.01	21%	0.214	C	C	.	.			trans	-83.7	131.1	179.5	-68.3	165.3	0	0	0	110.3	W164 L187 H190 P196 L277	W164-I194 HydrophobicContact CZ3-CG2 3.93Å; L187-I194 HydrophobicContact CB-CD1 4.25Å; L187-I194 HydrophobicContact CD1-CB 4.39Å; L187-I194 HydrophobicContact CD1-CG2 4.06Å; L187-I194 HydrophobicContact CD2-CD1 4.47Å; L187-I194 HydrophobicContact CD2-CG2 4.08Å; H190-I194 HydrophobicContact CB-CD1 4.08Å; H190-I194 HydrophobicContact CB-CG1 4.42Å; H190-I194 WeakPolarHBondContact O-CD1 3.46Å; H190-I194 VanDerWaalsContact O-CG1 3.23Å; H190-I194 WeakPolarHBondContact O-CG1 3.37Å; H190-I194 PolarHBondContact O-N 2.91Å; H190-I194 VanDerWaalsContact O-N 3.17Å; I194-P196 VanDerWaalsContact O-CD 3.22Å; I194-P196 WeakPolarHBondContact O-CD 3.33Å; I194-L277 HydrophobicContact CG1-CD2 3.84Å
195	V	94.9	Very high	90.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.215	C	C	.	.			trans	-81.6	109.6	164.9	172.2	0	0	0	0	108.6	W199 I200 P252 N278 Q281 Y297	V195-W199 HydrophobicContact CG1-CB 4.08Å; V195-W199 HydrophobicContact CG1-CE3 3.97Å; V195-W199 HydrophobicContact CG2-CE3 4.34Å; V195-W199 HydrophobicContact CG2-CZ3 4.5Å; V195-I200 HydrophobicContact CG1-CD1 4.03Å; V195-I200 HydrophobicContact CG1-CG1 3.95Å; V195-P252 HydrophobicContact CG2-CB 3.7Å; V195-N278 WeakPolarHBondContact O-CB 3.15Å; V195-N278 PolarHBondContact O-ND2 2.56Å; V195-Q281 HydrophobicContact CB-CG 3.78Å; V195-Q281 HydrophobicContact CG2-CG 4.02Å; V195-Q281 VanDerWaalsContact N-NE2 3.15Å; V195-Y297 HydrophobicContact CG1-CE1 4.46Å; V195-Y297 HydrophobicContact CG2-CE1 4.01Å
196	P	92.1	Very high	89.1	Confident	14 Å²	14	41.5 Å²	41.5	9%	0.091	24%	0.242	C	C	.	.			trans	-65	148.7	-176.3	-20.5	34.4	0	0	0	111.5	L187 I194 S198 W199	L187-P196 HydrophobicContact CD1-CB 4.2Å; L187-P196 HydrophobicContact CD1-CG 3.9Å; I194-P196 VanDerWaalsContact O-CD 3.22Å; I194-P196 WeakPolarHBondContact O-CD 3.33Å; P196-S198 PolarHBondContact O-N 3.35Å; P196-W199 HydrophobicContact CG-CD2 4.45Å; P196-W199 WeakPolarHBondContact O-CB 3.47Å; P196-W199 PolarHBondContact O-N 3.43Å
197	P	91.9	Very high	87.6	Confident	7 Å²	7	47 Å²	47	5%	0.045	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-27.6	173.4	-28.8	36.5	0	0	0	114.1	P111 F113 K114 L126 W164 W199 I200	P111-P197 WeakPolarHBondContact O-CG 3.49Å; F113-P197 CarbonylContact C-O 3.59Å; F113-P197 WeakPolarHBondContact CA-O 3.35Å; K114-P197 PolarHBondContact N-O 3.39Å; L126-P197 HydrophobicContact CD1-CG 3.92Å; W164-P197 HydrophobicContact CH2-CG 4.08Å; W164-P197 HydrophobicContact CZ2-CG 3.59Å; P197-W199 PolarHBondContact O-N 2.77Å; P197-I200 PolarHBondContact O-N 2.88Å; P197-I200 VanDerWaalsContact O-O 3.13Å
198	S	88.1	Confident	85.8	Confident	46 Å²	46	51.7 Å²	51.7	32%	0.322	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.9	177.8	56.2	0	0	0	0	113.7	P196	P196-S198 PolarHBondContact O-N 3.35Å
199	W	90.8	Very high	83.5	Confident	8 Å²	8	56 Å²	56	3%	0.03	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-27.2	176.8	-68.8	11.3	0	0	0	112.3	V195 P196 P197 L242 K243 P244 L245 M250 P252 V300	V195-W199 HydrophobicContact CG1-CB 4.08Å; V195-W199 HydrophobicContact CG1-CE3 3.97Å; V195-W199 HydrophobicContact CG2-CE3 4.34Å; V195-W199 HydrophobicContact CG2-CZ3 4.5Å; P196-W199 HydrophobicContact CG-CD2 4.45Å; P196-W199 WeakPolarHBondContact O-CB 3.47Å; P196-W199 PolarHBondContact O-N 3.43Å; P197-W199 PolarHBondContact O-N 2.77Å; W199-L242 CarbonylContact O-C 3.45Å; W199-L242 VanDerWaalsContact O-CA 3.31Å; W199-L242 WeakPolarHBondContact O-CA 3.39Å; W199-K243 PolarHBondContact O-N 3.41Å; W199-P244 HydrophobicContact CD2-CB 4.02Å; W199-P244 HydrophobicContact CE3-CB 3.64Å; W199-P244 HydrophobicContact CH2-CB 4.15Å; W199-P244 HydrophobicContact CZ2-CB 4.47Å; W199-P244 HydrophobicContact CZ3-CB 3.73Å; W199-L245 HydrophobicContact CZ2-CB 4.16Å; W199-L245 WeakPolarHBondContact CZ2-O 3.43Å; W199-M250 HydrophobicContact CH2-CE 3.71Å; W199-M250 HydrophobicContact CH2-SD 3.85Å; W199-M250 HydrophobicContact CZ2-CE 3.83Å; W199-M250 HydrophobicContact CZ2-SD 3.74Å; W199-P252 HydrophobicContact CH2-CG 4.23Å; W199-P252 HydrophobicContact CZ3-CG 3.89Å; W199-V300 HydrophobicContact CZ3-CG1 4.19Å
200	I	93.1	Very high	81.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	111.9	-175.5	-53.8	177.8	0	0	0	108.3	W46 F113 K114 V195 P197 F240 L242 R280	W46-I200 HydrophobicContact CZ3-CG2 4.4Å; F113-I200 CarbonylContact C-O 3.51Å; F113-I200 WeakPolarHBondContact CA-O 3.43Å; F113-I200 HydrophobicContact CB-CB 3.95Å; F113-I200 HydrophobicContact CB-CG2 3.73Å; F113-I200 WeakPolarHBondContact CB-O 3.19Å; K114-I200 PolarHBondContact N-O 3.05Å; V195-I200 HydrophobicContact CG1-CD1 4.03Å; V195-I200 HydrophobicContact CG1-CG1 3.95Å; P197-I200 PolarHBondContact O-N 2.88Å; P197-I200 VanDerWaalsContact O-O 3.13Å; I200-F240 HydrophobicContact CG2-CD1 3.79Å; I200-F240 HydrophobicContact CG2-CE1 4.37Å; I200-L242 HydrophobicContact CG1-CD1 4.27Å; I200-L242 HydrophobicContact CG1-CG 4.26Å; I200-L242 HydrophobicContact CG2-CD1 4.42Å; I200-R280 HydrophobicContact CD1-CB 3.69Å; I200-R280 HydrophobicContact CD1-CG 4.41Å
201	I	91.4	Very high	79.3	Confident	33 Å²	33	68 Å²	68	17%	0.169	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.6	-176	-55.1	178.5	0	0	0	109.2	K114 V203 F240 I241 K243	K114-I201 WeakPolarHBondContact O-CA 3.43Å; I201-V203 HydrophobicContact CG2-CG2 4.45Å; I201-F240 WeakPolarHBondContact O-CA 3.42Å; I201-I241 PolarHBondContact N-O 2.9Å; I201-I241 PolarHBondContact O-N 3.35Å; I201-K243 HydrophobicContact CD1-CB 4.06Å; I201-K243 HydrophobicContact CD1-CD 3.54Å; I201-K243 HydrophobicContact CD1-CG 3.76Å
202	K	91.4	Very high	77	Confident	28 Å²	28	74.6 Å²	74.6	12%	0.122	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	120.9	168	-173.4	-179.9	177.1	-170.1	0	109.2	E48 A50 F113 K114 G116 P239 F240	E48-K202 WeakPolarHBondContact O-CE 3.34Å; E48-K202 PolarHBondContact O-NZ 2.88Å; A50-K202 PolarHBondContact O-NZ 3.22Å; F113-K202 HydrophobicContact CD2-CB 3.6Å; F113-K202 HydrophobicContact CD2-CD 4.36Å; F113-K202 HydrophobicContact CE2-CB 3.65Å; F113-K202 HydrophobicContact CE2-CD 3.56Å; F113-K202 HydrophobicContact CE2-CG 4.23Å; F113-K202 HydrophobicContact CZ-CD 4.04Å; K114-K202 PolarHBondContact O-N 2.86Å; G116-K202 WeakPolarHBondContact CA-O 3.36Å; G116-K202 PolarHBondContact N-O 3.36Å; K202-P239 CarbonylContact C-O 3.57Å; K202-P239 WeakPolarHBondContact CA-O 3.49Å; K202-F240 HydrophobicContact CB-CD1 4.13Å; K202-F240 HydrophobicContact CB-CE1 3.72Å; K202-F240 HydrophobicContact CB-CZ 4.22Å; K202-F240 HydrophobicContact CD-CZ 4.26Å; K202-F240 HydrophobicContact CG-CE1 4.06Å; K202-F240 HydrophobicContact CG-CZ 4.06Å
203	V	87.7	Confident	74.6	Confident	41 Å²	41	79.1 Å²	79.1	25%	0.248	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-99.7	136.8	-177.7	-173.3	0	0	0	0	109	I201 W237 P239 I241	I201-V203 HydrophobicContact CG2-CG2 4.45Å; V203-W237 WeakPolarHBondContact O-CZ2 3.34Å; V203-P239 PolarHBondContact N-O 3.04Å; V203-I241 HydrophobicContact CG2-CB 4.2Å; V203-I241 HydrophobicContact CG2-CD1 3.64Å; V203-I241 HydrophobicContact CG2-CG1 3.68Å
204	R	81.5	Confident	72.3	Confident	193 Å²	193	83.8 Å²	83.8	73%	0.728	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-78.5	145	173.6	-65.5	-174.8	-179.8	-176.8	-1.3	110.3	W237	R204-W237 PolarHBondContact O-NE1 2.77Å
205	K	77.7	Confident	69.9	Low	132 Å²	132	94.8 Å²	94.8	57%	0.574	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-62.7	126.3	174.4	-162.6	171.6	-177.9	176.7	0	109.1	Q207 W237	K205-Q207 PolarHBondContact O-N 3.38Å; K205-Q207 VanDerWaalsContact O-N 3.11Å; K205-W237 VanDerWaalsContact CA-CE2 3.43Å; K205-W237 VanDerWaalsContact CA-CZ2 3.42Å; K205-W237 HydrophobicContact CB-CD2 4.29Å; K205-W237 HydrophobicContact CB-CE3 4.43Å; K205-W237 HydrophobicContact CB-CH2 3.73Å; K205-W237 HydrophobicContact CB-CZ2 3.6Å; K205-W237 HydrophobicContact CB-CZ3 4.17Å; K205-W237 HydrophobicContact CD-CE3 4.24Å; K205-W237 HydrophobicContact CD-CH2 4.34Å; K205-W237 HydrophobicContact CD-CZ3 4.02Å; K205-W237 HydrophobicContact CG-CD2 4.01Å; K205-W237 HydrophobicContact CG-CE3 4.01Å; K205-W237 HydrophobicContact CG-CH2 4.14Å; K205-W237 HydrophobicContact CG-CZ2 4.21Å; K205-W237 HydrophobicContact CG-CZ3 4.06Å
206	P	67.7	Low	67.7	Low	98 Å²	98	106.8 Å²	106.8	64%	0.636	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-59.5	118.1	172	-17.4	28.4	0	0	0	108.1	S208	P206-S208 PolarHBondContact O-N 3.25Å
207	Q	60.3	Low	65.4	Low	187 Å²	187	116.1 Å²	116.1	87%	0.874	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-72.2	123.4	170.7	-72	-155.4	-28.7	0	0	108.3	K205 S209	K205-Q207 PolarHBondContact O-N 3.38Å; K205-Q207 VanDerWaalsContact O-N 3.11Å; Q207-S209 PolarHBondContact O-N 3.26Å
208	S	50.3	Low	63.1	Low	116 Å²	116	125.2 Å²	125.2	81%	0.811	63%	0.625	S	S	*	*			trans	-66.4	95.2	168.1	53.7	0	0	0	0	108.4	P206 L210	P206-S208 PolarHBondContact O-N 3.25Å; S208-L210 PolarHBondContact O-N 3.11Å
209	S	42.8	Very low	60.9	Low	113 Å²	113	134.7 Å²	134.7	79%	0.79	65%	0.654	S	S	*	*			trans	-74.3	98.6	176.6	67.5	0	0	0	0	110.3	Q207 K211	Q207-S209 PolarHBondContact O-N 3.26Å; S209-K211 PolarHBondContact O-N 3.2Å
210	L	49.5	Very low	58.5	Low	164 Å²	164	139.9 Å²	139.9	86%	0.859	69%	0.687	S	S	*	*			trans	-64.8	107.8	150.2	-77.5	165.1	0	0	0	108	S208	S208-L210 PolarHBondContact O-N 3.11Å
211	K	42.6	Very low	55.9	Low	200 Å²	200	144.8 Å²	144.8	87%	0.87	72%	0.721	S	S	*	*				165.8	133.3	129.4	-90.6	172.6	-178.7	-179.5	0	112.4	S209	S209-K211 PolarHBondContact O-N 3.2Å
212	N	42.9	Very low	53.6	Low	168 Å²	168	153 Å²	153	90%	0.898	76%	0.756	S	S	*	*			trans	-34	136.8	167.6	-72.4	-28.6	0	0	0	115.7
213	S	39.3	Very low	51	Low	111 Å²	111	161.6 Å²	161.6	78%	0.776	79%	0.793	S	S	*	*			trans	-151.2	100	140.7	177	0	0	0	0	108.6	R215	S213-R215 PolarHBondContact O-N 3.42Å; S213-R215 VanDerWaalsContact O-N 3.17Å
214	A	47.8	Very low	48.7	Very low	99 Å²	99	171.5 Å²	171.5	82%	0.818	83%	0.826	S	S	*	*			trans	-62.3	109.5	168	0	0	0	0	0	109.4
215	R	44.8	Very low	46.3	Very low	233 Å²	233	174 Å²	174	88%	0.879	84%	0.835	S	S	*	*			trans	-133.4	93.6	150.5	-89.6	-172.8	173.5	169.7	-2.4	109.6	S213 K217	S213-R215 PolarHBondContact O-N 3.42Å; S213-R215 VanDerWaalsContact O-N 3.17Å; R215-K217 PolarHBondContact O-N 3.23Å
216	R	48.4	Very low	44.6	Very low	252 Å²	252	172.9 Å²	172.9	95%	0.951	85%	0.851	S	S	*	*			trans	-43.2	118.5	157.9	-83.8	171.8	147.3	-179.4	-5.1	109.6
217	K	43	Very low	43	Very low	210 Å²	210	173.5 Å²	173.5	91%	0.913	86%	0.857	S	S	*	*			trans	-127.3	103.2	144.2	-95.7	-174.5	177.8	178.3	0	108.7	R215 R219	R215-K217 PolarHBondContact O-N 3.23Å; K217-R219 PolarHBondContact O-N 3.41Å
218	K	45.1	Very low	41.8	Very low	198 Å²	198	174.2 Å²	174.2	86%	0.861	86%	0.858	S	S	*	*			trans	-66.7	114.4	171.9	-163.9	-177.9	-171.4	-175.9	0	107.5
219	R	41.4	Very low	40.9	Very low	245 Å²	245	179.1 Å²	179.1	93%	0.925	87%	0.865	S	S	*	*			trans	-139.8	138	152.2	-99.4	178.4	80.6	131.8	-3.2	109.3	K217	K217-R219 PolarHBondContact O-N 3.41Å
220	T	39.3	Very low	40.4	Very low	117 Å²	117	176.5 Å²	176.5	72%	0.718	86%	0.855	S	S	*	*			trans	-92.6	157.6	-156.7	40.6	0	0	0	0	112.7
221	S	38.6	Very low	39.7	Very low	102 Å²	102	176.9 Å²	176.9	71%	0.713	86%	0.857	S	S	*	*			trans	99.1	104.9	148.2	81.4	0	0	0	0	119.5
222	F	43.2	Very low	39.4	Very low	207 Å²	207	176 Å²	176	91%	0.908	86%	0.856	S	S	*	*				38.8	111.7	127.7	-61.6	-82.6	0	0	0	120
223	K	36.8	Very low	39.1	Very low	208 Å²	208	176.3 Å²	176.3	90%	0.904	85%	0.852	S	S	*	*				-166.1	121.6	98.8	-131.8	170.7	-178.1	172.7	0	110.2
224	R	39.7	Very low	39	Very low	248 Å²	248	178.6 Å²	178.6	94%	0.936	86%	0.856	S	S	*	*			trans	-67.3	127.1	170.2	-69.3	177.5	-176.1	167.7	0.6	108.8
225	R	31.8	Very low	39.2	Very low	245 Å²	245	178.9 Å²	178.9	93%	0.925	85%	0.852	S	S	*	*			trans	-119.3	109.3	145.3	-91.9	-174	171.4	-176.4	-2.2	106.9	S227	R225-S227 PolarHBondContact O-N 3.17Å
226	A	40.5	Very low	40.3	Very low	109 Å²	109	176.3 Å²	176.3	90%	0.901	85%	0.847	S	S	*	*			trans	-67.8	117.7	165	0	0	0	0	0	107.4
227	S	34.9	Very low	41.6	Very low	111 Å²	111	167.9 Å²	167.9	78%	0.776	82%	0.815	S	S	*	*			trans	-130.7	110	166.9	-176.3	0	0	0	0	107.8	R225	R225-S227 PolarHBondContact O-N 3.17Å
228	K	34.1	Very low	43.5	Very low	202 Å²	202	164.2 Å²	164.2	88%	0.878	80%	0.796	S	S	*	*			trans	25.5	97.6	155.6	-112.9	170.9	174.4	176.4	0	115.4	G230	K228-G230 PolarHBondContact O-N 3.26Å
229	K	32.6	Very low	45.5	Very low	220 Å²	220	156.2 Å²	156.2	96%	0.957	76%	0.764	S	S	*	*			trans	-60.6	91.9	151.1	-90.4	-176.8	172	-177.5	0	107.5
230	G	31.8	Very low	48	Very low	58 Å²	58	144.8 Å²	144.8	60%	0.598	72%	0.721	S	S	*	*			trans	-74.7	139.7	157.8	0	0	0	0	0	108.5	K228 E232	K228-G230 PolarHBondContact O-N 3.26Å; G230-E232 PolarHBondContact O-N 2.86Å
231	L	35.1	Very low	50.4	Low	171 Å²	171	143 Å²	143	90%	0.895	71%	0.706	S	S	*	*			trans	-58.2	85.9	-179.5	-164	73.8	0	0	0	111	Q233	L231-Q233 VanDerWaalsContact C-N 3.32Å; L231-Q233 PolarHBondContact O-N 2.93Å
232	E	36.5	Very low	53	Low	181 Å²	181	138.8 Å²	138.8	85%	0.846	68%	0.676	S	S	*	*			trans	-73.2	94.1	165.3	-80.6	-160.7	161.3	0	0	108.2	G230 D234	G230-E232 PolarHBondContact O-N 2.86Å; E232-D234 PolarHBondContact O-N 3.36Å
233	Q	36.2	Very low	55.2	Low	175 Å²	175	135.3 Å²	135.3	82%	0.818	66%	0.66	S	S	*	*			trans	-60.4	116.4	170.2	-162.6	159	27.6	0	0	109	L231 S235	L231-Q233 VanDerWaalsContact C-N 3.32Å; L231-Q233 PolarHBondContact O-N 2.93Å; Q233-S235 PolarHBondContact O-N 3.29Å
234	D	38.4	Very low	57.5	Low	159 Å²	159	126.8 Å²	126.8	85%	0.85	63%	0.626	S	S	*	*			trans	6.5	86.5	167.4	-90.5	-28.7	0	0	0	115.5	E232 K236	E232-D234 PolarHBondContact O-N 3.36Å; D234-K236 PolarHBondContact O-N 3.43Å
235	S	51.3	Low	59.3	Low	106 Å²	106	120.6 Å²	120.6	74%	0.741	61%	0.611	S	S	*	*			trans	-73.4	76.5	172.6	53.4	0	0	0	0	110	Q233 W237	Q233-S235 PolarHBondContact O-N 3.29Å; S235-W237 PolarHBondContact O-N 2.79Å; S235-W237 VanDerWaalsContact O-N 3.08Å
236	K	67.5	Low	61.1	Low	179 Å²	179	114.6 Å²	114.6	78%	0.778	60%	0.604	S	S	*	*			trans	-50.3	114.6	164.6	-174	176.2	-177.2	178.1	0	107.4	D234 R238	D234-K236 PolarHBondContact O-N 3.43Å; K236-R238 PolarHBondContact O-N 3.13Å
237	W	75.8	Confident	62.8	Low	74 Å²	74	111.2 Å²	111.2	28%	0.28	57%	0.573	S	S	.	*			trans	-51.7	130.5	179.3	167.3	83.1	0	0	0	110.3	E48 V203 R204 K205 S235 P239	E48-W237 HydrophobicContact CB-CH2 3.94Å; E48-W237 WeakPolarHBondContact OE2-CH2 3.4Å; V203-W237 WeakPolarHBondContact O-CZ2 3.34Å; R204-W237 PolarHBondContact O-NE1 2.77Å; K205-W237 VanDerWaalsContact CA-CE2 3.43Å; K205-W237 VanDerWaalsContact CA-CZ2 3.42Å; K205-W237 HydrophobicContact CB-CD2 4.29Å; K205-W237 HydrophobicContact CB-CE3 4.43Å; K205-W237 HydrophobicContact CB-CH2 3.73Å; K205-W237 HydrophobicContact CB-CZ2 3.6Å; K205-W237 HydrophobicContact CB-CZ3 4.17Å; K205-W237 HydrophobicContact CD-CE3 4.24Å; K205-W237 HydrophobicContact CD-CH2 4.34Å; K205-W237 HydrophobicContact CD-CZ3 4.02Å; K205-W237 HydrophobicContact CG-CD2 4.01Å; K205-W237 HydrophobicContact CG-CE3 4.01Å; K205-W237 HydrophobicContact CG-CH2 4.14Å; K205-W237 HydrophobicContact CG-CZ2 4.21Å; K205-W237 HydrophobicContact CG-CZ3 4.06Å; S235-W237 PolarHBondContact O-N 2.79Å; S235-W237 VanDerWaalsContact O-N 3.08Å; W237-P239 HydrophobicContact CH2-CB 4.3Å; W237-P239 HydrophobicContact CH2-CG 4.08Å; W237-P239 HydrophobicContact CZ3-CG 4.11Å
238	R	83.4	Confident	64.5	Low	133 Å²	133	111.3 Å²	111.3	50%	0.502	57%	0.571	S	S	.	*			trans	-110.3	135.1	178.8	-62.8	-172.9	-176	-100.1	2.8	109.8	K236 F240	K236-R238 PolarHBondContact O-N 3.13Å; R238-F240 PolarHBondContact O-N 3.24Å
239	P	87.6	Confident	66.5	Low	30 Å²	30	108.5 Å²	108.5	20%	0.195	57%	0.565	C	S	.	*	S	Bend	trans	-64.2	-20.2	-179.7	-21.9	32.4	0	0	0	114.3	K202 V203 W237	K202-P239 CarbonylContact C-O 3.57Å; K202-P239 WeakPolarHBondContact CA-O 3.49Å; V203-P239 PolarHBondContact N-O 3.04Å; W237-P239 HydrophobicContact CH2-CB 4.3Å; W237-P239 HydrophobicContact CH2-CG 4.08Å; W237-P239 HydrophobicContact CZ3-CG 4.11Å
240	F	92.2	Very high	69	Low	6 Å²	6	99.8 Å²	99.8	3%	0.026	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	143.1	-178	-71.2	-87.6	0	0	0	112	W46 A50 F113 I200 I201 K202 R238 L296	W46-F240 HydrophobicContact CE3-CB 4.16Å; W46-F240 HydrophobicContact CE3-CD1 4.42Å; W46-F240 AromaticContact CE3-CD2 3.74Å; W46-F240 HydrophobicContact CE3-CD2 3.74Å; W46-F240 HydrophobicContact CE3-CE2 4.25Å; W46-F240 AromaticContact CE3-CG 3.84Å; W46-F240 HydrophobicContact CE3-CG 3.84Å; W46-F240 HydrophobicContact CZ3-CB 4.17Å; W46-F240 HydrophobicContact CZ3-CD1 4.35Å; W46-F240 HydrophobicContact CZ3-CD2 4.42Å; W46-F240 HydrophobicContact CZ3-CG 4.06Å; W46-F240 VanDerWaalsContact O-CD2 3.32Å; W46-F240 WeakPolarHBondContact O-CD2 3.12Å; W46-F240 WeakPolarHBondContact O-CE2 3.21Å; A50-F240 HydrophobicContact CB-CE2 4.05Å; A50-F240 HydrophobicContact CB-CZ 3.65Å; F113-F240 HydrophobicContact CB-CE1 4.09Å; F113-F240 HydrophobicContact CD1-CE1 4.09Å; F113-F240 AromaticContact CD2-CE1 3.94Å; F113-F240 HydrophobicContact CD2-CE1 3.94Å; F113-F240 HydrophobicContact CE2-CE1 4.38Å; F113-F240 AromaticContact CG-CE1 3.77Å; F113-F240 HydrophobicContact CG-CE1 3.77Å; I200-F240 HydrophobicContact CG2-CD1 3.79Å; I200-F240 HydrophobicContact CG2-CE1 4.37Å; I201-F240 WeakPolarHBondContact O-CA 3.42Å; K202-F240 HydrophobicContact CB-CD1 4.13Å; K202-F240 HydrophobicContact CB-CE1 3.72Å; K202-F240 HydrophobicContact CB-CZ 4.22Å; K202-F240 HydrophobicContact CD-CZ 4.26Å; K202-F240 HydrophobicContact CG-CE1 4.06Å; K202-F240 HydrophobicContact CG-CZ 4.06Å; R238-F240 PolarHBondContact O-N 3.24Å; F240-L296 HydrophobicContact CB-CD1 4.46Å
241	I	91.4	Very high	71.9	Confident	78 Å²	78	99.9 Å²	99.9	40%	0.4	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138	173.3	-58.7	-179.1	0	0	0	108.7	I201 V203	I201-I241 PolarHBondContact N-O 2.9Å; I201-I241 PolarHBondContact O-N 3.35Å; V203-I241 HydrophobicContact CG2-CB 4.2Å; V203-I241 HydrophobicContact CG2-CD1 3.64Å; V203-I241 HydrophobicContact CG2-CG1 3.68Å
242	L	91.9	Very high	74.8	Confident	15 Å²	15	91.8 Å²	91.8	8%	0.079	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.4	170.4	-86.7	66.3	0	0	0	111.2	W199 I200 L296 Y297 V300	W199-L242 CarbonylContact O-C 3.45Å; W199-L242 VanDerWaalsContact O-CA 3.31Å; W199-L242 WeakPolarHBondContact O-CA 3.39Å; I200-L242 HydrophobicContact CG1-CD1 4.27Å; I200-L242 HydrophobicContact CG1-CG 4.26Å; I200-L242 HydrophobicContact CG2-CD1 4.42Å; L242-L296 HydrophobicContact CD1-CD1 3.55Å; L242-L296 HydrophobicContact CD1-CD2 4.01Å; L242-L296 HydrophobicContact CD1-CG 3.55Å; L242-Y297 HydrophobicContact CD2-CD1 3.54Å; L242-Y297 HydrophobicContact CD2-CD2 4.24Å; L242-Y297 HydrophobicContact CD2-CE1 3.55Å; L242-Y297 HydrophobicContact CD2-CE2 4.29Å; L242-Y297 HydrophobicContact CD2-CG 3.9Å; L242-V300 HydrophobicContact CD2-CG2 3.63Å
243	K	89.6	Confident	77.7	Confident	134 Å²	134	83.2 Å²	83.2	58%	0.583	43%	0.43	S	S	*	.			trans	-124	80.8	170.8	-66.1	-163.5	-174.2	-179.6	0	109.2	W199 I201	W199-K243 PolarHBondContact O-N 3.41Å; I201-K243 HydrophobicContact CD1-CB 4.06Å; I201-K243 HydrophobicContact CD1-CD 3.54Å; I201-K243 HydrophobicContact CD1-CG 3.76Å
244	P	86.3	Confident	80.7	Confident	29 Å²	29	74.9 Å²	74.9	19%	0.188	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-67.2	150.7	179.4	29.3	-34.1	0	0	0	111.1	W199 K299	W199-P244 HydrophobicContact CD2-CB 4.02Å; W199-P244 HydrophobicContact CE3-CB 3.64Å; W199-P244 HydrophobicContact CH2-CB 4.15Å; W199-P244 HydrophobicContact CZ2-CB 4.47Å; W199-P244 HydrophobicContact CZ3-CB 3.73Å; P244-K299 WeakPolarHBondContact CG-O 3.34Å
245	L	76.9	Confident	83.5	Confident	117 Å²	117	67.3 Å²	67.3	61%	0.613	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-94.8	120.8	168.2	-67.1	173.3	0	0	0	107.6	W199 S247	W199-L245 HydrophobicContact CZ2-CB 4.16Å; W199-L245 WeakPolarHBondContact CZ2-O 3.43Å; L245-S247 PolarHBondContact O-N 2.68Å
246	P	69.8	Low	85.7	Confident	120 Å²	120	62.3 Å²	62.3	78%	0.779	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-59.6	123.9	179.6	-21.4	31.8	0	0	0	110.7
247	S	76.2	Confident	87.1	Confident	37 Å²	37	53.8 Å²	53.8	26%	0.259	28%	0.278	S	S	.	.			trans	-145.3	124.4	170.1	176	0	0	0	0	108.5	L245 L249 M250	L245-S247 PolarHBondContact O-N 2.68Å; S247-L249 PolarHBondContact O-N 2.8Å; S247-M250 PolarHBondContact O-N 3.14Å
248	P	71.1	Confident	87.9	Confident	113 Å²	113	52.3 Å²	52.3	73%	0.734	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-20	-179.8	28.4	-33.9	0	0	0	112.5	N302	P248-N302 PolarHBondContact O-ND2 2.86Å
249	L	76.1	Confident	88.1	Confident	144 Å²	144	46.7 Å²	46.7	75%	0.754	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-19.3	-179.2	-60.7	175	0	0	0	113	S247	S247-L249 PolarHBondContact O-N 2.8Å
250	M	84.6	Confident	87.9	Confident	36 Å²	36	53.2 Å²	53.2	18%	0.177	28%	0.282	C	S	.	.			trans	-85.1	134.7	179.6	-66.5	-173.6	73.3	0	0	110	W199 S247 N302	W199-M250 HydrophobicContact CH2-CE 3.71Å; W199-M250 HydrophobicContact CH2-SD 3.85Å; W199-M250 HydrophobicContact CZ2-CE 3.83Å; W199-M250 HydrophobicContact CZ2-SD 3.74Å; S247-M250 PolarHBondContact O-N 3.14Å; M250-N302 VanDerWaalsContact O-CB 3.23Å; M250-N302 WeakPolarHBondContact O-CB 3.42Å; M250-N302 PolarHBondContact O-ND2 2.75Å
251	K	93.3	Very high	87.5	Confident	61 Å²	61	53.8 Å²	53.8	27%	0.265	29%	0.287	S	S	.	.			trans	-127.7	71.4	173.9	-65	172	179.8	169.6	0	108.9	G192 V253 N302 E366	G192-K251 CarbonylContact O-C 3.54Å; G192-K251 VanDerWaalsContact O-C 3.29Å; G192-K251 PolarHBondContact O-N 3.31Å; K251-V253 PolarHBondContact O-N 3.01Å; K251-N302 WeakPolarHBondContact CA-O 3.37Å; K251-E366 HydrophobicContact CB-CG 4.47Å; K251-E366 HydrophobicContact CD-CG 4.05Å; K251-E366 WeakPolarHBondContact CD-O 3.38Å; K251-E366 PolarHBondContact NZ-O 3.32Å
252	P	95.6	Very high	86.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.273	C	S	.	.			trans	-57.3	138.1	-175.1	-22.2	34.3	0	0	0	111.5	V195 W199 V300 P301 L303 R304	V195-P252 HydrophobicContact CG2-CB 3.7Å; W199-P252 HydrophobicContact CH2-CG 4.23Å; W199-P252 HydrophobicContact CZ3-CG 3.89Å; P252-V300 HydrophobicContact CB-CG1 3.94Å; P252-V300 HydrophobicContact CG-CG1 3.72Å; P252-P301 WeakPolarHBondContact CD-O 3.45Å; P252-L303 HydrophobicContact CB-CD1 4.42Å; P252-R304 PolarHBondContact O-N 3.31Å
253	V	97.8	Very high	85.8	Confident	1 Å²	1	52 Å²	52	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.3	-178.2	178.4	0	0	0	0	110.7	V193 K251 V255 Q281 R304 L306 L362 V365	V193-V253 HydrophobicContact CB-CB 4.25Å; V193-V253 HydrophobicContact CB-CG2 3.74Å; V193-V253 HydrophobicContact CG1-CG2 3.71Å; V193-V253 PolarHBondContact O-N 2.89Å; K251-V253 PolarHBondContact O-N 3.01Å; V253-V255 HydrophobicContact CG1-CG2 3.9Å; V253-Q281 PolarHBondContact O-NE2 3.2Å; V253-R304 CarbonylContact C-O 3.55Å; V253-R304 WeakPolarHBondContact CA-O 3.18Å; V253-R304 HydrophobicContact CG2-CB 4.37Å; V253-L306 HydrophobicContact CG1-CB 3.97Å; V253-L362 HydrophobicContact CG1-CD2 4.33Å; V253-V365 HydrophobicContact CG1-CG1 4.13Å; V253-V365 HydrophobicContact CG2-CG1 3.74Å
254	L	97.5	Very high	85.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.6	169.1	-169.4	64.5	0	0	0	108.8	F256 F283 L294 Y297 L303 R304 I305 L306	L254-F256 HydrophobicContact CD2-CE2 3.54Å; L254-F256 HydrophobicContact CD2-CZ 3.48Å; L254-F256 VanDerWaalsContact CD2-CZ 3.48Å; L254-F256 HydrophobicContact CG-CE2 3.78Å; L254-F256 HydrophobicContact CG-CZ 3.88Å; L254-F283 HydrophobicContact CD1-CD2 3.68Å; L254-F283 HydrophobicContact CD1-CE2 3.34Å; L254-F283 HydrophobicContact CD1-CZ 4.43Å; L254-F283 HydrophobicContact CG-CD2 4.39Å; L254-F283 HydrophobicContact CG-CE2 4.43Å; L254-L294 HydrophobicContact CD2-CD2 4.09Å; L254-Y297 HydrophobicContact CD1-CD1 4.17Å; L254-Y297 HydrophobicContact CD1-CD2 4Å; L254-Y297 HydrophobicContact CD1-CE1 4.14Å; L254-Y297 HydrophobicContact CD1-CE2 3.96Å; L254-Y297 HydrophobicContact CD1-CG 4.11Å; L254-Y297 HydrophobicContact CD2-CG 4.35Å; L254-L303 HydrophobicContact CB-CD1 4.25Å; L254-R304 PolarHBondContact N-O 3.21Å; L254-I305 HydrophobicContact CB-CG1 4.38Å; L254-I305 CarbonylContact O-C 3.55Å; L254-I305 WeakPolarHBondContact O-CA 3.42Å; L254-L306 PolarHBondContact O-N 3.46Å
255	V	98.1	Very high	85	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.1	-174.8	-173.1	0	0	0	0	109.8	V253 V257 F273 L277 Q281 V282 F283 L306	V253-V255 HydrophobicContact CG1-CG2 3.9Å; V255-V257 HydrophobicContact CG1-CG2 3.71Å; V255-F273 HydrophobicContact CG1-CD1 4.45Å; V255-F273 HydrophobicContact CG1-CD2 3.77Å; V255-F273 HydrophobicContact CG1-CE2 4Å; V255-F273 HydrophobicContact CG1-CG 4.03Å; V255-F273 HydrophobicContact CG1-CZ 4.45Å; V255-F273 HydrophobicContact CG2-CD1 4.27Å; V255-F273 HydrophobicContact CG2-CG 4.43Å; V255-L277 HydrophobicContact CG2-CD1 3.5Å; V255-L277 VanDerWaalsContact CG2-CD1 3.5Å; V255-Q281 PolarHBondContact N-O 3.04Å; V255-V282 HydrophobicContact CB-CG1 4.49Å; V255-V282 WeakPolarHBondContact O-CA 3.34Å; V255-F283 PolarHBondContact O-N 2.89Å; V255-L306 HydrophobicContact CG1-CB 4.44Å; V255-L306 HydrophobicContact CG1-CD2 4.23Å; V255-L306 HydrophobicContact CG1-CG 4.43Å; V255-L306 HydrophobicContact CG2-CB 4.28Å; V255-L306 HydrophobicContact CG2-CD2 4.33Å
256	F	97.8	Very high	85.6	Confident	1 Å²	1	46.3 Å²	46.3	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.5	171.3	-67.5	-74	0	0	0	109.5	L254 F283 L285 L290 A293 L294 I305 L306 C308 I317	L254-F256 HydrophobicContact CD2-CE2 3.54Å; L254-F256 HydrophobicContact CD2-CZ 3.48Å; L254-F256 VanDerWaalsContact CD2-CZ 3.48Å; L254-F256 HydrophobicContact CG-CE2 3.78Å; L254-F256 HydrophobicContact CG-CZ 3.88Å; F256-F283 HydrophobicContact CD1-CB 3.52Å; F256-F283 HydrophobicContact CD1-CG 4.22Å; F256-F283 HydrophobicContact CE1-CB 3.7Å; F256-F283 HydrophobicContact CE1-CD2 4.16Å; F256-F283 AromaticContact CE1-CG 3.9Å; F256-F283 HydrophobicContact CE1-CG 3.9Å; F256-L285 HydrophobicContact CB-CD1 4.03Å; F256-L285 HydrophobicContact CB-CD2 3.97Å; F256-L285 HydrophobicContact CB-CG 3.98Å; F256-L285 HydrophobicContact CD1-CD2 3.77Å; F256-L285 HydrophobicContact CD1-CG 4.49Å; F256-L285 HydrophobicContact CG-CD2 4.16Å; F256-L290 HydrophobicContact CD1-CD1 3.73Å; F256-L290 HydrophobicContact CD2-CD1 4.16Å; F256-L290 HydrophobicContact CE1-CD1 3.39Å; F256-L290 HydrophobicContact CE2-CD1 3.84Å; F256-L290 HydrophobicContact CG-CD1 4.11Å; F256-L290 HydrophobicContact CZ-CD1 3.45Å; F256-L290 VanDerWaalsContact CZ-CD1 3.45Å; F256-A293 HydrophobicContact CE1-CB 3.93Å; F256-A293 HydrophobicContact CZ-CB 4.05Å; F256-L294 HydrophobicContact CE2-CD2 3.97Å; F256-L294 HydrophobicContact CZ-CD2 4.02Å; F256-L294 HydrophobicContact CZ-CG 4.14Å; F256-I305 HydrophobicContact CD2-CG2 3.67Å; F256-I305 HydrophobicContact CE2-CG2 3.95Å; F256-L306 PolarHBondContact N-O 2.93Å; F256-C308 PolarHBondContact O-N 3.17Å; F256-I317 HydrophobicContact CB-CD1 3.86Å; F256-I317 HydrophobicContact CD2-CD1 4.06Å; F256-I317 HydrophobicContact CD2-CG1 4.47Å; F256-I317 HydrophobicContact CG-CD1 4.21Å
257	V	95.9	Very high	86.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.3	-177.5	-171.3	0	0	0	0	109.9	V255 P259 G266 L270 F273 V282 F283 L285 C308	V255-V257 HydrophobicContact CG1-CG2 3.71Å; V257-P259 WeakPolarHBondContact O-CD 3.39Å; V257-G266 VanDerWaalsContact CG1-O 3.25Å; V257-G266 WeakPolarHBondContact CG1-O 3.48Å; V257-L270 HydrophobicContact CB-CD1 3.81Å; V257-L270 HydrophobicContact CG1-CB 4.47Å; V257-L270 HydrophobicContact CG1-CD1 4.48Å; V257-L270 HydrophobicContact CG2-CD1 3.94Å; V257-F273 HydrophobicContact CG2-CD2 4.3Å; V257-V282 HydrophobicContact CG2-CG1 4.43Å; V257-F283 PolarHBondContact N-O 2.88Å; V257-L285 PolarHBondContact O-N 3.36Å; V257-C308 HydrophobicContact CB-CB 4.28Å; V257-C308 HydrophobicContact CG1-CB 4.08Å; V257-C308 HydrophobicContact CG2-CB 4.1Å
258	N	92.4	Very high	87.2	Confident	43 Å²	43	45.4 Å²	45.4	23%	0.23	25%	0.251	C	S	.	.			trans	-89.1	106	163.9	-176.7	-13	0	0	0	108.9	K260 S261 L285 C308	N258-K260 PolarHBondContact O-N 2.76Å; N258-K260 PolarHBondContact OD1-N 2.94Å; N258-S261 WeakPolarHBondContact CB-OG 3.48Å; N258-S261 PolarHBondContact ND2-OG 2.89Å; N258-S261 PolarHBondContact O-N 2.85Å; N258-L285 HydrophobicContact CB-CD1 4.37Å; N258-C308 PolarHBondContact N-O 3.29Å
259	P	88.7	Confident	88.3	Confident	16 Å²	16	40.1 Å²	40.1	10%	0.104	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-26	-172.3	-21.1	32.8	0	0	0	114.2	V257 S261 A267 D284	V257-P259 WeakPolarHBondContact O-CD 3.39Å; P259-S261 VanDerWaalsContact C-N 3.33Å; P259-A267 HydrophobicContact CB-CB 4.26Å; P259-A267 PolarHBondContact O-N 2.95Å; P259-D284 WeakPolarHBondContact CD-OD1 3.45Å; P259-D284 VanDerWaalsContact CG-CG 3.43Å; P259-D284 WeakPolarHBondContact CG-OD1 3.36Å
260	K	83.2	Confident	89.1	Confident	166 Å²	166	33.9 Å²	33.9	72%	0.722	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-15.1	-178.1	-61.9	-176.3	178.5	-177.7	0	113	N258	N258-K260 PolarHBondContact O-N 2.76Å; N258-K260 PolarHBondContact OD1-N 2.94Å
261	S	82.8	Confident	89.4	Confident	19 Å²	19	34.6 Å²	34.6	13%	0.133	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	151.9	-179	-61.5	0	0	0	0	112.4	N258 P259 Q265 G266	N258-S261 WeakPolarHBondContact CB-OG 3.48Å; N258-S261 PolarHBondContact ND2-OG 2.89Å; N258-S261 PolarHBondContact O-N 2.85Å; P259-S261 VanDerWaalsContact C-N 3.33Å; S261-Q265 PolarHBondContact O-N 3.49Å; S261-G266 PolarHBondContact O-N 3.02Å; S261-G266 VanDerWaalsContact O-N 3.16Å
262	G	75.3	Confident	89.5	Confident	10 Å²	10	34 Å²	34	10%	0.103	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	29.9	174.6	0	0	0	0	0	114.9	Q265 L337	G262-Q265 WeakPolarHBondContact O-CB 3.34Å; G262-Q265 VanDerWaalsContact O-CD 3.29Å; G262-Q265 WeakPolarHBondContact O-CG 3.46Å; G262-Q265 PolarHBondContact O-N 3.31Å; G262-Q265 PolarHBondContact O-NE2 3.48Å; G262-L337 WeakPolarHBondContact CA-O 3.36Å; G262-L337 PolarHBondContact N-O 2.86Å
263	G	73.7	Confident	89.6	Confident	45 Å²	45	34 Å²	34	46%	0.464	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	47.5	-175.5	0	0	0	0	0	112	Q265 N427	G263-Q265 VanDerWaalsContact C-N 3.26Å; G263-Q265 PolarHBondContact O-N 2.95Å; G263-N427 WeakPolarHBondContact CA-O 3.43Å
264	N	74.3	Confident	89.5	Confident	115 Å²	115	34.3 Å²	34.3	62%	0.615	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	69	7.9	-175.4	-57.4	-37.2	0	0	0	116.4	G266 A267	N264-G266 PolarHBondContact O-N 3.33Å; N264-A267 PolarHBondContact O-N 3.04Å
265	Q	84.4	Confident	89.3	Confident	45 Å²	45	37 Å²	37	21%	0.21	20%	0.197	C	C	.	.	H	α-helix	trans	-57.8	-31.4	170.3	-75.4	175.9	62.7	0	0	112.5	S261 G262 G263 A267 K268 L269	S261-Q265 PolarHBondContact O-N 3.49Å; G262-Q265 WeakPolarHBondContact O-CB 3.34Å; G262-Q265 VanDerWaalsContact O-CD 3.29Å; G262-Q265 WeakPolarHBondContact O-CG 3.46Å; G262-Q265 PolarHBondContact O-N 3.31Å; G262-Q265 PolarHBondContact O-NE2 3.48Å; G263-Q265 VanDerWaalsContact C-N 3.26Å; G263-Q265 PolarHBondContact O-N 2.95Å; Q265-A267 VanDerWaalsContact C-N 3.33Å; Q265-A267 PolarHBondContact O-N 3.01Å; Q265-K268 WeakPolarHBondContact O-CB 3.5Å; Q265-K268 PolarHBondContact O-N 3.35Å; Q265-L269 PolarHBondContact O-N 3.49Å
266	G	90	Very high	89.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-55.8	-43	176.4	0	0	0	0	0	113.4	V257 S261 N264 K268 L269 L270	V257-G266 VanDerWaalsContact CG1-O 3.25Å; V257-G266 WeakPolarHBondContact CG1-O 3.48Å; S261-G266 PolarHBondContact O-N 3.02Å; S261-G266 VanDerWaalsContact O-N 3.16Å; N264-G266 PolarHBondContact O-N 3.33Å; G266-K268 PolarHBondContact O-N 3.29Å; G266-L269 PolarHBondContact O-N 2.88Å; G266-L270 PolarHBondContact O-N 3.42Å
267	A	88.8	Confident	89.2	Confident	36 Å²	36	37.7 Å²	37.7	30%	0.298	20%	0.2	S	C	.	.	H	α-helix	trans	-64.4	-40.9	178.5	0	0	0	0	0	112.5	P259 N264 Q265 L270 H271	P259-A267 HydrophobicContact CB-CB 4.26Å; P259-A267 PolarHBondContact O-N 2.95Å; N264-A267 PolarHBondContact O-N 3.04Å; Q265-A267 VanDerWaalsContact C-N 3.33Å; Q265-A267 PolarHBondContact O-N 3.01Å; A267-L270 WeakPolarHBondContact O-CB 3.42Å; A267-L270 PolarHBondContact O-N 2.81Å; A267-H271 PolarHBondContact O-N 3.31Å
268	K	89.8	Confident	89.2	Confident	103 Å²	103	37.7 Å²	37.7	45%	0.448	20%	0.2	S	C	.	.	H	α-helix	trans	-61.4	-47.2	174.5	-176.4	-173	175.5	-166.8	0	110.6	Q265 G266 L270 H271 M272 D355	Q265-K268 WeakPolarHBondContact O-CB 3.5Å; Q265-K268 PolarHBondContact O-N 3.35Å; G266-K268 PolarHBondContact O-N 3.29Å; K268-L270 PolarHBondContact O-N 3.12Å; K268-H271 PolarHBondContact O-N 3.16Å; K268-M272 HydrophobicContact CD-SD 4.5Å; K268-M272 HydrophobicContact CG-SD 4Å; K268-M272 WeakPolarHBondContact O-CG 3.35Å; K268-M272 PolarHBondContact O-N 3.23Å; K268-M272 VanDerWaalsContact O-N 3.11Å; K268-D355 IonicContact NZ-OD1 2.73Å; K268-D355 PolarHBondContact NZ-OD1 3.29Å; K268-D355 IonicContact NZ-OD2 3.4Å; K268-D355 PolarHBondContact NZ-OD2 3.31Å
269	L	94	Very high	89.4	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-61.7	-41.4	179.3	-80.9	168.4	0	0	0	112.9	Q265 G266 H271 M272 F273 L335 L337 Y353 V358	Q265-L269 PolarHBondContact O-N 3.49Å; G266-L269 PolarHBondContact O-N 2.88Å; L269-H271 VanDerWaalsContact C-N 3.25Å; L269-H271 PolarHBondContact O-N 3.17Å; L269-M272 HydrophobicContact CD2-SD 4.47Å; L269-M272 WeakPolarHBondContact O-CB 3.46Å; L269-M272 PolarHBondContact O-N 3.03Å; L269-F273 HydrophobicContact CB-CD2 4.33Å; L269-F273 HydrophobicContact CB-CE2 4.15Å; L269-F273 HydrophobicContact CD2-CE2 4.02Å; L269-F273 HydrophobicContact CD2-CZ 4.49Å; L269-F273 WeakPolarHBondContact O-CD2 3.14Å; L269-F273 PolarHBondContact O-N 2.83Å; L269-L335 HydrophobicContact CD1-CD2 3.64Å; L269-L335 HydrophobicContact CD2-CD2 4.18Å; L269-L337 HydrophobicContact CD1-CD1 3.78Å; L269-L337 HydrophobicContact CD1-CD2 3.63Å; L269-L337 HydrophobicContact CD1-CG 4.27Å; L269-Y353 HydrophobicContact CD1-CD1 4.06Å; L269-Y353 HydrophobicContact CD1-CE1 4Å; L269-Y353 HydrophobicContact CD2-CE1 3.86Å; L269-Y353 HydrophobicContact CD2-CE2 4.36Å; L269-Y353 HydrophobicContact CG-CE1 4.13Å; L269-V358 HydrophobicContact CD2-CG1 3.49Å; L269-V358 VanDerWaalsContact CD2-CG1 3.49Å
270	L	93	Very high	89.7	Confident	14 Å²	14	35.3 Å²	35.3	7%	0.073	19%	0.186	C	C	.	.	H	α-helix	trans	-51	-48.3	174.7	-168	79.9	0	0	0	110.7	V257 G266 A267 K268 M272 F273 M274 V282 D284	V257-L270 HydrophobicContact CB-CD1 3.81Å; V257-L270 HydrophobicContact CG1-CB 4.47Å; V257-L270 HydrophobicContact CG1-CD1 4.48Å; V257-L270 HydrophobicContact CG2-CD1 3.94Å; G266-L270 PolarHBondContact O-N 3.42Å; A267-L270 WeakPolarHBondContact O-CB 3.42Å; A267-L270 PolarHBondContact O-N 2.81Å; K268-L270 PolarHBondContact O-N 3.12Å; L270-M272 VanDerWaalsContact C-N 3.34Å; L270-M272 PolarHBondContact O-N 3.4Å; L270-F273 PolarHBondContact O-N 2.85Å; L270-M274 HydrophobicContact CD1-CE 4.28Å; L270-M274 HydrophobicContact CD2-CE 4.12Å; L270-M274 HydrophobicContact CG-CE 3.91Å; L270-M274 VanDerWaalsContact O-CG 3.3Å; L270-M274 WeakPolarHBondContact O-CG 3.45Å; L270-M274 PolarHBondContact O-N 3.29Å; L270-V282 HydrophobicContact CD1-CG1 3.65Å; L270-V282 HydrophobicContact CG-CG1 4.31Å; L270-D284 HydrophobicContact CD1-CB 4.21Å; L270-D284 HydrophobicContact CD2-CB 4.27Å
271	H	92.3	Very high	90.3	Very high	51 Å²	51	27.4 Å²	27.4	24%	0.236	15%	0.152	C	C	.	.	H	α-helix	trans	-73	-22.7	179.1	-55.9	162.3	0	0	0	114	T58 A88 K91 A267 K268 L269 W275	T58-H271 WeakPolarHBondContact CG2-CE1 3.26Å; T58-H271 VanDerWaalsContact CG2-NE2 3.28Å; T58-H271 WeakPolarHBondContact CG2-NE2 3.39Å; A88-H271 HydrophobicContact CB-CB 4.25Å; K91-H271 PolarHBondContact NZ-O 3.08Å; A267-H271 PolarHBondContact O-N 3.31Å; K268-H271 PolarHBondContact O-N 3.16Å; L269-H271 VanDerWaalsContact C-N 3.25Å; L269-H271 PolarHBondContact O-N 3.17Å; H271-W275 PolarHBondContact O-N 2.98Å
272	M	94.3	Very high	91	Very high	47 Å²	47	26.8 Å²	26.8	23%	0.232	15%	0.148	C	C	.	.	H	α-helix	trans	-77.4	-42.2	174.7	-69.2	172.6	73.7	0	0	110.7	K268 L269 L270 W275 I276 V358	K268-M272 HydrophobicContact CD-SD 4.5Å; K268-M272 HydrophobicContact CG-SD 4Å; K268-M272 WeakPolarHBondContact O-CG 3.35Å; K268-M272 PolarHBondContact O-N 3.23Å; K268-M272 VanDerWaalsContact O-N 3.11Å; L269-M272 HydrophobicContact CD2-SD 4.47Å; L269-M272 WeakPolarHBondContact O-CB 3.46Å; L269-M272 PolarHBondContact O-N 3.03Å; L270-M272 VanDerWaalsContact C-N 3.34Å; L270-M272 PolarHBondContact O-N 3.4Å; M272-W275 WeakPolarHBondContact O-CB 3.16Å; M272-W275 PolarHBondContact O-N 3.46Å; M272-I276 PolarHBondContact O-N 3.17Å; M272-V358 HydrophobicContact CB-CG1 3.92Å; M272-V358 HydrophobicContact CB-CG2 3.91Å; M272-V358 HydrophobicContact CE-CG1 3.97Å; M272-V358 HydrophobicContact CE-CG2 4.07Å; M272-V358 HydrophobicContact SD-CG1 4.48Å
273	F	97.1	Very high	91.9	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-66	-43	174.3	-71.6	-61.8	0	0	0	112.1	V255 V257 L269 L270 W275 I276 L277 V282 L306 L335 V358 L362	V255-F273 HydrophobicContact CG1-CD1 4.45Å; V255-F273 HydrophobicContact CG1-CD2 3.77Å; V255-F273 HydrophobicContact CG1-CE2 4Å; V255-F273 HydrophobicContact CG1-CG 4.03Å; V255-F273 HydrophobicContact CG1-CZ 4.45Å; V255-F273 HydrophobicContact CG2-CD1 4.27Å; V255-F273 HydrophobicContact CG2-CG 4.43Å; V257-F273 HydrophobicContact CG2-CD2 4.3Å; L269-F273 HydrophobicContact CB-CD2 4.33Å; L269-F273 HydrophobicContact CB-CE2 4.15Å; L269-F273 HydrophobicContact CD2-CE2 4.02Å; L269-F273 HydrophobicContact CD2-CZ 4.49Å; L269-F273 WeakPolarHBondContact O-CD2 3.14Å; L269-F273 PolarHBondContact O-N 2.83Å; L270-F273 PolarHBondContact O-N 2.85Å; F273-W275 PolarHBondContact O-N 2.92Å; F273-I276 PolarHBondContact O-N 3.37Å; F273-I276 VanDerWaalsContact O-N 3.15Å; F273-L277 HydrophobicContact CD1-CD1 4.41Å; F273-L277 WeakPolarHBondContact O-CB 3.36Å; F273-L277 PolarHBondContact O-N 3.01Å; F273-V282 HydrophobicContact CB-CG1 3.93Å; F273-V282 HydrophobicContact CB-CG2 3.74Å; F273-L306 HydrophobicContact CE1-CD2 3.84Å; F273-L306 HydrophobicContact CE2-CD2 4.39Å; F273-L306 HydrophobicContact CZ-CD2 3.59Å; F273-L335 HydrophobicContact CE2-CD2 4.28Å; F273-L335 HydrophobicContact CZ-CD2 4.24Å; F273-V358 HydrophobicContact CD1-CB 4.33Å; F273-V358 HydrophobicContact CD1-CG1 4.45Å; F273-V358 HydrophobicContact CE1-CB 3.93Å; F273-V358 HydrophobicContact CE1-CG1 3.98Å; F273-V358 HydrophobicContact CE2-CG1 4.28Å; F273-V358 HydrophobicContact CZ-CB 4.32Å; F273-V358 HydrophobicContact CZ-CG1 3.89Å; F273-L362 HydrophobicContact CD1-CD2 4.36Å; F273-L362 HydrophobicContact CE1-CD2 4.13Å; F273-L362 HydrophobicContact CE1-CG 4.24Å
274	M	95.7	Very high	92.9	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.039	13%	0.131	C	C	.	.	H	α-helix	trans	-61.6	-26.5	176.4	-72.3	177.1	177	0	0	113.4	L56 A88 K110 L270 P279 V282	L56-M274 HydrophobicContact CD1-SD 4Å; A88-M274 HydrophobicContact CB-CB 4.21Å; A88-M274 HydrophobicContact CB-SD 4.03Å; K110-M274 PolarHBondContact NZ-O 2.87Å; L270-M274 HydrophobicContact CD1-CE 4.28Å; L270-M274 HydrophobicContact CD2-CE 4.12Å; L270-M274 HydrophobicContact CG-CE 3.91Å; L270-M274 VanDerWaalsContact O-CG 3.3Å; L270-M274 WeakPolarHBondContact O-CG 3.45Å; L270-M274 PolarHBondContact O-N 3.29Å; M274-P279 HydrophobicContact CB-CB 4.46Å; M274-P279 HydrophobicContact CB-CG 4.49Å; M274-P279 HydrophobicContact CG-CB 4.27Å; M274-V282 HydrophobicContact CE-CB 4.41Å; M274-V282 HydrophobicContact CE-CG1 4.4Å; M274-V282 HydrophobicContact CG-CB 3.91Å; M274-V282 HydrophobicContact CG-CG1 4.09Å; M274-V282 HydrophobicContact CG-CG2 4.14Å
275	W	94.8	Very high	93.8	Very high	57 Å²	57	21.4 Å²	21.4	22%	0.216	11%	0.105	C	C	.	.	H	α-helix	trans	-69.5	-48.8	174.5	167.4	-119.9	0	0	0	111.2	A88 A89 K91 K110 K166 H271 M272 F273	A88-W275 WeakPolarHBondContact O-CA 3.42Å; A88-W275 PolarHBondContact O-N 3.4Å; A89-W275 VanDerWaalsContact O-CE3 3.23Å; K91-W275 HydrophobicContact CB-CE3 4.22Å; K91-W275 HydrophobicContact CB-CZ3 4.27Å; K91-W275 VanDerWaalsContact CE-CB 3.45Å; K91-W275 HydrophobicContact CG-CD2 3.61Å; K91-W275 HydrophobicContact CG-CE3 3.43Å; K91-W275 VanDerWaalsContact CG-CE3 3.43Å; K91-W275 HydrophobicContact CG-CG 4.1Å; K91-W275 HydrophobicContact CG-CZ3 3.96Å; K110-W275 PolarHBondContact NZ-O 2.89Å; K166-W275 HydrophobicContact CD-CH2 4.31Å; K166-W275 HydrophobicContact CD-CZ2 3.78Å; K166-W275 VanDerWaalsContact NZ-CZ2 3.31Å; K166-W275 PolarHBondContact NZ-O 2.97Å; H271-W275 PolarHBondContact O-N 2.98Å; M272-W275 WeakPolarHBondContact O-CB 3.16Å; M272-W275 PolarHBondContact O-N 3.46Å; F273-W275 PolarHBondContact O-N 2.92Å
276	I	95.2	Very high	94	Very high	16 Å²	16	22.8 Å²	22.8	8%	0.082	12%	0.119	C	C	.	.	H	α-helix	trans	-78.9	-52.6	-176.1	-61.2	-172.9	0	0	0	111.4	H190 M272 F273 V358 L362	H190-I276 HydrophobicContact CB-CG2 4.28Å; M272-I276 PolarHBondContact O-N 3.17Å; F273-I276 PolarHBondContact O-N 3.37Å; F273-I276 VanDerWaalsContact O-N 3.15Å; I276-V358 HydrophobicContact CD1-CB 4.44Å; I276-V358 HydrophobicContact CD1-CG2 3.4Å; I276-V358 VanDerWaalsContact CD1-CG2 3.4Å; I276-V358 HydrophobicContact CG1-CG2 4.36Å; I276-L362 HydrophobicContact CB-CD1 4.34Å; I276-L362 HydrophobicContact CG2-CD1 3.69Å
277	L	97.3	Very high	93.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	-82.4	176.6	-176.6	-59.7	178.8	0	0	0	111.9	K110 V193 I194 V255 F273 P279 V282 L362	K110-L277 PolarHBondContact NZ-O 3.33Å; V193-L277 HydrophobicContact CG2-CD2 3.98Å; I194-L277 HydrophobicContact CG1-CD2 3.84Å; V255-L277 HydrophobicContact CG2-CD1 3.5Å; V255-L277 VanDerWaalsContact CG2-CD1 3.5Å; F273-L277 HydrophobicContact CD1-CD1 4.41Å; F273-L277 WeakPolarHBondContact O-CB 3.36Å; F273-L277 PolarHBondContact O-N 3.01Å; L277-P279 WeakPolarHBondContact O-CD 3.47Å; L277-V282 HydrophobicContact CB-CG2 4.32Å; L277-V282 HydrophobicContact CD1-CG2 4.31Å; L277-L362 HydrophobicContact CD1-CD2 4.12Å; L277-L362 HydrophobicContact CD2-CD1 3.92Å; L277-L362 HydrophobicContact CD2-CD2 4.3Å; L277-L362 HydrophobicContact CG-CD1 4.19Å
278	N	96.9	Very high	93.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.146	C	C	.	.			trans	-66.8	126.3	160.9	-171.4	-25.5	0	0	0	108.2	T112 W164 V195 R280 Q281	T112-N278 WeakPolarHBondContact CB-OD1 3.45Å; T112-N278 PolarHBondContact O-ND2 3.21Å; W164-N278 HydrophobicContact CH2-CB 3.74Å; W164-N278 HydrophobicContact CZ3-CB 4.12Å; V195-N278 WeakPolarHBondContact O-CB 3.15Å; V195-N278 PolarHBondContact O-ND2 2.56Å; N278-R280 PolarHBondContact O-N 3.34Å; N278-R280 PolarHBondContact OD1-N 2.74Å; N278-R280 VanDerWaalsContact OD1-N 3.16Å; N278-Q281 HydrophobicContact CB-CG 4.18Å; N278-Q281 VanDerWaalsContact CB-OE1 3.29Å; N278-Q281 WeakPolarHBondContact O-CB 3.48Å; N278-Q281 PolarHBondContact O-N 3.29Å
279	P	96.1	Very high	93.1	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.013	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-52	-27.3	177.9	-28.8	34.7	0	0	0	113.9	V44 L56 A89 T112 M274 L277 Q281 V282	V44-P279 HydrophobicContact CG2-CB 3.79Å; L56-P279 HydrophobicContact CD1-CB 3.74Å; L56-P279 HydrophobicContact CD1-CG 4.21Å; A89-P279 HydrophobicContact CB-CG 3.75Å; T112-P279 HydrophobicContact CG2-CB 4.43Å; T112-P279 HydrophobicContact CG2-CG 3.99Å; M274-P279 HydrophobicContact CB-CB 4.46Å; M274-P279 HydrophobicContact CB-CG 4.49Å; M274-P279 HydrophobicContact CG-CB 4.27Å; L277-P279 WeakPolarHBondContact O-CD 3.47Å; P279-Q281 PolarHBondContact O-N 3.31Å; P279-V282 PolarHBondContact O-N 2.98Å
280	R	95.5	Very high	92.9	Very high	6 Å²	6	25.1 Å²	25.1	2%	0.023	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-70.5	-6.4	175.2	-75.7	-179.3	-172.5	-74.2	-3.3	114.9	V44 D45 W46 T112 I200 N278 F283 Y297	V44-R280 HydrophobicContact CG1-CG 3.61Å; D45-R280 VanDerWaalsContact O-CZ 3.29Å; D45-R280 PolarHBondContact O-NH1 2.79Å; D45-R280 PolarHBondContact O-NH2 3.37Å; W46-R280 VanDerWaalsContact CE3-NH1 3.29Å; W46-R280 HydrophobicContact CH2-CB 3.57Å; W46-R280 HydrophobicContact CH2-CG 3.73Å; W46-R280 HydrophobicContact CZ2-CB 3.61Å; W46-R280 HydrophobicContact CZ2-CG 3.72Å; W46-R280 VanDerWaalsContact CZ2-O 3.26Å; W46-R280 WeakPolarHBondContact CZ2-O 3.32Å; W46-R280 HydrophobicContact CZ3-CG 4.34Å; T112-R280 PolarHBondContact OG1-NE 3.07Å; I200-R280 HydrophobicContact CD1-CB 3.69Å; I200-R280 HydrophobicContact CD1-CG 4.41Å; N278-R280 PolarHBondContact O-N 3.34Å; N278-R280 PolarHBondContact OD1-N 2.74Å; N278-R280 VanDerWaalsContact OD1-N 3.16Å; R280-F283 VanDerWaalsContact O-CE2 3.26Å; R280-F283 WeakPolarHBondContact O-CE2 3.37Å; R280-F283 WeakPolarHBondContact O-CZ 3.32Å; R280-Y297 VanDerWaalsContact C-OH 3.28Å; R280-Y297 PolarHBondContact O-OH 3.06Å
281	Q	95.9	Very high	92.9	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-95.3	-5.3	172.1	-66.1	174	-94.9	0	0	112.9	V193 V195 V253 V255 N278 P279 Y297	V193-Q281 PolarHBondContact O-NE2 3.48Å; V195-Q281 HydrophobicContact CB-CG 3.78Å; V195-Q281 HydrophobicContact CG2-CG 4.02Å; V195-Q281 VanDerWaalsContact N-NE2 3.15Å; V253-Q281 PolarHBondContact O-NE2 3.2Å; V255-Q281 PolarHBondContact N-O 3.04Å; N278-Q281 HydrophobicContact CB-CG 4.18Å; N278-Q281 VanDerWaalsContact CB-OE1 3.29Å; N278-Q281 WeakPolarHBondContact O-CB 3.48Å; N278-Q281 PolarHBondContact O-N 3.29Å; P279-Q281 PolarHBondContact O-N 3.31Å; Q281-Y297 HydrophobicContact CG-CE1 4.41Å
282	V	96.6	Very high	92.9	Very high	7 Å²	7	32.9 Å²	32.9	4%	0.042	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115	-171.5	-171	0	0	0	0	108.5	V255 V257 L270 F273 M274 L277 P279	V255-V282 HydrophobicContact CB-CG1 4.49Å; V255-V282 WeakPolarHBondContact O-CA 3.34Å; V257-V282 HydrophobicContact CG2-CG1 4.43Å; L270-V282 HydrophobicContact CD1-CG1 3.65Å; L270-V282 HydrophobicContact CG-CG1 4.31Å; F273-V282 HydrophobicContact CB-CG1 3.93Å; F273-V282 HydrophobicContact CB-CG2 3.74Å; M274-V282 HydrophobicContact CE-CB 4.41Å; M274-V282 HydrophobicContact CE-CG1 4.4Å; M274-V282 HydrophobicContact CG-CB 3.91Å; M274-V282 HydrophobicContact CG-CG1 4.09Å; M274-V282 HydrophobicContact CG-CG2 4.14Å; L277-V282 HydrophobicContact CB-CG2 4.32Å; L277-V282 HydrophobicContact CD1-CG2 4.31Å; P279-V282 PolarHBondContact O-N 2.98Å
283	F	95.6	Very high	92.8	Very high	24 Å²	24	30.8 Å²	30.8	11%	0.105	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.6	-173.1	-70.3	-93.4	0	0	0	110.6	W46 L254 V255 F256 V257 R280 A293 Y297	W46-F283 HydrophobicContact CZ2-CE1 4.13Å; W46-F283 AromaticContact CZ2-CZ 3.66Å; W46-F283 HydrophobicContact CZ2-CZ 3.66Å; W46-F283 AromaticContact NE1-CE1 3.86Å; L254-F283 HydrophobicContact CD1-CD2 3.68Å; L254-F283 HydrophobicContact CD1-CE2 3.34Å; L254-F283 HydrophobicContact CD1-CZ 4.43Å; L254-F283 HydrophobicContact CG-CD2 4.39Å; L254-F283 HydrophobicContact CG-CE2 4.43Å; V255-F283 PolarHBondContact O-N 2.89Å; F256-F283 HydrophobicContact CD1-CB 3.52Å; F256-F283 HydrophobicContact CD1-CG 4.22Å; F256-F283 HydrophobicContact CE1-CB 3.7Å; F256-F283 HydrophobicContact CE1-CD2 4.16Å; F256-F283 AromaticContact CE1-CG 3.9Å; F256-F283 HydrophobicContact CE1-CG 3.9Å; V257-F283 PolarHBondContact N-O 2.88Å; R280-F283 VanDerWaalsContact O-CE2 3.26Å; R280-F283 WeakPolarHBondContact O-CE2 3.37Å; R280-F283 WeakPolarHBondContact O-CZ 3.32Å; F283-A293 HydrophobicContact CD1-CB 3.66Å; F283-A293 HydrophobicContact CD2-CB 4.28Å; F283-A293 HydrophobicContact CE1-CB 3.4Å; F283-A293 HydrophobicContact CE2-CB 4.08Å; F283-A293 HydrophobicContact CG-CB 4.1Å; F283-A293 HydrophobicContact CZ-CB 3.62Å; F283-Y297 HydrophobicContact CE2-CE2 4.07Å; F283-Y297 AromaticContact CZ-CE2 4Å; F283-Y297 HydrophobicContact CZ-CE2 4Å
284	D	93.9	Very high	92.7	Very high	23 Å²	23	30.8 Å²	30.8	12%	0.123	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	112.1	172.2	178.3	-11.5	0	0	0	109	P259 L270 S286 Q287	P259-D284 WeakPolarHBondContact CD-OD1 3.45Å; P259-D284 VanDerWaalsContact CG-CG 3.43Å; P259-D284 WeakPolarHBondContact CG-OD1 3.36Å; L270-D284 HydrophobicContact CD1-CB 4.21Å; L270-D284 HydrophobicContact CD2-CB 4.27Å; D284-S286 VanDerWaalsContact CG-OG 3.23Å; D284-S286 PolarHBondContact O-N 3.44Å; D284-S286 WeakPolarHBondContact OD1-CA 3.41Å; D284-S286 VanDerWaalsContact OD1-CB 3.28Å; D284-S286 WeakPolarHBondContact OD1-CB 3.35Å; D284-S286 PolarHBondContact OD1-N 3.39Å; D284-S286 PolarHBondContact OD1-OG 3.37Å; D284-S286 PolarHBondContact OD2-OG 3.04Å; D284-Q287 HydrophobicContact CB-CG 4.14Å; D284-Q287 PolarHBondContact O-N 3Å; D284-Q287 VanDerWaalsContact O-N 3.15Å; D284-Q287 PolarHBondContact OD2-NE2 3.35Å
285	L	92	Very high	92.6	Very high	10 Å²	10	33.4 Å²	33.4	5%	0.052	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-66.7	-20	-178.6	-72	175.9	0	0	0	113.6	F256 V257 N258 Q287 G288 L290 T313 W316	F256-L285 HydrophobicContact CB-CD1 4.03Å; F256-L285 HydrophobicContact CB-CD2 3.97Å; F256-L285 HydrophobicContact CB-CG 3.98Å; F256-L285 HydrophobicContact CD1-CD2 3.77Å; F256-L285 HydrophobicContact CD1-CG 4.49Å; F256-L285 HydrophobicContact CG-CD2 4.16Å; V257-L285 PolarHBondContact O-N 3.36Å; N258-L285 HydrophobicContact CB-CD1 4.37Å; L285-Q287 PolarHBondContact O-N 3.03Å; L285-G288 PolarHBondContact O-N 3.01Å; L285-L290 HydrophobicContact CD2-CB 4.39Å; L285-L290 HydrophobicContact CD2-CD1 4.29Å; L285-T313 HydrophobicContact CD1-CG2 3.41Å; L285-T313 VanDerWaalsContact CD1-CG2 3.41Å; L285-W316 HydrophobicContact CB-CZ3 4.05Å; L285-W316 HydrophobicContact CD2-CE3 4.46Å; L285-W316 HydrophobicContact CD2-CZ3 4.15Å
286	S	88.9	Confident	92.5	Very high	74 Å²	74	32.5 Å²	32.5	52%	0.517	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-72.4	-19.2	175.6	74	0	0	0	0	113	D284 G288	D284-S286 VanDerWaalsContact CG-OG 3.23Å; D284-S286 PolarHBondContact O-N 3.44Å; D284-S286 WeakPolarHBondContact OD1-CA 3.41Å; D284-S286 VanDerWaalsContact OD1-CB 3.28Å; D284-S286 WeakPolarHBondContact OD1-CB 3.35Å; D284-S286 PolarHBondContact OD1-N 3.39Å; D284-S286 PolarHBondContact OD1-OG 3.37Å; D284-S286 PolarHBondContact OD2-OG 3.04Å; S286-G288 VanDerWaalsContact C-N 3.33Å
287	Q	86.4	Confident	92.4	Very high	115 Å²	115	31.8 Å²	31.8	54%	0.537	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-90.6	1.3	177.4	-60.8	177.9	26.8	0	0	112.4	D284 L285	D284-Q287 HydrophobicContact CB-CG 4.14Å; D284-Q287 PolarHBondContact O-N 3Å; D284-Q287 VanDerWaalsContact O-N 3.15Å; D284-Q287 PolarHBondContact OD2-NE2 3.35Å; L285-Q287 PolarHBondContact O-N 3.03Å
288	G	82.5	Confident	92.2	Very high	32 Å²	32	36 Å²	36	33%	0.33	19%	0.188	S	C	.	.			trans	71.3	-151	-173.6	0	0	0	0	0	112.4	L285 S286 L290	L285-G288 PolarHBondContact O-N 3.01Å; S286-G288 VanDerWaalsContact C-N 3.33Å; G288-L290 VanDerWaalsContact C-N 3.33Å; G288-L290 PolarHBondContact O-N 3.44Å
289	G	80.2	Confident	91.9	Very high	35 Å²	35	44.5 Å²	44.5	36%	0.361	23%	0.225	S	C	.	.			trans	80.3	5.9	172.8	0	0	0	0	0	116.1	R291 E292 A293	G289-R291 PolarHBondContact O-N 3.13Å; G289-E292 VanDerWaalsContact C-OE2 3.3Å; G289-E292 WeakPolarHBondContact CA-OE2 3.27Å; G289-E292 PolarHBondContact O-N 3.12Å; G289-A293 WeakPolarHBondContact O-CB 3.48Å; G289-A293 PolarHBondContact O-N 3.43Å
290	L	91.8	Very high	91.7	Very high	7 Å²	7	44.9 Å²	44.9	4%	0.037	23%	0.227	C	C	.	.	H	α-helix	trans	-56.1	-48.7	-178.8	173.1	61	0	0	0	111.9	F256 L285 G288 A293 L294 W316 I317 A320	F256-L290 HydrophobicContact CD1-CD1 3.73Å; F256-L290 HydrophobicContact CD2-CD1 4.16Å; F256-L290 HydrophobicContact CE1-CD1 3.39Å; F256-L290 HydrophobicContact CE2-CD1 3.84Å; F256-L290 HydrophobicContact CG-CD1 4.11Å; F256-L290 HydrophobicContact CZ-CD1 3.45Å; F256-L290 VanDerWaalsContact CZ-CD1 3.45Å; L285-L290 HydrophobicContact CD2-CB 4.39Å; L285-L290 HydrophobicContact CD2-CD1 4.29Å; G288-L290 VanDerWaalsContact C-N 3.33Å; G288-L290 PolarHBondContact O-N 3.44Å; L290-A293 PolarHBondContact O-N 3.18Å; L290-L294 HydrophobicContact CD1-CD1 3.91Å; L290-L294 HydrophobicContact CD1-CG 4.2Å; L290-L294 HydrophobicContact CG-CD1 4.14Å; L290-L294 VanDerWaalsContact O-CG 3.31Å; L290-L294 WeakPolarHBondContact O-CG 3.43Å; L290-L294 PolarHBondContact O-N 3.48Å; L290-W316 HydrophobicContact CD2-CD2 3.98Å; L290-W316 HydrophobicContact CD2-CG 4.08Å; L290-W316 HydrophobicContact CD2-CZ2 4.4Å; L290-I317 HydrophobicContact CD1-CG1 4.11Å; L290-I317 HydrophobicContact CD2-CG1 4.26Å; L290-A320 HydrophobicContact CD2-CB 3.71Å; L290-A320 HydrophobicContact CG-CB 4.01Å
291	R	92.4	Very high	91.4	Very high	115 Å²	115	46.6 Å²	46.6	43%	0.434	24%	0.239	S	C	.	.	H	α-helix	trans	-65.8	-43	-179.1	-75.6	179	165.6	-131.8	25.6	111.5	G289 A293 L294 E295 A320 E323	G289-R291 PolarHBondContact O-N 3.13Å; R291-A293 VanDerWaalsContact C-N 3.33Å; R291-A293 PolarHBondContact O-N 3.18Å; R291-L294 PolarHBondContact O-N 3.49Å; R291-E295 VanDerWaalsContact O-CB 3.3Å; R291-E295 WeakPolarHBondContact O-CB 3.41Å; R291-E295 PolarHBondContact O-N 3.5Å; R291-A320 HydrophobicContact CG-CB 4.47Å; R291-E323 IonicContact CZ-OE1 2.78Å; R291-E323 IonicContact CZ-OE2 3.41Å; R291-E323 IonicContact NE-OE2 2.84Å; R291-E323 PolarHBondContact NE-OE2 2.84Å; R291-E323 VanDerWaalsContact NE-OE2 3.07Å; R291-E323 IonicContact NH1-OE2 3.54Å; R291-E323 IonicContact NH2-OE1 2.64Å; R291-E323 PolarHBondContact NH2-OE1 2.9Å; R291-E323 IonicContact NH2-OE2 3.8Å; R291-E323 PolarHBondContact NH2-OE2 2.9Å
292	E	90.9	Very high	91.2	Very high	113 Å²	113	50.6 Å²	50.6	53%	0.528	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-39.7	177.9	-66.6	76	-171.8	0	0	111.8	G289 L296	G289-E292 VanDerWaalsContact C-OE2 3.3Å; G289-E292 WeakPolarHBondContact CA-OE2 3.27Å; G289-E292 PolarHBondContact O-N 3.12Å; E292-L296 VanDerWaalsContact O-CB 3.29Å; E292-L296 WeakPolarHBondContact O-CB 3.36Å; E292-L296 PolarHBondContact O-N 2.84Å
293	A	92.8	Very high	91.2	Very high	2 Å²	2	50.8 Å²	50.8	2%	0.017	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-50.6	175.1	0	0	0	0	0	111.3	F256 F283 G289 L290 R291 E295 L296 Y297	F256-A293 HydrophobicContact CE1-CB 3.93Å; F256-A293 HydrophobicContact CZ-CB 4.05Å; F283-A293 HydrophobicContact CD1-CB 3.66Å; F283-A293 HydrophobicContact CD2-CB 4.28Å; F283-A293 HydrophobicContact CE1-CB 3.4Å; F283-A293 HydrophobicContact CE2-CB 4.08Å; F283-A293 HydrophobicContact CG-CB 4.1Å; F283-A293 HydrophobicContact CZ-CB 3.62Å; G289-A293 WeakPolarHBondContact O-CB 3.48Å; G289-A293 PolarHBondContact O-N 3.43Å; L290-A293 PolarHBondContact O-N 3.18Å; R291-A293 VanDerWaalsContact C-N 3.33Å; R291-A293 PolarHBondContact O-N 3.18Å; A293-E295 VanDerWaalsContact C-N 3.32Å; A293-E295 PolarHBondContact O-N 2.68Å; A293-L296 WeakPolarHBondContact O-CB 3.3Å; A293-L296 PolarHBondContact O-N 3.27Å; A293-Y297 VanDerWaalsContact O-CD2 3.3Å; A293-Y297 WeakPolarHBondContact O-CD2 3.49Å; A293-Y297 PolarHBondContact O-N 3.12Å
294	L	95.4	Very high	91.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-42.1	178.6	-70.2	172.8	0	0	0	112	L254 F256 L290 R291 L296 Y297 R298 I305 A320 L321 L324	L254-L294 HydrophobicContact CD2-CD2 4.09Å; F256-L294 HydrophobicContact CE2-CD2 3.97Å; F256-L294 HydrophobicContact CZ-CD2 4.02Å; F256-L294 HydrophobicContact CZ-CG 4.14Å; L290-L294 HydrophobicContact CD1-CD1 3.91Å; L290-L294 HydrophobicContact CD1-CG 4.2Å; L290-L294 HydrophobicContact CG-CD1 4.14Å; L290-L294 VanDerWaalsContact O-CG 3.31Å; L290-L294 WeakPolarHBondContact O-CG 3.43Å; L290-L294 PolarHBondContact O-N 3.48Å; R291-L294 PolarHBondContact O-N 3.49Å; L294-L296 PolarHBondContact O-N 3.16Å; L294-Y297 CarbonylContact O-C 3.59Å; L294-Y297 PolarHBondContact O-N 2.96Å; L294-R298 PolarHBondContact O-N 2.84Å; L294-I305 HydrophobicContact CD2-CD1 3.69Å; L294-A320 HydrophobicContact CD1-CB 3.83Å; L294-L321 HydrophobicContact CD1-CD2 4.02Å; L294-L321 HydrophobicContact CD1-CG 4.37Å; L294-L321 HydrophobicContact CD2-CD2 3.85Å; L294-L321 HydrophobicContact CG-CD2 4.5Å; L294-L324 HydrophobicContact CB-CD1 3.41Å; L294-L324 VanDerWaalsContact CB-CD1 3.41Å; L294-L324 HydrophobicContact CD1-CD1 3.93Å; L294-L324 HydrophobicContact CG-CD1 4.33Å
295	E	92.8	Very high	91.5	Very high	64 Å²	64	49.7 Å²	49.7	30%	0.299	26%	0.255	S	S	.	.	H	α-helix	trans	-61.5	-43.2	175.4	-174.3	63.6	-129.2	0	0	112	R291 A293 Y297 R298	R291-E295 VanDerWaalsContact O-CB 3.3Å; R291-E295 WeakPolarHBondContact O-CB 3.41Å; R291-E295 PolarHBondContact O-N 3.5Å; A293-E295 VanDerWaalsContact C-N 3.32Å; A293-E295 PolarHBondContact O-N 2.68Å; E295-Y297 VanDerWaalsContact C-N 3.3Å; E295-Y297 PolarHBondContact O-N 3Å; E295-R298 WeakPolarHBondContact O-CB 3.27Å; E295-R298 PolarHBondContact O-N 2.94Å; E295-R298 IonicContact OE1-CZ 3.98Å; E295-R298 IonicContact OE1-NE 3.03Å; E295-R298 IonicContact OE1-NH1 2.86Å; E295-R298 PolarHBondContact OE1-NH1 3Å; E295-R298 IonicContact OE2-CZ 3.12Å; E295-R298 IonicContact OE2-NE 2.74Å; E295-R298 IonicContact OE2-NH1 3.2Å; E295-R298 PolarHBondContact OE2-NH1 2.92Å; E295-R298 IonicContact OE2-NH2 3.85Å; E295-R298 PolarHBondContact OE2-NH2 3.15Å
296	L	92.6	Very high	91.8	Very high	37 Å²	37	49.2 Å²	49.2	19%	0.194	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-36.2	178.9	179.2	64.5	0	0	0	112.4	W46 F240 L242 E292 A293 L294	W46-L296 HydrophobicContact CE3-CD2 3.93Å; W46-L296 HydrophobicContact CH2-CD2 3.56Å; W46-L296 HydrophobicContact CZ2-CD2 4.34Å; W46-L296 HydrophobicContact CZ3-CD2 3.35Å; F240-L296 HydrophobicContact CB-CD1 4.46Å; L242-L296 HydrophobicContact CD1-CD1 3.55Å; L242-L296 HydrophobicContact CD1-CD2 4.01Å; L242-L296 HydrophobicContact CD1-CG 3.55Å; E292-L296 VanDerWaalsContact O-CB 3.29Å; E292-L296 WeakPolarHBondContact O-CB 3.36Å; E292-L296 PolarHBondContact O-N 2.84Å; A293-L296 WeakPolarHBondContact O-CB 3.3Å; A293-L296 PolarHBondContact O-N 3.27Å; L294-L296 PolarHBondContact O-N 3.16Å
297	Y	94.5	Very high	92.2	Very high	1 Å²	1	45.7 Å²	45.7	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-94	-0.6	-178.6	-77	-101.8	0	0	0	113.9	W46 V195 L242 L254 R280 Q281 F283 A293 L294 E295 K299 V300 L303	W46-Y297 HydrophobicContact CH2-CE2 4.4Å; V195-Y297 HydrophobicContact CG1-CE1 4.46Å; V195-Y297 HydrophobicContact CG2-CE1 4.01Å; L242-Y297 HydrophobicContact CD2-CD1 3.54Å; L242-Y297 HydrophobicContact CD2-CD2 4.24Å; L242-Y297 HydrophobicContact CD2-CE1 3.55Å; L242-Y297 HydrophobicContact CD2-CE2 4.29Å; L242-Y297 HydrophobicContact CD2-CG 3.9Å; L254-Y297 HydrophobicContact CD1-CD1 4.17Å; L254-Y297 HydrophobicContact CD1-CD2 4Å; L254-Y297 HydrophobicContact CD1-CE1 4.14Å; L254-Y297 HydrophobicContact CD1-CE2 3.96Å; L254-Y297 HydrophobicContact CD1-CG 4.11Å; L254-Y297 HydrophobicContact CD2-CG 4.35Å; R280-Y297 VanDerWaalsContact C-OH 3.28Å; R280-Y297 PolarHBondContact O-OH 3.06Å; Q281-Y297 HydrophobicContact CG-CE1 4.41Å; F283-Y297 HydrophobicContact CE2-CE2 4.07Å; F283-Y297 AromaticContact CZ-CE2 4Å; F283-Y297 HydrophobicContact CZ-CE2 4Å; A293-Y297 VanDerWaalsContact O-CD2 3.3Å; A293-Y297 WeakPolarHBondContact O-CD2 3.49Å; A293-Y297 PolarHBondContact O-N 3.12Å; L294-Y297 CarbonylContact O-C 3.59Å; L294-Y297 PolarHBondContact O-N 2.96Å; E295-Y297 VanDerWaalsContact C-N 3.3Å; E295-Y297 PolarHBondContact O-N 3Å; Y297-K299 PolarHBondContact O-N 3.36Å; Y297-V300 HydrophobicContact CD1-CG2 3.94Å; Y297-V300 WeakPolarHBondContact O-CB 3.4Å; Y297-V300 WeakPolarHBondContact O-CG2 3.4Å; Y297-V300 PolarHBondContact O-N 3.47Å; Y297-L303 HydrophobicContact CD1-CD1 4.34Å
298	R	93	Very high	92.7	Very high	89 Å²	89	40.2 Å²	40.2	34%	0.336	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-33.1	-175.3	175.8	178.1	-75.1	158.1	-5.1	115.1	L294 E295 L324 M326	L294-R298 PolarHBondContact O-N 2.84Å; E295-R298 WeakPolarHBondContact O-CB 3.27Å; E295-R298 PolarHBondContact O-N 2.94Å; E295-R298 IonicContact OE1-CZ 3.98Å; E295-R298 IonicContact OE1-NE 3.03Å; E295-R298 IonicContact OE1-NH1 2.86Å; E295-R298 PolarHBondContact OE1-NH1 3Å; E295-R298 IonicContact OE2-CZ 3.12Å; E295-R298 IonicContact OE2-NE 2.74Å; E295-R298 IonicContact OE2-NH1 3.2Å; E295-R298 PolarHBondContact OE2-NH1 2.92Å; E295-R298 IonicContact OE2-NH2 3.85Å; E295-R298 PolarHBondContact OE2-NH2 3.15Å; R298-L324 PolarHBondContact NH2-O 3.41Å; R298-M326 HydrophobicContact CB-CE 3.94Å; R298-M326 HydrophobicContact CB-SD 3.73Å; R298-M326 HydrophobicContact CG-CE 3.99Å; R298-M326 HydrophobicContact CG-SD 3.54Å; R298-M326 VanDerWaalsContact CG-SD 3.54Å; R298-M326 PolarHBondContact NE-SD 2.97Å
299	K	90.1	Very high	93.1	Very high	178 Å²	178	38.7 Å²	38.7	77%	0.774	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	2.3	-177.1	-62.5	-175.3	179.9	-179.1	0	113.9	P244 Y297	P244-K299 WeakPolarHBondContact CG-O 3.34Å; Y297-K299 PolarHBondContact O-N 3.36Å
300	V	91.9	Very high	93.5	Very high	10 Å²	10	37.6 Å²	37.6	6%	0.061	18%	0.175	C	C	.	.			trans	-76	121.3	179.6	178.2	0	0	0	0	109.4	W199 L242 P252 Y297 L303	W199-V300 HydrophobicContact CZ3-CG1 4.19Å; L242-V300 HydrophobicContact CD2-CG2 3.63Å; P252-V300 HydrophobicContact CB-CG1 3.94Å; P252-V300 HydrophobicContact CG-CG1 3.72Å; Y297-V300 HydrophobicContact CD1-CG2 3.94Å; Y297-V300 WeakPolarHBondContact O-CB 3.4Å; Y297-V300 WeakPolarHBondContact O-CG2 3.4Å; Y297-V300 PolarHBondContact O-N 3.47Å; V300-L303 HydrophobicContact CB-CB 4.35Å; V300-L303 HydrophobicContact CB-CD1 4.21Å; V300-L303 HydrophobicContact CG1-CB 4.3Å; V300-L303 HydrophobicContact CG1-CD1 3.98Å
301	P	89.7	Confident	93.3	Very high	42 Å²	42	38.1 Å²	38.1	27%	0.273	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	148.7	179.8	30	-34.8	0	0	0	110.8	P252 L303	P252-P301 WeakPolarHBondContact CD-O 3.45Å; P301-L303 PolarHBondContact O-N 2.91Å
302	N	91.6	Very high	93	Very high	85 Å²	85	34.5 Å²	34.5	46%	0.455	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	27.3	177.1	-58	-27.5	0	0	0	114.4	P248 M250 K251 R304	P248-N302 PolarHBondContact O-ND2 2.86Å; M250-N302 VanDerWaalsContact O-CB 3.23Å; M250-N302 WeakPolarHBondContact O-CB 3.42Å; M250-N302 PolarHBondContact O-ND2 2.75Å; K251-N302 WeakPolarHBondContact CA-O 3.37Å; N302-R304 PolarHBondContact O-N 3.22Å
303	L	95.4	Very high	93	Very high	10 Å²	10	29.7 Å²	29.7	5%	0.052	16%	0.155	C	C	.	.			trans	-60.7	131.4	-179.2	-176.3	72.2	0	0	0	110.2	P252 L254 Y297 V300 P301 P330 P331	P252-L303 HydrophobicContact CB-CD1 4.42Å; L254-L303 HydrophobicContact CB-CD1 4.25Å; Y297-L303 HydrophobicContact CD1-CD1 4.34Å; V300-L303 HydrophobicContact CB-CB 4.35Å; V300-L303 HydrophobicContact CB-CD1 4.21Å; V300-L303 HydrophobicContact CG1-CB 4.3Å; V300-L303 HydrophobicContact CG1-CD1 3.98Å; P301-L303 PolarHBondContact O-N 2.91Å; L303-P330 HydrophobicContact CB-CB 4.29Å; L303-P330 HydrophobicContact CD2-CB 4.32Å; L303-P330 HydrophobicContact CG-CB 4.34Å; L303-P330 WeakPolarHBondContact O-CB 3.35Å; L303-P331 WeakPolarHBondContact O-CD 3.48Å
304	R	97.7	Very high	93.1	Very high	24 Å²	24	29.6 Å²	29.6	9%	0.091	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	150.8	168.7	-58.8	-164.9	169.6	-158.5	-5.1	109.8	P252 V253 L254 N302 P331 V365 E366 G368	P252-R304 PolarHBondContact O-N 3.31Å; V253-R304 CarbonylContact C-O 3.55Å; V253-R304 WeakPolarHBondContact CA-O 3.18Å; V253-R304 HydrophobicContact CG2-CB 4.37Å; L254-R304 PolarHBondContact N-O 3.21Å; N302-R304 PolarHBondContact O-N 3.22Å; R304-P331 HydrophobicContact CG-CG 3.96Å; R304-V365 HydrophobicContact CB-CG1 4.24Å; R304-V365 WeakPolarHBondContact CD-O 3.39Å; R304-V365 PolarHBondContact NH1-O 3Å; R304-E366 PolarHBondContact NH1-O 3.05Å; R304-E366 VanDerWaalsContact NH1-O 3.14Å; R304-G368 PolarHBondContact NH1-O 2.95Å; R304-G368 PolarHBondContact NH2-O 3.04Å; R304-G368 VanDerWaalsContact NH2-O 3.13Å
305	I	98.6	Very high	92.9	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.4	177.3	-64.4	170.6	0	0	0	109.1	L254 F256 L294 I317 L321 P330 P331 V332 A333	L254-I305 HydrophobicContact CB-CG1 4.38Å; L254-I305 CarbonylContact O-C 3.55Å; L254-I305 WeakPolarHBondContact O-CA 3.42Å; F256-I305 HydrophobicContact CD2-CG2 3.67Å; F256-I305 HydrophobicContact CE2-CG2 3.95Å; L294-I305 HydrophobicContact CD2-CD1 3.69Å; I305-I317 HydrophobicContact CD1-CG2 4.46Å; I305-I317 HydrophobicContact CG2-CG2 4.17Å; I305-L321 HydrophobicContact CD1-CD1 4.05Å; I305-L321 HydrophobicContact CD1-CD2 3.95Å; I305-L321 HydrophobicContact CD1-CG 4.46Å; I305-P330 HydrophobicContact CD1-CB 4.11Å; I305-P330 HydrophobicContact CD1-CG 3.57Å; I305-P330 HydrophobicContact CG1-CB 4.27Å; I305-P330 HydrophobicContact CG1-CG 4.25Å; I305-P331 PolarHBondContact N-O 3.21Å; I305-V332 HydrophobicContact CB-CG2 4.24Å; I305-V332 HydrophobicContact CD1-CG2 4.45Å; I305-V332 HydrophobicContact CG2-CG1 4.36Å; I305-V332 CarbonylContact O-C 3.54Å; I305-A333 PolarHBondContact O-N 3.12Å
306	L	98.5	Very high	92.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	114.6	169.1	178.2	60.1	0	0	0	109.3	V253 L254 V255 F256 F273 A333 L335 V361 V365	V253-L306 HydrophobicContact CG1-CB 3.97Å; L254-L306 PolarHBondContact O-N 3.46Å; V255-L306 HydrophobicContact CG1-CB 4.44Å; V255-L306 HydrophobicContact CG1-CD2 4.23Å; V255-L306 HydrophobicContact CG1-CG 4.43Å; V255-L306 HydrophobicContact CG2-CB 4.28Å; V255-L306 HydrophobicContact CG2-CD2 4.33Å; F256-L306 PolarHBondContact N-O 2.93Å; F273-L306 HydrophobicContact CE1-CD2 3.84Å; F273-L306 HydrophobicContact CE2-CD2 4.39Å; F273-L306 HydrophobicContact CZ-CD2 3.59Å; L306-A333 HydrophobicContact CD1-CB 3.88Å; L306-L335 HydrophobicContact CD1-CB 4.09Å; L306-V361 HydrophobicContact CD2-CG1 4.02Å; L306-V365 HydrophobicContact CB-CG2 4.44Å; L306-V365 HydrophobicContact CD1-CG2 3.78Å; L306-V365 HydrophobicContact CD2-CG2 4.22Å; L306-V365 HydrophobicContact CG-CG2 4.36Å
307	A	97.7	Very high	93	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	109	176.8	0	0	0	0	0	110.4	V314 I317 V332 A333 L335	A307-V314 HydrophobicContact CB-CG2 4.09Å; A307-I317 HydrophobicContact CB-CD1 3.49Å; A307-I317 VanDerWaalsContact CB-CD1 3.49Å; A307-V332 HydrophobicContact CB-CG1 4.07Å; A307-A333 PolarHBondContact N-O 2.85Å; A307-L335 PolarHBondContact O-N 3Å
308	C	96.5	Very high	93	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	101.3	177.3	-50.5	0	0	0	0	110.1	F256 V257 N258 L335 L337	F256-C308 PolarHBondContact O-N 3.17Å; V257-C308 HydrophobicContact CB-CB 4.28Å; V257-C308 HydrophobicContact CG1-CB 4.08Å; V257-C308 HydrophobicContact CG2-CB 4.1Å; N258-C308 PolarHBondContact N-O 3.29Å; C308-L335 HydrophobicContact CB-CB 4.18Å; C308-L335 HydrophobicContact CB-CD2 4.11Å; C308-L337 HydrophobicContact CB-CD1 3.87Å
309	G	92.3	Very high	93	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.7	-162.2	-172.7	0	0	0	0	0	112.7	L335 L337 G338	G309-L335 PolarHBondContact N-O 3.04Å; G309-L337 PolarHBondContact O-N 2.82Å; G309-G338 PolarHBondContact O-N 3.5Å
310	G	88.1	Confident	93.2	Very high	12 Å²	12	19.8 Å²	19.8	12%	0.124	11%	0.114	C	C	.	.			trans	-96.4	-173.9	167.6	0	0	0	0	0	112.1	G312 T313 V314	G310-G312 PolarHBondContact O-N 3.14Å; G310-T313 WeakPolarHBondContact O-CB 3.32Å; G310-T313 PolarHBondContact O-N 3.22Å; G310-V314 PolarHBondContact O-N 3.09Å
311	D	87.3	Confident	93.3	Very high	19 Å²	19	19.3 Å²	19.3	10%	0.102	11%	0.111	C	C	.	.	H	α-helix	trans	-55.5	-36.3	-177.6	-55.9	-80.1	0	0	0	113.2	T313 V314 G315 N341 D342 L343 N401 M552	D311-T313 PolarHBondContact O-N 3.42Å; D311-V314 PolarHBondContact O-N 2.91Å; D311-G315 PolarHBondContact O-N 3.34Å; D311-N341 WeakPolarHBondContact OD2-CA 3.36Å; D311-N341 PolarHBondContact OD2-N 2.86Å; D311-D342 PolarHBondContact OD1-N 3.37Å; D311-L343 WeakPolarHBondContact OD1-CB 3.43Å; D311-L343 PolarHBondContact OD1-N 3.13Å; D311-N401 VanDerWaalsContact CG-ND2 3.31Å; D311-N401 PolarHBondContact OD1-ND2 3.09Å; D311-M552 HydrophobicContact CB-CE 4.23Å; D311-M552 WeakPolarHBondContact O-CE 3.15Å
312	G	86.9	Confident	93.4	Very high	38 Å²	38	18.4 Å²	18.4	39%	0.392	10%	0.104	S	C	.	.	H	α-helix	trans	-64.3	-35.5	175.6	0	0	0	0	0	114	G310 V314 G315 W316	G310-G312 PolarHBondContact O-N 3.14Å; G312-V314 VanDerWaalsContact C-N 3.34Å; G312-G315 PolarHBondContact O-N 2.93Å; G312-W316 PolarHBondContact O-N 3.24Å
313	T	90.7	Very high	93.5	Very high	13 Å²	13	19.4 Å²	19.4	8%	0.08	11%	0.106	C	C	.	.	H	α-helix	trans	-64.4	-42	175.2	-61.9	0	0	0	0	110.8	L285 G310 D311 W316 I317	L285-T313 HydrophobicContact CD1-CG2 3.41Å; L285-T313 VanDerWaalsContact CD1-CG2 3.41Å; G310-T313 WeakPolarHBondContact O-CB 3.32Å; G310-T313 PolarHBondContact O-N 3.22Å; D311-T313 PolarHBondContact O-N 3.42Å; T313-W316 PolarHBondContact O-N 2.99Å; T313-I317 HydrophobicContact CG2-CD1 4.29Å; T313-I317 WeakPolarHBondContact O-CG1 3.48Å; T313-I317 PolarHBondContact O-N 2.81Å
314	V	93.8	Very high	93.4	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.3	-46.3	177.2	-175.4	0	0	0	0	110.1	A307 G310 D311 G312 W316 I317 L318 V332 V334 L343 M573	A307-V314 HydrophobicContact CB-CG2 4.09Å; G310-V314 PolarHBondContact O-N 3.09Å; D311-V314 PolarHBondContact O-N 2.91Å; G312-V314 VanDerWaalsContact C-N 3.34Å; V314-W316 VanDerWaalsContact C-N 3.31Å; V314-W316 PolarHBondContact O-N 3.23Å; V314-I317 PolarHBondContact O-N 3.22Å; V314-I317 VanDerWaalsContact O-N 3.16Å; V314-L318 HydrophobicContact CG1-CD1 4.07Å; V314-L318 HydrophobicContact CG1-CG 4.32Å; V314-L318 WeakPolarHBondContact O-CG 3.19Å; V314-L318 PolarHBondContact O-N 3.46Å; V314-V332 HydrophobicContact CG1-CG1 4.35Å; V314-V334 HydrophobicContact CG1-CG2 4.28Å; V314-V334 HydrophobicContact CG2-CB 4.41Å; V314-V334 HydrophobicContact CG2-CG1 3.86Å; V314-V334 HydrophobicContact CG2-CG2 3.75Å; V314-L343 HydrophobicContact CB-CD2 4.23Å; V314-L343 HydrophobicContact CG1-CD2 3.75Å; V314-M573 HydrophobicContact CG1-CE 3.96Å
315	G	91.9	Very high	93.1	Very high	9 Å²	9	27 Å²	27	9%	0.093	14%	0.142	C	C	.	.	H	α-helix	trans	-57.7	-40.2	177	0	0	0	0	0	113.5	D311 G312 I317 L318 S319 N400	D311-G315 PolarHBondContact O-N 3.34Å; G312-G315 PolarHBondContact O-N 2.93Å; G315-I317 PolarHBondContact O-N 3.14Å; G315-L318 PolarHBondContact O-N 3.21Å; G315-S319 PolarHBondContact O-N 3.49Å; G315-S319 PolarHBondContact O-OG 2.77Å; G315-N400 WeakPolarHBondContact CA-ND2 3.43Å
316	W	91.4	Very high	92.6	Very high	127 Å²	127	27.8 Å²	27.8	48%	0.481	15%	0.146	S	C	.	.	H	α-helix	trans	-62.7	-42.4	176.3	-174.9	20.6	0	0	0	112.5	L285 L290 G312 T313 V314 A320	L285-W316 HydrophobicContact CB-CZ3 4.05Å; L285-W316 HydrophobicContact CD2-CE3 4.46Å; L285-W316 HydrophobicContact CD2-CZ3 4.15Å; L290-W316 HydrophobicContact CD2-CD2 3.98Å; L290-W316 HydrophobicContact CD2-CG 4.08Å; L290-W316 HydrophobicContact CD2-CZ2 4.4Å; G312-W316 PolarHBondContact O-N 3.24Å; T313-W316 PolarHBondContact O-N 2.99Å; V314-W316 VanDerWaalsContact C-N 3.31Å; V314-W316 PolarHBondContact O-N 3.23Å; W316-A320 PolarHBondContact O-N 3.43Å
317	I	95.3	Very high	92	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.9	-45.5	177.1	-67.6	165.7	0	0	0	110.8	F256 L290 I305 A307 T313 V314 G315 S319 A320 L321 V332	F256-I317 HydrophobicContact CB-CD1 3.86Å; F256-I317 HydrophobicContact CD2-CD1 4.06Å; F256-I317 HydrophobicContact CD2-CG1 4.47Å; F256-I317 HydrophobicContact CG-CD1 4.21Å; L290-I317 HydrophobicContact CD1-CG1 4.11Å; L290-I317 HydrophobicContact CD2-CG1 4.26Å; I305-I317 HydrophobicContact CD1-CG2 4.46Å; I305-I317 HydrophobicContact CG2-CG2 4.17Å; A307-I317 HydrophobicContact CB-CD1 3.49Å; A307-I317 VanDerWaalsContact CB-CD1 3.49Å; T313-I317 HydrophobicContact CG2-CD1 4.29Å; T313-I317 WeakPolarHBondContact O-CG1 3.48Å; T313-I317 PolarHBondContact O-N 2.81Å; V314-I317 PolarHBondContact O-N 3.22Å; V314-I317 VanDerWaalsContact O-N 3.16Å; G315-I317 PolarHBondContact O-N 3.14Å; I317-S319 PolarHBondContact O-N 2.9Å; I317-A320 PolarHBondContact O-N 3.26Å; I317-L321 HydrophobicContact CG2-CD1 4.29Å; I317-L321 WeakPolarHBondContact O-CG 3.45Å; I317-L321 PolarHBondContact O-N 3.02Å; I317-V332 HydrophobicContact CG2-CG2 4.35Å
318	L	95.4	Very high	91.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-43	178.7	-68	177.2	0	0	0	112.1	V314 G315 A320 L321 D322 V332 L373 A571 M573	V314-L318 HydrophobicContact CG1-CD1 4.07Å; V314-L318 HydrophobicContact CG1-CG 4.32Å; V314-L318 WeakPolarHBondContact O-CG 3.19Å; V314-L318 PolarHBondContact O-N 3.46Å; G315-L318 PolarHBondContact O-N 3.21Å; L318-A320 PolarHBondContact O-N 2.92Å; L318-L321 HydrophobicContact CD2-CD1 4.39Å; L318-L321 WeakPolarHBondContact O-CB 3.4Å; L318-L321 PolarHBondContact O-N 3.49Å; L318-D322 PolarHBondContact O-N 3.11Å; L318-V332 HydrophobicContact CD2-CB 4.43Å; L318-V332 HydrophobicContact CD2-CG2 3.85Å; L318-L373 HydrophobicContact CD1-CD2 4.47Å; L318-A571 HydrophobicContact CD1-CB 4.43Å; L318-A571 HydrophobicContact CD2-CB 3.8Å; L318-M573 HydrophobicContact CD1-SD 4.31Å; L318-M573 HydrophobicContact CD2-SD 4.11Å
319	S	92.4	Very high	91.3	Very high	26 Å²	26	41.7 Å²	41.7	18%	0.182	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-41.8	174.2	-65.7	0	0	0	0	112.1	G315 I317 L321 D322 E323	G315-S319 PolarHBondContact O-N 3.49Å; G315-S319 PolarHBondContact O-OG 2.77Å; I317-S319 PolarHBondContact O-N 2.9Å; S319-L321 VanDerWaalsContact C-N 3.31Å; S319-L321 PolarHBondContact O-N 3.38Å; S319-D322 WeakPolarHBondContact O-CB 3.5Å; S319-D322 PolarHBondContact O-N 2.97Å; S319-E323 WeakPolarHBondContact O-CG 3.13Å; S319-E323 PolarHBondContact O-N 2.93Å
320	A	94.3	Very high	91.5	Very high	1 Å²	1	42 Å²	42	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-64.1	-35.3	176.1	0	0	0	0	0	112.5	L290 R291 L294 W316 I317 L318 L324	L290-A320 HydrophobicContact CD2-CB 3.71Å; L290-A320 HydrophobicContact CG-CB 4.01Å; R291-A320 HydrophobicContact CG-CB 4.47Å; L294-A320 HydrophobicContact CD1-CB 3.83Å; W316-A320 PolarHBondContact O-N 3.43Å; I317-A320 PolarHBondContact O-N 3.26Å; L318-A320 PolarHBondContact O-N 2.92Å; A320-L324 WeakPolarHBondContact O-CB 3.4Å; A320-L324 VanDerWaalsContact O-CG 3.25Å; A320-L324 WeakPolarHBondContact O-CG 3.25Å; A320-L324 PolarHBondContact O-N 3.39Å; A320-L324 VanDerWaalsContact O-N 3.12Å
321	L	95.1	Very high	91.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-41.2	174.5	-70	171.5	0	0	0	112.3	L294 I305 I317 L318 S319 L324 Q325 M326 Q329 P330 V332	L294-L321 HydrophobicContact CD1-CD2 4.02Å; L294-L321 HydrophobicContact CD1-CG 4.37Å; L294-L321 HydrophobicContact CD2-CD2 3.85Å; L294-L321 HydrophobicContact CG-CD2 4.5Å; I305-L321 HydrophobicContact CD1-CD1 4.05Å; I305-L321 HydrophobicContact CD1-CD2 3.95Å; I305-L321 HydrophobicContact CD1-CG 4.46Å; I317-L321 HydrophobicContact CG2-CD1 4.29Å; I317-L321 WeakPolarHBondContact O-CG 3.45Å; I317-L321 PolarHBondContact O-N 3.02Å; L318-L321 HydrophobicContact CD2-CD1 4.39Å; L318-L321 WeakPolarHBondContact O-CB 3.4Å; L318-L321 PolarHBondContact O-N 3.49Å; S319-L321 VanDerWaalsContact C-N 3.31Å; S319-L321 PolarHBondContact O-N 3.38Å; L321-L324 PolarHBondContact O-N 3.16Å; L321-Q325 PolarHBondContact O-N 3.38Å; L321-Q325 VanDerWaalsContact O-N 3.13Å; L321-M326 HydrophobicContact CD2-CB 4.43Å; L321-M326 HydrophobicContact CD2-CG 3.93Å; L321-M326 PolarHBondContact O-N 3.05Å; L321-Q329 HydrophobicContact CB-CG 4.33Å; L321-Q329 HydrophobicContact CD1-CG 4.22Å; L321-P330 HydrophobicContact CD1-CG 4.42Å; L321-P330 HydrophobicContact CD2-CG 3.72Å; L321-V332 HydrophobicContact CD1-CG2 3.82Å
322	D	91.8	Very high	92.5	Very high	23 Å²	23	41.3 Å²	41.3	12%	0.123	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-48.8	175.2	-69.6	-16	0	0	0	111.3	L318 S319 L324 Q325 R375 R568 N569	L318-D322 PolarHBondContact O-N 3.11Å; S319-D322 WeakPolarHBondContact O-CB 3.5Å; S319-D322 PolarHBondContact O-N 2.97Å; D322-L324 PolarHBondContact O-N 2.96Å; D322-Q325 WeakPolarHBondContact O-CG 3.22Å; D322-Q325 PolarHBondContact O-N 3.35Å; D322-R375 IonicContact OD1-CZ 3.81Å; D322-R375 IonicContact OD1-NH1 3.09Å; D322-R375 PolarHBondContact OD1-NH1 2.95Å; D322-R375 IonicContact OD2-CZ 2.77Å; D322-R375 IonicContact OD2-NH1 2.82Å; D322-R375 PolarHBondContact OD2-NH1 2.97Å; D322-R375 IonicContact OD2-NH2 3.38Å; D322-R375 PolarHBondContact OD2-NH2 3.43Å; D322-R568 IonicContact OD2-CZ 3.77Å; D322-R568 IonicContact OD2-NE 2.78Å; D322-R568 PolarHBondContact OD2-NE 3.29Å; D322-R568 IonicContact OD2-NH2 3.68Å; D322-N569 PolarHBondContact OD1-ND2 3.43Å
323	E	92.6	Very high	93	Very high	105 Å²	105	39.5 Å²	39.5	49%	0.491	20%	0.204	S	C	.	.	H	α-helix	trans	-61.8	-31.7	-178.5	-69.6	168.5	143	0	0	112.1	R291 S319	R291-E323 IonicContact CZ-OE1 2.78Å; R291-E323 IonicContact CZ-OE2 3.41Å; R291-E323 IonicContact NE-OE2 2.84Å; R291-E323 PolarHBondContact NE-OE2 2.84Å; R291-E323 VanDerWaalsContact NE-OE2 3.07Å; R291-E323 IonicContact NH1-OE2 3.54Å; R291-E323 IonicContact NH2-OE1 2.64Å; R291-E323 PolarHBondContact NH2-OE1 2.9Å; R291-E323 IonicContact NH2-OE2 3.8Å; R291-E323 PolarHBondContact NH2-OE2 2.9Å; S319-E323 WeakPolarHBondContact O-CG 3.13Å; S319-E323 PolarHBondContact O-N 2.93Å
324	L	93.4	Very high	93.3	Very high	24 Å²	24	39 Å²	39	13%	0.126	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-5.4	176.1	-72	176.5	0	0	0	113.4	L294 R298 A320 L321 D322 M326	L294-L324 HydrophobicContact CB-CD1 3.41Å; L294-L324 VanDerWaalsContact CB-CD1 3.41Å; L294-L324 HydrophobicContact CD1-CD1 3.93Å; L294-L324 HydrophobicContact CG-CD1 4.33Å; R298-L324 PolarHBondContact NH2-O 3.41Å; A320-L324 WeakPolarHBondContact O-CB 3.4Å; A320-L324 VanDerWaalsContact O-CG 3.25Å; A320-L324 WeakPolarHBondContact O-CG 3.25Å; A320-L324 PolarHBondContact O-N 3.39Å; A320-L324 VanDerWaalsContact O-N 3.12Å; L321-L324 PolarHBondContact O-N 3.16Å; D322-L324 PolarHBondContact O-N 2.96Å; L324-M326 HydrophobicContact CB-CG 3.98Å; L324-M326 PolarHBondContact O-N 3.34Å; L324-M326 VanDerWaalsContact O-N 3.16Å
325	Q	92.1	Very high	93.4	Very high	169 Å²	169	39 Å²	39	79%	0.79	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.9	45.4	179.7	-59.7	179.2	3.6	0	0	112.7	L321 D322 N327	L321-Q325 PolarHBondContact O-N 3.38Å; L321-Q325 VanDerWaalsContact O-N 3.13Å; D322-Q325 WeakPolarHBondContact O-CG 3.22Å; D322-Q325 PolarHBondContact O-N 3.35Å; Q325-N327 PolarHBondContact O-N 3.27Å
326	M	87.7	Confident	93.5	Very high	17 Å²	17	38.7 Å²	38.7	8%	0.084	20%	0.197	C	C	.	.			trans	-63.2	126.1	-177.4	-68.7	-77.9	-65.8	0	0	110.7	R298 L321 L324 P328 Q329 P330	R298-M326 HydrophobicContact CB-CE 3.94Å; R298-M326 HydrophobicContact CB-SD 3.73Å; R298-M326 HydrophobicContact CG-CE 3.99Å; R298-M326 HydrophobicContact CG-SD 3.54Å; R298-M326 VanDerWaalsContact CG-SD 3.54Å; R298-M326 PolarHBondContact NE-SD 2.97Å; L321-M326 HydrophobicContact CD2-CB 4.43Å; L321-M326 HydrophobicContact CD2-CG 3.93Å; L321-M326 PolarHBondContact O-N 3.05Å; L324-M326 HydrophobicContact CB-CG 3.98Å; L324-M326 PolarHBondContact O-N 3.34Å; L324-M326 VanDerWaalsContact O-N 3.16Å; M326-P328 CarbonylContact O-C 3.6Å; M326-Q329 PolarHBondContact O-N 3.05Å; M326-P330 HydrophobicContact CE-CG 4.35Å
327	N	85.3	Confident	93.4	Very high	153 Å²	153	32.7 Å²	32.7	82%	0.818	17%	0.174	S	C	*	.	S	Bend	trans	-135.9	118.6	178.9	-171.3	7.8	0	0	0	111.5	Q325	Q325-N327 PolarHBondContact O-N 3.27Å
328	P	87.1	Confident	92.7	Very high	110 Å²	110	33.4 Å²	33.4	71%	0.714	18%	0.182	S	C	*	.	S	Bend	cis	-65.8	150.2	-7.8	29.2	-35	0	0	0	111.6	M326	M326-P328 CarbonylContact O-C 3.6Å
329	Q	92.3	Very high	91.8	Very high	29 Å²	29	35.3 Å²	35.3	14%	0.136	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-72.8	124.4	176.5	-168.7	-178.1	46.6	0	0	109.7	L321 M326 N572	L321-Q329 HydrophobicContact CB-CG 4.33Å; L321-Q329 HydrophobicContact CD1-CG 4.22Å; M326-Q329 PolarHBondContact O-N 3.05Å; Q329-N572 PolarHBondContact O-ND2 2.73Å
330	P	96.1	Very high	90.9	Very high	7 Å²	7	35.4 Å²	35.4	5%	0.045	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-67.4	135.7	179.9	27.4	-34.8	0	0	0	110.9	L303 I305 L321 M326	L303-P330 HydrophobicContact CB-CB 4.29Å; L303-P330 HydrophobicContact CD2-CB 4.32Å; L303-P330 HydrophobicContact CG-CB 4.34Å; L303-P330 WeakPolarHBondContact O-CB 3.35Å; I305-P330 HydrophobicContact CD1-CB 4.11Å; I305-P330 HydrophobicContact CD1-CG 3.57Å; I305-P330 HydrophobicContact CG1-CB 4.27Å; I305-P330 HydrophobicContact CG1-CG 4.25Å; L321-P330 HydrophobicContact CD1-CG 4.42Å; L321-P330 HydrophobicContact CD2-CG 3.72Å; M326-P330 HydrophobicContact CE-CG 4.35Å
331	P	97.8	Very high	90.6	Very high	16 Å²	16	35.4 Å²	35.4	10%	0.104	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-68.3	142.8	177.8	29.8	-37.4	0	0	0	111.9	L303 R304 I305 V370 N572 V574	L303-P331 WeakPolarHBondContact O-CD 3.48Å; R304-P331 HydrophobicContact CG-CG 3.96Å; I305-P331 PolarHBondContact N-O 3.21Å; P331-V370 HydrophobicContact CB-CG1 4.06Å; P331-V370 HydrophobicContact CB-CG2 3.96Å; P331-V370 HydrophobicContact CG-CG2 4Å; P331-N572 CarbonylContact C-O 3.6Å; P331-N572 VanDerWaalsContact CA-O 3.23Å; P331-N572 WeakPolarHBondContact CA-O 3.45Å; P331-N572 HydrophobicContact CB-CB 3.92Å; P331-V574 HydrophobicContact CB-CG2 3.77Å; P331-V574 HydrophobicContact CG-CG2 4.19Å
332	V	98.5	Very high	90.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.7	-177.3	-174.7	0	0	0	0	111.4	I305 A307 V314 I317 L318 L321 N572 M573 V574	I305-V332 HydrophobicContact CB-CG2 4.24Å; I305-V332 HydrophobicContact CD1-CG2 4.45Å; I305-V332 HydrophobicContact CG2-CG1 4.36Å; I305-V332 CarbonylContact O-C 3.54Å; A307-V332 HydrophobicContact CB-CG1 4.07Å; V314-V332 HydrophobicContact CG1-CG1 4.35Å; I317-V332 HydrophobicContact CG2-CG2 4.35Å; L318-V332 HydrophobicContact CD2-CB 4.43Å; L318-V332 HydrophobicContact CD2-CG2 3.85Å; L321-V332 HydrophobicContact CD1-CG2 3.82Å; V332-N572 PolarHBondContact N-O 2.81Å; V332-M573 HydrophobicContact CB-CE 4.16Å; V332-M573 HydrophobicContact CB-SD 4Å; V332-M573 HydrophobicContact CG1-CE 4.42Å; V332-M573 CarbonylContact O-C 3.56Å; V332-M573 WeakPolarHBondContact O-CA 3.35Å; V332-M573 WeakPolarHBondContact O-CE 3.16Å; V332-V574 PolarHBondContact O-N 3.11Å
333	A	98.1	Very high	90.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	153.7	169	0	0	0	0	0	111	I305 L306 A307 W349 V365 V574	I305-A333 PolarHBondContact O-N 3.12Å; L306-A333 HydrophobicContact CD1-CB 3.88Å; A307-A333 PolarHBondContact N-O 2.85Å; A333-W349 HydrophobicContact CB-CH2 4.09Å; A333-W349 HydrophobicContact CB-CZ2 3.63Å; A333-V365 HydrophobicContact CB-CG1 4.11Å; A333-V365 HydrophobicContact CB-CG2 3.85Å; A333-V574 HydrophobicContact CB-CB 3.78Å; A333-V574 HydrophobicContact CB-CG1 4.34Å; A333-V574 HydrophobicContact CB-CG2 4.04Å
334	V	96.3	Very high	90.5	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.012	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.4	-177.5	-173.3	0	0	0	0	110.5	V314 A344 L347 W349 M573	V314-V334 HydrophobicContact CG1-CG2 4.28Å; V314-V334 HydrophobicContact CG2-CB 4.41Å; V314-V334 HydrophobicContact CG2-CG1 3.86Å; V314-V334 HydrophobicContact CG2-CG2 3.75Å; V334-A344 HydrophobicContact CB-CB 4.37Å; V334-A344 HydrophobicContact CG1-CB 3.88Å; V334-L347 HydrophobicContact CG2-CD1 4.37Å; V334-W349 WeakPolarHBondContact O-CB 3.47Å; V334-W349 VanDerWaalsContact O-CE3 3.27Å; V334-M573 HydrophobicContact CG2-CE 4.06Å
335	L	96.5	Very high	90.4	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	109.3	165.3	-172.5	70.6	0	0	0	108.7	L269 F273 L306 A307 C308 G309 L337 Y353 V361	L269-L335 HydrophobicContact CD1-CD2 3.64Å; L269-L335 HydrophobicContact CD2-CD2 4.18Å; F273-L335 HydrophobicContact CE2-CD2 4.28Å; F273-L335 HydrophobicContact CZ-CD2 4.24Å; L306-L335 HydrophobicContact CD1-CB 4.09Å; A307-L335 PolarHBondContact O-N 3Å; C308-L335 HydrophobicContact CB-CB 4.18Å; C308-L335 HydrophobicContact CB-CD2 4.11Å; G309-L335 PolarHBondContact N-O 3.04Å; L335-L337 PolarHBondContact O-N 2.8Å; L335-Y353 HydrophobicContact CD1-CD2 3.66Å; L335-Y353 HydrophobicContact CD1-CE2 4.22Å; L335-Y353 HydrophobicContact CD1-CG 4.38Å; L335-Y353 HydrophobicContact CD2-CD2 4.43Å; L335-Y353 HydrophobicContact CG-CD2 4.26Å; L335-V361 HydrophobicContact CD1-CG1 3.94Å; L335-V361 HydrophobicContact CD1-CG2 4.11Å
336	P	93.6	Very high	90.4	Very high	3 Å²	3	23.2 Å²	23.2	2%	0.019	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	94.7	-167	26.9	-33.3	0	0	0	112.7	N341 A344 G352 Y353	P336-N341 HydrophobicContact CB-CB 3.84Å; P336-A344 HydrophobicContact CB-CB 3.7Å; P336-A344 HydrophobicContact CG-CB 4.2Å; P336-G352 CarbonylContact O-C 3.58Å; P336-G352 WeakPolarHBondContact O-CA 3.44Å; P336-Y353 PolarHBondContact O-N 2.87Å
337	L	90.1	Very high	90.7	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	14%	0.135	C	C	.	.			trans	-103.4	-4.2	175.4	-57.2	-177.6	0	0	0	113.2	G262 L269 C308 G309 L335 Y353	G262-L337 WeakPolarHBondContact CA-O 3.36Å; G262-L337 PolarHBondContact N-O 2.86Å; L269-L337 HydrophobicContact CD1-CD1 3.78Å; L269-L337 HydrophobicContact CD1-CD2 3.63Å; L269-L337 HydrophobicContact CD1-CG 4.27Å; C308-L337 HydrophobicContact CB-CD1 3.87Å; G309-L337 PolarHBondContact O-N 2.82Å; L335-L337 PolarHBondContact O-N 2.8Å; L337-Y353 HydrophobicContact CD2-CD1 4.12Å; L337-Y353 HydrophobicContact CD2-CG 4.15Å
338	G	80.7	Confident	91.1	Very high	15 Å²	15	17.8 Å²	17.8	16%	0.155	11%	0.11	C	C	.	.	S	Bend	trans	-77.4	-177.3	176.2	0	0	0	0	0	113.7	G309 N341 R429	G309-G338 PolarHBondContact O-N 3.5Å; G338-N341 VanDerWaalsContact C-ND2 3.34Å; G338-N341 WeakPolarHBondContact CA-OD1 3.14Å; G338-N341 PolarHBondContact N-OD1 3.12Å; G338-N341 PolarHBondContact O-ND2 2.96Å; G338-R429 WeakPolarHBondContact O-CD 3.34Å
339	T	75.4	Confident	91.2	Very high	39 Å²	39	13 Å²	13	24%	0.239	8%	0.078	C	C	.	.	S	Bend	trans	-88.8	-42.7	172.5	-48.6	0	0	0	0	111.6	N432 K433	T339-N432 HydrophobicContact CG2-CB 3.86Å; T339-N432 PolarHBondContact OG1-ND2 2.9Å; T339-K433 HydrophobicContact CG2-CG 3.89Å
340	G	74.8	Confident	91	Very high	28 Å²	28	13.1 Å²	13.1	29%	0.289	9%	0.087	S	C	.	.			trans	-74.4	-73.8	180	0	0	0	0	0	111.6	R345	G340-R345 PolarHBondContact O-NH1 3.19Å
341	N	87.6	Confident	90.3	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.005	10%	0.098	C	C	.	.			trans	60.8	38.3	175.2	-54.6	-37	0	0	0	114.1	D311 P336 G338 A344 R345 G351	D311-N341 WeakPolarHBondContact OD2-CA 3.36Å; D311-N341 PolarHBondContact OD2-N 2.86Å; P336-N341 HydrophobicContact CB-CB 3.84Å; G338-N341 VanDerWaalsContact C-ND2 3.34Å; G338-N341 WeakPolarHBondContact CA-OD1 3.14Å; G338-N341 PolarHBondContact N-OD1 3.12Å; G338-N341 PolarHBondContact O-ND2 2.96Å; N341-A344 HydrophobicContact CB-CB 4.11Å; N341-A344 PolarHBondContact O-N 3.3Å; N341-R345 PolarHBondContact O-N 2.92Å; N341-R345 VanDerWaalsContact O-N 3.11Å; N341-R345 PolarHBondContact O-NH1 3.27Å; N341-R345 VanDerWaalsContact O-NH1 3.12Å; N341-G351 PolarHBondContact ND2-O 3.15Å
342	D	91.1	Very high	89.7	Confident	3 Å²	3	14.2 Å²	14.2	2%	0.016	10%	0.102	C	C	.	.	H	α-helix	trans	-69.1	-36.9	-178	-63.2	-59.5	0	0	0	112	D311 A344 R345 T346 I482 R484 A487 G488	D311-D342 PolarHBondContact OD1-N 3.37Å; D342-A344 VanDerWaalsContact C-N 3.34Å; D342-A344 PolarHBondContact O-N 2.6Å; D342-R345 PolarHBondContact O-N 3.02Å; D342-T346 PolarHBondContact O-N 3.08Å; D342-T346 PolarHBondContact O-OG1 2.87Å; D342-I482 HydrophobicContact CB-CD1 3.88Å; D342-R484 HydrophobicContact CB-CB 3.97Å; D342-R484 WeakPolarHBondContact CB-O 3.34Å; D342-R484 WeakPolarHBondContact O-CB 3.43Å; D342-A487 WeakPolarHBondContact OD1-CA 3.37Å; D342-A487 PolarHBondContact OD1-N 3.47Å; D342-A487 VanDerWaalsContact OD1-N 3.08Å; D342-G488 PolarHBondContact OD1-N 2.86Å
343	L	93.5	Very high	89.1	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.9	-40.4	174.7	-177.1	59	0	0	0	111.4	D311 V314 R345 T346 L347 L373 I482 M573	D311-L343 WeakPolarHBondContact OD1-CB 3.43Å; D311-L343 PolarHBondContact OD1-N 3.13Å; V314-L343 HydrophobicContact CB-CD2 4.23Å; V314-L343 HydrophobicContact CG1-CD2 3.75Å; L343-R345 PolarHBondContact O-N 3.46Å; L343-T346 WeakPolarHBondContact O-CB 3.36Å; L343-T346 PolarHBondContact O-N 2.96Å; L343-L347 HydrophobicContact CD1-CD1 3.99Å; L343-L347 HydrophobicContact CD1-CG 4.31Å; L343-L347 HydrophobicContact CG-CD1 4.06Å; L343-L347 WeakPolarHBondContact O-CB 3.35Å; L343-L347 WeakPolarHBondContact O-CG 3.34Å; L343-L347 PolarHBondContact O-N 2.82Å; L343-L373 HydrophobicContact CD1-CD1 4.13Å; L343-L373 HydrophobicContact CD1-CD2 3.82Å; L343-L373 HydrophobicContact CD2-CD2 4.28Å; L343-I482 HydrophobicContact CB-CD1 4.31Å; L343-I482 HydrophobicContact CD1-CG2 4.25Å; L343-M573 HydrophobicContact CD2-CE 4.13Å
344	A	93.4	Very high	88.3	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-64.4	-40.2	177.9	0	0	0	0	0	112	V334 P336 N341 D342 L347 N348 W349 G350	V334-A344 HydrophobicContact CB-CB 4.37Å; V334-A344 HydrophobicContact CG1-CB 3.88Å; P336-A344 HydrophobicContact CB-CB 3.7Å; P336-A344 HydrophobicContact CG-CB 4.2Å; N341-A344 HydrophobicContact CB-CB 4.11Å; N341-A344 PolarHBondContact O-N 3.3Å; D342-A344 VanDerWaalsContact C-N 3.34Å; D342-A344 PolarHBondContact O-N 2.6Å; A344-L347 CarbonylContact O-C 3.57Å; A344-L347 PolarHBondContact O-N 3.01Å; A344-N348 PolarHBondContact O-N 3.03Å; A344-W349 HydrophobicContact CB-CB 4.08Å; A344-W349 PolarHBondContact O-N 2.81Å; A344-G350 WeakPolarHBondContact CB-O 3.36Å; A344-G350 PolarHBondContact O-N 2.81Å
345	R	90.7	Very high	87.7	Confident	48 Å²	48	23.6 Å²	23.6	18%	0.181	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-44.2	173.6	-75.8	-178.4	-175.8	75.1	-14.3	112	G340 N341 D342 L343 L347 N348 G351 R484 A487 G488	G340-R345 PolarHBondContact O-NH1 3.19Å; N341-R345 PolarHBondContact O-N 2.92Å; N341-R345 VanDerWaalsContact O-N 3.11Å; N341-R345 PolarHBondContact O-NH1 3.27Å; N341-R345 VanDerWaalsContact O-NH1 3.12Å; D342-R345 PolarHBondContact O-N 3.02Å; L343-R345 PolarHBondContact O-N 3.46Å; R345-L347 PolarHBondContact O-N 3.46Å; R345-N348 PolarHBondContact O-N 2.85Å; R345-N348 VanDerWaalsContact O-N 3.14Å; R345-G351 VanDerWaalsContact NH1-CA 3.34Å; R345-R484 HydrophobicContact CB-CB 4.45Å; R345-R484 HydrophobicContact CB-CG 3.93Å; R345-A487 PolarHBondContact NE-O 2.62Å; R345-A487 PolarHBondContact NH2-O 3.47Å; R345-G488 VanDerWaalsContact CD-CA 3.44Å
346	T	92.4	Very high	87.2	Confident	14 Å²	14	25.1 Å²	25.1	9%	0.086	16%	0.163	C	C	.	.	H	α-helix	trans	-57.6	-38.6	176.2	-60.2	0	0	0	0	111.6	D342 L343 N348 I482 P483 R484	D342-T346 PolarHBondContact O-N 3.08Å; D342-T346 PolarHBondContact O-OG1 2.87Å; L343-T346 WeakPolarHBondContact O-CB 3.36Å; L343-T346 PolarHBondContact O-N 2.96Å; T346-N348 VanDerWaalsContact C-N 3.33Å; T346-N348 PolarHBondContact O-N 2.82Å; T346-I482 HydrophobicContact CG2-CB 4.21Å; T346-I482 HydrophobicContact CG2-CG2 4.42Å; T346-P483 HydrophobicContact CG2-CG 4.48Å; T346-R484 WeakPolarHBondContact OG1-CG 3.11Å
347	L	94	Very high	87	Confident	0 Å²	0	29 Å²	29	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	15.6	-179.1	-63.4	176	0	0	0	114.1	V334 L343 A344 R345 W349 V371 M573 Q575 K576	V334-L347 HydrophobicContact CG2-CD1 4.37Å; L343-L347 HydrophobicContact CD1-CD1 3.99Å; L343-L347 HydrophobicContact CD1-CG 4.31Å; L343-L347 HydrophobicContact CG-CD1 4.06Å; L343-L347 WeakPolarHBondContact O-CB 3.35Å; L343-L347 WeakPolarHBondContact O-CG 3.34Å; L343-L347 PolarHBondContact O-N 2.82Å; A344-L347 CarbonylContact O-C 3.57Å; A344-L347 PolarHBondContact O-N 3.01Å; R345-L347 PolarHBondContact O-N 3.46Å; L347-W349 PolarHBondContact O-N 2.89Å; L347-V371 HydrophobicContact CD2-CG2 3.63Å; L347-M573 HydrophobicContact CD1-CB 3.93Å; L347-M573 HydrophobicContact CD1-CE 3.66Å; L347-M573 HydrophobicContact CD1-CG 4.3Å; L347-M573 HydrophobicContact CD2-CB 4.21Å; L347-Q575 HydrophobicContact CD2-CB 4.5Å; L347-Q575 WeakPolarHBondContact O-CG 3.47Å; L347-K576 PolarHBondContact O-N 3.03Å
348	N	92.5	Very high	87.1	Confident	56 Å²	56	29.2 Å²	29.2	30%	0.299	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	16.4	179.8	-55.1	-35.6	0	0	0	115.9	A344 R345 T346 G350 K576	A344-N348 PolarHBondContact O-N 3.03Å; R345-N348 PolarHBondContact O-N 2.85Å; R345-N348 VanDerWaalsContact O-N 3.14Å; T346-N348 VanDerWaalsContact C-N 3.33Å; T346-N348 PolarHBondContact O-N 2.82Å; N348-G350 VanDerWaalsContact C-N 3.29Å; N348-K576 HydrophobicContact CB-CB 4.25Å; N348-K576 WeakPolarHBondContact O-CD 3.25Å
349	W	90.8	Very high	87.6	Confident	10 Å²	10	30.8 Å²	30.8	4%	0.038	20%	0.199	C	C	.	.	S	Bend	trans	-80.3	-12.2	174.9	-69.6	91.9	0	0	0	113.3	A333 V334 A344 L347 V361 H364 V365 V574 K576	A333-W349 HydrophobicContact CB-CH2 4.09Å; A333-W349 HydrophobicContact CB-CZ2 3.63Å; V334-W349 WeakPolarHBondContact O-CB 3.47Å; V334-W349 VanDerWaalsContact O-CE3 3.27Å; A344-W349 HydrophobicContact CB-CB 4.08Å; A344-W349 PolarHBondContact O-N 2.81Å; L347-W349 PolarHBondContact O-N 2.89Å; W349-V361 HydrophobicContact CZ3-CG1 4.42Å; W349-H364 HydrophobicContact CH2-CB 3.86Å; W349-H364 HydrophobicContact CZ3-CB 3.99Å; W349-V365 HydrophobicContact CH2-CB 4.44Å; W349-V365 HydrophobicContact CH2-CG2 3.57Å; W349-V365 HydrophobicContact CZ2-CG2 4.38Å; W349-V365 HydrophobicContact CZ3-CG2 4.26Å; W349-V574 HydrophobicContact CZ2-CB 4.45Å; W349-V574 HydrophobicContact CZ2-CG1 4.05Å; W349-V574 PolarHBondContact NE1-O 2.96Å; W349-K576 HydrophobicContact CD2-CB 3.93Å; W349-K576 HydrophobicContact CD2-CD 4.32Å; W349-K576 HydrophobicContact CE3-CB 4.37Å; W349-K576 HydrophobicContact CE3-CD 4.02Å; W349-K576 HydrophobicContact CG-CB 4.21Å; W349-K576 HydrophobicContact CZ2-CB 4.23Å; W349-K576 HydrophobicContact CZ3-CD 4.36Å
350	G	86.6	Confident	88.3	Confident	30 Å²	30	31.8 Å²	31.8	31%	0.309	20%	0.2	S	C	.	.			trans	92.5	176.4	176.2	0	0	0	0	0	113.9	A344 N348	A344-G350 WeakPolarHBondContact CB-O 3.36Å; A344-G350 PolarHBondContact O-N 2.81Å; N348-G350 VanDerWaalsContact C-N 3.29Å
351	G	81.5	Confident	89.3	Confident	28 Å²	28	30.5 Å²	30.5	29%	0.289	19%	0.186	S	C	.	.	S	Bend	trans	-82	-11.2	-174.9	0	0	0	0	0	115.4	N341 R345	N341-G351 PolarHBondContact ND2-O 3.15Å; R345-G351 VanDerWaalsContact NH1-CA 3.34Å
352	G	84.8	Confident	89.7	Confident	19 Å²	19	30.4 Å²	30.4	20%	0.196	19%	0.186	C	C	.	.	S	Bend	trans	-178.9	149.7	-178.2	0	0	0	0	0	112.1	P336	P336-G352 CarbonylContact O-C 3.58Å; P336-G352 WeakPolarHBondContact O-CA 3.44Å
353	Y	85.8	Confident	89.7	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.016	20%	0.199	C	C	.	.			trans	-69.7	137.8	170.5	-179	-111	0	0	0	110.2	L269 L335 P336 L337 D355 E356 V361 R429	L269-Y353 HydrophobicContact CD1-CD1 4.06Å; L269-Y353 HydrophobicContact CD1-CE1 4Å; L269-Y353 HydrophobicContact CD2-CE1 3.86Å; L269-Y353 HydrophobicContact CD2-CE2 4.36Å; L269-Y353 HydrophobicContact CG-CE1 4.13Å; L335-Y353 HydrophobicContact CD1-CD2 3.66Å; L335-Y353 HydrophobicContact CD1-CE2 4.22Å; L335-Y353 HydrophobicContact CD1-CG 4.38Å; L335-Y353 HydrophobicContact CD2-CD2 4.43Å; L335-Y353 HydrophobicContact CG-CD2 4.26Å; P336-Y353 PolarHBondContact O-N 2.87Å; L337-Y353 HydrophobicContact CD2-CD1 4.12Å; L337-Y353 HydrophobicContact CD2-CG 4.15Å; Y353-D355 VanDerWaalsContact CE1-CA 3.49Å; Y353-D355 HydrophobicContact CE1-CB 4.46Å; Y353-D355 WeakPolarHBondContact CE1-OD1 3.36Å; Y353-D355 VanDerWaalsContact CZ-CA 3.48Å; Y353-E356 HydrophobicContact CD2-CG 4.11Å; Y353-E356 HydrophobicContact CE2-CG 3.72Å; Y353-E356 WeakPolarHBondContact CE2-O 3.44Å; Y353-E356 PolarHBondContact OH-O 3.23Å; Y353-V361 HydrophobicContact CE2-CG2 4.36Å; Y353-R429 PolarHBondContact O-NH1 2.79Å; Y353-R429 PolarHBondContact O-NH2 3.26Å; Y353-R429 VanDerWaalsContact O-NH2 3.11Å
354	T	83	Confident	89.7	Confident	114 Å²	114	33.3 Å²	33.3	70%	0.699	20%	0.204	S	C	*	.			trans	-128	43.9	-175.7	58.7	0	0	0	0	110.6	E356	T354-E356 PolarHBondContact O-N 3.28Å
355	D	82.8	Confident	89.9	Confident	80 Å²	80	33.3 Å²	33.3	43%	0.428	20%	0.203	S	C	.	.			trans	55.4	23.7	178.8	-91.9	-31.7	0	0	0	115.5	K268 Y353	K268-D355 IonicContact NZ-OD1 2.73Å; K268-D355 PolarHBondContact NZ-OD1 3.29Å; K268-D355 IonicContact NZ-OD2 3.4Å; K268-D355 PolarHBondContact NZ-OD2 3.31Å; Y353-D355 VanDerWaalsContact CE1-CA 3.49Å; Y353-D355 HydrophobicContact CE1-CB 4.46Å; Y353-D355 WeakPolarHBondContact CE1-OD1 3.36Å; Y353-D355 VanDerWaalsContact CZ-CA 3.48Å
356	E	86.1	Confident	90	Very high	33 Å²	33	32.7 Å²	32.7	15%	0.154	20%	0.202	C	C	.	.			trans	-59.2	142.5	174.2	70.7	170.5	156.3	0	0	110.9	Y353 T354 V358 K360 V361 K576	Y353-E356 HydrophobicContact CD2-CG 4.11Å; Y353-E356 HydrophobicContact CE2-CG 3.72Å; Y353-E356 WeakPolarHBondContact CE2-O 3.44Å; Y353-E356 PolarHBondContact OH-O 3.23Å; T354-E356 PolarHBondContact O-N 3.28Å; E356-V358 PolarHBondContact O-N 2.92Å; E356-V358 VanDerWaalsContact O-N 3.13Å; E356-K360 IonicContact OE2-NZ 3.36Å; E356-V361 HydrophobicContact CG-CG2 3.74Å; E356-K576 IonicContact OE1-NZ 3.57Å; E356-K576 IonicContact OE2-NZ 2.7Å
357	P	89.6	Confident	89.9	Confident	84 Å²	84	37.1 Å²	37.1	55%	0.545	23%	0.225	S	C	.	.			trans	-54.7	125.7	-176.7	-27.2	34.5	0	0	0	111.9	S359 K360 V361	P357-S359 PolarHBondContact O-N 3.33Å; P357-K360 WeakPolarHBondContact O-CA 3.26Å; P357-K360 VanDerWaalsContact O-CB 3.3Å; P357-K360 WeakPolarHBondContact O-CB 3.26Å; P357-K360 PolarHBondContact O-N 3.28Å; P357-V361 PolarHBondContact O-N 3.42Å
358	V	92.7	Very high	89.8	Confident	7 Å²	7	37.2 Å²	37.2	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-55	-23	177.8	-72	0	0	0	0	113.5	L269 M272 F273 I276 E356 V361 L362	L269-V358 HydrophobicContact CD2-CG1 3.49Å; L269-V358 VanDerWaalsContact CD2-CG1 3.49Å; M272-V358 HydrophobicContact CB-CG1 3.92Å; M272-V358 HydrophobicContact CB-CG2 3.91Å; M272-V358 HydrophobicContact CE-CG1 3.97Å; M272-V358 HydrophobicContact CE-CG2 4.07Å; M272-V358 HydrophobicContact SD-CG1 4.48Å; F273-V358 HydrophobicContact CD1-CB 4.33Å; F273-V358 HydrophobicContact CD1-CG1 4.45Å; F273-V358 HydrophobicContact CE1-CB 3.93Å; F273-V358 HydrophobicContact CE1-CG1 3.98Å; F273-V358 HydrophobicContact CE2-CG1 4.28Å; F273-V358 HydrophobicContact CZ-CB 4.32Å; F273-V358 HydrophobicContact CZ-CG1 3.89Å; I276-V358 HydrophobicContact CD1-CB 4.44Å; I276-V358 HydrophobicContact CD1-CG2 3.4Å; I276-V358 VanDerWaalsContact CD1-CG2 3.4Å; I276-V358 HydrophobicContact CG1-CG2 4.36Å; E356-V358 PolarHBondContact O-N 2.92Å; E356-V358 VanDerWaalsContact O-N 3.13Å; V358-V361 PolarHBondContact O-N 3.44Å; V358-L362 VanDerWaalsContact O-CG 3.3Å; V358-L362 WeakPolarHBondContact O-CG 3.48Å; V358-L362 PolarHBondContact O-N 3.17Å
359	S	90.3	Very high	89.9	Confident	48 Å²	48	37.2 Å²	37.2	34%	0.336	23%	0.231	S	C	.	.	H	α-helix	trans	-59.8	-46.6	170.7	176.4	0	0	0	0	111.6	H190 P357 L362 C363	H190-S359 PolarHBondContact CE1-O 3.43Å; H190-S359 VanDerWaalsContact CE1-O 3.32Å; H190-S359 PolarHBondContact CE1-OG 2.99Å; H190-S359 WeakPolarHBondContact NE2-CB 3.36Å; H190-S359 PolarHBondContact NE2-OG 3.25Å; P357-S359 PolarHBondContact O-N 3.33Å; S359-L362 PolarHBondContact O-N 3.49Å; S359-C363 PolarHBondContact O-N 3.1Å; S359-C363 VanDerWaalsContact O-N 3.12Å; S359-C363 PolarHBondContact O-SG 3.15Å
360	K	91.2	Very high	90.1	Very high	60 Å²	60	40 Å²	40	26%	0.261	25%	0.249	S	C	.	.	H	α-helix	trans	-65.4	-41.1	175.9	-178.5	-179.9	171.6	-177.2	0	111.3	E356 P357 L362 C363 H364 T581	E356-K360 IonicContact OE2-NZ 3.36Å; P357-K360 WeakPolarHBondContact O-CA 3.26Å; P357-K360 VanDerWaalsContact O-CB 3.3Å; P357-K360 WeakPolarHBondContact O-CB 3.26Å; P357-K360 PolarHBondContact O-N 3.28Å; K360-L362 VanDerWaalsContact C-N 3.34Å; K360-L362 PolarHBondContact O-N 3.02Å; K360-C363 PolarHBondContact O-N 3.38Å; K360-H364 WeakPolarHBondContact CE-NE2 3.46Å; K360-H364 WeakPolarHBondContact CG-NE2 3.5Å; K360-H364 PolarHBondContact O-CD2 2.99Å; K360-H364 PolarHBondContact O-N 2.73Å; K360-T581 HydrophobicContact CD-CG2 3.8Å; K360-T581 WeakPolarHBondContact CE-OG1 3.19Å; K360-T581 PolarHBondContact NZ-OG1 3.15Å
361	V	94.6	Very high	90.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.8	-48	173.8	179.5	0	0	0	0	110.7	L306 L335 W349 Y353 E356 P357 V358 C363 H364 V365	L306-V361 HydrophobicContact CD2-CG1 4.02Å; L335-V361 HydrophobicContact CD1-CG1 3.94Å; L335-V361 HydrophobicContact CD1-CG2 4.11Å; W349-V361 HydrophobicContact CZ3-CG1 4.42Å; Y353-V361 HydrophobicContact CE2-CG2 4.36Å; E356-V361 HydrophobicContact CG-CG2 3.74Å; P357-V361 PolarHBondContact O-N 3.42Å; V358-V361 PolarHBondContact O-N 3.44Å; V361-C363 VanDerWaalsContact C-N 3.34Å; V361-C363 PolarHBondContact O-N 3.23Å; V361-H364 WeakPolarHBondContact O-CB 3.36Å; V361-H364 PolarHBondContact O-N 2.74Å; V361-H364 VanDerWaalsContact O-N 3.16Å; V361-V365 HydrophobicContact CG1-CG2 4.47Å; V361-V365 WeakPolarHBondContact O-CG2 3.34Å; V361-V365 PolarHBondContact O-N 3.23Å
362	L	95.6	Very high	91.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.1	-39.4	179.1	-70.4	170.4	0	0	0	112.6	V253 F273 I276 L277 V358 S359 K360 V365 E366	V253-L362 HydrophobicContact CG1-CD2 4.33Å; F273-L362 HydrophobicContact CD1-CD2 4.36Å; F273-L362 HydrophobicContact CE1-CD2 4.13Å; F273-L362 HydrophobicContact CE1-CG 4.24Å; I276-L362 HydrophobicContact CB-CD1 4.34Å; I276-L362 HydrophobicContact CG2-CD1 3.69Å; L277-L362 HydrophobicContact CD1-CD2 4.12Å; L277-L362 HydrophobicContact CD2-CD1 3.92Å; L277-L362 HydrophobicContact CD2-CD2 4.3Å; L277-L362 HydrophobicContact CG-CD1 4.19Å; V358-L362 VanDerWaalsContact O-CG 3.3Å; V358-L362 WeakPolarHBondContact O-CG 3.48Å; V358-L362 PolarHBondContact O-N 3.17Å; S359-L362 PolarHBondContact O-N 3.49Å; K360-L362 VanDerWaalsContact C-N 3.34Å; K360-L362 PolarHBondContact O-N 3.02Å; L362-V365 PolarHBondContact O-N 3.17Å; L362-E366 WeakPolarHBondContact O-CB 3.33Å; L362-E366 PolarHBondContact O-N 3.23Å
363	C	92.6	Very high	91.9	Very high	42 Å²	42	40.3 Å²	40.3	28%	0.284	23%	0.232	S	C	.	.	H	α-helix	trans	-61.3	-44.8	173.1	-61.1	0	0	0	0	111.3	S359 K360 V361 V365 E366 D367	S359-C363 PolarHBondContact O-N 3.1Å; S359-C363 VanDerWaalsContact O-N 3.12Å; S359-C363 PolarHBondContact O-SG 3.15Å; K360-C363 PolarHBondContact O-N 3.38Å; V361-C363 VanDerWaalsContact C-N 3.34Å; V361-C363 PolarHBondContact O-N 3.23Å; C363-V365 VanDerWaalsContact C-N 3.28Å; C363-V365 PolarHBondContact O-N 3.21Å; C363-E366 WeakPolarHBondContact O-CB 3.5Å; C363-E366 PolarHBondContact O-N 3.43Å; C363-E366 VanDerWaalsContact O-N 3.09Å; C363-D367 WeakPolarHBondContact O-CB 3.39Å; C363-D367 PolarHBondContact O-N 2.62Å
364	H	93.6	Very high	92.4	Very high	22 Å²	22	40.1 Å²	40.1	10%	0.102	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-35.3	175.7	-68.8	-50.4	0	0	0	113	W349 K360 V361 G368 K576	W349-H364 HydrophobicContact CH2-CB 3.86Å; W349-H364 HydrophobicContact CZ3-CB 3.99Å; K360-H364 WeakPolarHBondContact CE-NE2 3.46Å; K360-H364 WeakPolarHBondContact CG-NE2 3.5Å; K360-H364 PolarHBondContact O-CD2 2.99Å; K360-H364 PolarHBondContact O-N 2.73Å; V361-H364 WeakPolarHBondContact O-CB 3.36Å; V361-H364 PolarHBondContact O-N 2.74Å; V361-H364 VanDerWaalsContact O-N 3.16Å; H364-G368 WeakPolarHBondContact O-CA 3.43Å; H364-G368 PolarHBondContact O-N 2.83Å; H364-K576 HydrophobicContact CB-CD 4.47Å; H364-K576 HydrophobicContact CB-CG 4.26Å; H364-K576 WeakPolarHBondContact CD2-CE 3.44Å; H364-K576 WeakPolarHBondContact NE2-CE 3.26Å
365	V	96.1	Very high	93	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.4	-35.4	174	178.3	0	0	0	0	111.3	V253 R304 L306 A333 W349 V361 L362 C363	V253-V365 HydrophobicContact CG1-CG1 4.13Å; V253-V365 HydrophobicContact CG2-CG1 3.74Å; R304-V365 HydrophobicContact CB-CG1 4.24Å; R304-V365 WeakPolarHBondContact CD-O 3.39Å; R304-V365 PolarHBondContact NH1-O 3Å; L306-V365 HydrophobicContact CB-CG2 4.44Å; L306-V365 HydrophobicContact CD1-CG2 3.78Å; L306-V365 HydrophobicContact CD2-CG2 4.22Å; L306-V365 HydrophobicContact CG-CG2 4.36Å; A333-V365 HydrophobicContact CB-CG1 4.11Å; A333-V365 HydrophobicContact CB-CG2 3.85Å; W349-V365 HydrophobicContact CH2-CB 4.44Å; W349-V365 HydrophobicContact CH2-CG2 3.57Å; W349-V365 HydrophobicContact CZ2-CG2 4.38Å; W349-V365 HydrophobicContact CZ3-CG2 4.26Å; V361-V365 HydrophobicContact CG1-CG2 4.47Å; V361-V365 WeakPolarHBondContact O-CG2 3.34Å; V361-V365 PolarHBondContact O-N 3.23Å; L362-V365 PolarHBondContact O-N 3.17Å; C363-V365 VanDerWaalsContact C-N 3.28Å; C363-V365 PolarHBondContact O-N 3.21Å
366	E	92.8	Very high	93.7	Very high	35 Å²	35	31 Å²	31	16%	0.164	18%	0.177	C	C	.	.	H	α-helix	trans	-71.4	-44.3	178.1	-172.7	168.6	-158.2	0	0	112.2	V193 K251 R304 L362 C363	V193-E366 HydrophobicContact CG1-CB 3.81Å; V193-E366 HydrophobicContact CG1-CG 3.94Å; K251-E366 HydrophobicContact CB-CG 4.47Å; K251-E366 HydrophobicContact CD-CG 4.05Å; K251-E366 WeakPolarHBondContact CD-O 3.38Å; K251-E366 PolarHBondContact NZ-O 3.32Å; R304-E366 PolarHBondContact NH1-O 3.05Å; R304-E366 VanDerWaalsContact NH1-O 3.14Å; L362-E366 WeakPolarHBondContact O-CB 3.33Å; L362-E366 PolarHBondContact O-N 3.23Å; C363-E366 WeakPolarHBondContact O-CB 3.5Å; C363-E366 PolarHBondContact O-N 3.43Å; C363-E366 VanDerWaalsContact O-N 3.09Å
367	D	90.4	Very high	94.1	Very high	107 Å²	107	30.9 Å²	30.9	57%	0.572	18%	0.178	S	C	*	.	H	α-helix	trans	-89.7	-18.1	-173.1	-64.3	-27.2	0	0	0	113.9	C363	C363-D367 WeakPolarHBondContact O-CB 3.39Å; C363-D367 PolarHBondContact O-N 2.62Å
368	G	92.3	Very high	94.3	Very high	2 Å²	2	27.1 Å²	27.1	2%	0.021	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-57.1	143.6	-177.2	0	0	0	0	0	113.1	R304 H364 Q575	R304-G368 PolarHBondContact NH1-O 2.95Å; R304-G368 PolarHBondContact NH2-O 3.04Å; R304-G368 VanDerWaalsContact NH2-O 3.13Å; H364-G368 WeakPolarHBondContact O-CA 3.43Å; H364-G368 PolarHBondContact O-N 2.83Å; G368-Q575 VanDerWaalsContact CA-O 3.25Å; G368-Q575 WeakPolarHBondContact CA-O 3.19Å
369	S	94.3	Very high	94.2	Very high	56 Å²	56	31.1 Å²	31.1	39%	0.392	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	148.8	174.2	49.1	0	0	0	0	110	V574 Q575	S369-V574 CarbonylContact O-C 3.55Å; S369-V574 WeakPolarHBondContact O-CA 3.34Å; S369-Q575 PolarHBondContact N-O 3.43Å; S369-Q575 PolarHBondContact O-N 3.48Å
370	V	95.8	Very high	94.2	Very high	70 Å²	70	31 Å²	31	42%	0.424	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.8	172.3	-178.6	0	0	0	0	107.9	P331 N572 M573	P331-V370 HydrophobicContact CB-CG1 4.06Å; P331-V370 HydrophobicContact CB-CG2 3.96Å; P331-V370 HydrophobicContact CG-CG2 4Å; V370-N572 HydrophobicContact CG1-CB 3.98Å; V370-M573 CarbonylContact C-O 3.56Å; V370-M573 VanDerWaalsContact CA-O 3.29Å; V370-M573 WeakPolarHBondContact CA-O 3.03Å
371	V	95.8	Very high	94.1	Very high	25 Å²	25	32.4 Å²	32.4	15%	0.152	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	157.5	175.4	-59	0	0	0	0	109.4	L347 M573 Q575	L347-V371 HydrophobicContact CD2-CG2 3.63Å; V371-M573 HydrophobicContact CG2-CB 4.02Å; V371-M573 PolarHBondContact N-O 2.88Å; V371-M573 PolarHBondContact O-N 3.38Å; V371-Q575 HydrophobicContact CG1-CB 3.88Å; V371-Q575 HydrophobicContact CG2-CB 4.04Å
372	Q	96.6	Very high	93.1	Very high	58 Å²	58	40.5 Å²	40.5	27%	0.271	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	150.4	173.8	-63.7	-54.3	-45.8	0	0	110.1	H506 D507 Q570 A571 N572	Q372-H506 PolarHBondContact O-CD2 3.48Å; Q372-D507 HydrophobicContact CB-CB 3.91Å; Q372-Q570 HydrophobicContact CB-CB 4.3Å; Q372-A571 CarbonylContact C-O 3.59Å; Q372-N572 PolarHBondContact NE2-OD1 2.86Å; Q372-N572 PolarHBondContact OE1-OD1 2.93Å
373	L	97.3	Very high	91.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	116.7	169.9	175.6	67.7	0	0	0	108.2	L318 L343 N400 I482 H506 Q570 A571 M573	L318-L373 HydrophobicContact CD1-CD2 4.47Å; L343-L373 HydrophobicContact CD1-CD1 4.13Å; L343-L373 HydrophobicContact CD1-CD2 3.82Å; L343-L373 HydrophobicContact CD2-CD2 4.28Å; L373-N400 HydrophobicContact CD2-CB 4.17Å; L373-I482 HydrophobicContact CD1-CG2 3.83Å; L373-H506 CarbonylContact C-O 3.52Å; L373-H506 WeakPolarHBondContact CA-O 3.38Å; L373-H506 HydrophobicContact CD1-CB 4.08Å; L373-Q570 CarbonylContact O-C 3.54Å; L373-Q570 WeakPolarHBondContact O-CA 3.47Å; L373-A571 PolarHBondContact N-O 3.19Å; L373-A571 PolarHBondContact O-N 2.99Å; L373-M573 HydrophobicContact CB-CG 3.52Å; L373-M573 HydrophobicContact CD2-CE 4.49Å; L373-M573 HydrophobicContact CD2-CG 3.91Å; L373-M573 HydrophobicContact CD2-SD 4.13Å; L373-M573 HydrophobicContact CG-CG 4.37Å
374	D	97.3	Very high	90.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	142.8	172.3	-69.2	-40.5	0	0	0	110.6	N481 H506 D507 D508 G509 L567 Q570	D374-N481 WeakPolarHBondContact CB-OD1 3.32Å; D374-N481 PolarHBondContact O-ND2 3.44Å; D374-H506 PolarHBondContact N-O 2.91Å; D374-D507 WeakPolarHBondContact OD2-CA 3.47Å; D374-D507 PolarHBondContact OD2-N 3.31Å; D374-D508 PolarHBondContact OD2-N 3.48Å; D374-G509 WeakPolarHBondContact OD2-CA 3.5Å; D374-G509 PolarHBondContact OD2-N 3.25Å; D374-L567 HydrophobicContact CB-CD1 3.91Å; D374-Q570 WeakPolarHBondContact OD1-CG 3.13Å; D374-Q570 PolarHBondContact OD1-NE2 3.16Å
375	R	96.2	Very high	88.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	143.1	179.6	-62.5	178	61.1	-146.2	-6.1	108.9	D322 V398 N400 R568 N569 A571	D322-R375 IonicContact OD1-CZ 3.81Å; D322-R375 IonicContact OD1-NH1 3.09Å; D322-R375 PolarHBondContact OD1-NH1 2.95Å; D322-R375 IonicContact OD2-CZ 2.77Å; D322-R375 IonicContact OD2-NH1 2.82Å; D322-R375 PolarHBondContact OD2-NH1 2.97Å; D322-R375 IonicContact OD2-NH2 3.38Å; D322-R375 PolarHBondContact OD2-NH2 3.43Å; R375-V398 HydrophobicContact CB-CG2 4.4Å; R375-N400 WeakPolarHBondContact CD-OD1 3.01Å; R375-N400 WeakPolarHBondContact CG-OD1 3.47Å; R375-N400 PolarHBondContact NE-OD1 3.44Å; R375-R568 WeakPolarHBondContact O-CA 3.27Å; R375-R568 WeakPolarHBondContact O-CB 3.35Å; R375-R568 PolarHBondContact O-N 3.12Å; R375-N569 PolarHBondContact N-O 3.47Å; R375-N569 PolarHBondContact NH1-OD1 3.39Å; R375-A571 HydrophobicContact CG-CB 4.41Å
376	W	96.2	Very high	86.5	Confident	1 Å²	1	58.4 Å²	58.4	0%	0.004	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130.2	-163.6	-65.3	89.9	0	0	0	111.6	V398 F399 N481 G509 C510 I511 R537 I565 S566 L567	W376-V398 CarbonylContact O-C 3.5Å; W376-V398 WeakPolarHBondContact O-CA 3.25Å; W376-V398 WeakPolarHBondContact O-CG2 3.46Å; W376-F399 HydrophobicContact CB-CD1 3.83Å; W376-F399 HydrophobicContact CB-CD2 4.33Å; W376-F399 HydrophobicContact CB-CE1 3.41Å; W376-F399 VanDerWaalsContact CB-CE1 3.41Å; W376-F399 HydrophobicContact CB-CE2 3.93Å; W376-F399 HydrophobicContact CB-CG 4.3Å; W376-F399 HydrophobicContact CB-CZ 3.48Å; W376-F399 VanDerWaalsContact CB-CZ 3.48Å; W376-F399 HydrophobicContact CG-CE1 4.33Å; W376-F399 HydrophobicContact CG-CE2 4.13Å; W376-F399 AromaticContact CG-CZ 3.91Å; W376-F399 HydrophobicContact CG-CZ 3.91Å; W376-F399 PolarHBondContact N-O 2.95Å; W376-F399 PolarHBondContact O-N 2.79Å; W376-N481 VanDerWaalsContact NE1-CG 3.35Å; W376-N481 PolarHBondContact NE1-OD1 2.85Å; W376-G509 VanDerWaalsContact CH2-O 3.31Å; W376-G509 WeakPolarHBondContact CH2-O 3.47Å; W376-C510 VanDerWaalsContact CZ2-C 3.4Å; W376-C510 WeakPolarHBondContact CZ2-O 3.32Å; W376-I511 HydrophobicContact CB-CD1 4.3Å; W376-I511 HydrophobicContact CD2-CD1 3.23Å; W376-I511 HydrophobicContact CD2-CG1 3.62Å; W376-I511 VanDerWaalsContact CE2-CG1 3.42Å; W376-I511 HydrophobicContact CE3-CD1 3.2Å; W376-I511 HydrophobicContact CE3-CG1 3.88Å; W376-I511 HydrophobicContact CG-CD1 3.69Å; W376-I511 HydrophobicContact CG-CG1 4.18Å; W376-I511 HydrophobicContact CH2-CB 4.37Å; W376-I511 HydrophobicContact CH2-CD1 3.97Å; W376-I511 HydrophobicContact CH2-CG1 3.78Å; W376-I511 HydrophobicContact CZ2-CB 4.42Å; W376-I511 HydrophobicContact CZ2-CD1 4.05Å; W376-I511 HydrophobicContact CZ2-CG1 3.56Å; W376-I511 HydrophobicContact CZ3-CD1 3.56Å; W376-I511 HydrophobicContact CZ3-CG1 3.92Å; W376-R537 VanDerWaalsContact CZ3-O 3.32Å; W376-R537 WeakPolarHBondContact CZ3-O 3.21Å; W376-I565 HydrophobicContact CB-CG2 4.2Å; W376-I565 HydrophobicContact CE3-CG2 4.03Å; W376-S566 CarbonylContact C-O 3.55Å; W376-S566 WeakPolarHBondContact CA-O 3.36Å; W376-L567 HydrophobicContact CD2-CD1 4.38Å; W376-L567 HydrophobicContact CE3-CB 4.28Å; W376-L567 VanDerWaalsContact CE3-N 3.29Å; W376-L567 HydrophobicContact CH2-CB 4.23Å; W376-L567 HydrophobicContact CH2-CD1 4.39Å; W376-L567 HydrophobicContact CZ2-CD1 3.97Å; W376-L567 HydrophobicContact CZ3-CB 4.04Å
377	N	95.3	Very high	84.6	Confident	31 Å²	31	62.1 Å²	62.1	17%	0.166	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	143.5	174.3	-71.8	-44.6	0	0	0	110.5	N397 I565 S566 R568	N377-N397 WeakPolarHBondContact CA-O 3.33Å; N377-I565 WeakPolarHBondContact O-CA 3.24Å; N377-S566 PolarHBondContact N-O 3.02Å; N377-S566 PolarHBondContact O-N 3.16Å; N377-R568 WeakPolarHBondContact ND2-CB 3.38Å; N377-R568 WeakPolarHBondContact OD1-CB 3.49Å; N377-R568 VanDerWaalsContact OD1-CD 3.3Å; N377-R568 WeakPolarHBondContact OD1-CD 3.37Å; N377-R568 VanDerWaalsContact OD1-CG 3.25Å; N377-R568 WeakPolarHBondContact OD1-CG 3.35Å; N377-R568 PolarHBondContact OD1-NH1 2.96Å
378	L	92.9	Very high	83	Confident	5 Å²	5	61 Å²	61	3%	0.026	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	101.6	168.2	-76.8	163.3	0	0	0	108.5	L394 N397 F399 F403 V551 I565	L378-L394 HydrophobicContact CB-CD1 3.98Å; L378-L394 HydrophobicContact CD1-CD1 4.24Å; L378-N397 PolarHBondContact N-O 3.46Å; L378-F399 HydrophobicContact CD1-CD1 3.57Å; L378-F399 HydrophobicContact CD1-CE1 4.24Å; L378-F399 HydrophobicContact CD1-CG 4.48Å; L378-F399 HydrophobicContact CD2-CD1 4.3Å; L378-F399 HydrophobicContact CD2-CE1 4.14Å; L378-F399 HydrophobicContact CG-CD1 3.73Å; L378-F399 HydrophobicContact CG-CE1 3.99Å; L378-F403 HydrophobicContact CD1-CD2 4.14Å; L378-F403 HydrophobicContact CD1-CG 4.49Å; L378-F403 HydrophobicContact CD2-CD1 4.24Å; L378-F403 HydrophobicContact CD2-CD2 4.23Å; L378-F403 HydrophobicContact CD2-CE1 4.49Å; L378-F403 HydrophobicContact CD2-CE2 4.45Å; L378-F403 HydrophobicContact CD2-CG 4.12Å; L378-V551 HydrophobicContact CD1-CB 4.43Å; L378-V551 HydrophobicContact CD1-CG1 3.62Å; L378-V551 HydrophobicContact CD1-CG2 3.92Å; L378-I565 HydrophobicContact CD2-CD1 4.19Å; L378-I565 HydrophobicContact CD2-CG1 3.85Å
379	L	91.9	Very high	81.5	Confident	91 Å²	91	69.8 Å²	69.8	48%	0.476	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.1	176.3	-65.1	170.4	0	0	0	109	L563 R564	L379-L563 CarbonylContact O-C 3.58Å; L379-L563 VanDerWaalsContact O-CA 3.28Å; L379-L563 WeakPolarHBondContact O-CA 3.41Å; L379-R564 HydrophobicContact CB-CB 4.2Å; L379-R564 PolarHBondContact N-O 2.83Å; L379-R564 PolarHBondContact O-N 3.23Å
380	V	89.9	Confident	79.9	Confident	47 Å²	47	68.6 Å²	68.6	29%	0.285	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.2	179.5	-173.6	0	0	0	0	109.3	L394 L563	V380-L394 HydrophobicContact CG2-CD1 3.53Å; V380-L394 HydrophobicContact CG2-CG 3.77Å; V380-L563 HydrophobicContact CG2-CD2 3.97Å; V380-L563 HydrophobicContact CG2-CG 4.39Å
381	E	88	Confident	78.8	Confident	88 Å²	88	68.8 Å²	68.8	41%	0.411	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.3	173.1	-66.8	178.1	-166.7	0	0	109.6	T562 R564	E381-T562 PolarHBondContact N-O 3.22Å; E381-T562 PolarHBondContact O-N 2.78Å; E381-R564 IonicContact OE1-CZ 3.75Å; E381-R564 IonicContact OE1-NH1 3.21Å; E381-R564 PolarHBondContact OE1-NH1 2.97Å; E381-R564 IonicContact OE2-NH1 3.41Å
382	K	73.7	Confident	77.6	Confident	170 Å²	170	72.5 Å²	72.5	74%	0.739	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	131.2	-177	-64.3	-175.8	179	-171.2	0	110.6
383	T	67.6	Low	76.6	Confident	46 Å²	46	77.8 Å²	77.8	28%	0.282	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-85.6	139.1	166.6	-44.7	0	0	0	0	108.9	V385 S561	T383-V385 HydrophobicContact CG2-CG2 4Å; T383-V385 PolarHBondContact O-N 2.83Å; T383-S561 WeakPolarHBondContact OG1-CA 3.48Å
384	A	59	Low	75.7	Confident	115 Å²	115	78.4 Å²	78.4	95%	0.95	42%	0.422	S	S	*	.	S	Bend	trans	-71.2	18.9	-173.6	0	0	0	0	0	115.5
385	V	59.3	Low	74.4	Confident	109 Å²	109	82.1 Å²	82.1	66%	0.661	45%	0.446	S	S	*	.	S	Bend	trans	-92.3	147.2	-174.2	-175.4	0	0	0	0	110.5	T383	T383-V385 HydrophobicContact CG2-CG2 4Å; T383-V385 PolarHBondContact O-N 2.83Å
386	Q	54.1	Low	73.5	Confident	170 Å²	170	85 Å²	85	79%	0.794	46%	0.461	S	S	*	.			trans	-55.1	157	-177.9	-75.5	-154.4	15	0	0	114.1	E388	Q386-E388 PolarHBondContact O-N 2.92Å; Q386-E388 VanDerWaalsContact O-N 3.15Å
387	P	53.3	Low	73.1	Confident	113 Å²	113	89.4 Å²	89.4	73%	0.734	48%	0.484	S	S	*	.			trans	-75.3	107.3	-166.2	29.9	-32.5	0	0	0	112
388	E	57.3	Low	72.9	Confident	84 Å²	84	88.2 Å²	88.2	39%	0.393	48%	0.478	S	S	.	.			trans	-76	158.1	156.3	-73.2	-164.7	158	0	0	110.7	Q386 G390 T546	Q386-E388 PolarHBondContact O-N 2.92Å; Q386-E388 VanDerWaalsContact O-N 3.15Å; E388-G390 PolarHBondContact O-N 3.47Å; E388-T546 VanDerWaalsContact CB-OG1 3.31Å; E388-T546 WeakPolarHBondContact CB-OG1 3.26Å; E388-T546 WeakPolarHBondContact OE2-CB 3.25Å; E388-T546 PolarHBondContact OE2-N 3.33Å; E388-T546 PolarHBondContact OE2-OG1 3.12Å
389	E	59.4	Low	72.9	Confident	186 Å²	186	88 Å²	88	87%	0.869	48%	0.477	S	S	*	.	S	Bend	trans	-61.8	100.6	172.8	-73.8	-176.8	161.1	0	0	111	T546	E389-T546 WeakPolarHBondContact O-CG2 3.35Å
390	G	61.9	Low	73	Confident	31 Å²	31	83.7 Å²	83.7	32%	0.32	45%	0.454	S	S	.	.	S	Bend	trans	-178.2	157.2	179	0	0	0	0	0	112.8	E388	E388-G390 PolarHBondContact O-N 3.47Å
391	T	72.8	Confident	73.1	Confident	74 Å²	74	81.5 Å²	81.5	45%	0.454	44%	0.441	S	S	.	.	B	Isolated β-bridge	trans	-81.6	137	177.5	-68.6	0	0	0	0	110	K393 R557 A559	T391-K393 WeakPolarHBondContact CG2-O 3.45Å; T391-R557 PolarHBondContact N-O 3.35Å; T391-A559 PolarHBondContact O-N 2.77Å; T391-A559 VanDerWaalsContact O-N 3.13Å
392	Q	69.4	Low	73.4	Confident	103 Å²	103	78.2 Å²	78.2	48%	0.481	43%	0.425	S	S	.	.	S	Bend	trans	-93.4	0.1	179.6	-64	-176.8	-2.1	0	0	113.9	A559	Q392-A559 HydrophobicContact CG-CB 4.18Å
393	K	75.1	Confident	74.3	Confident	169 Å²	169	70.1 Å²	70.1	74%	0.735	39%	0.39	S	S	*	.	S	Bend	trans	-133	126.3	-176.1	-173.4	178.4	178.4	-177.1	0	111	T391	T391-K393 WeakPolarHBondContact CG2-O 3.45Å
394	L	78.3	Confident	75.5	Confident	14 Å²	14	67.9 Å²	67.9	7%	0.073	38%	0.376	C	S	.	.			trans	-71	143.1	172	-65.7	173	0	0	0	111	L378 V380 L396 V549 V551 L556 L558 L563	L378-L394 HydrophobicContact CB-CD1 3.98Å; L378-L394 HydrophobicContact CD1-CD1 4.24Å; V380-L394 HydrophobicContact CG2-CD1 3.53Å; V380-L394 HydrophobicContact CG2-CG 3.77Å; L394-L396 VanDerWaalsContact CB-O 3.32Å; L394-L396 WeakPolarHBondContact CB-O 3.43Å; L394-L396 PolarHBondContact O-N 2.93Å; L394-V549 HydrophobicContact CD2-CG2 3.95Å; L394-V551 HydrophobicContact CD1-CG2 4.46Å; L394-V551 HydrophobicContact CD2-CG2 4.19Å; L394-L556 HydrophobicContact CD2-CD1 4.33Å; L394-L556 HydrophobicContact CD2-CD2 4.15Å; L394-L558 HydrophobicContact CD2-CD1 4.13Å; L394-L563 HydrophobicContact CD1-CD2 3.85Å
395	P	70.3	Confident	77.1	Confident	78 Å²	78	62.4 Å²	62.4	51%	0.506	33%	0.331	S	S	.	.	S	Bend	trans	-68	-28.2	177.3	26.5	-35.4	0	0	0	111.3	P554 L556	P395-P554 HydrophobicContact CB-CB 4.41Å; P395-P554 HydrophobicContact CG-CB 3.6Å; P395-P554 HydrophobicContact CG-CG 4.38Å; P395-L556 HydrophobicContact CG-CD2 3.93Å
396	L	78.6	Confident	78.5	Confident	60 Å²	60	57.4 Å²	57.4	31%	0.314	30%	0.302	S	S	.	.			trans	-128.4	135.2	175.3	-63.2	175.4	0	0	0	109	L394 V551 P554	L394-L396 VanDerWaalsContact CB-O 3.32Å; L394-L396 WeakPolarHBondContact CB-O 3.43Å; L394-L396 PolarHBondContact O-N 2.93Å; L396-V551 HydrophobicContact CB-CG1 4.11Å; L396-P554 HydrophobicContact CD1-CG 3.75Å; L396-P554 HydrophobicContact CG-CG 4.28Å
397	N	87.1	Confident	80	Confident	94 Å²	94	49.9 Å²	49.9	50%	0.503	27%	0.266	S	S	.	.	S	Bend	trans	-99.8	12	174.2	65.4	-23.1	0	0	0	112.4	N377 L378	N377-N397 WeakPolarHBondContact CA-O 3.33Å; L378-N397 PolarHBondContact N-O 3.46Å
398	V	91.6	Very high	81.4	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.03	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	142	179	62.9	0	0	0	0	109.8	R375 W376	R375-V398 HydrophobicContact CB-CG2 4.4Å; W376-V398 CarbonylContact O-C 3.5Å; W376-V398 WeakPolarHBondContact O-CA 3.25Å; W376-V398 WeakPolarHBondContact O-CG2 3.46Å
399	F	92.9	Very high	82.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	153.4	167.9	70.9	-87.1	0	0	0	111.8	W376 L378 F403 N481 I511 V551 M552 I565	W376-F399 HydrophobicContact CB-CD1 3.83Å; W376-F399 HydrophobicContact CB-CD2 4.33Å; W376-F399 HydrophobicContact CB-CE1 3.41Å; W376-F399 VanDerWaalsContact CB-CE1 3.41Å; W376-F399 HydrophobicContact CB-CE2 3.93Å; W376-F399 HydrophobicContact CB-CG 4.3Å; W376-F399 HydrophobicContact CB-CZ 3.48Å; W376-F399 VanDerWaalsContact CB-CZ 3.48Å; W376-F399 HydrophobicContact CG-CE1 4.33Å; W376-F399 HydrophobicContact CG-CE2 4.13Å; W376-F399 AromaticContact CG-CZ 3.91Å; W376-F399 HydrophobicContact CG-CZ 3.91Å; W376-F399 PolarHBondContact N-O 2.95Å; W376-F399 PolarHBondContact O-N 2.79Å; L378-F399 HydrophobicContact CD1-CD1 3.57Å; L378-F399 HydrophobicContact CD1-CE1 4.24Å; L378-F399 HydrophobicContact CD1-CG 4.48Å; L378-F399 HydrophobicContact CD2-CD1 4.3Å; L378-F399 HydrophobicContact CD2-CE1 4.14Å; L378-F399 HydrophobicContact CG-CD1 3.73Å; L378-F399 HydrophobicContact CG-CE1 3.99Å; F399-F403 HydrophobicContact CD1-CB 4.12Å; F399-F403 HydrophobicContact CE1-CB 3.98Å; F399-F403 HydrophobicContact CE2-CB 4.43Å; F399-F403 HydrophobicContact CG-CB 4.36Å; F399-F403 HydrophobicContact CZ-CB 4.13Å; F399-N481 HydrophobicContact CE2-CB 4.34Å; F399-I511 HydrophobicContact CE2-CD1 4.31Å; F399-I511 HydrophobicContact CZ-CD1 3.64Å; F399-V551 HydrophobicContact CB-CG1 4Å; F399-M552 HydrophobicContact CB-CG 3.82Å; F399-M552 HydrophobicContact CB-SD 4.24Å; F399-I565 HydrophobicContact CE1-CG2 3.68Å; F399-I565 HydrophobicContact CZ-CG2 3.88Å
400	N	93.7	Very high	84.1	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	18%	0.181	C	C	.	.	S	Bend	trans	-117.2	-20.2	-179.5	-43.2	-54.7	0	0	0	112.9	G315 L373 R375 N481 M552	G315-N400 WeakPolarHBondContact CA-ND2 3.43Å; L373-N400 HydrophobicContact CD2-CB 4.17Å; R375-N400 WeakPolarHBondContact CD-OD1 3.01Å; R375-N400 WeakPolarHBondContact CG-OD1 3.47Å; R375-N400 PolarHBondContact NE-OD1 3.44Å; N400-N481 PolarHBondContact O-ND2 3.13Å; N400-M552 HydrophobicContact CB-CE 4.22Å; N400-M552 HydrophobicContact CB-SD 4.17Å; N400-M552 PolarHBondContact N-SD 2.65Å; N400-M552 VanDerWaalsContact N-SD 3.37Å; N400-M552 WeakPolarHBondContact ND2-CE 3.37Å
401	N	92.7	Very high	85.1	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.166	C	C	.	.	S	Bend	trans	-111.7	-64.5	-175.4	-63.8	16	0	0	0	110.5	D311 N481 I482 M552	D311-N401 VanDerWaalsContact CG-ND2 3.31Å; D311-N401 PolarHBondContact OD1-ND2 3.09Å; N401-N481 WeakPolarHBondContact O-CB 3.07Å; N401-N481 PolarHBondContact O-N 2.94Å; N401-I482 HydrophobicContact CB-CD1 3.66Å; N401-I482 HydrophobicContact CB-CG1 4.02Å; N401-I482 VanDerWaalsContact CG-CD1 3.5Å; N401-I482 PolarHBondContact O-N 2.72Å; N401-M552 HydrophobicContact CB-CG 4.47Å
402	Y	92.9	Very high	85.5	Confident	19 Å²	19	29.1 Å²	29.1	8%	0.075	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	160.3	-178.4	52.7	-94.9	0	0	0	111.7	F479 L480 Y485 Q550 M552	Y402-F479 CarbonylContact C-O 3.54Å; Y402-F479 WeakPolarHBondContact CA-O 3.3Å; Y402-F479 WeakPolarHBondContact CB-O 3.41Å; Y402-L480 HydrophobicContact CD1-CD1 4.31Å; Y402-L480 HydrophobicContact CG-CD1 4.44Å; Y402-Y485 AromaticContact CD1-CD2 3.72Å; Y402-Y485 HydrophobicContact CD1-CD2 3.72Å; Y402-Y485 HydrophobicContact CD1-CE2 4.29Å; Y402-Y485 HydrophobicContact CD2-CD2 4.1Å; Y402-Y485 AromaticContact CD2-CE2 3.81Å; Y402-Y485 HydrophobicContact CD2-CE2 3.81Å; Y402-Y485 AromaticContact CE1-CD2 3.74Å; Y402-Y485 HydrophobicContact CE1-CD2 3.74Å; Y402-Y485 HydrophobicContact CE1-CE2 4.22Å; Y402-Y485 HydrophobicContact CE2-CD2 4.08Å; Y402-Y485 AromaticContact CE2-CE2 3.71Å; Y402-Y485 HydrophobicContact CE2-CE2 3.71Å; Y402-Y485 AromaticContact CG-CD2 3.93Å; Y402-Y485 HydrophobicContact CG-CD2 3.93Å; Y402-Y485 HydrophobicContact CG-CE2 4.11Å; Y402-Y485 AromaticContact CZ-CD2 3.92Å; Y402-Y485 AromaticContact CZ-CE2 3.93Å; Y402-Q550 HydrophobicContact CE2-CG 4.28Å; Y402-Q550 PolarHBondContact OH-NE2 3.05Å; Y402-M552 PolarHBondContact O-N 2.74Å; Y402-M552 PolarHBondContact OH-O 3.26Å
403	F	93.8	Very high	86.1	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	130.5	166.3	169.2	-109	0	0	0	108.1	L378 F399 L405 F479 L541 V549 Q550 V551 L563 I565	L378-F403 HydrophobicContact CD1-CD2 4.14Å; L378-F403 HydrophobicContact CD1-CG 4.49Å; L378-F403 HydrophobicContact CD2-CD1 4.24Å; L378-F403 HydrophobicContact CD2-CD2 4.23Å; L378-F403 HydrophobicContact CD2-CE1 4.49Å; L378-F403 HydrophobicContact CD2-CE2 4.45Å; L378-F403 HydrophobicContact CD2-CG 4.12Å; F399-F403 HydrophobicContact CD1-CB 4.12Å; F399-F403 HydrophobicContact CE1-CB 3.98Å; F399-F403 HydrophobicContact CE2-CB 4.43Å; F399-F403 HydrophobicContact CG-CB 4.36Å; F399-F403 HydrophobicContact CZ-CB 4.13Å; F403-L405 HydrophobicContact CE1-CD2 4.47Å; F403-F479 HydrophobicContact CB-CB 4.34Å; F403-F479 HydrophobicContact CD1-CB 4.44Å; F403-F479 AromaticContact CD1-CD2 3.45Å; F403-F479 HydrophobicContact CD1-CD2 3.45Å; F403-F479 VanDerWaalsContact CD1-CD2 3.45Å; F403-F479 HydrophobicContact CD1-CE2 4.03Å; F403-F479 HydrophobicContact CD1-CG 4.22Å; F403-F479 AromaticContact CE1-CD2 3.99Å; F403-F479 HydrophobicContact CE1-CD2 3.99Å; F403-F479 HydrophobicContact CE1-CE2 4.1Å; F403-F479 HydrophobicContact CG-CD2 4.48Å; F403-F479 PolarHBondContact N-O 3.25Å; F403-F479 WeakPolarHBondContact O-CB 3.41Å; F403-F479 PolarHBondContact O-N 3.41Å; F403-L541 HydrophobicContact CE1-CD2 3.68Å; F403-L541 HydrophobicContact CZ-CD2 4.17Å; F403-V549 HydrophobicContact CE2-CB 3.96Å; F403-V549 HydrophobicContact CE2-CG1 4.43Å; F403-V549 HydrophobicContact CE2-CG2 4.49Å; F403-V549 HydrophobicContact CZ-CB 4.3Å; F403-V549 HydrophobicContact CZ-CG1 4.28Å; F403-Q550 WeakPolarHBondContact CA-O 3.48Å; F403-Q550 VanDerWaalsContact CD2-O 3.27Å; F403-Q550 WeakPolarHBondContact CD2-O 3.44Å; F403-V551 HydrophobicContact CD2-CG2 3.83Å; F403-V551 HydrophobicContact CE2-CG2 4.09Å; F403-L563 HydrophobicContact CZ-CD2 4.06Å; F403-I565 HydrophobicContact CD1-CD1 3.81Å; F403-I565 HydrophobicContact CE1-CD1 4.32Å
404	S	92.4	Very high	86.3	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	156.3	-179.3	67	0	0	0	0	112	I477 V549 Q550	S404-I477 WeakPolarHBondContact CA-O 3.38Å; S404-V549 CarbonylContact O-C 3.6Å; S404-V549 WeakPolarHBondContact O-CA 3.06Å; S404-Q550 PolarHBondContact N-O 3.36Å; S404-Q550 PolarHBondContact O-N 2.84Å; S404-Q550 WeakPolarHBondContact OG-CB 3.34Å
405	L	92	Very high	86.4	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	153.3	173.3	64.5	159.5	0	0	0	110.9	F403 L452 V456 C476 I477 F479 L541 P548 V549	F403-L405 HydrophobicContact CE1-CD2 4.47Å; L405-L452 HydrophobicContact CD1-CD1 4.25Å; L405-V456 HydrophobicContact CD1-CG1 3.82Å; L405-C476 WeakPolarHBondContact O-CA 3.42Å; L405-C476 PolarHBondContact O-SG 2.8Å; L405-I477 HydrophobicContact CD2-CB 3.78Å; L405-I477 HydrophobicContact CD2-CG2 4.18Å; L405-I477 HydrophobicContact CG-CB 4.26Å; L405-I477 PolarHBondContact N-O 3.39Å; L405-I477 PolarHBondContact O-N 3.17Å; L405-I477 VanDerWaalsContact O-N 3.07Å; L405-F479 HydrophobicContact CD2-CD2 4.3Å; L405-F479 HydrophobicContact CD2-CE2 3.63Å; L405-L541 HydrophobicContact CD1-CD1 4.04Å; L405-L541 HydrophobicContact CD1-CD2 4.06Å; L405-L541 HydrophobicContact CD2-CD2 3.98Å; L405-P548 WeakPolarHBondContact CA-O 3.47Å; L405-V549 HydrophobicContact CB-CG1 4.11Å
406	G	89.2	Confident	86.6	Confident	4 Å²	4	17.1 Å²	17.1	4%	0.041	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	100.9	-145.7	178.5	0	0	0	0	0	113.4	D408 A409 H410 Q475 P548	G406-D408 PolarHBondContact O-N 3.14Å; G406-A409 PolarHBondContact O-N 3.08Å; G406-H410 PolarHBondContact O-N 2.85Å; G406-Q475 WeakPolarHBondContact CA-O 3.41Å; G406-P548 PolarHBondContact N-O 2.88Å
407	F	85.3	Confident	86.8	Confident	11 Å²	11	19.2 Å²	19.2	5%	0.048	9%	0.094	C	C	.	.	H	α-helix	trans	-55.8	-48.8	-169	-175.9	-93.2	0	0	0	113.9	A409 H410 V411 D443 F444 Q475 M518 L521	F407-A409 VanDerWaalsContact C-N 3.34Å; F407-A409 PolarHBondContact O-N 3.06Å; F407-H410 WeakPolarHBondContact O-CA 3.35Å; F407-H410 VanDerWaalsContact O-CB 3.27Å; F407-H410 WeakPolarHBondContact O-CB 3.38Å; F407-H410 PolarHBondContact O-N 3.18Å; F407-V411 HydrophobicContact CD1-CG2 4.12Å; F407-V411 HydrophobicContact CE1-CG2 3.7Å; F407-V411 HydrophobicContact CZ-CG2 3.91Å; F407-V411 PolarHBondContact O-N 2.96Å; F407-D443 HydrophobicContact CE2-CB 3.88Å; F407-D443 HydrophobicContact CZ-CB 3.98Å; F407-F444 HydrophobicContact CZ-CB 4.27Å; F407-Q475 PolarHBondContact N-O 3.32Å; F407-M518 HydrophobicContact CB-CE 3.47Å; F407-M518 VanDerWaalsContact CB-CE 3.47Å; F407-M518 HydrophobicContact CB-SD 4.49Å; F407-M518 HydrophobicContact CD1-CE 3.58Å; F407-M518 HydrophobicContact CD1-SD 4.1Å; F407-M518 HydrophobicContact CD2-CE 3.98Å; F407-M518 HydrophobicContact CD2-SD 3.89Å; F407-M518 HydrophobicContact CE1-CE 4.28Å; F407-M518 HydrophobicContact CE1-SD 4.27Å; F407-M518 HydrophobicContact CE2-SD 4.08Å; F407-M518 HydrophobicContact CG-CE 3.39Å; F407-M518 HydrophobicContact CG-SD 3.89Å; F407-M518 HydrophobicContact CZ-SD 4.27Å; F407-L521 HydrophobicContact CD1-CD2 3.62Å; F407-L521 HydrophobicContact CE1-CD2 4.26Å
408	D	83.8	Confident	86.3	Confident	9 Å²	9	16 Å²	16	5%	0.048	8%	0.079	C	C	.	.	H	α-helix	trans	-62.6	-40.5	-178.9	-177.8	72.4	0	0	0	112.7	G406 H410 V411 T412 Y436 Y485 L521 Q550	G406-D408 PolarHBondContact O-N 3.14Å; D408-H410 PolarHBondContact O-N 2.84Å; D408-V411 PolarHBondContact O-N 3.08Å; D408-T412 WeakPolarHBondContact O-CB 3.31Å; D408-T412 PolarHBondContact O-N 3.4Å; D408-T412 PolarHBondContact O-OG1 2.8Å; D408-Y436 PolarHBondContact OD1-OH 2.81Å; D408-Y485 PolarHBondContact OD2-OH 3.47Å; D408-L521 HydrophobicContact CB-CD2 4.48Å; D408-Q550 PolarHBondContact OD2-OE1 3.29Å
409	A	86.8	Confident	85.5	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.1	-30.8	174.8	0	0	0	0	0	112.1	G406 F407 L413 P548 Q550	G406-A409 PolarHBondContact O-N 3.08Å; F407-A409 VanDerWaalsContact C-N 3.34Å; F407-A409 PolarHBondContact O-N 3.06Å; A409-L413 WeakPolarHBondContact O-CB 3.47Å; A409-L413 PolarHBondContact O-N 3.1Å; A409-P548 HydrophobicContact CB-CB 4.29Å; A409-P548 WeakPolarHBondContact CB-O 3.44Å; A409-Q550 HydrophobicContact CB-CB 3.94Å
410	H	85.1	Confident	84.7	Confident	36 Å²	36	26.9 Å²	26.9	17%	0.167	13%	0.126	C	C	.	.	H	α-helix	trans	-68	-49.8	175.1	-171.5	27.3	0	0	0	111.9	G406 F407 D408 T412 L413 E414 D443 P548	G406-H410 PolarHBondContact O-N 2.85Å; F407-H410 WeakPolarHBondContact O-CA 3.35Å; F407-H410 VanDerWaalsContact O-CB 3.27Å; F407-H410 WeakPolarHBondContact O-CB 3.38Å; F407-H410 PolarHBondContact O-N 3.18Å; D408-H410 PolarHBondContact O-N 2.84Å; H410-T412 VanDerWaalsContact C-N 3.3Å; H410-T412 PolarHBondContact O-N 2.82Å; H410-L413 WeakPolarHBondContact O-CB 3.37Å; H410-L413 PolarHBondContact O-N 3.19Å; H410-L413 VanDerWaalsContact O-N 3.12Å; H410-E414 PolarHBondContact O-N 2.75Å; H410-D443 IonicContact CD2-OD2 2.94Å; H410-D443 PolarHBondContact CD2-OD2 3.37Å; H410-D443 IonicContact NE2-OD2 3.99Å; H410-D443 PolarHBondContact NE2-OD2 3.31Å; H410-P548 HydrophobicContact CB-CB 4.15Å; H410-P548 HydrophobicContact CB-CG 3.84Å
411	V	82.4	Confident	83.9	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-42.5	177.3	174.2	0	0	0	0	110.4	F407 D408 L413 E414 F415 Y436 A439 A440 D443	F407-V411 HydrophobicContact CD1-CG2 4.12Å; F407-V411 HydrophobicContact CE1-CG2 3.7Å; F407-V411 HydrophobicContact CZ-CG2 3.91Å; F407-V411 PolarHBondContact O-N 2.96Å; D408-V411 PolarHBondContact O-N 3.08Å; V411-L413 VanDerWaalsContact C-N 3.3Å; V411-L413 PolarHBondContact O-N 3.23Å; V411-E414 PolarHBondContact O-N 3.41Å; V411-F415 WeakPolarHBondContact O-CB 3.32Å; V411-F415 PolarHBondContact O-N 3.43Å; V411-Y436 HydrophobicContact CG1-CD2 4.45Å; V411-Y436 HydrophobicContact CG1-CE1 4.42Å; V411-Y436 HydrophobicContact CG1-CE2 4.12Å; V411-A439 HydrophobicContact CG1-CB 4.12Å; V411-A440 HydrophobicContact CG1-CB 3.9Å; V411-A440 HydrophobicContact CG2-CB 4.37Å; V411-D443 HydrophobicContact CG2-CB 4.38Å
412	T	82.1	Confident	83.2	Confident	6 Å²	6	33.7 Å²	33.7	4%	0.037	17%	0.172	C	C	.	.	H	α-helix	trans	-63.2	-38.7	176.3	-59.5	0	0	0	0	111.4	D408 H410 F415 H416 Y436 Q550 T555	D408-T412 WeakPolarHBondContact O-CB 3.31Å; D408-T412 PolarHBondContact O-N 3.4Å; D408-T412 PolarHBondContact O-OG1 2.8Å; H410-T412 VanDerWaalsContact C-N 3.3Å; H410-T412 PolarHBondContact O-N 2.82Å; T412-F415 PolarHBondContact O-N 3.35Å; T412-H416 WeakPolarHBondContact O-CB 3.29Å; T412-H416 PolarHBondContact O-CD2 3.3Å; T412-H416 VanDerWaalsContact O-CD2 3.23Å; T412-H416 PolarHBondContact O-N 3.28Å; T412-Y436 WeakPolarHBondContact OG1-CE2 3.45Å; T412-Y436 PolarHBondContact OG1-OH 3.17Å; T412-Q550 PolarHBondContact OG1-OE1 2.63Å; T412-T555 HydrophobicContact CG2-CG2 3.44Å; T412-T555 VanDerWaalsContact CG2-CG2 3.44Å
413	L	81.8	Confident	82.2	Confident	12 Å²	12	36.8 Å²	36.8	6%	0.063	20%	0.195	C	C	.	.	H	α-helix	trans	-61.7	-48.4	175.1	-179.2	62.3	0	0	0	111.8	A409 H410 V411 F415 H416 E417 T555 R557	A409-L413 WeakPolarHBondContact O-CB 3.47Å; A409-L413 PolarHBondContact O-N 3.1Å; H410-L413 WeakPolarHBondContact O-CB 3.37Å; H410-L413 PolarHBondContact O-N 3.19Å; H410-L413 VanDerWaalsContact O-N 3.12Å; V411-L413 VanDerWaalsContact C-N 3.3Å; V411-L413 PolarHBondContact O-N 3.23Å; L413-F415 VanDerWaalsContact C-N 3.33Å; L413-F415 PolarHBondContact O-N 2.95Å; L413-H416 PolarHBondContact O-N 3.45Å; L413-H416 VanDerWaalsContact O-N 3.13Å; L413-E417 HydrophobicContact CD1-CG 4.29Å; L413-E417 WeakPolarHBondContact O-CG 3.04Å; L413-E417 PolarHBondContact O-N 2.68Å; L413-T555 WeakPolarHBondContact CA-OG1 3.41Å; L413-R557 HydrophobicContact CD2-CG 3.87Å
414	E	79.8	Confident	81.2	Confident	63 Å²	63	44.4 Å²	44.4	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-62	-41.4	178.2	-170	-170.4	-172.6	0	0	111.8	H410 V411 H416 E417 S418	H410-E414 PolarHBondContact O-N 2.75Å; V411-E414 PolarHBondContact O-N 3.41Å; E414-H416 VanDerWaalsContact C-N 3.32Å; E414-H416 PolarHBondContact O-N 2.9Å; E414-E417 PolarHBondContact O-N 3.5Å; E414-S418 VanDerWaalsContact O-CB 3.25Å; E414-S418 WeakPolarHBondContact O-CB 3.47Å; E414-S418 PolarHBondContact O-N 3.47Å; E414-S418 PolarHBondContact O-OG 3.15Å
415	F	79.6	Confident	80.1	Confident	16 Å²	16	51.1 Å²	51.1	7%	0.07	26%	0.259	C	S	.	.	H	α-helix	trans	-57.5	-45.5	173	173.3	-89.2	0	0	0	111.5	V411 T412 L413 R419 F426 N432 F435 Y436	V411-F415 WeakPolarHBondContact O-CB 3.32Å; V411-F415 PolarHBondContact O-N 3.43Å; T412-F415 PolarHBondContact O-N 3.35Å; L413-F415 VanDerWaalsContact C-N 3.33Å; L413-F415 PolarHBondContact O-N 2.95Å; F415-R419 WeakPolarHBondContact O-CB 3.35Å; F415-R419 PolarHBondContact O-N 3.02Å; F415-F426 HydrophobicContact CD2-CE1 4.14Å; F415-F426 AromaticContact CE2-CD1 3.89Å; F415-F426 HydrophobicContact CE2-CD1 3.89Å; F415-F426 AromaticContact CE2-CE1 3.58Å; F415-F426 HydrophobicContact CE2-CE1 3.58Å; F415-F426 AromaticContact CZ-CD1 3.93Å; F415-F426 HydrophobicContact CZ-CD1 3.93Å; F415-F426 HydrophobicContact CZ-CE1 4.04Å; F415-N432 HydrophobicContact CE2-CB 4.36Å; F415-N432 VanDerWaalsContact CE2-O 3.25Å; F415-N432 WeakPolarHBondContact CE2-O 3.38Å; F415-N432 HydrophobicContact CZ-CB 4.09Å; F415-F435 HydrophobicContact CD2-CB 4.5Å; F415-F435 AromaticContact CD2-CD1 3.7Å; F415-F435 HydrophobicContact CD2-CD1 3.7Å; F415-F435 HydrophobicContact CD2-CE1 4.5Å; F415-F435 HydrophobicContact CE2-CB 4.32Å; F415-F435 HydrophobicContact CE2-CD1 4.2Å; F415-Y436 HydrophobicContact CB-CD2 4.02Å; F415-Y436 HydrophobicContact CD2-CD2 4.01Å; F415-Y436 HydrophobicContact CD2-CG 4.49Å; F415-Y436 AromaticContact CG-CD2 3.93Å; F415-Y436 HydrophobicContact CG-CD2 3.93Å
416	H	76	Confident	78.8	Confident	22 Å²	22	52 Å²	52	10%	0.102	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-46.6	-179.8	-92.9	-93.6	0	0	0	112.4	T412 L413 E414 S418 R419 E420 S553	T412-H416 WeakPolarHBondContact O-CB 3.29Å; T412-H416 PolarHBondContact O-CD2 3.3Å; T412-H416 VanDerWaalsContact O-CD2 3.23Å; T412-H416 PolarHBondContact O-N 3.28Å; L413-H416 PolarHBondContact O-N 3.45Å; L413-H416 VanDerWaalsContact O-N 3.13Å; E414-H416 VanDerWaalsContact C-N 3.32Å; E414-H416 PolarHBondContact O-N 2.9Å; H416-S418 VanDerWaalsContact C-N 3.31Å; H416-S418 PolarHBondContact O-N 3.15Å; H416-R419 PolarHBondContact CE1-NH2 2.99Å; H416-R419 VanDerWaalsContact CE1-NH2 3.28Å; H416-R419 PolarHBondContact ND1-NH2 3.43Å; H416-R419 PolarHBondContact O-N 3.17Å; H416-E420 WeakPolarHBondContact O-CG 3.32Å; H416-E420 PolarHBondContact O-N 3.14Å; H416-S553 PolarHBondContact CE1-O 2.9Å; H416-S553 VanDerWaalsContact CE1-O 3.31Å; H416-S553 PolarHBondContact NE2-O 3Å
417	E	81.3	Confident	77.7	Confident	104 Å²	104	55.9 Å²	55.9	49%	0.486	28%	0.283	S	S	.	.	H	α-helix	trans	-59.9	-42.6	176.2	-71.4	175.1	172.4	0	0	111.1	L413 E414 R419 E420 A421	L413-E417 HydrophobicContact CD1-CG 4.29Å; L413-E417 WeakPolarHBondContact O-CG 3.04Å; L413-E417 PolarHBondContact O-N 2.68Å; E414-E417 PolarHBondContact O-N 3.5Å; E417-R419 VanDerWaalsContact C-N 3.35Å; E417-R419 PolarHBondContact O-N 3.25Å; E417-E420 PolarHBondContact O-N 3.12Å; E417-A421 WeakPolarHBondContact O-CB 3.46Å; E417-A421 PolarHBondContact O-N 3.16Å
418	S	77.4	Confident	76.9	Confident	25 Å²	25	57.4 Å²	57.4	18%	0.175	30%	0.295	C	S	.	.	H	α-helix	trans	-63	-39.9	175.8	-65	0	0	0	0	112.8	E414 H416 A421 N422 F426 F435	E414-S418 VanDerWaalsContact O-CB 3.25Å; E414-S418 WeakPolarHBondContact O-CB 3.47Å; E414-S418 PolarHBondContact O-N 3.47Å; E414-S418 PolarHBondContact O-OG 3.15Å; H416-S418 VanDerWaalsContact C-N 3.31Å; H416-S418 PolarHBondContact O-N 3.15Å; S418-A421 PolarHBondContact O-N 3.44Å; S418-N422 PolarHBondContact O-N 3.14Å; S418-F426 WeakPolarHBondContact O-CE2 3.23Å; S418-F435 VanDerWaalsContact CB-CE1 3.43Å; S418-F435 WeakPolarHBondContact OG-CZ 3.29Å
419	R	74.8	Confident	76.2	Confident	85 Å²	85	60.5 Å²	60.5	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-68.7	-38.9	177.5	-173.6	-179.9	75.1	174.1	4.3	112.4	F415 H416 E417 N422 P423 F426	F415-R419 WeakPolarHBondContact O-CB 3.35Å; F415-R419 PolarHBondContact O-N 3.02Å; H416-R419 PolarHBondContact CE1-NH2 2.99Å; H416-R419 VanDerWaalsContact CE1-NH2 3.28Å; H416-R419 PolarHBondContact ND1-NH2 3.43Å; H416-R419 PolarHBondContact O-N 3.17Å; E417-R419 VanDerWaalsContact C-N 3.35Å; E417-R419 PolarHBondContact O-N 3.25Å; R419-N422 CarbonylContact O-C 3.57Å; R419-P423 WeakPolarHBondContact O-CA 3.37Å; R419-F426 HydrophobicContact CB-CD1 4.07Å; R419-F426 HydrophobicContact CB-CD2 4.04Å; R419-F426 HydrophobicContact CB-CE1 4.21Å; R419-F426 HydrophobicContact CB-CE2 4.19Å; R419-F426 HydrophobicContact CB-CG 3.99Å; R419-F426 HydrophobicContact CB-CZ 4.27Å; R419-F426 HydrophobicContact CG-CB 3.74Å; R419-F426 HydrophobicContact CG-CD1 4.04Å; R419-F426 HydrophobicContact CG-CD2 4.01Å; R419-F426 HydrophobicContact CG-CG 3.67Å
420	E	75.2	Confident	75.2	Confident	150 Å²	150	67 Å²	67	70%	0.701	33%	0.334	S	S	*	.	H	α-helix	trans	-69.2	-37.4	175.7	-73.9	-179.2	-175.1	0	0	111.8	H416 E417	H416-E420 WeakPolarHBondContact O-CG 3.32Å; H416-E420 PolarHBondContact O-N 3.14Å; E417-E420 PolarHBondContact O-N 3.12Å
421	A	78.5	Confident	74.4	Confident	72 Å²	72	72.3 Å²	72.3	60%	0.595	35%	0.353	S	S	*	.	H	α-helix	trans	-69.7	-33.8	175.5	0	0	0	0	0	113.2	E417 S418	E417-A421 WeakPolarHBondContact O-CB 3.46Å; E417-A421 PolarHBondContact O-N 3.16Å; S418-A421 PolarHBondContact O-N 3.44Å
422	N	76.6	Confident	74	Confident	72 Å²	72	72.9 Å²	72.9	39%	0.385	36%	0.356	S	S	.	.			trans	-135	60.8	-172.6	-62.1	-82.3	0	0	0	113.9	S418 R419 E424 K425 F426	S418-N422 PolarHBondContact O-N 3.14Å; R419-N422 CarbonylContact O-C 3.57Å; N422-E424 PolarHBondContact O-N 2.97Å; N422-K425 HydrophobicContact CB-CB 4.42Å; N422-K425 HydrophobicContact CB-CD 4.03Å; N422-K425 HydrophobicContact CB-CG 4.26Å; N422-K425 PolarHBondContact O-N 3.32Å; N422-F426 HydrophobicContact CB-CE2 4.43Å; N422-F426 VanDerWaalsContact O-CD2 3.28Å; N422-F426 WeakPolarHBondContact O-CD2 3.43Å
423	P	72.7	Confident	73.5	Confident	85 Å²	85	77.2 Å²	77.2	55%	0.552	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-56.6	-32.7	-171.4	21	-33.3	0	0	0	114.4	R419 K425 F426	R419-P423 WeakPolarHBondContact O-CA 3.37Å; P423-K425 PolarHBondContact O-N 3.26Å; P423-F426 PolarHBondContact O-N 2.97Å; P423-F426 VanDerWaalsContact O-N 3.13Å
424	E	73	Confident	72.8	Confident	160 Å²	160	81.8 Å²	81.8	75%	0.748	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-61.1	-29.2	178.5	-61.4	-66.3	164.8	0	0	113.4	N422 F426 N427	N422-E424 PolarHBondContact O-N 2.97Å; E424-F426 VanDerWaalsContact C-N 3.3Å; E424-F426 PolarHBondContact O-N 2.83Å; E424-N427 PolarHBondContact O-ND2 3.2Å
425	K	68.3	Low	72.4	Confident	140 Å²	140	82.6 Å²	82.6	61%	0.609	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-77.7	-16.7	179.5	-66.4	-176.1	-178.8	174	0	112.8	N422 P423	N422-K425 HydrophobicContact CB-CB 4.42Å; N422-K425 HydrophobicContact CB-CD 4.03Å; N422-K425 HydrophobicContact CB-CG 4.26Å; N422-K425 PolarHBondContact O-N 3.32Å; P423-K425 PolarHBondContact O-N 3.26Å
426	F	66	Low	72.1	Confident	20 Å²	20	84.8 Å²	84.8	9%	0.088	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-110.4	36.8	-172.1	-66	-96.5	0	0	0	113.1	F415 S418 R419 N422 P423 E424 N432 F435	F415-F426 HydrophobicContact CD2-CE1 4.14Å; F415-F426 AromaticContact CE2-CD1 3.89Å; F415-F426 HydrophobicContact CE2-CD1 3.89Å; F415-F426 AromaticContact CE2-CE1 3.58Å; F415-F426 HydrophobicContact CE2-CE1 3.58Å; F415-F426 AromaticContact CZ-CD1 3.93Å; F415-F426 HydrophobicContact CZ-CD1 3.93Å; F415-F426 HydrophobicContact CZ-CE1 4.04Å; S418-F426 WeakPolarHBondContact O-CE2 3.23Å; R419-F426 HydrophobicContact CB-CD1 4.07Å; R419-F426 HydrophobicContact CB-CD2 4.04Å; R419-F426 HydrophobicContact CB-CE1 4.21Å; R419-F426 HydrophobicContact CB-CE2 4.19Å; R419-F426 HydrophobicContact CB-CG 3.99Å; R419-F426 HydrophobicContact CB-CZ 4.27Å; R419-F426 HydrophobicContact CG-CB 3.74Å; R419-F426 HydrophobicContact CG-CD1 4.04Å; R419-F426 HydrophobicContact CG-CD2 4.01Å; R419-F426 HydrophobicContact CG-CG 3.67Å; N422-F426 HydrophobicContact CB-CE2 4.43Å; N422-F426 VanDerWaalsContact O-CD2 3.28Å; N422-F426 WeakPolarHBondContact O-CD2 3.43Å; P423-F426 PolarHBondContact O-N 2.97Å; P423-F426 VanDerWaalsContact O-N 3.13Å; E424-F426 VanDerWaalsContact C-N 3.3Å; E424-F426 PolarHBondContact O-N 2.83Å; F426-N432 WeakPolarHBondContact CA-OD1 3.39Å; F426-N432 WeakPolarHBondContact CB-OD1 3.46Å; F426-N432 VanDerWaalsContact CD1-OD1 3.29Å; F426-N432 WeakPolarHBondContact CD1-OD1 3.17Å; F426-N432 PolarHBondContact O-ND2 3.16Å; F426-N432 PolarHBondContact O-OD1 2.87Å; F426-F435 HydrophobicContact CE1-CB 3.88Å; F426-F435 AromaticContact CE1-CD1 3.64Å; F426-F435 HydrophobicContact CE1-CD1 3.64Å; F426-F435 HydrophobicContact CE1-CD2 4.14Å; F426-F435 HydrophobicContact CE1-CE1 4.2Å; F426-F435 AromaticContact CE1-CG 3.59Å; F426-F435 HydrophobicContact CE1-CG 3.59Å; F426-F435 HydrophobicContact CZ-CB 4.43Å; F426-F435 AromaticContact CZ-CD1 3.71Å; F426-F435 HydrophobicContact CZ-CD1 3.71Å; F426-F435 AromaticContact CZ-CD2 3.81Å; F426-F435 HydrophobicContact CZ-CD2 3.81Å; F426-F435 AromaticContact CZ-CE1 3.84Å; F426-F435 HydrophobicContact CZ-CE1 3.84Å; F426-F435 AromaticContact CZ-CE2 3.94Å; F426-F435 HydrophobicContact CZ-CE2 3.94Å; F426-F435 AromaticContact CZ-CG 3.7Å; F426-F435 HydrophobicContact CZ-CG 3.7Å; F426-F435 AromaticContact CZ-CZ 3.96Å; F426-F435 HydrophobicContact CZ-CZ 3.96Å
427	N	65.3	Low	71.8	Confident	84 Å²	84	86.3 Å²	86.3	45%	0.449	42%	0.424	S	S	.	.			trans	-86.6	-5.2	-177.3	64.5	9.7	0	0	0	114.5	G263 E424	G263-N427 WeakPolarHBondContact CA-O 3.43Å; E424-N427 PolarHBondContact O-ND2 3.2Å
428	S	68.7	Low	71.4	Confident	43 Å²	43	83.3 Å²	83.3	30%	0.301	42%	0.421	S	S	.	.	S	Bend	trans	-129.1	137.4	-177.4	170.1	0	0	0	0	111.7	F430 R431 N432	S428-F430 VanDerWaalsContact C-N 3.27Å; S428-F430 PolarHBondContact O-N 3.15Å; S428-F430 PolarHBondContact OG-N 3.19Å; S428-R431 PolarHBondContact O-N 2.89Å; S428-N432 WeakPolarHBondContact O-CB 3.5Å; S428-N432 PolarHBondContact O-N 2.78Å; S428-N432 PolarHBondContact O-ND2 3.01Å; S428-N432 PolarHBondContact O-OD1 3.43Å
429	R	68.6	Low	71	Confident	74 Å²	74	82.5 Å²	82.5	28%	0.279	42%	0.416	S	S	.	.	H	α-helix	trans	-57.5	-41	175.6	-67.8	-173.2	-65.8	-154.8	-1.6	111.8	G338 Y353 N432 K433	G338-R429 WeakPolarHBondContact O-CD 3.34Å; Y353-R429 PolarHBondContact O-NH1 2.79Å; Y353-R429 PolarHBondContact O-NH2 3.26Å; Y353-R429 VanDerWaalsContact O-NH2 3.11Å; R429-N432 PolarHBondContact O-N 2.85Å; R429-K433 WeakPolarHBondContact O-CG 3.3Å; R429-K433 PolarHBondContact O-N 3.17Å
430	F	65.4	Low	70.7	Confident	136 Å²	136	79.8 Å²	79.8	60%	0.596	41%	0.412	S	S	*	.	H	α-helix	trans	-64	-49.4	179.4	179.1	-96.3	0	0	0	111.2	S428 N432 K433 M434	S428-F430 VanDerWaalsContact C-N 3.27Å; S428-F430 PolarHBondContact O-N 3.15Å; S428-F430 PolarHBondContact OG-N 3.19Å; F430-N432 VanDerWaalsContact C-N 3.3Å; F430-N432 PolarHBondContact O-N 3.18Å; F430-K433 PolarHBondContact O-N 3.03Å; F430-M434 HydrophobicContact CD1-CG 4.25Å; F430-M434 HydrophobicContact CE1-CG 3.87Å; F430-M434 HydrophobicContact CE2-CE 3.8Å; F430-M434 HydrophobicContact CZ-CE 3.8Å; F430-M434 HydrophobicContact CZ-CG 4.03Å; F430-M434 HydrophobicContact CZ-SD 4.42Å; F430-M434 WeakPolarHBondContact O-CG 3.24Å; F430-M434 PolarHBondContact O-N 3.01Å
431	R	69.9	Low	70.4	Confident	149 Å²	149	79.1 Å²	79.1	56%	0.562	41%	0.407	S	S	*	.	H	α-helix	trans	-60.8	-40.2	176.9	-68.7	-176.8	175.6	-176.7	-3.1	112.2	S428 K433 M434 F435	S428-R431 PolarHBondContact O-N 2.89Å; R431-K433 VanDerWaalsContact C-N 3.35Å; R431-K433 PolarHBondContact O-N 3.48Å; R431-M434 PolarHBondContact O-N 2.83Å; R431-F435 PolarHBondContact O-N 2.83Å
432	N	72.8	Confident	69.9	Low	12 Å²	12	77.9 Å²	77.9	6%	0.064	39%	0.394	C	S	.	.	H	α-helix	trans	-61.3	-44.1	176.8	-66.4	-8.8	0	0	0	111.2	T339 F415 F426 S428 R429 F430 F435 Y436	T339-N432 HydrophobicContact CG2-CB 3.86Å; T339-N432 PolarHBondContact OG1-ND2 2.9Å; F415-N432 HydrophobicContact CE2-CB 4.36Å; F415-N432 VanDerWaalsContact CE2-O 3.25Å; F415-N432 WeakPolarHBondContact CE2-O 3.38Å; F415-N432 HydrophobicContact CZ-CB 4.09Å; F426-N432 WeakPolarHBondContact CA-OD1 3.39Å; F426-N432 WeakPolarHBondContact CB-OD1 3.46Å; F426-N432 VanDerWaalsContact CD1-OD1 3.29Å; F426-N432 WeakPolarHBondContact CD1-OD1 3.17Å; F426-N432 PolarHBondContact O-ND2 3.16Å; F426-N432 PolarHBondContact O-OD1 2.87Å; S428-N432 WeakPolarHBondContact O-CB 3.5Å; S428-N432 PolarHBondContact O-N 2.78Å; S428-N432 PolarHBondContact O-ND2 3.01Å; S428-N432 PolarHBondContact O-OD1 3.43Å; R429-N432 PolarHBondContact O-N 2.85Å; F430-N432 VanDerWaalsContact C-N 3.3Å; F430-N432 PolarHBondContact O-N 3.18Å; N432-F435 PolarHBondContact O-N 2.9Å; N432-Y436 PolarHBondContact O-N 2.95Å; N432-Y436 VanDerWaalsContact O-N 3.07Å
433	K	71.6	Confident	69.4	Low	98 Å²	98	74.8 Å²	74.8	43%	0.426	38%	0.377	S	S	.	.	H	α-helix	trans	-63.1	-42.6	174.9	-72.4	-177.2	177.1	-170.3	0	112.1	T339 R429 F430 R431 Y436 A437	T339-K433 HydrophobicContact CG2-CG 3.89Å; R429-K433 WeakPolarHBondContact O-CG 3.3Å; R429-K433 PolarHBondContact O-N 3.17Å; F430-K433 PolarHBondContact O-N 3.03Å; R431-K433 VanDerWaalsContact C-N 3.35Å; R431-K433 PolarHBondContact O-N 3.48Å; K433-Y436 PolarHBondContact O-N 2.94Å; K433-A437 WeakPolarHBondContact O-CB 3.46Å; K433-A437 PolarHBondContact O-N 3.33Å
434	M	68.3	Low	69	Low	107 Å²	107	75.4 Å²	75.4	53%	0.527	37%	0.371	S	S	.	.	H	α-helix	trans	-64.2	-41.5	178.6	-71.4	-64.7	142.8	0	0	112.6	F430 R431 A437 G438	F430-M434 HydrophobicContact CD1-CG 4.25Å; F430-M434 HydrophobicContact CE1-CG 3.87Å; F430-M434 HydrophobicContact CE2-CE 3.8Å; F430-M434 HydrophobicContact CZ-CE 3.8Å; F430-M434 HydrophobicContact CZ-CG 4.03Å; F430-M434 HydrophobicContact CZ-SD 4.42Å; F430-M434 WeakPolarHBondContact O-CG 3.24Å; F430-M434 PolarHBondContact O-N 3.01Å; R431-M434 PolarHBondContact O-N 2.83Å; M434-A437 PolarHBondContact O-N 3.18Å; M434-G438 PolarHBondContact O-N 3.31Å
435	F	71.3	Confident	68.3	Low	81 Å²	81	73.1 Å²	73.1	36%	0.355	36%	0.364	S	S	.	.	H	α-helix	trans	-64.4	-42.5	175.8	-167.9	-82.7	0	0	0	111.5	F415 S418 F426 R431 N432 G438 A439	F415-F435 HydrophobicContact CD2-CB 4.5Å; F415-F435 AromaticContact CD2-CD1 3.7Å; F415-F435 HydrophobicContact CD2-CD1 3.7Å; F415-F435 HydrophobicContact CD2-CE1 4.5Å; F415-F435 HydrophobicContact CE2-CB 4.32Å; F415-F435 HydrophobicContact CE2-CD1 4.2Å; S418-F435 VanDerWaalsContact CB-CE1 3.43Å; S418-F435 WeakPolarHBondContact OG-CZ 3.29Å; F426-F435 HydrophobicContact CE1-CB 3.88Å; F426-F435 AromaticContact CE1-CD1 3.64Å; F426-F435 HydrophobicContact CE1-CD1 3.64Å; F426-F435 HydrophobicContact CE1-CD2 4.14Å; F426-F435 HydrophobicContact CE1-CE1 4.2Å; F426-F435 AromaticContact CE1-CG 3.59Å; F426-F435 HydrophobicContact CE1-CG 3.59Å; F426-F435 HydrophobicContact CZ-CB 4.43Å; F426-F435 AromaticContact CZ-CD1 3.71Å; F426-F435 HydrophobicContact CZ-CD1 3.71Å; F426-F435 AromaticContact CZ-CD2 3.81Å; F426-F435 HydrophobicContact CZ-CD2 3.81Å; F426-F435 AromaticContact CZ-CE1 3.84Å; F426-F435 HydrophobicContact CZ-CE1 3.84Å; F426-F435 AromaticContact CZ-CE2 3.94Å; F426-F435 HydrophobicContact CZ-CE2 3.94Å; F426-F435 AromaticContact CZ-CG 3.7Å; F426-F435 HydrophobicContact CZ-CG 3.7Å; F426-F435 AromaticContact CZ-CZ 3.96Å; F426-F435 HydrophobicContact CZ-CZ 3.96Å; R431-F435 PolarHBondContact O-N 2.83Å; N432-F435 PolarHBondContact O-N 2.9Å; F435-G438 PolarHBondContact O-N 2.6Å; F435-A439 WeakPolarHBondContact O-CB 3.07Å; F435-A439 PolarHBondContact O-N 2.82Å
436	Y	71.6	Confident	67.8	Low	62 Å²	62	72.7 Å²	72.7	24%	0.243	36%	0.364	C	S	.	.	H	α-helix	trans	-60	-46.6	175.7	-170.7	-89.7	0	0	0	111.9	D408 V411 T412 F415 N432 K433 G438 A439 A440	D408-Y436 PolarHBondContact OD1-OH 2.81Å; V411-Y436 HydrophobicContact CG1-CD2 4.45Å; V411-Y436 HydrophobicContact CG1-CE1 4.42Å; V411-Y436 HydrophobicContact CG1-CE2 4.12Å; T412-Y436 WeakPolarHBondContact OG1-CE2 3.45Å; T412-Y436 PolarHBondContact OG1-OH 3.17Å; F415-Y436 HydrophobicContact CB-CD2 4.02Å; F415-Y436 HydrophobicContact CD2-CD2 4.01Å; F415-Y436 HydrophobicContact CD2-CG 4.49Å; F415-Y436 AromaticContact CG-CD2 3.93Å; F415-Y436 HydrophobicContact CG-CD2 3.93Å; N432-Y436 PolarHBondContact O-N 2.95Å; N432-Y436 VanDerWaalsContact O-N 3.07Å; K433-Y436 PolarHBondContact O-N 2.94Å; Y436-G438 VanDerWaalsContact C-N 3.33Å; Y436-G438 PolarHBondContact O-N 3.49Å; Y436-A439 PolarHBondContact O-N 2.91Å; Y436-A440 WeakPolarHBondContact O-CB 3.39Å; Y436-A440 PolarHBondContact O-N 3.29Å
437	A	71	Confident	67.6	Low	54 Å²	54	79.3 Å²	79.3	45%	0.446	39%	0.388	S	S	.	.	H	α-helix	trans	-62.7	-39.9	176.6	0	0	0	0	0	112.1	K433 M434 A440 F441	K433-A437 WeakPolarHBondContact O-CB 3.46Å; K433-A437 PolarHBondContact O-N 3.33Å; M434-A437 PolarHBondContact O-N 3.18Å; A437-A440 PolarHBondContact O-N 3.46Å; A437-F441 WeakPolarHBondContact O-CB 3.46Å; A437-F441 PolarHBondContact O-N 3.37Å
438	G	71.8	Confident	67	Low	41 Å²	41	78.6 Å²	78.6	42%	0.423	39%	0.39	S	S	.	.	H	α-helix	trans	-64.5	-45	176.6	0	0	0	0	0	113.2	M434 F435 Y436 F441 S442	M434-G438 PolarHBondContact O-N 3.31Å; F435-G438 PolarHBondContact O-N 2.6Å; Y436-G438 VanDerWaalsContact C-N 3.33Å; Y436-G438 PolarHBondContact O-N 3.49Å; G438-F441 PolarHBondContact O-N 3.07Å; G438-S442 PolarHBondContact O-N 3.41Å
439	A	69.1	Low	66.5	Low	8 Å²	8	77.7 Å²	77.7	7%	0.066	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-47.3	175.1	0	0	0	0	0	111.1	V411 F435 Y436 F441 S442 D443	V411-A439 HydrophobicContact CG1-CB 4.12Å; F435-A439 WeakPolarHBondContact O-CB 3.07Å; F435-A439 PolarHBondContact O-N 2.82Å; Y436-A439 PolarHBondContact O-N 2.91Å; A439-F441 VanDerWaalsContact C-N 3.28Å; A439-F441 PolarHBondContact O-N 3.28Å; A439-S442 PolarHBondContact O-N 3.42Å; A439-D443 PolarHBondContact O-N 2.97Å
440	A	68.6	Low	66.2	Low	28 Å²	28	81.3 Å²	81.3	23%	0.231	40%	0.397	C	S	.	.	H	α-helix	trans	-56	-42	175.6	0	0	0	0	0	112.5	V411 Y436 A437 F444	V411-A440 HydrophobicContact CG1-CB 3.9Å; V411-A440 HydrophobicContact CG2-CB 4.37Å; Y436-A440 WeakPolarHBondContact O-CB 3.39Å; Y436-A440 PolarHBondContact O-N 3.29Å; A437-A440 PolarHBondContact O-N 3.46Å; A440-F444 WeakPolarHBondContact O-CB 3.31Å; A440-F444 PolarHBondContact O-N 2.87Å
441	F	69.9	Low	66.6	Low	135 Å²	135	78.3 Å²	78.3	59%	0.592	39%	0.387	S	S	*	.	H	α-helix	trans	-71.1	-40.7	179.8	-174.1	-98.3	0	0	0	113	A437 G438 A439 F444 L445	A437-F441 WeakPolarHBondContact O-CB 3.46Å; A437-F441 PolarHBondContact O-N 3.37Å; G438-F441 PolarHBondContact O-N 3.07Å; A439-F441 VanDerWaalsContact C-N 3.28Å; A439-F441 PolarHBondContact O-N 3.28Å; F441-F444 WeakPolarHBondContact O-CB 3.25Å; F441-F444 PolarHBondContact O-N 3.22Å; F441-L445 HydrophobicContact CD1-CD1 4.17Å; F441-L445 HydrophobicContact CE1-CD1 3.69Å; F441-L445 HydrophobicContact CE1-CG 4.41Å; F441-L445 HydrophobicContact CZ-CD1 4.22Å; F441-L445 PolarHBondContact O-N 3.29Å
442	S	66.7	Low	67.3	Low	46 Å²	46	72 Å²	72	32%	0.322	36%	0.364	S	S	.	.	H	α-helix	trans	-60.9	-49.1	175.8	176.5	0	0	0	0	111.2	G438 A439 F444 L445 Q446	G438-S442 PolarHBondContact O-N 3.41Å; A439-S442 PolarHBondContact O-N 3.42Å; S442-F444 VanDerWaalsContact C-N 3.32Å; S442-F444 PolarHBondContact O-N 3.45Å; S442-L445 WeakPolarHBondContact O-CB 3.15Å; S442-L445 PolarHBondContact O-N 3Å; S442-L445 VanDerWaalsContact O-N 3.15Å; S442-Q446 WeakPolarHBondContact O-CG 3.37Å; S442-Q446 PolarHBondContact O-N 2.9Å; S442-Q446 VanDerWaalsContact O-N 3.12Å; S442-Q446 PolarHBondContact OG-NE2 3Å
443	D	66.4	Low	68	Low	7 Å²	7	71.8 Å²	71.8	4%	0.037	36%	0.364	C	S	.	.	H	α-helix	trans	-69.4	-31.1	-179.9	-91.4	8.6	0	0	0	112.9	F407 H410 V411 A439 L445 Q446 R447	F407-D443 HydrophobicContact CE2-CB 3.88Å; F407-D443 HydrophobicContact CZ-CB 3.98Å; H410-D443 IonicContact CD2-OD2 2.94Å; H410-D443 PolarHBondContact CD2-OD2 3.37Å; H410-D443 IonicContact NE2-OD2 3.99Å; H410-D443 PolarHBondContact NE2-OD2 3.31Å; V411-D443 HydrophobicContact CG2-CB 4.38Å; A439-D443 PolarHBondContact O-N 2.97Å; D443-L445 PolarHBondContact O-N 3.19Å; D443-Q446 PolarHBondContact O-N 2.69Å; D443-Q446 VanDerWaalsContact O-N 3.17Å; D443-R447 PolarHBondContact O-N 3.25Å; D443-R447 VanDerWaalsContact O-N 3.1Å
444	F	64.3	Low	68.8	Low	98 Å²	98	73.4 Å²	73.4	43%	0.43	37%	0.371	S	S	.	.	H	α-helix	trans	-58.5	-39.1	171.6	-178.7	-92.1	0	0	0	111.5	F407 A440 F441 S442 M518	F407-F444 HydrophobicContact CZ-CB 4.27Å; A440-F444 WeakPolarHBondContact O-CB 3.31Å; A440-F444 PolarHBondContact O-N 2.87Å; F441-F444 WeakPolarHBondContact O-CB 3.25Å; F441-F444 PolarHBondContact O-N 3.22Å; S442-F444 VanDerWaalsContact C-N 3.32Å; S442-F444 PolarHBondContact O-N 3.45Å; F444-M518 HydrophobicContact CD2-SD 4.26Å; F444-M518 HydrophobicContact CE2-CB 4.05Å
445	L	59	Low	69.8	Low	113 Å²	113	71 Å²	71	59%	0.592	36%	0.359	S	S	*	.	H	α-helix	trans	-72.4	-35.4	175.2	-67.2	173.9	0	0	0	112.5	F441 S442 D443 R447	F441-L445 HydrophobicContact CD1-CD1 4.17Å; F441-L445 HydrophobicContact CE1-CD1 3.69Å; F441-L445 HydrophobicContact CE1-CG 4.41Å; F441-L445 HydrophobicContact CZ-CD1 4.22Å; F441-L445 PolarHBondContact O-N 3.29Å; S442-L445 WeakPolarHBondContact O-CB 3.15Å; S442-L445 PolarHBondContact O-N 3Å; S442-L445 VanDerWaalsContact O-N 3.15Å; D443-L445 PolarHBondContact O-N 3.19Å; L445-R447 PolarHBondContact O-N 3.49Å
446	Q	58.1	Low	70.8	Confident	131 Å²	131	67.3 Å²	67.3	61%	0.612	34%	0.342	S	S	*	.	H	α-helix	trans	-78.9	-11.6	-176.8	-66.1	-178.2	29.1	0	0	114.4	S442 D443 S448	S442-Q446 WeakPolarHBondContact O-CG 3.37Å; S442-Q446 PolarHBondContact O-N 2.9Å; S442-Q446 VanDerWaalsContact O-N 3.12Å; S442-Q446 PolarHBondContact OG-NE2 3Å; D443-Q446 PolarHBondContact O-N 2.69Å; D443-Q446 VanDerWaalsContact O-N 3.17Å; Q446-S448 VanDerWaalsContact C-N 3.26Å; Q446-S448 PolarHBondContact O-N 3.3Å
447	R	61.5	Low	71.9	Confident	159 Å²	159	69.5 Å²	69.5	60%	0.6	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	29.9	171.3	-68.3	170	167.6	-171.7	3.4	114.9	D443 L445 S449 R450	D443-R447 PolarHBondContact O-N 3.25Å; D443-R447 VanDerWaalsContact O-N 3.1Å; L445-R447 PolarHBondContact O-N 3.49Å; R447-S449 VanDerWaalsContact C-N 3.31Å; R447-S449 PolarHBondContact O-N 2.82Å; R447-R450 VanDerWaalsContact NE-NH2 3.18Å
448	S	53.4	Low	73.2	Confident	68 Å²	68	67 Å²	67	48%	0.476	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.3	-169.5	58.7	0	0	0	0	116.1	Q446	Q446-S448 VanDerWaalsContact C-N 3.26Å; Q446-S448 PolarHBondContact O-N 3.3Å
449	S	58	Low	74.4	Confident	24 Å²	24	66.1 Å²	66.1	17%	0.168	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	19.2	-172.7	81.3	0	0	0	0	116.8	R447 D451 L452	R447-S449 VanDerWaalsContact C-N 3.31Å; R447-S449 PolarHBondContact O-N 2.82Å; S449-D451 PolarHBondContact O-N 2.76Å; S449-L452 PolarHBondContact O-N 2.78Å
450	R	61.2	Low	75.8	Confident	151 Å²	151	65.7 Å²	65.7	57%	0.57	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-11.9	-167.8	-82.4	179.3	162.1	-156.7	-11.3	117.8	R447	R447-R450 VanDerWaalsContact NE-NH2 3.18Å
451	D	74.4	Confident	77.1	Confident	73 Å²	73	68 Å²	68	39%	0.39	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	6.8	-170.7	-71.1	-41.2	0	0	0	115.6	S449 S453 K454 H455	S449-D451 PolarHBondContact O-N 2.76Å; D451-S453 PolarHBondContact O-N 2.86Å; D451-K454 HydrophobicContact CB-CD 4.25Å; D451-K454 WeakPolarHBondContact O-CB 3.3Å; D451-K454 PolarHBondContact O-N 3.23Å; D451-K454 WeakPolarHBondContact OD1-CE 3.04Å; D451-K454 IonicContact OD1-NZ 2.88Å; D451-K454 PolarHBondContact OD1-NZ 3.29Å; D451-H455 PolarHBondContact O-CD2 3.4Å; D451-H455 VanDerWaalsContact O-CD2 3.25Å
452	L	85	Confident	78.2	Confident	16 Å²	16	64.9 Å²	64.9	8%	0.084	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-46.2	-47.3	-175.5	-179.3	69.4	0	0	0	113.2	L405 S449 K454 H455 V456 Q475 V547	L405-L452 HydrophobicContact CD1-CD1 4.25Å; S449-L452 PolarHBondContact O-N 2.78Å; L452-K454 PolarHBondContact O-N 2.87Å; L452-K454 VanDerWaalsContact O-N 3.1Å; L452-H455 PolarHBondContact O-N 2.99Å; L452-V456 HydrophobicContact CD1-CG1 3.82Å; L452-V456 HydrophobicContact CG-CG1 4.23Å; L452-Q475 WeakPolarHBondContact CD2-O 3.47Å; L452-V547 HydrophobicContact CD1-CG1 3.94Å
453	S	86.2	Confident	79.7	Confident	8 Å²	8	66 Å²	66	6%	0.056	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-58.2	-24.8	-177.8	63.5	0	0	0	0	114.6	D451 I469 Q470	D451-S453 PolarHBondContact O-N 2.86Å; S453-I469 VanDerWaalsContact CB-O 3.3Å; S453-I469 WeakPolarHBondContact CB-O 3.45Å; S453-Q470 WeakPolarHBondContact O-CG 3.39Å
454	K	88.3	Confident	81.1	Confident	132 Å²	132	68.8 Å²	68.8	57%	0.574	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-80.8	-19.2	178.1	-61.4	175.3	-177	163	0	113.3	D451 L452	D451-K454 HydrophobicContact CB-CD 4.25Å; D451-K454 WeakPolarHBondContact O-CB 3.3Å; D451-K454 PolarHBondContact O-N 3.23Å; D451-K454 WeakPolarHBondContact OD1-CE 3.04Å; D451-K454 IonicContact OD1-NZ 2.88Å; D451-K454 PolarHBondContact OD1-NZ 3.29Å; L452-K454 PolarHBondContact O-N 2.87Å; L452-K454 VanDerWaalsContact O-N 3.1Å
455	H	89.4	Confident	82.6	Confident	57 Å²	57	64.8 Å²	64.8	26%	0.264	33%	0.329	S	S	.	.	S	Bend	trans	-113.5	12.7	-170.9	-62.6	-89.6	0	0	0	113.2	D451 L452 Y544 K545	D451-H455 PolarHBondContact O-CD2 3.4Å; D451-H455 VanDerWaalsContact O-CD2 3.25Å; L452-H455 PolarHBondContact O-N 2.99Å; H455-Y544 WeakPolarHBondContact O-CD2 3.25Å; H455-Y544 PolarHBondContact O-N 2.89Å; H455-K545 HydrophobicContact CB-CB 4.13Å
456	V	93.3	Very high	84.3	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.012	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	146	179.5	-59.5	0	0	0	0	111	L405 L452 T466 I469 I477 L541 T542	L405-V456 HydrophobicContact CD1-CG1 3.82Å; L452-V456 HydrophobicContact CD1-CG1 3.82Å; L452-V456 HydrophobicContact CG-CG1 4.23Å; V456-T466 WeakPolarHBondContact O-CG2 3.39Å; V456-I469 HydrophobicContact CG2-CG2 4.11Å; V456-I477 HydrophobicContact CG2-CD1 4.06Å; V456-L541 HydrophobicContact CB-CD1 4.37Å; V456-T542 CarbonylContact C-O 3.56Å; V456-T542 WeakPolarHBondContact CA-O 3.43Å
457	R	95.4	Very high	86.1	Confident	109 Å²	109	57.8 Å²	57.8	41%	0.411	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.7	164.7	-179.5	-173.2	-179.7	-170.9	-4.4	108.2	V459 D464 T466 L541 T542 Y544	R457-V459 HydrophobicContact CG-CG2 4.42Å; R457-D464 IonicContact CZ-OD2 3.61Å; R457-D464 IonicContact NE-OD2 3.36Å; R457-D464 PolarHBondContact NE-OD2 3.33Å; R457-D464 IonicContact NH2-OD2 2.72Å; R457-D464 PolarHBondContact NH2-OD2 2.92Å; R457-T466 WeakPolarHBondContact CA-OG1 3.25Å; R457-T466 VanDerWaalsContact CG-OG1 3.28Å; R457-T466 WeakPolarHBondContact CG-OG1 3.4Å; R457-L541 CarbonylContact O-C 3.58Å; R457-L541 WeakPolarHBondContact O-CA 3.16Å; R457-T542 PolarHBondContact N-O 3.09Å; R457-T542 PolarHBondContact O-N 2.7Å; R457-Y544 HydrophobicContact CB-CE2 4.03Å
458	V	97.2	Very high	87.6	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	120.3	-178.7	-175	0	0	0	0	109.2	L465 T466 I469 I477 F479 V539 L541	V458-L465 HydrophobicContact CB-CB 4.48Å; V458-L465 HydrophobicContact CG1-CD1 4.42Å; V458-L465 PolarHBondContact O-N 3.12Å; V458-T466 PolarHBondContact N-OG1 2.86Å; V458-T466 VanDerWaalsContact N-OG1 3.12Å; V458-I469 HydrophobicContact CB-CD1 3.63Å; V458-I469 HydrophobicContact CG1-CD1 4.45Å; V458-I469 HydrophobicContact CG2-CD1 3.51Å; V458-I477 HydrophobicContact CG2-CD1 4.21Å; V458-F479 HydrophobicContact CG1-CE1 4.26Å; V458-F479 HydrophobicContact CG1-CZ 4.11Å; V458-V539 HydrophobicContact CG1-CG1 4.2Å; V458-L541 HydrophobicContact CG2-CD1 3.76Å
459	V	97.6	Very high	89.5	Confident	23 Å²	23	50.8 Å²	50.8	14%	0.139	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126.2	175.4	-176.8	0	0	0	0	108.6	R457 T463 D464 V539 V540	R457-V459 HydrophobicContact CG-CG2 4.42Å; V459-T463 CarbonylContact C-O 3.59Å; V459-T463 VanDerWaalsContact CA-O 3.31Å; V459-T463 WeakPolarHBondContact CA-O 3.48Å; V459-D464 HydrophobicContact CG2-CB 4.38Å; V459-V539 CarbonylContact O-C 3.29Å; V459-V539 WeakPolarHBondContact O-CA 3.42Å; V459-V540 HydrophobicContact CB-CB 4.36Å; V459-V540 PolarHBondContact N-O 3.06Å; V459-V540 PolarHBondContact O-N 3.14Å
460	C	97.1	Very high	91.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	118.4	-178	-69.1	0	0	0	0	109.3	G462 T463 L465 H534 C536 E538	C460-G462 PolarHBondContact O-N 3.29Å; C460-T463 PolarHBondContact N-O 2.9Å; C460-T463 WeakPolarHBondContact O-CA 3.43Å; C460-T463 VanDerWaalsContact O-CB 3.3Å; C460-T463 WeakPolarHBondContact O-CB 3.48Å; C460-T463 PolarHBondContact O-N 2.72Å; C460-L465 HydrophobicContact CB-CD1 3.95Å; C460-L465 HydrophobicContact CB-CG 4.48Å; C460-L465 WeakPolarHBondContact SG-CD1 3.18Å; C460-H534 HydrophobicContact CB-CB 4.19Å; C460-C536 HydrophobicContact CB-CB 3.93Å; C460-E538 WeakPolarHBondContact CA-O 3.45Å
461	D	96.3	Very high	92.7	Very high	77 Å²	77	54 Å²	54	41%	0.412	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	35	-176.2	-63.6	-21	0	0	0	113.9	C536 R537 E538	D461-C536 HydrophobicContact CB-CB 4.43Å; D461-C536 WeakPolarHBondContact OD2-CA 2.99Å; D461-C536 WeakPolarHBondContact OD2-CB 3.28Å; D461-R537 PolarHBondContact OD1-N 3.37Å; D461-R537 PolarHBondContact OD2-N 3.47Å; D461-E538 PolarHBondContact N-O 3.29Å; D461-E538 PolarHBondContact OD1-N 3.08Å
462	G	94.5	Very high	93.5	Very high	68 Å²	68	53.8 Å²	53.8	70%	0.701	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	-11.2	-177.2	0	0	0	0	0	115.5	C460	C460-G462 PolarHBondContact O-N 3.29Å
463	T	96.4	Very high	93.8	Very high	70 Å²	70	59.5 Å²	59.5	43%	0.429	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	120.9	175.6	-54.6	0	0	0	0	110.8	V459 C460 L465	V459-T463 CarbonylContact C-O 3.59Å; V459-T463 VanDerWaalsContact CA-O 3.31Å; V459-T463 WeakPolarHBondContact CA-O 3.48Å; C460-T463 PolarHBondContact N-O 2.9Å; C460-T463 WeakPolarHBondContact O-CA 3.43Å; C460-T463 VanDerWaalsContact O-CB 3.3Å; C460-T463 WeakPolarHBondContact O-CB 3.48Å; C460-T463 PolarHBondContact O-N 2.72Å; T463-L465 HydrophobicContact CG2-CD2 4.08Å; T463-L465 PolarHBondContact O-N 3.02Å
464	D	96.9	Very high	94.1	Very high	66 Å²	66	59.2 Å²	59.2	35%	0.353	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	110.4	177.5	-159.9	-33.8	0	0	0	110.9	R457 V459 T466	R457-D464 IonicContact CZ-OD2 3.61Å; R457-D464 IonicContact NE-OD2 3.36Å; R457-D464 PolarHBondContact NE-OD2 3.33Å; R457-D464 IonicContact NH2-OD2 2.72Å; R457-D464 PolarHBondContact NH2-OD2 2.92Å; V459-D464 HydrophobicContact CG2-CB 4.38Å; D464-T466 WeakPolarHBondContact OD1-CB 3.47Å; D464-T466 PolarHBondContact OD1-N 3.4Å; D464-T466 PolarHBondContact OD1-OG1 2.64Å
465	L	96	Very high	94.1	Very high	13 Å²	13	54.5 Å²	54.5	7%	0.068	29%	0.286	C	S	.	.			trans	-89.6	-4.4	-179.2	-58.7	-180	0	0	0	113	V458 C460 T463 P467 K468 I469 V513 L533 H534	V458-L465 HydrophobicContact CB-CB 4.48Å; V458-L465 HydrophobicContact CG1-CD1 4.42Å; V458-L465 PolarHBondContact O-N 3.12Å; C460-L465 HydrophobicContact CB-CD1 3.95Å; C460-L465 HydrophobicContact CB-CG 4.48Å; C460-L465 WeakPolarHBondContact SG-CD1 3.18Å; T463-L465 HydrophobicContact CG2-CD2 4.08Å; T463-L465 PolarHBondContact O-N 3.02Å; L465-P467 VanDerWaalsContact C-CD 3.45Å; L465-K468 PolarHBondContact O-N 3.29Å; L465-I469 HydrophobicContact CB-CD1 4.11Å; L465-I469 WeakPolarHBondContact O-CG1 3.42Å; L465-I469 PolarHBondContact O-N 2.9Å; L465-V513 HydrophobicContact CD1-CG1 4.39Å; L465-L533 HydrophobicContact CD1-CB 4.14Å; L465-H534 HydrophobicContact CD1-CB 3.97Å
466	T	94.9	Very high	94.2	Very high	17 Å²	17	51.8 Å²	51.8	10%	0.104	27%	0.274	C	S	.	.	H	α-helix	trans	-55.3	-42.6	-176.2	-49.2	0	0	0	0	113.5	V456 R457 V458 D464 K468 I469 Q470	V456-T466 WeakPolarHBondContact O-CG2 3.39Å; R457-T466 WeakPolarHBondContact CA-OG1 3.25Å; R457-T466 VanDerWaalsContact CG-OG1 3.28Å; R457-T466 WeakPolarHBondContact CG-OG1 3.4Å; V458-T466 PolarHBondContact N-OG1 2.86Å; V458-T466 VanDerWaalsContact N-OG1 3.12Å; D464-T466 WeakPolarHBondContact OD1-CB 3.47Å; D464-T466 PolarHBondContact OD1-N 3.4Å; D464-T466 PolarHBondContact OD1-OG1 2.64Å; T466-K468 PolarHBondContact O-N 3.5Å; T466-I469 PolarHBondContact O-N 3.37Å; T466-Q470 HydrophobicContact CG2-CG 4.41Å; T466-Q470 WeakPolarHBondContact O-CG 3.25Å; T466-Q470 PolarHBondContact O-N 3.32Å
467	P	94.9	Very high	94.3	Very high	81 Å²	81	51.7 Å²	51.7	53%	0.526	27%	0.273	S	S	.	.	H	α-helix	trans	-59.4	-45.7	177.6	-24	35.2	0	0	0	112.6	L465 I469 Q470 E471	L465-P467 VanDerWaalsContact C-CD 3.45Å; P467-I469 PolarHBondContact O-N 3.26Å; P467-Q470 PolarHBondContact O-N 3.3Å; P467-E471 WeakPolarHBondContact O-CB 3.44Å; P467-E471 PolarHBondContact O-N 3.42Å
468	K	93.7	Very high	94.3	Very high	80 Å²	80	46.5 Å²	46.5	35%	0.348	25%	0.253	S	S	.	.	H	α-helix	trans	-64.6	-40	178.9	-171.7	174.4	-178.5	-177.7	0	111.6	L465 T466 Q470 E471 L472 L533	L465-K468 PolarHBondContact O-N 3.29Å; T466-K468 PolarHBondContact O-N 3.5Å; K468-Q470 VanDerWaalsContact C-N 3.33Å; K468-Q470 PolarHBondContact O-N 3.05Å; K468-E471 PolarHBondContact O-N 2.76Å; K468-L472 HydrophobicContact CG-CD1 3.93Å; K468-L472 WeakPolarHBondContact O-CB 3.49Å; K468-L472 PolarHBondContact O-N 2.99Å; K468-L533 HydrophobicContact CD-CD2 3.99Å; K468-L533 HydrophobicContact CG-CD2 4.43Å
469	I	93.7	Very high	94.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-40.2	176.6	-68.5	163.7	0	0	0	111.4	S453 V456 V458 L465 T466 P467 K473 F474 I477 L533	S453-I469 VanDerWaalsContact CB-O 3.3Å; S453-I469 WeakPolarHBondContact CB-O 3.45Å; V456-I469 HydrophobicContact CG2-CG2 4.11Å; V458-I469 HydrophobicContact CB-CD1 3.63Å; V458-I469 HydrophobicContact CG1-CD1 4.45Å; V458-I469 HydrophobicContact CG2-CD1 3.51Å; L465-I469 HydrophobicContact CB-CD1 4.11Å; L465-I469 WeakPolarHBondContact O-CG1 3.42Å; L465-I469 PolarHBondContact O-N 2.9Å; T466-I469 PolarHBondContact O-N 3.37Å; P467-I469 PolarHBondContact O-N 3.26Å; I469-K473 WeakPolarHBondContact O-CA 3.28Å; I469-K473 PolarHBondContact O-N 3.42Å; I469-F474 HydrophobicContact CB-CD2 4.26Å; I469-F474 HydrophobicContact CG1-CD2 4.07Å; I469-F474 HydrophobicContact CG2-CD2 4.36Å; I469-F474 PolarHBondContact O-N 2.73Å; I469-I477 HydrophobicContact CD1-CD1 3.93Å; I469-I477 HydrophobicContact CG1-CD1 4.37Å; I469-I477 HydrophobicContact CG2-CD1 3.98Å; I469-L533 HydrophobicContact CG1-CD1 4.2Å
470	Q	92.6	Very high	94.1	Very high	89 Å²	89	45.4 Å²	45.4	42%	0.416	25%	0.247	S	C	.	.	H	α-helix	trans	-71.4	-42.8	178.1	-74.2	177.7	-0.9	0	0	112.4	S453 T466 P467 K468 K473	S453-Q470 WeakPolarHBondContact O-CG 3.39Å; T466-Q470 HydrophobicContact CG2-CG 4.41Å; T466-Q470 WeakPolarHBondContact O-CG 3.25Å; T466-Q470 PolarHBondContact O-N 3.32Å; P467-Q470 PolarHBondContact O-N 3.3Å; K468-Q470 VanDerWaalsContact C-N 3.33Å; K468-Q470 PolarHBondContact O-N 3.05Å; Q470-K473 WeakPolarHBondContact O-CG 3.38Å; Q470-K473 PolarHBondContact O-N 3.35Å
471	E	93.2	Very high	94.1	Very high	152 Å²	152	45.4 Å²	45.4	71%	0.71	25%	0.247	S	C	*	.	H	α-helix	trans	-60.5	-52	178.3	-178.8	179	-169.7	0	0	111.8	P467 K468 K473	P467-E471 WeakPolarHBondContact O-CB 3.44Å; P467-E471 PolarHBondContact O-N 3.42Å; K468-E471 PolarHBondContact O-N 2.76Å; E471-K473 PolarHBondContact O-N 3.48Å
472	L	91.3	Very high	94	Very high	69 Å²	69	41.7 Å²	41.7	36%	0.361	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.9	-179	-61.3	175.9	0	0	0	113.1	K468 F474	K468-L472 HydrophobicContact CG-CD1 3.93Å; K468-L472 WeakPolarHBondContact O-CB 3.49Å; K468-L472 PolarHBondContact O-N 2.99Å; L472-F474 HydrophobicContact CB-CD1 4.36Å; L472-F474 HydrophobicContact CB-CD2 4.42Å; L472-F474 HydrophobicContact CB-CE1 3.86Å; L472-F474 HydrophobicContact CB-CE2 3.89Å; L472-F474 HydrophobicContact CB-CZ 3.61Å; L472-F474 HydrophobicContact CD1-CE1 4.24Å; L472-F474 HydrophobicContact CD1-CE2 3.92Å; L472-F474 HydrophobicContact CD1-CZ 3.4Å; L472-F474 VanDerWaalsContact CD1-CZ 3.4Å; L472-F474 HydrophobicContact CG-CZ 4.15Å; L472-F474 PolarHBondContact O-N 3.47Å
473	K	91.2	Very high	93.8	Very high	137 Å²	137	39.9 Å²	39.9	60%	0.596	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	48.2	176.3	-58.1	175.9	-176.6	172.3	0	112.8	I469 Q470 E471 Q475	I469-K473 WeakPolarHBondContact O-CA 3.28Å; I469-K473 PolarHBondContact O-N 3.42Å; Q470-K473 WeakPolarHBondContact O-CG 3.38Å; Q470-K473 PolarHBondContact O-N 3.35Å; E471-K473 PolarHBondContact O-N 3.48Å; K473-Q475 PolarHBondContact O-N 3.11Å; K473-Q475 PolarHBondContact O-NE2 3.32Å
474	F	91.9	Very high	93.5	Very high	1 Å²	1	40.5 Å²	40.5	0%	0.004	20%	0.197	C	C	.	.			trans	-60.1	136.2	179.6	-62.7	-52.7	0	0	0	112	I469 L472 T517 E531 L533	I469-F474 HydrophobicContact CB-CD2 4.26Å; I469-F474 HydrophobicContact CG1-CD2 4.07Å; I469-F474 HydrophobicContact CG2-CD2 4.36Å; I469-F474 PolarHBondContact O-N 2.73Å; L472-F474 HydrophobicContact CB-CD1 4.36Å; L472-F474 HydrophobicContact CB-CD2 4.42Å; L472-F474 HydrophobicContact CB-CE1 3.86Å; L472-F474 HydrophobicContact CB-CE2 3.89Å; L472-F474 HydrophobicContact CB-CZ 3.61Å; L472-F474 HydrophobicContact CD1-CE1 4.24Å; L472-F474 HydrophobicContact CD1-CE2 3.92Å; L472-F474 HydrophobicContact CD1-CZ 3.4Å; L472-F474 VanDerWaalsContact CD1-CZ 3.4Å; L472-F474 HydrophobicContact CG-CZ 4.15Å; L472-F474 PolarHBondContact O-N 3.47Å; F474-T517 HydrophobicContact CD1-CG2 4Å; F474-T517 HydrophobicContact CE1-CG2 4.19Å; F474-E531 HydrophobicContact CE1-CB 3.71Å; F474-E531 HydrophobicContact CE1-CG 3.68Å; F474-E531 HydrophobicContact CZ-CB 3.5Å; F474-E531 HydrophobicContact CZ-CG 3.79Å; F474-L533 HydrophobicContact CD2-CD1 4.24Å; F474-L533 HydrophobicContact CE2-CD1 3.94Å; F474-L533 HydrophobicContact CE2-CD2 3.54Å; F474-L533 HydrophobicContact CE2-CG 4.31Å; F474-L533 HydrophobicContact CZ-CD2 3.87Å
475	Q	88.8	Confident	93.1	Very high	33 Å²	33	37.3 Å²	37.3	15%	0.154	18%	0.181	C	C	.	.	S	Bend	trans	-101.2	-10.9	176.7	-65.7	89.3	25.7	0	0	112.8	G406 F407 L452 K473 F516 M518	G406-Q475 WeakPolarHBondContact CA-O 3.41Å; F407-Q475 PolarHBondContact N-O 3.32Å; L452-Q475 WeakPolarHBondContact CD2-O 3.47Å; K473-Q475 PolarHBondContact O-N 3.11Å; K473-Q475 PolarHBondContact O-NE2 3.32Å; Q475-F516 PolarHBondContact N-O 3.35Å; Q475-M518 HydrophobicContact CB-CE 3.66Å; Q475-M518 HydrophobicContact CB-CG 4.42Å; Q475-M518 HydrophobicContact CG-CE 4.43Å; Q475-M518 HydrophobicContact CG-CG 4.18Å
476	C	91.4	Very high	92.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	140.2	171.5	177.5	0	0	0	0	109.3	L405 F516	L405-C476 WeakPolarHBondContact O-CA 3.42Å; L405-C476 PolarHBondContact O-SG 2.8Å; C476-F516 HydrophobicContact CB-CB 4.01Å; C476-F516 PolarHBondContact N-O 3.34Å; C476-F516 PolarHBondContact O-N 2.97Å
477	I	94.8	Very high	91.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.6	173.9	-59.6	167.9	0	0	0	106.7	S404 L405 V456 V458 I469 F479 V513 I514	S404-I477 WeakPolarHBondContact CA-O 3.38Å; L405-I477 HydrophobicContact CD2-CB 3.78Å; L405-I477 HydrophobicContact CD2-CG2 4.18Å; L405-I477 HydrophobicContact CG-CB 4.26Å; L405-I477 PolarHBondContact N-O 3.39Å; L405-I477 PolarHBondContact O-N 3.17Å; L405-I477 VanDerWaalsContact O-N 3.07Å; V456-I477 HydrophobicContact CG2-CD1 4.06Å; V458-I477 HydrophobicContact CG2-CD1 4.21Å; I469-I477 HydrophobicContact CD1-CD1 3.93Å; I469-I477 HydrophobicContact CG1-CD1 4.37Å; I469-I477 HydrophobicContact CG2-CD1 3.98Å; I477-F479 HydrophobicContact CG2-CE2 3.91Å; I477-F479 HydrophobicContact CG2-CZ 3.94Å; I477-V513 HydrophobicContact CG2-CG1 4.39Å; I477-I514 WeakPolarHBondContact CA-O 3.45Å
478	V	95.3	Very high	91.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.9	-178	-176.9	0	0	0	0	109	L480 Y485 I514 F516	V478-L480 HydrophobicContact CG1-CB 4.27Å; V478-Y485 HydrophobicContact CG1-CE2 4.35Å; V478-Y485 HydrophobicContact CG2-CE1 4.3Å; V478-I514 PolarHBondContact N-O 3.37Å; V478-I514 PolarHBondContact O-N 3.43Å; V478-F516 HydrophobicContact CB-CE2 4.19Å; V478-F516 HydrophobicContact CG2-CD2 3.81Å; V478-F516 HydrophobicContact CG2-CE2 3.73Å
479	F	96.3	Very high	90.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	108.4	169.5	-59.3	-84.1	0	0	0	107.3	Y402 F403 L405 V458 I477 I511 E512 V513 V539 L541 I565	Y402-F479 CarbonylContact C-O 3.54Å; Y402-F479 WeakPolarHBondContact CA-O 3.3Å; Y402-F479 WeakPolarHBondContact CB-O 3.41Å; F403-F479 HydrophobicContact CB-CB 4.34Å; F403-F479 HydrophobicContact CD1-CB 4.44Å; F403-F479 AromaticContact CD1-CD2 3.45Å; F403-F479 HydrophobicContact CD1-CD2 3.45Å; F403-F479 VanDerWaalsContact CD1-CD2 3.45Å; F403-F479 HydrophobicContact CD1-CE2 4.03Å; F403-F479 HydrophobicContact CD1-CG 4.22Å; F403-F479 AromaticContact CE1-CD2 3.99Å; F403-F479 HydrophobicContact CE1-CD2 3.99Å; F403-F479 HydrophobicContact CE1-CE2 4.1Å; F403-F479 HydrophobicContact CG-CD2 4.48Å; F403-F479 PolarHBondContact N-O 3.25Å; F403-F479 WeakPolarHBondContact O-CB 3.41Å; F403-F479 PolarHBondContact O-N 3.41Å; L405-F479 HydrophobicContact CD2-CD2 4.3Å; L405-F479 HydrophobicContact CD2-CE2 3.63Å; V458-F479 HydrophobicContact CG1-CE1 4.26Å; V458-F479 HydrophobicContact CG1-CZ 4.11Å; I477-F479 HydrophobicContact CG2-CE2 3.91Å; I477-F479 HydrophobicContact CG2-CZ 3.94Å; F479-I511 HydrophobicContact CB-CG2 3.89Å; F479-I511 HydrophobicContact CD1-CG2 4.2Å; F479-E512 CarbonylContact C-O 3.53Å; F479-E512 WeakPolarHBondContact CA-O 3.29Å; F479-V513 HydrophobicContact CD1-CB 4.46Å; F479-V513 HydrophobicContact CD1-CG1 4.11Å; F479-V513 HydrophobicContact CD1-CG2 3.84Å; F479-V513 HydrophobicContact CE1-CB 4.46Å; F479-V513 HydrophobicContact CE1-CG1 3.72Å; F479-V513 HydrophobicContact CE1-CG2 3.97Å; F479-V513 HydrophobicContact CZ-CG1 4.47Å; F479-V539 HydrophobicContact CD1-CG1 4.19Å; F479-V539 HydrophobicContact CD1-CG2 3.99Å; F479-V539 HydrophobicContact CE1-CB 4.24Å; F479-V539 HydrophobicContact CE1-CG1 3.43Å; F479-V539 VanDerWaalsContact CE1-CG1 3.43Å; F479-V539 HydrophobicContact CE1-CG2 3.96Å; F479-V539 HydrophobicContact CZ-CG1 3.89Å; F479-L541 HydrophobicContact CE2-CD2 4.18Å; F479-I565 HydrophobicContact CB-CD1 4.32Å; F479-I565 HydrophobicContact CD1-CD1 4.1Å; F479-I565 HydrophobicContact CD2-CD1 4.17Å; F479-I565 HydrophobicContact CG-CD1 3.92Å
480	L	95.3	Very high	90.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.3	-167	-173.5	64.7	0	0	0	110.1	Y402 V478 I482 P491 Q504 E512 I514	Y402-L480 HydrophobicContact CD1-CD1 4.31Å; Y402-L480 HydrophobicContact CG-CD1 4.44Å; V478-L480 HydrophobicContact CG1-CB 4.27Å; L480-I482 WeakPolarHBondContact CD1-O 3.43Å; L480-I482 WeakPolarHBondContact CD2-O 3.36Å; L480-I482 WeakPolarHBondContact CG-O 3.2Å; L480-P491 HydrophobicContact CD2-CG 3.32Å; L480-Q504 VanDerWaalsContact CD2-NE2 3.32Å; L480-E512 HydrophobicContact CB-CB 4.19Å; L480-E512 PolarHBondContact N-O 3.36Å; L480-E512 PolarHBondContact O-N 3.22Å; L480-E512 VanDerWaalsContact O-OE2 3.12Å; L480-I514 HydrophobicContact CB-CD1 4.39Å; L480-I514 HydrophobicContact CD2-CD1 3.82Å
481	N	95.8	Very high	90.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	-113.3	-19.1	177.3	179.4	63	0	0	0	112.6	D374 W376 F399 N400 N401 H506	D374-N481 WeakPolarHBondContact CB-OD1 3.32Å; D374-N481 PolarHBondContact O-ND2 3.44Å; W376-N481 VanDerWaalsContact NE1-CG 3.35Å; W376-N481 PolarHBondContact NE1-OD1 2.85Å; F399-N481 HydrophobicContact CE2-CB 4.34Å; N400-N481 PolarHBondContact O-ND2 3.13Å; N401-N481 WeakPolarHBondContact O-CB 3.07Å; N401-N481 PolarHBondContact O-N 2.94Å; N481-H506 WeakPolarHBondContact O-CA 3.46Å; N481-H506 VanDerWaalsContact O-CB 3.32Å; N481-H506 WeakPolarHBondContact O-CB 3.42Å
482	I	94.4	Very high	90.3	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-123.2	150.4	179	63	170.4	0	0	0	110.4	D342 L343 T346 L373 N401 L480 R484 H506	D342-I482 HydrophobicContact CB-CD1 3.88Å; L343-I482 HydrophobicContact CB-CD1 4.31Å; L343-I482 HydrophobicContact CD1-CG2 4.25Å; T346-I482 HydrophobicContact CG2-CB 4.21Å; T346-I482 HydrophobicContact CG2-CG2 4.42Å; L373-I482 HydrophobicContact CD1-CG2 3.83Å; N401-I482 HydrophobicContact CB-CD1 3.66Å; N401-I482 HydrophobicContact CB-CG1 4.02Å; N401-I482 VanDerWaalsContact CG-CD1 3.5Å; N401-I482 PolarHBondContact O-N 2.72Å; L480-I482 WeakPolarHBondContact CD1-O 3.43Å; L480-I482 WeakPolarHBondContact CD2-O 3.36Å; L480-I482 WeakPolarHBondContact CG-O 3.2Å; I482-R484 WeakPolarHBondContact CG1-O 3.35Å; I482-R484 PolarHBondContact O-N 3.3Å; I482-H506 HydrophobicContact CG2-CB 4.11Å
483	P	90.8	Very high	89.9	Confident	30 Å²	30	22.7 Å²	22.7	20%	0.195	12%	0.123	C	C	.	.	S	Bend	trans	-64.5	-11.7	-177.7	-22.1	31.8	0	0	0	116.6	T346 Q504	T346-P483 HydrophobicContact CG2-CG 4.48Å; P483-Q504 VanDerWaalsContact CA-OE1 3.28Å; P483-Q504 HydrophobicContact CG-CG 4.17Å
484	R	90.6	Very high	88.9	Confident	82 Å²	82	21.9 Å²	21.9	31%	0.309	13%	0.125	S	C	.	.			trans	-110.5	134.4	-173.3	-58.9	-63.7	-179.9	174.9	-8	110.6	D342 R345 T346 I482 G488 T489 M490	D342-R484 HydrophobicContact CB-CB 3.97Å; D342-R484 WeakPolarHBondContact CB-O 3.34Å; D342-R484 WeakPolarHBondContact O-CB 3.43Å; R345-R484 HydrophobicContact CB-CB 4.45Å; R345-R484 HydrophobicContact CB-CG 3.93Å; T346-R484 WeakPolarHBondContact OG1-CG 3.11Å; I482-R484 WeakPolarHBondContact CG1-O 3.35Å; I482-R484 PolarHBondContact O-N 3.3Å; R484-G488 WeakPolarHBondContact CD-O 3.41Å; R484-G488 PolarHBondContact NH1-O 3.04Å; R484-T489 WeakPolarHBondContact CA-O 3.4Å; R484-M490 VanDerWaalsContact NH1-CG 3.32Å; R484-M490 PolarHBondContact NH1-SD 3.32Å
485	Y	88.8	Confident	87.3	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-143.7	161.8	178.4	177.8	-118.5	0	0	0	109.6	Y402 D408 V478 A487 G488 T489 P491 L524	Y402-Y485 AromaticContact CD1-CD2 3.72Å; Y402-Y485 HydrophobicContact CD1-CD2 3.72Å; Y402-Y485 HydrophobicContact CD1-CE2 4.29Å; Y402-Y485 HydrophobicContact CD2-CD2 4.1Å; Y402-Y485 AromaticContact CD2-CE2 3.81Å; Y402-Y485 HydrophobicContact CD2-CE2 3.81Å; Y402-Y485 AromaticContact CE1-CD2 3.74Å; Y402-Y485 HydrophobicContact CE1-CD2 3.74Å; Y402-Y485 HydrophobicContact CE1-CE2 4.22Å; Y402-Y485 HydrophobicContact CE2-CD2 4.08Å; Y402-Y485 AromaticContact CE2-CE2 3.71Å; Y402-Y485 HydrophobicContact CE2-CE2 3.71Å; Y402-Y485 AromaticContact CG-CD2 3.93Å; Y402-Y485 HydrophobicContact CG-CD2 3.93Å; Y402-Y485 HydrophobicContact CG-CE2 4.11Å; Y402-Y485 AromaticContact CZ-CD2 3.92Å; Y402-Y485 AromaticContact CZ-CE2 3.93Å; D408-Y485 PolarHBondContact OD2-OH 3.47Å; V478-Y485 HydrophobicContact CG1-CE2 4.35Å; V478-Y485 HydrophobicContact CG2-CE1 4.3Å; Y485-A487 VanDerWaalsContact C-N 3.32Å; Y485-A487 PolarHBondContact O-N 3.31Å; Y485-A487 VanDerWaalsContact O-N 3.13Å; Y485-G488 CarbonylContact O-C 3.52Å; Y485-G488 PolarHBondContact O-N 3.23Å; Y485-T489 PolarHBondContact N-O 2.7Å; Y485-T489 PolarHBondContact O-N 3.11Å; Y485-T489 PolarHBondContact O-OG1 3.06Å; Y485-P491 HydrophobicContact CD1-CB 4.3Å; Y485-P491 HydrophobicContact CD1-CG 4.14Å; Y485-P491 HydrophobicContact CG-CG 4.25Å; Y485-L524 HydrophobicContact CD1-CD1 4.19Å; Y485-L524 HydrophobicContact CE1-CD1 4.16Å
486	C	83	Confident	85.6	Confident	22 Å²	22	26 Å²	26	15%	0.149	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.6	52.9	175.2	-77.8	0	0	0	0	114.8	Q525	C486-Q525 PolarHBondContact O-NE2 3.37Å
487	A	80.4	Confident	83.4	Confident	35 Å²	35	32.4 Å²	32.4	29%	0.289	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	70	29.6	179.5	0	0	0	0	0	115.6	D342 R345 Y485	D342-A487 WeakPolarHBondContact OD1-CA 3.37Å; D342-A487 PolarHBondContact OD1-N 3.47Å; D342-A487 VanDerWaalsContact OD1-N 3.08Å; R345-A487 PolarHBondContact NE-O 2.62Å; R345-A487 PolarHBondContact NH2-O 3.47Å; Y485-A487 VanDerWaalsContact C-N 3.32Å; Y485-A487 PolarHBondContact O-N 3.31Å; Y485-A487 VanDerWaalsContact O-N 3.13Å
488	G	81.6	Confident	81.4	Confident	15 Å²	15	37.3 Å²	37.3	16%	0.155	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	115.7	2.2	168.1	0	0	0	0	0	116.2	D342 R345 R484 Y485	D342-G488 PolarHBondContact OD1-N 2.86Å; R345-G488 VanDerWaalsContact CD-CA 3.44Å; R484-G488 WeakPolarHBondContact CD-O 3.41Å; R484-G488 PolarHBondContact NH1-O 3.04Å; Y485-G488 CarbonylContact O-C 3.52Å; Y485-G488 PolarHBondContact O-N 3.23Å
489	T	85.9	Confident	79.7	Confident	17 Å²	17	48.8 Å²	48.8	10%	0.104	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-64.2	158.8	173	70.1	0	0	0	0	110.5	R484 Y485 P491 L524	R484-T489 WeakPolarHBondContact CA-O 3.4Å; Y485-T489 PolarHBondContact N-O 2.7Å; Y485-T489 PolarHBondContact O-N 3.11Å; Y485-T489 PolarHBondContact O-OG1 3.06Å; T489-P491 VanDerWaalsContact O-CD 3.26Å; T489-P491 WeakPolarHBondContact O-CD 3.44Å; T489-L524 HydrophobicContact CG2-CB 4.35Å; T489-L524 WeakPolarHBondContact CG2-O 3.3Å
490	M	89.6	Confident	78.6	Confident	81 Å²	81	55 Å²	55	40%	0.399	30%	0.3	S	S	.	.			trans	-115.8	79.1	-178.4	-64.5	-169.9	-54	0	0	109.7	R484 W492 G493	R484-M490 VanDerWaalsContact NH1-CG 3.32Å; R484-M490 PolarHBondContact NH1-SD 3.32Å; M490-W492 PolarHBondContact O-N 3.32Å; M490-W492 VanDerWaalsContact O-N 3.17Å; M490-G493 PolarHBondContact O-N 3.35Å
491	P	89.9	Confident	78	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.8	-170.4	28.2	-39.5	0	0	0	114.3	L480 Y485 T489 I514 F516 L524 G530	L480-P491 HydrophobicContact CD2-CG 3.32Å; Y485-P491 HydrophobicContact CD1-CB 4.3Å; Y485-P491 HydrophobicContact CD1-CG 4.14Å; Y485-P491 HydrophobicContact CG-CG 4.25Å; T489-P491 VanDerWaalsContact O-CD 3.26Å; T489-P491 WeakPolarHBondContact O-CD 3.44Å; P491-I514 HydrophobicContact CB-CD1 3.87Å; P491-I514 HydrophobicContact CG-CD1 4.01Å; P491-F516 HydrophobicContact CB-CE2 4.32Å; P491-F516 HydrophobicContact CB-CZ 3.59Å; P491-L524 HydrophobicContact CB-CD2 3.96Å; P491-G530 PolarHBondContact O-N 3.4Å
492	W	90	Very high	77.4	Confident	2 Å²	2	64 Å²	64	1%	0.008	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-21.7	175.3	-167.6	-111.1	0	0	0	113.2	M490 F501 Q504 E512 I514 R532 Q535	M490-W492 PolarHBondContact O-N 3.32Å; M490-W492 VanDerWaalsContact O-N 3.17Å; W492-F501 HydrophobicContact CH2-CD1 4.08Å; W492-F501 HydrophobicContact CH2-CE1 4.38Å; W492-F501 HydrophobicContact CH2-CG 4.22Å; W492-F501 HydrophobicContact CZ2-CB 3.81Å; W492-F501 AromaticContact CZ2-CD1 3.92Å; W492-F501 HydrophobicContact CZ2-CD1 3.92Å; W492-F501 HydrophobicContact CZ2-CD2 4.35Å; W492-F501 AromaticContact CZ2-CG 3.76Å; W492-F501 HydrophobicContact CZ2-CG 3.76Å; W492-Q504 HydrophobicContact CB-CB 4.5Å; W492-Q504 VanDerWaalsContact CB-OE1 3.23Å; W492-Q504 HydrophobicContact CG-CB 4.13Å; W492-E512 HydrophobicContact CD2-CB 4.02Å; W492-E512 HydrophobicContact CD2-CG 3.44Å; W492-E512 VanDerWaalsContact CD2-CG 3.44Å; W492-E512 HydrophobicContact CE3-CB 3.49Å; W492-E512 VanDerWaalsContact CE3-CB 3.49Å; W492-E512 HydrophobicContact CE3-CG 3.46Å; W492-E512 VanDerWaalsContact CE3-CG 3.46Å; W492-E512 HydrophobicContact CG-CG 4.02Å; W492-E512 HydrophobicContact CH2-CB 4.22Å; W492-E512 HydrophobicContact CH2-CG 3.97Å; W492-E512 HydrophobicContact CZ2-CG 3.94Å; W492-E512 HydrophobicContact CZ3-CB 3.6Å; W492-E512 HydrophobicContact CZ3-CG 3.73Å; W492-I514 HydrophobicContact CB-CD1 4.3Å; W492-I514 HydrophobicContact CE3-CD1 3.74Å; W492-I514 HydrophobicContact CE3-CG1 3.62Å; W492-I514 HydrophobicContact CZ3-CG1 3.91Å; W492-R532 HydrophobicContact CD2-CG 3.88Å; W492-R532 HydrophobicContact CE3-CB 4.31Å; W492-R532 HydrophobicContact CE3-CG 3.68Å; W492-R532 HydrophobicContact CH2-CB 3.8Å; W492-R532 HydrophobicContact CH2-CG 3.93Å; W492-R532 HydrophobicContact CZ2-CB 4.29Å; W492-R532 HydrophobicContact CZ2-CG 4.1Å; W492-R532 HydrophobicContact CZ3-CB 3.82Å; W492-R532 HydrophobicContact CZ3-CG 3.71Å; W492-R532 WeakPolarHBondContact O-CD 3.28Å; W492-Q535 HydrophobicContact CH2-CG 3.81Å; W492-Q535 HydrophobicContact CZ2-CG 3.57Å
493	G	82.2	Confident	77	Confident	21 Å²	21	67.1 Å²	67.1	22%	0.216	36%	0.362	C	S	.	.			trans	71.8	-173	-175.3	0	0	0	0	0	114.2	M490	M490-G493 PolarHBondContact O-N 3.35Å
494	N	70.5	Confident	76.9	Confident	120 Å²	120	67.2 Å²	67.2	64%	0.642	36%	0.36	S	S	*	.			trans	-91	140.1	176.7	-70.1	-17.5	0	0	0	110.4	G496	N494-G496 PolarHBondContact O-N 3.04Å
495	T	57.5	Low	76.8	Confident	49 Å²	49	68.7 Å²	68.7	30%	0.301	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-78	-0.5	-177.6	49.5	0	0	0	0	114.8	D497 P503	T495-D497 PolarHBondContact O-N 3.45Å; T495-P503 HydrophobicContact CG2-CB 4.47Å
496	G	53.3	Low	77	Confident	71 Å²	71	69.9 Å²	69.9	73%	0.732	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-61.6	-27.6	-176.7	0	0	0	0	0	114.8	N494	N494-G496 PolarHBondContact O-N 3.04Å
497	D	45.8	Very low	77.5	Confident	136 Å²	136	71.2 Å²	71.2	73%	0.727	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-96.6	-13.1	-167.7	-60.1	-35.9	0	0	0	114.2	T495	T495-D497 PolarHBondContact O-N 3.45Å
498	H	52.1	Low	78.1	Confident	103 Å²	103	71.5 Å²	71.5	48%	0.477	37%	0.373	S	S	.	.			trans	-148.6	128.3	-178.7	-66.4	-90.3	0	0	0	111.9	D500 R532	H498-D500 VanDerWaalsContact C-N 3.3Å; H498-D500 PolarHBondContact O-N 3.11Å; H498-R532 PolarHBondContact CD2-NH2 3.06Å
499	R	58.9	Low	78.8	Confident	241 Å²	241	71.1 Å²	71.1	91%	0.909	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	3.9	-176.3	-67	-173.9	177.8	-169.3	-2.3	115.1	F501	R499-F501 VanDerWaalsContact C-N 3.34Å; R499-F501 PolarHBondContact O-N 2.99Å
500	D	73.6	Confident	79.2	Confident	130 Å²	130	71.4 Å²	71.4	70%	0.695	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.8	-170.8	-56	-33.8	0	0	0	113.5	H498	H498-D500 VanDerWaalsContact C-N 3.3Å; H498-D500 PolarHBondContact O-N 3.11Å
501	F	83.5	Confident	79.5	Confident	50 Å²	50	67.6 Å²	67.6	22%	0.219	35%	0.353	C	S	.	.	S	Bend	trans	-136.7	149.3	-176	-63.7	-71.3	0	0	0	112.5	W492 R499 R532 Q535	W492-F501 HydrophobicContact CH2-CD1 4.08Å; W492-F501 HydrophobicContact CH2-CE1 4.38Å; W492-F501 HydrophobicContact CH2-CG 4.22Å; W492-F501 HydrophobicContact CZ2-CB 3.81Å; W492-F501 AromaticContact CZ2-CD1 3.92Å; W492-F501 HydrophobicContact CZ2-CD1 3.92Å; W492-F501 HydrophobicContact CZ2-CD2 4.35Å; W492-F501 AromaticContact CZ2-CG 3.76Å; W492-F501 HydrophobicContact CZ2-CG 3.76Å; R499-F501 VanDerWaalsContact C-N 3.34Å; R499-F501 PolarHBondContact O-N 2.99Å; F501-R532 HydrophobicContact CD2-CB 3.98Å; F501-R532 HydrophobicContact CE2-CB 3.7Å; F501-R532 HydrophobicContact CZ-CB 4.3Å; F501-Q535 HydrophobicContact CD1-CG 4.43Å
502	E	83.9	Confident	79.8	Confident	139 Å²	139	67.6 Å²	67.6	65%	0.65	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-78.5	158.4	175.6	-69.5	-65.2	156.5	0	0	111.5	Q504 Q535	E502-Q504 PolarHBondContact O-N 2.97Å; E502-Q535 PolarHBondContact O-NE2 3.47Å; E502-Q535 PolarHBondContact O-OE1 3.27Å
503	P	85.3	Confident	80.1	Confident	65 Å²	65	67.5 Å²	67.5	42%	0.422	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-55.9	132	171.7	-23.6	34.3	0	0	0	111.6	T495 R505	T495-P503 HydrophobicContact CG2-CB 4.47Å; P503-R505 PolarHBondContact O-N 3.22Å
504	Q	87.7	Confident	80.7	Confident	32 Å²	32	66.5 Å²	66.5	15%	0.15	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-61.9	131.5	178.6	175.2	169	42.4	0	0	111.3	L480 P483 W492 E502 E512	L480-Q504 VanDerWaalsContact CD2-NE2 3.32Å; P483-Q504 VanDerWaalsContact CA-OE1 3.28Å; P483-Q504 HydrophobicContact CG-CG 4.17Å; W492-Q504 HydrophobicContact CB-CB 4.5Å; W492-Q504 VanDerWaalsContact CB-OE1 3.23Å; W492-Q504 HydrophobicContact CG-CB 4.13Å; E502-Q504 PolarHBondContact O-N 2.97Å; Q504-E512 HydrophobicContact CB-CG 4.41Å; Q504-E512 VanDerWaalsContact CG-CD 3.48Å; Q504-E512 HydrophobicContact CG-CG 4.11Å; Q504-E512 WeakPolarHBondContact CG-OE2 3.4Å; Q504-E512 VanDerWaalsContact NE2-CD 3.34Å; Q504-E512 PolarHBondContact NE2-OE2 3.37Å
505	R	88.7	Confident	81.9	Confident	114 Å²	114	60.8 Å²	60.8	43%	0.43	31%	0.312	S	S	.	.			trans	-134.7	166.4	177.9	-68	-179.9	65.3	-136.9	-0.1	109.6	P503 D507 D508	P503-R505 PolarHBondContact O-N 3.22Å; R505-D507 IonicContact CZ-OD1 3.96Å; R505-D507 IonicContact CZ-OD2 2.64Å; R505-D507 IonicContact NE-OD1 3.27Å; R505-D507 PolarHBondContact NE-OD1 3.48Å; R505-D507 VanDerWaalsContact NE-OD1 3.12Å; R505-D507 IonicContact NH2-OD1 3.74Å; R505-D507 PolarHBondContact NH2-OD1 2.93Å; R505-D507 IonicContact NH2-OD2 3.33Å; R505-D507 PolarHBondContact NH2-OD2 2.97Å; R505-D508 HydrophobicContact CB-CB 4.01Å
506	H	93.1	Very high	83.6	Confident	24 Å²	24	58.4 Å²	58.4	11%	0.111	30%	0.297	C	S	.	.	S	Bend	trans	-117	13.2	-178.8	57.5	-81.1	0	0	0	111.6	Q372 L373 D374 N481 I482	Q372-H506 PolarHBondContact O-CD2 3.48Å; L373-H506 CarbonylContact C-O 3.52Å; L373-H506 WeakPolarHBondContact CA-O 3.38Å; L373-H506 HydrophobicContact CD1-CB 4.08Å; D374-H506 PolarHBondContact N-O 2.91Å; N481-H506 WeakPolarHBondContact O-CA 3.46Å; N481-H506 VanDerWaalsContact O-CB 3.32Å; N481-H506 WeakPolarHBondContact O-CB 3.42Å; I482-H506 HydrophobicContact CG2-CB 4.11Å
507	D	93.9	Very high	85.3	Confident	50 Å²	50	57 Å²	57	27%	0.267	28%	0.275	S	S	.	.	S	Bend	trans	-146.6	18.6	-171	66.9	-30.8	0	0	0	112.9	Q372 D374 R505 Q570	Q372-D507 HydrophobicContact CB-CB 3.91Å; D374-D507 WeakPolarHBondContact OD2-CA 3.47Å; D374-D507 PolarHBondContact OD2-N 3.31Å; R505-D507 IonicContact CZ-OD1 3.96Å; R505-D507 IonicContact CZ-OD2 2.64Å; R505-D507 IonicContact NE-OD1 3.27Å; R505-D507 PolarHBondContact NE-OD1 3.48Å; R505-D507 VanDerWaalsContact NE-OD1 3.12Å; R505-D507 IonicContact NH2-OD1 3.74Å; R505-D507 PolarHBondContact NH2-OD1 2.93Å; R505-D507 IonicContact NH2-OD2 3.33Å; R505-D507 PolarHBondContact NH2-OD2 2.97Å; D507-Q570 PolarHBondContact O-NE2 2.89Å
508	D	93.8	Very high	87	Confident	41 Å²	41	52.4 Å²	52.4	22%	0.219	25%	0.249	C	C	.	.	S	Bend	trans	-103.4	-4.5	-177.6	65.7	-8.1	0	0	0	113.8	D374 R505 C510	D374-D508 PolarHBondContact OD2-N 3.48Å; R505-D508 HydrophobicContact CB-CB 4.01Å; D508-C510 VanDerWaalsContact C-N 3.32Å; D508-C510 PolarHBondContact OD1-N 3.16Å
509	G	95	Very high	88.5	Confident	7 Å²	7	51 Å²	51	7%	0.072	26%	0.256	C	S	.	.	S	Bend	trans	74.3	21	-177.1	0	0	0	0	0	113.5	D374 W376	D374-G509 WeakPolarHBondContact OD2-CA 3.5Å; D374-G509 PolarHBondContact OD2-N 3.25Å; W376-G509 VanDerWaalsContact CH2-O 3.31Å; W376-G509 WeakPolarHBondContact CH2-O 3.47Å
510	C	95.1	Very high	89.9	Confident	24 Å²	24	40.4 Å²	40.4	16%	0.162	22%	0.218	C	C	.	.			trans	-117.8	153.4	179.3	-68.1	0	0	0	0	112.1	W376 D508 C536	W376-C510 VanDerWaalsContact CZ2-C 3.4Å; W376-C510 WeakPolarHBondContact CZ2-O 3.32Å; D508-C510 VanDerWaalsContact C-N 3.32Å; D508-C510 PolarHBondContact OD1-N 3.16Å; C510-C536 CarbonylContact C-O 3.56Å; C510-C536 WeakPolarHBondContact CA-O 3.09Å
511	I	95.7	Very high	90.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.4	167.3	-82.2	166.6	0	0	0	108.8	W376 F399 F479 V513 Q535 C536 I565	W376-I511 HydrophobicContact CB-CD1 4.3Å; W376-I511 HydrophobicContact CD2-CD1 3.23Å; W376-I511 HydrophobicContact CD2-CG1 3.62Å; W376-I511 VanDerWaalsContact CE2-CG1 3.42Å; W376-I511 HydrophobicContact CE3-CD1 3.2Å; W376-I511 HydrophobicContact CE3-CG1 3.88Å; W376-I511 HydrophobicContact CG-CD1 3.69Å; W376-I511 HydrophobicContact CG-CG1 4.18Å; W376-I511 HydrophobicContact CH2-CB 4.37Å; W376-I511 HydrophobicContact CH2-CD1 3.97Å; W376-I511 HydrophobicContact CH2-CG1 3.78Å; W376-I511 HydrophobicContact CZ2-CB 4.42Å; W376-I511 HydrophobicContact CZ2-CD1 4.05Å; W376-I511 HydrophobicContact CZ2-CG1 3.56Å; W376-I511 HydrophobicContact CZ3-CD1 3.56Å; W376-I511 HydrophobicContact CZ3-CG1 3.92Å; F399-I511 HydrophobicContact CE2-CD1 4.31Å; F399-I511 HydrophobicContact CZ-CD1 3.64Å; F479-I511 HydrophobicContact CB-CG2 3.89Å; F479-I511 HydrophobicContact CD1-CG2 4.2Å; I511-V513 HydrophobicContact CG2-CG2 4.23Å; I511-Q535 WeakPolarHBondContact O-CA 3.29Å; I511-C536 PolarHBondContact N-O 3.43Å; I511-C536 PolarHBondContact O-N 3.27Å; I511-I565 HydrophobicContact CD1-CG2 3.48Å; I511-I565 VanDerWaalsContact CD1-CG2 3.48Å
512	E	95.8	Very high	90.3	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	126.7	165.3	-73.7	73	-150.1	0	0	111.3	F479 L480 W492 Q504 I514 Q535	F479-E512 CarbonylContact C-O 3.53Å; F479-E512 WeakPolarHBondContact CA-O 3.29Å; L480-E512 HydrophobicContact CB-CB 4.19Å; L480-E512 PolarHBondContact N-O 3.36Å; L480-E512 PolarHBondContact O-N 3.22Å; L480-E512 VanDerWaalsContact O-OE2 3.12Å; W492-E512 HydrophobicContact CD2-CB 4.02Å; W492-E512 HydrophobicContact CD2-CG 3.44Å; W492-E512 VanDerWaalsContact CD2-CG 3.44Å; W492-E512 HydrophobicContact CE3-CB 3.49Å; W492-E512 VanDerWaalsContact CE3-CB 3.49Å; W492-E512 HydrophobicContact CE3-CG 3.46Å; W492-E512 VanDerWaalsContact CE3-CG 3.46Å; W492-E512 HydrophobicContact CG-CG 4.02Å; W492-E512 HydrophobicContact CH2-CB 4.22Å; W492-E512 HydrophobicContact CH2-CG 3.97Å; W492-E512 HydrophobicContact CZ2-CG 3.94Å; W492-E512 HydrophobicContact CZ3-CB 3.6Å; W492-E512 HydrophobicContact CZ3-CG 3.73Å; Q504-E512 HydrophobicContact CB-CG 4.41Å; Q504-E512 VanDerWaalsContact CG-CD 3.48Å; Q504-E512 HydrophobicContact CG-CG 4.11Å; Q504-E512 WeakPolarHBondContact CG-OE2 3.4Å; Q504-E512 VanDerWaalsContact NE2-CD 3.34Å; Q504-E512 PolarHBondContact NE2-OE2 3.37Å; E512-I514 HydrophobicContact CB-CD1 4.49Å; E512-I514 HydrophobicContact CB-CG1 4.38Å; E512-Q535 HydrophobicContact CG-CG 4Å; E512-Q535 PolarHBondContact OE1-NE2 2.85Å
513	V	96.4	Very high	90.2	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	117.1	175.1	-170.6	0	0	0	0	108.8	L465 I477 F479 I511 L533 H534 C536	L465-V513 HydrophobicContact CD1-CG1 4.39Å; I477-V513 HydrophobicContact CG2-CG1 4.39Å; F479-V513 HydrophobicContact CD1-CB 4.46Å; F479-V513 HydrophobicContact CD1-CG1 4.11Å; F479-V513 HydrophobicContact CD1-CG2 3.84Å; F479-V513 HydrophobicContact CE1-CB 4.46Å; F479-V513 HydrophobicContact CE1-CG1 3.72Å; F479-V513 HydrophobicContact CE1-CG2 3.97Å; F479-V513 HydrophobicContact CZ-CG1 4.47Å; I511-V513 HydrophobicContact CG2-CG2 4.23Å; V513-L533 HydrophobicContact CB-CB 4.36Å; V513-L533 HydrophobicContact CG1-CB 4.24Å; V513-L533 HydrophobicContact CG1-CD1 4.3Å; V513-L533 WeakPolarHBondContact O-CA 3.25Å; V513-L533 VanDerWaalsContact O-CB 3.3Å; V513-L533 WeakPolarHBondContact O-CB 3.33Å; V513-L533 PolarHBondContact O-N 3.15Å; V513-H534 HydrophobicContact CB-CB 4.24Å; V513-H534 HydrophobicContact CG2-CB 4.29Å; V513-H534 PolarHBondContact N-O 3.14Å; V513-H534 PolarHBondContact O-N 3.4Å; V513-C536 VanDerWaalsContact CG2-SG 3.58Å
514	I	95.5	Very high	90	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.6	-171.3	-46.5	-178.7	0	0	0	109.7	I477 V478 L480 P491 W492 E512 F516 E531	I477-I514 WeakPolarHBondContact CA-O 3.45Å; V478-I514 PolarHBondContact N-O 3.37Å; V478-I514 PolarHBondContact O-N 3.43Å; L480-I514 HydrophobicContact CB-CD1 4.39Å; L480-I514 HydrophobicContact CD2-CD1 3.82Å; P491-I514 HydrophobicContact CB-CD1 3.87Å; P491-I514 HydrophobicContact CG-CD1 4.01Å; W492-I514 HydrophobicContact CB-CD1 4.3Å; W492-I514 HydrophobicContact CE3-CD1 3.74Å; W492-I514 HydrophobicContact CE3-CG1 3.62Å; W492-I514 HydrophobicContact CZ3-CG1 3.91Å; E512-I514 HydrophobicContact CB-CD1 4.49Å; E512-I514 HydrophobicContact CB-CG1 4.38Å; I514-F516 HydrophobicContact CB-CE2 4.03Å; I514-F516 HydrophobicContact CG2-CD2 4.18Å; I514-F516 HydrophobicContact CG2-CE1 4.43Å; I514-F516 HydrophobicContact CG2-CE2 3.51Å; I514-F516 HydrophobicContact CG2-CZ 3.65Å; I514-E531 WeakPolarHBondContact CA-O 3.46Å
515	G	94.8	Very high	89.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.8	172.7	0	0	0	0	0	111.3	E531	G515-E531 PolarHBondContact N-O 2.94Å; G515-E531 PolarHBondContact O-N 3.25Å
516	F	92.6	Very high	89	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123.6	175.6	-74	-77.2	0	0	0	111.5	Q475 C476 V478 P491 I514 S520 L521 L524	Q475-F516 PolarHBondContact N-O 3.35Å; C476-F516 HydrophobicContact CB-CB 4.01Å; C476-F516 PolarHBondContact N-O 3.34Å; C476-F516 PolarHBondContact O-N 2.97Å; V478-F516 HydrophobicContact CB-CE2 4.19Å; V478-F516 HydrophobicContact CG2-CD2 3.81Å; V478-F516 HydrophobicContact CG2-CE2 3.73Å; P491-F516 HydrophobicContact CB-CE2 4.32Å; P491-F516 HydrophobicContact CB-CZ 3.59Å; I514-F516 HydrophobicContact CB-CE2 4.03Å; I514-F516 HydrophobicContact CG2-CD2 4.18Å; I514-F516 HydrophobicContact CG2-CE1 4.43Å; I514-F516 HydrophobicContact CG2-CE2 3.51Å; I514-F516 HydrophobicContact CG2-CZ 3.65Å; F516-S520 WeakPolarHBondContact CA-OG 3.1Å; F516-L521 HydrophobicContact CB-CB 4.21Å; F516-L521 HydrophobicContact CB-CD1 4.22Å; F516-L521 HydrophobicContact CD1-CB 4.25Å; F516-L521 HydrophobicContact CD1-CD1 4.07Å; F516-L521 HydrophobicContact CD2-CD1 4.35Å; F516-L521 HydrophobicContact CG-CB 4.47Å; F516-L521 HydrophobicContact CG-CD1 3.94Å; F516-L524 HydrophobicContact CD1-CD1 4.35Å; F516-L524 HydrophobicContact CD1-CG 4.49Å; F516-L524 HydrophobicContact CE1-CD1 3.65Å; F516-L524 HydrophobicContact CE1-CD2 3.62Å; F516-L524 HydrophobicContact CE1-CG 3.71Å; F516-L524 HydrophobicContact CZ-CD1 3.82Å; F516-L524 HydrophobicContact CZ-CD2 3.94Å; F516-L524 HydrophobicContact CZ-CG 4.25Å
517	T	90.1	Very high	88.2	Confident	42 Å²	42	36 Å²	36	26%	0.258	24%	0.239	S	C	.	.			trans	-78.8	160.3	155	69.2	0	0	0	0	109.6	F474 A519 S520 L521	F474-T517 HydrophobicContact CD1-CG2 4Å; F474-T517 HydrophobicContact CE1-CG2 4.19Å; T517-A519 PolarHBondContact O-N 3.46Å; T517-S520 PolarHBondContact N-OG 3.43Å; T517-S520 PolarHBondContact O-N 2.78Å; T517-S520 VanDerWaalsContact O-N 3.16Å; T517-S520 PolarHBondContact O-OG 3.43Å; T517-S520 PolarHBondContact OG1-N 3.24Å; T517-S520 VanDerWaalsContact OG1-N 3.17Å; T517-S520 PolarHBondContact OG1-OG 3.32Å; T517-S520 VanDerWaalsContact OG1-OG 3.12Å; T517-L521 WeakPolarHBondContact O-CB 3.37Å; T517-L521 PolarHBondContact O-N 3.18Å
518	M	82.1	Confident	87.7	Confident	38 Å²	38	34.6 Å²	34.6	19%	0.187	24%	0.236	C	C	.	.	H	α-helix	trans	-52.9	-39.1	173	-71	-68.2	90.7	0	0	113.3	F407 F444 Q475 L521 A522	F407-M518 HydrophobicContact CB-CE 3.47Å; F407-M518 VanDerWaalsContact CB-CE 3.47Å; F407-M518 HydrophobicContact CB-SD 4.49Å; F407-M518 HydrophobicContact CD1-CE 3.58Å; F407-M518 HydrophobicContact CD1-SD 4.1Å; F407-M518 HydrophobicContact CD2-CE 3.98Å; F407-M518 HydrophobicContact CD2-SD 3.89Å; F407-M518 HydrophobicContact CE1-CE 4.28Å; F407-M518 HydrophobicContact CE1-SD 4.27Å; F407-M518 HydrophobicContact CE2-SD 4.08Å; F407-M518 HydrophobicContact CG-CE 3.39Å; F407-M518 HydrophobicContact CG-SD 3.89Å; F407-M518 HydrophobicContact CZ-SD 4.27Å; F444-M518 HydrophobicContact CD2-SD 4.26Å; F444-M518 HydrophobicContact CE2-CB 4.05Å; Q475-M518 HydrophobicContact CB-CE 3.66Å; Q475-M518 HydrophobicContact CB-CG 4.42Å; Q475-M518 HydrophobicContact CG-CE 4.43Å; Q475-M518 HydrophobicContact CG-CG 4.18Å; M518-L521 HydrophobicContact CE-CD2 3.92Å; M518-A522 WeakPolarHBondContact O-CB 3.5Å; M518-A522 PolarHBondContact O-N 3.09Å; M518-A522 VanDerWaalsContact O-N 3.08Å
519	A	83.6	Confident	87.5	Confident	75 Å²	75	37.2 Å²	37.2	62%	0.62	25%	0.247	S	C	*	.	H	α-helix	trans	-65.9	-49	176.8	0	0	0	0	0	111.7	T517 L521 A522 A523	T517-A519 PolarHBondContact O-N 3.46Å; A519-L521 VanDerWaalsContact C-N 3.33Å; A519-L521 PolarHBondContact O-N 3.32Å; A519-A522 PolarHBondContact O-N 2.92Å; A519-A523 WeakPolarHBondContact O-CB 3.45Å; A519-A523 PolarHBondContact O-N 2.89Å
520	S	87.5	Confident	87.3	Confident	17 Å²	17	36.9 Å²	36.9	12%	0.119	24%	0.244	C	C	.	.	H	α-helix	trans	-64.9	-35.3	178.9	60.2	0	0	0	0	112.9	F516 T517 A523 L524	F516-S520 WeakPolarHBondContact CA-OG 3.1Å; T517-S520 PolarHBondContact N-OG 3.43Å; T517-S520 PolarHBondContact O-N 2.78Å; T517-S520 VanDerWaalsContact O-N 3.16Å; T517-S520 PolarHBondContact O-OG 3.43Å; T517-S520 PolarHBondContact OG1-N 3.24Å; T517-S520 VanDerWaalsContact OG1-N 3.17Å; T517-S520 PolarHBondContact OG1-OG 3.32Å; T517-S520 VanDerWaalsContact OG1-OG 3.12Å; S520-A523 PolarHBondContact O-N 3.28Å; S520-L524 PolarHBondContact O-N 3.31Å
521	L	84.4	Confident	87.2	Confident	23 Å²	23	40 Å²	40	12%	0.12	26%	0.256	C	S	.	.	H	α-helix	trans	-67.1	-41.9	177.1	-168.6	70.2	0	0	0	111	F407 D408 F516 T517 M518 A519 A523 L524	F407-L521 HydrophobicContact CD1-CD2 3.62Å; F407-L521 HydrophobicContact CE1-CD2 4.26Å; D408-L521 HydrophobicContact CB-CD2 4.48Å; F516-L521 HydrophobicContact CB-CB 4.21Å; F516-L521 HydrophobicContact CB-CD1 4.22Å; F516-L521 HydrophobicContact CD1-CB 4.25Å; F516-L521 HydrophobicContact CD1-CD1 4.07Å; F516-L521 HydrophobicContact CD2-CD1 4.35Å; F516-L521 HydrophobicContact CG-CB 4.47Å; F516-L521 HydrophobicContact CG-CD1 3.94Å; T517-L521 WeakPolarHBondContact O-CB 3.37Å; T517-L521 PolarHBondContact O-N 3.18Å; M518-L521 HydrophobicContact CE-CD2 3.92Å; A519-L521 VanDerWaalsContact C-N 3.33Å; A519-L521 PolarHBondContact O-N 3.32Å; L521-A523 VanDerWaalsContact C-N 3.31Å; L521-L524 HydrophobicContact CD1-CD1 3.85Å; L521-L524 WeakPolarHBondContact O-CB 3.49Å; L521-L524 PolarHBondContact O-N 2.84Å
522	A	80.6	Confident	87.1	Confident	66 Å²	66	41.5 Å²	41.5	55%	0.545	26%	0.262	S	S	.	.	H	α-helix	trans	-65.2	-35.9	174.6	0	0	0	0	0	112	M518 A519 L524	M518-A522 WeakPolarHBondContact O-CB 3.5Å; M518-A522 PolarHBondContact O-N 3.09Å; M518-A522 VanDerWaalsContact O-N 3.08Å; A519-A522 PolarHBondContact O-N 2.92Å; A522-L524 VanDerWaalsContact C-N 3.27Å; A522-L524 PolarHBondContact O-N 3.14Å
523	A	83.1	Confident	87	Confident	34 Å²	34	41.9 Å²	41.9	28%	0.281	26%	0.264	S	S	.	.	H	α-helix	trans	-70.2	-17.5	179.1	0	0	0	0	0	114	A519 S520 L521 Q525 V526 G528	A519-A523 WeakPolarHBondContact O-CB 3.45Å; A519-A523 PolarHBondContact O-N 2.89Å; S520-A523 PolarHBondContact O-N 3.28Å; L521-A523 VanDerWaalsContact C-N 3.31Å; A523-Q525 PolarHBondContact O-N 3.13Å; A523-Q525 VanDerWaalsContact O-N 3.16Å; A523-V526 HydrophobicContact CB-CG2 4.47Å; A523-V526 WeakPolarHBondContact O-CG2 3.37Å; A523-V526 PolarHBondContact O-N 3.25Å; A523-G528 WeakPolarHBondContact O-CA 3.25Å; A523-G528 PolarHBondContact O-N 3.41Å
524	L	81.5	Confident	86.9	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.031	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-55.3	-36.3	-178.5	-78.8	-179.4	0	0	0	113.7	Y485 T489 P491 F516 S520 L521 A522 V526 G527 G528	Y485-L524 HydrophobicContact CD1-CD1 4.19Å; Y485-L524 HydrophobicContact CE1-CD1 4.16Å; T489-L524 HydrophobicContact CG2-CB 4.35Å; T489-L524 WeakPolarHBondContact CG2-O 3.3Å; P491-L524 HydrophobicContact CB-CD2 3.96Å; F516-L524 HydrophobicContact CD1-CD1 4.35Å; F516-L524 HydrophobicContact CD1-CG 4.49Å; F516-L524 HydrophobicContact CE1-CD1 3.65Å; F516-L524 HydrophobicContact CE1-CD2 3.62Å; F516-L524 HydrophobicContact CE1-CG 3.71Å; F516-L524 HydrophobicContact CZ-CD1 3.82Å; F516-L524 HydrophobicContact CZ-CD2 3.94Å; F516-L524 HydrophobicContact CZ-CG 4.25Å; S520-L524 PolarHBondContact O-N 3.31Å; L521-L524 HydrophobicContact CD1-CD1 3.85Å; L521-L524 WeakPolarHBondContact O-CB 3.49Å; L521-L524 PolarHBondContact O-N 2.84Å; A522-L524 VanDerWaalsContact C-N 3.27Å; A522-L524 PolarHBondContact O-N 3.14Å; L524-V526 VanDerWaalsContact C-N 3.25Å; L524-V526 PolarHBondContact O-N 3.49Å; L524-G527 PolarHBondContact O-N 3.27Å; L524-G528 WeakPolarHBondContact CD2-O 3.3Å
525	Q	76.6	Confident	86.9	Confident	135 Å²	135	45.1 Å²	45.1	63%	0.631	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-73.6	-18.6	-177.2	-64.1	-61.9	-35.3	0	0	112.9	C486 A523	C486-Q525 PolarHBondContact O-NE2 3.37Å; A523-Q525 PolarHBondContact O-N 3.13Å; A523-Q525 VanDerWaalsContact O-N 3.16Å
526	V	77.3	Confident	86.9	Confident	127 Å²	127	45.2 Å²	45.2	77%	0.77	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-104.6	21.8	177.5	-62.1	0	0	0	0	112.2	A523 L524	A523-V526 HydrophobicContact CB-CG2 4.47Å; A523-V526 WeakPolarHBondContact O-CG2 3.37Å; A523-V526 PolarHBondContact O-N 3.25Å; L524-V526 VanDerWaalsContact C-N 3.25Å; L524-V526 PolarHBondContact O-N 3.49Å
527	G	76.3	Confident	87.1	Confident	71 Å²	71	53.2 Å²	53.2	73%	0.732	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	8.5	178.4	0	0	0	0	0	114.8	L524	L524-G527 PolarHBondContact O-N 3.27Å
528	G	83.9	Confident	87.4	Confident	21 Å²	21	55.5 Å²	55.5	22%	0.216	32%	0.317	C	S	.	.			trans	-65.7	166.8	170	0	0	0	0	0	112.7	A523 L524	A523-G528 WeakPolarHBondContact O-CA 3.25Å; A523-G528 PolarHBondContact O-N 3.41Å; L524-G528 WeakPolarHBondContact CD2-O 3.3Å
529	H	90.3	Very high	88.1	Confident	95 Å²	95	53.8 Å²	53.8	44%	0.44	31%	0.309	S	S	.	.			trans	-128.1	165.4	176.4	60.3	67.4	0	0	0	110.6
530	G	90.8	Very high	88.8	Confident	1 Å²	1	52 Å²	52	1%	0.01	29%	0.29	C	S	.	.			trans	-84	175.5	170.9	0	0	0	0	0	112.2	P491 R532	P491-G530 PolarHBondContact O-N 3.4Å; G530-R532 PolarHBondContact O-N 3Å
531	E	92.5	Very high	89.1	Confident	90 Å²	90	51.2 Å²	51.2	42%	0.421	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	120.5	171	-73	-61	152.4	0	0	109.8	F474 I514 G515 L533	F474-E531 HydrophobicContact CE1-CB 3.71Å; F474-E531 HydrophobicContact CE1-CG 3.68Å; F474-E531 HydrophobicContact CZ-CB 3.5Å; F474-E531 HydrophobicContact CZ-CG 3.79Å; I514-E531 WeakPolarHBondContact CA-O 3.46Å; G515-E531 PolarHBondContact N-O 2.94Å; G515-E531 PolarHBondContact O-N 3.25Å; E531-L533 HydrophobicContact CB-CD2 4.39Å; E531-L533 PolarHBondContact O-N 2.97Å
532	R	93.1	Very high	89.6	Confident	30 Å²	30	50.9 Å²	50.9	11%	0.113	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	114.5	177.9	-65.9	177.1	-77.3	179	-5	109.4	W492 H498 F501 G530	W492-R532 HydrophobicContact CD2-CG 3.88Å; W492-R532 HydrophobicContact CE3-CB 4.31Å; W492-R532 HydrophobicContact CE3-CG 3.68Å; W492-R532 HydrophobicContact CH2-CB 3.8Å; W492-R532 HydrophobicContact CH2-CG 3.93Å; W492-R532 HydrophobicContact CZ2-CB 4.29Å; W492-R532 HydrophobicContact CZ2-CG 4.1Å; W492-R532 HydrophobicContact CZ3-CB 3.82Å; W492-R532 HydrophobicContact CZ3-CG 3.71Å; W492-R532 WeakPolarHBondContact O-CD 3.28Å; H498-R532 PolarHBondContact CD2-NH2 3.06Å; F501-R532 HydrophobicContact CD2-CB 3.98Å; F501-R532 HydrophobicContact CE2-CB 3.7Å; F501-R532 HydrophobicContact CZ-CB 4.3Å; G530-R532 PolarHBondContact O-N 3Å
533	L	93.8	Very high	90.2	Very high	9 Å²	9	47.8 Å²	47.8	5%	0.047	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-46	-177	-54.1	-178.9	0	0	0	112.1	L465 K468 I469 F474 V513 E531	L465-L533 HydrophobicContact CD1-CB 4.14Å; K468-L533 HydrophobicContact CD-CD2 3.99Å; K468-L533 HydrophobicContact CG-CD2 4.43Å; I469-L533 HydrophobicContact CG1-CD1 4.2Å; F474-L533 HydrophobicContact CD2-CD1 4.24Å; F474-L533 HydrophobicContact CE2-CD1 3.94Å; F474-L533 HydrophobicContact CE2-CD2 3.54Å; F474-L533 HydrophobicContact CE2-CG 4.31Å; F474-L533 HydrophobicContact CZ-CD2 3.87Å; V513-L533 HydrophobicContact CB-CB 4.36Å; V513-L533 HydrophobicContact CG1-CB 4.24Å; V513-L533 HydrophobicContact CG1-CD1 4.3Å; V513-L533 WeakPolarHBondContact O-CA 3.25Å; V513-L533 VanDerWaalsContact O-CB 3.3Å; V513-L533 WeakPolarHBondContact O-CB 3.33Å; V513-L533 PolarHBondContact O-N 3.15Å; E531-L533 HydrophobicContact CB-CD2 4.39Å; E531-L533 PolarHBondContact O-N 2.97Å
534	H	94.9	Very high	90.5	Very high	39 Å²	39	52 Å²	52	18%	0.181	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	156.6	-178	-145.6	-73.3	0	0	0	112.2	C460 L465 V513	C460-H534 HydrophobicContact CB-CB 4.19Å; L465-H534 HydrophobicContact CD1-CB 3.97Å; V513-H534 HydrophobicContact CB-CB 4.24Å; V513-H534 HydrophobicContact CG2-CB 4.29Å; V513-H534 PolarHBondContact N-O 3.14Å; V513-H534 PolarHBondContact O-N 3.4Å
535	Q	94.4	Very high	90.8	Very high	29 Å²	29	56.5 Å²	56.5	14%	0.136	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.4	157.6	-85.1	172.2	-32.6	0	0	108.1	W492 F501 E502 I511 E512	W492-Q535 HydrophobicContact CH2-CG 3.81Å; W492-Q535 HydrophobicContact CZ2-CG 3.57Å; F501-Q535 HydrophobicContact CD1-CG 4.43Å; E502-Q535 PolarHBondContact O-NE2 3.47Å; E502-Q535 PolarHBondContact O-OE1 3.27Å; I511-Q535 WeakPolarHBondContact O-CA 3.29Å; E512-Q535 HydrophobicContact CG-CG 4Å; E512-Q535 PolarHBondContact OE1-NE2 2.85Å
536	C	95.4	Very high	91.3	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.007	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	162.5	-167.6	58.2	0	0	0	0	114.4	C460 D461 C510 I511 V513 V539	C460-C536 HydrophobicContact CB-CB 3.93Å; D461-C536 HydrophobicContact CB-CB 4.43Å; D461-C536 WeakPolarHBondContact OD2-CA 2.99Å; D461-C536 WeakPolarHBondContact OD2-CB 3.28Å; C510-C536 CarbonylContact C-O 3.56Å; C510-C536 WeakPolarHBondContact CA-O 3.09Å; I511-C536 PolarHBondContact N-O 3.43Å; I511-C536 PolarHBondContact O-N 3.27Å; V513-C536 VanDerWaalsContact CG2-SG 3.58Å; C536-V539 VanDerWaalsContact SG-CG2 3.53Å
537	R	95.9	Very high	91.8	Very high	169 Å²	169	45.8 Å²	45.8	64%	0.638	23%	0.231	S	C	*	.	S	Bend	trans	-102.2	-22	179.7	-60.9	-172.8	172.9	172.4	-0.4	113.8	W376 D461	W376-R537 VanDerWaalsContact CZ3-O 3.32Å; W376-R537 WeakPolarHBondContact CZ3-O 3.21Å; D461-R537 PolarHBondContact OD1-N 3.37Å; D461-R537 PolarHBondContact OD2-N 3.47Å
538	E	96.7	Very high	92.3	Very high	90 Å²	90	43.4 Å²	43.4	42%	0.421	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	136.5	175.9	-168.9	179	-177.4	0	0	110.6	C460 D461 I565	C460-E538 WeakPolarHBondContact CA-O 3.45Å; D461-E538 PolarHBondContact N-O 3.29Å; D461-E538 PolarHBondContact OD1-N 3.08Å; E538-I565 WeakPolarHBondContact CA-O 3.16Å
539	V	97.9	Very high	92.6	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.3	173.2	-175.5	0	0	0	0	109.9	V458 V459 F479 C536 R564 I565	V458-V539 HydrophobicContact CG1-CG1 4.2Å; V459-V539 CarbonylContact O-C 3.29Å; V459-V539 WeakPolarHBondContact O-CA 3.42Å; F479-V539 HydrophobicContact CD1-CG1 4.19Å; F479-V539 HydrophobicContact CD1-CG2 3.99Å; F479-V539 HydrophobicContact CE1-CB 4.24Å; F479-V539 HydrophobicContact CE1-CG1 3.43Å; F479-V539 VanDerWaalsContact CE1-CG1 3.43Å; F479-V539 HydrophobicContact CE1-CG2 3.96Å; F479-V539 HydrophobicContact CZ-CG1 3.89Å; C536-V539 VanDerWaalsContact SG-CG2 3.53Å; V539-R564 WeakPolarHBondContact O-CA 3.45Å; V539-I565 HydrophobicContact CB-CB 3.94Å; V539-I565 HydrophobicContact CB-CD1 4.11Å; V539-I565 HydrophobicContact CB-CG1 4.11Å; V539-I565 HydrophobicContact CG1-CD1 4.36Å; V539-I565 HydrophobicContact CG2-CB 4.4Å; V539-I565 PolarHBondContact N-O 3.12Å; V539-I565 PolarHBondContact O-N 3.17Å
540	V	97.1	Very high	92.5	Very high	38 Å²	38	38.2 Å²	38.2	23%	0.23	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	109.7	164.4	-173.5	0	0	0	0	108.7	V459 T562 L563 R564	V459-V540 HydrophobicContact CB-CB 4.36Å; V459-V540 PolarHBondContact N-O 3.06Å; V459-V540 PolarHBondContact O-N 3.14Å; V540-T562 HydrophobicContact CG1-CG2 3.82Å; V540-L563 WeakPolarHBondContact CA-O 3.48Å; V540-R564 HydrophobicContact CG2-CG 4.36Å
541	L	95.5	Very high	92.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.3	177	167.2	67	0	0	0	109.1	F403 L405 V456 R457 V458 F479 T543 T562 L563	F403-L541 HydrophobicContact CE1-CD2 3.68Å; F403-L541 HydrophobicContact CZ-CD2 4.17Å; L405-L541 HydrophobicContact CD1-CD1 4.04Å; L405-L541 HydrophobicContact CD1-CD2 4.06Å; L405-L541 HydrophobicContact CD2-CD2 3.98Å; V456-L541 HydrophobicContact CB-CD1 4.37Å; R457-L541 CarbonylContact O-C 3.58Å; R457-L541 WeakPolarHBondContact O-CA 3.16Å; V458-L541 HydrophobicContact CG2-CD1 3.76Å; F479-L541 HydrophobicContact CE2-CD2 4.18Å; L541-T543 HydrophobicContact CD1-CG2 4.46Å; L541-T543 HydrophobicContact CG-CG2 4.38Å; L541-T562 CarbonylContact O-C 3.59Å; L541-T562 WeakPolarHBondContact O-CA 3.48Å; L541-L563 HydrophobicContact CB-CB 4.36Å; L541-L563 HydrophobicContact CB-CD1 4.49Å; L541-L563 HydrophobicContact CD2-CD1 3.9Å; L541-L563 HydrophobicContact CG-CD1 4.05Å; L541-L563 PolarHBondContact N-O 2.93Å; L541-L563 PolarHBondContact O-N 3.33Å
542	T	94.4	Very high	91.3	Very high	17 Å²	17	34.4 Å²	34.4	10%	0.104	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129	172.9	-49	0	0	0	0	109.7	V456 R457 Y544	V456-T542 CarbonylContact C-O 3.56Å; V456-T542 WeakPolarHBondContact CA-O 3.43Å; R457-T542 PolarHBondContact N-O 3.09Å; R457-T542 PolarHBondContact O-N 2.7Å; T542-Y544 HydrophobicContact CG2-CD1 4.3Å; T542-Y544 HydrophobicContact CG2-CE1 3.71Å
543	T	91.8	Very high	90.1	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.2	173.8	64.2	0	0	0	0	109.8	L541 V547 P560 S561 L563	L541-T543 HydrophobicContact CD1-CG2 4.46Å; L541-T543 HydrophobicContact CG-CG2 4.38Å; T543-V547 HydrophobicContact CG2-CG2 3.6Å; T543-P560 WeakPolarHBondContact O-CA 3.37Å; T543-P560 WeakPolarHBondContact O-CB 3.41Å; T543-S561 PolarHBondContact N-O 3.26Å; T543-S561 PolarHBondContact O-N 2.97Å; T543-S561 PolarHBondContact OG1-N 3.39Å; T543-S561 PolarHBondContact OG1-O 2.82Å; T543-L563 HydrophobicContact CG2-CD1 4.48Å
544	Y	89.8	Confident	89.1	Confident	122 Å²	122	36.5 Å²	36.5	48%	0.478	17%	0.174	S	C	.	.	S	Bend	trans	-101.8	-5.1	-178.9	-56.7	-67.8	0	0	0	113.5	H455 R457 T542	H455-Y544 WeakPolarHBondContact O-CD2 3.25Å; H455-Y544 PolarHBondContact O-N 2.89Å; R457-Y544 HydrophobicContact CB-CE2 4.03Å; T542-Y544 HydrophobicContact CG2-CD1 4.3Å; T542-Y544 HydrophobicContact CG2-CE1 3.71Å
545	K	88.1	Confident	88.4	Confident	102 Å²	102	35.6 Å²	35.6	44%	0.443	17%	0.171	S	C	.	.	S	Bend	trans	-138.6	159.8	175.2	-169.4	176	-179.5	-178	0	108.6	H455 V547	H455-K545 HydrophobicContact CB-CB 4.13Å; K545-V547 PolarHBondContact O-N 2.69Å
546	T	87.3	Confident	88	Confident	28 Å²	28	35.3 Å²	35.3	17%	0.172	17%	0.171	C	C	.	.			trans	-57.8	122.7	168.1	-56.6	0	0	0	0	110.7	E388 E389 R557 L558	E388-T546 VanDerWaalsContact CB-OG1 3.31Å; E388-T546 WeakPolarHBondContact CB-OG1 3.26Å; E388-T546 WeakPolarHBondContact OE2-CB 3.25Å; E388-T546 PolarHBondContact OE2-N 3.33Å; E388-T546 PolarHBondContact OE2-OG1 3.12Å; E389-T546 WeakPolarHBondContact O-CG2 3.35Å; T546-R557 HydrophobicContact CG2-CB 3.88Å; T546-L558 CarbonylContact C-O 3.6Å; T546-L558 VanDerWaalsContact CA-O 3.23Å; T546-L558 WeakPolarHBondContact CA-O 3.45Å
547	V	87.3	Confident	87.5	Confident	9 Å²	9	40.8 Å²	40.8	6%	0.055	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	143.1	-178.7	-69.2	0	0	0	0	111.6	L452 T543 K545 V549 L558	L452-V547 HydrophobicContact CD1-CG1 3.94Å; T543-V547 HydrophobicContact CG2-CG2 3.6Å; K545-V547 PolarHBondContact O-N 2.69Å; V547-V549 HydrophobicContact CG2-CG1 4.06Å; V547-L558 PolarHBondContact N-O 3.15Å; V547-L558 PolarHBondContact O-N 3.17Å
548	P	88.1	Confident	87.1	Confident	20 Å²	20	32.8 Å²	32.8	13%	0.13	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	133	169.3	28.6	-31.2	0	0	0	109.8	L405 G406 A409 H410 L556	L405-P548 WeakPolarHBondContact CA-O 3.47Å; G406-P548 PolarHBondContact N-O 2.88Å; A409-P548 HydrophobicContact CB-CB 4.29Å; A409-P548 WeakPolarHBondContact CB-O 3.44Å; H410-P548 HydrophobicContact CB-CB 4.15Å; H410-P548 HydrophobicContact CB-CG 3.84Å; P548-L556 WeakPolarHBondContact CA-O 3.33Å
549	V	89.8	Confident	86.6	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	150	178.4	-57.1	0	0	0	0	110.8	L394 F403 S404 L405 V547 T555 L556 L558	L394-V549 HydrophobicContact CD2-CG2 3.95Å; F403-V549 HydrophobicContact CE2-CB 3.96Å; F403-V549 HydrophobicContact CE2-CG1 4.43Å; F403-V549 HydrophobicContact CE2-CG2 4.49Å; F403-V549 HydrophobicContact CZ-CB 4.3Å; F403-V549 HydrophobicContact CZ-CG1 4.28Å; S404-V549 CarbonylContact O-C 3.6Å; S404-V549 WeakPolarHBondContact O-CA 3.06Å; L405-V549 HydrophobicContact CB-CG1 4.11Å; V547-V549 HydrophobicContact CG2-CG1 4.06Å; V549-T555 WeakPolarHBondContact O-CA 3.25Å; V549-L556 HydrophobicContact CG2-CD1 3.78Å; V549-L556 HydrophobicContact CG2-CG 3.98Å; V549-L556 PolarHBondContact N-O 2.97Å; V549-L556 PolarHBondContact O-N 2.77Å; V549-L558 HydrophobicContact CG1-CB 3.92Å; V549-L558 HydrophobicContact CG1-CD2 4.05Å; V549-L558 HydrophobicContact CG2-CB 3.86Å; V549-L558 HydrophobicContact CG2-CD2 4.46Å
550	Q	88.6	Confident	86.3	Confident	6 Å²	6	29.6 Å²	29.6	3%	0.028	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.2	176.5	-178.9	176.6	-2.2	0	0	110.1	Y402 F403 S404 D408 A409 T412 M552 T555	Y402-Q550 HydrophobicContact CE2-CG 4.28Å; Y402-Q550 PolarHBondContact OH-NE2 3.05Å; F403-Q550 WeakPolarHBondContact CA-O 3.48Å; F403-Q550 VanDerWaalsContact CD2-O 3.27Å; F403-Q550 WeakPolarHBondContact CD2-O 3.44Å; S404-Q550 PolarHBondContact N-O 3.36Å; S404-Q550 PolarHBondContact O-N 2.84Å; S404-Q550 WeakPolarHBondContact OG-CB 3.34Å; D408-Q550 PolarHBondContact OD2-OE1 3.29Å; A409-Q550 HydrophobicContact CB-CB 3.94Å; T412-Q550 PolarHBondContact OG1-OE1 2.63Å; Q550-M552 PolarHBondContact NE2-O 3.38Å; Q550-T555 HydrophobicContact CB-CG2 3.72Å; Q550-T555 HydrophobicContact CG-CG2 3.7Å
551	V	84.1	Confident	86	Confident	2 Å²	2	28 Å²	28	1%	0.012	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	95.8	175.2	-174.9	0	0	0	0	107.4	L378 L394 L396 F399 F403 S553 P554	L378-V551 HydrophobicContact CD1-CB 4.43Å; L378-V551 HydrophobicContact CD1-CG1 3.62Å; L378-V551 HydrophobicContact CD1-CG2 3.92Å; L394-V551 HydrophobicContact CD1-CG2 4.46Å; L394-V551 HydrophobicContact CD2-CG2 4.19Å; L396-V551 HydrophobicContact CB-CG1 4.11Å; F399-V551 HydrophobicContact CB-CG1 4Å; F403-V551 HydrophobicContact CD2-CG2 3.83Å; F403-V551 HydrophobicContact CE2-CG2 4.09Å; V551-S553 VanDerWaalsContact C-N 3.32Å; V551-S553 PolarHBondContact O-N 2.67Å; V551-P554 PolarHBondContact N-O 3.03Å; V551-P554 WeakPolarHBondContact O-CD 3.48Å
552	M	74.4	Confident	85.9	Confident	9 Å²	9	29.3 Å²	29.3	4%	0.044	15%	0.147	C	C	.	.	S	Bend	trans	56	-85.1	-170.2	-53.2	173.5	56.7	0	0	113.4	D311 F399 N400 N401 Y402 Q550	D311-M552 HydrophobicContact CB-CE 4.23Å; D311-M552 WeakPolarHBondContact O-CE 3.15Å; F399-M552 HydrophobicContact CB-CG 3.82Å; F399-M552 HydrophobicContact CB-SD 4.24Å; N400-M552 HydrophobicContact CB-CE 4.22Å; N400-M552 HydrophobicContact CB-SD 4.17Å; N400-M552 PolarHBondContact N-SD 2.65Å; N400-M552 VanDerWaalsContact N-SD 3.37Å; N400-M552 WeakPolarHBondContact ND2-CE 3.37Å; N401-M552 HydrophobicContact CB-CG 4.47Å; Y402-M552 PolarHBondContact O-N 2.74Å; Y402-M552 PolarHBondContact OH-O 3.26Å; Q550-M552 PolarHBondContact NE2-O 3.38Å
553	S	66.6	Low	85.8	Confident	42 Å²	42	28.5 Å²	28.5	29%	0.294	14%	0.142	S	C	.	.	S	Bend	trans	-118.5	-36.2	-178.1	-179.2	0	0	0	0	113.7	H416 V551	H416-S553 PolarHBondContact CE1-O 2.9Å; H416-S553 VanDerWaalsContact CE1-O 3.31Å; H416-S553 PolarHBondContact NE2-O 3Å; V551-S553 VanDerWaalsContact C-N 3.32Å; V551-S553 PolarHBondContact O-N 2.67Å
554	P	74.1	Confident	86	Confident	41 Å²	41	33.2 Å²	33.2	27%	0.266	16%	0.16	S	C	.	.			trans	-64.1	137.6	168	-30.1	35.3	0	0	0	113.8	P395 L396 V551	P395-P554 HydrophobicContact CB-CB 4.41Å; P395-P554 HydrophobicContact CG-CB 3.6Å; P395-P554 HydrophobicContact CG-CG 4.38Å; L396-P554 HydrophobicContact CD1-CG 3.75Å; L396-P554 HydrophobicContact CG-CG 4.28Å; V551-P554 PolarHBondContact N-O 3.03Å; V551-P554 WeakPolarHBondContact O-CD 3.48Å
555	T	78.7	Confident	86.4	Confident	21 Å²	21	27.4 Å²	27.4	13%	0.129	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.9	174.7	42.8	0	0	0	0	111.2	T412 L413 V549 Q550	T412-T555 HydrophobicContact CG2-CG2 3.44Å; T412-T555 VanDerWaalsContact CG2-CG2 3.44Å; L413-T555 WeakPolarHBondContact CA-OG1 3.41Å; V549-T555 WeakPolarHBondContact O-CA 3.25Å; Q550-T555 HydrophobicContact CB-CG2 3.72Å; Q550-T555 HydrophobicContact CG-CG2 3.7Å
556	L	86.1	Confident	86.8	Confident	23 Å²	23	24 Å²	24	12%	0.12	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	169.5	175.3	63.3	89.6	0	0	0	112.4	L394 P395 P548 V549 L558	L394-L556 HydrophobicContact CD2-CD1 4.33Å; L394-L556 HydrophobicContact CD2-CD2 4.15Å; P395-L556 HydrophobicContact CG-CD2 3.93Å; P548-L556 WeakPolarHBondContact CA-O 3.33Å; V549-L556 HydrophobicContact CG2-CD1 3.78Å; V549-L556 HydrophobicContact CG2-CG 3.98Å; V549-L556 PolarHBondContact N-O 2.97Å; V549-L556 PolarHBondContact O-N 2.77Å; L556-L558 HydrophobicContact CD1-CB 3.83Å; L556-L558 HydrophobicContact CD1-CD1 4.32Å
557	R	86.4	Confident	87.2	Confident	116 Å²	116	26.4 Å²	26.4	44%	0.438	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	113	167.2	-64.1	-178.3	-173.6	-86.4	-1	110.2	T391 L413 T546	T391-R557 PolarHBondContact N-O 3.35Å; L413-R557 HydrophobicContact CD2-CG 3.87Å; T546-R557 HydrophobicContact CG2-CB 3.88Å
558	L	86.5	Confident	87.5	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	121.7	-177.5	-177.1	67.9	0	0	0	109.1	L394 T546 V547 V549 L556 L563	L394-L558 HydrophobicContact CD2-CD1 4.13Å; T546-L558 CarbonylContact C-O 3.6Å; T546-L558 VanDerWaalsContact CA-O 3.23Å; T546-L558 WeakPolarHBondContact CA-O 3.45Å; V547-L558 PolarHBondContact N-O 3.15Å; V547-L558 PolarHBondContact O-N 3.17Å; V549-L558 HydrophobicContact CG1-CB 3.92Å; V549-L558 HydrophobicContact CG1-CD2 4.05Å; V549-L558 HydrophobicContact CG2-CB 3.86Å; V549-L558 HydrophobicContact CG2-CD2 4.46Å; L556-L558 HydrophobicContact CD1-CB 3.83Å; L556-L558 HydrophobicContact CD1-CD1 4.32Å; L558-L563 HydrophobicContact CD2-CD1 3.66Å; L558-L563 HydrophobicContact CD2-CD2 3.86Å; L558-L563 HydrophobicContact CD2-CG 4.19Å
559	A	87.1	Confident	87.8	Confident	6 Å²	6	31.9 Å²	31.9	5%	0.05	16%	0.159	C	C	.	.			trans	-61.9	159.2	173.3	0	0	0	0	0	111.3	T391 Q392 S561	T391-A559 PolarHBondContact O-N 2.77Å; T391-A559 VanDerWaalsContact O-N 3.13Å; Q392-A559 HydrophobicContact CG-CB 4.18Å; A559-S561 WeakPolarHBondContact O-CB 3.32Å; A559-S561 PolarHBondContact O-N 2.72Å; A559-S561 PolarHBondContact O-OG 3.32Å
560	P	90.3	Very high	88	Confident	18 Å²	18	35.7 Å²	35.7	12%	0.117	18%	0.176	C	C	.	.	S	Bend	trans	-47.9	116	178.7	-27.7	34	0	0	0	112.6	T543	T543-P560 WeakPolarHBondContact O-CA 3.37Å; T543-P560 WeakPolarHBondContact O-CB 3.41Å
561	S	91.1	Very high	88.4	Confident	4 Å²	4	35.4 Å²	35.4	3%	0.028	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	159.2	-169.9	-59.3	0	0	0	0	111.6	T383 T543 A559	T383-S561 WeakPolarHBondContact OG1-CA 3.48Å; T543-S561 PolarHBondContact N-O 3.26Å; T543-S561 PolarHBondContact O-N 2.97Å; T543-S561 PolarHBondContact OG1-N 3.39Å; T543-S561 PolarHBondContact OG1-O 2.82Å; A559-S561 WeakPolarHBondContact O-CB 3.32Å; A559-S561 PolarHBondContact O-N 2.72Å; A559-S561 PolarHBondContact O-OG 3.32Å
562	T	93.1	Very high	89.1	Confident	29 Å²	29	37 Å²	37	18%	0.178	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.7	166.6	-57.2	0	0	0	0	108.8	E381 V540 L541	E381-T562 PolarHBondContact N-O 3.22Å; E381-T562 PolarHBondContact O-N 2.78Å; V540-T562 HydrophobicContact CG1-CG2 3.82Å; L541-T562 CarbonylContact O-C 3.59Å; L541-T562 WeakPolarHBondContact O-CA 3.48Å
563	L	93.8	Very high	90.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	132.9	176.4	-57.5	101.5	0	0	0	110	L379 V380 L394 F403 V540 L541 T543 L558	L379-L563 CarbonylContact O-C 3.58Å; L379-L563 VanDerWaalsContact O-CA 3.28Å; L379-L563 WeakPolarHBondContact O-CA 3.41Å; V380-L563 HydrophobicContact CG2-CD2 3.97Å; V380-L563 HydrophobicContact CG2-CG 4.39Å; L394-L563 HydrophobicContact CD1-CD2 3.85Å; F403-L563 HydrophobicContact CZ-CD2 4.06Å; V540-L563 WeakPolarHBondContact CA-O 3.48Å; L541-L563 HydrophobicContact CB-CB 4.36Å; L541-L563 HydrophobicContact CB-CD1 4.49Å; L541-L563 HydrophobicContact CD2-CD1 3.9Å; L541-L563 HydrophobicContact CG-CD1 4.05Å; L541-L563 PolarHBondContact N-O 2.93Å; L541-L563 PolarHBondContact O-N 3.33Å; T543-L563 HydrophobicContact CG2-CD1 4.48Å; L558-L563 HydrophobicContact CD2-CD1 3.66Å; L558-L563 HydrophobicContact CD2-CD2 3.86Å; L558-L563 HydrophobicContact CD2-CG 4.19Å
564	R	95.4	Very high	91.6	Very high	99 Å²	99	34.6 Å²	34.6	37%	0.374	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.3	169.5	-74.6	-180	147	145.8	-6.1	109.9	L379 E381 V539 V540	L379-R564 HydrophobicContact CB-CB 4.2Å; L379-R564 PolarHBondContact N-O 2.83Å; L379-R564 PolarHBondContact O-N 3.23Å; E381-R564 IonicContact OE1-CZ 3.75Å; E381-R564 IonicContact OE1-NH1 3.21Å; E381-R564 PolarHBondContact OE1-NH1 2.97Å; E381-R564 IonicContact OE2-NH1 3.41Å; V539-R564 WeakPolarHBondContact O-CA 3.45Å; V540-R564 HydrophobicContact CG2-CG 4.36Å
565	I	96.8	Very high	92.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	126.2	174.1	-46.1	-178.4	0	0	0	108.3	W376 N377 L378 F399 F403 F479 I511 E538 V539	W376-I565 HydrophobicContact CB-CG2 4.2Å; W376-I565 HydrophobicContact CE3-CG2 4.03Å; N377-I565 WeakPolarHBondContact O-CA 3.24Å; L378-I565 HydrophobicContact CD2-CD1 4.19Å; L378-I565 HydrophobicContact CD2-CG1 3.85Å; F399-I565 HydrophobicContact CE1-CG2 3.68Å; F399-I565 HydrophobicContact CZ-CG2 3.88Å; F403-I565 HydrophobicContact CD1-CD1 3.81Å; F403-I565 HydrophobicContact CE1-CD1 4.32Å; F479-I565 HydrophobicContact CB-CD1 4.32Å; F479-I565 HydrophobicContact CD1-CD1 4.1Å; F479-I565 HydrophobicContact CD2-CD1 4.17Å; F479-I565 HydrophobicContact CG-CD1 3.92Å; I511-I565 HydrophobicContact CD1-CG2 3.48Å; I511-I565 VanDerWaalsContact CD1-CG2 3.48Å; E538-I565 WeakPolarHBondContact CA-O 3.16Å; V539-I565 HydrophobicContact CB-CB 3.94Å; V539-I565 HydrophobicContact CB-CD1 4.11Å; V539-I565 HydrophobicContact CB-CG1 4.11Å; V539-I565 HydrophobicContact CG1-CD1 4.36Å; V539-I565 HydrophobicContact CG2-CB 4.4Å; V539-I565 PolarHBondContact N-O 3.12Å; V539-I565 PolarHBondContact O-N 3.17Å
566	S	96.5	Very high	93.2	Very high	31 Å²	31	35.4 Å²	35.4	22%	0.217	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	152.1	-179.9	51.6	0	0	0	0	111	W376 N377 R568	W376-S566 CarbonylContact C-O 3.55Å; W376-S566 WeakPolarHBondContact CA-O 3.36Å; N377-S566 PolarHBondContact N-O 3.02Å; N377-S566 PolarHBondContact O-N 3.16Å; S566-R568 PolarHBondContact O-N 3.26Å
567	L	96.2	Very high	92.9	Very high	77 Å²	77	36.4 Å²	36.4	40%	0.403	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	129.1	176.8	-174.1	65.2	0	0	0	110.1	D374 W376	D374-L567 HydrophobicContact CB-CD1 3.91Å; W376-L567 HydrophobicContact CD2-CD1 4.38Å; W376-L567 HydrophobicContact CE3-CB 4.28Å; W376-L567 VanDerWaalsContact CE3-N 3.29Å; W376-L567 HydrophobicContact CH2-CB 4.23Å; W376-L567 HydrophobicContact CH2-CD1 4.39Å; W376-L567 HydrophobicContact CZ2-CD1 3.97Å; W376-L567 HydrophobicContact CZ3-CB 4.04Å
568	R	94.1	Very high	91.7	Very high	95 Å²	95	39.6 Å²	39.6	36%	0.358	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-64.4	178.9	-178.6	-174.7	-179.7	87.1	-0.2	110.9	D322 R375 N377 S566	D322-R568 IonicContact OD2-CZ 3.77Å; D322-R568 IonicContact OD2-NE 2.78Å; D322-R568 PolarHBondContact OD2-NE 3.29Å; D322-R568 IonicContact OD2-NH2 3.68Å; R375-R568 WeakPolarHBondContact O-CA 3.27Å; R375-R568 WeakPolarHBondContact O-CB 3.35Å; R375-R568 PolarHBondContact O-N 3.12Å; N377-R568 WeakPolarHBondContact ND2-CB 3.38Å; N377-R568 WeakPolarHBondContact OD1-CB 3.49Å; N377-R568 VanDerWaalsContact OD1-CD 3.3Å; N377-R568 WeakPolarHBondContact OD1-CD 3.37Å; N377-R568 VanDerWaalsContact OD1-CG 3.25Å; N377-R568 WeakPolarHBondContact OD1-CG 3.35Å; N377-R568 PolarHBondContact OD1-NH1 2.96Å; S566-R568 PolarHBondContact O-N 3.26Å
569	N	93.9	Very high	89.8	Confident	50 Å²	50	48.3 Å²	48.3	27%	0.267	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	176.9	-178.1	63.8	5.7	0	0	0	109.6	D322 R375	D322-N569 PolarHBondContact OD1-ND2 3.43Å; R375-N569 PolarHBondContact N-O 3.47Å; R375-N569 PolarHBondContact NH1-OD1 3.39Å
570	Q	95.3	Very high	87.4	Confident	81 Å²	81	58 Å²	58	38%	0.379	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	138.1	168.5	-70.4	-175.2	-36.8	0	0	109.9	Q372 L373 D374 D507	Q372-Q570 HydrophobicContact CB-CB 4.3Å; L373-Q570 CarbonylContact O-C 3.54Å; L373-Q570 WeakPolarHBondContact O-CA 3.47Å; D374-Q570 WeakPolarHBondContact OD1-CG 3.13Å; D374-Q570 PolarHBondContact OD1-NE2 3.16Å; D507-Q570 PolarHBondContact O-NE2 2.89Å
571	A	96.3	Very high	84.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139.8	173.5	0	0	0	0	0	111.2	L318 Q372 L373 R375 M573	L318-A571 HydrophobicContact CD1-CB 4.43Å; L318-A571 HydrophobicContact CD2-CB 3.8Å; Q372-A571 CarbonylContact C-O 3.59Å; L373-A571 PolarHBondContact N-O 3.19Å; L373-A571 PolarHBondContact O-N 2.99Å; R375-A571 HydrophobicContact CG-CB 4.41Å; A571-M573 PolarHBondContact O-N 2.84Å
572	N	97.5	Very high	81.6	Confident	36 Å²	36	66 Å²	66	19%	0.193	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	120.2	171.2	-67.5	-35.7	0	0	0	110	Q329 P331 V332 V370 Q372	Q329-N572 PolarHBondContact O-ND2 2.73Å; P331-N572 CarbonylContact C-O 3.6Å; P331-N572 VanDerWaalsContact CA-O 3.23Å; P331-N572 WeakPolarHBondContact CA-O 3.45Å; P331-N572 HydrophobicContact CB-CB 3.92Å; V332-N572 PolarHBondContact N-O 2.81Å; V370-N572 HydrophobicContact CG1-CB 3.98Å; Q372-N572 PolarHBondContact NE2-OD1 2.86Å; Q372-N572 PolarHBondContact OE1-OD1 2.93Å
573	M	97.8	Very high	78.5	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	150.3	176.6	-60.1	-56.9	-68.3	0	0	110.6	V314 L318 V332 V334 L343 L347 V370 V371 L373 A571	V314-M573 HydrophobicContact CG1-CE 3.96Å; L318-M573 HydrophobicContact CD1-SD 4.31Å; L318-M573 HydrophobicContact CD2-SD 4.11Å; V332-M573 HydrophobicContact CB-CE 4.16Å; V332-M573 HydrophobicContact CB-SD 4Å; V332-M573 HydrophobicContact CG1-CE 4.42Å; V332-M573 CarbonylContact O-C 3.56Å; V332-M573 WeakPolarHBondContact O-CA 3.35Å; V332-M573 WeakPolarHBondContact O-CE 3.16Å; V334-M573 HydrophobicContact CG2-CE 4.06Å; L343-M573 HydrophobicContact CD2-CE 4.13Å; L347-M573 HydrophobicContact CD1-CB 3.93Å; L347-M573 HydrophobicContact CD1-CE 3.66Å; L347-M573 HydrophobicContact CD1-CG 4.3Å; L347-M573 HydrophobicContact CD2-CB 4.21Å; V370-M573 CarbonylContact C-O 3.56Å; V370-M573 VanDerWaalsContact CA-O 3.29Å; V370-M573 WeakPolarHBondContact CA-O 3.03Å; V371-M573 HydrophobicContact CG2-CB 4.02Å; V371-M573 PolarHBondContact N-O 2.88Å; V371-M573 PolarHBondContact O-N 3.38Å; L373-M573 HydrophobicContact CB-CG 3.52Å; L373-M573 HydrophobicContact CD2-CE 4.49Å; L373-M573 HydrophobicContact CD2-CG 3.91Å; L373-M573 HydrophobicContact CD2-SD 4.13Å; L373-M573 HydrophobicContact CG-CG 4.37Å; A571-M573 PolarHBondContact O-N 2.84Å
574	V	97.7	Very high	75.4	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.5	171.3	-175.6	0	0	0	0	108.6	P331 V332 A333 W349 S369	P331-V574 HydrophobicContact CB-CG2 3.77Å; P331-V574 HydrophobicContact CG-CG2 4.19Å; V332-V574 PolarHBondContact O-N 3.11Å; A333-V574 HydrophobicContact CB-CB 3.78Å; A333-V574 HydrophobicContact CB-CG1 4.34Å; A333-V574 HydrophobicContact CB-CG2 4.04Å; W349-V574 HydrophobicContact CZ2-CB 4.45Å; W349-V574 HydrophobicContact CZ2-CG1 4.05Å; W349-V574 PolarHBondContact NE1-O 2.96Å; S369-V574 CarbonylContact O-C 3.55Å; S369-V574 WeakPolarHBondContact O-CA 3.34Å
575	Q	95.4	Very high	72.1	Confident	46 Å²	46	79.7 Å²	79.7	22%	0.215	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.9	170.9	-167.8	178.6	47.6	0	0	109.5	L347 G368 S369 V371 S577	L347-Q575 HydrophobicContact CD2-CB 4.5Å; L347-Q575 WeakPolarHBondContact O-CG 3.47Å; G368-Q575 VanDerWaalsContact CA-O 3.25Å; G368-Q575 WeakPolarHBondContact CA-O 3.19Å; S369-Q575 PolarHBondContact N-O 3.43Å; S369-Q575 PolarHBondContact O-N 3.48Å; V371-Q575 HydrophobicContact CG1-CB 3.88Å; V371-Q575 HydrophobicContact CG2-CB 4.04Å; Q575-S577 PolarHBondContact O-N 3.48Å
576	K	91	Very high	69	Low	32 Å²	32	87.6 Å²	87.6	14%	0.139	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-67.2	123.6	176.5	-177.7	169.3	175	173.9	0	108.5	L347 N348 W349 E356 H364 K578	L347-K576 PolarHBondContact O-N 3.03Å; N348-K576 HydrophobicContact CB-CB 4.25Å; N348-K576 WeakPolarHBondContact O-CD 3.25Å; W349-K576 HydrophobicContact CD2-CB 3.93Å; W349-K576 HydrophobicContact CD2-CD 4.32Å; W349-K576 HydrophobicContact CE3-CB 4.37Å; W349-K576 HydrophobicContact CE3-CD 4.02Å; W349-K576 HydrophobicContact CG-CB 4.21Å; W349-K576 HydrophobicContact CZ2-CB 4.23Å; W349-K576 HydrophobicContact CZ3-CD 4.36Å; E356-K576 IonicContact OE1-NZ 3.57Å; E356-K576 IonicContact OE2-NZ 2.7Å; H364-K576 HydrophobicContact CB-CD 4.47Å; H364-K576 HydrophobicContact CB-CG 4.26Å; H364-K576 WeakPolarHBondContact CD2-CE 3.44Å; H364-K576 WeakPolarHBondContact NE2-CE 3.26Å; K576-K578 PolarHBondContact O-N 3.26Å
577	S	78.1	Confident	65.8	Low	44 Å²	44	93.5 Å²	93.5	31%	0.308	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-61.4	137.3	175.9	-177.1	0	0	0	0	109.8	Q575 R579	Q575-S577 PolarHBondContact O-N 3.48Å; S577-R579 PolarHBondContact O-N 2.86Å; S577-R579 VanDerWaalsContact O-N 3.15Å; S577-R579 PolarHBondContact OG-N 3.23Å
578	K	60.9	Low	62.5	Low	184 Å²	184	96.4 Å²	96.4	80%	0.8	49%	0.488	S	S	*	.			trans	-72.2	4.3	174.1	-64.8	-176	178.6	-179.4	0	112.9	K576	K576-K578 PolarHBondContact O-N 3.26Å
579	R	47.3	Very low	59.6	Low	182 Å²	182	96.4 Å²	96.4	69%	0.687	50%	0.501	S	S	*	.			trans	-66.8	139.1	179.8	-78.6	-173	177.9	-168.4	-1	113.1	S577	S577-R579 PolarHBondContact O-N 2.86Å; S577-R579 VanDerWaalsContact O-N 3.15Å; S577-R579 PolarHBondContact OG-N 3.23Å
580	R	37.9	Very low	56.7	Low	209 Å²	209	101.9 Å²	101.9	79%	0.789	53%	0.525	S	S	*	.			trans	-45.2	135.7	-179.2	-136.4	174.1	-173.2	176	5.6	111.9	S582	R580-S582 PolarHBondContact O-N 3.21Å
581	T	30.1	Very low	53.9	Low	93 Å²	93	101.6 Å²	101.6	57%	0.571	54%	0.536	S	S	*	.	S	Bend	trans	-70.3	93.5	172.4	-53.3	0	0	0	0	109.4	K360	K360-T581 HydrophobicContact CD-CG2 3.8Å; K360-T581 WeakPolarHBondContact CE-OG1 3.19Å; K360-T581 PolarHBondContact NZ-OG1 3.15Å
582	S	27.9	Very low	51.3	Low	98 Å²	98	105.9 Å²	105.9	69%	0.685	56%	0.562	S	S	*	*			trans	-152	137.6	156.2	53.4	0	0	0	0	110.1	R580	R580-S582 PolarHBondContact O-N 3.21Å
583	V	29	Very low	48.9	Very low	130 Å²	130	107.6 Å²	107.6	79%	0.788	58%	0.575	S	S	*	*			trans	-51.9	142.3	178.5	-179.6	0	0	0	0	110.4	L585	V583-L585 PolarHBondContact O-N 3.43Å
584	P	27.3	Very low	46.6	Very low	121 Å²	121	115 Å²	115	79%	0.786	62%	0.615	S	S	*	*			trans	-67.9	110.3	178.5	22.1	-24.9	0	0	0	110.2
585	L	27.3	Very low	45	Very low	165 Å²	165	121.5 Å²	121.5	86%	0.864	64%	0.639	S	S	*	*			trans	-79	132.9	155.1	-87.8	155.3	0	0	0	107.3	V583 N587	V583-L585 PolarHBondContact O-N 3.43Å; L585-N587 PolarHBondContact O-N 3.49Å
586	L	32.4	Very low	44.1	Very low	165 Å²	165	120 Å²	120	86%	0.864	63%	0.633	S	S	*	*	S	Bend	trans	-49.3	135.9	170.9	-80.6	133.5	0	0	0	110.5
587	N	28.3	Very low	43.7	Very low	155 Å²	155	125.6 Å²	125.6	83%	0.829	65%	0.653	S	S	*	*			trans	99.8	86.6	178.1	-58	-10.8	0	0	0	114.8	L585	L585-N587 PolarHBondContact O-N 3.49Å
588	D	27.1	Very low	44.1	Very low	138 Å²	138	123.5 Å²	123.5	74%	0.738	64%	0.639	S	S	*	*			trans	-77.2	131.8	153.9	-163.2	0.7	0	0	0	107.4	H590	D588-H590 PolarHBondContact OD1-N 2.89Å
589	P	33.6	Very low	45.2	Very low	96 Å²	96	119.8 Å²	119.8	62%	0.623	62%	0.619	S	S	*	*				-138.7	126.6	98.5	35.1	-20.1	0	0	0	112.3
590	H	32.7	Very low	47.2	Very low	164 Å²	164	111.1 Å²	111.1	76%	0.759	59%	0.587	S	S	*	*				160.8	120	115.8	-77.8	-63.4	0	0	0	109.9	D588	D588-H590 PolarHBondContact OD1-N 2.89Å
591	A	36.3	Very low	49.7	Very low	75 Å²	75	101.2 Å²	101.2	62%	0.62	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-67.1	128.7	167.9	0	0	0	0	0	109.4	P593	A591-P593 WeakPolarHBondContact O-CD 3.22Å
592	V	41.3	Very low	52.5	Low	91 Å²	91	98 Å²	98	55%	0.552	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-65.5	122.1	171.9	-178.4	0	0	0	0	108.4	T708	V592-T708 HydrophobicContact CG1-CG2 3.91Å
593	P	47.3	Very low	55.4	Low	72 Å²	72	93.3 Å²	93.3	47%	0.468	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-67	149.5	179.2	-19.9	32.3	0	0	0	113.1	A591 R595 L596	A591-P593 WeakPolarHBondContact O-CD 3.22Å; P593-R595 WeakPolarHBondContact CB-O 3.49Å; P593-R595 PolarHBondContact O-N 2.84Å; P593-R595 VanDerWaalsContact O-N 3.17Å; P593-L596 HydrophobicContact CG-CD2 4.35Å
594	D	50.4	Low	58.1	Low	156 Å²	156	88 Å²	88	83%	0.834	46%	0.463	S	S	*	.	S	Bend	trans	-58.8	-26.4	175.2	-66.9	-39.5	0	0	0	112.8	G632	D594-G632 PolarHBondContact O-N 3.5Å
595	R	63.8	Low	60.8	Low	135 Å²	135	84.8 Å²	84.8	51%	0.509	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129.6	172.7	-72.1	-175.6	161.1	-161.6	-8.8	110.2	P593 V629 V630 E739	P593-R595 WeakPolarHBondContact CB-O 3.49Å; P593-R595 PolarHBondContact O-N 2.84Å; P593-R595 VanDerWaalsContact O-N 3.17Å; R595-V629 HydrophobicContact CB-CG1 4.28Å; R595-V630 CarbonylContact C-O 3.53Å; R595-V630 WeakPolarHBondContact CA-O 3.45Å; R595-E739 IonicContact NH2-OE2 3.95Å; R595-E739 PolarHBondContact NH2-OE2 2.87Å
596	L	76.4	Confident	63.4	Low	14 Å²	14	84.5 Å²	84.5	7%	0.073	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	128.5	176.3	-62	165.6	0	0	0	109.4	P593 L598 V629 V630 T708	P593-L596 HydrophobicContact CG-CD2 4.35Å; L596-L598 HydrophobicContact CB-CD1 4.45Å; L596-L598 HydrophobicContact CB-CD2 4.13Å; L596-L598 HydrophobicContact CB-CG 4.09Å; L596-V629 CarbonylContact O-C 3.5Å; L596-V629 WeakPolarHBondContact O-CA 3.36Å; L596-V630 HydrophobicContact CB-CG2 4.05Å; L596-V630 HydrophobicContact CD1-CG2 4.48Å; L596-V630 PolarHBondContact N-O 2.87Å; L596-V630 PolarHBondContact O-N 2.96Å; L596-T708 HydrophobicContact CD1-CG2 3.34Å; L596-T708 HydrophobicContact CD2-CG2 4.34Å; L596-T708 HydrophobicContact CG-CG2 4.41Å
597	R	82.1	Confident	65.7	Low	150 Å²	150	79 Å²	79	57%	0.566	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	104.8	173.1	-176.5	177.7	-179.4	-163.2	-1.4	107.9	I627 V629	R597-I627 HydrophobicContact CG-CG2 3.54Å; R597-V629 HydrophobicContact CB-CG2 4.45Å; R597-V629 HydrophobicContact CG-CG2 4.16Å
598	L	85.9	Confident	68.3	Low	1 Å²	1	72.3 Å²	72.3	1%	0.005	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.1	-169.5	-56.9	167.9	0	0	0	110.4	L596 I627 V628 V630 V707 D713 V715	L596-L598 HydrophobicContact CB-CD1 4.45Å; L596-L598 HydrophobicContact CB-CD2 4.13Å; L596-L598 HydrophobicContact CB-CG 4.09Å; L598-I627 WeakPolarHBondContact O-CA 3.24Å; L598-V628 HydrophobicContact CB-CG2 3.94Å; L598-V628 HydrophobicContact CD1-CG2 4.36Å; L598-V628 PolarHBondContact N-O 2.99Å; L598-V628 PolarHBondContact O-N 2.72Å; L598-V630 HydrophobicContact CD1-CG2 3.5Å; L598-V630 HydrophobicContact CG-CG2 4.36Å; L598-V707 HydrophobicContact CD1-CB 4.35Å; L598-V707 HydrophobicContact CD1-CG1 3.2Å; L598-V707 HydrophobicContact CD2-CG1 4.33Å; L598-V707 HydrophobicContact CG-CG1 4.38Å; L598-D713 WeakPolarHBondContact CA-O 3.42Å; L598-V715 HydrophobicContact CB-CG1 4.38Å
599	R	85.1	Confident	70.8	Confident	105 Å²	105	69.8 Å²	69.8	40%	0.396	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	122.6	168.3	179.1	178.4	173.4	156.6	-0.6	109.2	N601 D713 E714 V715	R599-N601 PolarHBondContact NE-OD1 3.38Å; R599-N601 VanDerWaalsContact NE-OD1 3.08Å; R599-D713 PolarHBondContact N-O 3.18Å; R599-E714 HydrophobicContact CB-CG 4.32Å; R599-E714 IonicContact NE-OE1 2.99Å; R599-E714 CarbonylContact O-C 3.49Å; R599-E714 WeakPolarHBondContact O-CA 3.39Å; R599-V715 PolarHBondContact O-N 2.94Å
600	V	89.8	Confident	73.1	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	121.9	177.1	-172.8	0	0	0	0	108.6	V625 G626 V628 I643 L646 V715 I717	V600-V625 HydrophobicContact CB-CB 4.16Å; V600-V625 HydrophobicContact CG1-CB 4.03Å; V600-V625 HydrophobicContact CG1-CG2 4.34Å; V600-V625 PolarHBondContact O-N 3.12Å; V600-G626 PolarHBondContact N-O 2.78Å; V600-V628 HydrophobicContact CG2-CG1 4.08Å; V600-V628 HydrophobicContact CG2-CG2 3.91Å; V600-I643 HydrophobicContact CG1-CD1 4.09Å; V600-I643 HydrophobicContact CG1-CG1 4.44Å; V600-I643 HydrophobicContact CG1-CG2 4.17Å; V600-I643 HydrophobicContact CG2-CD1 4.03Å; V600-I643 HydrophobicContact CG2-CG1 3.91Å; V600-L646 HydrophobicContact CG2-CD2 4.48Å; V600-V715 CarbonylContact C-O 3.52Å; V600-V715 WeakPolarHBondContact CA-O 3.43Å; V600-V715 HydrophobicContact CB-CG1 4.05Å; V600-V715 HydrophobicContact CG1-CG1 4.21Å; V600-V715 HydrophobicContact CG2-CG1 3.7Å; V600-I717 HydrophobicContact CG1-CD1 4Å; V600-I717 HydrophobicContact CG1-CG1 4.36Å; V600-I717 HydrophobicContact CG1-CG2 4.35Å
601	N	90.3	Very high	75.3	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.7	176.2	-61.2	-58.8	0	0	0	109.6	R599 I623 P624 E714 V715 F716 I717	R599-N601 PolarHBondContact NE-OD1 3.38Å; R599-N601 VanDerWaalsContact NE-OD1 3.08Å; N601-I623 CarbonylContact C-O 3.59Å; N601-I623 WeakPolarHBondContact CA-O 3.16Å; N601-P624 WeakPolarHBondContact OD1-CA 3.22Å; N601-E714 PolarHBondContact ND2-OE1 3.41Å; N601-E714 VanDerWaalsContact ND2-OE1 3.14Å; N601-V715 PolarHBondContact N-O 2.77Å; N601-F716 HydrophobicContact CB-CD1 3.74Å; N601-F716 HydrophobicContact CB-CE1 3.74Å; N601-F716 CarbonylContact O-C 3.55Å; N601-F716 VanDerWaalsContact O-CA 3.3Å; N601-F716 WeakPolarHBondContact O-CA 3.19Å; N601-I717 PolarHBondContact O-N 3.32Å
602	R	88.6	Confident	76.8	Confident	26 Å²	26	70.6 Å²	70.6	10%	0.098	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	145	176.4	69.2	178	-174.3	-175.7	7.3	111.6	S622 I623 V625 S677 L679 I717	R602-S622 WeakPolarHBondContact O-CA 3.35Å; R602-I623 HydrophobicContact CG-CB 3.78Å; R602-I623 HydrophobicContact CG-CG2 4.41Å; R602-I623 WeakPolarHBondContact CG-O 3.5Å; R602-I623 PolarHBondContact N-O 3.36Å; R602-I623 PolarHBondContact O-N 3.16Å; R602-V625 HydrophobicContact CB-CG2 3.67Å; R602-V625 HydrophobicContact CG-CG2 3.79Å; R602-S677 PolarHBondContact NH1-O 3.46Å; R602-S677 PolarHBondContact NH1-OG 3.01Å; R602-S677 PolarHBondContact NH2-OG 2.86Å; R602-L679 HydrophobicContact CB-CD2 4.19Å; R602-I717 CarbonylContact C-O 3.53Å; R602-I717 WeakPolarHBondContact CA-O 3.42Å; R602-I717 HydrophobicContact CB-CD1 4.22Å; R602-I717 HydrophobicContact CB-CG1 3.84Å
603	I	89.6	Confident	77.9	Confident	0 Å²	0	71 Å²	71	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.4	172.9	-64.6	169.3	0	0	0	106.9	Y608 L618 L686 F694 F716 I717 L718 D719	I603-Y608 HydrophobicContact CG2-CD2 4.46Å; I603-L618 HydrophobicContact CD1-CB 4.15Å; I603-L618 HydrophobicContact CG2-CD2 3.8Å; I603-L686 HydrophobicContact CB-CD1 4.48Å; I603-L686 HydrophobicContact CD1-CD1 3.9Å; I603-F694 HydrophobicContact CD1-CD2 4.47Å; I603-F694 HydrophobicContact CD1-CE2 4.14Å; I603-F716 HydrophobicContact CD1-CB 4.45Å; I603-F716 HydrophobicContact CD1-CD1 3.88Å; I603-F716 HydrophobicContact CG1-CD1 4.48Å; I603-I717 PolarHBondContact N-O 3.5Å; I603-L718 HydrophobicContact CG2-CD1 4.44Å; I603-L718 WeakPolarHBondContact O-CA 3.27Å; I603-D719 PolarHBondContact O-N 2.86Å
604	S	85.5	Confident	79.2	Confident	18 Å²	18	70.7 Å²	70.7	13%	0.126	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	147.7	176.1	69.7	0	0	0	0	111.5	Q606 E607 Y608	S604-Q606 PolarHBondContact O-N 3.34Å; S604-E607 PolarHBondContact O-N 2.95Å; S604-E607 VanDerWaalsContact O-N 3.12Å; S604-E607 WeakPolarHBondContact OG-CB 3.47Å; S604-E607 VanDerWaalsContact OG-CD 3.22Å; S604-E607 WeakPolarHBondContact OG-CG 3.46Å; S604-E607 PolarHBondContact OG-N 3.39Å; S604-E607 PolarHBondContact OG-OE2 3.12Å; S604-Y608 WeakPolarHBondContact O-CB 3.45Å; S604-Y608 PolarHBondContact O-N 3.26Å
605	L	83.6	Confident	80.6	Confident	54 Å²	54	65.7 Å²	65.7	28%	0.283	29%	0.286	S	S	.	.	H	α-helix	trans	-56.1	-38	176	-175	66.5	0	0	0	112.6	E607 Y608 D609 L718 D719	L605-E607 VanDerWaalsContact C-N 3.33Å; L605-E607 PolarHBondContact O-N 3.04Å; L605-Y608 WeakPolarHBondContact O-CB 3.46Å; L605-Y608 PolarHBondContact O-N 2.98Å; L605-D609 PolarHBondContact O-N 3.49Å; L605-L718 HydrophobicContact CD1-CD1 4.38Å; L605-L718 HydrophobicContact CD1-CD2 3.92Å; L605-L718 HydrophobicContact CD1-CG 4.35Å; L605-D719 PolarHBondContact N-O 3.3Å
606	Q	81.4	Confident	81.4	Confident	159 Å²	159	66.7 Å²	66.7	74%	0.743	30%	0.297	S	S	*	.	H	α-helix	trans	-62.1	-40	178.1	-170.4	178.5	23.1	0	0	112.4	S604 R610	S604-Q606 PolarHBondContact O-N 3.34Å; Q606-R610 WeakPolarHBondContact O-CB 3.09Å; Q606-R610 PolarHBondContact O-N 2.92Å; Q606-R610 VanDerWaalsContact O-N 3.08Å
607	E	81.5	Confident	81.5	Confident	49 Å²	49	73.2 Å²	73.2	23%	0.229	32%	0.32	C	S	.	.	H	α-helix	trans	-75.3	-37.9	178.4	-73.4	169.5	139.6	0	0	112.4	S604 L605 R610 L611 I621	S604-E607 PolarHBondContact O-N 2.95Å; S604-E607 VanDerWaalsContact O-N 3.12Å; S604-E607 WeakPolarHBondContact OG-CB 3.47Å; S604-E607 VanDerWaalsContact OG-CD 3.22Å; S604-E607 WeakPolarHBondContact OG-CG 3.46Å; S604-E607 PolarHBondContact OG-N 3.39Å; S604-E607 PolarHBondContact OG-OE2 3.12Å; L605-E607 VanDerWaalsContact C-N 3.33Å; L605-E607 PolarHBondContact O-N 3.04Å; E607-R610 PolarHBondContact O-N 3.42Å; E607-L611 WeakPolarHBondContact O-CB 3.33Å; E607-L611 PolarHBondContact O-N 3.4Å; E607-I621 HydrophobicContact CB-CD1 3.51Å; E607-I621 HydrophobicContact CG-CD1 3.82Å
608	Y	82.1	Confident	81.5	Confident	14 Å²	14	66 Å²	66	6%	0.055	29%	0.294	C	S	.	.	H	α-helix	trans	-57.6	-46.9	174.5	-172.2	-103.1	0	0	0	112.1	I603 S604 L605 Y613 L618 L686 F694 L718	I603-Y608 HydrophobicContact CG2-CD2 4.46Å; S604-Y608 WeakPolarHBondContact O-CB 3.45Å; S604-Y608 PolarHBondContact O-N 3.26Å; L605-Y608 WeakPolarHBondContact O-CB 3.46Å; L605-Y608 PolarHBondContact O-N 2.98Å; Y608-Y613 HydrophobicContact CD1-CD1 4.37Å; Y608-Y613 HydrophobicContact CD1-CE1 4.13Å; Y608-Y613 AromaticContact CE1-CD1 3.64Å; Y608-Y613 HydrophobicContact CE1-CD1 3.64Å; Y608-Y613 AromaticContact CE1-CE1 3.41Å; Y608-Y613 HydrophobicContact CE1-CE1 3.41Å; Y608-Y613 VanDerWaalsContact CE1-CE1 3.41Å; Y608-Y613 HydrophobicContact CE2-CD1 4.3Å; Y608-Y613 AromaticContact CZ-CD1 3.58Å; Y608-Y613 AromaticContact CZ-CE1 3.83Å; Y608-L618 HydrophobicContact CD2-CD1 3.91Å; Y608-L618 HydrophobicContact CD2-CD2 4.44Å; Y608-L618 HydrophobicContact CE2-CD1 4.31Å; Y608-L686 HydrophobicContact CD2-CD1 4.25Å; Y608-L686 HydrophobicContact CE2-CD1 4.07Å; Y608-L686 HydrophobicContact CE2-CD2 3.75Å; Y608-F694 HydrophobicContact CE2-CB 3.88Å; Y608-F694 PolarHBondContact OH-O 3.05Å; Y608-F694 VanDerWaalsContact OH-O 3.06Å; Y608-L718 HydrophobicContact CD1-CD1 4.08Å; Y608-L718 HydrophobicContact CD1-CD2 4.1Å; Y608-L718 HydrophobicContact CD2-CD1 3.94Å; Y608-L718 HydrophobicContact CE1-CD2 4.19Å; Y608-L718 HydrophobicContact CG-CD1 3.6Å; Y608-L718 HydrophobicContact CG-CD2 4.41Å
609	D	80.6	Confident	81.4	Confident	86 Å²	86	72.5 Å²	72.5	46%	0.46	32%	0.318	S	S	.	.	H	α-helix	trans	-71.9	-42.3	177.5	-70.8	-18	0	0	0	112.1	L605 L611 Q612	L605-D609 PolarHBondContact O-N 3.49Å; D609-L611 VanDerWaalsContact C-N 3.32Å; D609-L611 PolarHBondContact O-N 3.23Å; D609-Q612 PolarHBondContact O-N 3.25Å
610	R	81	Confident	81.3	Confident	170 Å²	170	74 Å²	74	64%	0.642	33%	0.334	S	S	*	.	H	α-helix	trans	-62.1	-38.2	-178.3	-175.1	-176.8	70.5	170.1	-2.9	112.6	Q606 E607 Q612	Q606-R610 WeakPolarHBondContact O-CB 3.09Å; Q606-R610 PolarHBondContact O-N 2.92Å; Q606-R610 VanDerWaalsContact O-N 3.08Å; E607-R610 PolarHBondContact O-N 3.42Å; R610-Q612 VanDerWaalsContact C-N 3.27Å; R610-Q612 PolarHBondContact O-N 3.35Å
611	L	78.3	Confident	80.9	Confident	23 Å²	23	76.6 Å²	76.6	12%	0.12	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	9.6	-177.8	-66.3	178.7	0	0	0	113.3	E607 D609 Y613 D614 R617 L618 I621	E607-L611 WeakPolarHBondContact O-CB 3.33Å; E607-L611 PolarHBondContact O-N 3.4Å; D609-L611 VanDerWaalsContact C-N 3.32Å; D609-L611 PolarHBondContact O-N 3.23Å; L611-Y613 PolarHBondContact O-N 3.45Å; L611-Y613 VanDerWaalsContact O-N 3.12Å; L611-D614 VanDerWaalsContact O-CB 3.27Å; L611-D614 WeakPolarHBondContact O-CB 3.27Å; L611-D614 PolarHBondContact O-N 3.06Å; L611-R617 HydrophobicContact CD1-CB 3.98Å; L611-R617 HydrophobicContact CD2-CB 4.46Å; L611-L618 HydrophobicContact CB-CD2 4.12Å; L611-L618 HydrophobicContact CB-CG 4.14Å; L611-L618 HydrophobicContact CD1-CD2 3.84Å; L611-L618 HydrophobicContact CD1-CG 4.08Å; L611-L618 HydrophobicContact CG-CD2 4.5Å; L611-I621 HydrophobicContact CD1-CD1 3.44Å; L611-I621 VanDerWaalsContact CD1-CD1 3.44Å; L611-I621 HydrophobicContact CD1-CG1 4.22Å
612	Q	68.6	Low	80.6	Confident	159 Å²	159	77.6 Å²	77.6	74%	0.743	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	43	174.9	-60.3	-173.6	-14.6	0	0	112.9	D609 R610 D614	D609-Q612 PolarHBondContact O-N 3.25Å; R610-Q612 VanDerWaalsContact C-N 3.27Å; R610-Q612 PolarHBondContact O-N 3.35Å; Q612-D614 PolarHBondContact O-N 3.06Å
613	Y	65.3	Low	80.3	Confident	98 Å²	98	79.9 Å²	79.9	38%	0.384	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	11.8	177.3	-40.9	-84.8	0	0	0	115.5	Y608 L611 K615 R693	Y608-Y613 HydrophobicContact CD1-CD1 4.37Å; Y608-Y613 HydrophobicContact CD1-CE1 4.13Å; Y608-Y613 AromaticContact CE1-CD1 3.64Å; Y608-Y613 HydrophobicContact CE1-CD1 3.64Å; Y608-Y613 AromaticContact CE1-CE1 3.41Å; Y608-Y613 HydrophobicContact CE1-CE1 3.41Å; Y608-Y613 VanDerWaalsContact CE1-CE1 3.41Å; Y608-Y613 HydrophobicContact CE2-CD1 4.3Å; Y608-Y613 AromaticContact CZ-CD1 3.58Å; Y608-Y613 AromaticContact CZ-CE1 3.83Å; L611-Y613 PolarHBondContact O-N 3.45Å; L611-Y613 VanDerWaalsContact O-N 3.12Å; Y613-K615 PolarHBondContact O-N 3.27Å; Y613-R693 WeakPolarHBondContact O-CA 3.44Å; Y613-R693 WeakPolarHBondContact O-CG 3.42Å
614	D	74.1	Confident	79.9	Confident	67 Å²	67	82 Å²	82	36%	0.358	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-62.3	107.3	176.8	-174.8	-33.4	0	0	0	111	L611 Q612 E616 R617 L618	L611-D614 VanDerWaalsContact O-CB 3.27Å; L611-D614 WeakPolarHBondContact O-CB 3.27Å; L611-D614 PolarHBondContact O-N 3.06Å; Q612-D614 PolarHBondContact O-N 3.06Å; D614-E616 PolarHBondContact O-N 3.41Å; D614-E616 PolarHBondContact OD1-N 3.42Å; D614-R617 HydrophobicContact CB-CB 4.33Å; D614-R617 HydrophobicContact CB-CG 4.44Å; D614-R617 PolarHBondContact O-N 3.36Å; D614-R617 PolarHBondContact OD1-N 3.14Å; D614-R617 WeakPolarHBondContact OD2-CD 3.31Å; D614-L618 VanDerWaalsContact O-CB 3.25Å; D614-L618 WeakPolarHBondContact O-CB 3.34Å; D614-L618 WeakPolarHBondContact O-CD1 3.4Å; D614-L618 WeakPolarHBondContact O-CG 3.43Å; D614-L618 PolarHBondContact O-N 3.39Å
615	K	78.8	Confident	79.7	Confident	50 Å²	50	81.3 Å²	81.3	22%	0.217	38%	0.376	C	S	.	.	H	α-helix	trans	-63.2	-40.4	-170.8	-173.3	-177.7	178.8	-176	0	113.5	Y613 R619 S688 S690 F694	Y613-K615 PolarHBondContact O-N 3.27Å; K615-R619 WeakPolarHBondContact O-CB 3.26Å; K615-R619 PolarHBondContact O-N 3.32Å; K615-R619 VanDerWaalsContact O-N 3.08Å; K615-S688 WeakPolarHBondContact CE-O 3.19Å; K615-S688 PolarHBondContact NZ-O 2.92Å; K615-S690 PolarHBondContact NZ-O 3.24Å; K615-F694 HydrophobicContact CB-CD2 4.48Å; K615-F694 HydrophobicContact CB-CE2 4.46Å; K615-F694 HydrophobicContact CG-CD2 4.18Å; K615-F694 HydrophobicContact CG-CE2 3.9Å; K615-F694 HydrophobicContact CG-CZ 4.1Å
616	E	80.4	Confident	79.5	Confident	156 Å²	156	78.8 Å²	78.8	73%	0.729	36%	0.363	S	S	*	.	H	α-helix	trans	-70.1	-46.2	-177.5	-67.4	-170.6	168.7	0	0	110.1	D614 L618 R619 D620	D614-E616 PolarHBondContact O-N 3.41Å; D614-E616 PolarHBondContact OD1-N 3.42Å; E616-L618 VanDerWaalsContact C-N 3.34Å; E616-L618 PolarHBondContact O-N 2.81Å; E616-R619 PolarHBondContact O-N 2.84Å; E616-D620 PolarHBondContact O-N 3.3Å; E616-D620 VanDerWaalsContact O-N 3.14Å
617	R	79.6	Confident	79.5	Confident	151 Å²	151	71.9 Å²	71.9	57%	0.57	33%	0.331	S	S	*	.	H	α-helix	trans	-68	-34.9	-179.9	-58.2	-176	84.5	179.9	7	112.3	L611 D614 D620 I621	L611-R617 HydrophobicContact CD1-CB 3.98Å; L611-R617 HydrophobicContact CD2-CB 4.46Å; D614-R617 HydrophobicContact CB-CB 4.33Å; D614-R617 HydrophobicContact CB-CG 4.44Å; D614-R617 PolarHBondContact O-N 3.36Å; D614-R617 PolarHBondContact OD1-N 3.14Å; D614-R617 WeakPolarHBondContact OD2-CD 3.31Å; R617-D620 PolarHBondContact O-N 3.33Å; R617-I621 WeakPolarHBondContact O-CG1 3.48Å; R617-I621 PolarHBondContact O-N 2.82Å
618	L	82.3	Confident	79.6	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-69.1	-35.4	175.9	-77.5	169.1	0	0	0	112.6	I603 Y608 L611 D614 E616 I621 S622 F694	I603-L618 HydrophobicContact CD1-CB 4.15Å; I603-L618 HydrophobicContact CG2-CD2 3.8Å; Y608-L618 HydrophobicContact CD2-CD1 3.91Å; Y608-L618 HydrophobicContact CD2-CD2 4.44Å; Y608-L618 HydrophobicContact CE2-CD1 4.31Å; L611-L618 HydrophobicContact CB-CD2 4.12Å; L611-L618 HydrophobicContact CB-CG 4.14Å; L611-L618 HydrophobicContact CD1-CD2 3.84Å; L611-L618 HydrophobicContact CD1-CG 4.08Å; L611-L618 HydrophobicContact CG-CD2 4.5Å; D614-L618 VanDerWaalsContact O-CB 3.25Å; D614-L618 WeakPolarHBondContact O-CB 3.34Å; D614-L618 WeakPolarHBondContact O-CD1 3.4Å; D614-L618 WeakPolarHBondContact O-CG 3.43Å; D614-L618 PolarHBondContact O-N 3.39Å; E616-L618 VanDerWaalsContact C-N 3.34Å; E616-L618 PolarHBondContact O-N 2.81Å; L618-I621 HydrophobicContact CD2-CD1 4.2Å; L618-I621 WeakPolarHBondContact O-CG1 3.07Å; L618-S622 PolarHBondContact O-N 3.22Å; L618-F694 HydrophobicContact CB-CD2 3.88Å; L618-F694 HydrophobicContact CB-CE2 3.68Å; L618-F694 HydrophobicContact CD1-CD2 3.89Å
619	R	84.1	Confident	79.6	Confident	136 Å²	136	70.8 Å²	70.8	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-65	-41.7	173.8	-171.6	171.9	-172.4	-174.5	1.7	111.4	K615 E616 I621 S622 E714 F716	K615-R619 WeakPolarHBondContact O-CB 3.26Å; K615-R619 PolarHBondContact O-N 3.32Å; K615-R619 VanDerWaalsContact O-N 3.08Å; E616-R619 PolarHBondContact O-N 2.84Å; R619-I621 VanDerWaalsContact C-N 3.33Å; R619-I621 PolarHBondContact O-N 2.94Å; R619-S622 WeakPolarHBondContact O-CB 3.23Å; R619-S622 PolarHBondContact O-N 3.48Å; R619-S622 PolarHBondContact O-OG 2.98Å; R619-E714 IonicContact CZ-OE2 2.86Å; R619-E714 VanDerWaalsContact CZ-OE2 3.26Å; R619-E714 IonicContact NE-OE2 3.45Å; R619-E714 PolarHBondContact NE-OE2 3.13Å; R619-E714 VanDerWaalsContact NE-OE2 3.09Å; R619-E714 IonicContact NH2-OE2 2.69Å; R619-E714 PolarHBondContact NH2-OE2 3.04Å; R619-F716 HydrophobicContact CG-CE1 4.1Å; R619-F716 HydrophobicContact CG-CZ 3.78Å
620	D	81.3	Confident	79.5	Confident	138 Å²	138	66.9 Å²	66.9	74%	0.738	31%	0.308	S	S	*	.	H	α-helix	trans	-64.9	-32.2	-179	-74	-14.9	0	0	0	114	E616 R617	E616-D620 PolarHBondContact O-N 3.3Å; E616-D620 VanDerWaalsContact O-N 3.14Å; R617-D620 PolarHBondContact O-N 3.33Å
621	I	81.5	Confident	79.1	Confident	54 Å²	54	66 Å²	66	28%	0.277	31%	0.305	S	S	.	.	H	α-helix	trans	-94.3	-6.2	179.9	65.6	165.6	0	0	0	113.4	E607 L611 R617 L618 R619	E607-I621 HydrophobicContact CB-CD1 3.51Å; E607-I621 HydrophobicContact CG-CD1 3.82Å; L611-I621 HydrophobicContact CD1-CD1 3.44Å; L611-I621 VanDerWaalsContact CD1-CD1 3.44Å; L611-I621 HydrophobicContact CD1-CG1 4.22Å; R617-I621 WeakPolarHBondContact O-CG1 3.48Å; R617-I621 PolarHBondContact O-N 2.82Å; L618-I621 HydrophobicContact CD2-CD1 4.2Å; L618-I621 WeakPolarHBondContact O-CG1 3.07Å; R619-I621 VanDerWaalsContact C-N 3.33Å; R619-I621 PolarHBondContact O-N 2.94Å
622	S	85.1	Confident	78.3	Confident	21 Å²	21	65.7 Å²	65.7	15%	0.147	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-63.8	140.7	-178.1	72.3	0	0	0	0	111.3	R602 L618 R619	R602-S622 WeakPolarHBondContact O-CA 3.35Å; L618-S622 PolarHBondContact O-N 3.22Å; R619-S622 WeakPolarHBondContact O-CB 3.23Å; R619-S622 PolarHBondContact O-N 3.48Å; R619-S622 PolarHBondContact O-OG 2.98Å
623	I	82.4	Confident	78.2	Confident	74 Å²	74	62.3 Å²	62.3	38%	0.379	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.6	-177	-58.4	171	0	0	0	108.3	N601 R602 V625	N601-I623 CarbonylContact C-O 3.59Å; N601-I623 WeakPolarHBondContact CA-O 3.16Å; R602-I623 HydrophobicContact CG-CB 3.78Å; R602-I623 HydrophobicContact CG-CG2 4.41Å; R602-I623 WeakPolarHBondContact CG-O 3.5Å; R602-I623 PolarHBondContact N-O 3.36Å; R602-I623 PolarHBondContact O-N 3.16Å; I623-V625 PolarHBondContact O-N 2.88Å
624	P	80.7	Confident	78.7	Confident	44 Å²	44	58.1 Å²	58.1	29%	0.286	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	134.2	177.3	26.3	-32.5	0	0	0	111.6	N601	N601-P624 WeakPolarHBondContact OD1-CA 3.22Å
625	V	81.4	Confident	79.2	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.03	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-40	178.3	-178.1	0	0	0	0	111	V600 R602 I623 L646 L679 I717	V600-V625 HydrophobicContact CB-CB 4.16Å; V600-V625 HydrophobicContact CG1-CB 4.03Å; V600-V625 HydrophobicContact CG1-CG2 4.34Å; V600-V625 PolarHBondContact O-N 3.12Å; R602-V625 HydrophobicContact CB-CG2 3.67Å; R602-V625 HydrophobicContact CG-CG2 3.79Å; I623-V625 PolarHBondContact O-N 2.88Å; V625-L646 HydrophobicContact CG1-CD2 4.32Å; V625-L679 HydrophobicContact CG1-CD1 4.47Å; V625-I717 HydrophobicContact CG2-CD1 4.4Å
626	G	79.8	Confident	79.4	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.7	-164.2	176.6	0	0	0	0	0	112	V600	V600-G626 PolarHBondContact N-O 2.78Å
627	I	81.1	Confident	79.5	Confident	14 Å²	14	52.3 Å²	52.3	7%	0.072	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	128.9	-176.7	-59.4	176.2	0	0	0	109.8	R597 L598 M733 L736	R597-I627 HydrophobicContact CG-CG2 3.54Å; L598-I627 WeakPolarHBondContact O-CA 3.24Å; I627-M733 HydrophobicContact CD1-SD 4.28Å; I627-L736 HydrophobicContact CB-CD1 4.36Å; I627-L736 HydrophobicContact CG2-CD1 4Å
628	V	83.7	Confident	79.5	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	140.5	171.4	-62.8	0	0	0	0	109.9	L598 V600 V630 I643 L646	L598-V628 HydrophobicContact CB-CG2 3.94Å; L598-V628 HydrophobicContact CD1-CG2 4.36Å; L598-V628 PolarHBondContact N-O 2.99Å; L598-V628 PolarHBondContact O-N 2.72Å; V600-V628 HydrophobicContact CG2-CG1 4.08Å; V600-V628 HydrophobicContact CG2-CG2 3.91Å; V628-V630 HydrophobicContact CG2-CG1 4.38Å; V628-I643 HydrophobicContact CG1-CG1 4.03Å; V628-I643 HydrophobicContact CG2-CG1 4.45Å; V628-L646 HydrophobicContact CG1-CB 4.46Å; V628-L646 HydrophobicContact CG1-CD2 4.13Å
629	V	81.1	Confident	79.7	Confident	37 Å²	37	47.7 Å²	47.7	22%	0.224	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	111.7	174.3	-177.2	0	0	0	0	108.2	R595 L596 R597 L736	R595-V629 HydrophobicContact CB-CG1 4.28Å; L596-V629 CarbonylContact O-C 3.5Å; L596-V629 WeakPolarHBondContact O-CA 3.36Å; R597-V629 HydrophobicContact CB-CG2 4.45Å; R597-V629 HydrophobicContact CG-CG2 4.16Å; V629-L736 HydrophobicContact CG2-CD1 4.43Å
630	V	78.6	Confident	80	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.024	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	164.2	-176.7	-59.8	0	0	0	0	110.5	R595 L596 L598 V628 C634 Y642	R595-V630 CarbonylContact C-O 3.53Å; R595-V630 WeakPolarHBondContact CA-O 3.45Å; L596-V630 HydrophobicContact CB-CG2 4.05Å; L596-V630 HydrophobicContact CD1-CG2 4.48Å; L596-V630 PolarHBondContact N-O 2.87Å; L596-V630 PolarHBondContact O-N 2.96Å; L598-V630 HydrophobicContact CD1-CG2 3.5Å; L598-V630 HydrophobicContact CG-CG2 4.36Å; V628-V630 HydrophobicContact CG2-CG1 4.38Å; V630-C634 HydrophobicContact CB-CB 3.83Å; V630-C634 HydrophobicContact CG2-CB 3.99Å; V630-Y642 HydrophobicContact CG1-CD2 3.86Å; V630-Y642 HydrophobicContact CG1-CE2 4.29Å; V630-Y642 HydrophobicContact CG1-CG 4.17Å
631	R	73.8	Confident	80.1	Confident	153 Å²	153	39.9 Å²	39.9	58%	0.577	21%	0.208	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	155.4	174.7	-67	170.9	48.3	149.1	-3.2	111.1	D633 C634	R631-D633 WeakPolarHBondContact CB-OD1 3.34Å; R631-D633 IonicContact CZ-OD1 3.07Å; R631-D633 IonicContact CZ-OD2 3.96Å; R631-D633 IonicContact NE-OD1 2.64Å; R631-D633 PolarHBondContact NE-OD1 2.86Å; R631-D633 IonicContact NE-OD2 2.99Å; R631-D633 IonicContact NH2-OD1 2.92Å; R631-D633 PolarHBondContact NH2-OD1 2.84Å; R631-D633 IonicContact NH2-OD2 2.96Å; R631-D633 PolarHBondContact NH2-OD2 3.25Å; R631-D633 PolarHBondContact O-N 2.92Å; R631-D633 VanDerWaalsContact O-N 3.12Å; R631-C634 WeakPolarHBondContact O-CB 3.41Å; R631-C634 PolarHBondContact O-N 3.25Å
632	G	61	Low	80.1	Confident	16 Å²	16	40.3 Å²	40.3	17%	0.165	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.5	177.1	0	0	0	0	0	115	D594 T708	D594-G632 PolarHBondContact O-N 3.5Å; G632-T708 WeakPolarHBondContact O-CG2 3.38Å
633	D	66.5	Low	80.2	Confident	87 Å²	87	39.3 Å²	39.3	47%	0.465	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	16.5	177.8	61.5	-15.7	0	0	0	113.5	R631 D635 F706	R631-D633 WeakPolarHBondContact CB-OD1 3.34Å; R631-D633 IonicContact CZ-OD1 3.07Å; R631-D633 IonicContact CZ-OD2 3.96Å; R631-D633 IonicContact NE-OD1 2.64Å; R631-D633 PolarHBondContact NE-OD1 2.86Å; R631-D633 IonicContact NE-OD2 2.99Å; R631-D633 IonicContact NH2-OD1 2.92Å; R631-D633 PolarHBondContact NH2-OD1 2.84Å; R631-D633 IonicContact NH2-OD2 2.96Å; R631-D633 PolarHBondContact NH2-OD2 3.25Å; R631-D633 PolarHBondContact O-N 2.92Å; R631-D633 VanDerWaalsContact O-N 3.12Å; D633-D635 PolarHBondContact O-N 2.68Å; D633-F706 VanDerWaalsContact O-CD1 3.32Å; D633-F706 WeakPolarHBondContact O-CD1 3.3Å; D633-F706 VanDerWaalsContact O-CE1 3.29Å; D633-F706 WeakPolarHBondContact O-CE1 3.37Å
634	C	76.1	Confident	80.1	Confident	11 Å²	11	38.5 Å²	38.5	7%	0.074	20%	0.196	C	C	.	.			trans	-69.5	127.6	178.9	-170.9	0	0	0	0	111.5	V630 R631 V707	V630-C634 HydrophobicContact CB-CB 3.83Å; V630-C634 HydrophobicContact CG2-CB 3.99Å; R631-C634 WeakPolarHBondContact O-CB 3.41Å; R631-C634 PolarHBondContact O-N 3.25Å; C634-V707 HydrophobicContact CB-CG2 4.16Å; C634-V707 WeakPolarHBondContact O-CG2 3.48Å; C634-V707 PolarHBondContact O-N 3.41Å
635	D	83.9	Confident	79.9	Confident	41 Å²	41	41.6 Å²	41.6	22%	0.219	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-76.4	166	166.7	57.4	52.2	0	0	0	111.9	D633 E637 T638 C639 H705 F706	D633-D635 PolarHBondContact O-N 2.68Å; D635-E637 PolarHBondContact OD1-N 2.83Å; D635-T638 WeakPolarHBondContact OD1-CA 3.09Å; D635-T638 WeakPolarHBondContact OD1-CB 3.3Å; D635-T638 PolarHBondContact OD1-N 2.79Å; D635-T638 PolarHBondContact OD1-OG1 3.02Å; D635-T638 PolarHBondContact OD2-OG1 3.31Å; D635-C639 VanDerWaalsContact O-CB 3.31Å; D635-C639 WeakPolarHBondContact O-CB 3.47Å; D635-C639 PolarHBondContact O-N 3.02Å; D635-H705 WeakPolarHBondContact CA-O 3.03Å; D635-F706 HydrophobicContact CB-CD1 4.37Å; D635-F706 HydrophobicContact CB-CE1 4.46Å
636	L	83.3	Confident	79.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-71.2	-30.8	-177.1	-61.1	-176.3	0	0	0	113.1	C639 R640 F685 I697 E702 H705 V707 I710	L636-C639 PolarHBondContact O-N 2.72Å; L636-R640 WeakPolarHBondContact O-CB 3.14Å; L636-R640 PolarHBondContact O-N 2.69Å; L636-F685 HydrophobicContact CB-CD2 3.98Å; L636-F685 HydrophobicContact CB-CE2 3.8Å; L636-F685 HydrophobicContact CB-CZ 4.34Å; L636-F685 HydrophobicContact CD1-CB 4.25Å; L636-F685 HydrophobicContact CD1-CD2 4.12Å; L636-F685 HydrophobicContact CD1-CG 4.2Å; L636-F685 HydrophobicContact CD2-CD1 4.47Å; L636-F685 HydrophobicContact CG-CD2 4.47Å; L636-F685 WeakPolarHBondContact O-CE2 3.04Å; L636-I697 HydrophobicContact CD1-CD1 3.6Å; L636-I697 HydrophobicContact CD1-CG2 4.14Å; L636-E702 HydrophobicContact CB-CB 3.79Å; L636-E702 HydrophobicContact CB-CG 4.06Å; L636-E702 WeakPolarHBondContact CB-O 3.38Å; L636-E702 PolarHBondContact N-O 2.92Å; L636-H705 HydrophobicContact CD1-CB 3.62Å; L636-H705 HydrophobicContact CG-CB 3.95Å; L636-H705 PolarHBondContact N-O 3.3Å; L636-V707 HydrophobicContact CD2-CB 4.27Å; L636-V707 HydrophobicContact CD2-CG2 3.78Å; L636-I710 HydrophobicContact CD1-CD1 3.78Å; L636-I710 HydrophobicContact CD1-CG1 4.48Å; L636-I710 HydrophobicContact CD1-CG2 4.25Å; L636-I710 HydrophobicContact CD2-CD1 3.35Å; L636-I710 HydrophobicContact CD2-CG1 3.81Å; L636-I710 HydrophobicContact CG-CD1 4.21Å
637	E	82.3	Confident	79.2	Confident	109 Å²	109	42.3 Å²	42.3	51%	0.509	20%	0.204	S	C	.	.	H	α-helix	trans	-64.4	-45.7	177.1	-179.5	172.4	-147.3	0	0	110.6	D635 R640 L641 E702	D635-E637 PolarHBondContact OD1-N 2.83Å; E637-R640 WeakPolarHBondContact O-CB 3.27Å; E637-R640 PolarHBondContact O-N 3.45Å; E637-L641 PolarHBondContact O-N 2.85Å; E637-E702 HydrophobicContact CB-CB 4.27Å
638	T	80.8	Confident	78.4	Confident	54 Å²	54	47.2 Å²	47.2	33%	0.331	23%	0.227	S	C	.	.	H	α-helix	trans	-66	-41.5	173.7	-57.8	0	0	0	0	110.8	D635 R640 L641 Y642	D635-T638 WeakPolarHBondContact OD1-CA 3.09Å; D635-T638 WeakPolarHBondContact OD1-CB 3.3Å; D635-T638 PolarHBondContact OD1-N 2.79Å; D635-T638 PolarHBondContact OD1-OG1 3.02Å; D635-T638 PolarHBondContact OD2-OG1 3.31Å; T638-R640 VanDerWaalsContact C-N 3.32Å; T638-R640 PolarHBondContact O-N 3.33Å; T638-L641 WeakPolarHBondContact O-CB 3.06Å; T638-L641 PolarHBondContact O-N 3.48Å; T638-Y642 HydrophobicContact CG2-CE2 3.93Å; T638-Y642 WeakPolarHBondContact O-CD2 3.34Å
639	C	86.3	Confident	77	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.9	-39.8	176.7	-168.9	0	0	0	0	112.2	D635 L636 L641 Y642 I643 F685 V707	D635-C639 VanDerWaalsContact O-CB 3.31Å; D635-C639 WeakPolarHBondContact O-CB 3.47Å; D635-C639 PolarHBondContact O-N 3.02Å; L636-C639 PolarHBondContact O-N 2.72Å; C639-L641 VanDerWaalsContact C-N 3.3Å; C639-L641 PolarHBondContact O-N 3.06Å; C639-Y642 WeakPolarHBondContact O-CB 3.34Å; C639-Y642 PolarHBondContact O-N 3.19Å; C639-I643 PolarHBondContact O-N 3.03Å; C639-I643 VanDerWaalsContact O-N 3.1Å; C639-F685 HydrophobicContact CB-CZ 4.37Å; C639-V707 HydrophobicContact CB-CG2 3.5Å
640	R	89.6	Confident	75.9	Confident	15 Å²	15	52.9 Å²	52.9	6%	0.057	26%	0.256	C	S	.	.	H	α-helix	trans	-57	-42	175.2	170.1	175.6	-65.1	-86.8	0.8	112	L636 E637 T638 Y642 I643 D644 W683 F685 E702	L636-R640 WeakPolarHBondContact O-CB 3.14Å; L636-R640 PolarHBondContact O-N 2.69Å; E637-R640 WeakPolarHBondContact O-CB 3.27Å; E637-R640 PolarHBondContact O-N 3.45Å; T638-R640 VanDerWaalsContact C-N 3.32Å; T638-R640 PolarHBondContact O-N 3.33Å; R640-Y642 PolarHBondContact O-N 3.35Å; R640-I643 PolarHBondContact O-N 3.17Å; R640-D644 WeakPolarHBondContact CG-OD2 3.46Å; R640-D644 WeakPolarHBondContact O-CB 3.2Å; R640-D644 PolarHBondContact O-N 3.26Å; R640-W683 HydrophobicContact CB-CH2 3.96Å; R640-W683 HydrophobicContact CB-CZ2 4.25Å; R640-W683 HydrophobicContact CG-CH2 3.83Å; R640-W683 HydrophobicContact CG-CZ2 3.67Å; R640-W683 VanDerWaalsContact NH1-CZ2 3.26Å; R640-W683 PolarHBondContact NH1-O 3.48Å; R640-W683 PolarHBondContact NH2-O 3.14Å; R640-F685 HydrophobicContact CB-CE2 3.97Å; R640-F685 HydrophobicContact CB-CZ 4.03Å; R640-E702 IonicContact CZ-OE1 3.25Å; R640-E702 IonicContact CZ-OE2 2.94Å; R640-E702 IonicContact NE-OE1 2.86Å; R640-E702 PolarHBondContact NE-OE1 2.92Å; R640-E702 IonicContact NE-OE2 3.89Å; R640-E702 PolarHBondContact NE-OE2 3.22Å; R640-E702 IonicContact NH2-OE1 2.89Å; R640-E702 PolarHBondContact NH2-OE1 2.89Å; R640-E702 IonicContact NH2-OE2 2.69Å
641	L	83.8	Confident	74.8	Confident	96 Å²	96	58 Å²	58	50%	0.503	28%	0.279	S	S	.	.	H	α-helix	trans	-60.2	-28.6	175.4	-61.6	173.2	0	0	0	113.2	E637 T638 C639 R645	E637-L641 PolarHBondContact O-N 2.85Å; T638-L641 WeakPolarHBondContact O-CB 3.06Å; T638-L641 PolarHBondContact O-N 3.48Å; C639-L641 VanDerWaalsContact C-N 3.3Å; C639-L641 PolarHBondContact O-N 3.06Å; L641-R645 WeakPolarHBondContact O-CB 3.41Å; L641-R645 WeakPolarHBondContact O-CG 3.44Å; L641-R645 PolarHBondContact O-N 3.18Å; L641-R645 PolarHBondContact O-NE 3.48Å
642	Y	81.9	Confident	73.5	Confident	63 Å²	63	57.9 Å²	57.9	25%	0.247	29%	0.285	C	S	.	.	H	α-helix	trans	-77.4	-38.3	173.6	-71	-84.3	0	0	0	112	V630 T638 C639 R640 R645 L646	V630-Y642 HydrophobicContact CG1-CD2 3.86Å; V630-Y642 HydrophobicContact CG1-CE2 4.29Å; V630-Y642 HydrophobicContact CG1-CG 4.17Å; T638-Y642 HydrophobicContact CG2-CE2 3.93Å; T638-Y642 WeakPolarHBondContact O-CD2 3.34Å; C639-Y642 WeakPolarHBondContact O-CB 3.34Å; C639-Y642 PolarHBondContact O-N 3.19Å; R640-Y642 PolarHBondContact O-N 3.35Å; Y642-R645 PolarHBondContact O-N 3.42Å; Y642-L646 WeakPolarHBondContact O-CB 3.47Å; Y642-L646 PolarHBondContact O-N 3.44Å
643	I	86.1	Confident	72.4	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-68.7	-39.3	177.1	-62.6	176.5	0	0	0	110.9	V600 V628 C639 R640 L646 Q647 L679 W683 F685 V715 I717	V600-I643 HydrophobicContact CG1-CD1 4.09Å; V600-I643 HydrophobicContact CG1-CG1 4.44Å; V600-I643 HydrophobicContact CG1-CG2 4.17Å; V600-I643 HydrophobicContact CG2-CD1 4.03Å; V600-I643 HydrophobicContact CG2-CG1 3.91Å; V628-I643 HydrophobicContact CG1-CG1 4.03Å; V628-I643 HydrophobicContact CG2-CG1 4.45Å; C639-I643 PolarHBondContact O-N 3.03Å; C639-I643 VanDerWaalsContact O-N 3.1Å; R640-I643 PolarHBondContact O-N 3.17Å; I643-L646 WeakPolarHBondContact O-CB 3.49Å; I643-L646 PolarHBondContact O-N 3.32Å; I643-Q647 PolarHBondContact O-N 2.85Å; I643-Q647 VanDerWaalsContact O-N 3.16Å; I643-L679 HydrophobicContact CG2-CD1 4.1Å; I643-W683 HydrophobicContact CB-CH2 4.15Å; I643-W683 HydrophobicContact CB-CZ2 4Å; I643-W683 HydrophobicContact CD1-CH2 3.95Å; I643-W683 HydrophobicContact CG2-CH2 4.04Å; I643-W683 HydrophobicContact CG2-CZ2 3.72Å; I643-F685 HydrophobicContact CD1-CE1 3.66Å; I643-F685 HydrophobicContact CD1-CZ 4.01Å; I643-V715 HydrophobicContact CD1-CG1 4.42Å; I643-I717 HydrophobicContact CD1-CG2 4.48Å
644	D	81.3	Confident	70.8	Confident	56 Å²	56	62.8 Å²	62.8	30%	0.299	33%	0.327	S	S	.	.	H	α-helix	trans	-67.8	-39.7	176	-69.1	-24.2	0	0	0	110.9	R640 Q647 E648 W683	R640-D644 WeakPolarHBondContact CG-OD2 3.46Å; R640-D644 WeakPolarHBondContact O-CB 3.2Å; R640-D644 PolarHBondContact O-N 3.26Å; D644-Q647 WeakPolarHBondContact O-CB 3.27Å; D644-Q647 PolarHBondContact O-N 3.25Å; D644-Q647 VanDerWaalsContact O-N 3.12Å; D644-E648 PolarHBondContact O-N 3.4Å; D644-W683 PolarHBondContact OD1-NE1 3.1Å; D644-W683 VanDerWaalsContact OD1-NE1 3.08Å
645	R	75.8	Confident	69	Low	110 Å²	110	67.7 Å²	67.7	42%	0.415	36%	0.361	S	S	.	.	H	α-helix	trans	-64.1	-39.1	171.6	-88	-173.6	-86.2	-179.5	-9	113.5	L641 Y642 Q647 E648 D649	L641-R645 WeakPolarHBondContact O-CB 3.41Å; L641-R645 WeakPolarHBondContact O-CG 3.44Å; L641-R645 PolarHBondContact O-N 3.18Å; L641-R645 PolarHBondContact O-NE 3.48Å; Y642-R645 PolarHBondContact O-N 3.42Å; R645-Q647 PolarHBondContact O-N 2.8Å; R645-E648 PolarHBondContact O-N 3.35Å; R645-D649 PolarHBondContact O-N 3.22Å
646	L	76.7	Confident	66.5	Low	5 Å²	5	72.2 Å²	72.2	3%	0.026	39%	0.391	C	S	.	.	H	α-helix	trans	-57.3	-34.1	172.3	175.9	72	0	0	0	111.2	V600 V625 V628 Y642 I643 L650 V737	V600-L646 HydrophobicContact CG2-CD2 4.48Å; V625-L646 HydrophobicContact CG1-CD2 4.32Å; V628-L646 HydrophobicContact CG1-CB 4.46Å; V628-L646 HydrophobicContact CG1-CD2 4.13Å; Y642-L646 WeakPolarHBondContact O-CB 3.47Å; Y642-L646 PolarHBondContact O-N 3.44Å; I643-L646 WeakPolarHBondContact O-CB 3.49Å; I643-L646 PolarHBondContact O-N 3.32Å; L646-L650 VanDerWaalsContact O-CD1 3.3Å; L646-L650 WeakPolarHBondContact O-CD1 3.38Å; L646-L650 VanDerWaalsContact O-CG 3.27Å; L646-L650 WeakPolarHBondContact O-CG 3.2Å; L646-V737 HydrophobicContact CD1-CG2 3.8Å
647	Q	70.3	Confident	63.9	Low	15 Å²	15	75.5 Å²	75.5	7%	0.07	42%	0.424	C	S	.	.	H	α-helix	trans	-72.7	-37.4	172.1	-66.7	-71	-70	0	0	112.4	I643 D644 R645 H651 L679	I643-Q647 PolarHBondContact O-N 2.85Å; I643-Q647 VanDerWaalsContact O-N 3.16Å; D644-Q647 WeakPolarHBondContact O-CB 3.27Å; D644-Q647 PolarHBondContact O-N 3.25Å; D644-Q647 VanDerWaalsContact O-N 3.12Å; R645-Q647 PolarHBondContact O-N 2.8Å; Q647-H651 PolarHBondContact O-CE1 3.48Å; Q647-H651 PolarHBondContact O-ND1 2.79Å; Q647-L679 HydrophobicContact CG-CD1 3.86Å; Q647-L679 HydrophobicContact CG-CG 4.23Å
648	E	63.2	Low	61.4	Low	118 Å²	118	79.6 Å²	79.6	55%	0.551	44%	0.443	S	S	*	.	H	α-helix	trans	-69.3	-43.3	-179.9	-69.9	177.4	171.1	0	0	112.9	D644 R645 L650 H651 Q652	D644-E648 PolarHBondContact O-N 3.4Å; R645-E648 PolarHBondContact O-N 3.35Å; E648-L650 VanDerWaalsContact C-N 3.34Å; E648-L650 PolarHBondContact O-N 3.43Å; E648-H651 PolarHBondContact O-N 3.02Å; E648-H651 VanDerWaalsContact O-N 3.15Å; E648-Q652 PolarHBondContact O-N 3.21Å
649	D	55.9	Low	59	Low	91 Å²	91	86.5 Å²	86.5	49%	0.487	46%	0.463	S	S	.	.	H	α-helix	trans	-66.6	-31.6	-178.7	-75.6	-17.1	0	0	0	113	R645 H651	R645-D649 PolarHBondContact O-N 3.22Å; D649-H651 PolarHBondContact O-N 3.2Å
650	L	56.5	Low	56.1	Low	66 Å²	66	93 Å²	93	35%	0.346	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.6	175.4	-76.6	169.2	0	0	0	113.3	L646 E648	L646-L650 VanDerWaalsContact O-CD1 3.3Å; L646-L650 WeakPolarHBondContact O-CD1 3.38Å; L646-L650 VanDerWaalsContact O-CG 3.27Å; L646-L650 WeakPolarHBondContact O-CG 3.2Å; E648-L650 VanDerWaalsContact C-N 3.34Å; E648-L650 PolarHBondContact O-N 3.43Å
651	H	55.5	Low	53.2	Low	111 Å²	111	100.4 Å²	100.4	51%	0.514	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-8.1	-174.7	-63.1	92.2	0	0	0	113.9	Q647 E648 D649	Q647-H651 PolarHBondContact O-CE1 3.48Å; Q647-H651 PolarHBondContact O-ND1 2.79Å; E648-H651 PolarHBondContact O-N 3.02Å; E648-H651 VanDerWaalsContact O-N 3.15Å; D649-H651 PolarHBondContact O-N 3.2Å
652	Q	46.7	Very low	50.3	Low	152 Å²	152	106.5 Å²	106.5	71%	0.71	56%	0.555	S	S	*	*			trans	-109	37.1	-179.1	-68.5	-169.7	13.2	0	0	114.6	E648 P654	E648-Q652 PolarHBondContact O-N 3.21Å; Q652-P654 WeakPolarHBondContact O-CD 3.38Å
653	A	37.7	Very low	47.7	Very low	94 Å²	94	112.1 Å²	112.1	78%	0.777	58%	0.584	S	S	*	*			trans	-88.3	100.5	174.4	0	0	0	0	0	112.7
654	P	33	Very low	44.8	Very low	112 Å²	112	120 Å²	120	73%	0.727	62%	0.62	S	S	*	*			trans	-78.3	142.4	157.1	31.2	-31.7	0	0	0	110.5	Q652 T656	Q652-P654 WeakPolarHBondContact O-CD 3.38Å; P654-T656 PolarHBondContact O-N 3.12Å
655	S	39.3	Very low	42.2	Very low	114 Å²	114	124 Å²	124	80%	0.797	64%	0.642	S	S	*	*	S	Bend	trans	-65.3	90.8	173.2	49.4	0	0	0	0	111.4
656	T	31.1	Very low	40	Very low	136 Å²	136	127.8 Å²	127.8	83%	0.834	66%	0.664	S	S	*	*			trans	175.1	110	148.1	38.9	0	0	0	0	112.5	P654	P654-T656 PolarHBondContact O-N 3.12Å
657	G	29.3	Very low	37.7	Very low	68 Å²	68	135 Å²	135	70%	0.701	70%	0.701	S	S	*	*			trans	53.7	106.4	141.1	0	0	0	0	0	121.1
658	H	28.2	Very low	35.7	Very low	196 Å²	196	145.8 Å²	145.8	91%	0.907	74%	0.741	S	S	*	*				-179.6	98.8	98.6	-94.1	69.7	0	0	0	108.8
659	R	30.5	Very low	34.4	Very low	199 Å²	199	143.9 Å²	143.9	75%	0.751	75%	0.754	S	S	*	*			trans	-94.2	125.6	171.8	-84	-178.3	159.8	163.1	-6.6	109.3	H661 D735	R659-H661 PolarHBondContact O-N 3.01Å; R659-D735 IonicContact NH2-OD1 3.58Å; R659-D735 IonicContact NH2-OD2 3.98Å; R659-D735 PolarHBondContact NH2-OD2 3.37Å
660	V	25.6	Very low	33	Very low	136 Å²	136	145.9 Å²	145.9	82%	0.824	77%	0.769	S	S	*	*			trans	-81.6	110.2	168.1	-178	0	0	0	0	107.9
661	H	28.3	Very low	31.6	Very low	171 Å²	171	148.2 Å²	148.2	79%	0.792	79%	0.788	S	S	*	*			trans	-74	130.3	172.5	-94.8	-82.9	0	0	0	110.6	R659	R659-H661 PolarHBondContact O-N 3.01Å
662	Y	23.3	Very low	30.3	Very low	223 Å²	223	151.1 Å²	151.1	88%	0.875	81%	0.805	S	S	*	*			trans	-105.1	137.3	146.8	-95.9	-89.6	0	0	0	108.5
663	Q	27	Very low	29.4	Very low	182 Å²	182	149.7 Å²	149.7	85%	0.85	81%	0.807	S	S	*	*			trans	-84.2	122.5	-165.4	-174.3	175.8	12.6	0	0	111.3
664	Q	25.5	Very low	29.5	Very low	165 Å²	165	151 Å²	151	77%	0.771	81%	0.81	S	S	*	*			trans	-165	115.2	145.4	-154.1	89	35.7	0	0	110.7
665	D	28	Very low	29.8	Very low	141 Å²	141	150.5 Å²	150.5	75%	0.754	81%	0.81	S	S	*	*			trans	56.6	117.3	154.6	-57.8	-29.3	0	0	0	122.3
666	E	28.5	Very low	30.1	Very low	189 Å²	189	148.1 Å²	148.1	88%	0.883	79%	0.791	S	S	*	*			trans	-66.8	142.6	168.8	-59.6	-179.3	144	0	0	112.2
667	I	27.9	Very low	31.3	Very low	156 Å²	156	143.7 Å²	143.7	80%	0.8	77%	0.765	S	S	*	*			trans	-175.3	124	131	-89.4	151.3	0	0	0	110.3
668	R	28.3	Very low	33	Very low	241 Å²	241	150.4 Å²	150.4	91%	0.909	77%	0.769	S	S	*	*			trans	65.8	113.7	158.2	-75.5	174.5	-178.1	-170.8	0.5	120.3
669	G	36.8	Very low	35.3	Very low	79 Å²	79	141.6 Å²	141.6	81%	0.814	73%	0.728	S	S	*	*			trans	-73.6	149	174.1	0	0	0	0	0	115.2
670	V	26.2	Very low	37.3	Very low	133 Å²	133	132.3 Å²	132.3	81%	0.806	69%	0.694	S	S	*	*			trans	-147.8	142.4	163.8	-176.2	0	0	0	0	106.9
671	P	26.7	Very low	39.3	Very low	114 Å²	114	131.5 Å²	131.5	74%	0.74	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-72.7	143	-173.3	-7.8	24.6	0	0	0	112.2
672	I	28.5	Very low	41.6	Very low	172 Å²	172	127.1 Å²	127.1	88%	0.882	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-82.2	119.1	175.5	-63	171.5	0	0	0	109.1
673	T	26.9	Very low	44.8	Very low	122 Å²	122	116.8 Å²	116.8	75%	0.748	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-91.6	122.5	171.7	49.3	0	0	0	0	110.7	S675	T673-S675 PolarHBondContact O-N 3.08Å
674	S	40	Very low	47.8	Very low	121 Å²	121	108.3 Å²	108.3	85%	0.846	59%	0.594	S	S	*	*			trans	-74.4	109.3	176.2	46	0	0	0	0	112.3
675	S	41	Very low	51	Low	103 Å²	103	100.4 Å²	100.4	72%	0.72	56%	0.558	S	S	*	*			trans	-158.5	77.7	162.5	63.6	0	0	0	0	112.4	T673	T673-S675 PolarHBondContact O-N 3.08Å
676	T	45.6	Very low	53.9	Low	64 Å²	64	93.7 Å²	93.7	39%	0.393	52%	0.522	S	S	.	.			trans	-115.7	101.7	164.1	44.5	0	0	0	0	108.8
677	S	55.6	Low	56.6	Low	42 Å²	42	86 Å²	86	29%	0.294	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-63.6	136.9	169.6	55.2	0	0	0	0	110.2	R602	R602-S677 PolarHBondContact NH1-O 3.46Å; R602-S677 PolarHBondContact NH1-OG 3.01Å; R602-S677 PolarHBondContact NH2-OG 2.86Å
678	R	65	Low	59.1	Low	210 Å²	210	79.5 Å²	79.5	79%	0.792	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-56.3	134.5	177.5	-171.2	178.8	-176.3	176	3	110.7
679	L	75.1	Confident	61.3	Low	10 Å²	10	71.5 Å²	71.5	5%	0.052	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-60.5	145.3	172.3	-66	172.7	0	0	0	111.2	R602 V625 I643 Q647 W683 I717	R602-L679 HydrophobicContact CB-CD2 4.19Å; V625-L679 HydrophobicContact CG1-CD1 4.47Å; I643-L679 HydrophobicContact CG2-CD1 4.1Å; Q647-L679 HydrophobicContact CG-CD1 3.86Å; Q647-L679 HydrophobicContact CG-CG 4.23Å; L679-W683 HydrophobicContact CB-CG 4.35Å; L679-I717 HydrophobicContact CD1-CD1 3.41Å; L679-I717 VanDerWaalsContact CD1-CD1 3.41Å; L679-I717 HydrophobicContact CD2-CD1 3.56Å; L679-I717 HydrophobicContact CG-CD1 4.13Å
680	S	73.1	Confident	62.8	Low	5 Å²	5	69.5 Å²	69.5	4%	0.035	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-62	142.7	175.8	78.8	0	0	0	0	111.3	N682 W683 D719 H720	S680-N682 VanDerWaalsContact CB-OD1 3.25Å; S680-N682 WeakPolarHBondContact CB-OD1 3.38Å; S680-N682 PolarHBondContact O-N 3.11Å; S680-N682 PolarHBondContact OG-OD1 3.18Å; S680-W683 PolarHBondContact O-N 3.39Å; S680-W683 VanDerWaalsContact O-N 3.09Å; S680-W683 PolarHBondContact OG-N 3.12Å; S680-D719 WeakPolarHBondContact CB-OD1 3.39Å; S680-D719 PolarHBondContact N-OD1 3.32Å; S680-D719 PolarHBondContact OG-OD1 3.11Å; S680-D719 VanDerWaalsContact OG-OD1 3.05Å; S680-H720 PolarHBondContact OG-N 3.37Å
681	P	68.2	Low	64.1	Low	118 Å²	118	67.2 Å²	67.2	77%	0.766	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-9	-178.9	24	-33.2	0	0	0	114.4
682	N	77.1	Confident	65.8	Low	80 Å²	80	67.5 Å²	67.5	43%	0.428	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	15.4	-179.5	62.8	-10.8	0	0	0	114	S680 H720	S680-N682 VanDerWaalsContact CB-OD1 3.25Å; S680-N682 WeakPolarHBondContact CB-OD1 3.38Å; S680-N682 PolarHBondContact O-N 3.11Å; S680-N682 PolarHBondContact OG-OD1 3.18Å; N682-H720 PolarHBondContact O-CD2 3.37Å; N682-H720 PolarHBondContact O-NE2 3.5Å
683	W	89.8	Confident	67.9	Low	6 Å²	6	64.9 Å²	64.9	2%	0.023	38%	0.376	C	S	.	.			trans	-53	147.9	177.8	69.7	-105.1	0	0	0	112.3	R640 I643 D644 L679 S680 F685 I717 L718	R640-W683 HydrophobicContact CB-CH2 3.96Å; R640-W683 HydrophobicContact CB-CZ2 4.25Å; R640-W683 HydrophobicContact CG-CH2 3.83Å; R640-W683 HydrophobicContact CG-CZ2 3.67Å; R640-W683 VanDerWaalsContact NH1-CZ2 3.26Å; R640-W683 PolarHBondContact NH1-O 3.48Å; R640-W683 PolarHBondContact NH2-O 3.14Å; I643-W683 HydrophobicContact CB-CH2 4.15Å; I643-W683 HydrophobicContact CB-CZ2 4Å; I643-W683 HydrophobicContact CD1-CH2 3.95Å; I643-W683 HydrophobicContact CG2-CH2 4.04Å; I643-W683 HydrophobicContact CG2-CZ2 3.72Å; D644-W683 PolarHBondContact OD1-NE1 3.1Å; D644-W683 VanDerWaalsContact OD1-NE1 3.08Å; L679-W683 HydrophobicContact CB-CG 4.35Å; S680-W683 PolarHBondContact O-N 3.39Å; S680-W683 VanDerWaalsContact O-N 3.09Å; S680-W683 PolarHBondContact OG-N 3.12Å; W683-F685 HydrophobicContact CH2-CE1 4.02Å; W683-F685 AromaticContact CH2-CE2 3.87Å; W683-F685 HydrophobicContact CH2-CE2 3.87Å; W683-F685 AromaticContact CH2-CZ 3.57Å; W683-F685 HydrophobicContact CH2-CZ 3.57Å; W683-F685 HydrophobicContact CZ3-CD1 4.09Å; W683-F685 HydrophobicContact CZ3-CD2 4.01Å; W683-F685 AromaticContact CZ3-CE1 3.86Å; W683-F685 HydrophobicContact CZ3-CE1 3.86Å; W683-F685 AromaticContact CZ3-CE2 3.77Å; W683-F685 HydrophobicContact CZ3-CE2 3.77Å; W683-F685 HydrophobicContact CZ3-CG 4.17Å; W683-F685 AromaticContact CZ3-CZ 3.7Å; W683-F685 HydrophobicContact CZ3-CZ 3.7Å; W683-I717 HydrophobicContact CD2-CD1 4.39Å; W683-I717 HydrophobicContact CE3-CB 3.77Å; W683-I717 HydrophobicContact CE3-CD1 4.33Å; W683-I717 HydrophobicContact CE3-CG2 3.65Å; W683-I717 HydrophobicContact CH2-CG2 4.25Å; W683-I717 HydrophobicContact CZ3-CB 4.11Å; W683-I717 HydrophobicContact CZ3-CG2 3.43Å; W683-I717 VanDerWaalsContact CZ3-CG2 3.43Å; W683-L718 CarbonylContact C-O 3.56Å; W683-L718 VanDerWaalsContact CA-O 3.26Å; W683-L718 WeakPolarHBondContact CA-O 3.37Å; W683-L718 WeakPolarHBondContact CB-O 3.46Å
684	S	89.8	Confident	70.5	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.021	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	153.3	-175.6	-51.9	0	0	0	0	112.6	R696 I717 L718 H720	S684-R696 PolarHBondContact OG-NE 3.39Å; S684-R696 VanDerWaalsContact OG-NE 3.15Å; S684-R696 PolarHBondContact OG-NH2 3.32Å; S684-R696 VanDerWaalsContact OG-NH2 3.17Å; S684-I717 CarbonylContact O-C 3.57Å; S684-I717 VanDerWaalsContact O-CA 3.32Å; S684-I717 WeakPolarHBondContact O-CA 3.34Å; S684-L718 PolarHBondContact N-O 3.32Å; S684-L718 PolarHBondContact O-N 2.8Å; S684-H720 PolarHBondContact OG-NE2 3.3Å
685	F	93	Very high	72.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	150.8	173.1	-71.2	-80.6	0	0	0	111.9	L636 C639 R640 I643 W683 I697 E702 I710 V715 I717	L636-F685 HydrophobicContact CB-CD2 3.98Å; L636-F685 HydrophobicContact CB-CE2 3.8Å; L636-F685 HydrophobicContact CB-CZ 4.34Å; L636-F685 HydrophobicContact CD1-CB 4.25Å; L636-F685 HydrophobicContact CD1-CD2 4.12Å; L636-F685 HydrophobicContact CD1-CG 4.2Å; L636-F685 HydrophobicContact CD2-CD1 4.47Å; L636-F685 HydrophobicContact CG-CD2 4.47Å; L636-F685 WeakPolarHBondContact O-CE2 3.04Å; C639-F685 HydrophobicContact CB-CZ 4.37Å; R640-F685 HydrophobicContact CB-CE2 3.97Å; R640-F685 HydrophobicContact CB-CZ 4.03Å; I643-F685 HydrophobicContact CD1-CE1 3.66Å; I643-F685 HydrophobicContact CD1-CZ 4.01Å; W683-F685 HydrophobicContact CH2-CE1 4.02Å; W683-F685 AromaticContact CH2-CE2 3.87Å; W683-F685 HydrophobicContact CH2-CE2 3.87Å; W683-F685 AromaticContact CH2-CZ 3.57Å; W683-F685 HydrophobicContact CH2-CZ 3.57Å; W683-F685 HydrophobicContact CZ3-CD1 4.09Å; W683-F685 HydrophobicContact CZ3-CD2 4.01Å; W683-F685 AromaticContact CZ3-CE1 3.86Å; W683-F685 HydrophobicContact CZ3-CE1 3.86Å; W683-F685 AromaticContact CZ3-CE2 3.77Å; W683-F685 HydrophobicContact CZ3-CE2 3.77Å; W683-F685 HydrophobicContact CZ3-CG 4.17Å; W683-F685 AromaticContact CZ3-CZ 3.7Å; W683-F685 HydrophobicContact CZ3-CZ 3.7Å; F685-I697 HydrophobicContact CB-CB 4.26Å; F685-I697 HydrophobicContact CB-CD1 4.28Å; F685-I697 PolarHBondContact O-N 3.04Å; F685-E702 HydrophobicContact CD2-CG 4.01Å; F685-E702 HydrophobicContact CE2-CG 4.35Å; F685-I710 HydrophobicContact CB-CD1 4.11Å; F685-I710 HydrophobicContact CD1-CD1 4.12Å; F685-I710 HydrophobicContact CG-CD1 4.33Å; F685-V715 HydrophobicContact CD1-CG2 3.7Å; F685-V715 HydrophobicContact CE1-CG2 3.89Å; F685-I717 HydrophobicContact CD1-CG2 4.05Å; F685-I717 HydrophobicContact CE1-CG2 4.27Å
686	L	89.2	Confident	74.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.9	172	-64.9	176.5	0	0	0	110	I603 Y608 S688 F694 Y695 R696 F716 L718	I603-L686 HydrophobicContact CB-CD1 4.48Å; I603-L686 HydrophobicContact CD1-CD1 3.9Å; Y608-L686 HydrophobicContact CD2-CD1 4.25Å; Y608-L686 HydrophobicContact CE2-CD1 4.07Å; Y608-L686 HydrophobicContact CE2-CD2 3.75Å; L686-S688 PolarHBondContact O-N 3.49Å; L686-F694 HydrophobicContact CB-CB 4.31Å; L686-F694 HydrophobicContact CB-CD1 3.96Å; L686-F694 HydrophobicContact CB-CG 4.38Å; L686-F694 HydrophobicContact CD1-CB 4.4Å; L686-F694 HydrophobicContact CD1-CG 4.4Å; L686-F694 HydrophobicContact CD2-CB 4.43Å; L686-Y695 CarbonylContact C-O 3.49Å; L686-Y695 WeakPolarHBondContact CA-O 3.44Å; L686-R696 HydrophobicContact CD2-CB 4.25Å; L686-F716 HydrophobicContact CB-CB 3.94Å; L686-F716 HydrophobicContact CD1-CB 4.21Å; L686-F716 PolarHBondContact N-O 3.49Å; L686-L718 HydrophobicContact CD1-CB 4.12Å; L686-L718 HydrophobicContact CD2-CB 3.96Å; L686-L718 HydrophobicContact CD2-CD2 4.31Å; L686-L718 HydrophobicContact CG-CB 4Å
687	D	85.3	Confident	76.3	Confident	26 Å²	26	56.7 Å²	56.7	14%	0.139	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	119.5	169.5	173.7	21.7	0	0	0	110.3	T689 S690 F694 Y695 I697 I710	D687-T689 WeakPolarHBondContact OD1-CB 3.44Å; D687-T689 PolarHBondContact OD1-N 2.76Å; D687-T689 PolarHBondContact OD1-OG1 3.43Å; D687-S690 PolarHBondContact OD2-OG 3.43Å; D687-F694 WeakPolarHBondContact O-CA 3.47Å; D687-Y695 PolarHBondContact N-O 3.12Å; D687-Y695 PolarHBondContact O-N 2.93Å; D687-I697 HydrophobicContact CB-CD1 4.24Å; D687-I697 HydrophobicContact CB-CG1 4.46Å; D687-I710 HydrophobicContact CB-CB 4.35Å; D687-I710 HydrophobicContact CB-CG2 4.46Å
688	S	80.9	Confident	77.3	Confident	20 Å²	20	58.5 Å²	58.5	14%	0.14	30%	0.298	C	S	.	.			trans	-104.5	-0.6	-178.7	74.4	0	0	0	0	113.5	K615 L686 I710	K615-S688 WeakPolarHBondContact CE-O 3.19Å; K615-S688 PolarHBondContact NZ-O 2.92Å; L686-S688 PolarHBondContact O-N 3.49Å; S688-I710 WeakPolarHBondContact CB-O 3.43Å; S688-I710 PolarHBondContact N-O 3.36Å; S688-I710 PolarHBondContact OG-O 3Å
689	T	73.4	Confident	77.8	Confident	74 Å²	74	55 Å²	55	45%	0.454	29%	0.288	S	S	.	.			trans	-83.1	-22.8	-177.4	65.2	0	0	0	0	113.5	D687 E709 I710	D687-T689 WeakPolarHBondContact OD1-CB 3.44Å; D687-T689 PolarHBondContact OD1-N 2.76Å; D687-T689 PolarHBondContact OD1-OG1 3.43Å; T689-E709 WeakPolarHBondContact CG2-O 3.35Å; T689-E709 PolarHBondContact OG1-O 2.89Å; T689-I710 VanDerWaalsContact CG2-C 3.5Å
690	S	68.8	Low	77.5	Confident	36 Å²	36	58.3 Å²	58.3	25%	0.252	32%	0.317	S	S	.	.	S	Bend	trans	-63.1	141.8	174.3	-71	0	0	0	0	111.8	K615 D687 D692 Y695	K615-S690 PolarHBondContact NZ-O 3.24Å; D687-S690 PolarHBondContact OD2-OG 3.43Å; S690-D692 PolarHBondContact O-N 2.88Å; S690-Y695 WeakPolarHBondContact OG-CD2 3.43Å
691	A	53	Low	77.1	Confident	86 Å²	86	62 Å²	62	71%	0.711	33%	0.334	S	S	*	.	S	Bend	trans	-67.2	-30.9	-167.6	0	0	0	0	0	114.3
692	D	61.8	Low	77.4	Confident	120 Å²	120	56.6 Å²	56.6	64%	0.642	30%	0.298	S	S	*	.	S	Bend	trans	-120.6	-21.4	-162.2	-36.2	-29.8	0	0	0	114.1	S690	S690-D692 PolarHBondContact O-N 2.88Å
693	R	74	Confident	77	Confident	116 Å²	116	57.8 Å²	57.8	44%	0.438	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-152.3	157.7	-170.1	-68.9	-177	-83.7	-163.1	-5.8	112	Y613	Y613-R693 WeakPolarHBondContact O-CA 3.44Å; Y613-R693 WeakPolarHBondContact O-CG 3.42Å
694	F	81.3	Confident	75.5	Confident	3 Å²	3	62.7 Å²	62.7	1%	0.013	33%	0.327	C	S	.	.			trans	-81	139.1	164.6	-74.8	-68.8	0	0	0	110.4	I603 Y608 K615 L618 L686 D687 F716	I603-F694 HydrophobicContact CD1-CD2 4.47Å; I603-F694 HydrophobicContact CD1-CE2 4.14Å; Y608-F694 HydrophobicContact CE2-CB 3.88Å; Y608-F694 PolarHBondContact OH-O 3.05Å; Y608-F694 VanDerWaalsContact OH-O 3.06Å; K615-F694 HydrophobicContact CB-CD2 4.48Å; K615-F694 HydrophobicContact CB-CE2 4.46Å; K615-F694 HydrophobicContact CG-CD2 4.18Å; K615-F694 HydrophobicContact CG-CE2 3.9Å; K615-F694 HydrophobicContact CG-CZ 4.1Å; L618-F694 HydrophobicContact CB-CD2 3.88Å; L618-F694 HydrophobicContact CB-CE2 3.68Å; L618-F694 HydrophobicContact CD1-CD2 3.89Å; L686-F694 HydrophobicContact CB-CB 4.31Å; L686-F694 HydrophobicContact CB-CD1 3.96Å; L686-F694 HydrophobicContact CB-CG 4.38Å; L686-F694 HydrophobicContact CD1-CB 4.4Å; L686-F694 HydrophobicContact CD1-CG 4.4Å; L686-F694 HydrophobicContact CD2-CB 4.43Å; D687-F694 WeakPolarHBondContact O-CA 3.47Å; F694-F716 HydrophobicContact CE1-CB 4.02Å; F694-F716 HydrophobicContact CE1-CD1 4.36Å; F694-F716 AromaticContact CE1-CD2 3.55Å; F694-F716 HydrophobicContact CE1-CD2 3.55Å; F694-F716 HydrophobicContact CE1-CE2 4.11Å; F694-F716 AromaticContact CE1-CG 3.7Å; F694-F716 HydrophobicContact CE1-CG 3.7Å; F694-F716 HydrophobicContact CZ-CB 4.47Å; F694-F716 HydrophobicContact CZ-CD1 4.03Å; F694-F716 AromaticContact CZ-CD2 3.86Å; F694-F716 HydrophobicContact CZ-CD2 3.86Å; F694-F716 HydrophobicContact CZ-CE1 4.25Å; F694-F716 HydrophobicContact CZ-CE2 4.09Å; F694-F716 AromaticContact CZ-CG 3.84Å; F694-F716 HydrophobicContact CZ-CG 3.84Å; F694-F716 HydrophobicContact CZ-CZ 4.3Å
695	Y	81.6	Confident	74.3	Confident	112 Å²	112	65.4 Å²	65.4	44%	0.439	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	131	172.5	-71.2	-83.4	0	0	0	110.6	L686 D687 S690	L686-Y695 CarbonylContact C-O 3.49Å; L686-Y695 WeakPolarHBondContact CA-O 3.44Å; D687-Y695 PolarHBondContact N-O 3.12Å; D687-Y695 PolarHBondContact O-N 2.93Å; S690-Y695 WeakPolarHBondContact OG-CD2 3.43Å
696	R	83.9	Confident	73.7	Confident	114 Å²	114	69.6 Å²	69.6	43%	0.43	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	130.4	175	-177.3	-176.1	175.8	-176.8	-1.6	109.9	S684 L686 H720	S684-R696 PolarHBondContact OG-NE 3.39Å; S684-R696 VanDerWaalsContact OG-NE 3.15Å; S684-R696 PolarHBondContact OG-NH2 3.32Å; S684-R696 VanDerWaalsContact OG-NH2 3.17Å; L686-R696 HydrophobicContact CD2-CB 4.25Å; R696-H720 PolarHBondContact NH1-CE1 2.86Å; R696-H720 PolarHBondContact NH2-CE1 3.35Å; R696-H720 PolarHBondContact NH2-NE2 2.98Å
697	I	81.9	Confident	73.2	Confident	9 Å²	9	69.6 Å²	69.6	5%	0.046	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	124	171	-57.6	175.5	0	0	0	107.6	L636 F685 D687 Q701 E702 I710	L636-I697 HydrophobicContact CD1-CD1 3.6Å; L636-I697 HydrophobicContact CD1-CG2 4.14Å; F685-I697 HydrophobicContact CB-CB 4.26Å; F685-I697 HydrophobicContact CB-CD1 4.28Å; F685-I697 PolarHBondContact O-N 3.04Å; D687-I697 HydrophobicContact CB-CD1 4.24Å; D687-I697 HydrophobicContact CB-CG1 4.46Å; I697-Q701 HydrophobicContact CG2-CB 4.14Å; I697-E702 HydrophobicContact CG2-CG 4.41Å; I697-I710 HydrophobicContact CD1-CB 4.14Å; I697-I710 HydrophobicContact CD1-CD1 4.13Å; I697-I710 HydrophobicContact CD1-CG2 3.43Å; I697-I710 VanDerWaalsContact CD1-CG2 3.43Å
698	D	77.3	Confident	73	Confident	81 Å²	81	70.9 Å²	70.9	43%	0.433	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-72.5	146	177.9	-72.5	-42.2	0	0	0	110.8	A700 Q701	D698-A700 PolarHBondContact O-N 3.15Å; D698-A700 VanDerWaalsContact O-N 3.12Å; D698-Q701 HydrophobicContact CB-CG 4.41Å; D698-Q701 WeakPolarHBondContact O-CA 3.49Å; D698-Q701 WeakPolarHBondContact O-CB 3.27Å; D698-Q701 PolarHBondContact O-N 2.85Å
699	K	75.4	Confident	72.9	Confident	136 Å²	136	73.2 Å²	73.2	59%	0.591	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-55.1	-36	-177.2	-170	176.1	180	179.2	0	112.9	Q701 E702	K699-Q701 PolarHBondContact O-N 3.23Å; K699-E702 WeakPolarHBondContact CA-OE1 3.36Å; K699-E702 PolarHBondContact O-N 3.04Å
700	A	68.3	Low	73.1	Confident	80 Å²	80	69.9 Å²	69.9	66%	0.661	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-67.4	-14	177	0	0	0	0	0	114	D698 H703	D698-A700 PolarHBondContact O-N 3.15Å; D698-A700 VanDerWaalsContact O-N 3.12Å; A700-H703 PolarHBondContact O-CE1 3.01Å; A700-H703 PolarHBondContact O-ND1 3.2Å; A700-H703 VanDerWaalsContact O-ND1 3.17Å
701	Q	64.2	Low	73.6	Confident	82 Å²	82	68.3 Å²	68.3	38%	0.383	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-101.4	-4.9	-179.4	-62.3	178.2	-22.7	0	0	112.8	I697 D698 K699 H703 L704 H705	I697-Q701 HydrophobicContact CG2-CB 4.14Å; D698-Q701 HydrophobicContact CB-CG 4.41Å; D698-Q701 WeakPolarHBondContact O-CA 3.49Å; D698-Q701 WeakPolarHBondContact O-CB 3.27Å; D698-Q701 PolarHBondContact O-N 2.85Å; K699-Q701 PolarHBondContact O-N 3.23Å; Q701-H703 VanDerWaalsContact C-N 3.31Å; Q701-H703 PolarHBondContact O-N 2.9Å; Q701-L704 WeakPolarHBondContact O-CA 3.39Å; Q701-L704 VanDerWaalsContact O-CB 3.32Å; Q701-L704 WeakPolarHBondContact O-CB 3.48Å; Q701-L704 PolarHBondContact O-N 2.94Å; Q701-H705 PolarHBondContact O-CD2 2.9Å
702	E	76.1	Confident	74.4	Confident	4 Å²	4	71.6 Å²	71.6	2%	0.019	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-64.3	-32.8	-172.7	-71.9	178.3	-168.5	0	0	113.9	L636 E637 R640 F685 I697 K699 L704 H705	L636-E702 HydrophobicContact CB-CB 3.79Å; L636-E702 HydrophobicContact CB-CG 4.06Å; L636-E702 WeakPolarHBondContact CB-O 3.38Å; L636-E702 PolarHBondContact N-O 2.92Å; E637-E702 HydrophobicContact CB-CB 4.27Å; R640-E702 IonicContact CZ-OE1 3.25Å; R640-E702 IonicContact CZ-OE2 2.94Å; R640-E702 IonicContact NE-OE1 2.86Å; R640-E702 PolarHBondContact NE-OE1 2.92Å; R640-E702 IonicContact NE-OE2 3.89Å; R640-E702 PolarHBondContact NE-OE2 3.22Å; R640-E702 IonicContact NH2-OE1 2.89Å; R640-E702 PolarHBondContact NH2-OE1 2.89Å; R640-E702 IonicContact NH2-OE2 2.69Å; F685-E702 HydrophobicContact CD2-CG 4.01Å; F685-E702 HydrophobicContact CE2-CG 4.35Å; I697-E702 HydrophobicContact CG2-CG 4.41Å; K699-E702 WeakPolarHBondContact CA-OE1 3.36Å; K699-E702 PolarHBondContact O-N 3.04Å; E702-L704 PolarHBondContact O-N 2.79Å; E702-H705 PolarHBondContact O-N 2.9Å
703	H	67.6	Low	75.1	Confident	105 Å²	105	71.5 Å²	71.5	49%	0.486	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-71.7	-11.9	173.8	70.3	-86.6	0	0	0	113.5	A700 Q701	A700-H703 PolarHBondContact O-CE1 3.01Å; A700-H703 PolarHBondContact O-ND1 3.2Å; A700-H703 VanDerWaalsContact O-ND1 3.17Å; Q701-H703 VanDerWaalsContact C-N 3.31Å; Q701-H703 PolarHBondContact O-N 2.9Å
704	L	58.8	Low	75.7	Confident	109 Å²	109	67.9 Å²	67.9	57%	0.571	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-95.1	-9	179.3	-57.8	174.9	0	0	0	112.8	Q701 E702	Q701-L704 WeakPolarHBondContact O-CA 3.39Å; Q701-L704 VanDerWaalsContact O-CB 3.32Å; Q701-L704 WeakPolarHBondContact O-CB 3.48Å; Q701-L704 PolarHBondContact O-N 2.94Å; E702-L704 PolarHBondContact O-N 2.79Å
705	H	65.4	Low	76.2	Confident	60 Å²	60	67.7 Å²	67.7	28%	0.278	33%	0.331	S	S	.	.			trans	-120.8	136	-174.5	-70.6	-63.9	0	0	0	111.2	D635 L636 Q701 E702 E709 I710	D635-H705 WeakPolarHBondContact CA-O 3.03Å; L636-H705 HydrophobicContact CD1-CB 3.62Å; L636-H705 HydrophobicContact CG-CB 3.95Å; L636-H705 PolarHBondContact N-O 3.3Å; Q701-H705 PolarHBondContact O-CD2 2.9Å; E702-H705 PolarHBondContact O-N 2.9Å; H705-E709 IonicContact ND1-OE2 2.93Å; H705-I710 HydrophobicContact CB-CG2 4.5Å
706	F	80.4	Confident	76.6	Confident	89 Å²	89	62.6 Å²	62.6	39%	0.39	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-90.5	151.4	170	-65.6	-79	0	0	0	111	D633 D635 T708 E709	D633-F706 VanDerWaalsContact O-CD1 3.32Å; D633-F706 WeakPolarHBondContact O-CD1 3.3Å; D633-F706 VanDerWaalsContact O-CE1 3.29Å; D633-F706 WeakPolarHBondContact O-CE1 3.37Å; D635-F706 HydrophobicContact CB-CD1 4.37Å; D635-F706 HydrophobicContact CB-CE1 4.46Å; F706-T708 PolarHBondContact O-N 3.5Å; F706-E709 HydrophobicContact CB-CG 4.11Å; F706-E709 PolarHBondContact N-OE2 2.77Å; F706-E709 VanDerWaalsContact N-OE2 3.12Å; F706-E709 WeakPolarHBondContact O-CB 3.47Å; F706-E709 PolarHBondContact O-N 3.34Å
707	V	78.4	Confident	77.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.7	-34.2	-179.8	-174.9	0	0	0	0	111.9	L598 C634 L636 C639 E709 I710 C711	L598-V707 HydrophobicContact CD1-CB 4.35Å; L598-V707 HydrophobicContact CD1-CG1 3.2Å; L598-V707 HydrophobicContact CD2-CG1 4.33Å; L598-V707 HydrophobicContact CG-CG1 4.38Å; C634-V707 HydrophobicContact CB-CG2 4.16Å; C634-V707 WeakPolarHBondContact O-CG2 3.48Å; C634-V707 PolarHBondContact O-N 3.41Å; L636-V707 HydrophobicContact CD2-CB 4.27Å; L636-V707 HydrophobicContact CD2-CG2 3.78Å; C639-V707 HydrophobicContact CB-CG2 3.5Å; V707-E709 PolarHBondContact O-N 3.44Å; V707-I710 WeakPolarHBondContact O-CG1 3.47Å; V707-I710 PolarHBondContact O-N 3.25Å; V707-C711 VanDerWaalsContact CG1-SG 3.5Å; V707-C711 PolarHBondContact O-N 2.99Å; V707-C711 VanDerWaalsContact O-N 3.14Å; V707-C711 PolarHBondContact O-SG 3.13Å
708	T	79.8	Confident	77.4	Confident	53 Å²	53	56.8 Å²	56.8	33%	0.325	29%	0.289	S	S	.	.	H	α-helix	trans	-68	-16.2	175.7	52.2	0	0	0	0	114.5	V592 L596 G632 F706	V592-T708 HydrophobicContact CG1-CG2 3.91Å; L596-T708 HydrophobicContact CD1-CG2 3.34Å; L596-T708 HydrophobicContact CD2-CG2 4.34Å; L596-T708 HydrophobicContact CG-CG2 4.41Å; G632-T708 WeakPolarHBondContact O-CG2 3.38Å; F706-T708 PolarHBondContact O-N 3.5Å
709	E	79	Confident	77.9	Confident	69 Å²	69	53.1 Å²	53.1	32%	0.322	27%	0.269	S	S	.	.	H	α-helix	trans	-84.8	-18.8	178.5	-63.8	-178.9	148.2	0	0	112.3	T689 H705 F706 V707	T689-E709 WeakPolarHBondContact CG2-O 3.35Å; T689-E709 PolarHBondContact OG1-O 2.89Å; H705-E709 IonicContact ND1-OE2 2.93Å; F706-E709 HydrophobicContact CB-CG 4.11Å; F706-E709 PolarHBondContact N-OE2 2.77Å; F706-E709 VanDerWaalsContact N-OE2 3.12Å; F706-E709 WeakPolarHBondContact O-CB 3.47Å; F706-E709 PolarHBondContact O-N 3.34Å; V707-E709 PolarHBondContact O-N 3.44Å
710	I	79.1	Confident	78	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-117	-15.4	-172	72.6	153.1	0	0	0	113	L636 F685 D687 S688 T689 I697 H705 V707 V715	L636-I710 HydrophobicContact CD1-CD1 3.78Å; L636-I710 HydrophobicContact CD1-CG1 4.48Å; L636-I710 HydrophobicContact CD1-CG2 4.25Å; L636-I710 HydrophobicContact CD2-CD1 3.35Å; L636-I710 HydrophobicContact CD2-CG1 3.81Å; L636-I710 HydrophobicContact CG-CD1 4.21Å; F685-I710 HydrophobicContact CB-CD1 4.11Å; F685-I710 HydrophobicContact CD1-CD1 4.12Å; F685-I710 HydrophobicContact CG-CD1 4.33Å; D687-I710 HydrophobicContact CB-CB 4.35Å; D687-I710 HydrophobicContact CB-CG2 4.46Å; S688-I710 WeakPolarHBondContact CB-O 3.43Å; S688-I710 PolarHBondContact N-O 3.36Å; S688-I710 PolarHBondContact OG-O 3Å; T689-I710 VanDerWaalsContact CG2-C 3.5Å; I697-I710 HydrophobicContact CD1-CB 4.14Å; I697-I710 HydrophobicContact CD1-CD1 4.13Å; I697-I710 HydrophobicContact CD1-CG2 3.43Å; I697-I710 VanDerWaalsContact CD1-CG2 3.43Å; H705-I710 HydrophobicContact CB-CG2 4.5Å; V707-I710 WeakPolarHBondContact O-CG1 3.47Å; V707-I710 PolarHBondContact O-N 3.25Å; I710-V715 HydrophobicContact CD1-CG2 4.19Å
711	C	77.6	Confident	77.9	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.02	25%	0.247	C	C	.	.			trans	-156.5	163.1	178.1	65.9	0	0	0	0	112.4	V707 E714	V707-C711 VanDerWaalsContact CG1-SG 3.5Å; V707-C711 PolarHBondContact O-N 2.99Å; V707-C711 VanDerWaalsContact O-N 3.14Å; V707-C711 PolarHBondContact O-SG 3.13Å; C711-E714 WeakPolarHBondContact CB-O 3.33Å
712	Q	70.1	Confident	77.4	Confident	155 Å²	155	49.1 Å²	49.1	72%	0.724	25%	0.251	S	S	*	.	S	Bend	trans	-103.2	-68.2	172.9	-68.2	178.7	-5.6	0	0	110.1
713	D	77.5	Confident	76.2	Confident	118 Å²	118	52.3 Å²	52.3	63%	0.631	27%	0.272	S	S	*	.	S	Bend	trans	-118.4	-15.4	-178.2	-57.4	-37.1	0	0	0	113.5	L598 R599	L598-D713 WeakPolarHBondContact CA-O 3.42Å; R599-D713 PolarHBondContact N-O 3.18Å
714	E	86.1	Confident	74.9	Confident	40 Å²	40	54.5 Å²	54.5	19%	0.187	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	120.6	-175.8	-59.8	-167.3	104	0	0	111	R599 N601 R619 C711 F716	R599-E714 HydrophobicContact CB-CG 4.32Å; R599-E714 IonicContact NE-OE1 2.99Å; R599-E714 CarbonylContact O-C 3.49Å; R599-E714 WeakPolarHBondContact O-CA 3.39Å; N601-E714 PolarHBondContact ND2-OE1 3.41Å; N601-E714 VanDerWaalsContact ND2-OE1 3.14Å; R619-E714 IonicContact CZ-OE2 2.86Å; R619-E714 VanDerWaalsContact CZ-OE2 3.26Å; R619-E714 IonicContact NE-OE2 3.45Å; R619-E714 PolarHBondContact NE-OE2 3.13Å; R619-E714 VanDerWaalsContact NE-OE2 3.09Å; R619-E714 IonicContact NH2-OE2 2.69Å; R619-E714 PolarHBondContact NH2-OE2 3.04Å; C711-E714 WeakPolarHBondContact CB-O 3.33Å; E714-F716 HydrophobicContact CB-CE2 3.87Å; E714-F716 HydrophobicContact CB-CZ 4.15Å
715	V	91.4	Very high	74	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	133.2	175	65.7	0	0	0	0	109.9	L598 R599 V600 N601 I643 F685 I710	L598-V715 HydrophobicContact CB-CG1 4.38Å; R599-V715 PolarHBondContact O-N 2.94Å; V600-V715 CarbonylContact C-O 3.52Å; V600-V715 WeakPolarHBondContact CA-O 3.43Å; V600-V715 HydrophobicContact CB-CG1 4.05Å; V600-V715 HydrophobicContact CG1-CG1 4.21Å; V600-V715 HydrophobicContact CG2-CG1 3.7Å; N601-V715 PolarHBondContact N-O 2.77Å; I643-V715 HydrophobicContact CD1-CG1 4.42Å; F685-V715 HydrophobicContact CD1-CG2 3.7Å; F685-V715 HydrophobicContact CE1-CG2 3.89Å; I710-V715 HydrophobicContact CD1-CG2 4.19Å
716	F	91.3	Very high	72.3	Confident	5 Å²	5	55.5 Å²	55.5	2%	0.022	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	136.1	179.6	-65.1	-91.3	0	0	0	110.2	N601 I603 R619 L686 F694 E714	N601-F716 HydrophobicContact CB-CD1 3.74Å; N601-F716 HydrophobicContact CB-CE1 3.74Å; N601-F716 CarbonylContact O-C 3.55Å; N601-F716 VanDerWaalsContact O-CA 3.3Å; N601-F716 WeakPolarHBondContact O-CA 3.19Å; I603-F716 HydrophobicContact CD1-CB 4.45Å; I603-F716 HydrophobicContact CD1-CD1 3.88Å; I603-F716 HydrophobicContact CG1-CD1 4.48Å; R619-F716 HydrophobicContact CG-CE1 4.1Å; R619-F716 HydrophobicContact CG-CZ 3.78Å; L686-F716 HydrophobicContact CB-CB 3.94Å; L686-F716 HydrophobicContact CD1-CB 4.21Å; L686-F716 PolarHBondContact N-O 3.49Å; F694-F716 HydrophobicContact CE1-CB 4.02Å; F694-F716 HydrophobicContact CE1-CD1 4.36Å; F694-F716 AromaticContact CE1-CD2 3.55Å; F694-F716 HydrophobicContact CE1-CD2 3.55Å; F694-F716 HydrophobicContact CE1-CE2 4.11Å; F694-F716 AromaticContact CE1-CG 3.7Å; F694-F716 HydrophobicContact CE1-CG 3.7Å; F694-F716 HydrophobicContact CZ-CB 4.47Å; F694-F716 HydrophobicContact CZ-CD1 4.03Å; F694-F716 AromaticContact CZ-CD2 3.86Å; F694-F716 HydrophobicContact CZ-CD2 3.86Å; F694-F716 HydrophobicContact CZ-CE1 4.25Å; F694-F716 HydrophobicContact CZ-CE2 4.09Å; F694-F716 AromaticContact CZ-CG 3.84Å; F694-F716 HydrophobicContact CZ-CG 3.84Å; F694-F716 HydrophobicContact CZ-CZ 4.3Å; E714-F716 HydrophobicContact CB-CE2 3.87Å; E714-F716 HydrophobicContact CB-CZ 4.15Å
717	I	92.9	Very high	70	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.8	176.2	64.2	176	0	0	0	110.3	V600 N601 R602 I603 V625 I643 L679 W683 S684 F685	V600-I717 HydrophobicContact CG1-CD1 4Å; V600-I717 HydrophobicContact CG1-CG1 4.36Å; V600-I717 HydrophobicContact CG1-CG2 4.35Å; N601-I717 PolarHBondContact O-N 3.32Å; R602-I717 CarbonylContact C-O 3.53Å; R602-I717 WeakPolarHBondContact CA-O 3.42Å; R602-I717 HydrophobicContact CB-CD1 4.22Å; R602-I717 HydrophobicContact CB-CG1 3.84Å; I603-I717 PolarHBondContact N-O 3.5Å; V625-I717 HydrophobicContact CG2-CD1 4.4Å; I643-I717 HydrophobicContact CD1-CG2 4.48Å; L679-I717 HydrophobicContact CD1-CD1 3.41Å; L679-I717 VanDerWaalsContact CD1-CD1 3.41Å; L679-I717 HydrophobicContact CD2-CD1 3.56Å; L679-I717 HydrophobicContact CG-CD1 4.13Å; W683-I717 HydrophobicContact CD2-CD1 4.39Å; W683-I717 HydrophobicContact CE3-CB 3.77Å; W683-I717 HydrophobicContact CE3-CD1 4.33Å; W683-I717 HydrophobicContact CE3-CG2 3.65Å; W683-I717 HydrophobicContact CH2-CG2 4.25Å; W683-I717 HydrophobicContact CZ3-CB 4.11Å; W683-I717 HydrophobicContact CZ3-CG2 3.43Å; W683-I717 VanDerWaalsContact CZ3-CG2 3.43Å; S684-I717 CarbonylContact O-C 3.57Å; S684-I717 VanDerWaalsContact O-CA 3.32Å; S684-I717 WeakPolarHBondContact O-CA 3.34Å; F685-I717 HydrophobicContact CD1-CG2 4.05Å; F685-I717 HydrophobicContact CE1-CG2 4.27Å
718	L	89.4	Confident	68.1	Low	1 Å²	1	65.7 Å²	65.7	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	115.8	176.4	-173.5	64.7	0	0	0	109.2	I603 L605 Y608 W683 S684 L686	I603-L718 HydrophobicContact CG2-CD1 4.44Å; I603-L718 WeakPolarHBondContact O-CA 3.27Å; L605-L718 HydrophobicContact CD1-CD1 4.38Å; L605-L718 HydrophobicContact CD1-CD2 3.92Å; L605-L718 HydrophobicContact CD1-CG 4.35Å; Y608-L718 HydrophobicContact CD1-CD1 4.08Å; Y608-L718 HydrophobicContact CD1-CD2 4.1Å; Y608-L718 HydrophobicContact CD2-CD1 3.94Å; Y608-L718 HydrophobicContact CE1-CD2 4.19Å; Y608-L718 HydrophobicContact CG-CD1 3.6Å; Y608-L718 HydrophobicContact CG-CD2 4.41Å; W683-L718 CarbonylContact C-O 3.56Å; W683-L718 VanDerWaalsContact CA-O 3.26Å; W683-L718 WeakPolarHBondContact CA-O 3.37Å; W683-L718 WeakPolarHBondContact CB-O 3.46Å; S684-L718 PolarHBondContact N-O 3.32Å; S684-L718 PolarHBondContact O-N 2.8Å; L686-L718 HydrophobicContact CD1-CB 4.12Å; L686-L718 HydrophobicContact CD2-CB 3.96Å; L686-L718 HydrophobicContact CD2-CD2 4.31Å; L686-L718 HydrophobicContact CG-CB 4Å
719	D	87.2	Confident	65.6	Low	4 Å²	4	68.8 Å²	68.8	2%	0.021	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	119.7	178	-160.8	-7.9	0	0	0	109.6	I603 L605 S680	I603-D719 PolarHBondContact O-N 2.86Å; L605-D719 PolarHBondContact N-O 3.3Å; S680-D719 WeakPolarHBondContact CB-OD1 3.39Å; S680-D719 PolarHBondContact N-OD1 3.32Å; S680-D719 PolarHBondContact OG-OD1 3.11Å; S680-D719 VanDerWaalsContact OG-OD1 3.05Å
720	H	78.5	Confident	63.9	Low	32 Å²	32	71.2 Å²	71.2	15%	0.148	44%	0.441	C	S	.	.	S	Bend	trans	-83.8	-14.6	-172.3	-64.8	-79	0	0	0	113.1	S680 N682 S684 R696	S680-H720 PolarHBondContact OG-N 3.37Å; N682-H720 PolarHBondContact O-CD2 3.37Å; N682-H720 PolarHBondContact O-NE2 3.5Å; S684-H720 PolarHBondContact OG-NE2 3.3Å; R696-H720 PolarHBondContact NH1-CE1 2.86Å; R696-H720 PolarHBondContact NH2-CE1 3.35Å; R696-H720 PolarHBondContact NH2-NE2 2.98Å
721	E	65.4	Low	61.5	Low	135 Å²	135	76.2 Å²	76.2	63%	0.631	48%	0.482	S	S	*	.	S	Bend	trans	-123.1	98.7	176.1	-64.6	-167.9	163.1	0	0	109.3
722	G	54.3	Low	59.3	Low	46 Å²	46	79.2 Å²	79.2	47%	0.474	51%	0.514	S	S	.	.			trans	-68.8	143	-178.5	0	0	0	0	0	112.4	V724	G722-V724 PolarHBondContact O-N 2.73Å
723	P	49.8	Very low	57.5	Low	71 Å²	71	79.2 Å²	79.2	46%	0.461	52%	0.516	S	S	.	.			trans	-65.2	130.3	168.4	26.5	-31.6	0	0	0	110	G725	P723-G725 PolarHBondContact O-N 2.98Å
724	V	40.4	Very low	55.9	Low	151 Å²	151	76 Å²	76	92%	0.915	50%	0.501	S	S	*	.	S	Bend	trans	-68.7	98.2	173.1	-178.1	0	0	0	0	108.9	G722	G722-V724 PolarHBondContact O-N 2.73Å
725	G	39.6	Very low	54	Low	61 Å²	61	79 Å²	79	63%	0.629	52%	0.519	S	S	*	.			trans	77.6	115.2	157.1	0	0	0	0	0	117.2	P723	P723-G725 PolarHBondContact O-N 2.98Å
726	S	30.6	Very low	51.6	Low	130 Å²	130	83.1 Å²	83.1	91%	0.909	54%	0.54	S	S	*	.			trans	-176.1	137.4	133.8	-75.5	0	0	0	0	110.1
727	Q	32.5	Very low	49.2	Very low	197 Å²	197	84.6 Å²	84.6	92%	0.921	55%	0.549	S	S	*	.			trans	-66.2	159.2	-176.2	-73.4	178.1	-27.6	0	0	114.1
728	A	36.8	Very low	46.8	Very low	105 Å²	105	88.6 Å²	88.6	87%	0.868	57%	0.574	S	S	*	*			trans	-46.9	141.2	-179.3	0	0	0	0	0	116.2
729	S	28.5	Very low	44	Very low	118 Å²	118	94.8 Å²	94.8	83%	0.825	60%	0.603	S	S	*	*			trans	-153.6	133.5	145.2	53	0	0	0	0	110.6
730	S	42.5	Very low	41.1	Very low	121 Å²	121	99.9 Å²	99.9	85%	0.846	64%	0.636	S	S	*	*			trans	-77.9	128.3	173.6	56.7	0	0	0	0	110.8
731	A	29.4	Very low	39	Very low	107 Å²	107	103.5 Å²	103.5	88%	0.884	67%	0.671	S	S	*	*			trans	159.4	144.2	143	0	0	0	0	0	113
732	G	31.6	Very low	37.3	Very low	67 Å²	67	101.7 Å²	101.7	69%	0.691	68%	0.679	S	S	*	*			trans	114.1	121.9	155.8	0	0	0	0	0	116.6
733	M	32.8	Very low	35.9	Very low	154 Å²	154	102.7 Å²	102.7	76%	0.759	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-69.1	132.6	172.8	-86.1	-75.5	-150.6	0	0	111.9	I627	I627-M733 HydrophobicContact CD1-SD 4.28Å
734	P	43.5	Very low	34.7	Very low	50 Å²	50	107.8 Å²	107.8	33%	0.325	71%	0.712	S	S	.	*	P	Polyproline II helix	trans	-94.4	162.4	170.6	0.9	19.7	0	0	0	113.9
735	D	45.5	Very low	34.1	Very low	104 Å²	104	109 Å²	109	56%	0.556	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-61.5	153.9	-170.3	-85.2	-37.6	0	0	0	115.6	R659	R659-D735 IonicContact NH2-OD1 3.58Å; R659-D735 IonicContact NH2-OD2 3.98Å; R659-D735 PolarHBondContact NH2-OD2 3.37Å
736	L	40.9	Very low	33.3	Very low	87 Å²	87	114.2 Å²	114.2	46%	0.455	72%	0.722	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.1	124.9	-173.2	-164.1	97.7	0	0	0	111	I627 V629 V738	I627-L736 HydrophobicContact CB-CD1 4.36Å; I627-L736 HydrophobicContact CG2-CD1 4Å; V629-L736 HydrophobicContact CG2-CD1 4.43Å; L736-V738 HydrophobicContact CD2-CG2 3.52Å; L736-V738 HydrophobicContact CG-CG2 4.2Å
737	V	42	Very low	33.1	Very low	35 Å²	35	117.2 Å²	117.2	21%	0.212	72%	0.721	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.7	125.5	173.2	-177.3	0	0	0	0	109.9	L646	L646-V737 HydrophobicContact CD1-CG2 3.8Å
738	V	42.5	Very low	32.7	Very low	84 Å²	84	111.4 Å²	111.4	51%	0.509	72%	0.715	S	S	.	*			trans	-132.9	148.1	176.8	-177.6	0	0	0	0	108.8	L736	L736-V738 HydrophobicContact CD2-CG2 3.52Å; L736-V738 HydrophobicContact CG-CG2 4.2Å
739	E	30.5	Very low	32.1	Very low	132 Å²	132	113.7 Å²	113.7	62%	0.617	71%	0.712	S	S	*	*			trans	-36.3	131.7	178.3	-77.7	179.2	120.5	0	0	115.1	R595	R595-E739 IonicContact NH2-OE2 3.95Å; R595-E739 PolarHBondContact NH2-OE2 2.87Å
740	P	26.3	Very low	31.8	Very low	111 Å²	111	115.4 Å²	115.4	72%	0.721	71%	0.712	S	S	*	*			trans	-79.3	126.8	161.7	-2.5	19.9	0	0	0	110.4	A742	P740-A742 PolarHBondContact O-N 3.47Å
741	A	34.6	Very low	31.3	Very low	108 Å²	108	117.2 Å²	117.2	89%	0.893	71%	0.711	S	S	*	*			trans	-72.4	108.2	163.7	0	0	0	0	0	108.9
742	A	29	Very low	31.3	Very low	96 Å²	96	120.9 Å²	120.9	79%	0.793	71%	0.712	S	S	*	*			trans	-97.7	108.4	-175.3	0	0	0	0	0	112.9	P740	P740-A742 PolarHBondContact O-N 3.47Å
743	G	24.6	Very low	31	Very low	68 Å²	68	128 Å²	128	70%	0.701	72%	0.724	S	S	*	*			trans	-120.4	143.7	148.5	0	0	0	0	0	110
744	L	24.7	Very low	30.6	Very low	178 Å²	178	132.7 Å²	132.7	93%	0.932	73%	0.734	S	S	*	*			trans	86.8	140.1	169.1	-69	158.7	0	0	0	120
745	Q	28.4	Very low	29.8	Very low	175 Å²	175	135.8 Å²	135.8	82%	0.818	76%	0.756	S	S	*	*			trans	-80.6	158.2	-156.9	-69.5	158.2	-17.6	0	0	115.6
746	N	22.8	Very low	29	Very low	172 Å²	172	139.3 Å²	139.3	92%	0.92	77%	0.769	S	S	*	*			trans	-150.8	139.4	132.2	-118.3	-12.5	0	0	0	112.3
747	Q	26.8	Very low	28.3	Very low	192 Å²	192	146.5 Å²	146.5	90%	0.897	79%	0.792	S	S	*	*			trans	-83.8	147.3	179.3	-72.4	173.5	-9.7	0	0	111.6
748	G	22.6	Very low	27.6	Very low	76 Å²	76	151.9 Å²	151.9	78%	0.784	82%	0.818	S	S	*	*			trans	153.9	117.5	163.3	0	0	0	0	0	113.7
749	N	24.5	Very low	26.8	Very low	153 Å²	153	156 Å²	156	82%	0.818	83%	0.832	S	S	*	*			trans	-39.1	142.7	179.5	-62.4	-22	0	0	0	115.8
750	D	22.6	Very low	26.6	Very low	154 Å²	154	156.5 Å²	156.5	82%	0.824	84%	0.844	S	S	*	*				-165.7	149.2	100.6	-121.7	-29	0	0	0	114.7
751	L	31.8	Very low	26.6	Very low	159 Å²	159	158.8 Å²	158.8	83%	0.832	85%	0.849	S	S	*	*			trans	-72.8	115.7	179.9	-74.2	117.2	0	0	0	111.5
752	M	29.3	Very low	26.1	Very low	183 Å²	183	160.4 Å²	160.4	90%	0.901	84%	0.843	S	S	*	*			trans	170.2	105	145.6	-104.7	178.7	167	0	0	109.2
753	K	25.1	Very low	25.9	Very low	217 Å²	217	163 Å²	163	94%	0.943	85%	0.848	S	S	*	*			trans	162.9	77.1	150.6	-91.6	165.6	-174.7	-175.9	0	107.6
754	R	25.8	Very low	25.9	Very low	253 Å²	253	164.4 Å²	164.4	96%	0.955	85%	0.853	S	S	*	*			trans	-124.2	84.8	166.4	-160.6	177.5	-170.6	174.2	2.2	106.2
755	S	26.4	Very low	26	Very low	115 Å²	115	160.5 Å²	160.5	80%	0.804	85%	0.847	S	S	*	*			trans	-155.1	140.6	163.2	-165.5	0	0	0	0	107.6
756	E	28.8	Very low	25.8	Very low	177 Å²	177	159.5 Å²	159.5	83%	0.827	85%	0.853	S	S	*	*	S	Bend	trans	78.4	69.9	-177	-63	-179.4	153.6	0	0	116.4
757	Y	24.9	Very low	25.8	Very low	238 Å²	238	155.9 Å²	155.9	93%	0.933	85%	0.847	S	S	*	*			trans	-159	69.9	145.3	-111.1	-78.8	0	0	0	108.7
758	I	27	Very low	25.7	Very low	149 Å²	149	152.5 Å²	152.5	76%	0.764	84%	0.844	S	S	*	*			trans	-143.1	90.6	162.7	-58.6	-176.2	0	0	0	107.5
759	E	26.9	Very low	26	Very low	169 Å²	169	155.3 Å²	155.3	79%	0.79	85%	0.846	S	S	*	*			trans	-162.7	57.3	156	-133.7	-179.1	-169.5	0	0	114.5
760	V	25.7	Very low	26	Very low	144 Å²	144	156.8 Å²	156.8	87%	0.873	85%	0.847	S	S	*	*	S	Bend	trans	-149.7	58.9	153	-162.5	0	0	0	0	110.6
761	L	26.6	Very low	26.2	Very low	159 Å²	159	156.8 Å²	156.8	83%	0.832	84%	0.842	S	S	*	*			trans	-140.6	94.9	166	-82.8	171.7	0	0	0	108.7
762	N	23.2	Very low	26	Very low	141 Å²	141	157.1 Å²	157.1	75%	0.754	84%	0.839	S	S	*	*			trans	174	90.7	145.9	-93.1	-27.7	0	0	0	111.1
763	V	25	Very low	25.7	Very low	150 Å²	150	156.6 Å²	156.6	91%	0.909	84%	0.837	S	S	*	*	S	Bend		-161.5	100.8	125.5	-179.3	0	0	0	0	106.7
764	A	25.1	Very low	25.8	Very low	98 Å²	98	151.1 Å²	151.1	81%	0.81	83%	0.826	S	S	*	*	S	Bend	trans	146.8	61.1	154	0	0	0	0	0	112.3
765	A	26.1	Very low	25.9	Very low	96 Å²	96	147.3 Å²	147.3	79%	0.793	82%	0.824	S	S	*	*			trans	-159.5	73.2	165.2	0	0	0	0	0	112.2
766	V	25.3	Very low	25.9	Very low	155 Å²	155	148.8 Å²	148.8	94%	0.939	82%	0.822	S	S	*	*			trans	-140.5	77.2	152.9	-166.1	0	0	0	0	109.2
767	A	23.2	Very low	25.9	Very low	96 Å²	96	147.6 Å²	147.6	79%	0.793	82%	0.821	S	S	*	*	S	Bend	trans	-159.5	107	150.8	0	0	0	0	0	109.7
768	S	24.6	Very low	26.1	Very low	121 Å²	121	139 Å²	139	85%	0.846	81%	0.806	S	S	*	*			trans	79.9	92	158.4	-142.3	0	0	0	0	118.3
769	V	27.2	Very low	26.3	Very low	135 Å²	135	139 Å²	139	82%	0.818	80%	0.801	S	S	*	*			trans	-122.5	116.7	141.7	178.1	0	0	0	0	107.8
770	H	26	Very low	26.6	Very low	183 Å²	183	137 Å²	137	85%	0.847	79%	0.794	S	S	*	*			trans	-151	99.4	152	-102.8	-74.7	0	0	0	108.9
771	H	27.1	Very low	26.8	Very low	155 Å²	155	137.1 Å²	137.1	72%	0.718	79%	0.789	S	S	*	*				-173.9	111.8	115.9	-126.1	-63.1	0	0	0	112.2
772	Q	26.7	Very low	27.1	Very low	165 Å²	165	136.8 Å²	136.8	77%	0.771	78%	0.783	S	S	*	*			trans	25.8	139.4	146.6	-71.4	169.7	-30.1	0	0	121.1
773	M	22	Very low	27.5	Very low	173 Å²	173	135.9 Å²	135.9	85%	0.852	78%	0.776	S	S	*	*			cis	-144.9	136.2	45.3	-70.3	-178.4	71.4	0	0	115.6
774	S	28.4	Very low	28.1	Very low	102 Å²	102	134.4 Å²	134.4	71%	0.713	76%	0.762	S	S	*	*			trans	28.4	113.1	151.1	69.9	0	0	0	0	122.4
775	L	27.6	Very low	28.9	Very low	173 Å²	173	135.8 Å²	135.8	91%	0.906	76%	0.755	S	S	*	*	S	Bend		-147.2	113.5	128.5	-89.4	170.6	0	0	0	108
776	D	27	Very low	30.2	Very low	146 Å²	146	135.1 Å²	135.1	78%	0.781	75%	0.75	S	S	*	*			trans	11.7	107.8	172.4	-65	-21	0	0	0	121.5	G778	D776-G778 PolarHBondContact O-N 2.94Å
777	D	27.2	Very low	32	Very low	151 Å²	151	133.3 Å²	133.3	81%	0.807	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	17.7	174.3	-85.6	-39	0	0	0	116
778	G	29.3	Very low	34.5	Very low	59 Å²	59	131.3 Å²	131.3	61%	0.608	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-30.6	-178.2	0	0	0	0	0	115	D776	D776-G778 PolarHBondContact O-N 2.94Å
779	F	32.6	Very low	37.3	Very low	148 Å²	148	128.7 Å²	128.7	65%	0.649	70%	0.696	S	S	*	*	S	Bend	trans	-99	-26.8	-163.4	-155.8	-100.6	0	0	0	113.9	Q782 M783	F779-Q782 PolarHBondContact O-N 3.3Å; F779-M783 HydrophobicContact CD1-SD 4.26Å; F779-M783 HydrophobicContact CE1-SD 4Å
780	I	32.1	Very low	39.9	Very low	126 Å²	126	127.3 Å²	127.3	65%	0.646	69%	0.69	S	S	*	*	S	Bend	trans	-79.9	-29.8	-175.4	-65.5	-164.7	0	0	0	112.7	Q782 M783	I780-Q782 PolarHBondContact O-N 3.49Å; I780-M783 PolarHBondContact O-N 2.82Å
781	L	30.9	Very low	42.5	Very low	148 Å²	148	122.6 Å²	122.6	78%	0.775	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-17.5	172.9	-92.3	159.5	0	0	0	113.1
782	Q	33	Very low	45.3	Very low	151 Å²	151	117.9 Å²	117.9	71%	0.706	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-14.9	-179.6	-145.2	165.8	9.7	0	0	113.3	F779 I780	F779-Q782 PolarHBondContact O-N 3.3Å; I780-Q782 PolarHBondContact O-N 3.49Å
783	M	31.3	Very low	48.2	Very low	123 Å²	123	114.3 Å²	114.3	61%	0.606	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-14.6	-178.3	-73	-169	67.2	0	0	114.9	F779 I780	F779-M783 HydrophobicContact CD1-SD 4.26Å; F779-M783 HydrophobicContact CE1-SD 4Å; I780-M783 PolarHBondContact O-N 2.82Å
784	I	36.5	Very low	51.2	Low	119 Å²	119	107.7 Å²	107.7	61%	0.61	61%	0.606	S	S	*	*	S	Bend	trans	-93.6	-14.4	-178.8	-62.6	175.4	0	0	0	112.4
785	N	42.1	Very low	54.2	Low	126 Å²	126	103 Å²	103	67%	0.674	57%	0.572	S	S	*	*			trans	-121.9	61.2	175.9	-90.5	-0.9	0	0	0	110.8	P787	N785-P787 WeakPolarHBondContact O-CD 3.42Å
786	A	53.5	Low	57.1	Low	83 Å²	83	95 Å²	95	69%	0.686	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-61.1	124.5	160.7	0	0	0	0	0	107.4	L788	A786-L788 PolarHBondContact O-N 2.86Å
787	P	63.5	Low	60.1	Low	117 Å²	117	91.1 Å²	91.1	76%	0.76	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-62.3	134.1	178.3	24	-30.6	0	0	0	109	N785 T789	N785-P787 WeakPolarHBondContact O-CD 3.42Å; P787-T789 PolarHBondContact O-N 2.81Å
788	L	75.8	Confident	63.1	Low	53 Å²	53	83.9 Å²	83.9	28%	0.277	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-50.6	134.7	172.6	-74.3	160.4	0	0	0	109	A786 E792 Q793 L796 V819	A786-L788 PolarHBondContact O-N 2.86Å; L788-E792 HydrophobicContact CB-CB 4.33Å; L788-E792 HydrophobicContact CD2-CB 3.88Å; L788-Q793 HydrophobicContact CB-CB 4.33Å; L788-L796 HydrophobicContact CD1-CD1 4.01Å; L788-L796 HydrophobicContact CD2-CD1 4.38Å; L788-V819 HydrophobicContact CD2-CG1 3.71Å
789	T	84.2	Confident	66	Low	66 Å²	66	81.1 Å²	81.1	41%	0.405	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-60.4	153.7	170.8	61.5	0	0	0	0	109.5	P787 D791 E792 Q793	P787-T789 PolarHBondContact O-N 2.81Å; T789-D791 PolarHBondContact O-N 2.83Å; T789-D791 VanDerWaalsContact O-N 3.14Å; T789-E792 WeakPolarHBondContact CB-OE2 3.45Å; T789-E792 WeakPolarHBondContact CG2-OE2 3.35Å; T789-E792 PolarHBondContact N-OE2 3.02Å; T789-E792 PolarHBondContact O-N 3.21Å; T789-E792 VanDerWaalsContact O-N 3.12Å; T789-E792 WeakPolarHBondContact OG1-CB 3.37Å; T789-E792 WeakPolarHBondContact OG1-CG 3.49Å; T789-E792 PolarHBondContact OG1-N 2.96Å; T789-E792 PolarHBondContact OG1-OE2 3.43Å; T789-Q793 PolarHBondContact O-N 3.31Å
790	P	81.9	Confident	68.7	Low	107 Å²	107	76.4 Å²	76.4	70%	0.695	43%	0.43	S	S	*	.	H	α-helix	trans	-54.1	-34.3	177.8	-27.3	35.4	0	0	0	113.2	A794	P790-A794 VanDerWaalsContact O-CB 3.22Å; P790-A794 WeakPolarHBondContact O-CB 3.5Å; P790-A794 PolarHBondContact O-N 3.46Å
791	D	79.9	Confident	71.5	Confident	83 Å²	83	74.7 Å²	74.7	44%	0.444	43%	0.426	S	S	.	.	H	α-helix	trans	-73.6	-38.1	179.4	-65.7	-36.1	0	0	0	112.5	T789 A794 L795 V815	T789-D791 PolarHBondContact O-N 2.83Å; T789-D791 VanDerWaalsContact O-N 3.14Å; D791-A794 PolarHBondContact O-N 3.45Å; D791-L795 WeakPolarHBondContact O-CB 3.21Å; D791-L795 PolarHBondContact O-N 3.13Å; D791-V815 HydrophobicContact CB-CG2 3.92Å
792	E	85.6	Confident	74.2	Confident	56 Å²	56	69.1 Å²	69.1	26%	0.262	40%	0.404	S	S	.	.	H	α-helix	trans	-65.5	-44.1	172.4	-76.1	170.6	147.6	0	0	111.8	L788 T789 A794 L795 L796 V815 V819	L788-E792 HydrophobicContact CB-CB 4.33Å; L788-E792 HydrophobicContact CD2-CB 3.88Å; T789-E792 WeakPolarHBondContact CB-OE2 3.45Å; T789-E792 WeakPolarHBondContact CG2-OE2 3.35Å; T789-E792 PolarHBondContact N-OE2 3.02Å; T789-E792 PolarHBondContact O-N 3.21Å; T789-E792 VanDerWaalsContact O-N 3.12Å; T789-E792 WeakPolarHBondContact OG1-CB 3.37Å; T789-E792 WeakPolarHBondContact OG1-CG 3.49Å; T789-E792 PolarHBondContact OG1-N 2.96Å; T789-E792 PolarHBondContact OG1-OE2 3.43Å; E792-A794 VanDerWaalsContact C-N 3.33Å; E792-A794 PolarHBondContact O-N 2.88Å; E792-L795 PolarHBondContact O-N 3.04Å; E792-L796 WeakPolarHBondContact O-CG 3.48Å; E792-L796 PolarHBondContact O-N 2.97Å; E792-V815 HydrophobicContact CG-CG1 3.91Å; E792-V819 HydrophobicContact CB-CG1 3.73Å; E792-V819 HydrophobicContact CG-CB 4.5Å; E792-V819 HydrophobicContact CG-CG1 3.88Å; E792-V819 HydrophobicContact CG-CG2 3.77Å
793	Q	87.4	Confident	76.9	Confident	90 Å²	90	65.2 Å²	65.2	42%	0.421	39%	0.388	S	S	.	.	H	α-helix	trans	-64.2	-39.5	175.5	-173.8	62	49.7	0	0	111.3	L788 T789 T797	L788-Q793 HydrophobicContact CB-CB 4.33Å; T789-Q793 PolarHBondContact O-N 3.31Å; Q793-T797 WeakPolarHBondContact O-CB 3.46Å; Q793-T797 PolarHBondContact O-N 3.03Å; Q793-T797 PolarHBondContact O-OG1 2.74Å
794	A	85.3	Confident	79.6	Confident	35 Å²	35	62 Å²	62	29%	0.289	37%	0.373	S	S	.	.	H	α-helix	trans	-64.4	-41.1	175.3	0	0	0	0	0	111.7	P790 D791 E792 T797 A798	P790-A794 VanDerWaalsContact O-CB 3.22Å; P790-A794 WeakPolarHBondContact O-CB 3.5Å; P790-A794 PolarHBondContact O-N 3.46Å; D791-A794 PolarHBondContact O-N 3.45Å; E792-A794 VanDerWaalsContact C-N 3.33Å; E792-A794 PolarHBondContact O-N 2.88Å; A794-T797 PolarHBondContact O-N 3.21Å; A794-A798 WeakPolarHBondContact O-CB 3.45Å; A794-A798 PolarHBondContact O-N 3.29Å
795	L	90.7	Very high	82	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.016	38%	0.376	C	S	.	.	H	α-helix	trans	-64.4	-43.5	177.3	-176	142	0	0	0	112.3	D791 E792 A798 A799 V811 V815 L817 A827	D791-L795 WeakPolarHBondContact O-CB 3.21Å; D791-L795 PolarHBondContact O-N 3.13Å; E792-L795 PolarHBondContact O-N 3.04Å; L795-A798 WeakPolarHBondContact O-CB 3.33Å; L795-A798 PolarHBondContact O-N 3.4Å; L795-A799 WeakPolarHBondContact O-CB 3.43Å; L795-A799 PolarHBondContact O-N 3.41Å; L795-V811 HydrophobicContact CD1-CG2 4.09Å; L795-V815 HydrophobicContact CB-CG1 4.19Å; L795-V815 HydrophobicContact CD1-CB 3.89Å; L795-V815 HydrophobicContact CD1-CG1 3.76Å; L795-V815 HydrophobicContact CG-CG1 4.45Å; L795-L817 HydrophobicContact CD2-CD2 4.48Å; L795-A827 HydrophobicContact CD2-CB 3.88Å
796	L	90.4	Very high	84	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-67.7	-36.4	175.7	-67.2	175.8	0	0	0	112.1	L788 E792 A799 S800 V819 D821 A827 L830	L788-L796 HydrophobicContact CD1-CD1 4.01Å; L788-L796 HydrophobicContact CD2-CD1 4.38Å; E792-L796 WeakPolarHBondContact O-CG 3.48Å; E792-L796 PolarHBondContact O-N 2.97Å; L796-A799 WeakPolarHBondContact O-CB 3.3Å; L796-A799 PolarHBondContact O-N 3.3Å; L796-S800 PolarHBondContact O-N 3.33Å; L796-V819 HydrophobicContact CD1-CG1 3.94Å; L796-V819 HydrophobicContact CD2-CG1 4.46Å; L796-V819 HydrophobicContact CG-CG1 4.14Å; L796-D821 HydrophobicContact CD1-CB 3.98Å; L796-A827 HydrophobicContact CD2-CB 4.39Å; L796-L830 HydrophobicContact CB-CD1 4.02Å; L796-L830 HydrophobicContact CD2-CD1 4.01Å; L796-L830 WeakPolarHBondContact O-CD1 3.33Å
797	T	89.3	Confident	85.7	Confident	65 Å²	65	55.5 Å²	55.5	40%	0.399	33%	0.327	S	S	.	.	H	α-helix	trans	-65.6	-41.8	174.4	-53.9	0	0	0	0	110.9	Q793 A794 A799 S800 T801	Q793-T797 WeakPolarHBondContact O-CB 3.46Å; Q793-T797 PolarHBondContact O-N 3.03Å; Q793-T797 PolarHBondContact O-OG1 2.74Å; A794-T797 PolarHBondContact O-N 3.21Å; T797-A799 VanDerWaalsContact C-N 3.32Å; T797-A799 PolarHBondContact O-N 3.17Å; T797-S800 PolarHBondContact O-N 2.95Å; T797-T801 HydrophobicContact CG2-CG2 4.27Å; T797-T801 WeakPolarHBondContact O-CB 3.46Å; T797-T801 WeakPolarHBondContact O-CG2 3.34Å; T797-T801 PolarHBondContact O-N 2.96Å; T797-T801 PolarHBondContact O-OG1 3.48Å
798	A	89.8	Confident	86.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.2	-43.4	173.4	0	0	0	0	0	111.2	A794 L795 S800 T801 G802 D803 L806 L807	A794-A798 WeakPolarHBondContact O-CB 3.45Å; A794-A798 PolarHBondContact O-N 3.29Å; L795-A798 WeakPolarHBondContact O-CB 3.33Å; L795-A798 PolarHBondContact O-N 3.4Å; A798-S800 VanDerWaalsContact C-N 3.32Å; A798-S800 PolarHBondContact O-N 3.44Å; A798-T801 PolarHBondContact O-N 3.37Å; A798-T801 PolarHBondContact O-OG1 3.12Å; A798-G802 PolarHBondContact O-N 3.43Å; A798-D803 HydrophobicContact CB-CB 4.37Å; A798-D803 PolarHBondContact O-N 3.41Å; A798-D803 VanDerWaalsContact O-N 3.13Å; A798-L806 HydrophobicContact CB-CB 3.95Å; A798-L806 HydrophobicContact CB-CD2 3.92Å; A798-L806 HydrophobicContact CB-CG 3.95Å; A798-L807 HydrophobicContact CB-CB 4.03Å
799	A	90.1	Very high	87	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.2	-36.6	176.4	0	0	0	0	0	113.1	L795 L796 T797 L807 A827 L830 A831 H836	L795-A799 WeakPolarHBondContact O-CB 3.43Å; L795-A799 PolarHBondContact O-N 3.41Å; L796-A799 WeakPolarHBondContact O-CB 3.3Å; L796-A799 PolarHBondContact O-N 3.3Å; T797-A799 VanDerWaalsContact C-N 3.32Å; T797-A799 PolarHBondContact O-N 3.17Å; A799-L807 HydrophobicContact CB-CD1 3.77Å; A799-A827 HydrophobicContact CB-CB 3.78Å; A799-L830 HydrophobicContact CB-CB 4.21Å; A799-A831 WeakPolarHBondContact O-CA 3.49Å; A799-H836 PolarHBondContact O-CD2 2.63Å
800	S	90.3	Very high	86.8	Confident	49 Å²	49	49.7 Å²	49.7	34%	0.343	29%	0.287	S	S	.	.	H	α-helix	trans	-76.4	-36	176.7	-172.7	0	0	0	0	113.1	L796 T797 A798 N834 H836	L796-S800 PolarHBondContact O-N 3.33Å; T797-S800 PolarHBondContact O-N 2.95Å; A798-S800 VanDerWaalsContact C-N 3.32Å; A798-S800 PolarHBondContact O-N 3.44Å; S800-N834 PolarHBondContact O-ND2 3.06Å; S800-H836 PolarHBondContact O-NE2 3.17Å
801	T	89.6	Confident	86.8	Confident	91 Å²	91	46.4 Å²	46.4	56%	0.558	27%	0.265	S	S	*	.	H	α-helix	trans	-89.5	-15.2	-173.8	52.6	0	0	0	0	114	T797 A798	T797-T801 HydrophobicContact CG2-CG2 4.27Å; T797-T801 WeakPolarHBondContact O-CB 3.46Å; T797-T801 WeakPolarHBondContact O-CG2 3.34Å; T797-T801 PolarHBondContact O-N 2.96Å; T797-T801 PolarHBondContact O-OG1 3.48Å; A798-T801 PolarHBondContact O-N 3.37Å; A798-T801 PolarHBondContact O-OG1 3.12Å
802	G	89	Confident	86.7	Confident	30 Å²	30	50.8 Å²	50.8	31%	0.309	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.5	10	-179.8	0	0	0	0	0	114.3	A798 L804 H836	A798-G802 PolarHBondContact O-N 3.43Å; G802-L804 PolarHBondContact O-N 2.97Å; G802-L804 VanDerWaalsContact O-N 3.07Å; G802-H836 PolarHBondContact N-NE2 3.13Å
803	D	89.8	Confident	86.2	Confident	70 Å²	70	54.6 Å²	54.6	37%	0.374	29%	0.287	S	S	.	.			trans	-80	92	-177.2	-168.1	-23.6	0	0	0	111.6	A798 L805 L806 L807	A798-D803 HydrophobicContact CB-CB 4.37Å; A798-D803 PolarHBondContact O-N 3.41Å; A798-D803 VanDerWaalsContact O-N 3.13Å; D803-L805 VanDerWaalsContact C-N 3.32Å; D803-L805 PolarHBondContact O-N 3.46Å; D803-L805 PolarHBondContact OD1-N 2.83Å; D803-L805 VanDerWaalsContact OD1-N 3.08Å; D803-L806 HydrophobicContact CB-CB 4.09Å; D803-L806 PolarHBondContact OD1-N 3.34Å; D803-L807 WeakPolarHBondContact O-CB 3.39Å; D803-L807 PolarHBondContact O-N 2.89Å; D803-L807 VanDerWaalsContact O-N 3.1Å
804	L	88.2	Confident	85.5	Confident	55 Å²	55	53.4 Å²	53.4	29%	0.288	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-37.6	178	178.9	64.3	0	0	0	112.9	G802 L807 M808 D838 L839 F842	G802-L804 PolarHBondContact O-N 2.97Å; G802-L804 VanDerWaalsContact O-N 3.07Å; L804-L807 PolarHBondContact O-N 2.67Å; L804-M808 HydrophobicContact CD1-CG 3.99Å; L804-M808 HydrophobicContact CD1-SD 4.14Å; L804-M808 HydrophobicContact CD2-SD 4.46Å; L804-M808 HydrophobicContact CG-CG 4.25Å; L804-M808 HydrophobicContact CG-SD 3.93Å; L804-M808 WeakPolarHBondContact O-CB 3.49Å; L804-M808 WeakPolarHBondContact O-CG 3.44Å; L804-M808 PolarHBondContact O-N 2.95Å; L804-D838 HydrophobicContact CD2-CB 4.32Å; L804-L839 HydrophobicContact CB-CD2 4.04Å; L804-L839 HydrophobicContact CD1-CD2 3.8Å; L804-F842 HydrophobicContact CD1-CB 3.79Å; L804-F842 HydrophobicContact CD1-CD1 4.4Å; L804-F842 HydrophobicContact CD1-CD2 4.44Å; L804-F842 HydrophobicContact CD1-CG 3.95Å
805	L	85.2	Confident	85.1	Confident	128 Å²	128	52.8 Å²	52.8	67%	0.67	29%	0.292	S	S	*	.	H	α-helix	trans	-69.4	-43.4	-176.3	-68.3	176	0	0	0	110.9	D803 M808 D809	D803-L805 VanDerWaalsContact C-N 3.32Å; D803-L805 PolarHBondContact O-N 3.46Å; D803-L805 PolarHBondContact OD1-N 2.83Å; D803-L805 VanDerWaalsContact OD1-N 3.08Å; L805-M808 PolarHBondContact O-N 2.97Å; L805-D809 WeakPolarHBondContact O-CB 3.4Å; L805-D809 PolarHBondContact O-N 3.23Å
806	L	84.8	Confident	84.6	Confident	64 Å²	64	55.3 Å²	55.3	34%	0.335	31%	0.31	S	S	.	.	H	α-helix	trans	-66.7	-39.2	177.4	-173.1	61.7	0	0	0	111.7	A798 D803 D809 G810	A798-L806 HydrophobicContact CB-CB 3.95Å; A798-L806 HydrophobicContact CB-CD2 3.92Å; A798-L806 HydrophobicContact CB-CG 3.95Å; D803-L806 HydrophobicContact CB-CB 4.09Å; D803-L806 PolarHBondContact OD1-N 3.34Å; L806-D809 PolarHBondContact O-N 3.01Å; L806-G810 PolarHBondContact O-N 2.87Å
807	L	89.3	Confident	84.3	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.4	-43.1	176	-169.9	137.5	0	0	0	111.9	A798 A799 D803 L804 D809 G810 V811 L817 L839 F842 I843	A798-L807 HydrophobicContact CB-CB 4.03Å; A799-L807 HydrophobicContact CB-CD1 3.77Å; D803-L807 WeakPolarHBondContact O-CB 3.39Å; D803-L807 PolarHBondContact O-N 2.89Å; D803-L807 VanDerWaalsContact O-N 3.1Å; L804-L807 PolarHBondContact O-N 2.67Å; L807-D809 VanDerWaalsContact C-N 3.33Å; L807-D809 PolarHBondContact O-N 3.43Å; L807-G810 PolarHBondContact O-N 2.96Å; L807-V811 HydrophobicContact CD2-CG2 4.48Å; L807-V811 WeakPolarHBondContact O-CG2 3.41Å; L807-V811 PolarHBondContact O-N 2.94Å; L807-L817 HydrophobicContact CD2-CD2 4.46Å; L807-L839 HydrophobicContact CB-CD2 3.84Å; L807-L839 HydrophobicContact CD1-CD2 3.86Å; L807-L839 HydrophobicContact CD2-CD2 4.04Å; L807-L839 HydrophobicContact CG-CD2 4.11Å; L807-F842 HydrophobicContact CD2-CD1 3.4Å; L807-F842 VanDerWaalsContact CD2-CD1 3.4Å; L807-F842 HydrophobicContact CD2-CE1 3.55Å; L807-I843 HydrophobicContact CD1-CD1 4.19Å; L807-I843 HydrophobicContact CD2-CG1 4.12Å
808	M	84.8	Confident	83.9	Confident	49 Å²	49	55.7 Å²	55.7	24%	0.241	31%	0.309	C	S	.	.	H	α-helix	trans	-61.3	-40.8	174.5	-73.7	178.8	83.6	0	0	112.2	L804 L805 V811 R812 F842	L804-M808 HydrophobicContact CD1-CG 3.99Å; L804-M808 HydrophobicContact CD1-SD 4.14Å; L804-M808 HydrophobicContact CD2-SD 4.46Å; L804-M808 HydrophobicContact CG-CG 4.25Å; L804-M808 HydrophobicContact CG-SD 3.93Å; L804-M808 WeakPolarHBondContact O-CB 3.49Å; L804-M808 WeakPolarHBondContact O-CG 3.44Å; L804-M808 PolarHBondContact O-N 2.95Å; L805-M808 PolarHBondContact O-N 2.97Å; M808-V811 PolarHBondContact O-N 3.47Å; M808-R812 WeakPolarHBondContact O-CG 3.38Å; M808-R812 PolarHBondContact O-N 2.91Å; M808-F842 HydrophobicContact CB-CZ 4.21Å; M808-F842 HydrophobicContact CE-CD2 4.4Å; M808-F842 HydrophobicContact CE-CE2 3.89Å; M808-F842 HydrophobicContact CG-CD1 4.37Å; M808-F842 HydrophobicContact CG-CD2 4.01Å; M808-F842 HydrophobicContact CG-CE1 3.99Å; M808-F842 HydrophobicContact CG-CE2 3.6Å; M808-F842 HydrophobicContact CG-CG 4.38Å; M808-F842 HydrophobicContact CG-CZ 3.58Å; M808-F842 HydrophobicContact SD-CE2 4.33Å
809	D	81.9	Confident	83.7	Confident	61 Å²	61	56.4 Å²	56.4	33%	0.326	31%	0.313	S	S	.	.	H	α-helix	trans	-70.4	-35.1	179.7	-166.1	52.9	0	0	0	112.2	L805 L806 L807 R813	L805-D809 WeakPolarHBondContact O-CB 3.4Å; L805-D809 PolarHBondContact O-N 3.23Å; L806-D809 PolarHBondContact O-N 3.01Å; L807-D809 VanDerWaalsContact C-N 3.33Å; L807-D809 PolarHBondContact O-N 3.43Å; D809-R813 WeakPolarHBondContact O-CG 3.34Å; D809-R813 PolarHBondContact O-N 2.95Å; D809-R813 VanDerWaalsContact O-N 3.12Å; D809-R813 PolarHBondContact O-NE 3.1Å; D809-R813 VanDerWaalsContact O-NE 3.17Å; D809-R813 IonicContact OD2-CZ 3.04Å; D809-R813 IonicContact OD2-NE 2.65Å; D809-R813 PolarHBondContact OD2-NE 3.18Å; D809-R813 IonicContact OD2-NH1 3.26Å; D809-R813 IonicContact OD2-NH2 3.55Å; D809-R813 PolarHBondContact OD2-NH2 3.41Å
810	G	79.6	Confident	83.4	Confident	4 Å²	4	60 Å²	60	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-62.6	-46.2	170.3	0	0	0	0	0	112.5	L806 L807 R812 R813 G814 V815	L806-G810 PolarHBondContact O-N 2.87Å; L807-G810 PolarHBondContact O-N 2.96Å; G810-R812 PolarHBondContact O-N 3.31Å; G810-R813 PolarHBondContact O-N 3.48Å; G810-G814 PolarHBondContact O-N 3.02Å; G810-V815 WeakPolarHBondContact O-CB 3.44Å; G810-V815 WeakPolarHBondContact O-CG2 3.49Å; G810-V815 PolarHBondContact O-N 3Å; G810-V815 VanDerWaalsContact O-N 3.11Å
811	V	82.3	Confident	83.1	Confident	37 Å²	37	59.7 Å²	59.7	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-64.8	-40.3	177	174.8	0	0	0	0	111.7	L795 L807 M808 R813 G814 L817 F842	L795-V811 HydrophobicContact CD1-CG2 4.09Å; L807-V811 HydrophobicContact CD2-CG2 4.48Å; L807-V811 WeakPolarHBondContact O-CG2 3.41Å; L807-V811 PolarHBondContact O-N 2.94Å; M808-V811 PolarHBondContact O-N 3.47Å; V811-R813 PolarHBondContact O-N 3.29Å; V811-G814 PolarHBondContact O-N 2.97Å; V811-L817 HydrophobicContact CG2-CD1 4.29Å; V811-L817 HydrophobicContact CG2-CD2 3.67Å; V811-L817 HydrophobicContact CG2-CG 3.91Å; V811-F842 HydrophobicContact CB-CE1 4.48Å; V811-F842 HydrophobicContact CG2-CE1 4.2Å
812	R	77.4	Confident	82.6	Confident	175 Å²	175	61 Å²	61	66%	0.66	33%	0.334	S	S	*	.	H	α-helix	trans	-62.7	-29.5	174.6	-77.3	-174	-137.4	148.7	3.7	113.4	M808 G810 G814	M808-R812 WeakPolarHBondContact O-CG 3.38Å; M808-R812 PolarHBondContact O-N 2.91Å; G810-R812 PolarHBondContact O-N 3.31Å; R812-G814 PolarHBondContact O-N 3.17Å
813	R	75.7	Confident	82	Confident	137 Å²	137	60 Å²	60	52%	0.517	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	1.9	174.5	-74.8	-178.2	-76.5	-163.8	-4.6	113.6	D809 G810 V811	D809-R813 WeakPolarHBondContact O-CG 3.34Å; D809-R813 PolarHBondContact O-N 2.95Å; D809-R813 VanDerWaalsContact O-N 3.12Å; D809-R813 PolarHBondContact O-NE 3.1Å; D809-R813 VanDerWaalsContact O-NE 3.17Å; D809-R813 IonicContact OD2-CZ 3.04Å; D809-R813 IonicContact OD2-NE 2.65Å; D809-R813 PolarHBondContact OD2-NE 3.18Å; D809-R813 IonicContact OD2-NH1 3.26Å; D809-R813 IonicContact OD2-NH2 3.55Å; D809-R813 PolarHBondContact OD2-NH2 3.41Å; G810-R813 PolarHBondContact O-N 3.48Å; V811-R813 PolarHBondContact O-N 3.29Å
814	G	71.3	Confident	81.7	Confident	65 Å²	65	56.6 Å²	56.6	67%	0.67	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	11.8	175.9	0	0	0	0	0	114.6	G810 V811 R812 S816	G810-G814 PolarHBondContact O-N 3.02Å; V811-G814 PolarHBondContact O-N 2.97Å; R812-G814 PolarHBondContact O-N 3.17Å; G814-S816 PolarHBondContact O-N 3.41Å
815	V	77.7	Confident	81.7	Confident	22 Å²	22	54.5 Å²	54.5	13%	0.133	30%	0.295	C	S	.	.			trans	-71	125.4	174.5	-173.4	0	0	0	0	109.2	D791 E792 L795 G810 V819	D791-V815 HydrophobicContact CB-CG2 3.92Å; E792-V815 HydrophobicContact CG-CG1 3.91Å; L795-V815 HydrophobicContact CB-CG1 4.19Å; L795-V815 HydrophobicContact CD1-CB 3.89Å; L795-V815 HydrophobicContact CD1-CG1 3.76Å; L795-V815 HydrophobicContact CG-CG1 4.45Å; G810-V815 WeakPolarHBondContact O-CB 3.44Å; G810-V815 WeakPolarHBondContact O-CG2 3.49Å; G810-V815 PolarHBondContact O-N 3Å; G810-V815 VanDerWaalsContact O-N 3.11Å; V815-V819 HydrophobicContact CG1-CG2 4.31Å
816	S	81.3	Confident	82.1	Confident	56 Å²	56	48.4 Å²	48.4	39%	0.392	26%	0.263	S	S	.	.			trans	-68.9	139	-176.8	179.7	0	0	0	0	112.4	G814 L818 V819	G814-S816 PolarHBondContact O-N 3.41Å; S816-L818 PolarHBondContact O-N 3.42Å; S816-L818 WeakPolarHBondContact OG-CB 3.36Å; S816-L818 PolarHBondContact OG-N 3.21Å; S816-L818 VanDerWaalsContact OG-N 3.14Å; S816-V819 WeakPolarHBondContact O-CB 3.44Å; S816-V819 WeakPolarHBondContact O-CG2 3.47Å; S816-V819 PolarHBondContact O-N 3.04Å
817	L	83.1	Confident	82.3	Confident	15 Å²	15	45.4 Å²	45.4	8%	0.079	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-7.9	171.4	-70.3	170.8	0	0	0	113	L795 L807 V811 V819 A827 I843 L851	L795-L817 HydrophobicContact CD2-CD2 4.48Å; L807-L817 HydrophobicContact CD2-CD2 4.46Å; V811-L817 HydrophobicContact CG2-CD1 4.29Å; V811-L817 HydrophobicContact CG2-CD2 3.67Å; V811-L817 HydrophobicContact CG2-CG 3.91Å; L817-V819 VanDerWaalsContact C-N 3.31Å; L817-A827 HydrophobicContact CD2-CB 4.37Å; L817-I843 HydrophobicContact CD1-CG2 4.34Å; L817-I843 HydrophobicContact CD2-CG1 4.18Å; L817-L851 HydrophobicContact CB-CD1 3.94Å; L817-L851 WeakPolarHBondContact O-CD2 3.4Å
818	L	81.7	Confident	82.6	Confident	62 Å²	62	45.4 Å²	45.4	33%	0.325	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-5.3	175.4	-65.3	165.9	0	0	0	113.2	S816 R820 L851	S816-L818 PolarHBondContact O-N 3.42Å; S816-L818 WeakPolarHBondContact OG-CB 3.36Å; S816-L818 PolarHBondContact OG-N 3.21Å; S816-L818 VanDerWaalsContact OG-N 3.14Å; L818-R820 VanDerWaalsContact O-CG 3.27Å; L818-R820 WeakPolarHBondContact O-CG 3.22Å; L818-L851 HydrophobicContact CD2-CD2 3.54Å; L818-L851 HydrophobicContact CD2-CG 3.94Å; L818-L851 HydrophobicContact CG-CD2 4.34Å
819	V	83.8	Confident	83	Confident	14 Å²	14	43 Å²	43	9%	0.085	24%	0.236	C	C	.	.			trans	-56.5	143.2	176.2	172.1	0	0	0	0	110.5	L788 E792 L796 V815 S816 L817 S826	L788-V819 HydrophobicContact CD2-CG1 3.71Å; E792-V819 HydrophobicContact CB-CG1 3.73Å; E792-V819 HydrophobicContact CG-CB 4.5Å; E792-V819 HydrophobicContact CG-CG1 3.88Å; E792-V819 HydrophobicContact CG-CG2 3.77Å; L796-V819 HydrophobicContact CD1-CG1 3.94Å; L796-V819 HydrophobicContact CD2-CG1 4.46Å; L796-V819 HydrophobicContact CG-CG1 4.14Å; V815-V819 HydrophobicContact CG1-CG2 4.31Å; S816-V819 WeakPolarHBondContact O-CB 3.44Å; S816-V819 WeakPolarHBondContact O-CG2 3.47Å; S816-V819 PolarHBondContact O-N 3.04Å; L817-V819 VanDerWaalsContact C-N 3.31Å; V819-S826 WeakPolarHBondContact O-CA 3.33Å
820	R	84.8	Confident	83.6	Confident	75 Å²	75	41 Å²	41	28%	0.283	23%	0.225	S	C	.	.	B	Isolated β-bridge	trans	-131.2	141.3	-173.4	-51.7	177.9	68.3	172.4	3.1	111.2	L818 G824 C825 T855	L818-R820 VanDerWaalsContact O-CG 3.27Å; L818-R820 WeakPolarHBondContact O-CG 3.22Å; R820-G824 VanDerWaalsContact CZ-O 3.23Å; R820-G824 PolarHBondContact NE-O 2.93Å; R820-G824 PolarHBondContact NH2-O 3.35Å; R820-C825 CarbonylContact C-O 3.59Å; R820-C825 VanDerWaalsContact CA-O 3.3Å; R820-C825 WeakPolarHBondContact CA-O 3.48Å; R820-T855 PolarHBondContact NH2-O 3.41Å
821	D	83.9	Confident	84.3	Confident	43 Å²	43	40.8 Å²	40.8	23%	0.23	22%	0.223	C	C	.	.			trans	-73.2	-178	170.1	69.4	14.7	0	0	0	112.4	L796 G823 G824 C825	L796-D821 HydrophobicContact CD1-CB 3.98Å; D821-G823 PolarHBondContact O-N 3.17Å; D821-G823 WeakPolarHBondContact OD1-CA 3.17Å; D821-G823 PolarHBondContact OD1-N 3.35Å; D821-G824 WeakPolarHBondContact O-CA 3.45Å; D821-G824 PolarHBondContact O-N 3.45Å; D821-G824 PolarHBondContact OD1-N 3.42Å; D821-C825 PolarHBondContact N-O 3.43Å; D821-C825 WeakPolarHBondContact OD1-CB 3.37Å; D821-C825 PolarHBondContact OD1-N 2.94Å; D821-C825 WeakPolarHBondContact OD2-CB 3.49Å
822	S	78.9	Confident	84.9	Confident	119 Å²	119	39 Å²	39	83%	0.832	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.1	178.3	53.9	0	0	0	0	114.3	G824	S822-G824 VanDerWaalsContact C-N 3.29Å
823	G	77.4	Confident	85.7	Confident	8 Å²	8	33.6 Å²	33.6	8%	0.082	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	3.2	173.7	0	0	0	0	0	113.1	D821 C825 R857 D858	D821-G823 PolarHBondContact O-N 3.17Å; D821-G823 WeakPolarHBondContact OD1-CA 3.17Å; D821-G823 PolarHBondContact OD1-N 3.35Å; G823-C825 VanDerWaalsContact C-N 3.31Å; G823-C825 PolarHBondContact O-N 3.11Å; G823-R857 PolarHBondContact O-N 3.44Å; G823-D858 WeakPolarHBondContact CA-OD2 2.95Å
824	G	83.1	Confident	86.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	19%	0.187	C	C	.	.			trans	74.6	15.6	-176.6	0	0	0	0	0	114	R820 D821 S822	R820-G824 VanDerWaalsContact CZ-O 3.23Å; R820-G824 PolarHBondContact NE-O 2.93Å; R820-G824 PolarHBondContact NH2-O 3.35Å; D821-G824 WeakPolarHBondContact O-CA 3.45Å; D821-G824 PolarHBondContact O-N 3.45Å; D821-G824 PolarHBondContact OD1-N 3.42Å; S822-G824 VanDerWaalsContact C-N 3.29Å
825	C	88.5	Confident	87.4	Confident	11 Å²	11	28.1 Å²	28.1	7%	0.074	16%	0.164	C	C	.	.			trans	-80.7	130.4	176.3	-65	0	0	0	0	110.5	R820 D821 G823 H829 L830	R820-C825 CarbonylContact C-O 3.59Å; R820-C825 VanDerWaalsContact CA-O 3.3Å; R820-C825 WeakPolarHBondContact CA-O 3.48Å; D821-C825 PolarHBondContact N-O 3.43Å; D821-C825 WeakPolarHBondContact OD1-CB 3.37Å; D821-C825 PolarHBondContact OD1-N 2.94Å; D821-C825 WeakPolarHBondContact OD2-CB 3.49Å; G823-C825 VanDerWaalsContact C-N 3.31Å; G823-C825 PolarHBondContact O-N 3.11Å; C825-H829 HydrophobicContact CB-CB 3.94Å; C825-L830 HydrophobicContact CB-CD2 4.06Å; C825-L830 HydrophobicContact CB-CG 4.31Å
826	S	92.1	Very high	88.3	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-87.5	171.8	173.3	70.4	0	0	0	0	112.3	V819 L828 H829 L830	V819-S826 WeakPolarHBondContact O-CA 3.33Å; S826-L828 PolarHBondContact O-N 2.83Å; S826-H829 PolarHBondContact N-ND1 3.49Å; S826-H829 WeakPolarHBondContact O-CB 3.47Å; S826-H829 PolarHBondContact O-N 3.32Å; S826-H829 PolarHBondContact OG-ND1 3.04Å; S826-L830 PolarHBondContact O-N 2.94Å; S826-L830 VanDerWaalsContact O-N 3.1Å
827	A	90.7	Very high	88.8	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-52.8	-37.5	174.1	0	0	0	0	0	112.7	L795 L796 A799 L817 L830 A831 I843	L795-A827 HydrophobicContact CD2-CB 3.88Å; L796-A827 HydrophobicContact CD2-CB 4.39Å; A799-A827 HydrophobicContact CB-CB 3.78Å; L817-A827 HydrophobicContact CD2-CB 4.37Å; A827-L830 PolarHBondContact O-N 3.36Å; A827-A831 VanDerWaalsContact O-CB 3.28Å; A827-A831 WeakPolarHBondContact O-CB 3.48Å; A827-A831 PolarHBondContact O-N 3.33Å; A827-I843 HydrophobicContact CB-CD1 4.16Å
828	L	94.4	Very high	89.1	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-68	-37.1	176.9	-171.2	60	0	0	0	112.3	S826 A832 V840 I843 L844 L851 A863 L879	S826-L828 PolarHBondContact O-N 2.83Å; L828-A832 WeakPolarHBondContact O-CB 3.29Å; L828-A832 PolarHBondContact O-N 3.47Å; L828-V840 HydrophobicContact CD1-CG1 4.1Å; L828-V840 HydrophobicContact CD1-CG2 4.45Å; L828-I843 HydrophobicContact CB-CG2 4.05Å; L828-I843 HydrophobicContact CD1-CB 4.29Å; L828-I843 HydrophobicContact CD1-CG2 3.88Å; L828-I843 HydrophobicContact CG-CG2 4.4Å; L828-L844 HydrophobicContact CD1-CD2 4.46Å; L828-L844 HydrophobicContact CD2-CD2 4.32Å; L828-L851 HydrophobicContact CD2-CB 3.93Å; L828-A863 HydrophobicContact CD2-CB 4.02Å; L828-A863 HydrophobicContact CG-CB 3.74Å; L828-L879 HydrophobicContact CD1-CD2 4.22Å; L828-L879 HydrophobicContact CD2-CD2 4.26Å; L828-L879 HydrophobicContact CG-CD2 4.49Å
829	H	94.1	Very high	89.5	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.8	-47.5	175.7	-71.4	93.4	0	0	0	111.3	C825 S826 A832 Q833 L854 E861 A863 K866	C825-H829 HydrophobicContact CB-CB 3.94Å; S826-H829 PolarHBondContact N-ND1 3.49Å; S826-H829 WeakPolarHBondContact O-CB 3.47Å; S826-H829 PolarHBondContact O-N 3.32Å; S826-H829 PolarHBondContact OG-ND1 3.04Å; H829-A832 PolarHBondContact O-N 2.99Å; H829-Q833 VanDerWaalsContact O-CB 3.25Å; H829-Q833 WeakPolarHBondContact O-CB 3.02Å; H829-Q833 PolarHBondContact O-N 3.39Å; H829-L854 PolarHBondContact CE1-O 3.2Å; H829-L854 PolarHBondContact NE2-O 3.13Å; H829-E861 PolarHBondContact NE2-O 3.01Å; H829-E861 VanDerWaalsContact NE2-O 3.13Å; H829-A863 PolarHBondContact CD2-N 3.4Å; H829-A863 PolarHBondContact NE2-N 3.13Å; H829-K866 HydrophobicContact CB-CD 3.94Å
830	L	93.5	Very high	89.9	Confident	17 Å²	17	30.4 Å²	30.4	9%	0.089	17%	0.171	C	C	.	.	H	α-helix	trans	-67.5	-43.5	-178.4	-61.3	174.5	0	0	0	111.7	L796 A799 C825 S826 A827 N834	L796-L830 HydrophobicContact CB-CD1 4.02Å; L796-L830 HydrophobicContact CD2-CD1 4.01Å; L796-L830 WeakPolarHBondContact O-CD1 3.33Å; A799-L830 HydrophobicContact CB-CB 4.21Å; C825-L830 HydrophobicContact CB-CD2 4.06Å; C825-L830 HydrophobicContact CB-CG 4.31Å; S826-L830 PolarHBondContact O-N 2.94Å; S826-L830 VanDerWaalsContact O-N 3.1Å; A827-L830 PolarHBondContact O-N 3.36Å; L830-N834 PolarHBondContact O-N 2.69Å; L830-N834 PolarHBondContact O-ND2 3.43Å
831	A	94.4	Very high	90.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-39.2	176.4	0	0	0	0	0	111.8	A799 A827 G835 H836 L839 V840 I843	A799-A831 WeakPolarHBondContact O-CA 3.49Å; A827-A831 VanDerWaalsContact O-CB 3.28Å; A827-A831 WeakPolarHBondContact O-CB 3.48Å; A827-A831 PolarHBondContact O-N 3.33Å; A831-G835 PolarHBondContact O-N 3.24Å; A831-G835 VanDerWaalsContact O-N 3.17Å; A831-H836 HydrophobicContact CB-CB 4.46Å; A831-H836 PolarHBondContact O-N 2.99Å; A831-L839 HydrophobicContact CB-CB 3.98Å; A831-L839 HydrophobicContact CB-CD1 4.39Å; A831-V840 HydrophobicContact CB-CG2 3.87Å; A831-I843 HydrophobicContact CB-CD1 4.12Å
832	A	95.3	Very high	90.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-71	-40.1	-179.8	0	0	0	0	0	112.8	L828 H829 G835 A863 A867 V875 L879	L828-A832 WeakPolarHBondContact O-CB 3.29Å; L828-A832 PolarHBondContact O-N 3.47Å; H829-A832 PolarHBondContact O-N 2.99Å; A832-G835 PolarHBondContact O-N 2.99Å; A832-A863 HydrophobicContact CB-CB 3.98Å; A832-A863 WeakPolarHBondContact CB-O 3.44Å; A832-A867 HydrophobicContact CB-CB 4.26Å; A832-V875 HydrophobicContact CB-CG1 3.78Å; A832-L879 HydrophobicContact CB-CD1 4.15Å
833	Q	94.3	Very high	90.9	Very high	61 Å²	61	22.7 Å²	22.7	29%	0.285	13%	0.128	S	C	.	.	H	α-helix	trans	-61.9	-44.1	175.9	-171.4	177.2	-8.8	0	0	111.6	H829 G835 K866 E870 Q872	H829-Q833 VanDerWaalsContact O-CB 3.25Å; H829-Q833 WeakPolarHBondContact O-CB 3.02Å; H829-Q833 PolarHBondContact O-N 3.39Å; Q833-G835 VanDerWaalsContact C-N 3.33Å; Q833-G835 PolarHBondContact O-N 2.96Å; Q833-K866 HydrophobicContact CB-CB 4.02Å; Q833-K866 HydrophobicContact CB-CD 4.4Å; Q833-K866 HydrophobicContact CG-CB 4.39Å; Q833-E870 HydrophobicContact CG-CG 3.63Å; Q833-E870 WeakPolarHBondContact O-CB 3.28Å; Q833-E870 WeakPolarHBondContact O-CG 3.36Å; Q833-Q872 PolarHBondContact O-NE2 3.18Å
834	N	91.5	Very high	91.3	Very high	70 Å²	70	24.4 Å²	24.4	37%	0.374	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-0.3	-176.9	-67.3	-67.2	0	0	0	114.3	S800 L830 H836	S800-N834 PolarHBondContact O-ND2 3.06Å; L830-N834 PolarHBondContact O-N 2.69Å; L830-N834 PolarHBondContact O-ND2 3.43Å; N834-H836 VanDerWaalsContact CB-NE2 3.33Å; N834-H836 WeakPolarHBondContact CB-NE2 3.47Å
835	G	91.9	Very high	91.3	Very high	17 Å²	17	31 Å²	31	18%	0.175	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	17.7	175.3	0	0	0	0	0	115.4	A831 A832 Q833 T837 Q872	A831-G835 PolarHBondContact O-N 3.24Å; A831-G835 VanDerWaalsContact O-N 3.17Å; A832-G835 PolarHBondContact O-N 2.99Å; Q833-G835 VanDerWaalsContact C-N 3.33Å; Q833-G835 PolarHBondContact O-N 2.96Å; G835-T837 VanDerWaalsContact C-N 3.34Å; G835-T837 PolarHBondContact O-N 3.07Å; G835-Q872 VanDerWaalsContact CA-CD 3.41Å
836	H	94.7	Very high	90.7	Very high	48 Å²	48	36.1 Å²	36.1	22%	0.222	19%	0.189	C	C	.	.			trans	-77.2	79.3	-174.3	-61.9	-42.1	0	0	0	111.9	A799 S800 G802 A831 N834 D838 L839 V840	A799-H836 PolarHBondContact O-CD2 2.63Å; S800-H836 PolarHBondContact O-NE2 3.17Å; G802-H836 PolarHBondContact N-NE2 3.13Å; A831-H836 HydrophobicContact CB-CB 4.46Å; A831-H836 PolarHBondContact O-N 2.99Å; N834-H836 VanDerWaalsContact CB-NE2 3.33Å; N834-H836 WeakPolarHBondContact CB-NE2 3.47Å; H836-D838 VanDerWaalsContact C-N 3.33Å; H836-D838 PolarHBondContact O-N 3.1Å; H836-L839 HydrophobicContact CB-CB 3.95Å; H836-L839 HydrophobicContact CB-CD1 3.84Å; H836-L839 HydrophobicContact CB-CG 4.16Å; H836-L839 WeakPolarHBondContact O-CB 3.19Å; H836-L839 PolarHBondContact O-N 2.99Å; H836-L839 VanDerWaalsContact O-N 3.14Å; H836-V840 WeakPolarHBondContact O-CG2 3.42Å; H836-V840 PolarHBondContact O-N 3.43Å
837	T	92.1	Very high	89.7	Confident	50 Å²	50	37.2 Å²	37.2	31%	0.307	20%	0.2	S	C	.	.	H	α-helix	trans	-55.2	-41.1	-174.6	52.6	0	0	0	0	114.1	G835 L839 V840 S841 A874 V875 M878	G835-T837 VanDerWaalsContact C-N 3.34Å; G835-T837 PolarHBondContact O-N 3.07Å; T837-L839 PolarHBondContact O-N 3.22Å; T837-V840 PolarHBondContact O-N 3.09Å; T837-S841 WeakPolarHBondContact O-CB 3.27Å; T837-S841 PolarHBondContact O-N 3.31Å; T837-A874 HydrophobicContact CG2-CB 3.65Å; T837-V875 HydrophobicContact CG2-CG2 3.92Å; T837-M878 HydrophobicContact CG2-SD 4.16Å; T837-M878 WeakPolarHBondContact O-CE 3.22Å
838	D	89.3	Confident	88.8	Confident	118 Å²	118	40.3 Å²	40.3	63%	0.631	22%	0.222	S	C	*	.	H	α-helix	trans	-65	-39.8	178.9	-63.5	-32.8	0	0	0	112.4	L804 H836 S841 F842	L804-D838 HydrophobicContact CD2-CB 4.32Å; H836-D838 VanDerWaalsContact C-N 3.33Å; H836-D838 PolarHBondContact O-N 3.1Å; D838-S841 PolarHBondContact O-N 3.09Å; D838-F842 WeakPolarHBondContact O-CB 3.44Å; D838-F842 PolarHBondContact O-N 3.16Å
839	L	90.7	Very high	87.9	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-67.5	-44.9	174.7	-76.5	-177.6	0	0	0	111.8	L804 L807 A831 H836 T837 S841 F842 I843	L804-L839 HydrophobicContact CB-CD2 4.04Å; L804-L839 HydrophobicContact CD1-CD2 3.8Å; L807-L839 HydrophobicContact CB-CD2 3.84Å; L807-L839 HydrophobicContact CD1-CD2 3.86Å; L807-L839 HydrophobicContact CD2-CD2 4.04Å; L807-L839 HydrophobicContact CG-CD2 4.11Å; A831-L839 HydrophobicContact CB-CB 3.98Å; A831-L839 HydrophobicContact CB-CD1 4.39Å; H836-L839 HydrophobicContact CB-CB 3.95Å; H836-L839 HydrophobicContact CB-CD1 3.84Å; H836-L839 HydrophobicContact CB-CG 4.16Å; H836-L839 WeakPolarHBondContact O-CB 3.19Å; H836-L839 PolarHBondContact O-N 2.99Å; H836-L839 VanDerWaalsContact O-N 3.14Å; T837-L839 PolarHBondContact O-N 3.22Å; L839-S841 VanDerWaalsContact C-N 3.3Å; L839-S841 PolarHBondContact O-N 3.44Å; L839-F842 PolarHBondContact O-N 3.08Å; L839-I843 WeakPolarHBondContact O-CB 3.34Å; L839-I843 WeakPolarHBondContact O-CD1 3.29Å; L839-I843 WeakPolarHBondContact O-CG1 3.42Å; L839-I843 PolarHBondContact O-N 2.97Å
840	V	93.2	Very high	86.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-42.8	177.3	176.4	0	0	0	0	109.7	L828 A831 H836 T837 F842 I843 L844 V875 M878 L879	L828-V840 HydrophobicContact CD1-CG1 4.1Å; L828-V840 HydrophobicContact CD1-CG2 4.45Å; A831-V840 HydrophobicContact CB-CG2 3.87Å; H836-V840 WeakPolarHBondContact O-CG2 3.42Å; H836-V840 PolarHBondContact O-N 3.43Å; T837-V840 PolarHBondContact O-N 3.09Å; V840-F842 PolarHBondContact O-N 3.36Å; V840-I843 PolarHBondContact O-N 2.92Å; V840-L844 HydrophobicContact CG1-CD1 3.65Å; V840-L844 HydrophobicContact CG1-CG 4.13Å; V840-L844 VanDerWaalsContact O-CB 3.28Å; V840-L844 WeakPolarHBondContact O-CB 3.4Å; V840-L844 WeakPolarHBondContact O-CG 3.43Å; V840-L844 PolarHBondContact O-N 3.09Å; V840-V875 HydrophobicContact CG1-CG1 4.37Å; V840-V875 HydrophobicContact CG2-CG1 4.11Å; V840-V875 HydrophobicContact CG2-CG2 4.24Å; V840-M878 HydrophobicContact CB-CE 3.97Å; V840-M878 HydrophobicContact CG1-CE 3.81Å; V840-L879 HydrophobicContact CG1-CD2 4.26Å; V840-L879 HydrophobicContact CG1-CG 4.47Å
841	S	90.4	Very high	86.3	Confident	43 Å²	43	52.5 Å²	52.5	30%	0.301	28%	0.282	S	S	.	.	H	α-helix	trans	-60.7	-46.9	176.7	-171.5	0	0	0	0	111.3	T837 D838 L839 L844 Q845 M878	T837-S841 WeakPolarHBondContact O-CB 3.27Å; T837-S841 PolarHBondContact O-N 3.31Å; D838-S841 PolarHBondContact O-N 3.09Å; L839-S841 VanDerWaalsContact C-N 3.3Å; L839-S841 PolarHBondContact O-N 3.44Å; S841-L844 PolarHBondContact O-N 3.24Å; S841-Q845 WeakPolarHBondContact O-CB 3.44Å; S841-Q845 VanDerWaalsContact O-CG 3.24Å; S841-Q845 WeakPolarHBondContact O-CG 3.48Å; S841-Q845 PolarHBondContact O-N 3.35Å; S841-Q845 PolarHBondContact OG-NE2 3.01Å; S841-M878 VanDerWaalsContact N-CE 3.31Å
842	F	88.4	Confident	85.7	Confident	29 Å²	29	53 Å²	53	13%	0.127	28%	0.284	C	S	.	.	H	α-helix	trans	-62.4	-47.4	177.4	178.8	-97.1	0	0	0	112.3	L804 L807 M808 V811 D838 L839 V840 L844 Q845 Q846	L804-F842 HydrophobicContact CD1-CB 3.79Å; L804-F842 HydrophobicContact CD1-CD1 4.4Å; L804-F842 HydrophobicContact CD1-CD2 4.44Å; L804-F842 HydrophobicContact CD1-CG 3.95Å; L807-F842 HydrophobicContact CD2-CD1 3.4Å; L807-F842 VanDerWaalsContact CD2-CD1 3.4Å; L807-F842 HydrophobicContact CD2-CE1 3.55Å; M808-F842 HydrophobicContact CB-CZ 4.21Å; M808-F842 HydrophobicContact CE-CD2 4.4Å; M808-F842 HydrophobicContact CE-CE2 3.89Å; M808-F842 HydrophobicContact CG-CD1 4.37Å; M808-F842 HydrophobicContact CG-CD2 4.01Å; M808-F842 HydrophobicContact CG-CE1 3.99Å; M808-F842 HydrophobicContact CG-CE2 3.6Å; M808-F842 HydrophobicContact CG-CG 4.38Å; M808-F842 HydrophobicContact CG-CZ 3.58Å; M808-F842 HydrophobicContact SD-CE2 4.33Å; V811-F842 HydrophobicContact CB-CE1 4.48Å; V811-F842 HydrophobicContact CG2-CE1 4.2Å; D838-F842 WeakPolarHBondContact O-CB 3.44Å; D838-F842 PolarHBondContact O-N 3.16Å; L839-F842 PolarHBondContact O-N 3.08Å; V840-F842 PolarHBondContact O-N 3.36Å; F842-L844 VanDerWaalsContact C-N 3.33Å; F842-L844 PolarHBondContact O-N 2.79Å; F842-Q845 PolarHBondContact O-N 3.27Å; F842-Q846 HydrophobicContact CD2-CG 4.09Å; F842-Q846 HydrophobicContact CE1-CG 4.23Å; F842-Q846 HydrophobicContact CE2-CG 3.65Å; F842-Q846 HydrophobicContact CZ-CB 4.46Å; F842-Q846 HydrophobicContact CZ-CG 3.74Å; F842-Q846 WeakPolarHBondContact O-CB 3.39Å; F842-Q846 WeakPolarHBondContact O-CG 3.41Å; F842-Q846 PolarHBondContact O-N 3.43Å
843	I	88.6	Confident	85.3	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-64.1	-37.8	179.2	-66.3	165.5	0	0	0	110.8	L807 L817 A827 L828 A831 L839 V840 G847 L851	L807-I843 HydrophobicContact CD1-CD1 4.19Å; L807-I843 HydrophobicContact CD2-CG1 4.12Å; L817-I843 HydrophobicContact CD1-CG2 4.34Å; L817-I843 HydrophobicContact CD2-CG1 4.18Å; A827-I843 HydrophobicContact CB-CD1 4.16Å; L828-I843 HydrophobicContact CB-CG2 4.05Å; L828-I843 HydrophobicContact CD1-CB 4.29Å; L828-I843 HydrophobicContact CD1-CG2 3.88Å; L828-I843 HydrophobicContact CG-CG2 4.4Å; A831-I843 HydrophobicContact CB-CD1 4.12Å; L839-I843 WeakPolarHBondContact O-CB 3.34Å; L839-I843 WeakPolarHBondContact O-CD1 3.29Å; L839-I843 WeakPolarHBondContact O-CG1 3.42Å; L839-I843 PolarHBondContact O-N 2.97Å; V840-I843 PolarHBondContact O-N 2.92Å; I843-G847 WeakPolarHBondContact O-CA 3.41Å; I843-G847 PolarHBondContact O-N 2.71Å; I843-L851 HydrophobicContact CG2-CD1 4.24Å
844	L	86.6	Confident	84.9	Confident	45 Å²	45	53.5 Å²	53.5	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-71.9	-28.8	177.1	-69.6	175.6	0	0	0	113.1	L828 V840 S841 F842 L852 M878 L879 A882	L828-L844 HydrophobicContact CD1-CD2 4.46Å; L828-L844 HydrophobicContact CD2-CD2 4.32Å; V840-L844 HydrophobicContact CG1-CD1 3.65Å; V840-L844 HydrophobicContact CG1-CG 4.13Å; V840-L844 VanDerWaalsContact O-CB 3.28Å; V840-L844 WeakPolarHBondContact O-CB 3.4Å; V840-L844 WeakPolarHBondContact O-CG 3.43Å; V840-L844 PolarHBondContact O-N 3.09Å; S841-L844 PolarHBondContact O-N 3.24Å; F842-L844 VanDerWaalsContact C-N 3.33Å; F842-L844 PolarHBondContact O-N 2.79Å; L844-L852 HydrophobicContact CD2-CD2 3.39Å; L844-L852 HydrophobicContact CD2-CG 4.26Å; L844-M878 HydrophobicContact CD1-CB 4.48Å; L844-L879 HydrophobicContact CD1-CD2 4.23Å; L844-L879 HydrophobicContact CD2-CD2 4.18Å; L844-A882 HydrophobicContact CD1-CB 3.84Å; L844-A882 HydrophobicContact CD2-CB 4Å; L844-A882 HydrophobicContact CG-CB 4.4Å
845	Q	83	Confident	84.7	Confident	138 Å²	138	52.8 Å²	52.8	65%	0.645	29%	0.287	S	S	*	.	H	α-helix	trans	-78.8	-35.2	176	-73.6	173.9	22.6	0	0	112.9	S841 F842	S841-Q845 WeakPolarHBondContact O-CB 3.44Å; S841-Q845 VanDerWaalsContact O-CG 3.24Å; S841-Q845 WeakPolarHBondContact O-CG 3.48Å; S841-Q845 PolarHBondContact O-N 3.35Å; S841-Q845 PolarHBondContact OG-NE2 3.01Å; F842-Q845 PolarHBondContact O-N 3.27Å
846	Q	76.1	Confident	84.3	Confident	119 Å²	119	52.1 Å²	52.1	56%	0.556	28%	0.279	S	S	*	.	H	α-helix	trans	-102.3	-23.2	-174.5	-60.2	-59.6	-43.9	0	0	113.9	F842	F842-Q846 HydrophobicContact CD2-CG 4.09Å; F842-Q846 HydrophobicContact CE1-CG 4.23Å; F842-Q846 HydrophobicContact CE2-CG 3.65Å; F842-Q846 HydrophobicContact CZ-CB 4.46Å; F842-Q846 HydrophobicContact CZ-CG 3.74Å; F842-Q846 WeakPolarHBondContact O-CB 3.39Å; F842-Q846 WeakPolarHBondContact O-CG 3.41Å; F842-Q846 PolarHBondContact O-N 3.43Å
847	G	71.6	Confident	83.6	Confident	22 Å²	22	55.8 Å²	55.8	23%	0.227	29%	0.291	C	S	.	.	S	Bend	trans	-89.3	159.5	-174.7	0	0	0	0	0	114.1	I843	I843-G847 WeakPolarHBondContact O-CA 3.41Å; I843-G847 PolarHBondContact O-N 2.71Å
848	S	71.8	Confident	83	Confident	66 Å²	66	59 Å²	59	46%	0.462	31%	0.307	S	S	.	.			trans	-68.4	145.5	173.8	176.5	0	0	0	0	111.6	V850 L851	S848-V850 PolarHBondContact O-N 3.46Å; S848-V850 WeakPolarHBondContact OG-CG2 3.42Å; S848-V850 PolarHBondContact OG-N 3.29Å; S848-L851 WeakPolarHBondContact O-CB 3.46Å; S848-L851 PolarHBondContact O-N 2.85Å
849	K	74.4	Confident	82.6	Confident	174 Å²	174	58.6 Å²	58.6	76%	0.757	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-57	-21.5	173.5	-68.9	-169.7	175.7	-170.5	0	113.5	L851 L852	K849-L851 PolarHBondContact O-N 3.43Å; K849-L852 HydrophobicContact CB-CD1 4.41Å; K849-L852 WeakPolarHBondContact O-CB 3.39Å; K849-L852 PolarHBondContact O-N 3.08Å; K849-L852 VanDerWaalsContact O-N 3.15Å
850	V	73.7	Confident	82.3	Confident	94 Å²	94	58.6 Å²	58.6	57%	0.57	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-57.1	-29.6	174.4	177.4	0	0	0	0	111.9	S848 L852 L854	S848-V850 PolarHBondContact O-N 3.46Å; S848-V850 WeakPolarHBondContact OG-CG2 3.42Å; S848-V850 PolarHBondContact OG-N 3.29Å; V850-L852 VanDerWaalsContact C-N 3.29Å; V850-L852 PolarHBondContact O-N 3.28Å; V850-L854 PolarHBondContact O-N 3.1Å
851	L	79.7	Confident	82.1	Confident	4 Å²	4	59.1 Å²	59.1	2%	0.021	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-65.5	-28.3	179.2	-72.5	167.2	0	0	0	113.6	L817 L818 L828 I843 S848 K849 D853 L854	L817-L851 HydrophobicContact CB-CD1 3.94Å; L817-L851 WeakPolarHBondContact O-CD2 3.4Å; L818-L851 HydrophobicContact CD2-CD2 3.54Å; L818-L851 HydrophobicContact CD2-CG 3.94Å; L818-L851 HydrophobicContact CG-CD2 4.34Å; L828-L851 HydrophobicContact CD2-CB 3.93Å; I843-L851 HydrophobicContact CG2-CD1 4.24Å; S848-L851 WeakPolarHBondContact O-CB 3.46Å; S848-L851 PolarHBondContact O-N 2.85Å; K849-L851 PolarHBondContact O-N 3.43Å; L851-D853 VanDerWaalsContact C-N 3.27Å; L851-D853 PolarHBondContact O-N 3.32Å; L851-L854 HydrophobicContact CD2-CD2 4.26Å; L851-L854 PolarHBondContact O-N 2.69Å
852	L	83.3	Confident	82.3	Confident	11 Å²	11	57.1 Å²	57.1	6%	0.058	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-61.3	-38.1	-175	-73.8	167.4	0	0	0	112.5	L844 K849 V850 L879 A882 A884	L844-L852 HydrophobicContact CD2-CD2 3.39Å; L844-L852 HydrophobicContact CD2-CG 4.26Å; K849-L852 HydrophobicContact CB-CD1 4.41Å; K849-L852 WeakPolarHBondContact O-CB 3.39Å; K849-L852 PolarHBondContact O-N 3.08Å; K849-L852 VanDerWaalsContact O-N 3.15Å; V850-L852 VanDerWaalsContact C-N 3.29Å; V850-L852 PolarHBondContact O-N 3.28Å; L852-L879 HydrophobicContact CD2-CD2 4.04Å; L852-A882 HydrophobicContact CD1-CB 4.47Å; L852-A882 VanDerWaalsContact CD1-O 3.27Å; L852-A882 WeakPolarHBondContact CD1-O 3.47Å; L852-A882 HydrophobicContact CD2-CB 3.95Å; L852-A884 HydrophobicContact CB-CB 4.44Å; L852-A884 HydrophobicContact CD2-CB 4.23Å
853	D	86.4	Confident	82.5	Confident	34 Å²	34	55.7 Å²	55.7	18%	0.182	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-118.1	15.6	-178.3	-61.9	-20	0	0	0	113.8	L851 T855 S885 K888	L851-D853 VanDerWaalsContact C-N 3.27Å; L851-D853 PolarHBondContact O-N 3.32Å; D853-T855 PolarHBondContact O-N 3.47Å; D853-S885 WeakPolarHBondContact OD1-CB 3.43Å; D853-S885 PolarHBondContact OD1-N 3.47Å; D853-K888 HydrophobicContact CB-CD 3.69Å; D853-K888 VanDerWaalsContact CG-NZ 3.32Å; D853-K888 WeakPolarHBondContact OD2-CE 3.49Å; D853-K888 IonicContact OD2-NZ 3.18Å; D853-K888 PolarHBondContact OD2-NZ 2.95Å
854	L	84.8	Confident	82.9	Confident	37 Å²	37	55.6 Å²	55.6	19%	0.194	28%	0.282	C	S	.	.			trans	-62.3	136.4	168.1	-172.5	70.1	0	0	0	108.1	H829 V850 L851 T862	H829-L854 PolarHBondContact CE1-O 3.2Å; H829-L854 PolarHBondContact NE2-O 3.13Å; V850-L854 PolarHBondContact O-N 3.1Å; L851-L854 HydrophobicContact CD2-CD2 4.26Å; L851-L854 PolarHBondContact O-N 2.69Å; L854-T862 WeakPolarHBondContact O-CA 3.48Å
855	T	87.6	Confident	83.2	Confident	56 Å²	56	53.5 Å²	53.5	34%	0.344	27%	0.271	S	S	.	.			trans	-106.2	141.7	179.3	58.9	0	0	0	0	111.1	R820 D853 E861 T862	R820-T855 PolarHBondContact NH2-O 3.41Å; D853-T855 PolarHBondContact O-N 3.47Å; T855-E861 WeakPolarHBondContact CA-O 3.47Å; T855-T862 HydrophobicContact CG2-CG2 3.97Å
856	D	84.5	Confident	83.7	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.011	24%	0.243	C	C	.	.			trans	-62.5	169.5	167.9	75.3	54.1	0	0	0	112.7	D858 K859 G860 E861 K866	D856-D858 PolarHBondContact OD1-N 3.24Å; D856-K859 PolarHBondContact OD1-N 2.9Å; D856-G860 WeakPolarHBondContact O-CA 3.15Å; D856-G860 PolarHBondContact OD1-N 3Å; D856-E861 PolarHBondContact N-O 3.15Å; D856-E861 VanDerWaalsContact OD2-CB 3.29Å; D856-E861 WeakPolarHBondContact OD2-CB 3.42Å; D856-E861 PolarHBondContact OD2-N 3.47Å; D856-K866 WeakPolarHBondContact OD2-CE 3.11Å; D856-K866 IonicContact OD2-NZ 3.97Å; D856-K866 PolarHBondContact OD2-NZ 2.9Å
857	R	80.1	Confident	84.6	Confident	126 Å²	126	42 Å²	42	48%	0.475	22%	0.216	S	C	.	.	S	Bend	trans	-86.8	-29.4	-178.8	-76.6	-179.2	176.5	-179	0.9	113.4	G823	G823-R857 PolarHBondContact O-N 3.44Å
858	D	79.1	Confident	85.7	Confident	117 Å²	117	40.9 Å²	40.9	63%	0.626	21%	0.205	S	C	*	.	S	Bend	trans	-81	-39.8	-168.8	-66.2	-22.9	0	0	0	112.7	G823 D856	G823-D858 WeakPolarHBondContact CA-OD2 2.95Å; D856-D858 PolarHBondContact OD1-N 3.24Å
859	K	79.9	Confident	86.7	Confident	110 Å²	110	39.6 Å²	39.6	48%	0.478	20%	0.196	S	C	.	.	S	Bend	trans	-127.3	-12.3	-173.3	-62.5	-179.2	-176.1	175.1	0	113.1	D856 E861 N890 F891	D856-K859 PolarHBondContact OD1-N 2.9Å; K859-E861 VanDerWaalsContact C-N 3.28Å; K859-E861 HydrophobicContact CB-CG 3.76Å; K859-E861 WeakPolarHBondContact CD-OE1 3.38Å; K859-N890 WeakPolarHBondContact O-CB 3.26Å; K859-F891 WeakPolarHBondContact O-CB 3.5Å; K859-F891 WeakPolarHBondContact O-CD2 3.42Å; K859-F891 WeakPolarHBondContact O-CG 3.4Å; K859-F891 PolarHBondContact O-N 3.41Å
860	G	85.7	Confident	87.5	Confident	2 Å²	2	35.9 Å²	35.9	2%	0.021	18%	0.182	C	C	.	.			trans	70.8	26.9	-176.1	0	0	0	0	0	112.1	D856 N890 F891	D856-G860 WeakPolarHBondContact O-CA 3.15Å; D856-G860 PolarHBondContact OD1-N 3Å; G860-N890 WeakPolarHBondContact O-CA 3.35Å; G860-F891 VanDerWaalsContact N-CE2 3.32Å
861	E	89.6	Confident	88.5	Confident	10 Å²	10	36 Å²	36	5%	0.047	17%	0.174	C	C	.	.			trans	-83.3	139.8	179.8	-64.7	170.6	162.9	0	0	110.2	H829 T855 D856 K859 H865 K866 N890	H829-E861 PolarHBondContact NE2-O 3.01Å; H829-E861 VanDerWaalsContact NE2-O 3.13Å; T855-E861 WeakPolarHBondContact CA-O 3.47Å; D856-E861 PolarHBondContact N-O 3.15Å; D856-E861 VanDerWaalsContact OD2-CB 3.29Å; D856-E861 WeakPolarHBondContact OD2-CB 3.42Å; D856-E861 PolarHBondContact OD2-N 3.47Å; K859-E861 VanDerWaalsContact C-N 3.28Å; K859-E861 HydrophobicContact CB-CG 3.76Å; K859-E861 WeakPolarHBondContact CD-OE1 3.38Å; E861-H865 HydrophobicContact CB-CB 3.69Å; E861-H865 HydrophobicContact CG-CB 4.04Å; E861-K866 HydrophobicContact CB-CG 4.22Å; E861-K866 IonicContact OE2-NZ 3.09Å; E861-K866 PolarHBondContact OE2-NZ 3.41Å; E861-N890 HydrophobicContact CG-CB 4.12Å
862	T	94.1	Very high	89.2	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	19%	0.186	C	C	.	.			trans	-83.5	170.3	168	68.7	0	0	0	0	110.8	L854 T855 L864 H865 K866	L854-T862 WeakPolarHBondContact O-CA 3.48Å; T855-T862 HydrophobicContact CG2-CG2 3.97Å; T862-L864 PolarHBondContact O-N 3.28Å; T862-L864 PolarHBondContact OG1-N 3Å; T862-H865 PolarHBondContact N-ND1 3.34Å; T862-H865 WeakPolarHBondContact O-CB 3.48Å; T862-H865 PolarHBondContact O-N 3.49Å; T862-H865 PolarHBondContact OG1-N 3.38Å; T862-H865 PolarHBondContact OG1-ND1 3.24Å; T862-K866 PolarHBondContact O-N 3.1Å; T862-K866 VanDerWaalsContact O-N 3.13Å
863	A	93.1	Very high	89.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-54.2	-35.1	172.7	0	0	0	0	0	112.6	L828 H829 A832 K866 A867 L879	L828-A863 HydrophobicContact CD2-CB 4.02Å; L828-A863 HydrophobicContact CG-CB 3.74Å; H829-A863 PolarHBondContact CD2-N 3.4Å; H829-A863 PolarHBondContact NE2-N 3.13Å; A832-A863 HydrophobicContact CB-CB 3.98Å; A832-A863 WeakPolarHBondContact CB-O 3.44Å; A863-K866 PolarHBondContact O-N 2.82Å; A863-A867 WeakPolarHBondContact O-CB 3.28Å; A863-A867 PolarHBondContact O-N 3.48Å; A863-L879 HydrophobicContact CB-CD1 4.12Å; A863-L879 HydrophobicContact CB-CD2 4.43Å
864	L	95.5	Very high	89.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.8	-36.8	176.8	-174	62	0	0	0	112.4	T862 A868 C876 L879 V880 A884 L886 A896 L910	T862-L864 PolarHBondContact O-N 3.28Å; T862-L864 PolarHBondContact OG1-N 3Å; L864-A868 VanDerWaalsContact O-CB 3.26Å; L864-A868 WeakPolarHBondContact O-CB 3.48Å; L864-A868 PolarHBondContact O-N 3.44Å; L864-C876 HydrophobicContact CD1-CB 4.23Å; L864-L879 HydrophobicContact CB-CD1 4.26Å; L864-L879 HydrophobicContact CD1-CB 4.01Å; L864-L879 HydrophobicContact CD1-CD1 4.25Å; L864-V880 HydrophobicContact CD1-CG2 4.1Å; L864-V880 HydrophobicContact CD2-CG2 4.17Å; L864-A884 HydrophobicContact CB-CB 4.36Å; L864-A884 HydrophobicContact CD2-CB 4.12Å; L864-L886 HydrophobicContact CD2-CD2 3.92Å; L864-A896 HydrophobicContact CB-CB 4.38Å; L864-A896 HydrophobicContact CD2-CB 3.95Å; L864-A896 HydrophobicContact CG-CB 3.71Å; L864-L910 HydrophobicContact CD1-CD2 4.29Å
865	H	94.3	Very high	90.2	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-42.9	174.6	-71.5	87.2	0	0	0	111.5	E861 T862 A868 S869 K888 K894 T895 A896	E861-H865 HydrophobicContact CB-CB 3.69Å; E861-H865 HydrophobicContact CG-CB 4.04Å; T862-H865 PolarHBondContact N-ND1 3.34Å; T862-H865 WeakPolarHBondContact O-CB 3.48Å; T862-H865 PolarHBondContact O-N 3.49Å; T862-H865 PolarHBondContact OG1-N 3.38Å; T862-H865 PolarHBondContact OG1-ND1 3.24Å; H865-A868 PolarHBondContact O-N 3.24Å; H865-S869 PolarHBondContact O-N 3.48Å; H865-S869 PolarHBondContact O-OG 2.86Å; H865-K888 PolarHBondContact CE1-O 2.77Å; H865-K888 PolarHBondContact NE2-O 3.34Å; H865-K894 PolarHBondContact NE2-O 3Å; H865-K894 VanDerWaalsContact NE2-O 3.16Å; H865-T895 VanDerWaalsContact NE2-C 3.34Å; H865-A896 PolarHBondContact CD2-N 3.33Å; H865-A896 PolarHBondContact NE2-N 2.97Å
866	K	93.1	Very high	90.5	Very high	14 Å²	14	36.2 Å²	36.2	6%	0.061	18%	0.176	C	C	.	.	H	α-helix	trans	-68.5	-39.5	178.2	-64.2	-166.8	-174.3	-62.6	0	112.8	H829 Q833 D856 E861 T862 A863 A868 S869 E870	H829-K866 HydrophobicContact CB-CD 3.94Å; Q833-K866 HydrophobicContact CB-CB 4.02Å; Q833-K866 HydrophobicContact CB-CD 4.4Å; Q833-K866 HydrophobicContact CG-CB 4.39Å; D856-K866 WeakPolarHBondContact OD2-CE 3.11Å; D856-K866 IonicContact OD2-NZ 3.97Å; D856-K866 PolarHBondContact OD2-NZ 2.9Å; E861-K866 HydrophobicContact CB-CG 4.22Å; E861-K866 IonicContact OE2-NZ 3.09Å; E861-K866 PolarHBondContact OE2-NZ 3.41Å; T862-K866 PolarHBondContact O-N 3.1Å; T862-K866 VanDerWaalsContact O-N 3.13Å; A863-K866 PolarHBondContact O-N 2.82Å; K866-A868 VanDerWaalsContact C-N 3.3Å; K866-A868 PolarHBondContact O-N 3.36Å; K866-S869 WeakPolarHBondContact CA-OG 3.24Å; K866-S869 PolarHBondContact O-OG 2.94Å; K866-E870 WeakPolarHBondContact O-CG 3.39Å; K866-E870 PolarHBondContact O-N 3.33Å
867	A	94.9	Very high	90.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.9	-39.5	172.7	0	0	0	0	0	111.6	A832 A863 K871 Q872 V875 C876 L879	A832-A867 HydrophobicContact CB-CB 4.26Å; A863-A867 WeakPolarHBondContact O-CB 3.28Å; A863-A867 PolarHBondContact O-N 3.48Å; A867-K871 PolarHBondContact O-N 3.42Å; A867-Q872 HydrophobicContact CB-CB 4.29Å; A867-Q872 PolarHBondContact O-N 3.42Å; A867-V875 HydrophobicContact CB-CB 4.28Å; A867-V875 HydrophobicContact CB-CG1 3.67Å; A867-C876 VanDerWaalsContact C-SG 3.57Å; A867-C876 VanDerWaalsContact CB-SG 3.57Å; A867-L879 HydrophobicContact CB-CD1 4.19Å
868	A	93.7	Very high	91.4	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-70.2	-41.3	178.9	0	0	0	0	0	112.6	L864 H865 K866 E870 K871 A896 Q899 A900 L910	L864-A868 VanDerWaalsContact O-CB 3.26Å; L864-A868 WeakPolarHBondContact O-CB 3.48Å; L864-A868 PolarHBondContact O-N 3.44Å; H865-A868 PolarHBondContact O-N 3.24Å; K866-A868 VanDerWaalsContact C-N 3.3Å; K866-A868 PolarHBondContact O-N 3.36Å; A868-E870 VanDerWaalsContact C-N 3.3Å; A868-E870 PolarHBondContact O-N 2.95Å; A868-K871 PolarHBondContact O-N 2.73Å; A868-A896 HydrophobicContact CB-CB 4.39Å; A868-A896 WeakPolarHBondContact CB-O 3.5Å; A868-Q899 HydrophobicContact CB-CB 4.35Å; A868-A900 HydrophobicContact CB-CB 4.34Å; A868-L910 HydrophobicContact CB-CD1 4.1Å
869	S	92.4	Very high	92	Very high	39 Å²	39	31.5 Å²	31.5	27%	0.273	15%	0.152	S	C	.	.	H	α-helix	trans	-63.8	-35.5	177.7	64.5	0	0	0	0	112.6	H865 K866 K871	H865-S869 PolarHBondContact O-N 3.48Å; H865-S869 PolarHBondContact O-OG 2.86Å; K866-S869 WeakPolarHBondContact CA-OG 3.24Å; K866-S869 PolarHBondContact O-OG 2.94Å; S869-K871 VanDerWaalsContact C-N 3.34Å
870	E	93.1	Very high	92.6	Very high	95 Å²	95	27.5 Å²	27.5	44%	0.444	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	8.9	177.9	-59.2	-57.9	154.6	0	0	113.4	Q833 K866 A868 Q872	Q833-E870 HydrophobicContact CG-CG 3.63Å; Q833-E870 WeakPolarHBondContact O-CB 3.28Å; Q833-E870 WeakPolarHBondContact O-CG 3.36Å; K866-E870 WeakPolarHBondContact O-CG 3.39Å; K866-E870 PolarHBondContact O-N 3.33Å; A868-E870 VanDerWaalsContact C-N 3.3Å; A868-E870 PolarHBondContact O-N 2.95Å; E870-Q872 VanDerWaalsContact C-N 3.29Å; E870-Q872 HydrophobicContact CB-CG 3.99Å; E870-Q872 PolarHBondContact O-N 3Å
871	K	93.4	Very high	92.7	Very high	96 Å²	96	35 Å²	35	42%	0.417	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	36.2	176.5	-50.8	179.3	-176.3	-169.7	0	113.8	A867 A868 S869 H873 G902 D903	A867-K871 PolarHBondContact O-N 3.42Å; A868-K871 PolarHBondContact O-N 2.73Å; S869-K871 VanDerWaalsContact C-N 3.34Å; K871-H873 PolarHBondContact O-CD2 2.94Å; K871-H873 VanDerWaalsContact O-CD2 3.25Å; K871-H873 PolarHBondContact O-N 3.4Å; K871-H873 VanDerWaalsContact O-N 3.07Å; K871-G902 PolarHBondContact NZ-O 3.14Å; K871-D903 HydrophobicContact CD-CB 4.06Å; K871-D903 HydrophobicContact CG-CB 4.12Å
872	Q	94.3	Very high	92.4	Very high	57 Å²	57	36.3 Å²	36.3	27%	0.266	18%	0.184	S	C	.	.			trans	-84.1	80	-179	-57.6	-64.1	-7.4	0	0	111.3	Q833 G835 A867 E870 A874 V875 C876	Q833-Q872 PolarHBondContact O-NE2 3.18Å; G835-Q872 VanDerWaalsContact CA-CD 3.41Å; A867-Q872 HydrophobicContact CB-CB 4.29Å; A867-Q872 PolarHBondContact O-N 3.42Å; E870-Q872 VanDerWaalsContact C-N 3.29Å; E870-Q872 HydrophobicContact CB-CG 3.99Å; E870-Q872 PolarHBondContact O-N 3Å; Q872-A874 PolarHBondContact O-N 3.17Å; Q872-V875 HydrophobicContact CB-CB 4Å; Q872-V875 HydrophobicContact CB-CG2 4.3Å; Q872-V875 PolarHBondContact O-N 2.86Å; Q872-C876 PolarHBondContact O-N 3.44Å; Q872-C876 PolarHBondContact O-SG 2.83Å
873	H	91.4	Very high	92	Very high	46 Å²	46	38.9 Å²	38.9	21%	0.213	21%	0.21	C	C	.	.	H	α-helix	trans	-53.8	-46.2	-174.6	-77.8	-102.8	0	0	0	114.6	K871 R877 D903	K871-H873 PolarHBondContact O-CD2 2.94Å; K871-H873 VanDerWaalsContact O-CD2 3.25Å; K871-H873 PolarHBondContact O-N 3.4Å; K871-H873 VanDerWaalsContact O-N 3.07Å; H873-R877 PolarHBondContact O-N 3.5Å; H873-R877 VanDerWaalsContact O-N 3.13Å; H873-D903 IonicContact CD2-OD2 3.57Å; H873-D903 IonicContact CE1-OD1 3.86Å; H873-D903 IonicContact CE1-OD2 3.48Å; H873-D903 IonicContact NE2-OD1 2.69Å; H873-D903 IonicContact NE2-OD2 3.55Å; H873-D903 PolarHBondContact NE2-OD2 3.48Å
874	A	90.4	Very high	91.7	Very high	43 Å²	43	39.2 Å²	39.2	36%	0.355	21%	0.213	S	C	.	.	H	α-helix	trans	-67.2	-43.3	-177.7	0	0	0	0	0	111.7	T837 Q872 R877 M878	T837-A874 HydrophobicContact CG2-CB 3.65Å; Q872-A874 PolarHBondContact O-N 3.17Å; A874-R877 PolarHBondContact O-N 2.89Å; A874-M878 WeakPolarHBondContact O-CG 3.37Å; A874-M878 PolarHBondContact O-N 3.22Å
875	V	94.4	Very high	91.2	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-65.6	-42.3	176.8	172.3	0	0	0	0	111.3	A832 T837 V840 A867 Q872 R877 M878 L879	A832-V875 HydrophobicContact CB-CG1 3.78Å; T837-V875 HydrophobicContact CG2-CG2 3.92Å; V840-V875 HydrophobicContact CG1-CG1 4.37Å; V840-V875 HydrophobicContact CG2-CG1 4.11Å; V840-V875 HydrophobicContact CG2-CG2 4.24Å; A867-V875 HydrophobicContact CB-CB 4.28Å; A867-V875 HydrophobicContact CB-CG1 3.67Å; Q872-V875 HydrophobicContact CB-CB 4Å; Q872-V875 HydrophobicContact CB-CG2 4.3Å; Q872-V875 PolarHBondContact O-N 2.86Å; V875-R877 VanDerWaalsContact C-N 3.31Å; V875-R877 PolarHBondContact O-N 3.29Å; V875-M878 PolarHBondContact O-N 3.04Å; V875-L879 HydrophobicContact CG1-CD1 3.78Å; V875-L879 HydrophobicContact CG1-CG 4.2Å; V875-L879 WeakPolarHBondContact O-CB 3.32Å; V875-L879 WeakPolarHBondContact O-CG 3.41Å; V875-L879 PolarHBondContact O-N 3.4Å
876	C	93.8	Very high	90.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.7	-43.6	176.4	-69.9	0	0	0	0	111.5	L864 A867 Q872 L879 V880 L906	L864-C876 HydrophobicContact CD1-CB 4.23Å; A867-C876 VanDerWaalsContact C-SG 3.57Å; A867-C876 VanDerWaalsContact CB-SG 3.57Å; Q872-C876 PolarHBondContact O-N 3.44Å; Q872-C876 PolarHBondContact O-SG 2.83Å; C876-L879 PolarHBondContact O-N 2.97Å; C876-V880 WeakPolarHBondContact O-CB 3.41Å; C876-V880 VanDerWaalsContact O-CG2 3.22Å; C876-V880 WeakPolarHBondContact O-CG2 3.36Å; C876-V880 PolarHBondContact O-N 3.07Å; C876-L906 HydrophobicContact CB-CD1 3.84Å
877	R	91.6	Very high	90.6	Very high	105 Å²	105	46.3 Å²	46.3	40%	0.396	25%	0.251	S	S	.	.	H	α-helix	trans	-61.1	-47.8	174.9	-75.6	-172.9	-75.7	-100.3	3.2	111.8	H873 A874 V875 L879 V880 E881 F909	H873-R877 PolarHBondContact O-N 3.5Å; H873-R877 VanDerWaalsContact O-N 3.13Å; A874-R877 PolarHBondContact O-N 2.89Å; V875-R877 VanDerWaalsContact C-N 3.31Å; V875-R877 PolarHBondContact O-N 3.29Å; R877-L879 PolarHBondContact O-N 3.43Å; R877-V880 PolarHBondContact O-N 3.09Å; R877-E881 WeakPolarHBondContact O-CB 3.48Å; R877-E881 VanDerWaalsContact O-CG 3.32Å; R877-E881 WeakPolarHBondContact O-CG 3.22Å; R877-E881 PolarHBondContact O-N 3.38Å; R877-F909 HydrophobicContact CB-CZ 4.48Å; R877-F909 HydrophobicContact CG-CE1 3.86Å; R877-F909 HydrophobicContact CG-CE2 4.24Å; R877-F909 HydrophobicContact CG-CZ 3.65Å
878	M	91.5	Very high	89.9	Confident	41 Å²	41	50.2 Å²	50.2	20%	0.202	27%	0.268	C	S	.	.	H	α-helix	trans	-61.7	-41.8	179.6	-70.9	172.5	53.3	0	0	113.1	T837 V840 S841 L844 A874 V875 E881 A882	T837-M878 HydrophobicContact CG2-SD 4.16Å; T837-M878 WeakPolarHBondContact O-CE 3.22Å; V840-M878 HydrophobicContact CB-CE 3.97Å; V840-M878 HydrophobicContact CG1-CE 3.81Å; S841-M878 VanDerWaalsContact N-CE 3.31Å; L844-M878 HydrophobicContact CD1-CB 4.48Å; A874-M878 WeakPolarHBondContact O-CG 3.37Å; A874-M878 PolarHBondContact O-N 3.22Å; V875-M878 PolarHBondContact O-N 3.04Å; M878-E881 PolarHBondContact O-N 3.29Å; M878-A882 VanDerWaalsContact O-CB 3.29Å; M878-A882 WeakPolarHBondContact O-CB 3.44Å; M878-A882 PolarHBondContact O-N 2.95Å
879	L	91.7	Very high	89.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67	-40.1	177.7	-72.1	173	0	0	0	111.7	L828 A832 V840 L844 L852 A863 L864 A867 V875 C876 R877 A882 G883 A884	L828-L879 HydrophobicContact CD1-CD2 4.22Å; L828-L879 HydrophobicContact CD2-CD2 4.26Å; L828-L879 HydrophobicContact CG-CD2 4.49Å; A832-L879 HydrophobicContact CB-CD1 4.15Å; V840-L879 HydrophobicContact CG1-CD2 4.26Å; V840-L879 HydrophobicContact CG1-CG 4.47Å; L844-L879 HydrophobicContact CD1-CD2 4.23Å; L844-L879 HydrophobicContact CD2-CD2 4.18Å; L852-L879 HydrophobicContact CD2-CD2 4.04Å; A863-L879 HydrophobicContact CB-CD1 4.12Å; A863-L879 HydrophobicContact CB-CD2 4.43Å; L864-L879 HydrophobicContact CB-CD1 4.26Å; L864-L879 HydrophobicContact CD1-CB 4.01Å; L864-L879 HydrophobicContact CD1-CD1 4.25Å; A867-L879 HydrophobicContact CB-CD1 4.19Å; V875-L879 HydrophobicContact CG1-CD1 3.78Å; V875-L879 HydrophobicContact CG1-CG 4.2Å; V875-L879 WeakPolarHBondContact O-CB 3.32Å; V875-L879 WeakPolarHBondContact O-CG 3.41Å; V875-L879 PolarHBondContact O-N 3.4Å; C876-L879 PolarHBondContact O-N 2.97Å; R877-L879 PolarHBondContact O-N 3.43Å; L879-A882 PolarHBondContact O-N 2.91Å; L879-G883 PolarHBondContact O-N 3.49Å; L879-A884 HydrophobicContact CB-CB 4.15Å; L879-A884 WeakPolarHBondContact O-CB 3.38Å; L879-A884 PolarHBondContact O-N 2.97Å
880	V	92.7	Very high	89.3	Confident	26 Å²	26	52.6 Å²	52.6	16%	0.158	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-43.1	175.4	171.9	0	0	0	0	111.2	L864 C876 R877 A882 G883 L886 F909 L910 Q913	L864-V880 HydrophobicContact CD1-CG2 4.1Å; L864-V880 HydrophobicContact CD2-CG2 4.17Å; C876-V880 WeakPolarHBondContact O-CB 3.41Å; C876-V880 VanDerWaalsContact O-CG2 3.22Å; C876-V880 WeakPolarHBondContact O-CG2 3.36Å; C876-V880 PolarHBondContact O-N 3.07Å; R877-V880 PolarHBondContact O-N 3.09Å; V880-A882 VanDerWaalsContact C-N 3.27Å; V880-A882 PolarHBondContact O-N 2.89Å; V880-G883 PolarHBondContact O-N 3.31Å; V880-L886 HydrophobicContact CG1-CD1 4.47Å; V880-L886 HydrophobicContact CG2-CD2 3.87Å; V880-F909 HydrophobicContact CG2-CE1 4.45Å; V880-L910 HydrophobicContact CG2-CD2 3.9Å; V880-Q913 HydrophobicContact CG1-CB 4.39Å; V880-Q913 HydrophobicContact CG1-CG 4.31Å
881	E	87.9	Confident	89	Confident	160 Å²	160	55 Å²	55	75%	0.748	29%	0.29	S	S	*	.	H	α-helix	trans	-62.6	-33.8	174.5	-75	172.9	-170.3	0	0	112.4	R877 M878 G883	R877-E881 WeakPolarHBondContact O-CB 3.48Å; R877-E881 VanDerWaalsContact O-CG 3.32Å; R877-E881 WeakPolarHBondContact O-CG 3.22Å; R877-E881 PolarHBondContact O-N 3.38Å; M878-E881 PolarHBondContact O-N 3.29Å; E881-G883 PolarHBondContact O-N 3.19Å
882	A	83.7	Confident	88.3	Confident	38 Å²	38	56.5 Å²	56.5	31%	0.314	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-7.7	174.6	0	0	0	0	0	113.9	L844 L852 M878 L879 V880	L844-A882 HydrophobicContact CD1-CB 3.84Å; L844-A882 HydrophobicContact CD2-CB 4Å; L844-A882 HydrophobicContact CG-CB 4.4Å; L852-A882 HydrophobicContact CD1-CB 4.47Å; L852-A882 VanDerWaalsContact CD1-O 3.27Å; L852-A882 WeakPolarHBondContact CD1-O 3.47Å; L852-A882 HydrophobicContact CD2-CB 3.95Å; M878-A882 VanDerWaalsContact O-CB 3.29Å; M878-A882 WeakPolarHBondContact O-CB 3.44Å; M878-A882 PolarHBondContact O-N 2.95Å; L879-A882 PolarHBondContact O-N 2.91Å; V880-A882 VanDerWaalsContact C-N 3.27Å; V880-A882 PolarHBondContact O-N 2.89Å
883	G	84.2	Confident	87.8	Confident	54 Å²	54	56.1 Å²	56.1	56%	0.557	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.8	24.8	175	0	0	0	0	0	115.4	L879 V880 E881	L879-G883 PolarHBondContact O-N 3.49Å; V880-G883 PolarHBondContact O-N 3.31Å; E881-G883 PolarHBondContact O-N 3.19Å
884	A	87.3	Confident	87.6	Confident	8 Å²	8	58.1 Å²	58.1	7%	0.066	32%	0.318	C	S	.	.			trans	-60.1	140	171.9	0	0	0	0	0	111.6	L852 L864 L879 L886	L852-A884 HydrophobicContact CB-CB 4.44Å; L852-A884 HydrophobicContact CD2-CB 4.23Å; L864-A884 HydrophobicContact CB-CB 4.36Å; L864-A884 HydrophobicContact CD2-CB 4.12Å; L879-A884 HydrophobicContact CB-CB 4.15Å; L879-A884 WeakPolarHBondContact O-CB 3.38Å; L879-A884 PolarHBondContact O-N 2.97Å; A884-L886 PolarHBondContact O-N 3.46Å
885	S	86.4	Confident	87.6	Confident	33 Å²	33	56.9 Å²	56.9	23%	0.231	31%	0.306	C	S	.	.			trans	-67.9	123.8	-179.6	-176.2	0	0	0	0	111.8	D853 E887 K888	D853-S885 WeakPolarHBondContact OD1-CB 3.43Å; D853-S885 PolarHBondContact OD1-N 3.47Å; S885-E887 VanDerWaalsContact C-N 3.34Å; S885-E887 PolarHBondContact OG-N 3.4Å; S885-K888 PolarHBondContact OG-N 3.49Å
886	L	86.9	Confident	87.3	Confident	18 Å²	18	56.9 Å²	56.9	9%	0.094	31%	0.306	C	S	.	.	S	Bend	trans	-82.1	-13.3	173.3	-69.8	165.9	0	0	0	112.8	L864 V880 A884 L910 Q913 Q914	L864-L886 HydrophobicContact CD2-CD2 3.92Å; V880-L886 HydrophobicContact CG1-CD1 4.47Å; V880-L886 HydrophobicContact CG2-CD2 3.87Å; A884-L886 PolarHBondContact O-N 3.46Å; L886-L910 HydrophobicContact CD2-CB 4.39Å; L886-L910 HydrophobicContact CD2-CD2 3.75Å; L886-Q913 HydrophobicContact CD1-CB 3.58Å; L886-Q914 HydrophobicContact CB-CB 4.42Å; L886-Q914 HydrophobicContact CB-CG 4.41Å
887	E	86.4	Confident	87.1	Confident	113 Å²	113	57.5 Å²	57.5	53%	0.528	31%	0.311	S	S	.	.	S	Bend	trans	-102.6	-13.3	-172.9	-60.1	-172.4	171.6	0	0	113.4	S885 T889 Q914	S885-E887 VanDerWaalsContact C-N 3.34Å; S885-E887 PolarHBondContact OG-N 3.4Å; E887-T889 PolarHBondContact O-N 3.42Å; E887-Q914 HydrophobicContact CG-CG 4.35Å
888	K	81.4	Confident	87	Confident	82 Å²	82	56.6 Å²	56.6	36%	0.357	31%	0.314	S	S	.	.			trans	-63.7	134.6	176.1	-82.7	-177.2	177.9	178.1	0	110.5	D853 H865 S885	D853-K888 HydrophobicContact CB-CD 3.69Å; D853-K888 VanDerWaalsContact CG-NZ 3.32Å; D853-K888 WeakPolarHBondContact OD2-CE 3.49Å; D853-K888 IonicContact OD2-NZ 3.18Å; D853-K888 PolarHBondContact OD2-NZ 2.95Å; H865-K888 PolarHBondContact CE1-O 2.77Å; H865-K888 PolarHBondContact NE2-O 3.34Å; S885-K888 PolarHBondContact OG-N 3.49Å
889	T	87.8	Confident	86.8	Confident	83 Å²	83	56.1 Å²	56.1	51%	0.509	31%	0.311	S	S	.	.			trans	-108.1	140.8	177	57.8	0	0	0	0	110.8	E887 K894 T895	E887-T889 PolarHBondContact O-N 3.42Å; T889-K894 WeakPolarHBondContact CA-O 3.25Å; T889-T895 HydrophobicContact CG2-CG2 4.04Å
890	N	85.6	Confident	86.5	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.027	31%	0.311	C	S	.	.			trans	-71.3	-177.9	170.2	76.5	-1.4	0	0	0	112.1	K859 G860 E861 Q892 G893 K894 Q899	K859-N890 WeakPolarHBondContact O-CB 3.26Å; G860-N890 WeakPolarHBondContact O-CA 3.35Å; E861-N890 HydrophobicContact CG-CB 4.12Å; N890-Q892 PolarHBondContact O-N 3.37Å; N890-Q892 WeakPolarHBondContact OD1-CA 3.21Å; N890-Q892 WeakPolarHBondContact OD1-CB 3.46Å; N890-Q892 PolarHBondContact OD1-N 3.09Å; N890-G893 PolarHBondContact O-N 3.11Å; N890-G893 PolarHBondContact OD1-N 3.39Å; N890-K894 PolarHBondContact N-O 3.37Å; N890-K894 PolarHBondContact OD1-N 3.37Å; N890-K894 VanDerWaalsContact OD1-N 3.08Å; N890-K894 PolarHBondContact OD1-O 3.49Å; N890-Q899 PolarHBondContact ND2-NE2 3.08Å
891	F	85.9	Confident	85.3	Confident	145 Å²	145	58.8 Å²	58.8	64%	0.636	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-12.6	-179.4	-60.2	-27.1	0	0	0	114.6	K859 G860	K859-F891 WeakPolarHBondContact O-CB 3.5Å; K859-F891 WeakPolarHBondContact O-CD2 3.42Å; K859-F891 WeakPolarHBondContact O-CG 3.4Å; K859-F891 PolarHBondContact O-N 3.41Å; G860-F891 VanDerWaalsContact N-CE2 3.32Å
892	Q	79.8	Confident	84.6	Confident	129 Å²	129	54.3 Å²	54.3	60%	0.603	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	3.7	173.3	-59.1	179	-1	0	0	112.7	N890 K894	N890-Q892 PolarHBondContact O-N 3.37Å; N890-Q892 WeakPolarHBondContact OD1-CA 3.21Å; N890-Q892 WeakPolarHBondContact OD1-CB 3.46Å; N890-Q892 PolarHBondContact OD1-N 3.09Å; Q892-K894 VanDerWaalsContact C-N 3.26Å; Q892-K894 HydrophobicContact CB-CG 4.39Å; Q892-K894 PolarHBondContact O-N 3.46Å
893	G	83.5	Confident	84.6	Confident	49 Å²	49	54 Å²	54	51%	0.505	33%	0.325	S	S	.	.	S	Bend	trans	73.3	14.7	-176.8	0	0	0	0	0	114.1	N890	N890-G893 PolarHBondContact O-N 3.11Å; N890-G893 PolarHBondContact OD1-N 3.39Å
894	K	86.1	Confident	84.6	Confident	87 Å²	87	56.1 Å²	56.1	38%	0.378	33%	0.332	S	S	.	.			trans	-94.7	135	-178.9	-70.1	-178.6	177.7	177.5	0	110.7	H865 T889 N890 Q892 D898	H865-K894 PolarHBondContact NE2-O 3Å; H865-K894 VanDerWaalsContact NE2-O 3.16Å; T889-K894 WeakPolarHBondContact CA-O 3.25Å; N890-K894 PolarHBondContact N-O 3.37Å; N890-K894 PolarHBondContact OD1-N 3.37Å; N890-K894 VanDerWaalsContact OD1-N 3.08Å; N890-K894 PolarHBondContact OD1-O 3.49Å; Q892-K894 VanDerWaalsContact C-N 3.26Å; Q892-K894 HydrophobicContact CB-CG 4.39Å; Q892-K894 PolarHBondContact O-N 3.46Å; K894-D898 HydrophobicContact CB-CB 3.89Å; K894-D898 HydrophobicContact CG-CB 4.19Å
895	T	91.5	Very high	84.5	Confident	18 Å²	18	62.7 Å²	62.7	11%	0.11	36%	0.361	C	S	.	.			trans	-78.1	170.4	170.8	65.5	0	0	0	0	111.1	H865 T889 A897 D898 Q899	H865-T895 VanDerWaalsContact NE2-C 3.34Å; T889-T895 HydrophobicContact CG2-CG2 4.04Å; T895-A897 PolarHBondContact O-N 3.43Å; T895-A897 PolarHBondContact OG1-N 2.85Å; T895-D898 WeakPolarHBondContact CB-OD2 3.23Å; T895-D898 PolarHBondContact N-OD2 2.74Å; T895-D898 WeakPolarHBondContact O-CB 3.44Å; T895-D898 PolarHBondContact O-N 3.5Å; T895-D898 VanDerWaalsContact O-N 3.09Å; T895-D898 VanDerWaalsContact OG1-CG 3.26Å; T895-D898 PolarHBondContact OG1-N 3.25Å; T895-D898 PolarHBondContact OG1-OD2 2.64Å; T895-Q899 PolarHBondContact O-N 3.29Å; T895-Q899 VanDerWaalsContact O-N 3.09Å
896	A	88.6	Confident	84.5	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.008	35%	0.351	C	S	.	.	H	α-helix	trans	-60.7	-32.6	172.9	0	0	0	0	0	112.4	L864 H865 A868 D898 Q899 A900 L910	L864-A896 HydrophobicContact CB-CB 4.38Å; L864-A896 HydrophobicContact CD2-CB 3.95Å; L864-A896 HydrophobicContact CG-CB 3.71Å; H865-A896 PolarHBondContact CD2-N 3.33Å; H865-A896 PolarHBondContact NE2-N 2.97Å; A868-A896 HydrophobicContact CB-CB 4.39Å; A868-A896 WeakPolarHBondContact CB-O 3.5Å; A896-D898 VanDerWaalsContact C-N 3.33Å; A896-D898 PolarHBondContact O-N 3.48Å; A896-Q899 PolarHBondContact O-N 3.09Å; A896-A900 PolarHBondContact O-N 3.31Å; A896-L910 HydrophobicContact CB-CD1 4.49Å
897	A	89.6	Confident	84.5	Confident	12 Å²	12	61.4 Å²	61.4	10%	0.099	36%	0.356	C	S	.	.	H	α-helix	trans	-64.6	-37.9	174.2	0	0	0	0	0	111.9	T895 Q899 A900 L910	T895-A897 PolarHBondContact O-N 3.43Å; T895-A897 PolarHBondContact OG1-N 2.85Å; A897-Q899 VanDerWaalsContact C-N 3.3Å; A897-Q899 PolarHBondContact O-N 3.2Å; A897-A900 PolarHBondContact O-N 3.07Å; A897-L910 HydrophobicContact CB-CB 3.86Å
898	D	88.8	Confident	84.5	Confident	86 Å²	86	60.8 Å²	60.8	46%	0.46	36%	0.359	S	S	.	.	H	α-helix	trans	-70.5	-26.7	176.2	-58.5	-51	0	0	0	112.6	K894 T895 A896 A900	K894-D898 HydrophobicContact CB-CB 3.89Å; K894-D898 HydrophobicContact CG-CB 4.19Å; T895-D898 WeakPolarHBondContact CB-OD2 3.23Å; T895-D898 PolarHBondContact N-OD2 2.74Å; T895-D898 WeakPolarHBondContact O-CB 3.44Å; T895-D898 PolarHBondContact O-N 3.5Å; T895-D898 VanDerWaalsContact O-N 3.09Å; T895-D898 VanDerWaalsContact OG1-CG 3.26Å; T895-D898 PolarHBondContact OG1-N 3.25Å; T895-D898 PolarHBondContact OG1-OD2 2.64Å; A896-D898 VanDerWaalsContact C-N 3.33Å; A896-D898 PolarHBondContact O-N 3.48Å; D898-A900 VanDerWaalsContact C-N 3.34Å
899	Q	87.7	Confident	84.9	Confident	31 Å²	31	59.3 Å²	59.3	15%	0.145	35%	0.353	C	S	.	.	H	α-helix	trans	-76.8	-19.1	175.5	-70.4	-60.9	-15.5	0	0	113.4	A868 N890 T895 A896 A897 A901	A868-Q899 HydrophobicContact CB-CB 4.35Å; N890-Q899 PolarHBondContact ND2-NE2 3.08Å; T895-Q899 PolarHBondContact O-N 3.29Å; T895-Q899 VanDerWaalsContact O-N 3.09Å; A896-Q899 PolarHBondContact O-N 3.09Å; A897-Q899 VanDerWaalsContact C-N 3.3Å; A897-Q899 PolarHBondContact O-N 3.2Å; Q899-A901 PolarHBondContact O-N 3.44Å
900	A	84.9	Confident	84.9	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.008	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	21.9	171.4	0	0	0	0	0	113.3	A868 A896 A897 D898 G902 D903 L906 A907	A868-A900 HydrophobicContact CB-CB 4.34Å; A896-A900 PolarHBondContact O-N 3.31Å; A897-A900 PolarHBondContact O-N 3.07Å; D898-A900 VanDerWaalsContact C-N 3.34Å; A900-G902 PolarHBondContact O-N 3.13Å; A900-G902 VanDerWaalsContact O-N 3.09Å; A900-D903 PolarHBondContact O-N 3.46Å; A900-L906 HydrophobicContact CB-CB 4.31Å; A900-L906 HydrophobicContact CB-CD2 4.18Å; A900-L906 HydrophobicContact CB-CG 4.12Å; A900-A907 HydrophobicContact CB-CB 4.15Å
901	A	68	Low	84.8	Confident	82 Å²	82	57.4 Å²	57.4	68%	0.678	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	114.5	-178.8	0	0	0	0	0	111	Q899	Q899-A901 PolarHBondContact O-N 3.44Å
902	G	72.4	Confident	84.7	Confident	65 Å²	65	52.9 Å²	52.9	67%	0.67	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.6	8	-175	0	0	0	0	0	114.9	K871 A900	K871-G902 PolarHBondContact NZ-O 3.14Å; A900-G902 PolarHBondContact O-N 3.13Å; A900-G902 VanDerWaalsContact O-N 3.09Å
903	D	84.5	Confident	84.7	Confident	31 Å²	31	50 Å²	50	17%	0.166	32%	0.316	C	S	.	.			trans	-133.1	93.4	164.6	-167	-40.4	0	0	0	110.2	K871 H873 A900 E905 L906 A907	K871-D903 HydrophobicContact CD-CB 4.06Å; K871-D903 HydrophobicContact CG-CB 4.12Å; H873-D903 IonicContact CD2-OD2 3.57Å; H873-D903 IonicContact CE1-OD1 3.86Å; H873-D903 IonicContact CE1-OD2 3.48Å; H873-D903 IonicContact NE2-OD1 2.69Å; H873-D903 IonicContact NE2-OD2 3.55Å; H873-D903 PolarHBondContact NE2-OD2 3.48Å; A900-D903 PolarHBondContact O-N 3.46Å; D903-E905 PolarHBondContact O-N 3.28Å; D903-E905 PolarHBondContact OD1-N 3.29Å; D903-L906 HydrophobicContact CB-CB 4.1Å; D903-L906 PolarHBondContact O-N 3.47Å; D903-L906 PolarHBondContact OD1-N 2.88Å; D903-A907 WeakPolarHBondContact O-CB 3.25Å; D903-A907 PolarHBondContact O-N 3.48Å
904	S	82.6	Confident	84	Confident	100 Å²	100	50.4 Å²	50.4	70%	0.699	31%	0.305	S	S	*	.	H	α-helix	trans	-64	-29.1	-174.9	-54.4	0	0	0	0	113.1	V908	S904-V908 WeakPolarHBondContact O-CB 3.13Å; S904-V908 WeakPolarHBondContact O-CG2 3.27Å; S904-V908 PolarHBondContact O-N 3.06Å
905	E	85.7	Confident	82.7	Confident	145 Å²	145	53.4 Å²	53.4	68%	0.678	32%	0.32	S	S	*	.	H	α-helix	trans	-73	-44.6	-179.9	-173.6	178.2	174.2	0	0	110.5	D903 V908 F909	D903-E905 PolarHBondContact O-N 3.28Å; D903-E905 PolarHBondContact OD1-N 3.29Å; E905-V908 PolarHBondContact O-N 2.98Å; E905-F909 WeakPolarHBondContact O-CB 3.39Å; E905-F909 PolarHBondContact O-N 3.37Å
906	L	87.8	Confident	80.9	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-67.9	-42.1	178.4	-172.7	57.5	0	0	0	112.3	C876 A900 D903 V908 F909 L910	C876-L906 HydrophobicContact CB-CD1 3.84Å; A900-L906 HydrophobicContact CB-CB 4.31Å; A900-L906 HydrophobicContact CB-CD2 4.18Å; A900-L906 HydrophobicContact CB-CG 4.12Å; D903-L906 HydrophobicContact CB-CB 4.1Å; D903-L906 PolarHBondContact O-N 3.47Å; D903-L906 PolarHBondContact OD1-N 2.88Å; L906-V908 VanDerWaalsContact C-N 3.33Å; L906-V908 PolarHBondContact O-N 3.44Å; L906-F909 HydrophobicContact CD1-CD1 4.23Å; L906-F909 WeakPolarHBondContact O-CB 3.33Å; L906-F909 PolarHBondContact O-N 3.13Å; L906-L910 HydrophobicContact CD1-CD1 4.43Å; L906-L910 HydrophobicContact CD1-CG 4.42Å; L906-L910 HydrophobicContact CG-CD1 4.23Å; L906-L910 WeakPolarHBondContact O-CG 3.34Å; L906-L910 PolarHBondContact O-N 3.29Å
907	A	86.8	Confident	79	Confident	24 Å²	24	57.3 Å²	57.3	20%	0.198	35%	0.345	C	S	.	.	H	α-helix	trans	-62.4	-40.1	177.2	0	0	0	0	0	112.1	A900 D903 S911	A900-A907 HydrophobicContact CB-CB 4.15Å; D903-A907 WeakPolarHBondContact O-CB 3.25Å; D903-A907 PolarHBondContact O-N 3.48Å; A907-S911 VanDerWaalsContact O-CB 3.25Å; A907-S911 WeakPolarHBondContact O-CB 3.46Å; A907-S911 PolarHBondContact O-N 3.22Å; A907-S911 PolarHBondContact O-OG 3.07Å
908	V	86.5	Confident	76.8	Confident	100 Å²	100	59.9 Å²	59.9	61%	0.606	36%	0.362	S	S	*	.	H	α-helix	trans	-67.2	-42.5	174.4	169.9	0	0	0	0	111	S904 E905 L906 S911 S912	S904-V908 WeakPolarHBondContact O-CB 3.13Å; S904-V908 WeakPolarHBondContact O-CG2 3.27Å; S904-V908 PolarHBondContact O-N 3.06Å; E905-V908 PolarHBondContact O-N 2.98Å; L906-V908 VanDerWaalsContact C-N 3.33Å; L906-V908 PolarHBondContact O-N 3.44Å; V908-S911 PolarHBondContact O-N 3.47Å; V908-S912 VanDerWaalsContact O-CB 3.25Å; V908-S912 WeakPolarHBondContact O-CB 3.38Å; V908-S912 PolarHBondContact O-N 3.29Å; V908-S912 PolarHBondContact O-OG 3.17Å
909	F	89.9	Confident	74.3	Confident	51 Å²	51	59.1 Å²	59.1	22%	0.224	37%	0.374	C	S	.	.	H	α-helix	trans	-56.3	-55.3	175.1	169.5	-103.8	0	0	0	111.3	R877 V880 E905 L906 S911 S912 Q913	R877-F909 HydrophobicContact CB-CZ 4.48Å; R877-F909 HydrophobicContact CG-CE1 3.86Å; R877-F909 HydrophobicContact CG-CE2 4.24Å; R877-F909 HydrophobicContact CG-CZ 3.65Å; V880-F909 HydrophobicContact CG2-CE1 4.45Å; E905-F909 WeakPolarHBondContact O-CB 3.39Å; E905-F909 PolarHBondContact O-N 3.37Å; L906-F909 HydrophobicContact CD1-CD1 4.23Å; L906-F909 WeakPolarHBondContact O-CB 3.33Å; L906-F909 PolarHBondContact O-N 3.13Å; F909-S911 PolarHBondContact O-N 3.4Å; F909-S912 PolarHBondContact O-N 2.92Å; F909-S912 PolarHBondContact O-OG 3.18Å; F909-Q913 HydrophobicContact CD2-CG 4.31Å; F909-Q913 HydrophobicContact CE2-CG 3.87Å; F909-Q913 HydrophobicContact CZ-CG 3.99Å; F909-Q913 WeakPolarHBondContact O-CG 3.48Å; F909-Q913 PolarHBondContact O-N 3.42Å; F909-Q913 VanDerWaalsContact O-N 3.09Å
910	L	87.3	Confident	71.7	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	40%	0.398	C	S	.	.	H	α-helix	trans	-62	-41.6	-178.5	-66.8	172.5	0	0	0	112.1	L864 A868 V880 L886 A896 A897 L906 S912 Q913 Q914	L864-L910 HydrophobicContact CD1-CD2 4.29Å; A868-L910 HydrophobicContact CB-CD1 4.1Å; V880-L910 HydrophobicContact CG2-CD2 3.9Å; L886-L910 HydrophobicContact CD2-CB 4.39Å; L886-L910 HydrophobicContact CD2-CD2 3.75Å; A896-L910 HydrophobicContact CB-CD1 4.49Å; A897-L910 HydrophobicContact CB-CB 3.86Å; L906-L910 HydrophobicContact CD1-CD1 4.43Å; L906-L910 HydrophobicContact CD1-CG 4.42Å; L906-L910 HydrophobicContact CG-CD1 4.23Å; L906-L910 WeakPolarHBondContact O-CG 3.34Å; L906-L910 PolarHBondContact O-N 3.29Å; L910-S912 PolarHBondContact O-N 3.32Å; L910-Q913 PolarHBondContact O-N 3.3Å; L910-Q914 PolarHBondContact O-N 2.72Å; L910-Q914 VanDerWaalsContact O-N 3.11Å
911	S	84	Confident	69.2	Low	47 Å²	47	67.9 Å²	67.9	33%	0.329	43%	0.426	S	S	.	.	H	α-helix	trans	-67	-35.7	177.2	-57.9	0	0	0	0	112.8	A907 V908 F909 Q914 Q915	A907-S911 VanDerWaalsContact O-CB 3.25Å; A907-S911 WeakPolarHBondContact O-CB 3.46Å; A907-S911 PolarHBondContact O-N 3.22Å; A907-S911 PolarHBondContact O-OG 3.07Å; V908-S911 PolarHBondContact O-N 3.47Å; F909-S911 PolarHBondContact O-N 3.4Å; S911-Q914 WeakPolarHBondContact O-CB 3.48Å; S911-Q914 PolarHBondContact O-N 2.95Å; S911-Q915 PolarHBondContact O-N 3.21Å
912	S	82.5	Confident	67.5	Low	49 Å²	49	72.8 Å²	72.8	34%	0.343	44%	0.435	S	S	.	.	H	α-helix	trans	-68.5	-37.3	177.4	74.2	0	0	0	0	112.2	V908 F909 L910 Q914 Q915 T916	V908-S912 VanDerWaalsContact O-CB 3.25Å; V908-S912 WeakPolarHBondContact O-CB 3.38Å; V908-S912 PolarHBondContact O-N 3.29Å; V908-S912 PolarHBondContact O-OG 3.17Å; F909-S912 PolarHBondContact O-N 2.92Å; F909-S912 PolarHBondContact O-OG 3.18Å; L910-S912 PolarHBondContact O-N 3.32Å; S912-Q914 VanDerWaalsContact C-N 3.32Å; S912-Q915 PolarHBondContact O-N 2.84Å; S912-T916 PolarHBondContact O-N 3.25Å; S912-T916 PolarHBondContact O-OG1 2.95Å
913	Q	80.3	Confident	65.8	Low	70 Å²	70	76.6 Å²	76.6	33%	0.327	44%	0.44	S	S	.	.	H	α-helix	trans	-71.2	-28.2	175.7	-63.6	-53.4	-52.7	0	0	112.1	V880 L886 F909 L910 T916 S917	V880-Q913 HydrophobicContact CG1-CB 4.39Å; V880-Q913 HydrophobicContact CG1-CG 4.31Å; L886-Q913 HydrophobicContact CD1-CB 3.58Å; F909-Q913 HydrophobicContact CD2-CG 4.31Å; F909-Q913 HydrophobicContact CE2-CG 3.87Å; F909-Q913 HydrophobicContact CZ-CG 3.99Å; F909-Q913 WeakPolarHBondContact O-CG 3.48Å; F909-Q913 PolarHBondContact O-N 3.42Å; F909-Q913 VanDerWaalsContact O-N 3.09Å; L910-Q913 PolarHBondContact O-N 3.3Å; Q913-T916 WeakPolarHBondContact CA-OG1 3.25Å; Q913-T916 PolarHBondContact O-OG1 3.45Å; Q913-S917 WeakPolarHBondContact O-CB 3.38Å; Q913-S917 PolarHBondContact O-N 3.04Å; Q913-S917 PolarHBondContact O-OG 3.09Å; Q913-S917 VanDerWaalsContact O-OG 3.1Å
914	Q	68.5	Low	63.6	Low	56 Å²	56	82.4 Å²	82.4	26%	0.262	47%	0.47	S	S	.	.	H	α-helix	trans	-67.9	-34.4	173.9	-164.8	179.5	6.7	0	0	112.3	L886 E887 L910 S911 S912 S917 S918	L886-Q914 HydrophobicContact CB-CB 4.42Å; L886-Q914 HydrophobicContact CB-CG 4.41Å; E887-Q914 HydrophobicContact CG-CG 4.35Å; L910-Q914 PolarHBondContact O-N 2.72Å; L910-Q914 VanDerWaalsContact O-N 3.11Å; S911-Q914 WeakPolarHBondContact O-CB 3.48Å; S911-Q914 PolarHBondContact O-N 2.95Å; S912-Q914 VanDerWaalsContact C-N 3.32Å; Q914-S917 WeakPolarHBondContact CA-OG 3.46Å; Q914-S917 PolarHBondContact O-OG 3.19Å; Q914-S918 PolarHBondContact O-N 2.73Å; Q914-S918 VanDerWaalsContact O-N 3.17Å; Q914-S918 PolarHBondContact O-OG 3.25Å
915	Q	58.3	Low	60.9	Low	150 Å²	150	86.3 Å²	86.3	70%	0.701	48%	0.477	S	S	*	.	H	α-helix	trans	-74.4	-31.4	177.6	-69.1	179.5	11.2	0	0	112.8	S911 S912 S918	S911-Q915 PolarHBondContact O-N 3.21Å; S912-Q915 PolarHBondContact O-N 2.84Å; Q915-S918 PolarHBondContact O-OG 3.46Å
916	T	55.2	Low	58.2	Low	84 Å²	84	85.2 Å²	85.2	52%	0.515	48%	0.481	S	S	.	.	H	α-helix	trans	-78	-33.5	175.8	49.4	0	0	0	0	112.5	S912 Q913 T920	S912-T916 PolarHBondContact O-N 3.25Å; S912-T916 PolarHBondContact O-OG1 2.95Å; Q913-T916 WeakPolarHBondContact CA-OG1 3.25Å; Q913-T916 PolarHBondContact O-OG1 3.45Å; T916-T920 PolarHBondContact O-OG1 3.37Å
917	S	47	Very low	55.3	Low	18 Å²	18	89.6 Å²	89.6	13%	0.126	52%	0.517	C	S	.	.	H	α-helix	trans	-71.3	-37	175.8	63.2	0	0	0	0	112.8	Q913 Q914 G919 T920 N921	Q913-S917 WeakPolarHBondContact O-CB 3.38Å; Q913-S917 PolarHBondContact O-N 3.04Å; Q913-S917 PolarHBondContact O-OG 3.09Å; Q913-S917 VanDerWaalsContact O-OG 3.1Å; Q914-S917 WeakPolarHBondContact CA-OG 3.46Å; Q914-S917 PolarHBondContact O-OG 3.19Å; S917-G919 PolarHBondContact O-N 2.97Å; S917-G919 VanDerWaalsContact O-N 3.13Å; S917-T920 PolarHBondContact O-N 3.07Å; S917-T920 PolarHBondContact O-OG1 3.22Å; S917-N921 WeakPolarHBondContact O-CB 3.13Å; S917-N921 PolarHBondContact O-N 3.3Å
918	S	43.9	Very low	52.4	Low	66 Å²	66	98.8 Å²	98.8	46%	0.462	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.8	-21.3	177.1	64.2	0	0	0	0	114.6	Q914 Q915	Q914-S918 PolarHBondContact O-N 2.73Å; Q914-S918 VanDerWaalsContact O-N 3.17Å; Q914-S918 PolarHBondContact O-OG 3.25Å; Q915-S918 PolarHBondContact O-OG 3.46Å
919	G	36.1	Very low	50.7	Low	69 Å²	69	98.7 Å²	98.7	71%	0.711	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-7.7	173.4	0	0	0	0	0	115.1	S917	S917-G919 PolarHBondContact O-N 2.97Å; S917-G919 VanDerWaalsContact O-N 3.13Å
920	T	32.9	Very low	48.7	Very low	106 Å²	106	101.2 Å²	101.2	65%	0.65	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.3	-13.6	-171.9	48.2	0	0	0	0	114.9	T916 S917	T916-T920 PolarHBondContact O-OG1 3.37Å; S917-T920 PolarHBondContact O-N 3.07Å; S917-T920 PolarHBondContact O-OG1 3.22Å
921	N	33.3	Very low	46.5	Very low	110 Å²	110	106.8 Å²	106.8	59%	0.588	62%	0.619	S	S	*	*			trans	-106.6	12.7	-175.8	-79.5	-19.1	0	0	0	115.7	S917 D923	S917-N921 WeakPolarHBondContact O-CB 3.13Å; S917-N921 PolarHBondContact O-N 3.3Å; N921-D923 PolarHBondContact O-N 2.93Å
922	E	33.2	Very low	44.3	Very low	185 Å²	185	110.3 Å²	110.3	86%	0.864	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-2.8	170.6	-77	-166.5	152.6	0	0	113.7
923	D	36.5	Very low	41.9	Very low	146 Å²	146	114.1 Å²	114.1	78%	0.781	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	6.1	-164.1	-83.6	-29.7	0	0	0	117.2	N921	N921-D923 PolarHBondContact O-N 2.93Å
924	L	37.8	Very low	39.4	Very low	152 Å²	152	117.1 Å²	117.1	80%	0.796	68%	0.676	S	S	*	*			trans	-143.8	98.6	176.7	-78.5	164.5	0	0	0	112
925	E	26.6	Very low	37.3	Very low	182 Å²	182	121.4 Å²	121.4	85%	0.85	71%	0.706	S	S	*	*			trans	-160	134.9	140.4	-111.1	168.4	-160.7	0	0	113.7
926	T	27.5	Very low	35.7	Very low	122 Å²	122	119.2 Å²	119.2	75%	0.748	71%	0.706	S	S	*	*			trans	-51.3	140.4	-175.5	23.4	0	0	0	0	115.7
927	A	26.8	Very low	34	Very low	94 Å²	94	122.2 Å²	122.2	78%	0.777	72%	0.722	S	S	*	*				50.5	81.8	82.6	0	0	0	0	0	112.9
928	V	27	Very low	32.9	Very low	216 Å²	216	131.6 Å²	131.6	100%	1.309	78%	0.776	S	S	*	*			trans	-134	0	145.5	-176.2	0	0	0	0	106.5

Retrieved 928 of 928 residues in 494.5 ms (Link to these results)

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