A0A3Q0KQ49_SCHMA Loading...

Putative sodium/calcium exchanger

AlphaFold DB , UniProt , Accession A0A3Q0KQ49, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 916 aa.

						>A0A3Q0KQ49_SCHMA|A0A3Q0KQ49
MIKYIFFFTVCSIISKPLAAEKLVNGTCPSSQRTFCYDGIIVPMWRPSTGITTGDKAARAIVYFSALMYLFLGVSIIADRFMAAIEVITSQEKEVTLRKKNGETQTISVRIWNETVSNLTLMALGSSAPEILLSVIEIIGKNFEAGDLGPGTIVGSAAFNLFVIIGVCIVVVPDGQVRRIKHLSVFFITSSWSLFAYLWMYLIIAVFTPGVVEVWEALLTFIFFPIIVICAYLADTKIFFKKFLKKKYRATALMKAANGDLELTNHTEEVTYAPTDGESLAEESEFDRHRMDYVEAIKEIRKRNPNIGMKELEELAQMEVLNKGPKSRAYYRMQATRQLTGSGNVIKKAKVERRMSFDDNRLTTETYPPHVQRFFFNPGHYTVMENVGTFPVTVTRVGGDMHAVVSVEYFTLDGTAVAGEDYEPVKGLLLFSAGETHKQIMISIIDDDIFEEDEHFTVHLRNLEVKHSSTKIEPVLVDPMVATIMVLDDDHSGVFQFDVVDLTVSESCEYAEIKVQRVSGCRGVVRLPYQTVEGTAKGGGKDFEDMVGYIEFQNDQTEGTIRIRVMDDNNYEKSEYFYVQLGEPVLIDKDAINEWETIPSHLFARIAQRSDSLISGNSSMKRRNSRTPSTKDGNLNPRKSLGFVETGQPRLGQQTRIKITITESTEFKNTVDRLVKQGTLALVVGTSSWKEQFIEAITVSAGGDVDDDEGEKLPTCMDYVMHFLTVFWKVLFAFVPPTDYGGGWFCFTVCILVIGVLTAVIGDVASSFGCSIGLTDAVTAITFVALGTSLPDTFASKVAAVGDQYADSSIGNVTGSNAVNVFLGIGLGWSIAAIYHAIKGTQFLVQPGSLGFSVTTYCIFALVAIFLILYRRKKSIGGELGGPKVAKYISASFLFFLWFVYILLAGLENYCIIEGF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	46.6	Very low	187 Å²	187	127.7 Å²	127.7	92%	0.921	61%	0.608	S	S	*	*				0	-59.3	0	-140.6	175.4	-92.8	0	0	111.5	K3 Y4 I5	M1-K3 VanDerWaalsContact C-N 3.33Å; M1-K3 PolarHBondContact O-N 3.29Å; M1-Y4 PolarHBondContact O-N 2.64Å; M1-I5 HydrophobicContact CG-CD1 4.47Å; M1-I5 WeakPolarHBondContact O-CG1 3.39Å; M1-I5 PolarHBondContact O-N 2.81Å; M1-I5 VanDerWaalsContact O-N 3.12Å
2	I	50	Low	46.2	Very low	148 Å²	148	124.2 Å²	124.2	76%	0.759	61%	0.606	S	S	*	*	H	α-helix	trans	-55.9	-38.6	176.7	-66	167.2	0	0	0	113.8	Y4 I5 F6	I2-Y4 VanDerWaalsContact C-N 3.32Å; I2-Y4 PolarHBondContact O-N 3.36Å; I2-I5 PolarHBondContact O-N 2.85Å; I2-F6 PolarHBondContact O-N 3.19Å
3	K	45.6	Very low	46	Very low	187 Å²	187	120.2 Å²	120.2	81%	0.813	59%	0.588	S	S	*	*	H	α-helix	trans	-63.3	-31.4	175.5	-73.4	-173.2	175.5	-175.9	0	114.6	M1	M1-K3 VanDerWaalsContact C-N 3.33Å; M1-K3 PolarHBondContact O-N 3.29Å
4	Y	48.7	Very low	45.7	Very low	180 Å²	180	116.9 Å²	116.9	71%	0.706	57%	0.574	S	S	*	*	H	α-helix	trans	-84.4	-35.2	-179.9	-74.2	-79.9	0	0	0	111.6	M1 I2 F7 F8	M1-Y4 PolarHBondContact O-N 2.64Å; I2-Y4 VanDerWaalsContact C-N 3.32Å; I2-Y4 PolarHBondContact O-N 3.36Å; Y4-F7 PolarHBondContact O-N 3.45Å; Y4-F8 PolarHBondContact O-N 3.15Å
5	I	53	Low	45	Very low	99 Å²	99	115.3 Å²	115.3	51%	0.508	58%	0.578	S	S	.	*	H	α-helix	trans	-63.1	-46.5	174.2	-64.3	167.3	0	0	0	109.3	M1 I2 F7 F8 T9	M1-I5 HydrophobicContact CG-CD1 4.47Å; M1-I5 WeakPolarHBondContact O-CG1 3.39Å; M1-I5 PolarHBondContact O-N 2.81Å; M1-I5 VanDerWaalsContact O-N 3.12Å; I2-I5 PolarHBondContact O-N 2.85Å; I5-F7 PolarHBondContact O-N 3.48Å; I5-F8 PolarHBondContact O-N 3.17Å; I5-T9 WeakPolarHBondContact O-CB 3.44Å; I5-T9 PolarHBondContact O-N 2.87Å; I5-T9 PolarHBondContact O-OG1 3.2Å
6	F	51.8	Low	44.2	Very low	143 Å²	143	119.8 Å²	119.8	63%	0.627	59%	0.593	S	S	*	*	H	α-helix	trans	-59.2	-43.9	179.1	-162	-98	0	0	0	112.6	I2 V10	I2-F6 PolarHBondContact O-N 3.19Å; F6-V10 HydrophobicContact CD1-CG2 4.24Å; F6-V10 HydrophobicContact CE1-CG2 4.08Å; F6-V10 HydrophobicContact CZ-CG2 4.44Å; F6-V10 WeakPolarHBondContact O-CB 3.44Å; F6-V10 WeakPolarHBondContact O-CG2 3.36Å; F6-V10 PolarHBondContact O-N 2.56Å
7	F	48.3	Very low	43.7	Very low	144 Å²	144	119.6 Å²	119.6	63%	0.632	60%	0.603	S	S	*	*	H	α-helix	trans	-66.6	-43.7	179.3	-160.9	-94.7	0	0	0	112.6	Y4 I5 C11	Y4-F7 PolarHBondContact O-N 3.45Å; I5-F7 PolarHBondContact O-N 3.48Å; F7-C11 PolarHBondContact O-N 3.33Å; F7-C11 PolarHBondContact O-SG 3.44Å
8	F	43.5	Very low	43.2	Very low	150 Å²	150	120.6 Å²	120.6	66%	0.658	61%	0.609	S	S	*	*	H	α-helix	trans	-70.5	-37.3	178	-106.4	-86.2	0	0	0	113	Y4 I5 C11 S12	Y4-F8 PolarHBondContact O-N 3.15Å; I5-F8 PolarHBondContact O-N 3.17Å; F8-C11 PolarHBondContact O-N 3.47Å; F8-S12 WeakPolarHBondContact O-CB 3.21Å; F8-S12 PolarHBondContact O-N 3.22Å; F8-S12 PolarHBondContact O-OG 3.45Å
9	T	48.6	Very low	42.7	Very low	69 Å²	69	119.1 Å²	119.1	42%	0.423	62%	0.617	S	S	.	*	H	α-helix	trans	-67.7	-39.7	178.9	-37.3	0	0	0	0	110.3	I5 S12 I13	I5-T9 WeakPolarHBondContact O-CB 3.44Å; I5-T9 PolarHBondContact O-N 2.87Å; I5-T9 PolarHBondContact O-OG1 3.2Å; T9-S12 PolarHBondContact O-N 3.06Å; T9-I13 HydrophobicContact CG2-CD1 4.13Å; T9-I13 WeakPolarHBondContact O-CD1 3.37Å; T9-I13 WeakPolarHBondContact O-CG1 3.18Å; T9-I13 PolarHBondContact O-N 3.35Å; T9-I13 VanDerWaalsContact O-N 3.15Å
10	V	47.5	Very low	42.6	Very low	37 Å²	37	115.8 Å²	115.8	22%	0.224	61%	0.608	C	S	.	*	H	α-helix	trans	-63.8	-45.2	173.8	172.4	0	0	0	0	110.9	F6 S12 I14 L198	F6-V10 HydrophobicContact CD1-CG2 4.24Å; F6-V10 HydrophobicContact CE1-CG2 4.08Å; F6-V10 HydrophobicContact CZ-CG2 4.44Å; F6-V10 WeakPolarHBondContact O-CB 3.44Å; F6-V10 WeakPolarHBondContact O-CG2 3.36Å; F6-V10 PolarHBondContact O-N 2.56Å; V10-S12 PolarHBondContact O-N 2.84Å; V10-I14 HydrophobicContact CG1-CD1 4.2Å; V10-I14 VanDerWaalsContact O-CD1 3.24Å; V10-I14 WeakPolarHBondContact O-CD1 3.4Å; V10-I14 VanDerWaalsContact O-CG1 3.24Å; V10-I14 WeakPolarHBondContact O-CG1 3.49Å; V10-L198 HydrophobicContact CG1-CD1 3.97Å
11	C	41	Very low	42.5	Very low	61 Å²	61	118.7 Å²	118.7	41%	0.412	62%	0.619	S	S	.	*	H	α-helix	trans	-66	-35	177.7	-75.1	0	0	0	0	113.9	F7 F8	F7-C11 PolarHBondContact O-N 3.33Å; F7-C11 PolarHBondContact O-SG 3.44Å; F8-C11 PolarHBondContact O-N 3.47Å
12	S	41.8	Very low	42.9	Very low	85 Å²	85	116.2 Å²	116.2	59%	0.594	60%	0.603	S	S	*	*	H	α-helix	trans	-77.7	-24.3	-179.6	-70.7	0	0	0	0	114.1	F8 T9 V10 I14	F8-S12 WeakPolarHBondContact O-CB 3.21Å; F8-S12 PolarHBondContact O-N 3.22Å; F8-S12 PolarHBondContact O-OG 3.45Å; T9-S12 PolarHBondContact O-N 3.06Å; V10-S12 PolarHBondContact O-N 2.84Å; S12-I14 VanDerWaalsContact C-N 3.28Å
13	I	43.2	Very low	42.8	Very low	72 Å²	72	112.1 Å²	112.1	37%	0.369	58%	0.582	S	S	.	*	H	α-helix	trans	-72.2	-25	175	-68.1	165	0	0	0	111.2	T9 S15 V206	T9-I13 HydrophobicContact CG2-CD1 4.13Å; T9-I13 WeakPolarHBondContact O-CD1 3.37Å; T9-I13 WeakPolarHBondContact O-CG1 3.18Å; T9-I13 PolarHBondContact O-N 3.35Å; T9-I13 VanDerWaalsContact O-N 3.15Å; I13-S15 VanDerWaalsContact C-N 3.26Å; I13-S15 PolarHBondContact O-N 3.12Å; I13-V206 HydrophobicContact CG2-CG1 3.87Å; I13-V206 HydrophobicContact CG2-CG2 3.83Å
14	I	41.7	Very low	43.1	Very low	75 Å²	75	110.3 Å²	110.3	39%	0.385	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.2	-8.3	-175.2	-65.4	164.4	0	0	0	113.5	V10 S12	V10-I14 HydrophobicContact CG1-CD1 4.2Å; V10-I14 VanDerWaalsContact O-CD1 3.24Å; V10-I14 WeakPolarHBondContact O-CD1 3.4Å; V10-I14 VanDerWaalsContact O-CG1 3.24Å; V10-I14 WeakPolarHBondContact O-CG1 3.49Å; S12-I14 VanDerWaalsContact C-N 3.28Å
15	S	35	Very low	43	Very low	92 Å²	92	108.6 Å²	108.6	64%	0.643	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	28.7	-167.2	-56.8	0	0	0	0	117.2	I13 P17	I13-S15 VanDerWaalsContact C-N 3.26Å; I13-S15 PolarHBondContact O-N 3.12Å; S15-P17 WeakPolarHBondContact O-CD 3.24Å
16	K	32.8	Very low	43.1	Very low	188 Å²	188	106.6 Å²	106.6	82%	0.817	59%	0.593	S	S	*	*			trans	-103.6	104.6	164.1	-78.8	-168.9	177.4	-177.6	0	110.7	L18	K16-L18 PolarHBondContact O-N 3.38Å
17	P	35.4	Very low	43.2	Very low	117 Å²	117	102.8 Å²	102.8	76%	0.76	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-75.1	119.9	170.1	29.8	-29.4	0	0	0	108.7	S15	S15-P17 WeakPolarHBondContact O-CD 3.24Å
18	L	34.5	Very low	43.8	Very low	137 Å²	137	96.7 Å²	96.7	72%	0.717	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-84	142.7	157.7	-144	78.6	0	0	0	106.4	K16	K16-L18 PolarHBondContact O-N 3.38Å
19	A	35	Very low	44.6	Very low	92 Å²	92	92.3 Å²	92.3	76%	0.76	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-82.5	125.2	-172.6	0	0	0	0	0	111	E21	A19-E21 PolarHBondContact O-N 3.06Å
20	A	39.1	Very low	45.1	Very low	53 Å²	53	89.9 Å²	89.9	44%	0.438	53%	0.529	S	S	.	.			trans	-71	105.2	165.7	0	0	0	0	0	109.7	K22	A20-K22 PolarHBondContact O-N 2.9Å
21	E	40.3	Very low	45.3	Very low	176 Å²	176	90.9 Å²	90.9	82%	0.822	54%	0.538	S	S	*	.			trans	-64.7	115.2	170.5	-86	-174	152.1	0	0	109.8	A19 L23	A19-E21 PolarHBondContact O-N 3.06Å; E21-L23 PolarHBondContact O-N 3.35Å
22	K	43.4	Very low	45.7	Very low	135 Å²	135	93.1 Å²	93.1	59%	0.587	54%	0.542	S	S	*	.			trans	-60.2	135.3	159.9	-73.7	177.7	-179.5	169.7	0	107.9	A20	A20-K22 PolarHBondContact O-N 2.9Å
23	L	49.4	Very low	46.4	Very low	63 Å²	63	93.5 Å²	93.5	33%	0.33	53%	0.531	S	S	.	.			trans	-55.3	150.9	169.2	-72.1	163.5	0	0	0	109.4	E21 N25 G26 T27 Q32	E21-L23 PolarHBondContact O-N 3.35Å; L23-N25 PolarHBondContact O-N 3.04Å; L23-G26 PolarHBondContact O-N 3.05Å; L23-T27 WeakPolarHBondContact CB-O 3.24Å; L23-Q32 HydrophobicContact CD1-CG 4.29Å
24	V	51.9	Low	47	Very low	149 Å²	149	92.2 Å²	92.2	90%	0.903	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-23.6	-178.6	-178.8	0	0	0	0	113.4
25	N	46.8	Very low	48	Very low	143 Å²	143	95.3 Å²	95.3	77%	0.765	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	9.9	178.8	-65.6	-7.1	0	0	0	114.9	L23 T27	L23-N25 PolarHBondContact O-N 3.04Å; N25-T27 PolarHBondContact O-N 3.27Å; N25-T27 VanDerWaalsContact O-N 3.17Å
26	G	53.3	Low	49.6	Very low	57 Å²	57	93.1 Å²	93.1	59%	0.588	52%	0.521	S	S	*	.	S	Bend	trans	72.6	0.5	180	0	0	0	0	0	115.3	L23	L23-G26 PolarHBondContact O-N 3.05Å
27	T	55.1	Low	51.5	Low	63 Å²	63	90.1 Å²	90.1	39%	0.387	51%	0.506	S	S	.	.			trans	-80	134.6	174.9	49.4	0	0	0	0	111	L23 N25	L23-T27 WeakPolarHBondContact CB-O 3.24Å; N25-T27 PolarHBondContact O-N 3.27Å; N25-T27 VanDerWaalsContact O-N 3.17Å
28	C	60.9	Low	53.4	Low	16 Å²	16	88.8 Å²	88.8	11%	0.108	49%	0.492	C	S	.	.			trans	-60	134.1	173.9	-174.4	0	0	0	0	110.6	S30 S31 Y910 C911	C28-S30 PolarHBondContact O-N 3.22Å; C28-S30 PolarHBondContact SG-OG 2.95Å; C28-S31 WeakPolarHBondContact O-CB 3.42Å; C28-S31 PolarHBondContact O-N 3.37Å; C28-Y910 VanDerWaalsContact SG-C 3.54Å; C28-C911 VanDerWaalsContact CA-SG 3.57Å; C28-C911 HydrophobicContact CB-CB 3.57Å; C28-C911 WeakPolarHBondContact CB-SG 3.32Å; C28-C911 WeakPolarHBondContact SG-CB 3.49Å; C28-C911 PolarHBondContact SG-N 3.05Å; C28-C911 VanDerWaalsContact SG-N 3.38Å; C28-C911 CovalentContact SG-SG 2.01Å; C28-C911 PolarHBondContact SG-SG 3.06Å
29	P	60	Low	55.5	Low	58 Å²	58	83.3 Å²	83.3	38%	0.377	47%	0.469	S	S	.	.	H	α-helix	trans	-58.6	-32.3	178.8	18.3	-29.5	0	0	0	113.3	S31 Q32	P29-S31 VanDerWaalsContact C-N 3.26Å; P29-S31 PolarHBondContact O-N 3.43Å; P29-Q32 WeakPolarHBondContact O-CB 3.24Å; P29-Q32 PolarHBondContact O-N 3.46Å; P29-Q32 VanDerWaalsContact O-N 3.12Å
30	S	58.3	Low	57.7	Low	18 Å²	18	83 Å²	83	13%	0.126	45%	0.454	C	S	.	.	H	α-helix	trans	-68.4	-21.3	174.4	64	0	0	0	0	113.5	C28 Q32 R33 N909	C28-S30 PolarHBondContact O-N 3.22Å; C28-S30 PolarHBondContact SG-OG 2.95Å; S30-Q32 PolarHBondContact O-N 2.92Å; S30-R33 WeakPolarHBondContact O-CA 3.47Å; S30-R33 WeakPolarHBondContact O-CB 3.38Å; S30-R33 PolarHBondContact O-N 2.92Å; S30-N909 VanDerWaalsContact CB-O 3.28Å; S30-N909 WeakPolarHBondContact CB-O 3.49Å; S30-N909 PolarHBondContact OG-O 2.75Å
31	S	52.1	Low	59.8	Low	59 Å²	59	84.6 Å²	84.6	41%	0.413	45%	0.454	S	S	.	.	H	α-helix	trans	-61.2	-31.1	170.9	176.9	0	0	0	0	111.1	C28 P29 R33 T34	C28-S31 WeakPolarHBondContact O-CB 3.42Å; C28-S31 PolarHBondContact O-N 3.37Å; P29-S31 VanDerWaalsContact C-N 3.26Å; P29-S31 PolarHBondContact O-N 3.43Å; S31-R33 VanDerWaalsContact C-N 3.26Å; S31-R33 PolarHBondContact O-N 2.69Å; S31-T34 PolarHBondContact O-N 2.9Å; S31-T34 PolarHBondContact O-OG1 3.03Å
32	Q	50.4	Low	62	Low	107 Å²	107	78 Å²	78	50%	0.5	43%	0.426	S	S	.	.	H	α-helix	trans	-70.4	-22.7	172.4	-63.5	-173.6	-15.6	0	0	111.7	L23 P29 S30 T34 F35	L23-Q32 HydrophobicContact CD1-CG 4.29Å; P29-Q32 WeakPolarHBondContact O-CB 3.24Å; P29-Q32 PolarHBondContact O-N 3.46Å; P29-Q32 VanDerWaalsContact O-N 3.12Å; S30-Q32 PolarHBondContact O-N 2.92Å; Q32-T34 PolarHBondContact O-N 2.99Å; Q32-F35 HydrophobicContact CB-CE2 4.28Å; Q32-F35 WeakPolarHBondContact O-CD2 3.37Å; Q32-F35 WeakPolarHBondContact O-CE2 3.4Å; Q32-F35 PolarHBondContact O-N 3.08Å
33	R	55.3	Low	63.9	Low	94 Å²	94	76.3 Å²	76.3	36%	0.355	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	1.7	174.4	-59.8	-173.8	-175.7	-178.2	2.7	114.1	S30 S31 F35 D147	S30-R33 WeakPolarHBondContact O-CA 3.47Å; S30-R33 WeakPolarHBondContact O-CB 3.38Å; S30-R33 PolarHBondContact O-N 2.92Å; S31-R33 VanDerWaalsContact C-N 3.26Å; S31-R33 PolarHBondContact O-N 2.69Å; R33-F35 PolarHBondContact O-N 3.46Å; R33-D147 IonicContact CZ-OD2 3.67Å; R33-D147 IonicContact NE-OD2 3.97Å; R33-D147 VanDerWaalsContact NH1-CG 3.32Å; R33-D147 IonicContact NH1-OD1 3.15Å; R33-D147 PolarHBondContact NH1-OD1 3.13Å; R33-D147 VanDerWaalsContact NH1-OD1 3.15Å; R33-D147 IonicContact NH1-OD2 2.71Å; R33-D147 PolarHBondContact NH1-OD2 3.14Å
34	T	56.8	Low	65.3	Low	45 Å²	45	74.5 Å²	74.5	28%	0.276	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	1.9	170.9	61	0	0	0	0	113.4	S31 Q32 C36 C770 T775	S31-T34 PolarHBondContact O-N 2.9Å; S31-T34 PolarHBondContact O-OG1 3.03Å; Q32-T34 PolarHBondContact O-N 2.99Å; T34-C36 PolarHBondContact O-N 3.18Å; T34-C770 PolarHBondContact O-SG 2.97Å; T34-T775 HydrophobicContact CG2-CG2 4.18Å
35	F	62	Low	66.8	Low	140 Å²	140	73 Å²	73	61%	0.614	40%	0.397	S	S	*	.	S	Bend	trans	-64.1	122.6	171.9	-71.5	-60.2	0	0	0	109.9	Q32 R33 Y37	Q32-F35 HydrophobicContact CB-CE2 4.28Å; Q32-F35 WeakPolarHBondContact O-CD2 3.37Å; Q32-F35 WeakPolarHBondContact O-CE2 3.4Å; Q32-F35 PolarHBondContact O-N 3.08Å; R33-F35 PolarHBondContact O-N 3.46Å; F35-Y37 WeakPolarHBondContact O-CD2 3.06Å; F35-Y37 VanDerWaalsContact O-CE2 3.24Å; F35-Y37 WeakPolarHBondContact O-CE2 3.43Å; F35-Y37 PolarHBondContact O-N 3.34Å
36	C	68.2	Low	68.4	Low	45 Å²	45	74.4 Å²	74.4	30%	0.304	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-64.1	131.8	176.1	-44.9	0	0	0	0	109.4	T34 M44 C770	T34-C36 PolarHBondContact O-N 3.18Å; C36-M44 HydrophobicContact CB-CE 3.17Å; C36-M44 HydrophobicContact CB-CG 4.49Å; C36-M44 HydrophobicContact CB-SD 3.4Å; C36-M44 WeakPolarHBondContact CB-SD 3.47Å; C36-M44 VanDerWaalsContact O-CE 3.27Å; C36-M44 WeakPolarHBondContact O-CE 3.48Å; C36-C770 WeakPolarHBondContact CA-SG 3.34Å; C36-C770 HydrophobicContact CB-CB 3.86Å; C36-C770 WeakPolarHBondContact CB-SG 3.43Å; C36-C770 PolarHBondContact N-SG 3.08Å; C36-C770 VanDerWaalsContact N-SG 3.35Å; C36-C770 WeakPolarHBondContact SG-CB 3.45Å; C36-C770 CovalentContact SG-SG 2.01Å; C36-C770 PolarHBondContact SG-SG 2.88Å
37	Y	72.6	Confident	69.5	Low	126 Å²	126	75.5 Å²	75.5	49%	0.494	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-100.3	148.5	170.2	-56.3	-79.2	0	0	0	110.1	F35 G39 M44	F35-Y37 WeakPolarHBondContact O-CD2 3.06Å; F35-Y37 VanDerWaalsContact O-CE2 3.24Å; F35-Y37 WeakPolarHBondContact O-CE2 3.43Å; F35-Y37 PolarHBondContact O-N 3.34Å; Y37-G39 PolarHBondContact O-N 3.43Å; Y37-M44 WeakPolarHBondContact O-CE 3.18Å
38	D	76.3	Confident	70.1	Confident	89 Å²	89	75.5 Å²	75.5	48%	0.476	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-65.2	134.1	167.3	-85	-37.7	0	0	0	108.3	M44 R46	D38-M44 WeakPolarHBondContact OD1-CB 3.17Å; D38-M44 PolarHBondContact OD1-N 3.43Å; D38-R46 IonicContact OD2-NH2 2.7Å; D38-R46 PolarHBondContact OD2-NH2 3.01Å; D38-R46 VanDerWaalsContact OD2-NH2 3.08Å
39	G	79.1	Confident	70.5	Confident	22 Å²	22	80.3 Å²	80.3	23%	0.227	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-66.5	162.9	179.1	0	0	0	0	0	112.4	Y37 I41 V42 D763	Y37-G39 PolarHBondContact O-N 3.43Å; G39-I41 VanDerWaalsContact C-N 3.33Å; G39-V42 VanDerWaalsContact CA-O 3.32Å; G39-V42 WeakPolarHBondContact CA-O 3.3Å; G39-V42 PolarHBondContact N-O 3.03Å; G39-D763 VanDerWaalsContact CA-OD1 3.22Å; G39-D763 WeakPolarHBondContact CA-OD1 3.22Å
40	I	80.1	Confident	71.2	Confident	85 Å²	85	81.8 Å²	81.8	44%	0.436	45%	0.446	S	S	.	.	S	Bend	trans	-65.1	-40.4	178.4	-59.1	166.9	0	0	0	110.5	I136 D763	I40-I136 HydrophobicContact CD1-CG2 4.03Å; I40-D763 PolarHBondContact N-OD1 2.01Å; I40-D763 PolarHBondContact N-OD2 2.9Å; I40-D763 VanDerWaalsContact N-OD2 3.1Å
41	I	83.6	Confident	72.1	Confident	86 Å²	86	82.5 Å²	82.5	44%	0.441	45%	0.447	S	S	.	.	S	Bend	trans	-116.3	-48.1	-178	-59.5	-179.3	0	0	0	110.5	G39 A759 V760 D763	G39-I41 VanDerWaalsContact C-N 3.33Å; I41-A759 HydrophobicContact CD1-CB 3.5Å; I41-A759 VanDerWaalsContact CD1-CB 3.5Å; I41-A759 HydrophobicContact CG1-CB 4.34Å; I41-V760 HydrophobicContact CB-CG2 4.43Å; I41-V760 HydrophobicContact CD1-CG2 4.12Å; I41-V760 HydrophobicContact CG2-CG2 4.13Å; I41-D763 WeakPolarHBondContact CA-OD2 3.4Å; I41-D763 PolarHBondContact N-OD2 3.42Å
42	V	85.8	Confident	73.6	Confident	39 Å²	39	83.6 Å²	83.6	24%	0.236	45%	0.452	C	S	.	.	S	Bend	trans	-93.6	118.1	-174.3	-177.2	0	0	0	0	110	G39 V760 D763	G39-V42 VanDerWaalsContact CA-O 3.32Å; G39-V42 WeakPolarHBondContact CA-O 3.3Å; G39-V42 PolarHBondContact N-O 3.03Å; V42-V760 HydrophobicContact CG2-CG1 3.94Å; V42-V760 HydrophobicContact CG2-CG2 4.42Å; V42-D763 HydrophobicContact CB-CB 4Å; V42-D763 HydrophobicContact CG2-CB 4.42Å; V42-D763 PolarHBondContact N-OD2 2.73Å
43	P	83.5	Confident	75.1	Confident	98 Å²	98	84.5 Å²	84.5	64%	0.636	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-68.6	147.8	176.7	29.2	-34.4	0	0	0	110.9
44	M	79.4	Confident	76.5	Confident	26 Å²	26	82.2 Å²	82.2	13%	0.128	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-69.1	142.3	179.9	-172.3	-163.4	-52.9	0	0	112	C36 Y37 D38 R46	C36-M44 HydrophobicContact CB-CE 3.17Å; C36-M44 HydrophobicContact CB-CG 4.49Å; C36-M44 HydrophobicContact CB-SD 3.4Å; C36-M44 WeakPolarHBondContact CB-SD 3.47Å; C36-M44 VanDerWaalsContact O-CE 3.27Å; C36-M44 WeakPolarHBondContact O-CE 3.48Å; Y37-M44 WeakPolarHBondContact O-CE 3.18Å; D38-M44 WeakPolarHBondContact OD1-CB 3.17Å; D38-M44 PolarHBondContact OD1-N 3.43Å; M44-R46 PolarHBondContact O-N 2.94Å; M44-R46 VanDerWaalsContact O-N 3.11Å
45	W	83.3	Confident	77.9	Confident	117 Å²	117	84 Å²	84	44%	0.443	48%	0.478	S	S	.	.			trans	-72.1	105	174	-171.6	-3.5	0	0	0	111.3	R59 V62 Y63	W45-R59 HydrophobicContact CD2-CG 4.05Å; W45-R59 HydrophobicContact CE3-CB 4.28Å; W45-R59 HydrophobicContact CE3-CG 3.63Å; W45-R59 HydrophobicContact CH2-CG 3.91Å; W45-R59 HydrophobicContact CZ2-CG 4.3Å; W45-R59 HydrophobicContact CZ3-CB 4.2Å; W45-R59 HydrophobicContact CZ3-CG 3.57Å; W45-R59 PolarHBondContact O-NH1 3.46Å; W45-V62 HydrophobicContact CZ3-CB 4.36Å; W45-V62 HydrophobicContact CZ3-CG1 4.31Å; W45-V62 HydrophobicContact CZ3-CG2 4.5Å; W45-Y63 WeakPolarHBondContact CB-OH 3.13Å; W45-Y63 HydrophobicContact CE3-CE2 4.41Å; W45-Y63 PolarHBondContact N-OH 3.5Å
46	R	80	Confident	79	Confident	173 Å²	173	82.2 Å²	82.2	65%	0.653	47%	0.47	S	S	*	.	S	Bend	trans	-86.2	152.6	176.8	-62.5	-172.6	-178.5	-171.2	1.1	112.6	D38 M44	D38-R46 IonicContact OD2-NH2 2.7Å; D38-R46 PolarHBondContact OD2-NH2 3.01Å; D38-R46 VanDerWaalsContact OD2-NH2 3.08Å; M44-R46 PolarHBondContact O-N 2.94Å; M44-R46 VanDerWaalsContact O-N 3.11Å
47	P	77.7	Confident	79.9	Confident	80 Å²	80	82.5 Å²	82.5	52%	0.519	48%	0.476	S	S	.	.			cis	-75.4	154.4	-3.8	30.6	-35.5	0	0	0	111.9	I51 R59	P47-I51 HydrophobicContact CG-CG1 4.42Å; P47-I51 WeakPolarHBondContact O-CD1 3.27Å; P47-R59 PolarHBondContact O-NH1 3.44Å; P47-R59 PolarHBondContact O-NH2 3.32Å; P47-R59 VanDerWaalsContact O-NH2 3.12Å
48	S	66.2	Low	80.7	Confident	62 Å²	62	78.8 Å²	78.8	43%	0.434	47%	0.471	S	S	.	.			trans	-96.2	-27.9	178	54.9	0	0	0	0	113.6	I51	S48-I51 WeakPolarHBondContact O-CD1 3.37Å
49	T	70.3	Confident	81.3	Confident	117 Å²	117	75.8 Å²	75.8	72%	0.718	45%	0.453	S	S	*	.	S	Bend	trans	-113.3	144	-177.3	55.2	0	0	0	0	111.6
50	G	74.1	Confident	81.8	Confident	90 Å²	90	75.3 Å²	75.3	93%	0.928	45%	0.447	S	S	*	.	S	Bend	trans	85	20	176.1	0	0	0	0	0	115.7
51	I	76.4	Confident	82.4	Confident	32 Å²	32	76.6 Å²	76.6	16%	0.164	45%	0.454	C	S	.	.			trans	-91.1	148.5	-175	-51.2	162.4	0	0	0	111.3	P47 S48 D55 K56	P47-I51 HydrophobicContact CG-CG1 4.42Å; P47-I51 WeakPolarHBondContact O-CD1 3.27Å; S48-I51 WeakPolarHBondContact O-CD1 3.37Å; I51-D55 HydrophobicContact CG2-CB 3.16Å; I51-K56 HydrophobicContact CB-CG 4.43Å; I51-K56 HydrophobicContact CG2-CG 4.3Å
52	T	84.4	Confident	82.9	Confident	82 Å²	82	76.2 Å²	76.2	50%	0.503	46%	0.455	S	S	.	.			trans	-65.7	157.8	174.7	72.8	0	0	0	0	112.2	G54 D55 K56	T52-G54 VanDerWaalsContact C-N 3.27Å; T52-G54 PolarHBondContact O-N 3.32Å; T52-D55 PolarHBondContact O-N 3.5Å; T52-D55 WeakPolarHBondContact OG1-CB 3.31Å; T52-D55 PolarHBondContact OG1-N 3.08Å; T52-D55 VanDerWaalsContact OG1-N 3.16Å; T52-D55 PolarHBondContact OG1-OD2 2.81Å; T52-K56 PolarHBondContact O-N 3.12Å; T52-K56 VanDerWaalsContact O-N 3.11Å
53	T	82.5	Confident	83.3	Confident	127 Å²	127	75.3 Å²	75.3	78%	0.779	45%	0.448	S	S	*	.	H	α-helix	trans	-61.5	-36.1	175.3	49	0	0	0	0	112.3	K56 A57	T53-K56 PolarHBondContact O-N 3.04Å; T53-A57 PolarHBondContact O-N 3.39Å
54	G	85.1	Confident	83.8	Confident	46 Å²	46	74.6 Å²	74.6	47%	0.474	44%	0.435	S	S	.	.	H	α-helix	trans	-64.3	-44.7	176.8	0	0	0	0	0	112.7	T52 A57 A58	T52-G54 VanDerWaalsContact C-N 3.27Å; T52-G54 PolarHBondContact O-N 3.32Å; G54-A57 PolarHBondContact O-N 2.89Å; G54-A58 WeakPolarHBondContact O-CB 3.17Å; G54-A58 PolarHBondContact O-N 2.82Å
55	D	86.2	Confident	84.5	Confident	82 Å²	82	76.5 Å²	76.5	44%	0.439	45%	0.45	S	S	.	.	H	α-helix	trans	-64.9	-39.9	176.5	-68.8	-36.6	0	0	0	111.8	I51 T52 A57 A58 R59	I51-D55 HydrophobicContact CG2-CB 3.16Å; T52-D55 PolarHBondContact O-N 3.5Å; T52-D55 WeakPolarHBondContact OG1-CB 3.31Å; T52-D55 PolarHBondContact OG1-N 3.08Å; T52-D55 VanDerWaalsContact OG1-N 3.16Å; T52-D55 PolarHBondContact OG1-OD2 2.81Å; D55-A57 VanDerWaalsContact C-N 3.34Å; D55-A57 PolarHBondContact O-N 2.9Å; D55-A58 PolarHBondContact O-N 3.17Å; D55-R59 WeakPolarHBondContact O-CB 3.41Å; D55-R59 VanDerWaalsContact O-CG 3.23Å; D55-R59 WeakPolarHBondContact O-CG 3.1Å; D55-R59 PolarHBondContact O-N 3.09Å
56	K	84.9	Confident	85	Confident	103 Å²	103	72.7 Å²	72.7	45%	0.448	44%	0.444	S	S	.	.	H	α-helix	trans	-59	-46	173.6	-72.1	-175.6	-179.7	-171.3	0	111.5	I51 T52 T53 R59 A60	I51-K56 HydrophobicContact CB-CG 4.43Å; I51-K56 HydrophobicContact CG2-CG 4.3Å; T52-K56 PolarHBondContact O-N 3.12Å; T52-K56 VanDerWaalsContact O-N 3.11Å; T53-K56 PolarHBondContact O-N 3.04Å; K56-R59 PolarHBondContact O-N 3.25Å; K56-A60 WeakPolarHBondContact O-CB 2.83Å; K56-A60 PolarHBondContact O-N 3.47Å
57	A	86.7	Confident	85.7	Confident	50 Å²	50	64.5 Å²	64.5	41%	0.413	41%	0.413	S	S	.	.	H	α-helix	trans	-63.6	-44.5	177.7	0	0	0	0	0	111.8	T53 G54 D55 R59 A60 I61	T53-A57 PolarHBondContact O-N 3.39Å; G54-A57 PolarHBondContact O-N 2.89Å; D55-A57 VanDerWaalsContact C-N 3.34Å; D55-A57 PolarHBondContact O-N 2.9Å; A57-R59 PolarHBondContact O-N 2.98Å; A57-A60 PolarHBondContact O-N 2.84Å; A57-I61 VanDerWaalsContact O-CG1 3.29Å; A57-I61 WeakPolarHBondContact O-CG1 3.41Å; A57-I61 PolarHBondContact O-N 3.44Å
58	A	89.4	Confident	86.4	Confident	48 Å²	48	64.9 Å²	64.9	40%	0.397	41%	0.409	S	S	.	.	H	α-helix	trans	-59.7	-45.1	176.8	0	0	0	0	0	111.7	G54 D55 I61 V62	G54-A58 WeakPolarHBondContact O-CB 3.17Å; G54-A58 PolarHBondContact O-N 2.82Å; D55-A58 PolarHBondContact O-N 3.17Å; A58-I61 PolarHBondContact O-N 3.27Å; A58-V62 WeakPolarHBondContact O-CG2 3.44Å; A58-V62 PolarHBondContact O-N 3.49Å
59	R	89.3	Confident	87.8	Confident	27 Å²	27	66 Å²	66	10%	0.102	41%	0.405	C	S	.	.	H	α-helix	trans	-62.2	-44.8	175.7	-69.9	-177	-177.6	-169.9	9.2	112.4	W45 P47 D55 K56 A57 I61 V62 Y63	W45-R59 HydrophobicContact CD2-CG 4.05Å; W45-R59 HydrophobicContact CE3-CB 4.28Å; W45-R59 HydrophobicContact CE3-CG 3.63Å; W45-R59 HydrophobicContact CH2-CG 3.91Å; W45-R59 HydrophobicContact CZ2-CG 4.3Å; W45-R59 HydrophobicContact CZ3-CB 4.2Å; W45-R59 HydrophobicContact CZ3-CG 3.57Å; W45-R59 PolarHBondContact O-NH1 3.46Å; P47-R59 PolarHBondContact O-NH1 3.44Å; P47-R59 PolarHBondContact O-NH2 3.32Å; P47-R59 VanDerWaalsContact O-NH2 3.12Å; D55-R59 WeakPolarHBondContact O-CB 3.41Å; D55-R59 VanDerWaalsContact O-CG 3.23Å; D55-R59 WeakPolarHBondContact O-CG 3.1Å; D55-R59 PolarHBondContact O-N 3.09Å; K56-R59 PolarHBondContact O-N 3.25Å; A57-R59 PolarHBondContact O-N 2.98Å; R59-I61 VanDerWaalsContact C-N 3.31Å; R59-I61 PolarHBondContact O-N 3.1Å; R59-V62 PolarHBondContact O-N 3.12Å; R59-Y63 HydrophobicContact CB-CD2 4.43Å; R59-Y63 HydrophobicContact CB-CE2 4.43Å; R59-Y63 WeakPolarHBondContact O-CD2 3.43Å; R59-Y63 PolarHBondContact O-N 3.25Å
60	A	89.2	Confident	89	Confident	12 Å²	12	61.3 Å²	61.3	10%	0.099	38%	0.375	C	S	.	.	H	α-helix	trans	-59.7	-42	177	0	0	0	0	0	111.7	K56 A57 Y63 F64 F768 I772	K56-A60 WeakPolarHBondContact O-CB 2.83Å; K56-A60 PolarHBondContact O-N 3.47Å; A57-A60 PolarHBondContact O-N 2.84Å; A60-Y63 PolarHBondContact O-N 2.97Å; A60-F64 WeakPolarHBondContact O-CB 3.22Å; A60-F64 PolarHBondContact O-N 2.89Å; A60-F768 HydrophobicContact CB-CE2 4.39Å; A60-F768 WeakPolarHBondContact O-CD2 3.41Å; A60-I772 HydrophobicContact CB-CD1 4.12Å; A60-I772 HydrophobicContact CB-CG1 3.72Å
61	I	92.5	Very high	89.9	Confident	111 Å²	111	57.3 Å²	57.3	57%	0.569	33%	0.332	S	S	*	.	H	α-helix	trans	-63.5	-43.4	176.2	-67.7	164.4	0	0	0	111.1	A57 A58 R59 S65	A57-I61 VanDerWaalsContact O-CG1 3.29Å; A57-I61 WeakPolarHBondContact O-CG1 3.41Å; A57-I61 PolarHBondContact O-N 3.44Å; A58-I61 PolarHBondContact O-N 3.27Å; R59-I61 VanDerWaalsContact C-N 3.31Å; R59-I61 PolarHBondContact O-N 3.1Å; I61-S65 VanDerWaalsContact O-CB 3.3Å; I61-S65 WeakPolarHBondContact O-CB 3.47Å; I61-S65 PolarHBondContact O-N 3.49Å; I61-S65 PolarHBondContact O-OG 3.31Å
62	V	94.2	Very high	90.6	Very high	78 Å²	78	57.4 Å²	57.4	47%	0.473	33%	0.332	S	S	.	.	H	α-helix	trans	-62.7	-50	177.7	171.5	0	0	0	0	110.8	W45 A58 R59 F64 S65 A66	W45-V62 HydrophobicContact CZ3-CB 4.36Å; W45-V62 HydrophobicContact CZ3-CG1 4.31Å; W45-V62 HydrophobicContact CZ3-CG2 4.5Å; A58-V62 WeakPolarHBondContact O-CG2 3.44Å; A58-V62 PolarHBondContact O-N 3.49Å; R59-V62 PolarHBondContact O-N 3.12Å; V62-F64 PolarHBondContact O-N 2.68Å; V62-S65 PolarHBondContact O-N 2.87Å; V62-A66 WeakPolarHBondContact O-CB 3.28Å; V62-A66 PolarHBondContact O-N 3.24Å
63	Y	93.3	Very high	91.1	Very high	21 Å²	21	53.5 Å²	53.5	8%	0.082	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-40.7	178.7	-74.2	-56.9	0	0	0	112.5	W45 R59 A60 A66 L67 V764	W45-Y63 WeakPolarHBondContact CB-OH 3.13Å; W45-Y63 HydrophobicContact CE3-CE2 4.41Å; W45-Y63 PolarHBondContact N-OH 3.5Å; R59-Y63 HydrophobicContact CB-CD2 4.43Å; R59-Y63 HydrophobicContact CB-CE2 4.43Å; R59-Y63 WeakPolarHBondContact O-CD2 3.43Å; R59-Y63 PolarHBondContact O-N 3.25Å; A60-Y63 PolarHBondContact O-N 2.97Å; Y63-A66 PolarHBondContact O-N 2.71Å; Y63-L67 VanDerWaalsContact O-CB 3.24Å; Y63-L67 WeakPolarHBondContact O-CB 3.34Å; Y63-L67 PolarHBondContact O-N 3.15Å; Y63-V764 HydrophobicContact CD1-CG1 4.18Å
64	F	93.9	Very high	91.6	Very high	83 Å²	83	47.6 Å²	47.6	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-61.6	-45.1	175.1	-176.5	-103.8	0	0	0	111.8	A60 V62 L67 M68 F768 F783	A60-F64 WeakPolarHBondContact O-CB 3.22Å; A60-F64 PolarHBondContact O-N 2.89Å; V62-F64 PolarHBondContact O-N 2.68Å; F64-L67 PolarHBondContact O-N 3.35Å; F64-M68 HydrophobicContact CD1-CG 4.35Å; F64-M68 HydrophobicContact CE1-CG 3.96Å; F64-M68 HydrophobicContact CE2-CG 4.4Å; F64-M68 HydrophobicContact CZ-CG 3.99Å; F64-M68 HydrophobicContact CZ-SD 4.23Å; F64-M68 WeakPolarHBondContact O-CG 3.47Å; F64-M68 PolarHBondContact O-N 2.66Å; F64-F768 HydrophobicContact CB-CD2 4.08Å; F64-F768 HydrophobicContact CB-CE2 3.64Å; F64-F768 HydrophobicContact CB-CZ 4.31Å; F64-F768 HydrophobicContact CD2-CE1 4.49Å; F64-F768 HydrophobicContact CD2-CE2 4.02Å; F64-F768 AromaticContact CD2-CZ 3.81Å; F64-F768 HydrophobicContact CD2-CZ 3.81Å; F64-F768 HydrophobicContact CG-CE2 4.26Å; F64-F768 HydrophobicContact CG-CZ 4.47Å; F64-F783 HydrophobicContact CE2-CD1 4.08Å; F64-F783 HydrophobicContact CE2-CE1 4.07Å
65	S	94.2	Very high	91.8	Very high	65 Å²	65	46.1 Å²	46.1	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-64.5	-41.7	178.2	-55.7	0	0	0	0	111.3	I61 V62 M68 Y69	I61-S65 VanDerWaalsContact O-CB 3.3Å; I61-S65 WeakPolarHBondContact O-CB 3.47Å; I61-S65 PolarHBondContact O-N 3.49Å; I61-S65 PolarHBondContact O-OG 3.31Å; V62-S65 PolarHBondContact O-N 2.87Å; S65-M68 PolarHBondContact O-N 3.35Å; S65-Y69 WeakPolarHBondContact O-CB 3.49Å; S65-Y69 PolarHBondContact O-N 3.37Å
66	A	94.5	Very high	92.1	Very high	38 Å²	38	42.8 Å²	42.8	31%	0.314	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-43.4	174.1	0	0	0	0	0	111.6	V62 Y63 Y69 L70 V764	V62-A66 WeakPolarHBondContact O-CB 3.28Å; V62-A66 PolarHBondContact O-N 3.24Å; Y63-A66 PolarHBondContact O-N 2.71Å; A66-Y69 PolarHBondContact O-N 3.12Å; A66-L70 WeakPolarHBondContact O-CB 3.24Å; A66-L70 VanDerWaalsContact O-CG 3.26Å; A66-L70 WeakPolarHBondContact O-CG 3Å; A66-L70 PolarHBondContact O-N 3.46Å; A66-V764 HydrophobicContact CB-CG1 4.32Å
67	L	94.6	Very high	92.5	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-46.7	178.1	-171.6	68.5	0	0	0	111.3	Y63 F64 Y69 L70 F71 I761 V764 A765 F783	Y63-L67 VanDerWaalsContact O-CB 3.24Å; Y63-L67 WeakPolarHBondContact O-CB 3.34Å; Y63-L67 PolarHBondContact O-N 3.15Å; F64-L67 PolarHBondContact O-N 3.35Å; L67-Y69 VanDerWaalsContact C-N 3.32Å; L67-Y69 PolarHBondContact O-N 3.07Å; L67-L70 PolarHBondContact O-N 3.07Å; L67-F71 HydrophobicContact CD1-CE1 4.42Å; L67-F71 HydrophobicContact CD1-CE2 3.96Å; L67-F71 HydrophobicContact CD1-CZ 3.71Å; L67-F71 HydrophobicContact CD2-CE2 3.82Å; L67-F71 HydrophobicContact CD2-CZ 4.11Å; L67-F71 HydrophobicContact CG-CD2 4.15Å; L67-F71 HydrophobicContact CG-CE2 3.43Å; L67-F71 VanDerWaalsContact CG-CE2 3.43Å; L67-F71 HydrophobicContact CG-CZ 3.73Å; L67-F71 VanDerWaalsContact O-CD2 3.25Å; L67-F71 WeakPolarHBondContact O-CD2 3.38Å; L67-F71 WeakPolarHBondContact O-CG 3.48Å; L67-F71 PolarHBondContact O-N 3.01Å; L67-I761 HydrophobicContact CD1-CG2 3.93Å; L67-V764 HydrophobicContact CB-CG1 4.07Å; L67-V764 HydrophobicContact CD1-CG1 4.25Å; L67-A765 HydrophobicContact CD1-CB 4.12Å; L67-F783 HydrophobicContact CD2-CB 4.36Å
68	M	93	Very high	92.6	Very high	87 Å²	87	35.7 Å²	35.7	43%	0.429	20%	0.197	S	C	.	.	H	α-helix	trans	-61	-40.2	174.7	-70.8	-57.5	-60.3	0	0	112.2	F64 S65 F71 L72	F64-M68 HydrophobicContact CD1-CG 4.35Å; F64-M68 HydrophobicContact CE1-CG 3.96Å; F64-M68 HydrophobicContact CE2-CG 4.4Å; F64-M68 HydrophobicContact CZ-CG 3.99Å; F64-M68 HydrophobicContact CZ-SD 4.23Å; F64-M68 WeakPolarHBondContact O-CG 3.47Å; F64-M68 PolarHBondContact O-N 2.66Å; S65-M68 PolarHBondContact O-N 3.35Å; M68-F71 PolarHBondContact O-N 2.52Å; M68-F71 HydrophobicContact SD-CD2 4.32Å; M68-L72 PolarHBondContact O-N 2.95Å; M68-L72 VanDerWaalsContact O-N 3.17Å
69	Y	94.7	Very high	92.5	Very high	87 Å²	87	34 Å²	34	34%	0.341	18%	0.182	S	C	.	.	H	α-helix	trans	-67.5	-34.9	176.5	-170.7	-110.7	0	0	0	112.9	S65 A66 L67 L72 G73 L724 F727 W728	S65-Y69 WeakPolarHBondContact O-CB 3.49Å; S65-Y69 PolarHBondContact O-N 3.37Å; A66-Y69 PolarHBondContact O-N 3.12Å; L67-Y69 VanDerWaalsContact C-N 3.32Å; L67-Y69 PolarHBondContact O-N 3.07Å; Y69-L72 HydrophobicContact CD2-CD2 4.45Å; Y69-L72 WeakPolarHBondContact O-CB 3.06Å; Y69-L72 PolarHBondContact O-N 3.48Å; Y69-G73 PolarHBondContact O-N 2.77Å; Y69-G73 VanDerWaalsContact O-N 3.16Å; Y69-L724 WeakPolarHBondContact CE2-O 3.08Å; Y69-F727 HydrophobicContact CE1-CD1 4.29Å; Y69-F727 WeakPolarHBondContact OH-CB 3.5Å; Y69-F727 VanDerWaalsContact OH-CD1 3.26Å; Y69-F727 WeakPolarHBondContact OH-CD1 3.26Å; Y69-W728 AromaticContact CD1-CZ2 3.88Å; Y69-W728 HydrophobicContact CD1-CZ2 3.88Å; Y69-W728 AromaticContact CD1-NE1 3.6Å; Y69-W728 AromaticContact CE1-CE2 3.6Å; Y69-W728 AromaticContact CE1-CZ2 3.7Å; Y69-W728 HydrophobicContact CE1-CZ2 3.7Å; Y69-W728 AromaticContact CE1-NE1 3.2Å; Y69-W728 AromaticContact CE2-NE1 3.66Å; Y69-W728 AromaticContact CG-NE1 3.99Å; Y69-W728 AromaticContact CZ-CD1 3.79Å; Y69-W728 AromaticContact CZ-NE1 3.24Å; Y69-W728 PolarHBondContact O-NE1 2.74Å
70	L	95.2	Very high	92.5	Very high	18 Å²	18	33.8 Å²	33.8	9%	0.094	18%	0.181	C	C	.	.	H	α-helix	trans	-71.3	-38.2	174.9	-71.6	164.7	0	0	0	112.1	A66 L67 L72 G73 V74 W728 L757 V760 I761 V764	A66-L70 WeakPolarHBondContact O-CB 3.24Å; A66-L70 VanDerWaalsContact O-CG 3.26Å; A66-L70 WeakPolarHBondContact O-CG 3Å; A66-L70 PolarHBondContact O-N 3.46Å; L67-L70 PolarHBondContact O-N 3.07Å; L70-L72 VanDerWaalsContact C-N 3.25Å; L70-L72 PolarHBondContact O-N 3.28Å; L70-G73 CarbonylContact O-C 3.4Å; L70-G73 WeakPolarHBondContact O-CA 3.28Å; L70-G73 PolarHBondContact O-N 3.36Å; L70-G73 VanDerWaalsContact O-N 3.07Å; L70-V74 PolarHBondContact O-N 2.71Å; L70-W728 HydrophobicContact CD2-CH2 4.12Å; L70-W728 HydrophobicContact CD2-CZ2 4.14Å; L70-L757 HydrophobicContact CD2-CD2 4.33Å; L70-V760 HydrophobicContact CD1-CG1 3.78Å; L70-V760 HydrophobicContact CD2-CG1 4Å; L70-I761 HydrophobicContact CB-CD1 4.07Å; L70-I761 HydrophobicContact CB-CG1 3.6Å; L70-I761 HydrophobicContact CD1-CG1 4.11Å; L70-I761 HydrophobicContact CG-CG1 4.39Å; L70-V764 HydrophobicContact CD1-CB 4.28Å; L70-V764 HydrophobicContact CD1-CG1 4.43Å; L70-V764 HydrophobicContact CD1-CG2 4.01Å
71	F	94.2	Very high	92.6	Very high	5 Å²	5	33.2 Å²	33.2	2%	0.022	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-35	173	-69.2	-44	0	0	0	112.3	L67 M68 V74 S75 I761 T788	L67-F71 HydrophobicContact CD1-CE1 4.42Å; L67-F71 HydrophobicContact CD1-CE2 3.96Å; L67-F71 HydrophobicContact CD1-CZ 3.71Å; L67-F71 HydrophobicContact CD2-CE2 3.82Å; L67-F71 HydrophobicContact CD2-CZ 4.11Å; L67-F71 HydrophobicContact CG-CD2 4.15Å; L67-F71 HydrophobicContact CG-CE2 3.43Å; L67-F71 VanDerWaalsContact CG-CE2 3.43Å; L67-F71 HydrophobicContact CG-CZ 3.73Å; L67-F71 VanDerWaalsContact O-CD2 3.25Å; L67-F71 WeakPolarHBondContact O-CD2 3.38Å; L67-F71 WeakPolarHBondContact O-CG 3.48Å; L67-F71 PolarHBondContact O-N 3.01Å; M68-F71 PolarHBondContact O-N 2.52Å; M68-F71 HydrophobicContact SD-CD2 4.32Å; F71-V74 PolarHBondContact O-N 3.39Å; F71-S75 WeakPolarHBondContact O-CB 3.1Å; F71-S75 PolarHBondContact O-N 3.36Å; F71-S75 PolarHBondContact O-OG 2.98Å; F71-I761 HydrophobicContact CD1-CD1 3.98Å; F71-I761 HydrophobicContact CE1-CD1 4.11Å; F71-I761 HydrophobicContact CE1-CG2 3.73Å; F71-I761 HydrophobicContact CZ-CG2 4.18Å; F71-T788 HydrophobicContact CE1-CG2 4.16Å
72	L	91.5	Very high	92.5	Very high	34 Å²	34	28 Å²	28	18%	0.178	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-43.9	171.1	-171.2	65.7	0	0	0	111.3	M68 Y69 L70 S75 I76 M721 L724 T725	M68-L72 PolarHBondContact O-N 2.95Å; M68-L72 VanDerWaalsContact O-N 3.17Å; Y69-L72 HydrophobicContact CD2-CD2 4.45Å; Y69-L72 WeakPolarHBondContact O-CB 3.06Å; Y69-L72 PolarHBondContact O-N 3.48Å; L70-L72 VanDerWaalsContact C-N 3.25Å; L70-L72 PolarHBondContact O-N 3.28Å; L72-S75 WeakPolarHBondContact O-CB 3.37Å; L72-S75 PolarHBondContact O-N 3.2Å; L72-I76 HydrophobicContact CG-CD1 4.37Å; L72-I76 WeakPolarHBondContact O-CD1 3.37Å; L72-I76 VanDerWaalsContact O-CG1 3.31Å; L72-I76 WeakPolarHBondContact O-CG1 3.09Å; L72-I76 PolarHBondContact O-N 3.32Å; L72-I76 VanDerWaalsContact O-N 3.14Å; L72-M721 HydrophobicContact CD1-CE 4.39Å; L72-L724 HydrophobicContact CD2-CB 4.39Å; L72-T725 HydrophobicContact CD1-CG2 3.61Å; L72-T725 HydrophobicContact CD2-CG2 3.52Å; L72-T725 HydrophobicContact CG-CG2 3.66Å
73	G	93.7	Very high	92.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.4	-52	172.7	0	0	0	0	0	112.6	Y69 L70 S75 I76 I77 F732	Y69-G73 PolarHBondContact O-N 2.77Å; Y69-G73 VanDerWaalsContact O-N 3.16Å; L70-G73 CarbonylContact O-C 3.4Å; L70-G73 WeakPolarHBondContact O-CA 3.28Å; L70-G73 PolarHBondContact O-N 3.36Å; L70-G73 VanDerWaalsContact O-N 3.07Å; G73-S75 VanDerWaalsContact C-N 3.28Å; G73-S75 PolarHBondContact O-N 2.9Å; G73-I76 PolarHBondContact O-N 3.38Å; G73-I76 VanDerWaalsContact O-N 3.16Å; G73-I77 PolarHBondContact O-N 2.95Å; G73-I77 VanDerWaalsContact O-N 3.08Å; G73-F732 VanDerWaalsContact O-CE2 3.23Å; G73-F732 WeakPolarHBondContact O-CE2 3.42Å
74	V	93	Very high	92.1	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.024	13%	0.125	C	C	.	.	H	α-helix	trans	-58.7	-39.4	177.4	170.8	0	0	0	0	111.9	L70 F71 I76 I77 A78 P129 L757 I761	L70-V74 PolarHBondContact O-N 2.71Å; F71-V74 PolarHBondContact O-N 3.39Å; V74-I76 PolarHBondContact O-N 3.49Å; V74-I77 VanDerWaalsContact O-CG2 3.27Å; V74-I77 WeakPolarHBondContact O-CG2 3.42Å; V74-A78 WeakPolarHBondContact O-CB 3.47Å; V74-A78 PolarHBondContact O-N 3.49Å; V74-P129 HydrophobicContact CG1-CB 4.16Å; V74-P129 HydrophobicContact CG1-CG 3.6Å; V74-L757 HydrophobicContact CG2-CB 3.81Å; V74-L757 HydrophobicContact CG2-CD1 4.32Å; V74-I761 HydrophobicContact CB-CD1 4.35Å; V74-I761 HydrophobicContact CG2-CD1 3.35Å
75	S	90	Very high	91.8	Very high	15 Å²	15	19.6 Å²	19.6	11%	0.105	11%	0.108	C	C	.	.	H	α-helix	trans	-60.8	-44.1	177.2	-58.1	0	0	0	0	111.6	F71 L72 G73 A78 D79 T336 P791	F71-S75 WeakPolarHBondContact O-CB 3.1Å; F71-S75 PolarHBondContact O-N 3.36Å; F71-S75 PolarHBondContact O-OG 2.98Å; L72-S75 WeakPolarHBondContact O-CB 3.37Å; L72-S75 PolarHBondContact O-N 3.2Å; G73-S75 VanDerWaalsContact C-N 3.28Å; G73-S75 PolarHBondContact O-N 2.9Å; S75-A78 PolarHBondContact O-N 2.99Å; S75-D79 PolarHBondContact O-N 2.91Å; S75-T336 WeakPolarHBondContact O-CG2 3.1Å; S75-P791 WeakPolarHBondContact OG-CG 3.21Å
76	I	91.4	Very high	91.4	Very high	12 Å²	12	17.1 Å²	17.1	6%	0.062	9%	0.089	C	C	.	.	H	α-helix	trans	-70.2	-42.1	-178.6	-61	159	0	0	0	111.6	L72 G73 V74 A78 D79 T340 T725 W728 K729 F732	L72-I76 HydrophobicContact CG-CD1 4.37Å; L72-I76 WeakPolarHBondContact O-CD1 3.37Å; L72-I76 VanDerWaalsContact O-CG1 3.31Å; L72-I76 WeakPolarHBondContact O-CG1 3.09Å; L72-I76 PolarHBondContact O-N 3.32Å; L72-I76 VanDerWaalsContact O-N 3.14Å; G73-I76 PolarHBondContact O-N 3.38Å; G73-I76 VanDerWaalsContact O-N 3.16Å; V74-I76 PolarHBondContact O-N 3.49Å; I76-A78 VanDerWaalsContact C-N 3.28Å; I76-A78 PolarHBondContact O-N 3.3Å; I76-D79 VanDerWaalsContact O-CB 3.3Å; I76-D79 WeakPolarHBondContact O-CB 3.39Å; I76-D79 PolarHBondContact O-N 3.38Å; I76-T340 HydrophobicContact CD1-CG2 4.32Å; I76-T340 HydrophobicContact CG1-CG2 3.73Å; I76-T725 HydrophobicContact CD1-CG2 3.92Å; I76-W728 HydrophobicContact CD1-CB 3.49Å; I76-W728 VanDerWaalsContact CD1-CB 3.49Å; I76-W728 HydrophobicContact CD1-CG 4.23Å; I76-K729 HydrophobicContact CD1-CG 4.47Å; I76-K729 HydrophobicContact CG2-CG 4.29Å; I76-F732 HydrophobicContact CB-CD2 4.05Å; I76-F732 HydrophobicContact CB-CE2 4.16Å; I76-F732 HydrophobicContact CG2-CD2 3.76Å; I76-F732 HydrophobicContact CG2-CE2 4.37Å
77	I	93.3	Very high	91	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-69.3	-30.9	176.5	-172.1	65.1	0	0	0	111.3	G73 V74 D79 R80 F81 F732 V735 V753 I754 L757	G73-I77 PolarHBondContact O-N 2.95Å; G73-I77 VanDerWaalsContact O-N 3.08Å; V74-I77 VanDerWaalsContact O-CG2 3.27Å; V74-I77 WeakPolarHBondContact O-CG2 3.42Å; I77-D79 VanDerWaalsContact C-N 3.28Å; I77-D79 PolarHBondContact O-N 3.03Å; I77-R80 HydrophobicContact CD1-CB 4.34Å; I77-R80 PolarHBondContact O-N 2.76Å; I77-F81 WeakPolarHBondContact O-CB 3.41Å; I77-F81 PolarHBondContact O-N 3.45Å; I77-F732 HydrophobicContact CB-CD1 4.41Å; I77-F732 HydrophobicContact CB-CD2 3.94Å; I77-F732 HydrophobicContact CB-CE1 4.32Å; I77-F732 HydrophobicContact CB-CE2 3.84Å; I77-F732 HydrophobicContact CB-CG 4.24Å; I77-F732 HydrophobicContact CB-CZ 4.04Å; I77-F732 HydrophobicContact CD1-CB 4.2Å; I77-F732 HydrophobicContact CD1-CD1 3.97Å; I77-F732 HydrophobicContact CD1-CD2 4.48Å; I77-F732 HydrophobicContact CD1-CG 3.96Å; I77-F732 HydrophobicContact CG2-CE2 4.42Å; I77-F732 HydrophobicContact CG2-CZ 4.43Å; I77-V735 HydrophobicContact CD1-CG2 3.93Å; I77-V753 HydrophobicContact CD1-CB 4.36Å; I77-V753 HydrophobicContact CD1-CG1 4.1Å; I77-V753 HydrophobicContact CG1-CB 4.23Å; I77-V753 HydrophobicContact CG1-CG1 3.89Å; I77-I754 HydrophobicContact CB-CG1 4.4Å; I77-I754 HydrophobicContact CG1-CG1 3.94Å; I77-I754 HydrophobicContact CG2-CD1 4.46Å; I77-I754 HydrophobicContact CG2-CG1 3.6Å; I77-L757 HydrophobicContact CG2-CD1 3.94Å
78	A	89.4	Confident	90.7	Very high	3 Å²	3	16.2 Å²	16.2	3%	0.025	8%	0.079	C	C	.	.	H	α-helix	trans	-62.9	-33.3	173.5	0	0	0	0	0	112.2	V74 S75 I76 F81 M82	V74-A78 WeakPolarHBondContact O-CB 3.47Å; V74-A78 PolarHBondContact O-N 3.49Å; S75-A78 PolarHBondContact O-N 2.99Å; I76-A78 VanDerWaalsContact C-N 3.28Å; I76-A78 PolarHBondContact O-N 3.3Å; A78-F81 PolarHBondContact O-N 3.03Å; A78-M82 WeakPolarHBondContact O-CB 3.43Å; A78-M82 VanDerWaalsContact O-CG 3.23Å; A78-M82 WeakPolarHBondContact O-CG 3.41Å; A78-M82 PolarHBondContact O-N 3.22Å
79	D	86.9	Confident	90.2	Very high	14 Å²	14	12.5 Å²	12.5	8%	0.075	6%	0.062	C	C	.	.	H	α-helix	trans	-56.9	-51.4	170.5	179.7	50.4	0	0	0	111.2	S75 I76 I77 F81 M82 A83 M333 T336 R337	S75-D79 PolarHBondContact O-N 2.91Å; I76-D79 VanDerWaalsContact O-CB 3.3Å; I76-D79 WeakPolarHBondContact O-CB 3.39Å; I76-D79 PolarHBondContact O-N 3.38Å; I77-D79 VanDerWaalsContact C-N 3.28Å; I77-D79 PolarHBondContact O-N 3.03Å; D79-F81 VanDerWaalsContact C-N 3.32Å; D79-F81 PolarHBondContact O-N 3.39Å; D79-M82 PolarHBondContact O-N 3.22Å; D79-A83 PolarHBondContact O-N 3.43Å; D79-M333 WeakPolarHBondContact OD1-CA 3.48Å; D79-M333 WeakPolarHBondContact OD1-CB 3.18Å; D79-M333 WeakPolarHBondContact OD1-CG 3.41Å; D79-T336 HydrophobicContact CB-CG2 3.89Å; D79-R337 IonicContact OD2-NE 2.64Å
80	R	89.7	Confident	89.4	Confident	22 Å²	22	9 Å²	9	8%	0.083	5%	0.05	C	C	.	.	H	α-helix	trans	-63.1	-38.7	177.6	-68.4	-70.5	-178.4	-174.5	-8	112.3	I77 A83 A84 T686 E695	I77-R80 HydrophobicContact CD1-CB 4.34Å; I77-R80 PolarHBondContact O-N 2.76Å; R80-A83 PolarHBondContact O-N 2.91Å; R80-A84 PolarHBondContact O-N 2.92Å; R80-T686 PolarHBondContact NH1-OG1 3.16Å; R80-E695 IonicContact CZ-OE2 3.77Å; R80-E695 IonicContact NH1-OE2 3.65Å; R80-E695 IonicContact NH2-OE2 3.28Å; R80-E695 PolarHBondContact NH2-OE2 2.86Å; R80-E695 VanDerWaalsContact NH2-OE2 3.07Å
81	F	92.1	Very high	88.6	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-64.2	-44	176.7	-174.8	-133.5	0	0	0	112.1	I77 A78 D79 A84 I85 G125 A128 F747 C750 I751 I754	I77-F81 WeakPolarHBondContact O-CB 3.41Å; I77-F81 PolarHBondContact O-N 3.45Å; A78-F81 PolarHBondContact O-N 3.03Å; D79-F81 VanDerWaalsContact C-N 3.32Å; D79-F81 PolarHBondContact O-N 3.39Å; F81-A84 WeakPolarHBondContact O-CB 3.29Å; F81-A84 PolarHBondContact O-N 2.99Å; F81-I85 HydrophobicContact CD1-CD1 4Å; F81-I85 HydrophobicContact CD2-CD1 4.3Å; F81-I85 HydrophobicContact CE1-CD1 3.8Å; F81-I85 HydrophobicContact CE2-CD1 4.1Å; F81-I85 HydrophobicContact CE2-CG1 4.43Å; F81-I85 HydrophobicContact CG-CD1 4.25Å; F81-I85 HydrophobicContact CZ-CD1 3.83Å; F81-I85 WeakPolarHBondContact O-CG1 3.42Å; F81-I85 PolarHBondContact O-N 3.46Å; F81-G125 VanDerWaalsContact CE1-CA 3.48Å; F81-A128 HydrophobicContact CD1-CB 4.28Å; F81-A128 HydrophobicContact CE1-CB 3.67Å; F81-A128 HydrophobicContact CZ-CB 4.48Å; F81-F747 HydrophobicContact CD2-CD2 4.08Å; F81-F747 HydrophobicContact CD2-CE2 4.47Å; F81-F747 AromaticContact CE2-CD2 3.33Å; F81-F747 HydrophobicContact CE2-CD2 3.33Å; F81-F747 AromaticContact CE2-CE2 3.37Å; F81-F747 HydrophobicContact CE2-CE2 3.37Å; F81-F747 HydrophobicContact CE2-CG 4.03Å; F81-F747 HydrophobicContact CE2-CZ 4.12Å; F81-F747 HydrophobicContact CZ-CD2 4.1Å; F81-F747 AromaticContact CZ-CE2 3.67Å; F81-F747 HydrophobicContact CZ-CE2 3.67Å; F81-F747 HydrophobicContact CZ-CZ 4.27Å; F81-C750 HydrophobicContact CB-CB 3.9Å; F81-C750 HydrophobicContact CD2-CB 3.64Å; F81-C750 HydrophobicContact CG-CB 4.12Å; F81-I751 HydrophobicContact CD2-CG1 4.32Å; F81-I751 HydrophobicContact CE2-CD1 3.86Å; F81-I751 HydrophobicContact CE2-CG1 3.45Å; F81-I751 VanDerWaalsContact CE2-CG1 3.45Å; F81-I751 HydrophobicContact CZ-CD1 3.94Å; F81-I751 HydrophobicContact CZ-CG1 3.65Å; F81-I754 HydrophobicContact CB-CD1 3.95Å; F81-I754 HydrophobicContact CD1-CD1 3.82Å; F81-I754 HydrophobicContact CE1-CD1 4.46Å; F81-I754 HydrophobicContact CG-CD1 3.89Å
82	M	88.9	Confident	87.5	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-66.4	-36.7	175.7	-67.4	-62.7	-73.4	0	0	112.2	A78 D79 A84 I85 E86 M122 G125 R328 A329 R332 M333	A78-M82 WeakPolarHBondContact O-CB 3.43Å; A78-M82 VanDerWaalsContact O-CG 3.23Å; A78-M82 WeakPolarHBondContact O-CG 3.41Å; A78-M82 PolarHBondContact O-N 3.22Å; D79-M82 PolarHBondContact O-N 3.22Å; M82-A84 VanDerWaalsContact C-N 3.31Å; M82-A84 PolarHBondContact O-N 3.4Å; M82-I85 PolarHBondContact O-N 3.12Å; M82-I85 HydrophobicContact SD-CD1 4.13Å; M82-E86 PolarHBondContact O-N 3.49Å; M82-M122 HydrophobicContact CE-SD 4.02Å; M82-G125 VanDerWaalsContact SD-CA 3.54Å; M82-R328 HydrophobicContact CE-CG 4.34Å; M82-A329 HydrophobicContact CB-CB 4.23Å; M82-A329 HydrophobicContact CE-CB 4.08Å; M82-R332 HydrophobicContact CE-CB 4.26Å; M82-R332 HydrophobicContact CG-CB 4.4Å; M82-R332 HydrophobicContact CG-CG 4.03Å; M82-R332 PolarHBondContact SD-NH1 3.16Å; M82-M333 HydrophobicContact CB-CG 4.16Å
83	A	88.4	Confident	86.7	Confident	6 Å²	6	19.3 Å²	19.3	5%	0.05	10%	0.095	C	C	.	.	H	α-helix	trans	-60.3	-42.1	173.3	0	0	0	0	0	111.7	D79 R80 E86 V87 M333 V684 T738	D79-A83 PolarHBondContact O-N 3.43Å; R80-A83 PolarHBondContact O-N 2.91Å; A83-E86 PolarHBondContact O-N 3.36Å; A83-V87 WeakPolarHBondContact O-CG2 3.44Å; A83-V87 PolarHBondContact O-N 2.92Å; A83-V87 VanDerWaalsContact O-N 3.13Å; A83-M333 VanDerWaalsContact CA-SD 3.53Å; A83-M333 HydrophobicContact CB-SD 3.53Å; A83-M333 VanDerWaalsContact CB-SD 3.53Å; A83-V684 HydrophobicContact CB-CG1 4.18Å; A83-T738 HydrophobicContact CB-CG2 4.11Å
84	A	90.8	Very high	85.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.7	-43.7	175.6	0	0	0	0	0	112.1	R80 F81 M82 V87 I88 T738 C746 F747	R80-A84 PolarHBondContact O-N 2.92Å; F81-A84 WeakPolarHBondContact O-CB 3.29Å; F81-A84 PolarHBondContact O-N 2.99Å; M82-A84 VanDerWaalsContact C-N 3.31Å; M82-A84 PolarHBondContact O-N 3.4Å; A84-V87 PolarHBondContact O-N 3.18Å; A84-I88 VanDerWaalsContact O-CG1 3.27Å; A84-I88 WeakPolarHBondContact O-CG1 3.33Å; A84-I88 PolarHBondContact O-N 3.24Å; A84-T738 HydrophobicContact CB-CG2 4.36Å; A84-C746 HydrophobicContact CB-CB 3.94Å; A84-F747 HydrophobicContact CB-CB 4.13Å
85	I	88.8	Confident	84.3	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-42	177.1	-68.3	160.7	0	0	0	111.3	F81 M82 V87 I88 T89 L121 M122 F747	F81-I85 HydrophobicContact CD1-CD1 4Å; F81-I85 HydrophobicContact CD2-CD1 4.3Å; F81-I85 HydrophobicContact CE1-CD1 3.8Å; F81-I85 HydrophobicContact CE2-CD1 4.1Å; F81-I85 HydrophobicContact CE2-CG1 4.43Å; F81-I85 HydrophobicContact CG-CD1 4.25Å; F81-I85 HydrophobicContact CZ-CD1 3.83Å; F81-I85 WeakPolarHBondContact O-CG1 3.42Å; F81-I85 PolarHBondContact O-N 3.46Å; M82-I85 PolarHBondContact O-N 3.12Å; M82-I85 HydrophobicContact SD-CD1 4.13Å; I85-V87 VanDerWaalsContact C-N 3.35Å; I85-V87 PolarHBondContact O-N 3.41Å; I85-I88 PolarHBondContact O-N 2.85Å; I85-T89 HydrophobicContact CG2-CG2 4.06Å; I85-T89 WeakPolarHBondContact O-CB 3.49Å; I85-T89 WeakPolarHBondContact O-CG2 3.15Å; I85-T89 PolarHBondContact O-N 3.38Å; I85-T89 PolarHBondContact O-OG1 3.4Å; I85-L121 VanDerWaalsContact CD1-O 3.32Å; I85-L121 WeakPolarHBondContact CD1-O 3.38Å; I85-L121 HydrophobicContact CG2-CB 3.72Å; I85-M122 HydrophobicContact CG2-CE 4.02Å; I85-M122 HydrophobicContact CG2-CG 4.13Å; I85-M122 HydrophobicContact CG2-SD 3.53Å; I85-M122 VanDerWaalsContact CG2-SD 3.53Å; I85-F747 HydrophobicContact CD1-CE2 4.37Å; I85-F747 HydrophobicContact CG1-CD2 3.84Å; I85-F747 HydrophobicContact CG1-CE2 3.89Å
86	E	86.1	Confident	83	Confident	14 Å²	14	33.4 Å²	33.4	7%	0.065	17%	0.17	C	C	.	.	H	α-helix	trans	-58.1	-48.1	176.2	-174.6	64.5	-168.8	0	0	110.8	M82 A83 I88 T89 S90 M122 S327 A329 V684	M82-E86 PolarHBondContact O-N 3.49Å; A83-E86 PolarHBondContact O-N 3.36Å; E86-I88 VanDerWaalsContact C-N 3.33Å; E86-I88 PolarHBondContact O-N 2.94Å; E86-T89 PolarHBondContact O-N 3.31Å; E86-T89 PolarHBondContact O-OG1 2.69Å; E86-S90 WeakPolarHBondContact O-CB 3.45Å; E86-S90 PolarHBondContact O-N 3.4Å; E86-S90 PolarHBondContact O-OG 3.05Å; E86-M122 WeakPolarHBondContact OE2-CE 3.39Å; E86-S327 VanDerWaalsContact OE1-CB 3.23Å; E86-S327 WeakPolarHBondContact OE1-CB 3.38Å; E86-S327 PolarHBondContact OE1-OG 3.42Å; E86-S327 VanDerWaalsContact OE1-OG 3.11Å; E86-S327 WeakPolarHBondContact OE2-CB 3.17Å; E86-S327 PolarHBondContact OE2-OG 3.42Å; E86-A329 HydrophobicContact CB-CB 3.81Å; E86-A329 HydrophobicContact CG-CB 4.33Å; E86-A329 VanDerWaalsContact OE2-CB 3.26Å; E86-A329 WeakPolarHBondContact OE2-CB 3.39Å; E86-V684 HydrophobicContact CB-CG1 4.14Å; E86-V684 HydrophobicContact CG-CB 4.3Å; E86-V684 HydrophobicContact CG-CG1 4.08Å; E86-V684 HydrophobicContact CG-CG2 4.32Å
87	V	85.4	Confident	81.5	Confident	19 Å²	19	35.4 Å²	35.4	12%	0.115	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-37.3	178.1	174.2	0	0	0	0	112.1	A83 A84 I85 S90 Q91	A83-V87 WeakPolarHBondContact O-CG2 3.44Å; A83-V87 PolarHBondContact O-N 2.92Å; A83-V87 VanDerWaalsContact O-N 3.13Å; A84-V87 PolarHBondContact O-N 3.18Å; I85-V87 VanDerWaalsContact C-N 3.35Å; I85-V87 PolarHBondContact O-N 3.41Å; V87-S90 WeakPolarHBondContact CA-OG 3.37Å; V87-S90 PolarHBondContact O-OG 3.42Å; V87-Q91 WeakPolarHBondContact O-CG 3.46Å
88	I	87.3	Confident	79.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.3	-42.7	177.1	-68.6	164	0	0	0	111.6	A84 I85 E86 Q91 W112 L121 G742 W744 F747	A84-I88 VanDerWaalsContact O-CG1 3.27Å; A84-I88 WeakPolarHBondContact O-CG1 3.33Å; A84-I88 PolarHBondContact O-N 3.24Å; I85-I88 PolarHBondContact O-N 2.85Å; E86-I88 VanDerWaalsContact C-N 3.33Å; E86-I88 PolarHBondContact O-N 2.94Å; I88-Q91 WeakPolarHBondContact O-CG 3.48Å; I88-W112 PolarHBondContact O-NE1 2.85Å; I88-L121 HydrophobicContact CG2-CD1 3.82Å; I88-G742 WeakPolarHBondContact CG1-O 3.31Å; I88-W744 HydrophobicContact CD1-CD2 3.9Å; I88-W744 HydrophobicContact CD1-CE3 4.06Å; I88-W744 HydrophobicContact CD1-CG 4.27Å; I88-W744 HydrophobicContact CD1-CZ3 4.43Å; I88-W744 HydrophobicContact CG1-CD2 4.33Å; I88-W744 HydrophobicContact CG1-CG 4.43Å; I88-W744 HydrophobicContact CG2-CH2 4.33Å; I88-W744 HydrophobicContact CG2-CZ2 3.68Å; I88-F747 HydrophobicContact CD1-CB 3.76Å; I88-F747 HydrophobicContact CD1-CD2 4Å; I88-F747 HydrophobicContact CD1-CG 3.98Å
89	T	82.5	Confident	78	Confident	9 Å²	9	47.6 Å²	47.6	6%	0.055	23%	0.227	C	C	.	.	H	α-helix	trans	-82.6	-20.5	-173	54.6	0	0	0	0	113.6	I85 E86 Q91 L121 M122	I85-T89 HydrophobicContact CG2-CG2 4.06Å; I85-T89 WeakPolarHBondContact O-CB 3.49Å; I85-T89 WeakPolarHBondContact O-CG2 3.15Å; I85-T89 PolarHBondContact O-N 3.38Å; I85-T89 PolarHBondContact O-OG1 3.4Å; E86-T89 PolarHBondContact O-N 3.31Å; E86-T89 PolarHBondContact O-OG1 2.69Å; T89-Q91 VanDerWaalsContact C-N 3.34Å; T89-L121 HydrophobicContact CG2-CB 4.18Å; T89-L121 HydrophobicContact CG2-CD1 3.88Å; T89-M122 WeakPolarHBondContact OG1-CE 3.3Å
90	S	79	Confident	76.2	Confident	14 Å²	14	55 Å²	55	10%	0.098	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	4.6	177.8	56.3	0	0	0	0	114.3	E86 V87 E92 A681	E86-S90 WeakPolarHBondContact O-CB 3.45Å; E86-S90 PolarHBondContact O-N 3.4Å; E86-S90 PolarHBondContact O-OG 3.05Å; V87-S90 WeakPolarHBondContact CA-OG 3.37Å; V87-S90 PolarHBondContact O-OG 3.42Å; S90-E92 PolarHBondContact O-N 3.08Å; S90-A681 WeakPolarHBondContact OG-CB 3.17Å
91	Q	78.3	Confident	74.3	Confident	65 Å²	65	60.8 Å²	60.8	30%	0.304	29%	0.291	S	S	.	.			trans	-59.6	132.5	176.5	-66.7	-178.2	2.2	0	0	111	V87 I88 T89 I111 G742	V87-Q91 WeakPolarHBondContact O-CG 3.46Å; I88-Q91 WeakPolarHBondContact O-CG 3.48Å; T89-Q91 VanDerWaalsContact C-N 3.34Å; Q91-I111 HydrophobicContact CB-CD1 3.83Å; Q91-I111 HydrophobicContact CB-CG1 4.49Å; Q91-I111 WeakPolarHBondContact O-CG1 3.47Å; Q91-I111 PolarHBondContact O-N 3.47Å; Q91-G742 PolarHBondContact NE2-O 2.85Å
92	E	72	Confident	72.4	Confident	73 Å²	73	62.7 Å²	62.7	34%	0.341	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	149.8	178.8	-65.9	175.4	-162.3	0	0	110.6	S90 S108 V109 R110 T679	S90-E92 PolarHBondContact O-N 3.08Å; E92-S108 WeakPolarHBondContact OE2-CB 3.24Å; E92-S108 PolarHBondContact OE2-OG 3.41Å; E92-V109 CarbonylContact C-O 3.56Å; E92-V109 WeakPolarHBondContact CA-O 3.29Å; E92-R110 HydrophobicContact CG-CG 4.16Å; E92-T679 PolarHBondContact OE1-OG1 2.9Å
93	K	73	Confident	70.8	Confident	136 Å²	136	68.2 Å²	68.2	59%	0.591	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	126	174.4	-179.1	178.2	-178.8	-177.3	0	108.5	V95 V109 I111	K93-V95 PolarHBondContact O-N 3.29Å; K93-V109 PolarHBondContact N-O 3.06Å; K93-V109 PolarHBondContact O-N 2.77Å; K93-I111 HydrophobicContact CB-CD1 4.39Å; K93-I111 HydrophobicContact CB-CG1 3.9Å
94	E	70	Confident	69.3	Low	154 Å²	154	73 Å²	73	72%	0.72	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	123	171.3	-65.2	179	-178.2	0	0	109.9
95	V	68	Low	67.7	Low	58 Å²	58	75.9 Å²	75.9	35%	0.352	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121.1	173	-177.4	0	0	0	0	107.7	K93 L97 I107 V109	K93-V95 PolarHBondContact O-N 3.29Å; V95-L97 HydrophobicContact CG1-CD2 4.09Å; V95-L97 HydrophobicContact CG1-CG 4.33Å; V95-L97 PolarHBondContact O-N 2.64Å; V95-I107 PolarHBondContact N-O 3.07Å; V95-I107 PolarHBondContact O-N 3.36Å; V95-V109 HydrophobicContact CG2-CG2 4.47Å
96	T	62.9	Low	66.3	Low	103 Å²	103	80.2 Å²	80.2	63%	0.632	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	103.3	172.6	43	0	0	0	0	109.3	T106	T96-T106 HydrophobicContact CG2-CG2 3.55Å
97	L	58.7	Low	65.1	Low	53 Å²	53	80.7 Å²	80.7	28%	0.277	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	128.3	171.7	-65.8	176.7	0	0	0	109.2	V95 Q105 I107	V95-L97 HydrophobicContact CG1-CD2 4.09Å; V95-L97 HydrophobicContact CG1-CG 4.33Å; V95-L97 PolarHBondContact O-N 2.64Å; L97-Q105 PolarHBondContact N-O 3.1Å; L97-Q105 PolarHBondContact O-N 3.41Å; L97-I107 HydrophobicContact CD1-CD1 3.73Å; L97-I107 HydrophobicContact CD1-CG1 4.26Å
98	R	58.8	Low	64.1	Low	206 Å²	206	82.8 Å²	82.8	78%	0.777	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	113.6	174	-167.2	173.9	-175.9	-175.4	-1	108.7	T104	R98-T104 HydrophobicContact CG-CG2 4.39Å
99	K	50.6	Low	63	Low	53 Å²	53	85.4 Å²	85.4	23%	0.23	44%	0.439	C	S	.	.			trans	-64.6	159.8	175.8	-74.8	-174.3	157.7	-174.8	0	111.2	N101 G102 E103 Q105 E283	K99-N101 PolarHBondContact O-N 3.02Å; K99-G102 PolarHBondContact O-N 3.49Å; K99-E103 WeakPolarHBondContact CB-O 3.36Å; K99-E103 PolarHBondContact N-O 3.28Å; K99-Q105 HydrophobicContact CD-CG 4.09Å; K99-E283 WeakPolarHBondContact CE-OE1 3.24Å; K99-E283 IonicContact NZ-OE1 3.86Å; K99-E283 PolarHBondContact NZ-OE1 2.92Å
100	K	48.2	Very low	62.5	Low	171 Å²	171	91.1 Å²	91.1	74%	0.743	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.6	170.1	-69.7	-177.6	-178.2	171.2	0	112.8	G102	K100-G102 PolarHBondContact O-N 2.85Å
101	N	51.1	Low	62.5	Low	142 Å²	142	95 Å²	95	76%	0.759	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	2.6	-179.8	-60.6	5.7	0	0	0	113.1	K99 E103	K99-N101 PolarHBondContact O-N 3.02Å; N101-E103 VanDerWaalsContact C-N 3.29Å; N101-E103 PolarHBondContact O-N 3.49Å
102	G	51.2	Low	62.6	Low	40 Å²	40	95.5 Å²	95.5	41%	0.412	48%	0.478	S	S	.	.	S	Bend	trans	88.7	-19.3	179.5	0	0	0	0	0	114.8	K99 K100	K99-G102 PolarHBondContact O-N 3.49Å; K100-G102 PolarHBondContact O-N 2.85Å
103	E	55.9	Low	63.1	Low	117 Å²	117	94.2 Å²	94.2	55%	0.547	47%	0.473	S	S	.	.			trans	-65.2	135.4	175.2	-66.1	178.3	174.6	0	0	112.1	K99 N101	K99-E103 WeakPolarHBondContact CB-O 3.36Å; K99-E103 PolarHBondContact N-O 3.28Å; N101-E103 VanDerWaalsContact C-N 3.29Å; N101-E103 PolarHBondContact O-N 3.49Å
104	T	56.5	Low	63.4	Low	105 Å²	105	93.8 Å²	93.8	64%	0.644	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	118.8	172.7	51	0	0	0	0	109.3	R98	R98-T104 HydrophobicContact CG-CG2 4.39Å
105	Q	56.9	Low	63.9	Low	61 Å²	61	87.2 Å²	87.2	29%	0.285	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.1	171.5	-68.1	-162.9	-10.1	0	0	110	L97 K99	L97-Q105 PolarHBondContact N-O 3.1Å; L97-Q105 PolarHBondContact O-N 3.41Å; K99-Q105 HydrophobicContact CD-CG 4.09Å
106	T	60.2	Low	64.9	Low	91 Å²	91	85.7 Å²	85.7	56%	0.558	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	109.7	171.6	47.7	0	0	0	0	108.6	T96	T96-T106 HydrophobicContact CG2-CG2 3.55Å
107	I	61.7	Low	65.9	Low	24 Å²	24	81.2 Å²	81.2	12%	0.123	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	132.5	172.8	-53.9	-169.9	0	0	0	108.1	V95 L97 V109	V95-I107 PolarHBondContact N-O 3.07Å; V95-I107 PolarHBondContact O-N 3.36Å; L97-I107 HydrophobicContact CD1-CD1 3.73Å; L97-I107 HydrophobicContact CD1-CG1 4.26Å; I107-V109 HydrophobicContact CG2-CG2 4.24Å
108	S	63.9	Low	67	Low	64 Å²	64	80.8 Å²	80.8	45%	0.448	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	121	171.6	64.7	0	0	0	0	109.6	E92	E92-S108 WeakPolarHBondContact OE2-CB 3.24Å; E92-S108 PolarHBondContact OE2-OG 3.41Å
109	V	64.1	Low	68.2	Low	54 Å²	54	71.6 Å²	71.6	33%	0.327	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	135	-178.2	-178.5	0	0	0	0	109.3	E92 K93 V95 I107 I111	E92-V109 CarbonylContact C-O 3.56Å; E92-V109 WeakPolarHBondContact CA-O 3.29Å; K93-V109 PolarHBondContact N-O 3.06Å; K93-V109 PolarHBondContact O-N 2.77Å; V95-V109 HydrophobicContact CG2-CG2 4.47Å; I107-V109 HydrophobicContact CG2-CG2 4.24Å; V109-I111 PolarHBondContact O-N 3.21Å
110	R	71.8	Confident	70	Confident	129 Å²	129	70 Å²	70	49%	0.487	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	131.3	175	-68	-177.1	-178	173.2	1.6	110.9	E92 W112	E92-R110 HydrophobicContact CG-CG 4.16Å; R110-W112 VanDerWaalsContact C-N 3.27Å; R110-W112 PolarHBondContact O-N 3.25Å
111	I	78	Confident	71.8	Confident	95 Å²	95	62.8 Å²	62.8	49%	0.487	34%	0.336	S	S	.	.	S	Bend	trans	-65.9	-35.9	178.1	-63.4	174.6	0	0	0	110.5	Q91 K93 V109	Q91-I111 HydrophobicContact CB-CD1 3.83Å; Q91-I111 HydrophobicContact CB-CG1 4.49Å; Q91-I111 WeakPolarHBondContact O-CG1 3.47Å; Q91-I111 PolarHBondContact O-N 3.47Å; K93-I111 HydrophobicContact CB-CD1 4.39Å; K93-I111 HydrophobicContact CB-CG1 3.9Å; V109-I111 PolarHBondContact O-N 3.21Å
112	W	80.4	Confident	73.4	Confident	76 Å²	76	56.2 Å²	56.2	29%	0.288	30%	0.301	S	S	.	.	S	Bend	trans	-97.3	128.5	-179.3	-66.1	85.7	0	0	0	111.4	I88 R110 V116 L121	I88-W112 PolarHBondContact O-NE1 2.85Å; R110-W112 VanDerWaalsContact C-N 3.27Å; R110-W112 PolarHBondContact O-N 3.25Å; W112-V116 HydrophobicContact CE3-CG1 4.25Å; W112-V116 HydrophobicContact CZ3-CG1 4.38Å; W112-L121 HydrophobicContact CH2-CD1 4.01Å; W112-L121 HydrophobicContact CZ2-CD1 4.02Å; W112-L121 HydrophobicContact CZ3-CD1 4.49Å
113	N	82.6	Confident	75	Confident	47 Å²	47	54.3 Å²	54.3	25%	0.251	28%	0.281	S	S	.	.			trans	-65.4	136.4	165.7	172.4	-79.5	0	0	0	109.7	T115 V116 S117 Y232 D235	N113-T115 VanDerWaalsContact C-N 3.35Å; N113-T115 PolarHBondContact O-N 3.18Å; N113-T115 WeakPolarHBondContact OD1-CA 3.36Å; N113-T115 VanDerWaalsContact OD1-CB 3.3Å; N113-T115 WeakPolarHBondContact OD1-CB 3.39Å; N113-T115 PolarHBondContact OD1-N 3.23Å; N113-V116 HydrophobicContact CB-CB 4.19Å; N113-V116 HydrophobicContact CB-CG2 4.02Å; N113-V116 WeakPolarHBondContact O-CB 3.29Å; N113-V116 PolarHBondContact O-N 3.4Å; N113-V116 VanDerWaalsContact O-N 3.07Å; N113-V116 PolarHBondContact OD1-N 3.38Å; N113-S117 PolarHBondContact O-N 3.42Å; N113-S117 PolarHBondContact O-OG 3.24Å; N113-Y232 HydrophobicContact CB-CD2 4.06Å; N113-Y232 HydrophobicContact CB-CE2 3.98Å; N113-D235 PolarHBondContact ND2-OD2 3.05Å
114	E	79.3	Confident	76.6	Confident	126 Å²	126	50.2 Å²	50.2	59%	0.589	26%	0.263	S	S	*	.	H	α-helix	trans	-59.2	-40.5	-175.6	-172.1	-178.7	173.8	0	0	113.4	V116 S117 N118	E114-V116 VanDerWaalsContact C-N 3.34Å; E114-S117 WeakPolarHBondContact CA-OG 3.29Å; E114-S117 PolarHBondContact O-OG 3.32Å; E114-N118 VanDerWaalsContact O-CB 3.23Å; E114-N118 WeakPolarHBondContact O-CB 3.36Å; E114-N118 PolarHBondContact O-N 3.09Å; E114-N118 PolarHBondContact O-ND2 2.92Å; E114-N118 VanDerWaalsContact O-ND2 3.12Å
115	T	81.8	Confident	78.1	Confident	17 Å²	17	45.3 Å²	45.3	10%	0.104	23%	0.233	C	C	.	.	H	α-helix	trans	-66	-39.9	176.1	-62.5	0	0	0	0	111.1	N113 L119 V185 A231 D235	N113-T115 VanDerWaalsContact C-N 3.35Å; N113-T115 PolarHBondContact O-N 3.18Å; N113-T115 WeakPolarHBondContact OD1-CA 3.36Å; N113-T115 VanDerWaalsContact OD1-CB 3.3Å; N113-T115 WeakPolarHBondContact OD1-CB 3.39Å; N113-T115 PolarHBondContact OD1-N 3.23Å; T115-L119 HydrophobicContact CG2-CD1 4.1Å; T115-L119 PolarHBondContact O-N 3.07Å; T115-L119 VanDerWaalsContact O-N 3.16Å; T115-V185 HydrophobicContact CG2-CG1 3.84Å; T115-A231 HydrophobicContact CG2-CB 3.87Å; T115-D235 HydrophobicContact CG2-CB 4.21Å; T115-D235 WeakPolarHBondContact OG1-CB 3.27Å; T115-D235 PolarHBondContact OG1-OD2 3.13Å
116	V	87.7	Confident	79.4	Confident	25 Å²	25	42.6 Å²	42.6	15%	0.152	22%	0.22	C	C	.	.	H	α-helix	trans	-67.8	-47	178.6	175.4	0	0	0	0	110.8	W112 N113 E114 N118 L119 T120 V228 Y232	W112-V116 HydrophobicContact CE3-CG1 4.25Å; W112-V116 HydrophobicContact CZ3-CG1 4.38Å; N113-V116 HydrophobicContact CB-CB 4.19Å; N113-V116 HydrophobicContact CB-CG2 4.02Å; N113-V116 WeakPolarHBondContact O-CB 3.29Å; N113-V116 PolarHBondContact O-N 3.4Å; N113-V116 VanDerWaalsContact O-N 3.07Å; N113-V116 PolarHBondContact OD1-N 3.38Å; E114-V116 VanDerWaalsContact C-N 3.34Å; V116-N118 VanDerWaalsContact C-N 3.31Å; V116-N118 PolarHBondContact O-N 3.35Å; V116-L119 PolarHBondContact O-N 3.23Å; V116-T120 HydrophobicContact CG1-CG2 4.13Å; V116-T120 WeakPolarHBondContact O-CB 3.4Å; V116-T120 WeakPolarHBondContact O-CG2 3.5Å; V116-T120 PolarHBondContact O-N 2.92Å; V116-T120 PolarHBondContact O-OG1 3.46Å; V116-V228 HydrophobicContact CB-CG1 4.5Å; V116-V228 HydrophobicContact CG1-CG1 3.85Å; V116-V228 HydrophobicContact CG2-CG1 4.29Å; V116-Y232 HydrophobicContact CG2-CD2 3.69Å; V116-Y232 HydrophobicContact CG2-CG 4.09Å
117	S	84.5	Confident	80.9	Confident	10 Å²	10	38.2 Å²	38.2	7%	0.07	19%	0.194	C	C	.	.	H	α-helix	trans	-60.8	-42.3	177.9	62.7	0	0	0	0	111.3	N113 E114 L119 T120 L121 M122	N113-S117 PolarHBondContact O-N 3.42Å; N113-S117 PolarHBondContact O-OG 3.24Å; E114-S117 WeakPolarHBondContact CA-OG 3.29Å; E114-S117 PolarHBondContact O-OG 3.32Å; S117-L119 PolarHBondContact O-N 3.33Å; S117-T120 PolarHBondContact O-N 3.33Å; S117-L121 PolarHBondContact O-N 2.84Å; S117-M122 VanDerWaalsContact O-CB 3.3Å; S117-M122 WeakPolarHBondContact O-CB 3.37Å; S117-M122 VanDerWaalsContact O-CG 3.31Å; S117-M122 WeakPolarHBondContact O-CG 3.43Å; S117-M122 PolarHBondContact O-N 2.82Å
118	N	82	Confident	82.4	Confident	44 Å²	44	37.2 Å²	37.2	24%	0.235	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-36.6	178.9	-79.3	-27.6	0	0	0	113.8	E114 V116 A123 R328	E114-N118 VanDerWaalsContact O-CB 3.23Å; E114-N118 WeakPolarHBondContact O-CB 3.36Å; E114-N118 PolarHBondContact O-N 3.09Å; E114-N118 PolarHBondContact O-ND2 2.92Å; E114-N118 VanDerWaalsContact O-ND2 3.12Å; V116-N118 VanDerWaalsContact C-N 3.31Å; V116-N118 PolarHBondContact O-N 3.35Å; N118-A123 PolarHBondContact O-N 3.35Å; N118-R328 PolarHBondContact O-NH1 2.87Å; N118-R328 VanDerWaalsContact O-NH1 3.16Å
119	L	84.3	Confident	83.8	Confident	12 Å²	12	34.3 Å²	34.3	6%	0.063	17%	0.169	C	C	.	.	H	α-helix	trans	-91	-18	-179.8	-70.9	173.6	0	0	0	114.5	T115 V116 S117 A123 T189 A231 V819	T115-L119 HydrophobicContact CG2-CD1 4.1Å; T115-L119 PolarHBondContact O-N 3.07Å; T115-L119 VanDerWaalsContact O-N 3.16Å; V116-L119 PolarHBondContact O-N 3.23Å; S117-L119 PolarHBondContact O-N 3.33Å; L119-A123 WeakPolarHBondContact O-CB 3.35Å; L119-T189 HydrophobicContact CD1-CG2 3.81Å; L119-T189 HydrophobicContact CD2-CG2 3.73Å; L119-T189 HydrophobicContact CG-CG2 4.36Å; L119-A231 HydrophobicContact CD1-CB 3.18Å; L119-V819 WeakPolarHBondContact O-CG2 3.11Å
120	T	88	Confident	85.2	Confident	20 Å²	20	31.8 Å²	31.8	12%	0.123	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-95	-180	56.3	0	0	0	0	111.3	V116 S117 M122 A123 L124 F224 V228	V116-T120 HydrophobicContact CG1-CG2 4.13Å; V116-T120 WeakPolarHBondContact O-CB 3.4Å; V116-T120 WeakPolarHBondContact O-CG2 3.5Å; V116-T120 PolarHBondContact O-N 2.92Å; V116-T120 PolarHBondContact O-OG1 3.46Å; S117-T120 PolarHBondContact O-N 3.33Å; T120-M122 PolarHBondContact O-N 2.83Å; T120-A123 PolarHBondContact O-N 3.39Å; T120-L124 VanDerWaalsContact O-CB 3.31Å; T120-L124 WeakPolarHBondContact O-CB 3.44Å; T120-L124 PolarHBondContact O-N 3.37Å; T120-F224 HydrophobicContact CG2-CZ 4.13Å; T120-V228 HydrophobicContact CG2-CB 4.25Å; T120-V228 HydrophobicContact CG2-CG1 3.7Å; T120-V228 HydrophobicContact CG2-CG2 3.47Å; T120-V228 VanDerWaalsContact CG2-CG2 3.47Å
121	L	85.7	Confident	86.3	Confident	20 Å²	20	26 Å²	26	11%	0.105	13%	0.132	C	C	.	.	H	α-helix	trans	-66	-36.7	-172.8	-68	175.3	0	0	0	112.1	I85 I88 T89 W112 S117 L124 G125 F747	I85-L121 VanDerWaalsContact CD1-O 3.32Å; I85-L121 WeakPolarHBondContact CD1-O 3.38Å; I85-L121 HydrophobicContact CG2-CB 3.72Å; I88-L121 HydrophobicContact CG2-CD1 3.82Å; T89-L121 HydrophobicContact CG2-CB 4.18Å; T89-L121 HydrophobicContact CG2-CD1 3.88Å; W112-L121 HydrophobicContact CH2-CD1 4.01Å; W112-L121 HydrophobicContact CZ2-CD1 4.02Å; W112-L121 HydrophobicContact CZ3-CD1 4.49Å; S117-L121 PolarHBondContact O-N 2.84Å; L121-L124 HydrophobicContact CD2-CD2 4.43Å; L121-G125 PolarHBondContact O-N 3.48Å; L121-F747 HydrophobicContact CD2-CE2 4.1Å; L121-F747 HydrophobicContact CD2-CZ 4.1Å
122	M	84.4	Confident	87.1	Confident	3 Å²	3	23 Å²	23	2%	0.015	12%	0.117	C	C	.	.	H	α-helix	trans	-72.1	-38	179.6	-67.3	-68.8	-172.6	0	0	113.1	M82 I85 E86 T89 S117 T120 G125 S126 A329	M82-M122 HydrophobicContact CE-SD 4.02Å; I85-M122 HydrophobicContact CG2-CE 4.02Å; I85-M122 HydrophobicContact CG2-CG 4.13Å; I85-M122 HydrophobicContact CG2-SD 3.53Å; I85-M122 VanDerWaalsContact CG2-SD 3.53Å; E86-M122 WeakPolarHBondContact OE2-CE 3.39Å; T89-M122 WeakPolarHBondContact OG1-CE 3.3Å; S117-M122 VanDerWaalsContact O-CB 3.3Å; S117-M122 WeakPolarHBondContact O-CB 3.37Å; S117-M122 VanDerWaalsContact O-CG 3.31Å; S117-M122 WeakPolarHBondContact O-CG 3.43Å; S117-M122 PolarHBondContact O-N 2.82Å; T120-M122 PolarHBondContact O-N 2.83Å; M122-G125 PolarHBondContact O-N 3.14Å; M122-S126 PolarHBondContact O-N 3.5Å; M122-S126 VanDerWaalsContact O-N 3.08Å; M122-A329 HydrophobicContact CE-CB 3.82Å; M122-A329 HydrophobicContact SD-CB 3.86Å
123	A	85.9	Confident	87.7	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-69.1	-42.3	175	0	0	0	0	0	111.1	N118 L119 T120 G125 S126 S127 V819	N118-A123 PolarHBondContact O-N 3.35Å; L119-A123 WeakPolarHBondContact O-CB 3.35Å; T120-A123 PolarHBondContact O-N 3.39Å; A123-G125 VanDerWaalsContact C-N 3.27Å; A123-G125 PolarHBondContact O-N 2.88Å; A123-S126 VanDerWaalsContact O-CB 3.3Å; A123-S126 WeakPolarHBondContact O-CB 3.42Å; A123-S126 PolarHBondContact O-N 3.38Å; A123-S127 PolarHBondContact O-N 3.33Å; A123-S127 VanDerWaalsContact O-N 3.1Å; A123-V819 HydrophobicContact CB-CB 4.31Å; A123-V819 HydrophobicContact CB-CG2 3.76Å
124	L	89.6	Confident	88.2	Confident	32 Å²	32	17.7 Å²	17.7	17%	0.168	9%	0.094	C	C	.	.	H	α-helix	trans	-56.6	-43.9	169	174.4	65.4	0	0	0	111.2	T120 L121 S126 S127 A128 I131 F747 L823	T120-L124 VanDerWaalsContact O-CB 3.31Å; T120-L124 WeakPolarHBondContact O-CB 3.44Å; T120-L124 PolarHBondContact O-N 3.37Å; L121-L124 HydrophobicContact CD2-CD2 4.43Å; L124-S126 VanDerWaalsContact C-N 3.32Å; L124-S126 PolarHBondContact O-N 2.94Å; L124-S127 CarbonylContact O-C 3.43Å; L124-S127 PolarHBondContact O-N 3.46Å; L124-A128 WeakPolarHBondContact O-CA 3.47Å; L124-A128 WeakPolarHBondContact O-CB 3.21Å; L124-A128 PolarHBondContact O-N 2.9Å; L124-I131 HydrophobicContact CD1-CD1 3.79Å; L124-F747 HydrophobicContact CD2-CZ 4.16Å; L124-L823 HydrophobicContact CD1-CD2 3.77Å
125	G	87.6	Confident	88.9	Confident	1 Å²	1	12.6 Å²	12.6	1%	0.01	7%	0.072	C	C	.	.	H	α-helix	trans	-47.5	-54.8	172.9	0	0	0	0	0	112.4	F81 M82 L121 M122 A123 R332	F81-G125 VanDerWaalsContact CE1-CA 3.48Å; M82-G125 VanDerWaalsContact SD-CA 3.54Å; L121-G125 PolarHBondContact O-N 3.48Å; M122-G125 PolarHBondContact O-N 3.14Å; A123-G125 VanDerWaalsContact C-N 3.27Å; A123-G125 PolarHBondContact O-N 2.88Å; G125-R332 PolarHBondContact O-NH1 2.79Å
126	S	85.1	Confident	89.4	Confident	4 Å²	4	13.5 Å²	13.5	3%	0.028	8%	0.076	C	C	.	.	H	α-helix	trans	-53.9	-52.6	176.7	-124.2	0	0	0	0	112.4	M122 A123 L124 R328 R332 D792	M122-S126 PolarHBondContact O-N 3.5Å; M122-S126 VanDerWaalsContact O-N 3.08Å; A123-S126 VanDerWaalsContact O-CB 3.3Å; A123-S126 WeakPolarHBondContact O-CB 3.42Å; A123-S126 PolarHBondContact O-N 3.38Å; L124-S126 VanDerWaalsContact C-N 3.32Å; L124-S126 PolarHBondContact O-N 2.94Å; S126-R328 PolarHBondContact OG-NH2 3.47Å; S126-R332 VanDerWaalsContact CA-CZ 3.46Å; S126-R332 VanDerWaalsContact CA-NH1 3.34Å; S126-R332 PolarHBondContact O-NH2 2.74Å; S126-D792 WeakPolarHBondContact CB-OD2 3.4Å; S126-D792 PolarHBondContact OG-OD1 3.22Å; S126-D792 VanDerWaalsContact OG-OD1 3.06Å; S126-D792 PolarHBondContact OG-OD2 3.4Å
127	S	90.9	Very high	89.6	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-109	17.3	-162.6	-51.6	0	0	0	0	114.9	A123 L124 P129 E130 I131 N820	A123-S127 PolarHBondContact O-N 3.33Å; A123-S127 VanDerWaalsContact O-N 3.1Å; L124-S127 CarbonylContact O-C 3.43Å; L124-S127 PolarHBondContact O-N 3.46Å; S127-P129 VanDerWaalsContact C-CD 3.43Å; S127-P129 VanDerWaalsContact C-N 3.3Å; S127-E130 VanDerWaalsContact C-OE2 3.23Å; S127-E130 WeakPolarHBondContact CA-OE2 3.43Å; S127-E130 PolarHBondContact O-N 3.33Å; S127-I131 WeakPolarHBondContact O-CB 3.47Å; S127-I131 VanDerWaalsContact O-CG1 3.28Å; S127-I131 WeakPolarHBondContact O-CG1 3.38Å; S127-I131 PolarHBondContact O-N 3.4Å; S127-N820 WeakPolarHBondContact CB-OD1 3.29Å; S127-N820 PolarHBondContact OG-OD1 2.93Å
128	A	93	Very high	90	Very high	3 Å²	3	12.6 Å²	12.6	3%	0.025	7%	0.069	C	C	.	.	H	α-helix	trans	-53.9	-41.8	176.1	0	0	0	0	0	112.6	F81 L124 E130 I131 L132 I754	F81-A128 HydrophobicContact CD1-CB 4.28Å; F81-A128 HydrophobicContact CE1-CB 3.67Å; F81-A128 HydrophobicContact CZ-CB 4.48Å; L124-A128 WeakPolarHBondContact O-CA 3.47Å; L124-A128 WeakPolarHBondContact O-CB 3.21Å; L124-A128 PolarHBondContact O-N 2.9Å; A128-E130 PolarHBondContact O-N 2.87Å; A128-I131 PolarHBondContact O-N 2.87Å; A128-L132 HydrophobicContact CB-CD1 4.34Å; A128-L132 WeakPolarHBondContact O-CB 3.38Å; A128-L132 WeakPolarHBondContact O-CD1 3.31Å; A128-L132 WeakPolarHBondContact O-CG 3.13Å; A128-L132 PolarHBondContact O-N 2.91Å; A128-I754 HydrophobicContact CB-CD1 4.49Å; A128-I754 HydrophobicContact CB-CG2 4.49Å
129	P	92.9	Very high	90.4	Very high	3 Å²	3	14.8 Å²	14.8	2%	0.019	8%	0.079	C	C	.	.	H	α-helix	trans	-57.5	-44.8	177.9	-26.8	36.8	0	0	0	113.7	V74 S127 L133 I754 T758 T788	V74-P129 HydrophobicContact CG1-CB 4.16Å; V74-P129 HydrophobicContact CG1-CG 3.6Å; S127-P129 VanDerWaalsContact C-CD 3.43Å; S127-P129 VanDerWaalsContact C-N 3.3Å; P129-L133 VanDerWaalsContact O-CB 3.23Å; P129-L133 WeakPolarHBondContact O-CB 3.14Å; P129-L133 PolarHBondContact O-N 2.86Å; P129-I754 HydrophobicContact CG-CG2 4.35Å; P129-T758 HydrophobicContact CB-CG2 3.86Å; P129-T788 HydrophobicContact CB-CG2 3.8Å
130	E	93.6	Very high	90.6	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-71.4	-42.8	-178.4	-62.9	85.1	170.8	0	0	112.5	S127 A128 S134 T152 I153 S156 T788	S127-E130 VanDerWaalsContact C-OE2 3.23Å; S127-E130 WeakPolarHBondContact CA-OE2 3.43Å; S127-E130 PolarHBondContact O-N 3.33Å; A128-E130 PolarHBondContact O-N 2.87Å; E130-S134 PolarHBondContact O-N 2.65Å; E130-S134 VanDerWaalsContact O-N 3.13Å; E130-S134 PolarHBondContact O-OG 3.03Å; E130-T152 HydrophobicContact CB-CG2 4.49Å; E130-T152 HydrophobicContact CG-CG2 3.89Å; E130-I153 HydrophobicContact CB-CG1 4.18Å; E130-S156 PolarHBondContact OE1-OG 2.92Å; E130-T788 WeakPolarHBondContact OE1-CB 3.15Å; E130-T788 PolarHBondContact OE1-OG1 3.29Å
131	I	94.1	Very high	90.6	Very high	8 Å²	8	18.1 Å²	18.1	4%	0.041	10%	0.101	C	C	.	.	H	α-helix	trans	-62.6	-48.8	177.1	-70	167.2	0	0	0	109.6	L124 S127 A128 S134 V135 V819 L823	L124-I131 HydrophobicContact CD1-CD1 3.79Å; S127-I131 WeakPolarHBondContact O-CB 3.47Å; S127-I131 VanDerWaalsContact O-CG1 3.28Å; S127-I131 WeakPolarHBondContact O-CG1 3.38Å; S127-I131 PolarHBondContact O-N 3.4Å; A128-I131 PolarHBondContact O-N 2.87Å; I131-S134 PolarHBondContact O-N 3.44Å; I131-V135 WeakPolarHBondContact O-CG2 3.22Å; I131-V135 PolarHBondContact O-N 3.4Å; I131-V135 VanDerWaalsContact O-N 3.11Å; I131-V819 HydrophobicContact CD1-CG1 4.11Å; I131-L823 HydrophobicContact CD1-CD2 4.18Å; I131-L823 HydrophobicContact CD1-CG 4.4Å
132	L	95	Very high	90.7	Very high	33 Å²	33	22.9 Å²	22.9	17%	0.173	13%	0.127	C	C	.	.	H	α-helix	trans	-67.7	-39.2	-179.3	-70.8	167	0	0	0	111.6	A128 S134 V135 I136 I751 I754	A128-L132 HydrophobicContact CB-CD1 4.34Å; A128-L132 WeakPolarHBondContact O-CB 3.38Å; A128-L132 WeakPolarHBondContact O-CD1 3.31Å; A128-L132 WeakPolarHBondContact O-CG 3.13Å; A128-L132 PolarHBondContact O-N 2.91Å; L132-S134 VanDerWaalsContact C-N 3.29Å; L132-S134 PolarHBondContact O-N 3.32Å; L132-V135 PolarHBondContact O-N 2.86Å; L132-I136 HydrophobicContact CB-CD1 4.31Å; L132-I136 VanDerWaalsContact O-CB 3.28Å; L132-I136 WeakPolarHBondContact O-CB 3.45Å; L132-I136 WeakPolarHBondContact O-CD1 3.29Å; L132-I136 WeakPolarHBondContact O-CG1 3.29Å; L132-I136 PolarHBondContact O-N 3.31Å; L132-I751 HydrophobicContact CD1-CG2 4.41Å; L132-I751 HydrophobicContact CD2-CG2 4.3Å; L132-I754 HydrophobicContact CD1-CB 3.97Å; L132-I754 HydrophobicContact CD1-CG2 3.55Å
133	L	94.2	Very high	91	Very high	8 Å²	8	24.9 Å²	24.9	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-57.8	-44.2	175.3	-176.7	65.6	0	0	0	111.4	P129 I136 E137 L148 T152 V784	P129-L133 VanDerWaalsContact O-CB 3.23Å; P129-L133 WeakPolarHBondContact O-CB 3.14Å; P129-L133 PolarHBondContact O-N 2.86Å; L133-I136 PolarHBondContact O-N 3.49Å; L133-E137 VanDerWaalsContact O-CB 3.27Å; L133-E137 WeakPolarHBondContact O-CB 3.42Å; L133-E137 PolarHBondContact O-N 3.49Å; L133-L148 HydrophobicContact CD1-CD2 4.18Å; L133-L148 HydrophobicContact CD2-CD2 4.42Å; L133-L148 HydrophobicContact CD2-CG 4.47Å; L133-T152 HydrophobicContact CD2-CG2 4.06Å; L133-T152 WeakPolarHBondContact CD2-OG1 3.37Å; L133-V784 HydrophobicContact CD2-CG1 3.91Å
134	S	92.1	Very high	91.2	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.014	16%	0.164	C	C	.	.	H	α-helix	trans	-67.1	-39.5	-179.9	-56.9	0	0	0	0	112.7	E130 I131 L132 I138 G149 I153	E130-S134 PolarHBondContact O-N 2.65Å; E130-S134 VanDerWaalsContact O-N 3.13Å; E130-S134 PolarHBondContact O-OG 3.03Å; I131-S134 PolarHBondContact O-N 3.44Å; L132-S134 VanDerWaalsContact C-N 3.29Å; L132-S134 PolarHBondContact O-N 3.32Å; S134-I138 WeakPolarHBondContact O-CD1 3.39Å; S134-I138 WeakPolarHBondContact O-CG1 3.48Å; S134-I138 PolarHBondContact O-N 3.28Å; S134-G149 WeakPolarHBondContact OG-CA 3.44Å; S134-G149 PolarHBondContact OG-O 3.08Å; S134-I153 WeakPolarHBondContact OG-CD1 3.19Å
135	V	94	Very high	91	Very high	20 Å²	20	31 Å²	31	12%	0.121	17%	0.17	C	C	.	.	H	α-helix	trans	-69.7	-44.2	177	173	0	0	0	0	111.3	I131 L132 I138 I139 L827	I131-V135 WeakPolarHBondContact O-CG2 3.22Å; I131-V135 PolarHBondContact O-N 3.4Å; I131-V135 VanDerWaalsContact O-N 3.11Å; L132-V135 PolarHBondContact O-N 2.86Å; V135-I138 PolarHBondContact O-N 3.45Å; V135-I139 HydrophobicContact CG1-CD1 3.85Å; V135-I139 WeakPolarHBondContact O-CG1 3.44Å; V135-I139 PolarHBondContact O-N 2.88Å; V135-I139 VanDerWaalsContact O-N 3.14Å; V135-L827 HydrophobicContact CG2-CD2 4.13Å; V135-L827 HydrophobicContact CG2-CG 4.31Å
136	I	92.9	Very high	91	Very high	36 Å²	36	31.3 Å²	31.3	19%	0.185	17%	0.173	C	C	.	.	H	α-helix	trans	-69	-38.9	-178.5	-68.3	167	0	0	0	111.1	I40 L132 L133 I138 I139 G140 G755 A759	I40-I136 HydrophobicContact CD1-CG2 4.03Å; L132-I136 HydrophobicContact CB-CD1 4.31Å; L132-I136 VanDerWaalsContact O-CB 3.28Å; L132-I136 WeakPolarHBondContact O-CB 3.45Å; L132-I136 WeakPolarHBondContact O-CD1 3.29Å; L132-I136 WeakPolarHBondContact O-CG1 3.29Å; L132-I136 PolarHBondContact O-N 3.31Å; L133-I136 PolarHBondContact O-N 3.49Å; I136-I138 VanDerWaalsContact C-N 3.31Å; I136-I138 PolarHBondContact O-N 3.46Å; I136-I139 PolarHBondContact O-N 3.31Å; I136-G140 PolarHBondContact O-N 3.05Å; I136-G755 WeakPolarHBondContact CD1-O 3.24Å; I136-A759 HydrophobicContact CD1-CB 4.33Å; I136-A759 HydrophobicContact CG2-CB 3.9Å
137	E	91.7	Very high	91.1	Very high	10 Å²	10	33.1 Å²	33.1	5%	0.047	18%	0.182	C	C	.	.	H	α-helix	trans	-58.1	-45.6	176.9	-178.7	178.5	-144	0	0	111.2	L133 G140 K141 G146 D147 L148 G149	L133-E137 VanDerWaalsContact O-CB 3.27Å; L133-E137 WeakPolarHBondContact O-CB 3.42Å; L133-E137 PolarHBondContact O-N 3.49Å; E137-G140 PolarHBondContact O-N 3.24Å; E137-K141 HydrophobicContact CG-CD 3.91Å; E137-K141 WeakPolarHBondContact O-CB 3.4Å; E137-K141 WeakPolarHBondContact O-CG 3.47Å; E137-K141 PolarHBondContact O-N 3.42Å; E137-K141 IonicContact OE1-NZ 3.84Å; E137-K141 PolarHBondContact OE1-NZ 2.84Å; E137-G146 VanDerWaalsContact CD-CA 3.45Å; E137-G146 VanDerWaalsContact OE1-CA 3.29Å; E137-G146 WeakPolarHBondContact OE1-CA 3.3Å; E137-D147 PolarHBondContact OE1-N 3.26Å; E137-L148 WeakPolarHBondContact OE1-CB 3.4Å; E137-L148 PolarHBondContact OE1-N 3.12Å; E137-L148 VanDerWaalsContact OE1-N 3.09Å; E137-L148 PolarHBondContact OE2-N 3.44Å; E137-G149 WeakPolarHBondContact OE2-CA 3.27Å; E137-G149 PolarHBondContact OE2-N 3.42Å
138	I	92.3	Very high	91	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-62.1	-47.6	177.8	-71.1	170.7	0	0	0	110.6	S134 V135 I136 G140 K141 F143 G828 A832	S134-I138 WeakPolarHBondContact O-CD1 3.39Å; S134-I138 WeakPolarHBondContact O-CG1 3.48Å; S134-I138 PolarHBondContact O-N 3.28Å; V135-I138 PolarHBondContact O-N 3.45Å; I136-I138 VanDerWaalsContact C-N 3.31Å; I136-I138 PolarHBondContact O-N 3.46Å; I138-G140 VanDerWaalsContact C-N 3.35Å; I138-G140 PolarHBondContact O-N 2.92Å; I138-K141 PolarHBondContact O-N 3.28Å; I138-F143 HydrophobicContact CG2-CD1 4.23Å; I138-F143 WeakPolarHBondContact O-CA 3.3Å; I138-F143 PolarHBondContact O-N 3.49Å; I138-G828 WeakPolarHBondContact CD1-O 3.25Å; I138-A832 HydrophobicContact CG2-CB 3.71Å
139	I	91.6	Very high	90.9	Very high	89 Å²	89	33.3 Å²	33.3	46%	0.456	18%	0.183	S	C	.	.	H	α-helix	trans	-64.5	-42	179.7	-66.1	168.2	0	0	0	110.8	V135 I136 N142 F143	V135-I139 HydrophobicContact CG1-CD1 3.85Å; V135-I139 WeakPolarHBondContact O-CG1 3.44Å; V135-I139 PolarHBondContact O-N 2.88Å; V135-I139 VanDerWaalsContact O-N 3.14Å; I136-I139 PolarHBondContact O-N 3.31Å; I139-N142 PolarHBondContact O-N 2.88Å; I139-F143 HydrophobicContact CG1-CE1 4.42Å
140	G	87.2	Confident	90.9	Very high	34 Å²	34	33.6 Å²	33.6	35%	0.351	18%	0.184	S	C	.	.	H	α-helix	trans	-69.6	-30.3	-178.5	0	0	0	0	0	113.9	I136 E137 I138 N142	I136-G140 PolarHBondContact O-N 3.05Å; E137-G140 PolarHBondContact O-N 3.24Å; I138-G140 VanDerWaalsContact C-N 3.35Å; I138-G140 PolarHBondContact O-N 2.92Å; G140-N142 VanDerWaalsContact C-N 3.3Å; G140-N142 PolarHBondContact O-N 2.91Å
141	K	87.9	Confident	90.8	Very high	68 Å²	68	33.8 Å²	33.8	30%	0.296	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	29	175.9	-66.8	-179	175.8	171.5	0	112.9	E137 I138 F143 E144	E137-K141 HydrophobicContact CG-CD 3.91Å; E137-K141 WeakPolarHBondContact O-CB 3.4Å; E137-K141 WeakPolarHBondContact O-CG 3.47Å; E137-K141 PolarHBondContact O-N 3.42Å; E137-K141 IonicContact OE1-NZ 3.84Å; E137-K141 PolarHBondContact OE1-NZ 2.84Å; I138-K141 PolarHBondContact O-N 3.28Å; K141-F143 VanDerWaalsContact C-N 3.29Å; K141-F143 PolarHBondContact O-N 3.23Å; K141-E144 HydrophobicContact CB-CB 4.43Å; K141-E144 VanDerWaalsContact O-CB 3.3Å; K141-E144 WeakPolarHBondContact O-CB 3.34Å; K141-E144 WeakPolarHBondContact O-CG 3.5Å; K141-E144 PolarHBondContact O-N 2.94Å
142	N	89	Confident	90.8	Very high	121 Å²	121	33.4 Å²	33.4	65%	0.647	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	38.8	-179.8	-64.7	-54.3	0	0	0	114.4	I139 G140 E144	I139-N142 PolarHBondContact O-N 2.88Å; G140-N142 VanDerWaalsContact C-N 3.3Å; G140-N142 PolarHBondContact O-N 2.91Å; N142-E144 PolarHBondContact O-N 2.98Å
143	F	91	Very high	90.8	Very high	44 Å²	44	31.9 Å²	31.9	19%	0.193	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	10.9	-177.1	-51.8	-89.5	0	0	0	115	I138 I139 K141 I831 A832 Y835 H836 F843	I138-F143 HydrophobicContact CG2-CD1 4.23Å; I138-F143 WeakPolarHBondContact O-CA 3.3Å; I138-F143 PolarHBondContact O-N 3.49Å; I139-F143 HydrophobicContact CG1-CE1 4.42Å; K141-F143 VanDerWaalsContact C-N 3.29Å; K141-F143 PolarHBondContact O-N 3.23Å; F143-I831 HydrophobicContact CD1-CG2 4.01Å; F143-I831 HydrophobicContact CE1-CG2 3.61Å; F143-A832 HydrophobicContact CB-CB 4.4Å; F143-Y835 HydrophobicContact CB-CD1 3.5Å; F143-Y835 VanDerWaalsContact CB-CD1 3.5Å; F143-Y835 HydrophobicContact CB-CE1 3.89Å; F143-Y835 HydrophobicContact CB-CG 4.05Å; F143-Y835 HydrophobicContact CD1-CD1 4.36Å; F143-Y835 HydrophobicContact CD1-CD2 4.46Å; F143-Y835 HydrophobicContact CD1-CG 4.04Å; F143-Y835 AromaticContact CD2-CD1 3.48Å; F143-Y835 HydrophobicContact CD2-CD1 3.48Å; F143-Y835 VanDerWaalsContact CD2-CD1 3.48Å; F143-Y835 AromaticContact CD2-CD2 3.68Å; F143-Y835 HydrophobicContact CD2-CD2 3.68Å; F143-Y835 AromaticContact CD2-CE1 3.35Å; F143-Y835 HydrophobicContact CD2-CE1 3.35Å; F143-Y835 AromaticContact CD2-CE2 3.55Å; F143-Y835 HydrophobicContact CD2-CE2 3.55Å; F143-Y835 AromaticContact CD2-CG 3.61Å; F143-Y835 HydrophobicContact CD2-CG 3.61Å; F143-Y835 AromaticContact CD2-CZ 3.33Å; F143-Y835 HydrophobicContact CE1-CD2 4.42Å; F143-Y835 HydrophobicContact CE1-CG 4.42Å; F143-Y835 HydrophobicContact CE2-CD1 4.31Å; F143-Y835 AromaticContact CE2-CD2 3.64Å; F143-Y835 HydrophobicContact CE2-CD2 3.64Å; F143-Y835 HydrophobicContact CE2-CE1 4.15Å; F143-Y835 AromaticContact CE2-CE2 3.44Å; F143-Y835 HydrophobicContact CE2-CE2 3.44Å; F143-Y835 VanDerWaalsContact CE2-CE2 3.44Å; F143-Y835 HydrophobicContact CE2-CG 4.03Å; F143-Y835 AromaticContact CE2-CZ 3.67Å; F143-Y835 AromaticContact CG-CD1 3.51Å; F143-Y835 HydrophobicContact CG-CD1 3.51Å; F143-Y835 HydrophobicContact CG-CD2 4.11Å; F143-Y835 AromaticContact CG-CE1 3.85Å; F143-Y835 HydrophobicContact CG-CE1 3.85Å; F143-Y835 HydrophobicContact CG-CE2 4.4Å; F143-Y835 AromaticContact CG-CG 3.61Å; F143-Y835 HydrophobicContact CG-CG 3.61Å; F143-Y835 HydrophobicContact CZ-CD2 4.02Å; F143-Y835 HydrophobicContact CZ-CE2 4.21Å; F143-Y835 HydrophobicContact CZ-CG 4.41Å; F143-H836 PolarHBondContact O-NE2 3.09Å; F143-H836 VanDerWaalsContact O-NE2 3.09Å; F143-F843 WeakPolarHBondContact O-CD2 3.48Å; F143-F843 WeakPolarHBondContact O-CE2 3.32Å
144	E	89	Confident	90.8	Very high	126 Å²	126	31.5 Å²	31.5	59%	0.589	17%	0.174	S	C	*	.			trans	-78.6	149	169.1	-60.5	-178.7	176.1	0	0	111.2	K141 N142	K141-E144 HydrophobicContact CB-CB 4.43Å; K141-E144 VanDerWaalsContact O-CB 3.3Å; K141-E144 WeakPolarHBondContact O-CB 3.34Å; K141-E144 WeakPolarHBondContact O-CG 3.5Å; K141-E144 PolarHBondContact O-N 2.94Å; N142-E144 PolarHBondContact O-N 2.98Å
145	A	86.4	Confident	91	Very high	36 Å²	36	31.4 Å²	31.4	30%	0.298	17%	0.174	S	C	.	.			trans	-72.2	130.5	179.4	0	0	0	0	0	110.9	F843 L844 V845	A145-F843 HydrophobicContact CB-CE2 3.84Å; A145-F843 HydrophobicContact CB-CZ 3.9Å; A145-L844 VanDerWaalsContact CB-O 3.31Å; A145-L844 WeakPolarHBondContact CB-O 3.01Å; A145-V845 HydrophobicContact CB-CB 4.4Å; A145-V845 HydrophobicContact CB-CG1 4.49Å; A145-V845 HydrophobicContact CB-CG2 3.83Å
146	G	86.1	Confident	90.9	Very high	7 Å²	7	30.4 Å²	30.4	7%	0.072	17%	0.168	C	C	.	.			trans	-106.4	162.6	171.3	0	0	0	0	0	112.9	E137 P150	E137-G146 VanDerWaalsContact CD-CA 3.45Å; E137-G146 VanDerWaalsContact OE1-CA 3.29Å; E137-G146 WeakPolarHBondContact OE1-CA 3.3Å; G146-P150 VanDerWaalsContact O-CD 3.29Å; G146-P150 WeakPolarHBondContact O-CD 3.33Å; G146-P150 WeakPolarHBondContact O-CG 3.38Å
147	D	87.8	Confident	91	Very high	41 Å²	41	28.7 Å²	28.7	22%	0.219	16%	0.159	C	C	.	.	S	Bend	trans	-90.1	-19.2	-180	-68	-32.8	0	0	0	112.4	R33 E137 G151 D776 A777	R33-D147 IonicContact CZ-OD2 3.67Å; R33-D147 IonicContact NE-OD2 3.97Å; R33-D147 VanDerWaalsContact NH1-CG 3.32Å; R33-D147 IonicContact NH1-OD1 3.15Å; R33-D147 PolarHBondContact NH1-OD1 3.13Å; R33-D147 VanDerWaalsContact NH1-OD1 3.15Å; R33-D147 IonicContact NH1-OD2 2.71Å; R33-D147 PolarHBondContact NH1-OD2 3.14Å; E137-D147 PolarHBondContact OE1-N 3.26Å; D147-G151 WeakPolarHBondContact O-CA 3.37Å; D147-G151 PolarHBondContact O-N 2.84Å; D147-D776 HydrophobicContact CB-CB 4.42Å; D147-A777 HydrophobicContact CB-CB 4.31Å
148	L	88.7	Confident	91.2	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.042	16%	0.157	C	C	.	.	H	α-helix	trans	-74.1	-50.8	-170.2	-166.8	80.1	0	0	0	111.3	L133 E137 G151 T152 D776 A780	L133-L148 HydrophobicContact CD1-CD2 4.18Å; L133-L148 HydrophobicContact CD2-CD2 4.42Å; L133-L148 HydrophobicContact CD2-CG 4.47Å; E137-L148 WeakPolarHBondContact OE1-CB 3.4Å; E137-L148 PolarHBondContact OE1-N 3.12Å; E137-L148 VanDerWaalsContact OE1-N 3.09Å; E137-L148 PolarHBondContact OE2-N 3.44Å; L148-G151 PolarHBondContact O-N 2.92Å; L148-T152 WeakPolarHBondContact O-CB 3.45Å; L148-T152 PolarHBondContact O-N 2.96Å; L148-T152 PolarHBondContact O-OG1 3.49Å; L148-D776 HydrophobicContact CD1-CB 4.27Å; L148-A780 HydrophobicContact CD1-CB 3.91Å; L148-A780 HydrophobicContact CG-CB 4.37Å; L148-A780 VanDerWaalsContact O-CB 3.31Å; L148-A780 WeakPolarHBondContact O-CB 3.14Å
149	G	91.2	Very high	91.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.7	-57.7	-179.5	0	0	0	0	0	112.7	S134 E137 G151 T152 I153	S134-G149 WeakPolarHBondContact OG-CA 3.44Å; S134-G149 PolarHBondContact OG-O 3.08Å; E137-G149 WeakPolarHBondContact OE2-CA 3.27Å; E137-G149 PolarHBondContact OE2-N 3.42Å; G149-G151 VanDerWaalsContact C-N 3.31Å; G149-G151 PolarHBondContact O-N 2.87Å; G149-T152 PolarHBondContact O-N 2.89Å; G149-T152 VanDerWaalsContact O-N 3.15Å; G149-I153 PolarHBondContact O-N 3.48Å
150	P	92.6	Very high	91.4	Very high	9 Å²	9	24.3 Å²	24.3	6%	0.058	14%	0.136	C	C	.	.	H	α-helix	trans	-58.2	-40.8	174.7	-24.1	34.3	0	0	0	113.1	G146 T152 I153 V154 I825 L850	G146-P150 VanDerWaalsContact O-CD 3.29Å; G146-P150 WeakPolarHBondContact O-CD 3.33Å; G146-P150 WeakPolarHBondContact O-CG 3.38Å; P150-T152 VanDerWaalsContact C-N 3.34Å; P150-T152 PolarHBondContact O-N 3.38Å; P150-I153 PolarHBondContact O-N 2.77Å; P150-V154 WeakPolarHBondContact O-CG2 2.93Å; P150-V154 PolarHBondContact O-N 3.35Å; P150-V154 VanDerWaalsContact O-N 3.07Å; P150-I825 HydrophobicContact CB-CD1 3.98Å; P150-I825 HydrophobicContact CG-CD1 3.88Å; P150-L850 HydrophobicContact CB-CD1 3.78Å; P150-L850 HydrophobicContact CB-CD2 3.81Å; P150-L850 HydrophobicContact CB-CG 4.47Å
151	G	92.6	Very high	91.8	Very high	4 Å²	4	22.9 Å²	22.9	4%	0.041	12%	0.12	C	C	.	.	H	α-helix	trans	-60.4	-41.4	175.1	0	0	0	0	0	112.8	D147 L148 G149 G155 I781	D147-G151 WeakPolarHBondContact O-CA 3.37Å; D147-G151 PolarHBondContact O-N 2.84Å; L148-G151 PolarHBondContact O-N 2.92Å; G149-G151 VanDerWaalsContact C-N 3.31Å; G149-G151 PolarHBondContact O-N 2.87Å; G151-G155 PolarHBondContact O-N 3.37Å; G151-I781 VanDerWaalsContact O-CG1 3.31Å; G151-I781 WeakPolarHBondContact O-CG1 3.2Å
152	T	94.5	Very high	92.1	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.6	-42.6	176.1	-64.6	0	0	0	0	110.8	E130 L133 L148 G149 P150 V154 G155 S156 V784	E130-T152 HydrophobicContact CB-CG2 4.49Å; E130-T152 HydrophobicContact CG-CG2 3.89Å; L133-T152 HydrophobicContact CD2-CG2 4.06Å; L133-T152 WeakPolarHBondContact CD2-OG1 3.37Å; L148-T152 WeakPolarHBondContact O-CB 3.45Å; L148-T152 PolarHBondContact O-N 2.96Å; L148-T152 PolarHBondContact O-OG1 3.49Å; G149-T152 PolarHBondContact O-N 2.89Å; G149-T152 VanDerWaalsContact O-N 3.15Å; P150-T152 VanDerWaalsContact C-N 3.34Å; P150-T152 PolarHBondContact O-N 3.38Å; T152-V154 PolarHBondContact O-N 3.48Å; T152-G155 PolarHBondContact O-N 3.27Å; T152-S156 VanDerWaalsContact O-CB 3.28Å; T152-S156 WeakPolarHBondContact O-CB 3.27Å; T152-S156 PolarHBondContact O-N 3.2Å; T152-S156 PolarHBondContact O-OG 3.14Å; T152-S156 VanDerWaalsContact O-OG 3.07Å; T152-V784 HydrophobicContact CG2-CB 4.43Å; T152-V784 HydrophobicContact CG2-CG1 3.87Å; T152-V784 WeakPolarHBondContact OG1-CG1 3.29Å
153	I	94.6	Very high	92.5	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-58.6	-47.7	177.8	-77.5	174.6	0	0	0	111.5	E130 S134 G149 P150 A157 Y197 N820 V821 I825	E130-I153 HydrophobicContact CB-CG1 4.18Å; S134-I153 WeakPolarHBondContact OG-CD1 3.19Å; G149-I153 PolarHBondContact O-N 3.48Å; P150-I153 PolarHBondContact O-N 2.77Å; I153-A157 WeakPolarHBondContact O-CB 3.36Å; I153-A157 PolarHBondContact O-N 3.38Å; I153-Y197 HydrophobicContact CG2-CE1 4.26Å; I153-N820 WeakPolarHBondContact CD1-O 3.36Å; I153-N820 HydrophobicContact CG1-CB 4.33Å; I153-N820 HydrophobicContact CG2-CB 3.82Å; I153-V821 HydrophobicContact CG2-CG2 4.09Å; I153-I825 HydrophobicContact CD1-CD1 3.72Å; I153-I825 HydrophobicContact CD1-CG1 3.68Å; I153-I825 HydrophobicContact CG2-CG1 4.48Å
154	V	94.6	Very high	92.6	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-71.3	-41.3	-179.6	-173.4	0	0	0	0	111.3	P150 T152 A157 A158 Y197 M200 L850 S853 V854 Y901	P150-V154 WeakPolarHBondContact O-CG2 2.93Å; P150-V154 PolarHBondContact O-N 3.35Å; P150-V154 VanDerWaalsContact O-N 3.07Å; T152-V154 PolarHBondContact O-N 3.48Å; V154-A157 WeakPolarHBondContact O-CB 3.36Å; V154-A157 PolarHBondContact O-N 3.4Å; V154-A158 PolarHBondContact O-N 3.27Å; V154-Y197 HydrophobicContact CG2-CD1 4.32Å; V154-Y197 HydrophobicContact CG2-CE1 4.2Å; V154-M200 HydrophobicContact CG2-CE 3.72Å; V154-L850 HydrophobicContact CG2-CD1 4.03Å; V154-S853 WeakPolarHBondContact CG1-OG 3.4Å; V154-V854 HydrophobicContact CG1-CG2 4.17Å; V154-V854 HydrophobicContact CG2-CG2 3.62Å; V154-Y901 WeakPolarHBondContact CG1-OH 3.09Å
155	G	94.4	Very high	92.8	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-58.9	-47.2	174.9	0	0	0	0	0	112.8	G151 T152 A157 A158 F159 A785	G151-G155 PolarHBondContact O-N 3.37Å; T152-G155 PolarHBondContact O-N 3.27Å; G155-A157 VanDerWaalsContact C-N 3.32Å; G155-A157 PolarHBondContact O-N 3.16Å; G155-A158 PolarHBondContact O-N 3.14Å; G155-F159 WeakPolarHBondContact O-CB 3.1Å; G155-F159 PolarHBondContact O-N 3.47Å; G155-A785 VanDerWaalsContact C-CB 3.43Å
156	S	93.8	Very high	93.2	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-64.7	-38.3	177.9	-67.2	0	0	0	0	110.7	E130 T152 A158 F159 N160 A785 T788 S789	E130-S156 PolarHBondContact OE1-OG 2.92Å; T152-S156 VanDerWaalsContact O-CB 3.28Å; T152-S156 WeakPolarHBondContact O-CB 3.27Å; T152-S156 PolarHBondContact O-N 3.2Å; T152-S156 PolarHBondContact O-OG 3.14Å; T152-S156 VanDerWaalsContact O-OG 3.07Å; S156-A158 VanDerWaalsContact C-N 3.35Å; S156-A158 PolarHBondContact O-N 3.46Å; S156-F159 PolarHBondContact O-N 2.9Å; S156-N160 WeakPolarHBondContact O-CB 3.31Å; S156-N160 PolarHBondContact O-N 3.09Å; S156-N160 PolarHBondContact O-ND2 2.79Å; S156-N160 PolarHBondContact O-OD1 3.43Å; S156-A785 VanDerWaalsContact N-CB 3.31Å; S156-A785 WeakPolarHBondContact OG-CA 3.2Å; S156-A785 PolarHBondContact OG-O 2.92Å; S156-T788 PolarHBondContact OG-OG1 2.8Å; S156-S789 WeakPolarHBondContact CB-OG 3.44Å; S156-S789 PolarHBondContact OG-OG 3.49Å
157	A	94.5	Very high	93.7	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-62.7	-40.5	176.3	0	0	0	0	0	113.2	I153 V154 G155 L161 Y197 N817 Y857	I153-A157 WeakPolarHBondContact O-CB 3.36Å; I153-A157 PolarHBondContact O-N 3.38Å; V154-A157 WeakPolarHBondContact O-CB 3.36Å; V154-A157 PolarHBondContact O-N 3.4Å; G155-A157 VanDerWaalsContact C-N 3.32Å; G155-A157 PolarHBondContact O-N 3.16Å; A157-L161 WeakPolarHBondContact O-CB 3.4Å; A157-L161 PolarHBondContact O-N 3.36Å; A157-Y197 HydrophobicContact CB-CE1 3.74Å; A157-Y197 HydrophobicContact CB-CE2 4.06Å; A157-Y197 WeakPolarHBondContact CB-OH 3.44Å; A157-N817 PolarHBondContact O-ND2 3.36Å; A157-Y857 HydrophobicContact CB-CE1 4.36Å; A157-Y857 HydrophobicContact CB-CE2 4.04Å; A157-Y857 WeakPolarHBondContact O-CE2 3.35Å
158	A	95.5	Very high	94	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-65	-47.9	173.9	0	0	0	0	0	111.1	V154 G155 S156 N160 L161 F162 Y857 Y901	V154-A158 PolarHBondContact O-N 3.27Å; G155-A158 PolarHBondContact O-N 3.14Å; S156-A158 VanDerWaalsContact C-N 3.35Å; S156-A158 PolarHBondContact O-N 3.46Å; A158-N160 PolarHBondContact O-N 3.48Å; A158-L161 PolarHBondContact O-N 2.01Å; A158-F162 HydrophobicContact CB-CD2 4.01Å; A158-F162 HydrophobicContact CB-CE2 3.81Å; A158-F162 VanDerWaalsContact O-CB 3.26Å; A158-F162 WeakPolarHBondContact O-CB 3.07Å; A158-F162 WeakPolarHBondContact O-CD2 3.46Å; A158-F162 WeakPolarHBondContact O-CG 3.08Å; A158-F162 PolarHBondContact O-N 3.45Å; A158-Y857 HydrophobicContact CB-CD2 3.84Å; A158-Y857 HydrophobicContact CB-CE2 4.24Å; A158-Y901 HydrophobicContact CB-CD1 3.69Å; A158-Y901 HydrophobicContact CB-CE1 3.43Å; A158-Y901 VanDerWaalsContact CB-CE1 3.43Å; A158-Y901 HydrophobicContact CB-CG 4.37Å
159	F	95.6	Very high	94.2	Very high	11 Å²	11	3.4 Å²	3.4	5%	0.048	2%	0.021	C	C	.	.	I	π-helix	trans	-61.8	-45	178.3	-172.3	-94.6	0	0	0	112	G155 S156 V163 I164 L786 S789 T793 W898	G155-F159 WeakPolarHBondContact O-CB 3.1Å; G155-F159 PolarHBondContact O-N 3.47Å; S156-F159 PolarHBondContact O-N 2.9Å; F159-V163 HydrophobicContact CD2-CB 3.76Å; F159-V163 HydrophobicContact CD2-CG1 4.15Å; F159-V163 HydrophobicContact CD2-CG2 3.69Å; F159-V163 HydrophobicContact CE1-CB 4.46Å; F159-V163 HydrophobicContact CE1-CG1 4.32Å; F159-V163 HydrophobicContact CE2-CB 3.64Å; F159-V163 HydrophobicContact CE2-CG1 3.48Å; F159-V163 VanDerWaalsContact CE2-CG1 3.48Å; F159-V163 HydrophobicContact CE2-CG2 3.78Å; F159-V163 HydrophobicContact CG-CB 4.21Å; F159-V163 HydrophobicContact CG-CG2 4.45Å; F159-V163 HydrophobicContact CZ-CB 4.02Å; F159-V163 HydrophobicContact CZ-CG1 3.59Å; F159-V163 WeakPolarHBondContact O-CA 3.42Å; F159-V163 WeakPolarHBondContact O-CB 3.4Å; F159-V163 PolarHBondContact O-N 3.32Å; F159-I164 HydrophobicContact CD1-CD1 4.3Å; F159-I164 HydrophobicContact CD1-CG1 4.06Å; F159-I164 HydrophobicContact CE1-CD1 4.37Å; F159-I164 HydrophobicContact CE1-CG1 3.97Å; F159-I164 PolarHBondContact O-N 3.11Å; F159-I164 VanDerWaalsContact O-N 3.09Å; F159-L786 HydrophobicContact CD2-CD1 4.04Å; F159-L786 HydrophobicContact CE1-CD1 4.26Å; F159-L786 HydrophobicContact CE2-CD1 3.25Å; F159-L786 HydrophobicContact CZ-CD1 3.39Å; F159-S789 VanDerWaalsContact CD1-CB 3.43Å; F159-T793 VanDerWaalsContact CE1-OG1 3.29Å; F159-T793 WeakPolarHBondContact CE1-OG1 3.16Å; F159-W898 AromaticContact CD2-CE2 3.8Å; F159-W898 AromaticContact CD2-CZ2 3.86Å; F159-W898 HydrophobicContact CD2-CZ2 3.86Å; F159-W898 AromaticContact CD2-NE1 3.69Å; F159-W898 HydrophobicContact CE2-CZ2 4.25Å
160	N	93	Very high	94.3	Very high	1 Å²	1	5.6 Å²	5.6	1%	0.005	3%	0.034	C	C	.	.	I	π-helix	trans	-60.9	-48.1	177.7	-71.6	-10.4	0	0	0	111.8	S156 A158 I164 S789 V813 N817	S156-N160 WeakPolarHBondContact O-CB 3.31Å; S156-N160 PolarHBondContact O-N 3.09Å; S156-N160 PolarHBondContact O-ND2 2.79Å; S156-N160 PolarHBondContact O-OD1 3.43Å; A158-N160 PolarHBondContact O-N 3.48Å; N160-I164 HydrophobicContact CB-CD1 4.24Å; N160-I164 WeakPolarHBondContact O-CB 3.45Å; N160-I164 WeakPolarHBondContact OD1-CD1 3.44Å; N160-S789 WeakPolarHBondContact OD1-CB 3.31Å; N160-S789 PolarHBondContact OD1-OG 2.78Å; N160-V813 HydrophobicContact CB-CG1 3.96Å; N160-V813 VanDerWaalsContact O-CG1 3.31Å; N160-V813 WeakPolarHBondContact O-CG1 3.27Å; N160-N817 PolarHBondContact ND2-OD1 2.79Å
161	L	94	Very high	94.3	Very high	4 Å²	4	6.9 Å²	6.9	2%	0.021	4%	0.041	C	C	.	.	I	π-helix	trans	-74.9	-34.2	-176.7	-173.5	60.7	0	0	0	113.1	A157 A158 I165 Y857 A861 A864 I868	A157-L161 WeakPolarHBondContact O-CB 3.4Å; A157-L161 PolarHBondContact O-N 3.36Å; A158-L161 PolarHBondContact O-N 2.01Å; L161-I165 WeakPolarHBondContact O-CB 3.2Å; L161-I165 WeakPolarHBondContact O-CG1 3.43Å; L161-Y857 HydrophobicContact CD2-CE2 4.34Å; L161-A861 HydrophobicContact CD2-CB 3.44Å; L161-A861 VanDerWaalsContact CD2-CB 3.44Å; L161-A864 HydrophobicContact CD2-CB 4.37Å; L161-A864 HydrophobicContact CG-CB 4.29Å; L161-I868 HydrophobicContact CD1-CD1 4.49Å
162	F	95.9	Very high	94.2	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.04	C	C	.	.	I	π-helix	trans	-95.9	-59.4	-173.8	-53.7	-34.6	0	0	0	112	A158 G166 Y857 F860 A864 L894 W898	A158-F162 HydrophobicContact CB-CD2 4.01Å; A158-F162 HydrophobicContact CB-CE2 3.81Å; A158-F162 VanDerWaalsContact O-CB 3.26Å; A158-F162 WeakPolarHBondContact O-CB 3.07Å; A158-F162 WeakPolarHBondContact O-CD2 3.46Å; A158-F162 WeakPolarHBondContact O-CG 3.08Å; A158-F162 PolarHBondContact O-N 3.45Å; F162-G166 PolarHBondContact O-N 3.35Å; F162-Y857 HydrophobicContact CE2-CD2 4.22Å; F162-Y857 HydrophobicContact CZ-CD2 4.07Å; F162-Y857 HydrophobicContact CZ-CE2 4.24Å; F162-F860 HydrophobicContact CE1-CB 4.12Å; F162-F860 HydrophobicContact CE2-CB 4.2Å; F162-F860 HydrophobicContact CZ-CB 3.52Å; F162-A864 HydrophobicContact CD1-CB 3.86Å; F162-A864 HydrophobicContact CE1-CB 3.73Å; F162-L894 WeakPolarHBondContact O-CB 3.42Å; F162-W898 HydrophobicContact CB-CB 3.86Å; F162-W898 HydrophobicContact CD2-CB 4Å; F162-W898 HydrophobicContact CG-CB 4.38Å
163	V	95.7	Very high	93.8	Very high	9 Å²	9	9.2 Å²	9.2	6%	0.055	6%	0.056	C	C	.	.	I	π-helix	trans	-74.8	-51.1	-172.4	176	0	0	0	0	110.7	F159 I165 G166 V167 F895 W898	F159-V163 HydrophobicContact CD2-CB 3.76Å; F159-V163 HydrophobicContact CD2-CG1 4.15Å; F159-V163 HydrophobicContact CD2-CG2 3.69Å; F159-V163 HydrophobicContact CE1-CB 4.46Å; F159-V163 HydrophobicContact CE1-CG1 4.32Å; F159-V163 HydrophobicContact CE2-CB 3.64Å; F159-V163 HydrophobicContact CE2-CG1 3.48Å; F159-V163 VanDerWaalsContact CE2-CG1 3.48Å; F159-V163 HydrophobicContact CE2-CG2 3.78Å; F159-V163 HydrophobicContact CG-CB 4.21Å; F159-V163 HydrophobicContact CG-CG2 4.45Å; F159-V163 HydrophobicContact CZ-CB 4.02Å; F159-V163 HydrophobicContact CZ-CG1 3.59Å; F159-V163 WeakPolarHBondContact O-CA 3.42Å; F159-V163 WeakPolarHBondContact O-CB 3.4Å; F159-V163 PolarHBondContact O-N 3.32Å; V163-I165 PolarHBondContact O-N 2.97Å; V163-G166 CarbonylContact O-C 3.21Å; V163-G166 WeakPolarHBondContact O-CA 3.29Å; V163-G166 PolarHBondContact O-N 3.15Å; V163-G166 VanDerWaalsContact O-N 3.11Å; V163-V167 HydrophobicContact CG1-CG2 4.4Å; V163-V167 WeakPolarHBondContact O-CG2 3.05Å; V163-V167 PolarHBondContact O-N 3.34Å; V163-F895 HydrophobicContact CB-CE1 4.34Å; V163-F895 HydrophobicContact CG1-CD1 4.4Å; V163-F895 HydrophobicContact CG1-CE1 3.59Å; V163-F895 HydrophobicContact CG1-CZ 3.91Å; V163-F895 HydrophobicContact CG2-CD1 4.24Å; V163-F895 HydrophobicContact CG2-CE1 4.23Å; V163-W898 HydrophobicContact CG2-CB 3.91Å; V163-W898 HydrophobicContact CG2-CD2 3.6Å; V163-W898 HydrophobicContact CG2-CE3 4.08Å; V163-W898 HydrophobicContact CG2-CG 3.52Å
164	I	94.4	Very high	93.4	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	8%	0.077	C	C	.	.	I	π-helix	trans	-61.8	-45.1	-177.4	-58.7	-174.1	0	0	0	110.8	F159 N160 G166 V167 C168 D792 T793 S796 V813	F159-I164 HydrophobicContact CD1-CD1 4.3Å; F159-I164 HydrophobicContact CD1-CG1 4.06Å; F159-I164 HydrophobicContact CE1-CD1 4.37Å; F159-I164 HydrophobicContact CE1-CG1 3.97Å; F159-I164 PolarHBondContact O-N 3.11Å; F159-I164 VanDerWaalsContact O-N 3.09Å; N160-I164 HydrophobicContact CB-CD1 4.24Å; N160-I164 WeakPolarHBondContact O-CB 3.45Å; N160-I164 WeakPolarHBondContact OD1-CD1 3.44Å; I164-G166 VanDerWaalsContact C-N 3.34Å; I164-G166 PolarHBondContact O-N 2.98Å; I164-V167 PolarHBondContact O-N 3.16Å; I164-C168 WeakPolarHBondContact O-CB 3.29Å; I164-C168 PolarHBondContact O-N 3.24Å; I164-C168 PolarHBondContact O-SG 3.37Å; I164-D792 HydrophobicContact CD1-CB 3.99Å; I164-T793 HydrophobicContact CG1-CG2 4.35Å; I164-T793 WeakPolarHBondContact CG1-OG1 3.47Å; I164-S796 VanDerWaalsContact CG2-CB 3.4Å; I164-V813 HydrophobicContact CB-CG2 4.39Å; I164-V813 HydrophobicContact CG2-CG2 3.97Å
165	I	93.7	Very high	93	Very high	1 Å²	1	17 Å²	17	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-64.1	-40.7	175.4	-57.3	-57	0	0	0	111.3	L161 V163 V167 C168 I169 I810 V813 I868 L894	L161-I165 WeakPolarHBondContact O-CB 3.2Å; L161-I165 WeakPolarHBondContact O-CG1 3.43Å; V163-I165 PolarHBondContact O-N 2.97Å; I165-V167 VanDerWaalsContact C-N 3.33Å; I165-V167 PolarHBondContact O-N 3.38Å; I165-C168 PolarHBondContact O-N 2.95Å; I165-I169 HydrophobicContact CG2-CD1 4.18Å; I165-I169 HydrophobicContact CG2-CG1 4.5Å; I165-I169 WeakPolarHBondContact O-CG1 3.26Å; I165-I169 PolarHBondContact O-N 2.97Å; I165-I810 HydrophobicContact CD1-CB 4.32Å; I165-I810 HydrophobicContact CD1-CG1 4.07Å; I165-I810 HydrophobicContact CD1-CG2 4.23Å; I165-V813 HydrophobicContact CD1-CB 4.21Å; I165-V813 HydrophobicContact CD1-CG1 4.16Å; I165-V813 HydrophobicContact CD1-CG2 4.13Å; I165-V813 HydrophobicContact CG1-CG1 4.32Å; I165-I868 HydrophobicContact CG2-CD1 3.97Å; I165-I868 HydrophobicContact CG2-CG1 4.2Å; I165-L894 HydrophobicContact CB-CD1 4.28Å; I165-L894 HydrophobicContact CG2-CD1 3.98Å
166	G	95	Very high	92.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-56.7	-45.2	173.6	0	0	0	0	0	112.6	F162 V163 I164 I169 V170 A891	F162-G166 PolarHBondContact O-N 3.35Å; V163-G166 CarbonylContact O-C 3.21Å; V163-G166 WeakPolarHBondContact O-CA 3.29Å; V163-G166 PolarHBondContact O-N 3.15Å; V163-G166 VanDerWaalsContact O-N 3.11Å; I164-G166 VanDerWaalsContact C-N 3.34Å; I164-G166 PolarHBondContact O-N 2.98Å; G166-I169 PolarHBondContact O-N 2.85Å; G166-V170 WeakPolarHBondContact O-CG2 3.38Å; G166-V170 PolarHBondContact O-N 3.46Å; G166-A891 WeakPolarHBondContact O-CB 3.21Å
167	V	94.7	Very high	92.5	Very high	32 Å²	32	23.8 Å²	23.8	19%	0.194	15%	0.152	C	C	.	.	H	α-helix	trans	-61.9	-48.6	173.2	173.3	0	0	0	0	110.5	V163 I164 I165 I169 V170 V171 T793 K797 F895	V163-V167 HydrophobicContact CG1-CG2 4.4Å; V163-V167 WeakPolarHBondContact O-CG2 3.05Å; V163-V167 PolarHBondContact O-N 3.34Å; I164-V167 PolarHBondContact O-N 3.16Å; I165-V167 VanDerWaalsContact C-N 3.33Å; I165-V167 PolarHBondContact O-N 3.38Å; V167-I169 PolarHBondContact O-N 3.45Å; V167-V170 PolarHBondContact O-N 3.04Å; V167-V171 HydrophobicContact CG1-CG1 3.81Å; V167-V171 WeakPolarHBondContact O-CG1 3.46Å; V167-V171 WeakPolarHBondContact O-CG2 3.36Å; V167-V171 PolarHBondContact O-N 3.39Å; V167-T793 HydrophobicContact CG2-CG2 4.47Å; V167-K797 HydrophobicContact CG1-CB 4.37Å; V167-F895 HydrophobicContact CG2-CE2 4.42Å; V167-F895 HydrophobicContact CG2-CZ 3.82Å
168	C	94.3	Very high	92.4	Very high	0 Å²	0	25 Å²	25	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.9	-33.7	179	-67.9	0	0	0	0	112.5	I164 I165 V172 S796 A800 L880	I164-C168 WeakPolarHBondContact O-CB 3.29Å; I164-C168 PolarHBondContact O-N 3.24Å; I164-C168 PolarHBondContact O-SG 3.37Å; I165-C168 PolarHBondContact O-N 2.95Å; C168-V172 WeakPolarHBondContact O-CG2 3.31Å; C168-S796 VanDerWaalsContact SG-CB 3.59Å; C168-S796 PolarHBondContact SG-O 2.74Å; C168-A800 HydrophobicContact CB-CB 4.03Å; C168-L880 HydrophobicContact CB-CD1 4.11Å; C168-L880 HydrophobicContact CB-CD2 3.91Å
169	I	94.1	Very high	92.1	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-66.1	-42.8	174	-69.7	166.4	0	0	0	110.8	I165 G166 V167 L880 K887 A891 L894	I165-I169 HydrophobicContact CG2-CD1 4.18Å; I165-I169 HydrophobicContact CG2-CG1 4.5Å; I165-I169 WeakPolarHBondContact O-CG1 3.26Å; I165-I169 PolarHBondContact O-N 2.97Å; G166-I169 PolarHBondContact O-N 2.85Å; V167-I169 PolarHBondContact O-N 3.45Å; I169-L880 HydrophobicContact CG1-CD2 3.71Å; I169-K887 HydrophobicContact CG2-CB 4.33Å; I169-K887 HydrophobicContact CG2-CG 3.88Å; I169-K887 WeakPolarHBondContact CG2-O 3.46Å; I169-K887 WeakPolarHBondContact O-CE 3.3Å; I169-K887 VanDerWaalsContact O-CG 3.32Å; I169-K887 WeakPolarHBondContact O-CG 3.34Å; I169-A891 HydrophobicContact CG2-CB 4.4Å; I169-L894 HydrophobicContact CD1-CD1 3.81Å
170	V	93.2	Very high	91.6	Very high	45 Å²	45	30.6 Å²	30.6	27%	0.273	18%	0.177	S	C	.	.	H	α-helix	trans	-78.2	-29.5	-174.2	178.6	0	0	0	0	113.5	G166 V167 K887 Y888 A891	G166-V170 WeakPolarHBondContact O-CG2 3.38Å; G166-V170 PolarHBondContact O-N 3.46Å; V167-V170 PolarHBondContact O-N 3.04Å; V170-K887 WeakPolarHBondContact O-CE 3.25Å; V170-K887 PolarHBondContact O-NZ 3.33Å; V170-Y888 HydrophobicContact CG1-CE1 3.93Å; V170-Y888 HydrophobicContact CG2-CD1 4.45Å; V170-A891 HydrophobicContact CG2-CB 3.31Å
171	V	91.4	Very high	91	Very high	37 Å²	37	36.6 Å²	36.6	22%	0.224	20%	0.203	C	C	.	.	H	α-helix	trans	-82.5	-19.4	-174.3	-62.6	0	0	0	0	114	V167 K797 A800 V801	V167-V171 HydrophobicContact CG1-CG1 3.81Å; V167-V171 WeakPolarHBondContact O-CG1 3.46Å; V167-V171 WeakPolarHBondContact O-CG2 3.36Å; V167-V171 PolarHBondContact O-N 3.39Å; V171-K797 HydrophobicContact CB-CG 4.19Å; V171-K797 HydrophobicContact CG1-CD 4.08Å; V171-K797 HydrophobicContact CG1-CG 3.93Å; V171-K797 HydrophobicContact CG2-CG 4.08Å; V171-A800 HydrophobicContact CG2-CB 4.06Å; V171-V801 HydrophobicContact CB-CG2 4.17Å; V171-V801 HydrophobicContact CG2-CG2 4.15Å
172	V	90.9	Very high	90.3	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	22%	0.218	C	C	.	.	S	Bend	trans	-59.4	129.4	176.5	173.1	0	0	0	0	109.7	C168 Q176 R178 A800 L880 K887	C168-V172 WeakPolarHBondContact O-CG2 3.31Å; V172-Q176 HydrophobicContact CG1-CB 4.06Å; V172-Q176 WeakPolarHBondContact CG1-O 3.44Å; V172-R178 HydrophobicContact CG1-CG 4.35Å; V172-R178 HydrophobicContact CG2-CG 3.93Å; V172-A800 HydrophobicContact CG2-CB 4.38Å; V172-L880 HydrophobicContact CG2-CB 3.85Å; V172-K887 PolarHBondContact O-NZ 3.22Å
173	P	87.3	Confident	89.7	Confident	52 Å²	52	41.2 Å²	41.2	34%	0.338	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-52.4	145.8	-179.8	-28.4	34.9	0	0	0	113.4	G175 Q176	P173-G175 PolarHBondContact O-N 3.39Å; P173-Q176 HydrophobicContact CB-CG 4.44Å; P173-Q176 PolarHBondContact O-N 2.88Å; P173-Q176 VanDerWaalsContact O-N 3.12Å
174	D	86.4	Confident	89.1	Confident	84 Å²	84	44.1 Å²	44.1	45%	0.449	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	130.9	-178.8	-72.6	-21.6	0	0	0	110.9	K884 K887	D174-K884 WeakPolarHBondContact OD2-CE 3.27Å; D174-K884 IonicContact OD2-NZ 2.73Å; D174-K884 PolarHBondContact OD2-NZ 3.34Å; D174-K887 IonicContact OD1-NZ 3.59Å; D174-K887 PolarHBondContact OD1-NZ 3.36Å
175	G	84.3	Confident	88.6	Confident	79 Å²	79	45 Å²	45	81%	0.814	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.4	-13.3	-177.3	0	0	0	0	0	114.6	P173	P173-G175 PolarHBondContact O-N 3.39Å
176	Q	89.3	Confident	88.3	Confident	86 Å²	86	45.3 Å²	45.3	40%	0.402	25%	0.253	S	S	.	.			trans	-98.2	151.1	177	-58.1	-171.6	11.8	0	0	111.9	V172 P173 G882	V172-Q176 HydrophobicContact CG1-CB 4.06Å; V172-Q176 WeakPolarHBondContact CG1-O 3.44Å; P173-Q176 HydrophobicContact CB-CG 4.44Å; P173-Q176 PolarHBondContact O-N 2.88Å; P173-Q176 VanDerWaalsContact O-N 3.12Å; Q176-G882 PolarHBondContact O-N 2.71Å; Q176-G882 VanDerWaalsContact O-N 3.09Å
177	V	90.2	Very high	87.9	Confident	57 Å²	57	50 Å²	50	35%	0.345	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.2	172.9	-69.8	0	0	0	0	109	L880	V177-L880 WeakPolarHBondContact CA-O 3.46Å
178	R	90.8	Very high	87.6	Confident	25 Å²	25	50.7 Å²	50.7	9%	0.094	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.8	172.4	-49	-62.4	-174	-138.1	8.3	109.2	V172 A800 V801 D803 Q804 A806 E879 L880	V172-R178 HydrophobicContact CG1-CG 4.35Å; V172-R178 HydrophobicContact CG2-CG 3.93Å; R178-A800 PolarHBondContact NE-O 3.21Å; R178-V801 PolarHBondContact NH2-O 3.43Å; R178-V801 VanDerWaalsContact NH2-O 3.08Å; R178-D803 WeakPolarHBondContact CD-O 3.49Å; R178-D803 VanDerWaalsContact CZ-O 3.25Å; R178-D803 PolarHBondContact NE-O 3.13Å; R178-Q804 VanDerWaalsContact CD-O 3.25Å; R178-Q804 WeakPolarHBondContact CD-O 3.47Å; R178-A806 HydrophobicContact CB-CB 3.97Å; R178-E879 PolarHBondContact O-N 2.99Å; R178-L880 HydrophobicContact CB-CB 4.06Å; R178-L880 HydrophobicContact CB-CD1 4.33Å; R178-L880 HydrophobicContact CG-CB 4.38Å; R178-L880 PolarHBondContact N-O 2.91Å; R178-L880 VanDerWaalsContact N-O 3.09Å; R178-L880 PolarHBondContact O-N 3.23Å
179	R	89.3	Confident	87.3	Confident	121 Å²	121	50.9 Å²	50.9	46%	0.457	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-115.3	149	177.6	-70.3	-173.8	177.1	175.2	5	111.5	K181 Y805 A806 G877 E879	R179-K181 PolarHBondContact O-N 3.32Å; R179-Y805 CarbonylContact O-C 3.59Å; R179-Y805 VanDerWaalsContact O-CA 3.32Å; R179-Y805 WeakPolarHBondContact O-CA 3.45Å; R179-Y805 WeakPolarHBondContact O-CB 3.32Å; R179-A806 PolarHBondContact O-N 3.34Å; R179-G877 PolarHBondContact NE-O 2.81Å; R179-G877 PolarHBondContact NH2-O 2.85Å; R179-E879 VanDerWaalsContact CA-OE2 3.28Å; R179-E879 WeakPolarHBondContact CA-OE2 3.49Å
180	I	85.8	Confident	87	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.036	28%	0.279	C	S	.	.			trans	-75.3	121.6	171.4	-58.1	176.2	0	0	0	108.8	L183 F186 A806 D807 I810 E879	I180-L183 HydrophobicContact CB-CD2 4.18Å; I180-L183 HydrophobicContact CG2-CD2 4.28Å; I180-L183 HydrophobicContact CG2-CG 4.44Å; I180-F186 HydrophobicContact CD1-CD1 3.97Å; I180-F186 HydrophobicContact CD1-CD2 3.82Å; I180-F186 HydrophobicContact CD1-CE1 4.11Å; I180-F186 HydrophobicContact CD1-CE2 3.97Å; I180-F186 HydrophobicContact CD1-CG 3.81Å; I180-F186 HydrophobicContact CD1-CZ 4.11Å; I180-F186 HydrophobicContact CG2-CB 4.05Å; I180-F186 HydrophobicContact CG2-CG 4.43Å; I180-A806 HydrophobicContact CG1-CB 3.92Å; I180-D807 WeakPolarHBondContact CA-OD2 3.46Å; I180-D807 WeakPolarHBondContact CG2-OD1 3.38Å; I180-I810 HydrophobicContact CD1-CB 4.45Å; I180-I810 HydrophobicContact CD1-CD1 4.09Å; I180-I810 HydrophobicContact CD1-CG2 4.36Å; I180-I810 HydrophobicContact CG1-CD1 4.3Å; I180-E879 HydrophobicContact CD1-CG 4.27Å; I180-E879 HydrophobicContact CG1-CG 4.3Å
181	K	80.6	Confident	86.9	Confident	127 Å²	127	52.4 Å²	52.4	55%	0.552	29%	0.29	S	S	*	.	S	Bend	trans	-77.1	-45.7	177.3	-176.8	-177.8	175.2	-170.4	0	111	R179 L183 Y805 D807	R179-K181 PolarHBondContact O-N 3.32Å; K181-L183 PolarHBondContact O-N 3.4Å; K181-Y805 HydrophobicContact CB-CD1 3.92Å; K181-Y805 HydrophobicContact CB-CE1 4.29Å; K181-Y805 HydrophobicContact CB-CG 4.18Å; K181-Y805 HydrophobicContact CD-CD2 4.42Å; K181-Y805 HydrophobicContact CD-CE1 4.43Å; K181-Y805 HydrophobicContact CD-CE2 4.25Å; K181-D807 PolarHBondContact N-OD1 2.99Å; K181-D807 PolarHBondContact N-OD2 3.09Å
182	H	79.9	Confident	87	Confident	69 Å²	69	53.1 Å²	53.1	32%	0.319	29%	0.288	S	S	.	.			trans	-99.3	65.7	-173.7	-64.4	-101.5	0	0	0	112.9	S184 V185 F186 D235 D807	H182-S184 VanDerWaalsContact C-N 3.3Å; H182-S184 PolarHBondContact O-N 3.34Å; H182-V185 HydrophobicContact CB-CB 4.24Å; H182-V185 HydrophobicContact CB-CG2 4.23Å; H182-V185 PolarHBondContact O-N 3.43Å; H182-V185 VanDerWaalsContact O-N 3.16Å; H182-F186 PolarHBondContact O-N 3Å; H182-D235 IonicContact ND1-OD1 2.73Å; H182-D807 IonicContact CD2-OD1 3.08Å; H182-D807 PolarHBondContact N-OD1 2.87Å
183	L	82.8	Confident	87.1	Confident	33 Å²	33	53.3 Å²	53.3	17%	0.173	29%	0.289	C	S	.	.	H	α-helix	trans	-60.4	-35	-174.9	-68.2	149	0	0	0	114.4	I180 K181 V185 F186 F187	I180-L183 HydrophobicContact CB-CD2 4.18Å; I180-L183 HydrophobicContact CG2-CD2 4.28Å; I180-L183 HydrophobicContact CG2-CG 4.44Å; K181-L183 PolarHBondContact O-N 3.4Å; L183-V185 VanDerWaalsContact C-N 3.34Å; L183-F186 PolarHBondContact O-N 2.95Å; L183-F187 HydrophobicContact CB-CD2 4.34Å; L183-F187 HydrophobicContact CB-CE2 4.26Å; L183-F187 WeakPolarHBondContact O-CD2 3.29Å; L183-F187 PolarHBondContact O-N 3.42Å
184	S	83.7	Confident	87.4	Confident	69 Å²	69	52.2 Å²	52.2	48%	0.483	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-42.4	178.6	-61	0	0	0	0	111.7	H182 I188	H182-S184 VanDerWaalsContact C-N 3.3Å; H182-S184 PolarHBondContact O-N 3.34Å; S184-I188 WeakPolarHBondContact O-CG1 3.11Å; S184-I188 PolarHBondContact O-N 3.3Å
185	V	83.9	Confident	87.8	Confident	19 Å²	19	50.9 Å²	50.9	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-65.8	-47.4	175.8	-178.7	0	0	0	0	109.2	T115 H182 L183 F187 I188 T189 D235	T115-V185 HydrophobicContact CG2-CG1 3.84Å; H182-V185 HydrophobicContact CB-CB 4.24Å; H182-V185 HydrophobicContact CB-CG2 4.23Å; H182-V185 PolarHBondContact O-N 3.43Å; H182-V185 VanDerWaalsContact O-N 3.16Å; L183-V185 VanDerWaalsContact C-N 3.34Å; V185-F187 PolarHBondContact O-N 2.81Å; V185-I188 PolarHBondContact O-N 3.5Å; V185-I188 VanDerWaalsContact O-N 3.12Å; V185-T189 HydrophobicContact CG1-CG2 4.15Å; V185-T189 WeakPolarHBondContact O-CG2 3.48Å; V185-T189 PolarHBondContact O-N 2.96Å; V185-T189 PolarHBondContact O-OG1 3.28Å; V185-D235 HydrophobicContact CG2-CB 4.05Å
186	F	86	Confident	88.3	Confident	8 Å²	8	47.1 Å²	47.1	4%	0.035	23%	0.232	C	C	.	.	H	α-helix	trans	-56.8	-44.2	176.9	175.3	-103.2	0	0	0	113.5	I180 H182 L183 I188 T189 S190 I810 T814 L869	I180-F186 HydrophobicContact CD1-CD1 3.97Å; I180-F186 HydrophobicContact CD1-CD2 3.82Å; I180-F186 HydrophobicContact CD1-CE1 4.11Å; I180-F186 HydrophobicContact CD1-CE2 3.97Å; I180-F186 HydrophobicContact CD1-CG 3.81Å; I180-F186 HydrophobicContact CD1-CZ 4.11Å; I180-F186 HydrophobicContact CG2-CB 4.05Å; I180-F186 HydrophobicContact CG2-CG 4.43Å; H182-F186 PolarHBondContact O-N 3Å; L183-F186 PolarHBondContact O-N 2.95Å; F186-I188 VanDerWaalsContact C-N 3.3Å; F186-I188 PolarHBondContact O-N 3.01Å; F186-T189 WeakPolarHBondContact CA-OG1 3.4Å; F186-T189 PolarHBondContact O-N 3.43Å; F186-T189 PolarHBondContact O-OG1 2.96Å; F186-T189 VanDerWaalsContact O-OG1 3.1Å; F186-S190 WeakPolarHBondContact O-CB 3.35Å; F186-S190 PolarHBondContact O-N 3.07Å; F186-I810 HydrophobicContact CD2-CG2 4.34Å; F186-I810 HydrophobicContact CE2-CG2 3.57Å; F186-I810 HydrophobicContact CZ-CG2 4.24Å; F186-T814 HydrophobicContact CE2-CG2 4.01Å; F186-L869 HydrophobicContact CE1-CD2 4.11Å
187	F	88	Confident	88.6	Confident	98 Å²	98	43 Å²	43	43%	0.43	21%	0.213	S	C	.	.	H	α-helix	trans	-63.7	-37.6	178	-82.3	-60.9	0	0	0	112.1	L183 V185 S191 L869	L183-F187 HydrophobicContact CB-CD2 4.34Å; L183-F187 HydrophobicContact CB-CE2 4.26Å; L183-F187 WeakPolarHBondContact O-CD2 3.29Å; L183-F187 PolarHBondContact O-N 3.42Å; V185-F187 PolarHBondContact O-N 2.81Å; F187-S191 VanDerWaalsContact O-CB 3.22Å; F187-S191 WeakPolarHBondContact O-CB 3.4Å; F187-S191 PolarHBondContact O-N 3.15Å; F187-S191 PolarHBondContact O-OG 3.37Å; F187-L869 HydrophobicContact CE1-CD1 3.98Å; F187-L869 HydrophobicContact CE1-CD2 4.08Å; F187-L869 HydrophobicContact CZ-CD2 4.06Å
188	I	88.1	Confident	88.8	Confident	47 Å²	47	42.6 Å²	42.6	24%	0.241	21%	0.208	C	C	.	.	H	α-helix	trans	-69	-51.6	177.4	-71.3	167.1	0	0	0	109.7	S184 V185 F186 S190 S191 W192 C230 A234	S184-I188 WeakPolarHBondContact O-CG1 3.11Å; S184-I188 PolarHBondContact O-N 3.3Å; V185-I188 PolarHBondContact O-N 3.5Å; V185-I188 VanDerWaalsContact O-N 3.12Å; F186-I188 VanDerWaalsContact C-N 3.3Å; F186-I188 PolarHBondContact O-N 3.01Å; I188-S190 PolarHBondContact O-N 3.24Å; I188-S191 PolarHBondContact O-N 3.3Å; I188-W192 VanDerWaalsContact O-CD1 3.22Å; I188-W192 PolarHBondContact O-N 2.89Å; I188-C230 HydrophobicContact CG2-CB 4.28Å; I188-A234 HydrophobicContact CD1-CB 3.21Å
189	T	87.1	Confident	89	Confident	4 Å²	4	42.3 Å²	42.3	3%	0.025	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-41.9	-178.2	57.6	0	0	0	0	111.8	L119 V185 F186 W192 S193	L119-T189 HydrophobicContact CD1-CG2 3.81Å; L119-T189 HydrophobicContact CD2-CG2 3.73Å; L119-T189 HydrophobicContact CG-CG2 4.36Å; V185-T189 HydrophobicContact CG1-CG2 4.15Å; V185-T189 WeakPolarHBondContact O-CG2 3.48Å; V185-T189 PolarHBondContact O-N 2.96Å; V185-T189 PolarHBondContact O-OG1 3.28Å; F186-T189 WeakPolarHBondContact CA-OG1 3.4Å; F186-T189 PolarHBondContact O-N 3.43Å; F186-T189 PolarHBondContact O-OG1 2.96Å; F186-T189 VanDerWaalsContact O-OG1 3.1Å; T189-W192 PolarHBondContact O-N 3.03Å; T189-S193 WeakPolarHBondContact O-CB 3.49Å; T189-S193 PolarHBondContact O-N 3.42Å; T189-S193 PolarHBondContact O-OG 2.81Å
190	S	88.8	Confident	89.1	Confident	6 Å²	6	36.6 Å²	36.6	4%	0.042	19%	0.186	C	C	.	.	H	α-helix	trans	-68	-36.1	176.8	179	0	0	0	0	113.1	F186 I188 S193 L194 I865	F186-S190 WeakPolarHBondContact O-CB 3.35Å; F186-S190 PolarHBondContact O-N 3.07Å; I188-S190 PolarHBondContact O-N 3.24Å; S190-S193 WeakPolarHBondContact CA-OG 3.33Å; S190-S193 PolarHBondContact O-OG 3.45Å; S190-L194 PolarHBondContact O-N 3.45Å; S190-L194 VanDerWaalsContact O-N 3.14Å; S190-I865 WeakPolarHBondContact OG-CD1 3.38Å
191	S	91.3	Very high	89.5	Confident	72 Å²	72	37.2 Å²	37.2	50%	0.503	19%	0.188	S	C	.	.	H	α-helix	trans	-68.5	-43.5	175.8	-60.2	0	0	0	0	111.1	F187 I188 L194 F195	F187-S191 VanDerWaalsContact O-CB 3.22Å; F187-S191 WeakPolarHBondContact O-CB 3.4Å; F187-S191 PolarHBondContact O-N 3.15Å; F187-S191 PolarHBondContact O-OG 3.37Å; I188-S191 PolarHBondContact O-N 3.3Å; S191-L194 PolarHBondContact O-N 3.34Å; S191-F195 VanDerWaalsContact O-CB 3.31Å; S191-F195 WeakPolarHBondContact O-CB 3.33Å; S191-F195 PolarHBondContact O-N 2.95Å
192	W	93.4	Very high	90.1	Very high	52 Å²	52	32.3 Å²	32.3	20%	0.197	17%	0.168	C	C	.	.	H	α-helix	trans	-69.3	-33	176.2	-81.9	101.6	0	0	0	112.7	I188 T189 F195 A196 F223 I226 I227 F822	I188-W192 VanDerWaalsContact O-CD1 3.22Å; I188-W192 PolarHBondContact O-N 2.89Å; T189-W192 PolarHBondContact O-N 3.03Å; W192-F195 AromaticContact CE3-CD1 3.71Å; W192-F195 HydrophobicContact CE3-CD1 3.71Å; W192-F195 HydrophobicContact CE3-CE1 4.3Å; W192-F195 AromaticContact CZ3-CD1 3.72Å; W192-F195 HydrophobicContact CZ3-CD1 3.72Å; W192-F195 AromaticContact CZ3-CE1 3.83Å; W192-F195 HydrophobicContact CZ3-CE1 3.83Å; W192-F195 PolarHBondContact O-N 3.42Å; W192-A196 WeakPolarHBondContact O-CB 3.49Å; W192-A196 PolarHBondContact O-N 3.32Å; W192-F223 HydrophobicContact CH2-CD1 4.08Å; W192-F223 HydrophobicContact CH2-CE1 4.48Å; W192-F223 HydrophobicContact CZ3-CB 4.28Å; W192-F223 AromaticContact CZ3-CD1 3.81Å; W192-F223 HydrophobicContact CZ3-CD1 3.81Å; W192-F223 HydrophobicContact CZ3-CE1 4.39Å; W192-F223 HydrophobicContact CZ3-CG 4.11Å; W192-I226 HydrophobicContact CH2-CG2 3.73Å; W192-I226 HydrophobicContact CZ2-CG2 3.84Å; W192-I227 HydrophobicContact CB-CB 4.46Å; W192-I227 HydrophobicContact CB-CD1 3.37Å; W192-I227 HydrophobicContact CB-CG1 3.77Å; W192-I227 HydrophobicContact CD2-CB 4.22Å; W192-I227 HydrophobicContact CD2-CG1 4.31Å; W192-I227 HydrophobicContact CG-CB 4.18Å; W192-I227 HydrophobicContact CG-CD1 3.94Å; W192-I227 HydrophobicContact CG-CG1 3.74Å; W192-F822 AromaticContact CE3-CE2 3.91Å; W192-F822 HydrophobicContact CE3-CE2 3.91Å; W192-F822 AromaticContact CE3-CZ 3.77Å; W192-F822 HydrophobicContact CE3-CZ 3.77Å; W192-F822 HydrophobicContact CZ3-CZ 4.27Å
193	S	91.9	Very high	90.7	Very high	4 Å²	4	29 Å²	29	3%	0.028	15%	0.153	C	C	.	.	H	α-helix	trans	-63.9	-46.4	174.7	73.7	0	0	0	0	110.9	T189 S190 A196 Y197 T814	T189-S193 WeakPolarHBondContact O-CB 3.49Å; T189-S193 PolarHBondContact O-N 3.42Å; T189-S193 PolarHBondContact O-OG 2.81Å; S190-S193 WeakPolarHBondContact CA-OG 3.33Å; S190-S193 PolarHBondContact O-OG 3.45Å; S193-A196 WeakPolarHBondContact O-CB 3.38Å; S193-A196 PolarHBondContact O-N 2.84Å; S193-Y197 WeakPolarHBondContact O-CD2 3.42Å; S193-T814 WeakPolarHBondContact CB-O 3.42Å
194	L	93.1	Very high	91.1	Very high	29 Å²	29	27.5 Å²	27.5	15%	0.152	14%	0.144	C	C	.	.	H	α-helix	trans	-64.2	-43.1	174.3	-75.6	172.8	0	0	0	112	S190 S191 A196 Y197 L198 A861 L862 I865	S190-L194 PolarHBondContact O-N 3.45Å; S190-L194 VanDerWaalsContact O-N 3.14Å; S191-L194 PolarHBondContact O-N 3.34Å; L194-A196 PolarHBondContact O-N 2.92Å; L194-Y197 PolarHBondContact O-N 3.3Å; L194-L198 WeakPolarHBondContact O-CB 3.3Å; L194-L198 PolarHBondContact O-N 3.4Å; L194-A861 HydrophobicContact CD2-CB 3.51Å; L194-L862 HydrophobicContact CD1-CD2 3.55Å; L194-L862 HydrophobicContact CD1-CG 4.29Å; L194-L862 HydrophobicContact CD2-CG 4.49Å; L194-I865 HydrophobicContact CD1-CD1 3.54Å; L194-I865 HydrophobicContact CD2-CD1 3.97Å; L194-I865 HydrophobicContact CG-CD1 3.73Å
195	F	95.3	Very high	91.3	Very high	57 Å²	57	25.5 Å²	25.5	25%	0.25	13%	0.132	C	C	.	.	H	α-helix	trans	-60.2	-34.6	177.3	176.9	-107.3	0	0	0	111.8	S191 W192 Y197 L198 W199 F223 F822	S191-F195 VanDerWaalsContact O-CB 3.31Å; S191-F195 WeakPolarHBondContact O-CB 3.33Å; S191-F195 PolarHBondContact O-N 2.95Å; W192-F195 AromaticContact CE3-CD1 3.71Å; W192-F195 HydrophobicContact CE3-CD1 3.71Å; W192-F195 HydrophobicContact CE3-CE1 4.3Å; W192-F195 AromaticContact CZ3-CD1 3.72Å; W192-F195 HydrophobicContact CZ3-CD1 3.72Å; W192-F195 AromaticContact CZ3-CE1 3.83Å; W192-F195 HydrophobicContact CZ3-CE1 3.83Å; W192-F195 PolarHBondContact O-N 3.42Å; F195-Y197 PolarHBondContact O-N 3.48Å; F195-L198 HydrophobicContact CD2-CD2 4.48Å; F195-L198 PolarHBondContact O-N 3.26Å; F195-W199 HydrophobicContact CE1-CB 4.25Å; F195-W199 HydrophobicContact CE2-CB 4.44Å; F195-W199 HydrophobicContact CE2-CE3 4.26Å; F195-W199 HydrophobicContact CZ-CB 4.17Å; F195-W199 HydrophobicContact CZ-CD2 4.24Å; F195-W199 AromaticContact CZ-CE3 3.71Å; F195-W199 HydrophobicContact CZ-CE3 3.71Å; F195-W199 HydrophobicContact CZ-CG 4.43Å; F195-W199 HydrophobicContact CZ-CZ3 4.49Å; F195-W199 WeakPolarHBondContact O-CA 3.32Å; F195-W199 WeakPolarHBondContact O-CB 3.4Å; F195-W199 PolarHBondContact O-N 3.34Å; F195-F223 HydrophobicContact CE1-CD2 4.21Å; F195-F223 HydrophobicContact CE1-CE1 4.47Å; F195-F223 AromaticContact CE1-CE2 3.89Å; F195-F223 HydrophobicContact CE1-CE2 3.89Å; F195-F223 HydrophobicContact CE1-CZ 4.05Å; F195-F223 HydrophobicContact CZ-CE2 4.26Å; F195-F223 HydrophobicContact CZ-CZ 4.25Å; F195-F822 HydrophobicContact CD1-CZ 4.14Å
196	A	94.8	Very high	91.6	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.4	-48.3	179.3	0	0	0	0	0	112.2	W192 S193 L194 W199 M200 V821 F822	W192-A196 WeakPolarHBondContact O-CB 3.49Å; W192-A196 PolarHBondContact O-N 3.32Å; S193-A196 WeakPolarHBondContact O-CB 3.38Å; S193-A196 PolarHBondContact O-N 2.84Å; L194-A196 PolarHBondContact O-N 2.92Å; A196-W199 PolarHBondContact O-N 2.9Å; A196-M200 PolarHBondContact O-N 3.19Å; A196-V821 HydrophobicContact CB-CB 3.81Å; A196-V821 HydrophobicContact CB-CG1 4.06Å; A196-V821 HydrophobicContact CB-CG2 4.21Å; A196-F822 HydrophobicContact CB-CD1 4.18Å; A196-F822 HydrophobicContact CB-CD2 4.36Å; A196-F822 HydrophobicContact CB-CE1 3.57Å; A196-F822 HydrophobicContact CB-CE2 3.79Å; A196-F822 HydrophobicContact CB-CZ 3.34Å
197	Y	95.2	Very high	91.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-70.5	-37.9	177.4	-67.5	-87.9	0	0	0	112	I153 V154 A157 S193 L194 F195 W199 M200 Y201 N817 V821 V854 Y857 C858	I153-Y197 HydrophobicContact CG2-CE1 4.26Å; V154-Y197 HydrophobicContact CG2-CD1 4.32Å; V154-Y197 HydrophobicContact CG2-CE1 4.2Å; A157-Y197 HydrophobicContact CB-CE1 3.74Å; A157-Y197 HydrophobicContact CB-CE2 4.06Å; A157-Y197 WeakPolarHBondContact CB-OH 3.44Å; S193-Y197 WeakPolarHBondContact O-CD2 3.42Å; L194-Y197 PolarHBondContact O-N 3.3Å; F195-Y197 PolarHBondContact O-N 3.48Å; Y197-W199 VanDerWaalsContact C-N 3.33Å; Y197-W199 PolarHBondContact O-N 3.29Å; Y197-M200 HydrophobicContact CD1-CE 3.71Å; Y197-M200 HydrophobicContact CE1-CE 4.3Å; Y197-M200 PolarHBondContact O-N 3.16Å; Y197-Y201 PolarHBondContact O-N 3.19Å; Y197-N817 HydrophobicContact CE2-CB 4.18Å; Y197-N817 VanDerWaalsContact CE2-O 3.29Å; Y197-N817 WeakPolarHBondContact CE2-O 3.32Å; Y197-N817 PolarHBondContact OH-O 2.83Å; Y197-V821 HydrophobicContact CD1-CG2 3.95Å; Y197-V821 HydrophobicContact CD2-CG2 4.22Å; Y197-V821 HydrophobicContact CE1-CG2 3.55Å; Y197-V821 HydrophobicContact CE2-CG2 3.83Å; Y197-V821 HydrophobicContact CG-CG2 4.24Å; Y197-V821 VanDerWaalsContact CZ-CG2 3.43Å; Y197-V854 WeakPolarHBondContact O-CG1 3.27Å; Y197-Y857 AromaticContact CD1-CD1 3.9Å; Y197-Y857 HydrophobicContact CD1-CD1 3.9Å; Y197-Y857 AromaticContact CD1-CE1 3.91Å; Y197-Y857 HydrophobicContact CD1-CE1 3.91Å; Y197-Y857 HydrophobicContact CD2-CD1 4.18Å; Y197-Y857 AromaticContact CD2-CE1 3.45Å; Y197-Y857 HydrophobicContact CD2-CE1 3.45Å; Y197-Y857 VanDerWaalsContact CD2-CE1 3.45Å; Y197-Y857 HydrophobicContact CE1-CE1 4.28Å; Y197-Y857 AromaticContact CE2-CE1 3.89Å; Y197-Y857 HydrophobicContact CE2-CE1 3.89Å; Y197-Y857 AromaticContact CG-CD1 3.76Å; Y197-Y857 HydrophobicContact CG-CD1 3.76Å; Y197-Y857 AromaticContact CG-CE1 3.52Å; Y197-Y857 HydrophobicContact CG-CE1 3.52Å; Y197-C858 VanDerWaalsContact CB-SG 3.59Å
198	L	94.1	Very high	91.9	Very high	47 Å²	47	28 Å²	28	25%	0.246	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-40.4	173.9	-174.8	143.4	0	0	0	111.6	V10 L194 F195 Y201 L202	V10-L198 HydrophobicContact CG1-CD1 3.97Å; L194-L198 WeakPolarHBondContact O-CB 3.3Å; L194-L198 PolarHBondContact O-N 3.4Å; F195-L198 HydrophobicContact CD2-CD2 4.48Å; F195-L198 PolarHBondContact O-N 3.26Å; L198-Y201 WeakPolarHBondContact O-CB 3.37Å; L198-Y201 PolarHBondContact O-N 3.47Å; L198-L202 HydrophobicContact CD2-CD1 3.66Å; L198-L202 HydrophobicContact CD2-CG 4.01Å; L198-L202 WeakPolarHBondContact O-CG 3.45Å; L198-L202 PolarHBondContact O-N 2.85Å
199	W	95.4	Very high	91.9	Very high	20 Å²	20	30 Å²	30	8%	0.076	16%	0.164	C	C	.	.	H	α-helix	trans	-62.4	-44.2	175.1	177	-100.6	0	0	0	111.1	F195 A196 Y197 Y201 L202 I203 F207 W215 L219 T220 F223	F195-W199 HydrophobicContact CE1-CB 4.25Å; F195-W199 HydrophobicContact CE2-CB 4.44Å; F195-W199 HydrophobicContact CE2-CE3 4.26Å; F195-W199 HydrophobicContact CZ-CB 4.17Å; F195-W199 HydrophobicContact CZ-CD2 4.24Å; F195-W199 AromaticContact CZ-CE3 3.71Å; F195-W199 HydrophobicContact CZ-CE3 3.71Å; F195-W199 HydrophobicContact CZ-CG 4.43Å; F195-W199 HydrophobicContact CZ-CZ3 4.49Å; F195-W199 WeakPolarHBondContact O-CA 3.32Å; F195-W199 WeakPolarHBondContact O-CB 3.4Å; F195-W199 PolarHBondContact O-N 3.34Å; A196-W199 PolarHBondContact O-N 2.9Å; Y197-W199 VanDerWaalsContact C-N 3.33Å; Y197-W199 PolarHBondContact O-N 3.29Å; W199-Y201 VanDerWaalsContact C-N 3.27Å; W199-Y201 PolarHBondContact O-N 3.36Å; W199-L202 HydrophobicContact CE3-CD1 4.33Å; W199-L202 WeakPolarHBondContact O-CB 3.12Å; W199-L202 PolarHBondContact O-N 2.86Å; W199-I203 HydrophobicContact CD2-CG2 4.32Å; W199-I203 HydrophobicContact CZ2-CG2 3.83Å; W199-I203 WeakPolarHBondContact O-CG1 3.06Å; W199-I203 PolarHBondContact O-N 3.29Å; W199-F207 HydrophobicContact CE3-CE2 4.45Å; W199-F207 AromaticContact CH2-CE2 3.84Å; W199-F207 HydrophobicContact CH2-CE2 3.84Å; W199-F207 AromaticContact CZ3-CE2 3.69Å; W199-F207 HydrophobicContact CZ3-CE2 3.69Å; W199-F207 HydrophobicContact CZ3-CZ 4.39Å; W199-W215 HydrophobicContact CH2-CZ3 4.45Å; W199-L219 HydrophobicContact CH2-CD2 3.76Å; W199-L219 HydrophobicContact CZ2-CD2 3.76Å; W199-L219 HydrophobicContact CZ2-CG 4.27Å; W199-T220 PolarHBondContact NE1-OG1 3.23Å; W199-F223 AromaticContact CD2-CE2 3.72Å; W199-F223 HydrophobicContact CD2-CE2 3.72Å; W199-F223 AromaticContact CE2-CE2 3.6Å; W199-F223 HydrophobicContact CE3-CE2 4.14Å; W199-F223 HydrophobicContact CG-CE2 4.11Å; W199-F223 HydrophobicContact CH2-CE2 4.35Å; W199-F223 AromaticContact CZ2-CE2 3.95Å; W199-F223 HydrophobicContact CZ2-CE2 3.95Å; W199-F223 HydrophobicContact CZ3-CE2 4.42Å; W199-F223 AromaticContact NE1-CE2 3.87Å
200	M	92.6	Very high	91.9	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-38.7	173.5	-177.6	175.8	52.1	0	0	112.1	V154 A196 Y197 I203 I204 V821 I825 W829 V854	V154-M200 HydrophobicContact CG2-CE 3.72Å; A196-M200 PolarHBondContact O-N 3.19Å; Y197-M200 HydrophobicContact CD1-CE 3.71Å; Y197-M200 HydrophobicContact CE1-CE 4.3Å; Y197-M200 PolarHBondContact O-N 3.16Å; M200-I203 VanDerWaalsContact O-CG1 3.22Å; M200-I203 WeakPolarHBondContact O-CG1 3.31Å; M200-I204 VanDerWaalsContact O-CG1 3.28Å; M200-I204 WeakPolarHBondContact O-CG1 3.34Å; M200-I204 PolarHBondContact O-N 3.05Å; M200-V821 HydrophobicContact CB-CG1 4.24Å; M200-I825 HydrophobicContact SD-CG1 4.2Å; M200-W829 HydrophobicContact CG-CH2 4.06Å; M200-W829 HydrophobicContact CG-CZ3 4.47Å; M200-W829 HydrophobicContact SD-CH2 4.45Å; M200-V854 HydrophobicContact CE-CB 4.26Å; M200-V854 HydrophobicContact CE-CG1 3.96Å; M200-V854 HydrophobicContact CE-CG2 3.22Å; M200-V854 HydrophobicContact SD-CG2 4.46Å
201	Y	92.7	Very high	92.1	Very high	20 Å²	20	31.5 Å²	31.5	8%	0.078	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-43.5	171.5	169.2	-104.2	0	0	0	112.4	Y197 L198 W199 I203 I204 A205 V206 T855 F916	Y197-Y201 PolarHBondContact O-N 3.19Å; L198-Y201 WeakPolarHBondContact O-CB 3.37Å; L198-Y201 PolarHBondContact O-N 3.47Å; W199-Y201 VanDerWaalsContact C-N 3.27Å; W199-Y201 PolarHBondContact O-N 3.36Å; Y201-I203 PolarHBondContact O-N 3.03Å; Y201-I204 PolarHBondContact O-N 2.63Å; Y201-A205 HydrophobicContact CD2-CB 3.96Å; Y201-A205 HydrophobicContact CE2-CB 3.59Å; Y201-A205 WeakPolarHBondContact O-CB 3.2Å; Y201-A205 PolarHBondContact O-N 3.3Å; Y201-V206 HydrophobicContact CD1-CG2 4.44Å; Y201-V206 HydrophobicContact CE1-CG2 3.86Å; Y201-T855 WeakPolarHBondContact CD2-OG1 3.21Å; Y201-F916 HydrophobicContact CD2-CZ 4.39Å; Y201-F916 AromaticContact CE2-CE1 3.86Å; Y201-F916 HydrophobicContact CE2-CE1 3.86Å; Y201-F916 HydrophobicContact CE2-CE2 4.05Å; Y201-F916 AromaticContact CE2-CZ 3.41Å; Y201-F916 HydrophobicContact CE2-CZ 3.41Å; Y201-F916 VanDerWaalsContact CE2-CZ 3.41Å
202	L	92.9	Very high	92.2	Very high	24 Å²	24	28.2 Å²	28.2	13%	0.126	15%	0.151	C	C	.	.	I	π-helix	trans	-60.6	-43.2	-179.7	-69.9	177.9	0	0	0	112.4	L198 W199 V206 F207	L198-L202 HydrophobicContact CD2-CD1 3.66Å; L198-L202 HydrophobicContact CD2-CG 4.01Å; L198-L202 WeakPolarHBondContact O-CG 3.45Å; L198-L202 PolarHBondContact O-N 2.85Å; W199-L202 HydrophobicContact CE3-CD1 4.33Å; W199-L202 WeakPolarHBondContact O-CB 3.12Å; W199-L202 PolarHBondContact O-N 2.86Å; L202-V206 HydrophobicContact CD2-CB 4.06Å; L202-V206 HydrophobicContact CD2-CG1 4.28Å; L202-V206 HydrophobicContact CD2-CG2 3.91Å; L202-V206 CarbonylContact O-C 3.57Å; L202-V206 WeakPolarHBondContact O-CA 3.49Å; L202-V206 WeakPolarHBondContact O-CB 3.37Å; L202-V206 PolarHBondContact O-N 3.09Å; L202-F207 HydrophobicContact CB-CD2 4.33Å; L202-F207 HydrophobicContact CB-CE2 4.03Å; L202-F207 HydrophobicContact CB-CZ 4.28Å; L202-F207 HydrophobicContact CD1-CE2 4.46Å; L202-F207 HydrophobicContact CD1-CZ 4.18Å; L202-F207 PolarHBondContact O-N 3.1Å
203	I	92.8	Very high	92.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	I	π-helix	trans	-70	-39.8	-178.6	61.1	-171.9	0	0	0	112.2	W199 M200 Y201 F207 E216 W829	W199-I203 HydrophobicContact CD2-CG2 4.32Å; W199-I203 HydrophobicContact CZ2-CG2 3.83Å; W199-I203 WeakPolarHBondContact O-CG1 3.06Å; W199-I203 PolarHBondContact O-N 3.29Å; M200-I203 VanDerWaalsContact O-CG1 3.22Å; M200-I203 WeakPolarHBondContact O-CG1 3.31Å; Y201-I203 PolarHBondContact O-N 3.03Å; I203-F207 HydrophobicContact CG2-CD2 4.31Å; I203-E216 HydrophobicContact CG2-CB 4.14Å; I203-E216 HydrophobicContact CG2-CG 4.36Å; I203-W829 HydrophobicContact CD1-CE3 3.93Å; I203-W829 HydrophobicContact CD1-CZ3 3.44Å; I203-W829 VanDerWaalsContact CD1-CZ3 3.44Å; I203-W829 HydrophobicContact CG1-CZ3 3.99Å
204	I	91	Very high	92.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.175	C	C	.	.	I	π-helix	trans	-81.7	-27.7	-177.2	67.7	-171.4	0	0	0	114.2	M200 Y201 P209 G210 W829 V845 P847 L850	M200-I204 VanDerWaalsContact O-CG1 3.28Å; M200-I204 WeakPolarHBondContact O-CG1 3.34Å; M200-I204 PolarHBondContact O-N 3.05Å; Y201-I204 PolarHBondContact O-N 2.63Å; I204-P209 WeakPolarHBondContact O-CA 3.42Å; I204-G210 PolarHBondContact O-N 3.49Å; I204-W829 HydrophobicContact CG2-CH2 3.63Å; I204-W829 HydrophobicContact CG2-CZ3 3.91Å; I204-V845 HydrophobicContact CG2-CG1 4.11Å; I204-P847 HydrophobicContact CB-CB 4.39Å; I204-P847 HydrophobicContact CG1-CB 4.2Å; I204-L850 HydrophobicContact CD1-CD2 4.29Å; I204-L850 HydrophobicContact CD1-CG 4.21Å
205	A	88.6	Confident	92.5	Very high	27 Å²	27	36.8 Å²	36.8	22%	0.223	19%	0.191	C	C	.	.	I	π-helix	trans	-120.2	-21.7	-169.9	0	0	0	0	0	114.8	Y201 P847	Y201-A205 HydrophobicContact CD2-CB 3.96Å; Y201-A205 HydrophobicContact CE2-CB 3.59Å; Y201-A205 WeakPolarHBondContact O-CB 3.2Å; Y201-A205 PolarHBondContact O-N 3.3Å; A205-P847 HydrophobicContact CB-CB 4.31Å
206	V	90.2	Very high	92.5	Very high	51 Å²	51	34.1 Å²	34.1	31%	0.309	18%	0.179	S	C	.	.	I	π-helix	trans	-116	-52.7	-169.4	-176.8	0	0	0	0	113.2	I13 Y201 L202	I13-V206 HydrophobicContact CG2-CG1 3.87Å; I13-V206 HydrophobicContact CG2-CG2 3.83Å; Y201-V206 HydrophobicContact CD1-CG2 4.44Å; Y201-V206 HydrophobicContact CE1-CG2 3.86Å; L202-V206 HydrophobicContact CD2-CB 4.06Å; L202-V206 HydrophobicContact CD2-CG1 4.28Å; L202-V206 HydrophobicContact CD2-CG2 3.91Å; L202-V206 CarbonylContact O-C 3.57Å; L202-V206 WeakPolarHBondContact O-CA 3.49Å; L202-V206 WeakPolarHBondContact O-CB 3.37Å; L202-V206 PolarHBondContact O-N 3.09Å
207	F	91.6	Very high	92.5	Very high	99 Å²	99	34.1 Å²	34.1	43%	0.434	18%	0.179	S	C	.	.	I	π-helix	trans	-76.2	-60.5	-175.4	-65.8	-26.3	0	0	0	111.8	W199 L202 I203 E216	W199-F207 HydrophobicContact CE3-CE2 4.45Å; W199-F207 AromaticContact CH2-CE2 3.84Å; W199-F207 HydrophobicContact CH2-CE2 3.84Å; W199-F207 AromaticContact CZ3-CE2 3.69Å; W199-F207 HydrophobicContact CZ3-CE2 3.69Å; W199-F207 HydrophobicContact CZ3-CZ 4.39Å; L202-F207 HydrophobicContact CB-CD2 4.33Å; L202-F207 HydrophobicContact CB-CE2 4.03Å; L202-F207 HydrophobicContact CB-CZ 4.28Å; L202-F207 HydrophobicContact CD1-CE2 4.46Å; L202-F207 HydrophobicContact CD1-CZ 4.18Å; L202-F207 PolarHBondContact O-N 3.1Å; I203-F207 HydrophobicContact CG2-CD2 4.31Å; F207-E216 WeakPolarHBondContact CB-OE1 3.44Å
208	T	89.4	Confident	92.6	Very high	28 Å²	28	37.2 Å²	37.2	17%	0.172	20%	0.195	C	C	.	.	S	Bend	trans	-129.7	85.5	177.4	44	0	0	0	0	109.1	G210 V211 E213 E216	T208-G210 PolarHBondContact O-N 3.35Å; T208-G210 VanDerWaalsContact O-N 3.14Å; T208-V211 WeakPolarHBondContact CB-O 3.29Å; T208-V211 PolarHBondContact O-N 3.16Å; T208-V211 VanDerWaalsContact O-N 3.13Å; T208-V211 PolarHBondContact OG1-O 2.88Å; T208-E213 HydrophobicContact CG2-CG 4.17Å; T208-E216 VanDerWaalsContact OG1-CD 3.29Å; T208-E216 PolarHBondContact OG1-OE1 3.34Å; T208-E216 VanDerWaalsContact OG1-OE1 3.08Å; T208-E216 PolarHBondContact OG1-OE2 3Å
209	P	88.3	Confident	92.7	Very high	90 Å²	90	37.3 Å²	37.3	58%	0.584	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	123.5	-172.6	25.1	-34.2	0	0	0	111	I204 V211	I204-P209 WeakPolarHBondContact O-CA 3.42Å; P209-V211 VanDerWaalsContact C-N 3.28Å; P209-V211 PolarHBondContact O-N 3.42Å
210	G	87.2	Confident	92.7	Very high	8 Å²	8	36.4 Å²	36.4	8%	0.082	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	-4.5	177.5	0	0	0	0	0	116	I204 T208 L844 V845	I204-G210 PolarHBondContact O-N 3.49Å; T208-G210 PolarHBondContact O-N 3.35Å; T208-G210 VanDerWaalsContact O-N 3.14Å; G210-L844 WeakPolarHBondContact O-CA 3.45Å; G210-V845 CarbonylContact C-O 3.58Å; G210-V845 VanDerWaalsContact CA-O 3.24Å; G210-V845 WeakPolarHBondContact CA-O 3.38Å; G210-V845 PolarHBondContact O-N 3.46Å
211	V	92.2	Very high	92.8	Very high	32 Å²	32	39.9 Å²	39.9	19%	0.194	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-135.6	126.1	-176.5	-173.6	0	0	0	0	109.5	T208 P209 Q842 L844	T208-V211 WeakPolarHBondContact CB-O 3.29Å; T208-V211 PolarHBondContact O-N 3.16Å; T208-V211 VanDerWaalsContact O-N 3.13Å; T208-V211 PolarHBondContact OG1-O 2.88Å; P209-V211 VanDerWaalsContact C-N 3.28Å; P209-V211 PolarHBondContact O-N 3.42Å; V211-Q842 HydrophobicContact CG1-CB 3.98Å; V211-Q842 HydrophobicContact CG1-CG 4.37Å; V211-L844 HydrophobicContact CG2-CD2 3.83Å
212	V	94	Very high	93	Very high	4 Å²	4	43 Å²	43	2%	0.024	22%	0.224	C	C	.	.			trans	-100.6	118.3	175.9	174.1	0	0	0	0	109.4	E216 A217 W829 F843 V845	V212-E216 HydrophobicContact CG1-CB 4.4Å; V212-A217 HydrophobicContact CG1-CB 4.06Å; V212-W829 HydrophobicContact CG1-CE3 4.04Å; V212-W829 HydrophobicContact CG2-CE3 3.92Å; V212-W829 HydrophobicContact CG2-CZ3 3.96Å; V212-F843 HydrophobicContact CB-CD1 3.83Å; V212-F843 HydrophobicContact CB-CE1 4.25Å; V212-F843 HydrophobicContact CG1-CD1 4.32Å; V212-F843 PolarHBondContact N-O 3.42Å; V212-V845 HydrophobicContact CB-CG2 4.32Å; V212-V845 HydrophobicContact CG2-CB 3.96Å; V212-V845 HydrophobicContact CG2-CG2 3.66Å
213	E	94.3	Very high	93.1	Very high	89 Å²	89	43 Å²	43	42%	0.416	22%	0.223	S	C	.	.			trans	-78.7	156.2	178.2	-65.8	-170	176.3	0	0	111.9	T208 W215 E216 A217	T208-E213 HydrophobicContact CG2-CG 4.17Å; E213-W215 VanDerWaalsContact C-N 3.25Å; E213-W215 PolarHBondContact O-N 3.43Å; E213-W215 PolarHBondContact OE2-NE1 3.25Å; E213-E216 HydrophobicContact CB-CG 4.18Å; E213-E216 PolarHBondContact N-OE2 3.25Å; E213-E216 PolarHBondContact O-N 3.48Å; E213-E216 VanDerWaalsContact O-N 3.12Å; E213-A217 PolarHBondContact O-N 2.81Å; E213-A217 VanDerWaalsContact O-N 3.1Å
214	V	95.2	Very high	93.2	Very high	51 Å²	51	44.5 Å²	44.5	31%	0.309	23%	0.23	S	C	.	.	H	α-helix	trans	-57.1	-40.4	-179.2	-179.3	0	0	0	0	111.7	L218 A833 I834 A837	V214-L218 HydrophobicContact CG1-CD1 3.83Å; V214-L218 HydrophobicContact CG1-CG 4.29Å; V214-L218 WeakPolarHBondContact O-CB 3.31Å; V214-L218 VanDerWaalsContact O-CG 3.27Å; V214-L218 WeakPolarHBondContact O-CG 3.11Å; V214-L218 PolarHBondContact O-N 3.32Å; V214-A833 HydrophobicContact CG2-CB 4.09Å; V214-I834 HydrophobicContact CG1-CG1 4.02Å; V214-A837 HydrophobicContact CG2-CB 3.7Å
215	W	95.6	Very high	93.3	Very high	125 Å²	125	47.3 Å²	47.3	47%	0.473	25%	0.249	S	C	.	.	H	α-helix	trans	-70.5	-34	-179.6	73.6	-93.1	0	0	0	112.2	W199 E213 L219	W199-W215 HydrophobicContact CH2-CZ3 4.45Å; E213-W215 VanDerWaalsContact C-N 3.25Å; E213-W215 PolarHBondContact O-N 3.43Å; E213-W215 PolarHBondContact OE2-NE1 3.25Å; W215-L219 HydrophobicContact CE3-CD2 4.23Å; W215-L219 HydrophobicContact CZ3-CD2 3.97Å; W215-L219 WeakPolarHBondContact O-CB 3.34Å; W215-L219 PolarHBondContact O-N 3.5Å
216	E	95	Very high	93.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.3	-44.5	177.5	-64	-179.8	134.5	0	0	110.7	I203 F207 T208 V212 E213 L219 T220	I203-E216 HydrophobicContact CG2-CB 4.14Å; I203-E216 HydrophobicContact CG2-CG 4.36Å; F207-E216 WeakPolarHBondContact CB-OE1 3.44Å; T208-E216 VanDerWaalsContact OG1-CD 3.29Å; T208-E216 PolarHBondContact OG1-OE1 3.34Å; T208-E216 VanDerWaalsContact OG1-OE1 3.08Å; T208-E216 PolarHBondContact OG1-OE2 3Å; V212-E216 HydrophobicContact CG1-CB 4.4Å; E213-E216 HydrophobicContact CB-CG 4.18Å; E213-E216 PolarHBondContact N-OE2 3.25Å; E213-E216 PolarHBondContact O-N 3.48Å; E213-E216 VanDerWaalsContact O-N 3.12Å; E216-L219 PolarHBondContact O-N 2.92Å; E216-T220 WeakPolarHBondContact O-CB 3.45Å; E216-T220 PolarHBondContact O-N 3.04Å; E216-T220 PolarHBondContact O-OG1 2.85Å
217	A	94.7	Very high	93.7	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-48.7	177	0	0	0	0	0	111.7	V212 E213 L219 T220 F221 W829 S830 A833	V212-A217 HydrophobicContact CG1-CB 4.06Å; E213-A217 PolarHBondContact O-N 2.81Å; E213-A217 VanDerWaalsContact O-N 3.1Å; A217-L219 VanDerWaalsContact C-N 3.34Å; A217-L219 PolarHBondContact O-N 3.03Å; A217-T220 WeakPolarHBondContact O-CB 3.16Å; A217-T220 PolarHBondContact O-N 3.17Å; A217-F221 PolarHBondContact O-N 3.42Å; A217-W829 HydrophobicContact CB-CB 4.06Å; A217-S830 PolarHBondContact O-OG 3.01Å; A217-S830 VanDerWaalsContact O-OG 3.1Å; A217-A833 HydrophobicContact CB-CB 4.17Å
218	L	96.4	Very high	93.7	Very high	65 Å²	65	42.8 Å²	42.8	34%	0.34	22%	0.223	S	C	.	.	H	α-helix	trans	-63	-39.9	177.5	-73.5	175.9	0	0	0	112.2	V214 T220 F221 I222 S830 I834	V214-L218 HydrophobicContact CG1-CD1 3.83Å; V214-L218 HydrophobicContact CG1-CG 4.29Å; V214-L218 WeakPolarHBondContact O-CB 3.31Å; V214-L218 VanDerWaalsContact O-CG 3.27Å; V214-L218 WeakPolarHBondContact O-CG 3.11Å; V214-L218 PolarHBondContact O-N 3.32Å; L218-T220 VanDerWaalsContact C-N 3.33Å; L218-F221 PolarHBondContact O-N 3.08Å; L218-I222 WeakPolarHBondContact O-CB 3.24Å; L218-I222 VanDerWaalsContact O-CG1 3.24Å; L218-I222 WeakPolarHBondContact O-CG1 3.32Å; L218-I222 PolarHBondContact O-N 3.09Å; L218-S830 PolarHBondContact N-OG 2.88Å; L218-I834 HydrophobicContact CD2-CD1 4.37Å
219	L	96.5	Very high	93.8	Very high	50 Å²	50	46.1 Å²	46.1	26%	0.262	24%	0.239	S	C	.	.	H	α-helix	trans	-65.6	-39.3	177.5	-176.7	60.6	0	0	0	111.3	W199 W215 E216 A217 F221 I222 F223	W199-L219 HydrophobicContact CH2-CD2 3.76Å; W199-L219 HydrophobicContact CZ2-CD2 3.76Å; W199-L219 HydrophobicContact CZ2-CG 4.27Å; W215-L219 HydrophobicContact CE3-CD2 4.23Å; W215-L219 HydrophobicContact CZ3-CD2 3.97Å; W215-L219 WeakPolarHBondContact O-CB 3.34Å; W215-L219 PolarHBondContact O-N 3.5Å; E216-L219 PolarHBondContact O-N 2.92Å; A217-L219 VanDerWaalsContact C-N 3.34Å; A217-L219 PolarHBondContact O-N 3.03Å; L219-F221 VanDerWaalsContact C-N 3.28Å; L219-F221 PolarHBondContact O-N 3.12Å; L219-I222 PolarHBondContact O-N 3.34Å; L219-F223 HydrophobicContact CD1-CE1 4.06Å; L219-F223 HydrophobicContact CD1-CZ 4.02Å; L219-F223 HydrophobicContact CD2-CE2 4.34Å; L219-F223 HydrophobicContact CD2-CZ 3.99Å; L219-F223 HydrophobicContact CG-CE1 4.26Å; L219-F223 HydrophobicContact CG-CE2 3.89Å; L219-F223 HydrophobicContact CG-CZ 3.72Å; L219-F223 WeakPolarHBondContact O-CD2 3.06Å; L219-F223 WeakPolarHBondContact O-CG 3.4Å; L219-F223 PolarHBondContact O-N 2.89Å
220	T	95.7	Very high	93.8	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-57.6	-43.4	173.1	-54.6	0	0	0	0	111	W199 E216 A217 L218 F223 F822	W199-T220 PolarHBondContact NE1-OG1 3.23Å; E216-T220 WeakPolarHBondContact O-CB 3.45Å; E216-T220 PolarHBondContact O-N 3.04Å; E216-T220 PolarHBondContact O-OG1 2.85Å; A217-T220 WeakPolarHBondContact O-CB 3.16Å; A217-T220 PolarHBondContact O-N 3.17Å; L218-T220 VanDerWaalsContact C-N 3.33Å; T220-F223 PolarHBondContact O-N 3Å; T220-F822 HydrophobicContact CG2-CD1 4.33Å; T220-F822 WeakPolarHBondContact O-CA 3.22Å
221	F	95.3	Very high	93.8	Very high	74 Å²	74	43.5 Å²	43.5	33%	0.325	22%	0.221	S	C	.	.	H	α-helix	trans	-67.1	-40.7	174.8	-178.1	-132.3	0	0	0	112.9	A217 L218 L219 F223 F224 P225 F822 L823	A217-F221 PolarHBondContact O-N 3.42Å; L218-F221 PolarHBondContact O-N 3.08Å; L219-F221 VanDerWaalsContact C-N 3.28Å; L219-F221 PolarHBondContact O-N 3.12Å; F221-F223 VanDerWaalsContact C-N 3.26Å; F221-F223 PolarHBondContact O-N 3.37Å; F221-F224 WeakPolarHBondContact O-CB 3.34Å; F221-F224 PolarHBondContact O-N 2.84Å; F221-F224 VanDerWaalsContact O-N 3.15Å; F221-P225 WeakPolarHBondContact O-CD 3.29Å; F221-F822 WeakPolarHBondContact CA-O 3.3Å; F221-L823 HydrophobicContact CD2-CD1 4.14Å; F221-L823 HydrophobicContact CE2-CD1 3.56Å
222	I	95.9	Very high	93.6	Very high	84 Å²	84	46.7 Å²	46.7	43%	0.431	23%	0.23	S	C	.	.	H	α-helix	trans	-67	-23.7	177.4	-70.2	164.9	0	0	0	112.3	L218 L219 F224 P225 I226	L218-I222 WeakPolarHBondContact O-CB 3.24Å; L218-I222 VanDerWaalsContact O-CG1 3.24Å; L218-I222 WeakPolarHBondContact O-CG1 3.32Å; L218-I222 PolarHBondContact O-N 3.09Å; L219-I222 PolarHBondContact O-N 3.34Å; I222-F224 PolarHBondContact O-N 3.37Å; I222-P225 WeakPolarHBondContact O-CD 3.22Å; I222-P225 WeakPolarHBondContact O-CG 3.28Å; I222-I226 HydrophobicContact CG2-CD1 3.8Å; I222-I226 HydrophobicContact CG2-CG1 4.35Å; I222-I226 WeakPolarHBondContact O-CG1 3.44Å; I222-I226 PolarHBondContact O-N 3.49Å
223	F	95.6	Very high	93.3	Very high	24 Å²	24	49.6 Å²	49.6	11%	0.105	25%	0.246	C	C	.	.	H	α-helix	trans	-63.1	-23.8	173.2	-73.3	-40.9	0	0	0	113.4	W192 F195 W199 L219 T220 F221 I226 I227 F822	W192-F223 HydrophobicContact CH2-CD1 4.08Å; W192-F223 HydrophobicContact CH2-CE1 4.48Å; W192-F223 HydrophobicContact CZ3-CB 4.28Å; W192-F223 AromaticContact CZ3-CD1 3.81Å; W192-F223 HydrophobicContact CZ3-CD1 3.81Å; W192-F223 HydrophobicContact CZ3-CE1 4.39Å; W192-F223 HydrophobicContact CZ3-CG 4.11Å; F195-F223 HydrophobicContact CE1-CD2 4.21Å; F195-F223 HydrophobicContact CE1-CE1 4.47Å; F195-F223 AromaticContact CE1-CE2 3.89Å; F195-F223 HydrophobicContact CE1-CE2 3.89Å; F195-F223 HydrophobicContact CE1-CZ 4.05Å; F195-F223 HydrophobicContact CZ-CE2 4.26Å; F195-F223 HydrophobicContact CZ-CZ 4.25Å; W199-F223 AromaticContact CD2-CE2 3.72Å; W199-F223 HydrophobicContact CD2-CE2 3.72Å; W199-F223 AromaticContact CE2-CE2 3.6Å; W199-F223 HydrophobicContact CE3-CE2 4.14Å; W199-F223 HydrophobicContact CG-CE2 4.11Å; W199-F223 HydrophobicContact CH2-CE2 4.35Å; W199-F223 AromaticContact CZ2-CE2 3.95Å; W199-F223 HydrophobicContact CZ2-CE2 3.95Å; W199-F223 HydrophobicContact CZ3-CE2 4.42Å; W199-F223 AromaticContact NE1-CE2 3.87Å; L219-F223 HydrophobicContact CD1-CE1 4.06Å; L219-F223 HydrophobicContact CD1-CZ 4.02Å; L219-F223 HydrophobicContact CD2-CE2 4.34Å; L219-F223 HydrophobicContact CD2-CZ 3.99Å; L219-F223 HydrophobicContact CG-CE1 4.26Å; L219-F223 HydrophobicContact CG-CE2 3.89Å; L219-F223 HydrophobicContact CG-CZ 3.72Å; L219-F223 WeakPolarHBondContact O-CD2 3.06Å; L219-F223 WeakPolarHBondContact O-CG 3.4Å; L219-F223 PolarHBondContact O-N 2.89Å; T220-F223 PolarHBondContact O-N 3Å; F221-F223 VanDerWaalsContact C-N 3.26Å; F221-F223 PolarHBondContact O-N 3.37Å; F223-I226 HydrophobicContact CD1-CD1 3.94Å; F223-I226 HydrophobicContact CE1-CD1 4.44Å; F223-I226 PolarHBondContact O-N 2.8Å; F223-I227 WeakPolarHBondContact O-CG2 3.14Å; F223-I227 PolarHBondContact O-N 3.23Å; F223-F822 HydrophobicContact CB-CD1 3.5Å; F223-F822 VanDerWaalsContact CB-CD1 3.5Å; F223-F822 HydrophobicContact CB-CD2 4.25Å; F223-F822 HydrophobicContact CB-CE1 3.57Å; F223-F822 HydrophobicContact CB-CE2 4.31Å; F223-F822 HydrophobicContact CB-CG 3.87Å; F223-F822 HydrophobicContact CB-CZ 4Å; F223-F822 HydrophobicContact CD2-CD1 4.19Å; F223-F822 AromaticContact CD2-CE1 3.82Å; F223-F822 HydrophobicContact CD2-CE1 3.82Å; F223-F822 HydrophobicContact CG-CD1 4.33Å; F223-F822 HydrophobicContact CG-CE1 4.06Å
224	F	94	Very high	92.7	Very high	32 Å²	32	46.3 Å²	46.3	14%	0.14	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-55	175.4	176.2	-114.4	0	0	0	113.5	T120 F221 I222 I226 I227 V228 V819 F822 L823	T120-F224 HydrophobicContact CG2-CZ 4.13Å; F221-F224 WeakPolarHBondContact O-CB 3.34Å; F221-F224 PolarHBondContact O-N 2.84Å; F221-F224 VanDerWaalsContact O-N 3.15Å; I222-F224 PolarHBondContact O-N 3.37Å; F224-I226 PolarHBondContact O-N 3.44Å; F224-I227 WeakPolarHBondContact O-CG2 3.39Å; F224-I227 PolarHBondContact O-N 3.43Å; F224-V228 HydrophobicContact CE2-CG2 4.24Å; F224-V228 HydrophobicContact CZ-CG2 4.43Å; F224-V228 VanDerWaalsContact O-CG2 3.29Å; F224-V228 WeakPolarHBondContact O-CG2 3.17Å; F224-V228 PolarHBondContact O-N 3.03Å; F224-V819 HydrophobicContact CD2-CG1 4.48Å; F224-V819 HydrophobicContact CD2-CG2 4.13Å; F224-V819 HydrophobicContact CE2-CB 4.49Å; F224-V819 HydrophobicContact CE2-CG1 4.08Å; F224-V819 HydrophobicContact CE2-CG2 3.74Å; F224-F822 HydrophobicContact CB-CB 3.87Å; F224-L823 HydrophobicContact CZ-CD2 4.43Å
225	P	93.9	Very high	92	Very high	60 Å²	60	45.6 Å²	45.6	39%	0.39	23%	0.228	S	C	.	.	H	α-helix	trans	-63.5	-30	173.7	21.5	-31.6	0	0	0	112.8	F221 I222 V228 I229	F221-P225 WeakPolarHBondContact O-CD 3.29Å; I222-P225 WeakPolarHBondContact O-CD 3.22Å; I222-P225 WeakPolarHBondContact O-CG 3.28Å; P225-V228 PolarHBondContact O-N 2.93Å; P225-I229 VanDerWaalsContact O-CG1 3.29Å; P225-I229 WeakPolarHBondContact O-CG1 3.47Å; P225-I229 PolarHBondContact O-N 2.96Å
226	I	93.9	Very high	91	Very high	60 Å²	60	41.5 Å²	41.5	31%	0.308	22%	0.217	S	C	.	.	H	α-helix	trans	-64.1	-48.7	177.2	-67.6	170.2	0	0	0	111.5	W192 I222 F223 F224 V228 I229 C230	W192-I226 HydrophobicContact CH2-CG2 3.73Å; W192-I226 HydrophobicContact CZ2-CG2 3.84Å; I222-I226 HydrophobicContact CG2-CD1 3.8Å; I222-I226 HydrophobicContact CG2-CG1 4.35Å; I222-I226 WeakPolarHBondContact O-CG1 3.44Å; I222-I226 PolarHBondContact O-N 3.49Å; F223-I226 HydrophobicContact CD1-CD1 3.94Å; F223-I226 HydrophobicContact CE1-CD1 4.44Å; F223-I226 PolarHBondContact O-N 2.8Å; F224-I226 PolarHBondContact O-N 3.44Å; I226-V228 VanDerWaalsContact C-N 3.27Å; I226-V228 PolarHBondContact O-N 3.32Å; I226-I229 PolarHBondContact O-N 2.93Å; I226-C230 WeakPolarHBondContact O-CB 3.23Å; I226-C230 PolarHBondContact O-N 3.31Å; I226-C230 PolarHBondContact O-SG 3.22Å; I226-C230 VanDerWaalsContact O-SG 3.35Å
227	I	92.3	Very high	89.6	Confident	4 Å²	4	47 Å²	47	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-60.9	-39.2	178.1	-174.7	-175.8	0	0	0	111	W192 F223 F224 C230 A231 A818 F822	W192-I227 HydrophobicContact CB-CB 4.46Å; W192-I227 HydrophobicContact CB-CD1 3.37Å; W192-I227 HydrophobicContact CB-CG1 3.77Å; W192-I227 HydrophobicContact CD2-CB 4.22Å; W192-I227 HydrophobicContact CD2-CG1 4.31Å; W192-I227 HydrophobicContact CG-CB 4.18Å; W192-I227 HydrophobicContact CG-CD1 3.94Å; W192-I227 HydrophobicContact CG-CG1 3.74Å; F223-I227 WeakPolarHBondContact O-CG2 3.14Å; F223-I227 PolarHBondContact O-N 3.23Å; F224-I227 WeakPolarHBondContact O-CG2 3.39Å; F224-I227 PolarHBondContact O-N 3.43Å; I227-C230 PolarHBondContact O-N 2.8Å; I227-A231 WeakPolarHBondContact O-CB 3.45Å; I227-A231 PolarHBondContact O-N 3.47Å; I227-A818 HydrophobicContact CD1-CB 3.85Å; I227-F822 HydrophobicContact CG2-CD2 4.32Å
228	V	91.6	Very high	87.6	Confident	17 Å²	17	50.5 Å²	50.5	10%	0.103	26%	0.259	C	S	.	.	H	α-helix	trans	-62.6	-46.8	178.5	174.6	0	0	0	0	110.9	V116 T120 F224 P225 I226 A231 Y232	V116-V228 HydrophobicContact CB-CG1 4.5Å; V116-V228 HydrophobicContact CG1-CG1 3.85Å; V116-V228 HydrophobicContact CG2-CG1 4.29Å; T120-V228 HydrophobicContact CG2-CB 4.25Å; T120-V228 HydrophobicContact CG2-CG1 3.7Å; T120-V228 HydrophobicContact CG2-CG2 3.47Å; T120-V228 VanDerWaalsContact CG2-CG2 3.47Å; F224-V228 HydrophobicContact CE2-CG2 4.24Å; F224-V228 HydrophobicContact CZ-CG2 4.43Å; F224-V228 VanDerWaalsContact O-CG2 3.29Å; F224-V228 WeakPolarHBondContact O-CG2 3.17Å; F224-V228 PolarHBondContact O-N 3.03Å; P225-V228 PolarHBondContact O-N 2.93Å; I226-V228 VanDerWaalsContact C-N 3.27Å; I226-V228 PolarHBondContact O-N 3.32Å; V228-A231 PolarHBondContact O-N 3.45Å; V228-Y232 WeakPolarHBondContact O-CB 3.43Å; V228-Y232 PolarHBondContact O-N 2.97Å
229	I	91.2	Very high	85.2	Confident	99 Å²	99	53.5 Å²	53.5	51%	0.508	27%	0.269	S	S	.	.	H	α-helix	trans	-63.2	-45.5	176.3	-67.4	165.7	0	0	0	110.5	P225 I226 A231 Y232 L233	P225-I229 VanDerWaalsContact O-CG1 3.29Å; P225-I229 WeakPolarHBondContact O-CG1 3.47Å; P225-I229 PolarHBondContact O-N 2.96Å; I226-I229 PolarHBondContact O-N 2.93Å; I229-A231 VanDerWaalsContact C-N 3.32Å; I229-A231 PolarHBondContact O-N 3.17Å; I229-Y232 PolarHBondContact O-N 2.93Å; I229-L233 HydrophobicContact CG2-CD1 4Å; I229-L233 HydrophobicContact CG2-CG 4.32Å; I229-L233 WeakPolarHBondContact O-CB 3.36Å; I229-L233 VanDerWaalsContact O-CG 3.27Å; I229-L233 WeakPolarHBondContact O-CG 3.42Å; I229-L233 PolarHBondContact O-N 3.25Å
230	C	90.3	Very high	82.8	Confident	43 Å²	43	57.7 Å²	57.7	29%	0.291	29%	0.285	S	S	.	.	H	α-helix	trans	-60.3	-41.1	178	-73.4	0	0	0	0	112.4	I188 I226 I227 L233 A234	I188-C230 HydrophobicContact CG2-CB 4.28Å; I226-C230 WeakPolarHBondContact O-CB 3.23Å; I226-C230 PolarHBondContact O-N 3.31Å; I226-C230 PolarHBondContact O-SG 3.22Å; I226-C230 VanDerWaalsContact O-SG 3.35Å; I227-C230 PolarHBondContact O-N 2.8Å; C230-L233 PolarHBondContact O-N 2.78Å; C230-A234 WeakPolarHBondContact O-CB 3.5Å; C230-A234 PolarHBondContact O-N 3.49Å; C230-A234 VanDerWaalsContact O-N 3.1Å
231	A	87.1	Confident	80.3	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-67.9	-42.5	177.2	0	0	0	0	0	111.9	T115 L119 I227 V228 I229 L233 A234 D235	T115-A231 HydrophobicContact CG2-CB 3.87Å; L119-A231 HydrophobicContact CD1-CB 3.18Å; I227-A231 WeakPolarHBondContact O-CB 3.45Å; I227-A231 PolarHBondContact O-N 3.47Å; V228-A231 PolarHBondContact O-N 3.45Å; I229-A231 VanDerWaalsContact C-N 3.32Å; I229-A231 PolarHBondContact O-N 3.17Å; A231-L233 PolarHBondContact O-N 2.77Å; A231-A234 WeakPolarHBondContact O-CB 3.1Å; A231-A234 PolarHBondContact O-N 3.44Å; A231-A234 VanDerWaalsContact O-N 3.16Å; A231-D235 PolarHBondContact O-N 2.96Å
232	Y	87.3	Confident	77.8	Confident	98 Å²	98	68.2 Å²	68.2	38%	0.384	33%	0.331	S	S	.	.	H	α-helix	trans	-59	-44.5	173.8	176.1	-104.5	0	0	0	112.3	N113 V116 V228 I229 A234 D235 T236	N113-Y232 HydrophobicContact CB-CD2 4.06Å; N113-Y232 HydrophobicContact CB-CE2 3.98Å; V116-Y232 HydrophobicContact CG2-CD2 3.69Å; V116-Y232 HydrophobicContact CG2-CG 4.09Å; V228-Y232 WeakPolarHBondContact O-CB 3.43Å; V228-Y232 PolarHBondContact O-N 2.97Å; I229-Y232 PolarHBondContact O-N 2.93Å; Y232-A234 VanDerWaalsContact C-N 3.26Å; Y232-A234 PolarHBondContact O-N 3.36Å; Y232-D235 PolarHBondContact O-N 3.39Å; Y232-T236 HydrophobicContact CD1-CG2 4.38Å; Y232-T236 HydrophobicContact CD2-CG2 3.96Å; Y232-T236 HydrophobicContact CE1-CG2 3.98Å; Y232-T236 HydrophobicContact CE2-CG2 3.51Å; Y232-T236 HydrophobicContact CG-CG2 4.38Å; Y232-T236 WeakPolarHBondContact O-CB 3.47Å; Y232-T236 WeakPolarHBondContact O-CG2 3.47Å; Y232-T236 PolarHBondContact O-N 3.08Å; Y232-T236 PolarHBondContact O-OG1 3.41Å
233	L	87.1	Confident	75	Confident	66 Å²	66	71.3 Å²	71.3	35%	0.346	34%	0.342	S	S	.	.	H	α-helix	trans	-64.7	-30.7	177.1	-69.9	176.6	0	0	0	112.8	I229 C230 A231 T236	I229-L233 HydrophobicContact CG2-CD1 4Å; I229-L233 HydrophobicContact CG2-CG 4.32Å; I229-L233 WeakPolarHBondContact O-CB 3.36Å; I229-L233 VanDerWaalsContact O-CG 3.27Å; I229-L233 WeakPolarHBondContact O-CG 3.42Å; I229-L233 PolarHBondContact O-N 3.25Å; C230-L233 PolarHBondContact O-N 2.78Å; A231-L233 PolarHBondContact O-N 2.77Å; L233-T236 PolarHBondContact O-OG1 3.24Å
234	A	83.1	Confident	72.4	Confident	20 Å²	20	74.8 Å²	74.8	17%	0.165	36%	0.361	C	S	.	.	H	α-helix	trans	-74.3	-40	176.4	0	0	0	0	0	112.7	I188 C230 A231 Y232	I188-A234 HydrophobicContact CD1-CB 3.21Å; C230-A234 WeakPolarHBondContact O-CB 3.5Å; C230-A234 PolarHBondContact O-N 3.49Å; C230-A234 VanDerWaalsContact O-N 3.1Å; A231-A234 WeakPolarHBondContact O-CB 3.1Å; A231-A234 PolarHBondContact O-N 3.44Å; A231-A234 VanDerWaalsContact O-N 3.16Å; Y232-A234 VanDerWaalsContact C-N 3.26Å; Y232-A234 PolarHBondContact O-N 3.36Å
235	D	79.8	Confident	69.9	Low	35 Å²	35	80.9 Å²	80.9	19%	0.187	39%	0.387	C	S	.	.	H	α-helix	trans	-72.5	-44.6	-178.9	-171.7	44.2	0	0	0	112.3	N113 T115 H182 V185 A231 Y232 K237	N113-D235 PolarHBondContact ND2-OD2 3.05Å; T115-D235 HydrophobicContact CG2-CB 4.21Å; T115-D235 WeakPolarHBondContact OG1-CB 3.27Å; T115-D235 PolarHBondContact OG1-OD2 3.13Å; H182-D235 IonicContact ND1-OD1 2.73Å; V185-D235 HydrophobicContact CG2-CB 4.05Å; A231-D235 PolarHBondContact O-N 2.96Å; Y232-D235 PolarHBondContact O-N 3.39Å; D235-K237 PolarHBondContact O-N 3.1Å
236	T	74.1	Confident	67.2	Low	40 Å²	40	85.8 Å²	85.8	25%	0.245	40%	0.403	C	S	.	.	S	Bend	trans	-64	-9.8	177.3	53.7	0	0	0	0	113.8	Y232 L233 I238	Y232-T236 HydrophobicContact CD1-CG2 4.38Å; Y232-T236 HydrophobicContact CD2-CG2 3.96Å; Y232-T236 HydrophobicContact CE1-CG2 3.98Å; Y232-T236 HydrophobicContact CE2-CG2 3.51Å; Y232-T236 HydrophobicContact CG-CG2 4.38Å; Y232-T236 WeakPolarHBondContact O-CB 3.47Å; Y232-T236 WeakPolarHBondContact O-CG2 3.47Å; Y232-T236 PolarHBondContact O-N 3.08Å; Y232-T236 PolarHBondContact O-OG1 3.41Å; L233-T236 PolarHBondContact O-OG1 3.24Å; T236-I238 PolarHBondContact O-N 3.31Å
237	K	65	Low	64.1	Low	115 Å²	115	90.4 Å²	90.4	50%	0.5	42%	0.42	S	S	.	.			trans	50.5	17	178.3	-68.5	175.3	-175	171.7	0	114.6	D235 F239 F240 K241	D235-K237 PolarHBondContact O-N 3.1Å; K237-F239 PolarHBondContact O-N 3.22Å; K237-F239 VanDerWaalsContact O-N 3.17Å; K237-F240 PolarHBondContact O-N 3.12Å; K237-K241 PolarHBondContact O-N 2.82Å
238	I	53.7	Low	61.6	Low	73 Å²	73	98.6 Å²	98.6	37%	0.374	45%	0.452	S	S	.	.	H	α-helix	trans	-56.1	-40.9	-172.6	-71.5	168.9	0	0	0	110.9	T236 K242	T236-I238 PolarHBondContact O-N 3.31Å; I238-K242 HydrophobicContact CG2-CD 4.18Å; I238-K242 VanDerWaalsContact O-CB 3.3Å; I238-K242 WeakPolarHBondContact O-CB 3.28Å; I238-K242 WeakPolarHBondContact O-CG 3.28Å; I238-K242 PolarHBondContact O-N 2.71Å; I238-K242 VanDerWaalsContact O-N 3.08Å
239	F	45.4	Very low	59.1	Low	129 Å²	129	107.1 Å²	107.1	57%	0.566	48%	0.483	S	S	*	.	H	α-helix	trans	-69.1	-42	178.6	-80.9	-84.5	0	0	0	112.8	K237 F243	K237-F239 PolarHBondContact O-N 3.22Å; K237-F239 VanDerWaalsContact O-N 3.17Å; F239-F243 WeakPolarHBondContact O-CB 3.48Å; F239-F243 PolarHBondContact O-N 2.98Å
240	F	46.4	Very low	56.8	Low	137 Å²	137	105 Å²	105	60%	0.601	48%	0.48	S	S	*	.	H	α-helix	trans	-71.7	-43.7	179.9	-79.4	-79.2	0	0	0	112.2	K237 K242 F243 L244	K237-F240 PolarHBondContact O-N 3.12Å; F240-K242 PolarHBondContact O-N 3.5Å; F240-F243 PolarHBondContact O-N 2.85Å; F240-L244 HydrophobicContact CB-CD1 4.32Å; F240-L244 HydrophobicContact CD1-CD1 4.37Å; F240-L244 WeakPolarHBondContact O-CB 3.21Å; F240-L244 WeakPolarHBondContact O-CD1 3.36Å; F240-L244 PolarHBondContact O-N 3.38Å
241	K	44.1	Very low	54.4	Low	144 Å²	144	106.5 Å²	106.5	63%	0.626	49%	0.488	S	S	*	.	H	α-helix	trans	-64.7	-39.7	176.3	-79.7	-175	176.1	178.6	0	111.7	K237 K245	K237-K241 PolarHBondContact O-N 2.82Å; K241-K245 WeakPolarHBondContact O-CB 3.41Å; K241-K245 WeakPolarHBondContact O-CG 2.78Å; K241-K245 PolarHBondContact O-N 3.5Å
242	K	41.2	Very low	52.4	Low	153 Å²	153	109.2 Å²	109.2	67%	0.665	51%	0.51	S	S	*	.	H	α-helix	trans	-68.6	-42.9	175.3	-77.5	-177.5	177.2	175.8	0	112.5	I238 F240 K246	I238-K242 HydrophobicContact CG2-CD 4.18Å; I238-K242 VanDerWaalsContact O-CB 3.3Å; I238-K242 WeakPolarHBondContact O-CB 3.28Å; I238-K242 WeakPolarHBondContact O-CG 3.28Å; I238-K242 PolarHBondContact O-N 2.71Å; I238-K242 VanDerWaalsContact O-N 3.08Å; F240-K242 PolarHBondContact O-N 3.5Å; K242-K246 WeakPolarHBondContact O-CB 3.48Å; K242-K246 PolarHBondContact O-N 2.87Å
243	F	38.7	Very low	50.6	Low	149 Å²	149	110.5 Å²	110.5	65%	0.654	52%	0.523	S	S	*	.	H	α-helix	trans	-71.6	-42.7	178.1	-100.6	-91.6	0	0	0	113.3	F239 F240 K246 K247	F239-F243 WeakPolarHBondContact O-CB 3.48Å; F239-F243 PolarHBondContact O-N 2.98Å; F240-F243 PolarHBondContact O-N 2.85Å; F243-K246 PolarHBondContact O-N 3.39Å; F243-K247 WeakPolarHBondContact O-CB 3.45Å; F243-K247 PolarHBondContact O-N 3.44Å
244	L	40.8	Very low	48.6	Very low	97 Å²	97	114.2 Å²	114.2	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-65	-41.3	175.2	-89.6	135.3	0	0	0	111.1	F240 K246 K247 Y248	F240-L244 HydrophobicContact CB-CD1 4.32Å; F240-L244 HydrophobicContact CD1-CD1 4.37Å; F240-L244 WeakPolarHBondContact O-CB 3.21Å; F240-L244 WeakPolarHBondContact O-CD1 3.36Å; F240-L244 PolarHBondContact O-N 3.38Å; L244-K246 VanDerWaalsContact C-N 3.32Å; L244-K246 PolarHBondContact O-N 2.97Å; L244-K247 PolarHBondContact O-N 3.5Å; L244-Y248 HydrophobicContact CD2-CD2 4.48Å; L244-Y248 WeakPolarHBondContact O-CB 3.33Å; L244-Y248 PolarHBondContact O-N 3.34Å
245	K	40.5	Very low	46.7	Very low	160 Å²	160	120.1 Å²	120.1	70%	0.696	56%	0.562	S	S	*	*	H	α-helix	trans	-60.7	-40.1	172.1	-84.4	-173.2	172.4	-175.2	0	111.9	K241 R249	K241-K245 WeakPolarHBondContact O-CB 3.41Å; K241-K245 WeakPolarHBondContact O-CG 2.78Å; K241-K245 PolarHBondContact O-N 3.5Å; K245-R249 WeakPolarHBondContact O-CB 3.41Å; K245-R249 PolarHBondContact O-N 3.1Å
246	K	37.3	Very low	45.1	Very low	163 Å²	163	122.3 Å²	122.3	71%	0.709	59%	0.585	S	S	*	*	H	α-helix	trans	-68	-38.2	178.4	-144.2	175.7	-172.8	-178.1	0	111.9	K242 F243 L244 A250	K242-K246 WeakPolarHBondContact O-CB 3.48Å; K242-K246 PolarHBondContact O-N 2.87Å; F243-K246 PolarHBondContact O-N 3.39Å; L244-K246 VanDerWaalsContact C-N 3.32Å; L244-K246 PolarHBondContact O-N 2.97Å; K246-A250 WeakPolarHBondContact O-CB 3.45Å; K246-A250 PolarHBondContact O-N 3.46Å
247	K	30.1	Very low	43.8	Very low	157 Å²	157	124.2 Å²	124.2	68%	0.683	61%	0.605	S	S	*	*	H	α-helix	trans	-74.6	-40.3	177.3	-149.5	178	-174.2	-177.3	0	112.1	F243 L244 A250 T251	F243-K247 WeakPolarHBondContact O-CB 3.45Å; F243-K247 PolarHBondContact O-N 3.44Å; L244-K247 PolarHBondContact O-N 3.5Å; K247-A250 PolarHBondContact O-N 3.13Å; K247-T251 WeakPolarHBondContact O-CB 3.43Å; K247-T251 PolarHBondContact O-N 3.41Å; K247-T251 PolarHBondContact O-OG1 2.88Å
248	Y	38.3	Very low	42.5	Very low	175 Å²	175	124.5 Å²	124.5	69%	0.686	61%	0.612	S	S	*	*	H	α-helix	trans	-63.6	-41.5	172.9	-106.7	-98.1	0	0	0	111.7	L244 A250 T251 A252	L244-Y248 HydrophobicContact CD2-CD2 4.48Å; L244-Y248 WeakPolarHBondContact O-CB 3.33Å; L244-Y248 PolarHBondContact O-N 3.34Å; Y248-A250 VanDerWaalsContact C-N 3.35Å; Y248-A250 PolarHBondContact O-N 2.93Å; Y248-T251 PolarHBondContact O-N 3.36Å; Y248-A252 WeakPolarHBondContact O-CB 3.34Å; Y248-A252 PolarHBondContact O-N 3.47Å
249	R	39.2	Very low	41.6	Very low	197 Å²	197	124.1 Å²	124.1	74%	0.743	63%	0.626	S	S	*	*	H	α-helix	trans	-59.8	-43.9	171.2	-101.7	-176.2	164.2	170.7	-4	112	K245 L253	K245-R249 WeakPolarHBondContact O-CB 3.41Å; K245-R249 PolarHBondContact O-N 3.1Å; R249-L253 WeakPolarHBondContact O-CB 3.47Å; R249-L253 PolarHBondContact O-N 3.02Å
250	A	42.4	Very low	41	Very low	55 Å²	55	124.9 Å²	124.9	46%	0.455	64%	0.636	S	S	.	*	H	α-helix	trans	-65.5	-44.1	178.7	0	0	0	0	0	112.3	K246 K247 Y248 M254	K246-A250 WeakPolarHBondContact O-CB 3.45Å; K246-A250 PolarHBondContact O-N 3.46Å; K247-A250 PolarHBondContact O-N 3.13Å; Y248-A250 VanDerWaalsContact C-N 3.35Å; Y248-A250 PolarHBondContact O-N 2.93Å; A250-M254 PolarHBondContact O-N 2.96Å
251	T	41.7	Very low	40.6	Very low	73 Å²	73	125.3 Å²	125.3	45%	0.448	64%	0.644	S	S	.	*	H	α-helix	trans	-70.1	-37.5	178.3	-48.9	0	0	0	0	112	K247 Y248 M254 K255	K247-T251 WeakPolarHBondContact O-CB 3.43Å; K247-T251 PolarHBondContact O-N 3.41Å; K247-T251 PolarHBondContact O-OG1 2.88Å; Y248-T251 PolarHBondContact O-N 3.36Å; T251-M254 PolarHBondContact O-N 2.84Å; T251-K255 PolarHBondContact O-N 3.46Å
252	A	44.8	Very low	40	Very low	57 Å²	57	127.6 Å²	127.6	47%	0.471	66%	0.657	S	S	.	*	H	α-helix	trans	-67.3	-40.8	175.6	0	0	0	0	0	111.6	Y248 M254 K255 A256	Y248-A252 WeakPolarHBondContact O-CB 3.34Å; Y248-A252 PolarHBondContact O-N 3.47Å; A252-M254 VanDerWaalsContact C-N 3.35Å; A252-K255 PolarHBondContact O-N 3.24Å; A252-A256 VanDerWaalsContact O-CB 3.29Å; A252-A256 WeakPolarHBondContact O-CB 3.13Å; A252-A256 PolarHBondContact O-N 2.84Å
253	L	49.3	Very low	39.6	Very low	126 Å²	126	127.4 Å²	127.4	66%	0.66	66%	0.662	S	S	*	*	H	α-helix	trans	-62.9	-39.8	171.6	-103.6	149.8	0	0	0	112	R249 A257	R249-L253 WeakPolarHBondContact O-CB 3.47Å; R249-L253 PolarHBondContact O-N 3.02Å; L253-A257 VanDerWaalsContact O-CB 3.3Å; L253-A257 WeakPolarHBondContact O-CB 3.34Å; L253-A257 PolarHBondContact O-N 3.2Å
254	M	44.5	Very low	39.2	Very low	144 Å²	144	126 Å²	126	71%	0.709	67%	0.666	S	S	*	*	H	α-helix	trans	-66.5	-40.6	175.5	-110.4	-172.8	174.4	0	0	112.7	A250 T251 A252 A257 N258	A250-M254 PolarHBondContact O-N 2.96Å; T251-M254 PolarHBondContact O-N 2.84Å; A252-M254 VanDerWaalsContact C-N 3.35Å; M254-A257 PolarHBondContact O-N 2.82Å; M254-N258 PolarHBondContact O-N 3.02Å
255	K	44.1	Very low	38.5	Very low	144 Å²	144	128.9 Å²	128.9	63%	0.626	68%	0.682	S	S	*	*	H	α-helix	trans	-69.9	-39.3	176.9	-82.4	-170	171.4	-167.5	0	112.3	T251 A252 A257 N258 G259	T251-K255 PolarHBondContact O-N 3.46Å; A252-K255 PolarHBondContact O-N 3.24Å; K255-A257 VanDerWaalsContact C-N 3.31Å; K255-A257 PolarHBondContact O-N 3.1Å; K255-N258 PolarHBondContact O-N 3.11Å; K255-G259 PolarHBondContact O-N 3.39Å
256	A	46.2	Very low	38	Very low	80 Å²	80	128.7 Å²	128.7	66%	0.661	68%	0.683	S	S	*	*	H	α-helix	trans	-64.6	-35.4	173.5	0	0	0	0	0	112	A252 N258	A252-A256 VanDerWaalsContact O-CB 3.29Å; A252-A256 WeakPolarHBondContact O-CB 3.13Å; A252-A256 PolarHBondContact O-N 2.84Å; A256-N258 VanDerWaalsContact C-N 3.32Å; A256-N258 PolarHBondContact O-N 3.37Å
257	A	45.7	Very low	37.5	Very low	80 Å²	80	128 Å²	128	66%	0.661	69%	0.693	S	S	*	*	H	α-helix	trans	-69.6	-26.4	175.7	0	0	0	0	0	113.6	L253 M254 K255	L253-A257 VanDerWaalsContact O-CB 3.3Å; L253-A257 WeakPolarHBondContact O-CB 3.34Å; L253-A257 PolarHBondContact O-N 3.2Å; M254-A257 PolarHBondContact O-N 2.82Å; K255-A257 VanDerWaalsContact C-N 3.31Å; K255-A257 PolarHBondContact O-N 3.1Å
258	N	37.7	Very low	37.3	Very low	122 Å²	122	128.5 Å²	128.5	65%	0.652	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	7.3	-178.1	-78.9	8.6	0	0	0	114.7	M254 K255 A256 D260	M254-N258 PolarHBondContact O-N 3.02Å; K255-N258 PolarHBondContact O-N 3.11Å; A256-N258 VanDerWaalsContact C-N 3.32Å; A256-N258 PolarHBondContact O-N 3.37Å; N258-D260 VanDerWaalsContact C-N 3.27Å; N258-D260 PolarHBondContact O-N 3.14Å; N258-D260 VanDerWaalsContact O-N 3.14Å
259	G	35.1	Very low	36.6	Very low	65 Å²	65	128.3 Å²	128.3	67%	0.67	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.3	1.4	166.1	0	0	0	0	0	117.4	K255 L261	K255-G259 PolarHBondContact O-N 3.39Å; G259-L261 VanDerWaalsContact C-N 3.32Å; G259-L261 PolarHBondContact O-N 3.03Å; G259-L261 VanDerWaalsContact O-N 3.13Å
260	D	34	Very low	36.1	Very low	144 Å²	144	125.1 Å²	125.1	77%	0.77	71%	0.705	S	S	*	*			trans	-87	41.8	-173.4	-68.7	-27.2	0	0	0	114.6	N258	N258-D260 VanDerWaalsContact C-N 3.27Å; N258-D260 PolarHBondContact O-N 3.14Å; N258-D260 VanDerWaalsContact O-N 3.14Å
261	L	37.9	Very low	35.2	Very low	147 Å²	147	128.2 Å²	128.2	77%	0.77	72%	0.718	S	S	*	*			trans	-119	90.1	169.7	-146.7	83.1	0	0	0	110.4	G259 L263	G259-L261 VanDerWaalsContact C-N 3.32Å; G259-L261 PolarHBondContact O-N 3.03Å; G259-L261 VanDerWaalsContact O-N 3.13Å; L261-L263 PolarHBondContact O-N 3.07Å; L261-L263 VanDerWaalsContact O-N 3.16Å
262	E	31.2	Very low	34.4	Very low	191 Å²	191	134.7 Å²	134.7	89%	0.893	74%	0.736	S	S	*	*			trans	-62.9	110.7	167.1	-68.8	-174.8	159.9	0	0	108.9	T264	E262-T264 PolarHBondContact O-N 3.26Å; E262-T264 VanDerWaalsContact O-N 3.16Å
263	L	31.8	Very low	33.6	Very low	150 Å²	150	136.3 Å²	136.3	79%	0.785	75%	0.75	S	S	*	*			trans	-77.8	91.5	-178	-172	76.4	0	0	0	109.5	L261	L261-L263 PolarHBondContact O-N 3.07Å; L261-L263 VanDerWaalsContact O-N 3.16Å
264	T	30.2	Very low	32.7	Very low	119 Å²	119	133.7 Å²	133.7	73%	0.73	74%	0.74	S	S	*	*			trans	-71.2	130.5	165.9	0.6	0	0	0	0	109.3	E262 H266	E262-T264 PolarHBondContact O-N 3.26Å; E262-T264 VanDerWaalsContact O-N 3.16Å; T264-H266 PolarHBondContact O-N 2.8Å
265	N	27.2	Very low	32.2	Very low	157 Å²	157	132.7 Å²	132.7	84%	0.84	74%	0.743	S	S	*	*	S	Bend	trans	-62.8	65.5	-176	-77.9	-20.6	0	0	0	114.7
266	H	29.1	Very low	31.7	Very low	156 Å²	156	131.2 Å²	131.2	72%	0.722	74%	0.741	S	S	*	*			trans	-107.2	118.6	147.6	-73.4	-72.3	0	0	0	106.3	T264 E268	T264-H266 PolarHBondContact O-N 2.8Å; H266-E268 PolarHBondContact O-N 3.43Å
267	T	26.7	Very low	31.2	Very low	149 Å²	149	130.2 Å²	130.2	91%	0.914	74%	0.739	S	S	*	*			trans	-60.5	72.3	164.3	40	0	0	0	0	108.6	E269	T267-E269 PolarHBondContact O-N 3.39Å
268	E	26.1	Very low	31	Very low	167 Å²	167	133.3 Å²	133.3	78%	0.78	74%	0.74	S	S	*	*			trans	-77	99.2	159.4	-74.4	-171.9	165.8	0	0	105.3	H266 V270	H266-E268 PolarHBondContact O-N 3.43Å; E268-V270 PolarHBondContact O-N 2.89Å; E268-V270 VanDerWaalsContact O-N 3.09Å
269	E	24.9	Very low	31	Very low	171 Å²	171	129.9 Å²	129.9	80%	0.799	73%	0.725	S	S	*	*			trans	-44.6	120.6	158.3	-77.7	-178.7	140.7	0	0	107.8	T267 T271	T267-E269 PolarHBondContact O-N 3.39Å; E269-T271 PolarHBondContact O-N 3.4Å; E269-T271 PolarHBondContact O-OG1 3.21Å
270	V	26.7	Very low	31.4	Very low	130 Å²	130	132.2 Å²	132.2	79%	0.788	72%	0.722	S	S	*	*			trans	-66.8	85.1	172	177.7	0	0	0	0	106.4	E268 Y272	E268-V270 PolarHBondContact O-N 2.89Å; E268-V270 VanDerWaalsContact O-N 3.09Å; V270-Y272 PolarHBondContact O-N 2.95Å
271	T	24	Very low	32.2	Very low	120 Å²	120	128 Å²	128	74%	0.736	71%	0.707	S	S	*	*			trans	-65.4	105.2	177.1	-41.7	0	0	0	0	107	E269 A273	E269-T271 PolarHBondContact O-N 3.4Å; E269-T271 PolarHBondContact O-OG1 3.21Å; T271-A273 VanDerWaalsContact C-N 3.27Å; T271-A273 PolarHBondContact O-N 3.37Å
272	Y	25.9	Very low	32.7	Very low	209 Å²	209	123.8 Å²	123.8	82%	0.82	68%	0.684	S	S	*	*			trans	-54.8	97.4	162	-81.9	-93.8	0	0	0	107.2	V270 P274	V270-Y272 PolarHBondContact O-N 2.95Å; Y272-P274 WeakPolarHBondContact O-CD 3.46Å
273	A	28.6	Very low	33.5	Very low	92 Å²	92	117.5 Å²	117.5	76%	0.76	65%	0.654	S	S	*	*			trans	-62.5	105.4	172.1	0	0	0	0	0	107.3	T271	T271-A273 VanDerWaalsContact C-N 3.27Å; T271-A273 PolarHBondContact O-N 3.37Å
274	P	28.7	Very low	34.8	Very low	70 Å²	70	113.6 Å²	113.6	46%	0.455	64%	0.64	S	S	.	*			trans	-73.5	154.4	-178.7	21.1	-10.2	0	0	0	109	Y272	Y272-P274 WeakPolarHBondContact O-CD 3.46Å
275	T	34	Very low	36.2	Very low	124 Å²	124	112.3 Å²	112.3	76%	0.761	63%	0.625	S	S	*	*	S	Bend	trans	-42.9	145.9	165.1	-28.7	0	0	0	0	110
276	D	34	Very low	37.8	Very low	112 Å²	112	108.4 Å²	108.4	60%	0.599	60%	0.601	S	S	*	*			trans	90	61.1	179.6	-40.6	-26.7	0	0	0	114.6	E278 S279	D276-E278 PolarHBondContact O-N 2.93Å; D276-S279 PolarHBondContact O-N 3.47Å; D276-S279 PolarHBondContact O-OG 3.12Å
277	G	36.3	Very low	39.4	Very low	59 Å²	59	104.4 Å²	104.4	61%	0.608	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	7.9	167.2	0	0	0	0	0	114.7
278	E	40.5	Very low	41.3	Very low	145 Å²	145	102.5 Å²	102.5	68%	0.678	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-44.9	170.9	-76.1	171.4	174.9	0	0	109.7	D276 L280 A281 E282	D276-E278 PolarHBondContact O-N 2.93Å; E278-L280 PolarHBondContact O-N 3.5Å; E278-A281 PolarHBondContact O-N 3.41Å; E278-A281 VanDerWaalsContact O-N 3.15Å; E278-E282 WeakPolarHBondContact O-CB 3.41Å; E278-E282 VanDerWaalsContact O-CG 3.27Å; E278-E282 WeakPolarHBondContact O-CG 3.31Å; E278-E282 PolarHBondContact O-N 3.1Å
279	S	38.9	Very low	43.2	Very low	50 Å²	50	98.1 Å²	98.1	35%	0.35	54%	0.54	S	S	.	.	H	α-helix	trans	-62.1	-38.8	-177.7	75.8	0	0	0	0	113.7	D276 E283	D276-S279 PolarHBondContact O-N 3.47Å; D276-S279 PolarHBondContact O-OG 3.12Å; S279-E283 VanDerWaalsContact O-CB 3.29Å; S279-E283 WeakPolarHBondContact O-CB 3.19Å; S279-E283 PolarHBondContact O-N 3.39Å
280	L	43.4	Very low	45.3	Very low	114 Å²	114	91.4 Å²	91.4	60%	0.597	51%	0.508	S	S	*	.	H	α-helix	trans	-72.4	-32.4	178.6	-77.4	171.3	0	0	0	113.1	E278 S284	E278-L280 PolarHBondContact O-N 3.5Å; L280-S284 WeakPolarHBondContact O-CB 3.38Å; L280-S284 PolarHBondContact O-N 3.29Å
281	A	49.7	Very low	47.4	Very low	57 Å²	57	88.8 Å²	88.8	47%	0.471	49%	0.488	S	S	.	.	H	α-helix	trans	-72.3	-39.4	177.1	0	0	0	0	0	110.4	E278 S284 E285	E278-A281 PolarHBondContact O-N 3.41Å; E278-A281 VanDerWaalsContact O-N 3.15Å; A281-S284 WeakPolarHBondContact O-CB 3.43Å; A281-S284 PolarHBondContact O-N 2.83Å; A281-E285 WeakPolarHBondContact O-CG 3.44Å; A281-E285 PolarHBondContact O-N 3.44Å
282	E	49.2	Very low	49.9	Very low	58 Å²	58	86 Å²	86	27%	0.271	47%	0.469	S	S	.	.	H	α-helix	trans	-73.9	-40.9	-178	-69.3	165.7	-169.8	0	0	112.6	E278 S284 E285 F286	E278-E282 WeakPolarHBondContact O-CB 3.41Å; E278-E282 VanDerWaalsContact O-CG 3.27Å; E278-E282 WeakPolarHBondContact O-CG 3.31Å; E278-E282 PolarHBondContact O-N 3.1Å; E282-S284 VanDerWaalsContact C-N 3.27Å; E282-S284 PolarHBondContact O-N 2.98Å; E282-E285 PolarHBondContact O-N 3.46Å; E282-F286 PolarHBondContact O-N 3.27Å
283	E	48.7	Very low	52.4	Low	58 Å²	58	76.3 Å²	76.3	27%	0.271	43%	0.431	S	S	.	.	H	α-helix	trans	-59.5	-40.9	171.4	-172.6	167.7	-165.4	0	0	110.9	K99 S279 E285 F286 D287	K99-E283 WeakPolarHBondContact CE-OE1 3.24Å; K99-E283 IonicContact NZ-OE1 3.86Å; K99-E283 PolarHBondContact NZ-OE1 2.92Å; S279-E283 VanDerWaalsContact O-CB 3.29Å; S279-E283 WeakPolarHBondContact O-CB 3.19Å; S279-E283 PolarHBondContact O-N 3.39Å; E283-E285 VanDerWaalsContact C-N 3.25Å; E283-E285 PolarHBondContact O-N 3.32Å; E283-F286 PolarHBondContact O-N 3.45Å; E283-D287 PolarHBondContact O-N 3.05Å
284	S	58.7	Low	54.6	Low	69 Å²	69	72.4 Å²	72.4	48%	0.483	40%	0.397	S	S	.	.	H	α-helix	trans	-64.4	-25.2	174.6	178.6	0	0	0	0	113.7	L280 A281 E282 R288	L280-S284 WeakPolarHBondContact O-CB 3.38Å; L280-S284 PolarHBondContact O-N 3.29Å; A281-S284 WeakPolarHBondContact O-CB 3.43Å; A281-S284 PolarHBondContact O-N 2.83Å; E282-S284 VanDerWaalsContact C-N 3.27Å; E282-S284 PolarHBondContact O-N 2.98Å; S284-R288 VanDerWaalsContact O-CB 3.24Å; S284-R288 WeakPolarHBondContact O-CB 3.2Å; S284-R288 PolarHBondContact O-N 3.07Å; S284-R288 VanDerWaalsContact O-N 3.14Å
285	E	58.8	Low	56.9	Low	92 Å²	92	74.4 Å²	74.4	43%	0.43	40%	0.4	S	S	.	.	H	α-helix	trans	-77.9	-45.8	177	-55.6	-141.9	112.6	0	0	111.3	A281 E282 E283 D287 R288 H289	A281-E285 WeakPolarHBondContact O-CG 3.44Å; A281-E285 PolarHBondContact O-N 3.44Å; E282-E285 PolarHBondContact O-N 3.46Å; E283-E285 VanDerWaalsContact C-N 3.25Å; E283-E285 PolarHBondContact O-N 3.32Å; E285-D287 VanDerWaalsContact C-N 3.32Å; E285-D287 PolarHBondContact O-N 3.47Å; E285-R288 WeakPolarHBondContact O-CB 3.37Å; E285-R288 PolarHBondContact O-N 2.97Å; E285-R288 IonicContact OE1-CZ 3.57Å; E285-R288 IonicContact OE1-NH1 2.63Å; E285-R288 PolarHBondContact OE1-NH1 3.1Å; E285-R288 IonicContact OE1-NH2 3.72Å; E285-R288 PolarHBondContact OE1-NH2 3.19Å; E285-H289 PolarHBondContact O-CD2 3.45Å; E285-H289 PolarHBondContact O-N 3.44Å
286	F	61.8	Low	59.1	Low	74 Å²	74	68.6 Å²	68.6	33%	0.325	37%	0.365	S	S	.	.	H	α-helix	trans	-57.7	-47.5	175.2	-179.3	-100.8	0	0	0	110.8	E282 E283 R288 H289 R290 V675	E282-F286 PolarHBondContact O-N 3.27Å; E283-F286 PolarHBondContact O-N 3.45Å; F286-R288 VanDerWaalsContact C-N 3.32Å; F286-R288 PolarHBondContact O-N 2.94Å; F286-H289 PolarHBondContact O-N 3.49Å; F286-R290 HydrophobicContact CD1-CG 4.35Å; F286-R290 HydrophobicContact CE1-CG 4.14Å; F286-R290 HydrophobicContact CZ-CG 4.46Å; F286-R290 WeakPolarHBondContact O-CG 3.44Å; F286-R290 PolarHBondContact O-N 3.18Å; F286-V675 HydrophobicContact CD2-CG1 3.9Å; F286-V675 HydrophobicContact CE2-CG1 3.4Å; F286-V675 HydrophobicContact CZ-CG1 4.05Å
287	D	62.9	Low	61.3	Low	73 Å²	73	63.4 Å²	63.4	39%	0.39	34%	0.337	S	S	.	.	H	α-helix	trans	-61.4	-40.7	176.8	-71.9	-18.2	0	0	0	111.9	E283 E285 R290 M291	E283-D287 PolarHBondContact O-N 3.05Å; E285-D287 VanDerWaalsContact C-N 3.32Å; E285-D287 PolarHBondContact O-N 3.47Å; D287-R290 WeakPolarHBondContact O-CB 3.26Å; D287-R290 PolarHBondContact O-N 2.88Å; D287-M291 VanDerWaalsContact O-CG 3.29Å; D287-M291 WeakPolarHBondContact O-CG 3.38Å; D287-M291 PolarHBondContact O-N 2.91Å
288	R	65.2	Low	63.1	Low	108 Å²	108	65 Å²	65	41%	0.408	33%	0.327	S	S	.	.	H	α-helix	trans	-60.9	-45.9	174.7	-177.2	-177.3	68.7	-132.8	1.7	111.9	S284 E285 F286 R290 M291 D292	S284-R288 VanDerWaalsContact O-CB 3.24Å; S284-R288 WeakPolarHBondContact O-CB 3.2Å; S284-R288 PolarHBondContact O-N 3.07Å; S284-R288 VanDerWaalsContact O-N 3.14Å; E285-R288 WeakPolarHBondContact O-CB 3.37Å; E285-R288 PolarHBondContact O-N 2.97Å; E285-R288 IonicContact OE1-CZ 3.57Å; E285-R288 IonicContact OE1-NH1 2.63Å; E285-R288 PolarHBondContact OE1-NH1 3.1Å; E285-R288 IonicContact OE1-NH2 3.72Å; E285-R288 PolarHBondContact OE1-NH2 3.19Å; F286-R288 VanDerWaalsContact C-N 3.32Å; F286-R288 PolarHBondContact O-N 2.94Å; R288-R290 VanDerWaalsContact C-N 3.3Å; R288-R290 PolarHBondContact O-N 3.3Å; R288-M291 WeakPolarHBondContact O-CB 3.21Å; R288-M291 PolarHBondContact O-N 2.99Å; R288-M291 VanDerWaalsContact O-N 3.12Å; R288-D292 VanDerWaalsContact O-CG 3.3Å; R288-D292 PolarHBondContact O-N 3.26Å
289	H	66.8	Low	65	Low	75 Å²	75	61.4 Å²	61.4	35%	0.347	31%	0.31	S	S	.	.	H	α-helix	trans	-60.1	-40.8	176.9	-79.7	-70.7	0	0	0	111.9	E285 F286 M291 D292 Y293	E285-H289 PolarHBondContact O-CD2 3.45Å; E285-H289 PolarHBondContact O-N 3.44Å; F286-H289 PolarHBondContact O-N 3.49Å; H289-M291 VanDerWaalsContact C-N 3.34Å; H289-M291 PolarHBondContact O-N 2.78Å; H289-D292 PolarHBondContact O-N 3.09Å; H289-Y293 VanDerWaalsContact O-CD2 3.23Å; H289-Y293 WeakPolarHBondContact O-CD2 3.2Å; H289-Y293 PolarHBondContact O-N 3.36Å
290	R	69.9	Low	66.9	Low	30 Å²	30	59.8 Å²	59.8	11%	0.113	30%	0.298	C	S	.	.	H	α-helix	trans	-58.3	-46.6	173	-63.3	172.3	70.6	73.3	7.8	111.6	F286 D287 R288 D292 Y293 V294 V671 D672 V675	F286-R290 HydrophobicContact CD1-CG 4.35Å; F286-R290 HydrophobicContact CE1-CG 4.14Å; F286-R290 HydrophobicContact CZ-CG 4.46Å; F286-R290 WeakPolarHBondContact O-CG 3.44Å; F286-R290 PolarHBondContact O-N 3.18Å; D287-R290 WeakPolarHBondContact O-CB 3.26Å; D287-R290 PolarHBondContact O-N 2.88Å; R288-R290 VanDerWaalsContact C-N 3.3Å; R288-R290 PolarHBondContact O-N 3.3Å; R290-D292 VanDerWaalsContact C-N 3.31Å; R290-D292 PolarHBondContact O-N 2.95Å; R290-Y293 PolarHBondContact O-N 3.42Å; R290-V294 VanDerWaalsContact O-CG2 3.28Å; R290-V294 WeakPolarHBondContact O-CG2 3.05Å; R290-V294 PolarHBondContact O-N 2.84Å; R290-V671 HydrophobicContact CB-CG1 4.4Å; R290-D672 IonicContact CZ-OD1 2.74Å; R290-D672 IonicContact NH1-OD1 2.99Å; R290-D672 PolarHBondContact NH1-OD1 3.39Å; R290-D672 IonicContact NH2-OD1 2.7Å; R290-D672 PolarHBondContact NH2-OD1 3.35Å; R290-V675 HydrophobicContact CB-CG2 4.4Å; R290-V675 HydrophobicContact CG-CG1 4.48Å; R290-V675 HydrophobicContact CG-CG2 3.91Å
291	M	70.4	Confident	68.4	Low	75 Å²	75	58.3 Å²	58.3	37%	0.369	28%	0.284	S	S	.	.	H	α-helix	trans	-61.7	-39.1	178.9	-62.6	-59.6	130.8	0	0	112	D287 R288 H289 Y293 V294 E295 Y571	D287-M291 VanDerWaalsContact O-CG 3.29Å; D287-M291 WeakPolarHBondContact O-CG 3.38Å; D287-M291 PolarHBondContact O-N 2.91Å; R288-M291 WeakPolarHBondContact O-CB 3.21Å; R288-M291 PolarHBondContact O-N 2.99Å; R288-M291 VanDerWaalsContact O-N 3.12Å; H289-M291 VanDerWaalsContact C-N 3.34Å; H289-M291 PolarHBondContact O-N 2.78Å; M291-Y293 VanDerWaalsContact C-N 3.35Å; M291-Y293 PolarHBondContact O-N 2.97Å; M291-V294 PolarHBondContact O-N 3.16Å; M291-E295 WeakPolarHBondContact O-CB 3.34Å; M291-E295 PolarHBondContact O-N 3.22Å; M291-Y571 HydrophobicContact CE-CE1 3.45Å; M291-Y571 VanDerWaalsContact CE-CE1 3.45Å; M291-Y571 VanDerWaalsContact CE-OH 3.27Å; M291-Y571 WeakPolarHBondContact CE-OH 3.45Å; M291-Y571 HydrophobicContact SD-CD1 3.93Å; M291-Y571 HydrophobicContact SD-CE1 3.28Å; M291-Y571 WeakPolarHBondContact SD-CE1 3.36Å
292	D	75	Confident	69.6	Low	63 Å²	63	64.5 Å²	64.5	34%	0.337	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-41.6	178	-63.6	-22.2	0	0	0	111.4	R288 H289 R290 A296	R288-D292 VanDerWaalsContact O-CG 3.3Å; R288-D292 PolarHBondContact O-N 3.26Å; H289-D292 PolarHBondContact O-N 3.09Å; R290-D292 VanDerWaalsContact C-N 3.31Å; R290-D292 PolarHBondContact O-N 2.95Å; D292-A296 WeakPolarHBondContact O-CB 3.27Å; D292-A296 PolarHBondContact O-N 3.02Å
293	Y	78.6	Confident	71	Confident	5 Å²	5	68.4 Å²	68.4	2%	0.02	31%	0.313	C	S	.	.	H	α-helix	trans	-65	-42.5	174.5	-84.1	-74.8	0	0	0	112.5	H289 R290 M291 A296 I297 V320 L674 V675 G678	H289-Y293 VanDerWaalsContact O-CD2 3.23Å; H289-Y293 WeakPolarHBondContact O-CD2 3.2Å; H289-Y293 PolarHBondContact O-N 3.36Å; R290-Y293 PolarHBondContact O-N 3.42Å; M291-Y293 VanDerWaalsContact C-N 3.35Å; M291-Y293 PolarHBondContact O-N 2.97Å; Y293-A296 PolarHBondContact O-N 3.41Å; Y293-I297 VanDerWaalsContact O-CG1 3.28Å; Y293-I297 WeakPolarHBondContact O-CG1 3.45Å; Y293-I297 PolarHBondContact O-N 3.16Å; Y293-V320 HydrophobicContact CD1-CB 4.19Å; Y293-V320 HydrophobicContact CD1-CG2 3.6Å; Y293-V320 HydrophobicContact CD2-CG1 4.27Å; Y293-V320 HydrophobicContact CD2-CG2 4.34Å; Y293-V320 HydrophobicContact CE1-CB 3.83Å; Y293-V320 HydrophobicContact CE1-CG1 4.1Å; Y293-V320 HydrophobicContact CE1-CG2 3.78Å; Y293-V320 HydrophobicContact CE2-CB 4.42Å; Y293-V320 HydrophobicContact CE2-CG1 3.79Å; Y293-V320 HydrophobicContact CE2-CG2 4.48Å; Y293-V320 HydrophobicContact CG-CG2 3.88Å; Y293-L674 HydrophobicContact CD1-CB 3.79Å; Y293-L674 HydrophobicContact CD1-CD1 3.95Å; Y293-L674 HydrophobicContact CD1-CG 4.44Å; Y293-L674 HydrophobicContact CE1-CB 3.77Å; Y293-L674 HydrophobicContact CE1-CD1 4.36Å; Y293-L674 HydrophobicContact CE1-CG 4.49Å; Y293-L674 HydrophobicContact CG-CB 4.3Å; Y293-V675 HydrophobicContact CD2-CG2 3.56Å; Y293-V675 HydrophobicContact CE2-CG2 4.05Å; Y293-V675 HydrophobicContact CG-CG2 4.36Å; Y293-G678 VanDerWaalsContact OH-CA 3.26Å; Y293-G678 WeakPolarHBondContact OH-CA 3.34Å
294	V	75.5	Confident	72.4	Confident	9 Å²	9	69.6 Å²	69.6	6%	0.055	32%	0.321	C	S	.	.	H	α-helix	trans	-61.6	-48.4	177.2	167.1	0	0	0	0	110.9	R290 M291 A296 I297 K298 Y571 F667 V671	R290-V294 VanDerWaalsContact O-CG2 3.28Å; R290-V294 WeakPolarHBondContact O-CG2 3.05Å; R290-V294 PolarHBondContact O-N 2.84Å; M291-V294 PolarHBondContact O-N 3.16Å; V294-A296 VanDerWaalsContact C-N 3.34Å; V294-A296 PolarHBondContact O-N 3.02Å; V294-I297 PolarHBondContact O-N 2.9Å; V294-K298 WeakPolarHBondContact O-CB 3.43Å; V294-K298 PolarHBondContact O-N 3.36Å; V294-Y571 HydrophobicContact CB-CD2 4.27Å; V294-Y571 HydrophobicContact CB-CG 4.48Å; V294-Y571 VanDerWaalsContact CG1-CB 3.43Å; V294-Y571 HydrophobicContact CG1-CD1 4.05Å; V294-Y571 HydrophobicContact CG1-CD2 3.35Å; V294-Y571 HydrophobicContact CG1-CE2 4.07Å; V294-Y571 HydrophobicContact CG1-CG 3.33Å; V294-Y571 HydrophobicContact CG2-CD2 3.94Å; V294-Y571 HydrophobicContact CG2-CE2 3.84Å; V294-F667 HydrophobicContact CB-CZ 4.38Å; V294-F667 HydrophobicContact CG1-CE1 4.41Å; V294-F667 HydrophobicContact CG1-CZ 4.25Å; V294-F667 HydrophobicContact CG2-CE1 3.99Å; V294-F667 HydrophobicContact CG2-CZ 4.04Å; V294-V671 HydrophobicContact CG2-CG1 4.14Å; V294-V671 HydrophobicContact CG2-CG2 3.99Å
295	E	77.3	Confident	73.1	Confident	113 Å²	113	71.3 Å²	71.3	53%	0.528	33%	0.33	S	S	.	.	H	α-helix	trans	-61.6	-43	178.2	-175.3	171.9	-151.7	0	0	111	M291 K298 E299	M291-E295 WeakPolarHBondContact O-CB 3.34Å; M291-E295 PolarHBondContact O-N 3.22Å; E295-K298 WeakPolarHBondContact O-CB 3.36Å; E295-K298 PolarHBondContact O-N 3.44Å; E295-E299 WeakPolarHBondContact O-CG 3.15Å; E295-E299 PolarHBondContact O-N 2.96Å
296	A	79.4	Confident	73.7	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.008	35%	0.351	C	S	.	.	H	α-helix	trans	-59.8	-48.3	175.2	0	0	0	0	0	112.3	D292 Y293 V294 K298 E299 I300 E319 V320	D292-A296 WeakPolarHBondContact O-CB 3.27Å; D292-A296 PolarHBondContact O-N 3.02Å; Y293-A296 PolarHBondContact O-N 3.41Å; V294-A296 VanDerWaalsContact C-N 3.34Å; V294-A296 PolarHBondContact O-N 3.02Å; A296-K298 VanDerWaalsContact C-N 3.28Å; A296-K298 PolarHBondContact O-N 3.08Å; A296-E299 PolarHBondContact O-N 2.88Å; A296-I300 WeakPolarHBondContact O-CD1 3.23Å; A296-I300 WeakPolarHBondContact O-CG1 3.35Å; A296-I300 PolarHBondContact O-N 3.26Å; A296-E319 HydrophobicContact CB-CB 4.09Å; A296-E319 HydrophobicContact CB-CG 3.87Å; A296-V320 HydrophobicContact CB-CG2 3.84Å
297	I	80.8	Confident	74.4	Confident	3 Å²	3	72.5 Å²	72.5	2%	0.015	34%	0.343	C	S	.	.	H	α-helix	trans	-61.1	-40.5	178	-66.7	164.9	0	0	0	110.7	Y293 V294 I300 R301 L312 A316 F667 V671 L674	Y293-I297 VanDerWaalsContact O-CG1 3.28Å; Y293-I297 WeakPolarHBondContact O-CG1 3.45Å; Y293-I297 PolarHBondContact O-N 3.16Å; V294-I297 PolarHBondContact O-N 2.9Å; I297-I300 PolarHBondContact O-N 2.79Å; I297-R301 HydrophobicContact CG2-CG 4.41Å; I297-R301 WeakPolarHBondContact O-CB 3.42Å; I297-R301 PolarHBondContact O-N 2.89Å; I297-L312 HydrophobicContact CG2-CD1 3.99Å; I297-L312 HydrophobicContact CG2-CD2 3.76Å; I297-L312 HydrophobicContact CG2-CG 3.99Å; I297-A316 HydrophobicContact CD1-CB 4.38Å; I297-A316 HydrophobicContact CG1-CB 3.51Å; I297-F667 HydrophobicContact CB-CE2 3.93Å; I297-F667 HydrophobicContact CB-CZ 4.41Å; I297-F667 HydrophobicContact CD1-CD2 4.39Å; I297-F667 HydrophobicContact CD1-CE2 3.56Å; I297-F667 HydrophobicContact CD1-CZ 4.13Å; I297-F667 HydrophobicContact CG1-CE2 4.33Å; I297-F667 HydrophobicContact CG2-CD2 4.38Å; I297-F667 HydrophobicContact CG2-CE2 3.53Å; I297-F667 HydrophobicContact CG2-CZ 4.4Å; I297-V671 HydrophobicContact CD1-CG2 3.93Å; I297-L674 HydrophobicContact CD1-CD1 4.18Å
298	K	74.5	Confident	74.9	Confident	92 Å²	92	71 Å²	71	40%	0.4	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-46.7	177.2	-171.3	178.5	-172.1	176.7	0	111.9	V294 E295 A296 I300 K302 N570	V294-K298 WeakPolarHBondContact O-CB 3.43Å; V294-K298 PolarHBondContact O-N 3.36Å; E295-K298 WeakPolarHBondContact O-CB 3.36Å; E295-K298 PolarHBondContact O-N 3.44Å; A296-K298 VanDerWaalsContact C-N 3.28Å; A296-K298 PolarHBondContact O-N 3.08Å; K298-I300 VanDerWaalsContact C-N 3.35Å; K298-I300 PolarHBondContact O-N 2.85Å; K298-K302 WeakPolarHBondContact O-CB 3.41Å; K298-K302 PolarHBondContact O-N 3.43Å; K298-N570 VanDerWaalsContact CE-OD1 3.26Å; K298-N570 WeakPolarHBondContact CE-OD1 3.13Å; K298-N570 PolarHBondContact NZ-OD1 3.41Å
299	E	79.5	Confident	75.1	Confident	71 Å²	71	69 Å²	69	33%	0.332	34%	0.34	S	S	.	.	H	α-helix	trans	-62.3	-41.5	176.5	-73.7	-169.6	149.8	0	0	112	E295 A296 K302 R303 K323	E295-E299 WeakPolarHBondContact O-CG 3.15Å; E295-E299 PolarHBondContact O-N 2.96Å; A296-E299 PolarHBondContact O-N 2.88Å; E299-K302 PolarHBondContact O-N 3.01Å; E299-R303 WeakPolarHBondContact O-CG 3.38Å; E299-R303 PolarHBondContact O-N 2.96Å; E299-R303 VanDerWaalsContact O-N 3.12Å; E299-K323 IonicContact OE2-NZ 2.97Å; E299-K323 PolarHBondContact OE2-NZ 3.28Å
300	I	78.7	Confident	75.3	Confident	16 Å²	16	71.1 Å²	71.1	8%	0.082	35%	0.349	C	S	.	.	H	α-helix	trans	-68	-45.6	-179.8	-66.1	159.5	0	0	0	111.1	A296 I297 K298 K302 R303 N304 I307 L312 L315 A316 E319	A296-I300 WeakPolarHBondContact O-CD1 3.23Å; A296-I300 WeakPolarHBondContact O-CG1 3.35Å; A296-I300 PolarHBondContact O-N 3.26Å; I297-I300 PolarHBondContact O-N 2.79Å; K298-I300 VanDerWaalsContact C-N 3.35Å; K298-I300 PolarHBondContact O-N 2.85Å; I300-K302 VanDerWaalsContact C-N 3.29Å; I300-K302 PolarHBondContact O-N 3.06Å; I300-R303 PolarHBondContact O-N 3.49Å; I300-N304 PolarHBondContact O-N 3.04Å; I300-I307 HydrophobicContact CG2-CD1 3.97Å; I300-L312 HydrophobicContact CB-CD1 3.87Å; I300-L312 HydrophobicContact CG2-CD1 3.48Å; I300-L312 VanDerWaalsContact CG2-CD1 3.48Å; I300-L315 VanDerWaalsContact CD1-C 3.44Å; I300-L315 HydrophobicContact CD1-CB 3.7Å; I300-L315 HydrophobicContact CG1-CB 4.38Å; I300-L315 HydrophobicContact CG2-CB 4.19Å; I300-L315 HydrophobicContact CG2-CD1 3.88Å; I300-A316 VanDerWaalsContact CD1-CA 3.45Å; I300-A316 HydrophobicContact CD1-CB 3.99Å; I300-A316 VanDerWaalsContact CD1-N 3.31Å; I300-E319 HydrophobicContact CD1-CB 4.36Å
301	R	75.2	Confident	75.6	Confident	82 Å²	82	74 Å²	74	31%	0.309	36%	0.364	S	S	.	.	H	α-helix	trans	-61.5	-38	174.9	-81.1	-170.4	173.9	-178.9	-0	112	I297 R303 N304 P305 L312 N569	I297-R301 HydrophobicContact CG2-CG 4.41Å; I297-R301 WeakPolarHBondContact O-CB 3.42Å; I297-R301 PolarHBondContact O-N 2.89Å; R301-R303 VanDerWaalsContact C-N 3.29Å; R301-R303 PolarHBondContact O-N 2.92Å; R301-N304 CarbonylContact O-C 3.59Å; R301-N304 PolarHBondContact O-N 3.01Å; R301-P305 WeakPolarHBondContact O-CA 3.29Å; R301-L312 HydrophobicContact CG-CD1 4.11Å; R301-L312 HydrophobicContact CG-CD2 3.95Å; R301-N569 PolarHBondContact NH1-OD1 2.96Å
302	K	74.8	Confident	76	Confident	187 Å²	187	70.7 Å²	70.7	81%	0.813	35%	0.347	S	S	*	.	H	α-helix	trans	-62.1	-37	175.8	-175	178.5	179.7	179.8	0	112.2	K298 E299 I300	K298-K302 WeakPolarHBondContact O-CB 3.41Å; K298-K302 PolarHBondContact O-N 3.43Å; E299-K302 PolarHBondContact O-N 3.01Å; I300-K302 VanDerWaalsContact C-N 3.29Å; I300-K302 PolarHBondContact O-N 3.06Å
303	R	78.8	Confident	76	Confident	141 Å²	141	68.2 Å²	68.2	53%	0.532	33%	0.334	S	S	.	.	H	α-helix	trans	-76.3	-39.6	174.9	-66.5	-177.5	-166.8	-169.7	11.4	111.8	E299 I300 R301 D708	E299-R303 WeakPolarHBondContact O-CG 3.38Å; E299-R303 PolarHBondContact O-N 2.96Å; E299-R303 VanDerWaalsContact O-N 3.12Å; I300-R303 PolarHBondContact O-N 3.49Å; R301-R303 VanDerWaalsContact C-N 3.29Å; R301-R303 PolarHBondContact O-N 2.92Å; R303-D708 IonicContact CZ-OD2 3.74Å; R303-D708 IonicContact NH1-OD1 3.93Å; R303-D708 IonicContact NH1-OD2 2.81Å; R303-D708 PolarHBondContact NH1-OD2 2.72Å
304	N	78.3	Confident	75.8	Confident	83 Å²	83	68.8 Å²	68.8	44%	0.444	34%	0.336	S	S	.	.			trans	-130.5	87	-173.9	-63.6	-63	0	0	0	111.2	I300 R301 N306 I307	I300-N304 PolarHBondContact O-N 3.04Å; R301-N304 CarbonylContact O-C 3.59Å; R301-N304 PolarHBondContact O-N 3.01Å; N304-N306 VanDerWaalsContact C-N 3.29Å; N304-N306 PolarHBondContact O-N 3.21Å; N304-I307 HydrophobicContact CB-CB 4.12Å; N304-I307 HydrophobicContact CB-CD1 4.49Å; N304-I307 VanDerWaalsContact O-CG2 3.26Å; N304-I307 WeakPolarHBondContact O-CG2 3.49Å; N304-I307 PolarHBondContact O-N 3.45Å
305	P	72.8	Confident	75.9	Confident	104 Å²	104	70.5 Å²	70.5	68%	0.675	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-24.6	-175.1	23.1	-32.8	0	0	0	114.3	R301	R301-P305 WeakPolarHBondContact O-CA 3.29Å
306	N	72.2	Confident	76	Confident	161 Å²	161	65.1 Å²	65.1	86%	0.861	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	22.5	-175.5	-62.9	-20.5	0	0	0	113.5	N304	N304-N306 VanDerWaalsContact C-N 3.29Å; N304-N306 PolarHBondContact O-N 3.21Å
307	I	75.2	Confident	75.8	Confident	30 Å²	30	65.4 Å²	65.4	15%	0.154	32%	0.321	C	S	.	.			trans	-73.7	136.7	-176.6	-168.1	165.9	0	0	0	111.8	I300 N304 E311 L312 L315	I300-I307 HydrophobicContact CG2-CD1 3.97Å; N304-I307 HydrophobicContact CB-CB 4.12Å; N304-I307 HydrophobicContact CB-CD1 4.49Å; N304-I307 VanDerWaalsContact O-CG2 3.26Å; N304-I307 WeakPolarHBondContact O-CG2 3.49Å; N304-I307 PolarHBondContact O-N 3.45Å; I307-E311 HydrophobicContact CD1-CB 4.26Å; I307-E311 HydrophobicContact CD1-CG 4.03Å; I307-E311 HydrophobicContact CG1-CB 3.97Å; I307-E311 HydrophobicContact CG1-CG 4.16Å; I307-L312 HydrophobicContact CD1-CB 4.46Å; I307-L312 HydrophobicContact CG1-CB 4.4Å; I307-L312 HydrophobicContact CG2-CB 4.07Å; I307-L312 HydrophobicContact CG2-CD1 3.91Å; I307-L312 HydrophobicContact CG2-CD2 4.36Å; I307-L312 HydrophobicContact CG2-CG 4.35Å; I307-L315 HydrophobicContact CD1-CD1 3.42Å; I307-L315 VanDerWaalsContact CD1-CD1 3.42Å; I307-L315 HydrophobicContact CD1-CG 4.39Å
308	G	73.3	Confident	75.5	Confident	41 Å²	41	66 Å²	66	42%	0.423	32%	0.324	S	S	.	.			trans	-68.8	147.7	176.5	0	0	0	0	0	111.9	K310 E311 L312	G308-K310 VanDerWaalsContact C-N 3.29Å; G308-K310 PolarHBondContact O-N 3.16Å; G308-E311 PolarHBondContact O-N 2.74Å; G308-E311 VanDerWaalsContact O-N 3.08Å; G308-L312 WeakPolarHBondContact O-CB 3.4Å; G308-L312 PolarHBondContact O-N 3.11Å
309	M	70.7	Confident	75.7	Confident	67 Å²	67	64.1 Å²	64.1	33%	0.33	32%	0.316	S	S	.	.	H	α-helix	trans	-54.4	-42	-174.6	-166.6	64.3	178.1	0	0	113.5	L312 E313 T670	M309-L312 WeakPolarHBondContact O-CB 3.39Å; M309-L312 PolarHBondContact O-N 2.97Å; M309-L312 HydrophobicContact SD-CD2 4.4Å; M309-E313 VanDerWaalsContact O-CG 3.28Å; M309-E313 WeakPolarHBondContact O-CG 3.11Å; M309-E313 PolarHBondContact O-N 3.16Å; M309-T670 HydrophobicContact CE-CG2 3.67Å; M309-T670 WeakPolarHBondContact CE-OG1 3.21Å
310	K	70.4	Confident	75.6	Confident	120 Å²	120	61.4 Å²	61.4	52%	0.522	31%	0.305	S	S	.	.	H	α-helix	trans	-66.7	-43.2	178.4	-172.9	179.2	176	-178.3	0	112.6	G308 L312 E313 E314	G308-K310 VanDerWaalsContact C-N 3.29Å; G308-K310 PolarHBondContact O-N 3.16Å; K310-L312 VanDerWaalsContact C-N 3.31Å; K310-E313 PolarHBondContact O-N 2.9Å; K310-E314 WeakPolarHBondContact CE-OE1 3.43Å; K310-E314 WeakPolarHBondContact O-CG 3.45Å; K310-E314 PolarHBondContact O-N 3.01Å
311	E	76.8	Confident	75.2	Confident	91 Å²	91	61.2 Å²	61.2	43%	0.425	30%	0.304	S	S	.	.	H	α-helix	trans	-68.7	-34.6	177.6	-167.9	177.8	-167.7	0	0	111.2	I307 G308 E314 L315 K348	I307-E311 HydrophobicContact CD1-CB 4.26Å; I307-E311 HydrophobicContact CD1-CG 4.03Å; I307-E311 HydrophobicContact CG1-CB 3.97Å; I307-E311 HydrophobicContact CG1-CG 4.16Å; G308-E311 PolarHBondContact O-N 2.74Å; G308-E311 VanDerWaalsContact O-N 3.08Å; E311-E314 PolarHBondContact O-N 3.45Å; E311-L315 WeakPolarHBondContact O-CG 3.28Å; E311-L315 PolarHBondContact O-N 3.27Å; E311-K348 IonicContact OE1-NZ 3.81Å
312	L	78.7	Confident	75.2	Confident	4 Å²	4	58.4 Å²	58.4	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-60.9	-44.5	173.9	-177.6	56.3	0	0	0	111.8	I297 I300 R301 I307 G308 M309 K310 L315 A316	I297-L312 HydrophobicContact CG2-CD1 3.99Å; I297-L312 HydrophobicContact CG2-CD2 3.76Å; I297-L312 HydrophobicContact CG2-CG 3.99Å; I300-L312 HydrophobicContact CB-CD1 3.87Å; I300-L312 HydrophobicContact CG2-CD1 3.48Å; I300-L312 VanDerWaalsContact CG2-CD1 3.48Å; R301-L312 HydrophobicContact CG-CD1 4.11Å; R301-L312 HydrophobicContact CG-CD2 3.95Å; I307-L312 HydrophobicContact CD1-CB 4.46Å; I307-L312 HydrophobicContact CG1-CB 4.4Å; I307-L312 HydrophobicContact CG2-CB 4.07Å; I307-L312 HydrophobicContact CG2-CD1 3.91Å; I307-L312 HydrophobicContact CG2-CD2 4.36Å; I307-L312 HydrophobicContact CG2-CG 4.35Å; G308-L312 WeakPolarHBondContact O-CB 3.4Å; G308-L312 PolarHBondContact O-N 3.11Å; M309-L312 WeakPolarHBondContact O-CB 3.39Å; M309-L312 PolarHBondContact O-N 2.97Å; M309-L312 HydrophobicContact SD-CD2 4.4Å; K310-L312 VanDerWaalsContact C-N 3.31Å; L312-L315 PolarHBondContact O-N 2.88Å; L312-A316 WeakPolarHBondContact O-CB 3.2Å; L312-A316 PolarHBondContact O-N 3.34Å
313	E	74.6	Confident	75	Confident	12 Å²	12	55 Å²	55	6%	0.056	28%	0.28	C	S	.	.	H	α-helix	trans	-62.7	-45.9	175.8	-73.9	171.8	174	0	0	111.8	M309 K310 L315 A316 Q317 M355 T670 R673 L674	M309-E313 VanDerWaalsContact O-CG 3.28Å; M309-E313 WeakPolarHBondContact O-CG 3.11Å; M309-E313 PolarHBondContact O-N 3.16Å; K310-E313 PolarHBondContact O-N 2.9Å; E313-L315 PolarHBondContact O-N 3.32Å; E313-A316 PolarHBondContact O-N 3.01Å; E313-Q317 WeakPolarHBondContact O-CB 3.39Å; E313-Q317 PolarHBondContact O-N 3.06Å; E313-M355 WeakPolarHBondContact O-CE 3.46Å; E313-T670 HydrophobicContact CG-CG2 3.52Å; E313-T670 WeakPolarHBondContact OE1-CB 3.34Å; E313-T670 WeakPolarHBondContact OE1-CG2 3.44Å; E313-T670 PolarHBondContact OE1-OG1 3.39Å; E313-R673 IonicContact OE1-CZ 3.47Å; E313-R673 IonicContact OE1-NH2 2.71Å; E313-R673 PolarHBondContact OE1-NH2 3.22Å; E313-R673 IonicContact OE2-CZ 3.17Å; E313-R673 IonicContact OE2-NH2 2.8Å; E313-R673 PolarHBondContact OE2-NH2 2.9Å; E313-L674 HydrophobicContact CB-CD1 4.5Å; E313-L674 HydrophobicContact CB-CD2 4.18Å; E313-L674 HydrophobicContact CG-CD1 4.26Å
314	E	73.9	Confident	74.4	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.075	27%	0.267	C	S	.	.	H	α-helix	trans	-57.8	-48	176.3	-74.1	172.1	-163.3	0	0	112	K310 E311 M318 M355	K310-E314 WeakPolarHBondContact CE-OE1 3.43Å; K310-E314 WeakPolarHBondContact O-CG 3.45Å; K310-E314 PolarHBondContact O-N 3.01Å; E311-E314 PolarHBondContact O-N 3.45Å; E314-M318 WeakPolarHBondContact O-CB 3.23Å; E314-M318 VanDerWaalsContact O-CG 3.25Å; E314-M318 WeakPolarHBondContact O-CG 3.46Å; E314-M318 PolarHBondContact O-N 3.47Å; E314-M355 HydrophobicContact CB-SD 4.11Å; E314-M355 HydrophobicContact CG-CE 4.28Å; E314-M355 HydrophobicContact CG-SD 3.27Å; E314-M355 WeakPolarHBondContact CG-SD 3.28Å
315	L	78.3	Confident	73.8	Confident	45 Å²	45	50.9 Å²	50.9	24%	0.236	28%	0.281	C	S	.	.	H	α-helix	trans	-67.4	-40.5	177.4	-69.5	-176.2	0	0	0	111.9	I300 I307 E311 L312 E313 M318 E319	I300-L315 VanDerWaalsContact CD1-C 3.44Å; I300-L315 HydrophobicContact CD1-CB 3.7Å; I300-L315 HydrophobicContact CG1-CB 4.38Å; I300-L315 HydrophobicContact CG2-CB 4.19Å; I300-L315 HydrophobicContact CG2-CD1 3.88Å; I307-L315 HydrophobicContact CD1-CD1 3.42Å; I307-L315 VanDerWaalsContact CD1-CD1 3.42Å; I307-L315 HydrophobicContact CD1-CG 4.39Å; E311-L315 WeakPolarHBondContact O-CG 3.28Å; E311-L315 PolarHBondContact O-N 3.27Å; L312-L315 PolarHBondContact O-N 2.88Å; E313-L315 PolarHBondContact O-N 3.32Å; L315-M318 WeakPolarHBondContact O-CB 3.21Å; L315-M318 PolarHBondContact O-N 2.85Å; L315-E319 VanDerWaalsContact O-CB 3.31Å; L315-E319 WeakPolarHBondContact O-CB 3.24Å; L315-E319 PolarHBondContact O-N 3.47Å
316	A	79.9	Confident	74	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-42.1	178.8	0	0	0	0	0	111.5	I297 I300 L312 E313 E319 V320 L674	I297-A316 HydrophobicContact CD1-CB 4.38Å; I297-A316 HydrophobicContact CG1-CB 3.51Å; I300-A316 VanDerWaalsContact CD1-CA 3.45Å; I300-A316 HydrophobicContact CD1-CB 3.99Å; I300-A316 VanDerWaalsContact CD1-N 3.31Å; L312-A316 WeakPolarHBondContact O-CB 3.2Å; L312-A316 PolarHBondContact O-N 3.34Å; E313-A316 PolarHBondContact O-N 3.01Å; A316-E319 PolarHBondContact O-N 2.86Å; A316-V320 WeakPolarHBondContact O-CG2 3.41Å; A316-V320 PolarHBondContact O-N 3.45Å; A316-L674 HydrophobicContact CB-CD1 4.29Å
317	Q	75.1	Confident	74.1	Confident	7 Å²	7	42 Å²	42	3%	0.033	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-43.7	174.2	-176.5	162.5	-0.1	0	0	111.6	E313 E319 V320 L321 V351 M355 L674 Q677	E313-Q317 WeakPolarHBondContact O-CB 3.39Å; E313-Q317 PolarHBondContact O-N 3.06Å; Q317-E319 VanDerWaalsContact C-N 3.32Å; Q317-E319 PolarHBondContact O-N 3.31Å; Q317-V320 PolarHBondContact O-N 3.17Å; Q317-L321 HydrophobicContact CG-CD1 3.74Å; Q317-L321 HydrophobicContact CG-CG 4.11Å; Q317-L321 VanDerWaalsContact O-CB 3.23Å; Q317-L321 WeakPolarHBondContact O-CB 3.47Å; Q317-L321 WeakPolarHBondContact O-CD1 3.33Å; Q317-L321 WeakPolarHBondContact O-CG 3.31Å; Q317-L321 PolarHBondContact O-N 3.18Å; Q317-V351 HydrophobicContact CG-CG1 4.43Å; Q317-M355 HydrophobicContact CB-CE 3.51Å; Q317-M355 HydrophobicContact CG-CE 4.13Å; Q317-L674 HydrophobicContact CB-CD2 4.29Å; Q317-Q677 PolarHBondContact NE2-O 3.1Å
318	M	74.7	Confident	74.1	Confident	16 Å²	16	41.1 Å²	41.1	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-45.1	174.6	-78.2	-71.6	-52.5	0	0	112.2	E314 L315 L321 N322 I346 V351 V705	E314-M318 WeakPolarHBondContact O-CB 3.23Å; E314-M318 VanDerWaalsContact O-CG 3.25Å; E314-M318 WeakPolarHBondContact O-CG 3.46Å; E314-M318 PolarHBondContact O-N 3.47Å; L315-M318 WeakPolarHBondContact O-CB 3.21Å; L315-M318 PolarHBondContact O-N 2.85Å; M318-L321 PolarHBondContact O-N 2.72Å; M318-N322 VanDerWaalsContact O-CB 3.31Å; M318-N322 WeakPolarHBondContact O-CB 3.3Å; M318-N322 VanDerWaalsContact O-CG 3.26Å; M318-N322 PolarHBondContact O-N 2.82Å; M318-N322 PolarHBondContact O-ND2 3.37Å; M318-I346 HydrophobicContact CE-CG2 3.55Å; M318-I346 HydrophobicContact SD-CG2 3.6Å; M318-I346 VanDerWaalsContact SD-CG2 3.6Å; M318-V351 HydrophobicContact CG-CB 4.37Å; M318-V351 HydrophobicContact CG-CG1 4.28Å; M318-V351 HydrophobicContact CG-CG2 4.35Å; M318-V351 HydrophobicContact SD-CB 3.91Å; M318-V351 HydrophobicContact SD-CG1 4.37Å; M318-V351 HydrophobicContact SD-CG2 3.39Å; M318-V351 WeakPolarHBondContact SD-CG2 3.5Å; M318-V705 HydrophobicContact CE-CG1 4.32Å
319	E	77.7	Confident	74.3	Confident	52 Å²	52	39.2 Å²	39.2	24%	0.243	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-49	-179.5	-172.5	66.4	-170	0	0	111.5	A296 I300 L315 A316 Q317 L321 N322 K323	A296-E319 HydrophobicContact CB-CB 4.09Å; A296-E319 HydrophobicContact CB-CG 3.87Å; I300-E319 HydrophobicContact CD1-CB 4.36Å; L315-E319 VanDerWaalsContact O-CB 3.31Å; L315-E319 WeakPolarHBondContact O-CB 3.24Å; L315-E319 PolarHBondContact O-N 3.47Å; A316-E319 PolarHBondContact O-N 2.86Å; Q317-E319 VanDerWaalsContact C-N 3.32Å; Q317-E319 PolarHBondContact O-N 3.31Å; E319-L321 PolarHBondContact O-N 3.39Å; E319-N322 PolarHBondContact O-N 2.79Å; E319-K323 HydrophobicContact CG-CD 4.09Å; E319-K323 WeakPolarHBondContact O-CB 3.21Å; E319-K323 WeakPolarHBondContact O-CG 3.47Å; E319-K323 PolarHBondContact O-N 2.96Å; E319-K323 WeakPolarHBondContact OE1-CE 3.17Å; E319-K323 IonicContact OE1-NZ 3.4Å; E319-K323 PolarHBondContact OE1-NZ 2.94Å
320	V	76.4	Confident	74.9	Confident	15 Å²	15	36.3 Å²	36.3	9%	0.091	19%	0.187	C	C	.	.	H	α-helix	trans	-65.4	-39.4	177.7	174.6	0	0	0	0	111.6	Y293 A296 A316 Q317 N322 G324	Y293-V320 HydrophobicContact CD1-CB 4.19Å; Y293-V320 HydrophobicContact CD1-CG2 3.6Å; Y293-V320 HydrophobicContact CD2-CG1 4.27Å; Y293-V320 HydrophobicContact CD2-CG2 4.34Å; Y293-V320 HydrophobicContact CE1-CB 3.83Å; Y293-V320 HydrophobicContact CE1-CG1 4.1Å; Y293-V320 HydrophobicContact CE1-CG2 3.78Å; Y293-V320 HydrophobicContact CE2-CB 4.42Å; Y293-V320 HydrophobicContact CE2-CG1 3.79Å; Y293-V320 HydrophobicContact CE2-CG2 4.48Å; Y293-V320 HydrophobicContact CG-CG2 3.88Å; A296-V320 HydrophobicContact CB-CG2 3.84Å; A316-V320 WeakPolarHBondContact O-CG2 3.41Å; A316-V320 PolarHBondContact O-N 3.45Å; Q317-V320 PolarHBondContact O-N 3.17Å; V320-N322 VanDerWaalsContact C-N 3.32Å; V320-N322 PolarHBondContact O-N 3.47Å; V320-G324 WeakPolarHBondContact O-CA 3.13Å; V320-G324 PolarHBondContact O-N 2.88Å
321	L	72.3	Confident	75.5	Confident	11 Å²	11	31 Å²	31	6%	0.058	16%	0.163	C	C	.	.	H	α-helix	trans	-64.6	-36.4	175.4	-73.7	174	0	0	0	112.4	Q317 M318 E319 L680 V683	Q317-L321 HydrophobicContact CG-CD1 3.74Å; Q317-L321 HydrophobicContact CG-CG 4.11Å; Q317-L321 VanDerWaalsContact O-CB 3.23Å; Q317-L321 WeakPolarHBondContact O-CB 3.47Å; Q317-L321 WeakPolarHBondContact O-CD1 3.33Å; Q317-L321 WeakPolarHBondContact O-CG 3.31Å; Q317-L321 PolarHBondContact O-N 3.18Å; M318-L321 PolarHBondContact O-N 2.72Å; E319-L321 PolarHBondContact O-N 3.39Å; L321-L680 HydrophobicContact CD2-CB 4.4Å; L321-V683 HydrophobicContact CD1-CG2 3.65Å
322	N	73.6	Confident	75.7	Confident	24 Å²	24	26.8 Å²	26.8	13%	0.128	14%	0.144	C	C	.	.	H	α-helix	trans	-75.8	-38.6	178.8	-78.9	-22.3	0	0	0	112.7	M318 E319 V320 K326	M318-N322 VanDerWaalsContact O-CB 3.31Å; M318-N322 WeakPolarHBondContact O-CB 3.3Å; M318-N322 VanDerWaalsContact O-CG 3.26Å; M318-N322 PolarHBondContact O-N 2.82Å; M318-N322 PolarHBondContact O-ND2 3.37Å; E319-N322 PolarHBondContact O-N 2.79Å; V320-N322 VanDerWaalsContact C-N 3.32Å; V320-N322 PolarHBondContact O-N 3.47Å; N322-K326 WeakPolarHBondContact O-CE 3.32Å; N322-K326 PolarHBondContact O-NZ 2.81Å
323	K	71.5	Confident	75.9	Confident	116 Å²	116	26.6 Å²	26.6	50%	0.504	14%	0.143	S	C	.	.	H	α-helix	trans	-73.6	-27.4	175	-77.4	175.7	167.8	152.9	0	112.8	E299 E319	E299-K323 IonicContact OE2-NZ 2.97Å; E299-K323 PolarHBondContact OE2-NZ 3.28Å; E319-K323 HydrophobicContact CG-CD 4.09Å; E319-K323 WeakPolarHBondContact O-CB 3.21Å; E319-K323 WeakPolarHBondContact O-CG 3.47Å; E319-K323 PolarHBondContact O-N 2.96Å; E319-K323 WeakPolarHBondContact OE1-CE 3.17Å; E319-K323 IonicContact OE1-NZ 3.4Å; E319-K323 PolarHBondContact OE1-NZ 2.94Å
324	G	67	Low	76.3	Confident	24 Å²	24	26.7 Å²	26.7	25%	0.247	14%	0.143	C	C	.	.	S	Bend	trans	-63.7	160.5	-178.3	0	0	0	0	0	114	V320 K326	V320-G324 WeakPolarHBondContact O-CA 3.13Å; V320-G324 PolarHBondContact O-N 2.88Å; G324-K326 PolarHBondContact O-N 3.22Å
325	P	65.7	Low	76.7	Confident	113 Å²	113	26 Å²	26	73%	0.734	14%	0.14	S	C	*	.	P	Polyproline II helix	trans	-63.5	124.1	176.3	27	-33.5	0	0	0	110.5
326	K	75.9	Confident	76.9	Confident	54 Å²	54	24 Å²	24	24%	0.235	13%	0.13	C	C	.	.	P	Polyproline II helix	trans	-88.5	138.4	-179	-73.1	160.6	178.9	170.1	0	110.4	N322 G324 Y330 Y331	N322-K326 WeakPolarHBondContact O-CE 3.32Å; N322-K326 PolarHBondContact O-NZ 2.81Å; G324-K326 PolarHBondContact O-N 3.22Å; K326-Y330 HydrophobicContact CB-CD1 3.75Å; K326-Y330 HydrophobicContact CB-CE1 4.34Å; K326-Y330 HydrophobicContact CB-CG 4.24Å; K326-Y330 HydrophobicContact CD-CD1 3.89Å; K326-Y330 HydrophobicContact CD-CE1 3.57Å; K326-Y330 HydrophobicContact CG-CD1 3.81Å; K326-Y330 HydrophobicContact CG-CE1 3.95Å; K326-Y330 HydrophobicContact CG-CG 4.32Å; K326-Y331 HydrophobicContact CB-CD2 4.42Å; K326-Y331 HydrophobicContact CB-CE1 4.3Å; K326-Y331 HydrophobicContact CB-CE2 3.58Å; K326-Y331 WeakPolarHBondContact CB-OH 3.49Å; K326-Y331 HydrophobicContact CD-CE1 4.05Å; K326-Y331 WeakPolarHBondContact CD-OH 3.4Å
327	S	74.8	Confident	77.1	Confident	23 Å²	23	24.5 Å²	24.5	16%	0.161	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-75.2	162.4	178.8	92.1	0	0	0	0	112.2	E86 A329 Y330 Y331	E86-S327 VanDerWaalsContact OE1-CB 3.23Å; E86-S327 WeakPolarHBondContact OE1-CB 3.38Å; E86-S327 PolarHBondContact OE1-OG 3.42Å; E86-S327 VanDerWaalsContact OE1-OG 3.11Å; E86-S327 WeakPolarHBondContact OE2-CB 3.17Å; E86-S327 PolarHBondContact OE2-OG 3.42Å; S327-A329 VanDerWaalsContact C-N 3.28Å; S327-A329 PolarHBondContact O-N 3.06Å; S327-A329 PolarHBondContact OG-N 2.93Å; S327-A329 VanDerWaalsContact OG-N 3.11Å; S327-Y330 WeakPolarHBondContact O-CB 3.29Å; S327-Y330 PolarHBondContact O-N 2.63Å; S327-Y330 PolarHBondContact OG-N 3.45Å; S327-Y330 VanDerWaalsContact OG-N 3.07Å; S327-Y331 VanDerWaalsContact O-CD2 3.26Å; S327-Y331 WeakPolarHBondContact O-CD2 3.3Å; S327-Y331 PolarHBondContact O-N 3.43Å
328	R	74.2	Confident	77.4	Confident	13 Å²	13	27.6 Å²	27.6	5%	0.049	15%	0.146	C	C	.	.	H	α-helix	trans	-55.1	-42.4	168.6	167	171.9	-176.2	-176.2	5.5	112.8	M82 N118 S126 Y330 Y331 R332 N812 S816	M82-R328 HydrophobicContact CE-CG 4.34Å; N118-R328 PolarHBondContact O-NH1 2.87Å; N118-R328 VanDerWaalsContact O-NH1 3.16Å; S126-R328 PolarHBondContact OG-NH2 3.47Å; R328-Y330 VanDerWaalsContact C-N 3.31Å; R328-Y331 PolarHBondContact O-N 3.41Å; R328-R332 PolarHBondContact O-N 3.36Å; R328-N812 WeakPolarHBondContact CD-ND2 3.46Å; R328-N812 WeakPolarHBondContact CD-OD1 3.29Å; R328-N812 WeakPolarHBondContact CG-ND2 3.36Å; R328-N812 PolarHBondContact NE-ND2 2.89Å; R328-S816 PolarHBondContact NH2-OG 3.1Å
329	A	78	Confident	77.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64	-41.6	179.9	0	0	0	0	0	110.5	M82 E86 M122 S327 Y331 R332 M333	M82-A329 HydrophobicContact CB-CB 4.23Å; M82-A329 HydrophobicContact CE-CB 4.08Å; E86-A329 HydrophobicContact CB-CB 3.81Å; E86-A329 HydrophobicContact CG-CB 4.33Å; E86-A329 VanDerWaalsContact OE2-CB 3.26Å; E86-A329 WeakPolarHBondContact OE2-CB 3.39Å; M122-A329 HydrophobicContact CE-CB 3.82Å; M122-A329 HydrophobicContact SD-CB 3.86Å; S327-A329 VanDerWaalsContact C-N 3.28Å; S327-A329 PolarHBondContact O-N 3.06Å; S327-A329 PolarHBondContact OG-N 2.93Å; S327-A329 VanDerWaalsContact OG-N 3.11Å; A329-Y331 VanDerWaalsContact C-N 3.34Å; A329-Y331 PolarHBondContact O-N 3.28Å; A329-R332 PolarHBondContact O-N 3.44Å; A329-R332 VanDerWaalsContact O-N 3.13Å; A329-M333 VanDerWaalsContact C-CE 3.44Å; A329-M333 HydrophobicContact CB-CE 4.05Å; A329-M333 WeakPolarHBondContact O-CE 3.17Å; A329-M333 VanDerWaalsContact O-CG 3.3Å; A329-M333 WeakPolarHBondContact O-CG 3.3Å; A329-M333 PolarHBondContact O-N 3.16Å
330	Y	84	Confident	77.8	Confident	7 Å²	7	27 Å²	27	3%	0.027	15%	0.145	C	C	.	.	H	α-helix	trans	-50.4	-52.4	176.2	173.6	-88.4	0	0	0	111.8	K326 S327 R328 R332 M333 Q334 V345 I346 L680	K326-Y330 HydrophobicContact CB-CD1 3.75Å; K326-Y330 HydrophobicContact CB-CE1 4.34Å; K326-Y330 HydrophobicContact CB-CG 4.24Å; K326-Y330 HydrophobicContact CD-CD1 3.89Å; K326-Y330 HydrophobicContact CD-CE1 3.57Å; K326-Y330 HydrophobicContact CG-CD1 3.81Å; K326-Y330 HydrophobicContact CG-CE1 3.95Å; K326-Y330 HydrophobicContact CG-CG 4.32Å; S327-Y330 WeakPolarHBondContact O-CB 3.29Å; S327-Y330 PolarHBondContact O-N 2.63Å; S327-Y330 PolarHBondContact OG-N 3.45Å; S327-Y330 VanDerWaalsContact OG-N 3.07Å; R328-Y330 VanDerWaalsContact C-N 3.31Å; Y330-R332 VanDerWaalsContact C-N 3.33Å; Y330-R332 PolarHBondContact O-N 3.42Å; Y330-M333 PolarHBondContact O-N 3.34Å; Y330-Q334 HydrophobicContact CE1-CB 4.46Å; Y330-Q334 WeakPolarHBondContact O-CB 3.48Å; Y330-Q334 PolarHBondContact O-N 3.4Å; Y330-Q334 PolarHBondContact OH-OE1 3.01Å; Y330-V345 HydrophobicContact CD2-CB 4.07Å; Y330-V345 HydrophobicContact CD2-CG1 3.96Å; Y330-V345 HydrophobicContact CD2-CG2 4.48Å; Y330-V345 HydrophobicContact CE2-CB 3.74Å; Y330-V345 HydrophobicContact CE2-CG1 4.07Å; Y330-V345 HydrophobicContact CE2-CG2 4.35Å; Y330-I346 HydrophobicContact CE2-CD1 3.71Å; Y330-I346 HydrophobicContact CE2-CG1 3.96Å; Y330-L680 HydrophobicContact CD2-CD1 4.47Å; Y330-L680 HydrophobicContact CD2-CD2 4.46Å
331	Y	82.6	Confident	77.8	Confident	7 Å²	7	26.3 Å²	26.3	3%	0.027	14%	0.141	C	C	.	.	H	α-helix	trans	-64.8	-37	-179.3	-69.3	-60.8	0	0	0	113.2	K326 S327 R328 A329 A335 V798 A799 D803	K326-Y331 HydrophobicContact CB-CD2 4.42Å; K326-Y331 HydrophobicContact CB-CE1 4.3Å; K326-Y331 HydrophobicContact CB-CE2 3.58Å; K326-Y331 WeakPolarHBondContact CB-OH 3.49Å; K326-Y331 HydrophobicContact CD-CE1 4.05Å; K326-Y331 WeakPolarHBondContact CD-OH 3.4Å; S327-Y331 VanDerWaalsContact O-CD2 3.26Å; S327-Y331 WeakPolarHBondContact O-CD2 3.3Å; S327-Y331 PolarHBondContact O-N 3.43Å; R328-Y331 PolarHBondContact O-N 3.41Å; A329-Y331 VanDerWaalsContact C-N 3.34Å; A329-Y331 PolarHBondContact O-N 3.28Å; Y331-A335 VanDerWaalsContact O-CB 3.22Å; Y331-A335 WeakPolarHBondContact O-CB 3.31Å; Y331-A335 PolarHBondContact O-N 3.22Å; Y331-V798 HydrophobicContact CD1-CB 4.39Å; Y331-V798 HydrophobicContact CD1-CG1 3.73Å; Y331-V798 HydrophobicContact CE1-CG1 4.35Å; Y331-A799 HydrophobicContact CD1-CB 4.44Å; Y331-A799 HydrophobicContact CD2-CB 3.94Å; Y331-A799 HydrophobicContact CE2-CB 4.38Å; Y331-A799 HydrophobicContact CG-CB 3.96Å; Y331-D803 WeakPolarHBondContact CE2-OD2 3.5Å; Y331-D803 VanDerWaalsContact OH-CG 3.29Å; Y331-D803 PolarHBondContact OH-OD1 3.27Å
332	R	80.6	Confident	78	Confident	4 Å²	4	26.6 Å²	26.6	2%	0.015	14%	0.144	C	C	.	.	H	α-helix	trans	-67	-40.2	176.7	-171	157.5	-170.5	-128	11.5	112.3	M82 G125 S126 R328 A329 Y330 T336 D792 A795	M82-R332 HydrophobicContact CE-CB 4.26Å; M82-R332 HydrophobicContact CG-CB 4.4Å; M82-R332 HydrophobicContact CG-CG 4.03Å; M82-R332 PolarHBondContact SD-NH1 3.16Å; G125-R332 PolarHBondContact O-NH1 2.79Å; S126-R332 VanDerWaalsContact CA-CZ 3.46Å; S126-R332 VanDerWaalsContact CA-NH1 3.34Å; S126-R332 PolarHBondContact O-NH2 2.74Å; R328-R332 PolarHBondContact O-N 3.36Å; A329-R332 PolarHBondContact O-N 3.44Å; A329-R332 VanDerWaalsContact O-N 3.13Å; Y330-R332 VanDerWaalsContact C-N 3.33Å; Y330-R332 PolarHBondContact O-N 3.42Å; R332-T336 PolarHBondContact O-N 2.95Å; R332-T336 PolarHBondContact O-OG1 3.43Å; R332-D792 IonicContact CZ-OD1 3.07Å; R332-D792 VanDerWaalsContact CZ-OD1 3.28Å; R332-D792 IonicContact NE-OD1 2.61Å; R332-D792 PolarHBondContact NE-OD1 3.05Å; R332-D792 IonicContact NH2-OD1 2.68Å; R332-D792 PolarHBondContact NH2-OD1 3.29Å; R332-A795 HydrophobicContact CB-CB 3.8Å; R332-A795 HydrophobicContact CG-CB 4Å
333	M	83.1	Confident	78.1	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68.5	-44.8	175.9	-66.3	-178.2	-73.9	0	0	111.4	D79 M82 A83 A329 Y330 A335 T336 R337 V345 V684	D79-M333 WeakPolarHBondContact OD1-CA 3.48Å; D79-M333 WeakPolarHBondContact OD1-CB 3.18Å; D79-M333 WeakPolarHBondContact OD1-CG 3.41Å; M82-M333 HydrophobicContact CB-CG 4.16Å; A83-M333 VanDerWaalsContact CA-SD 3.53Å; A83-M333 HydrophobicContact CB-SD 3.53Å; A83-M333 VanDerWaalsContact CB-SD 3.53Å; A329-M333 VanDerWaalsContact C-CE 3.44Å; A329-M333 HydrophobicContact CB-CE 4.05Å; A329-M333 WeakPolarHBondContact O-CE 3.17Å; A329-M333 VanDerWaalsContact O-CG 3.3Å; A329-M333 WeakPolarHBondContact O-CG 3.3Å; A329-M333 PolarHBondContact O-N 3.16Å; Y330-M333 PolarHBondContact O-N 3.34Å; M333-A335 VanDerWaalsContact C-N 3.33Å; M333-A335 PolarHBondContact O-N 2.85Å; M333-T336 PolarHBondContact O-N 2.62Å; M333-R337 WeakPolarHBondContact O-CB 3.42Å; M333-R337 VanDerWaalsContact O-CG 3.25Å; M333-R337 WeakPolarHBondContact O-CG 3.07Å; M333-R337 PolarHBondContact O-N 3.2Å; M333-V345 HydrophobicContact CB-CG2 3.7Å; M333-V345 HydrophobicContact CE-CG1 4.37Å; M333-V684 HydrophobicContact CE-CB 4.15Å; M333-V684 HydrophobicContact CE-CG1 3.19Å; M333-V684 HydrophobicContact CE-CG2 3.83Å; M333-V684 HydrophobicContact SD-CG1 3.51Å; M333-V684 VanDerWaalsContact SD-CG1 3.51Å
334	Q	83.3	Confident	78.5	Confident	13 Å²	13	20.9 Å²	20.9	6%	0.061	12%	0.119	C	C	.	.	H	α-helix	trans	-59.9	-45.2	177.5	-172.1	178.2	12.5	0	0	111.3	Y330 T336 R337 Q338 V345	Y330-Q334 HydrophobicContact CE1-CB 4.46Å; Y330-Q334 WeakPolarHBondContact O-CB 3.48Å; Y330-Q334 PolarHBondContact O-N 3.4Å; Y330-Q334 PolarHBondContact OH-OE1 3.01Å; Q334-T336 PolarHBondContact O-N 3.4Å; Q334-R337 PolarHBondContact O-N 2.98Å; Q334-Q338 WeakPolarHBondContact O-CB 3.46Å; Q334-Q338 VanDerWaalsContact O-CG 3.29Å; Q334-Q338 WeakPolarHBondContact O-CG 3.23Å; Q334-Q338 PolarHBondContact O-N 3.1Å; Q334-V345 HydrophobicContact CB-CG2 3.9Å
335	A	81.9	Confident	78.8	Confident	2 Å²	2	19.7 Å²	19.7	2%	0.017	11%	0.107	C	C	.	.	H	α-helix	trans	-57.2	-49.5	175.1	0	0	0	0	0	112.1	Y331 M333 R337 Q338 L339 F794 V798	Y331-A335 VanDerWaalsContact O-CB 3.22Å; Y331-A335 WeakPolarHBondContact O-CB 3.31Å; Y331-A335 PolarHBondContact O-N 3.22Å; M333-A335 VanDerWaalsContact C-N 3.33Å; M333-A335 PolarHBondContact O-N 2.85Å; A335-R337 PolarHBondContact O-N 3.49Å; A335-Q338 PolarHBondContact O-N 2.81Å; A335-L339 VanDerWaalsContact O-CG 3.3Å; A335-L339 WeakPolarHBondContact O-CG 3.37Å; A335-L339 PolarHBondContact O-N 3.08Å; A335-L339 VanDerWaalsContact O-N 3.11Å; A335-F794 VanDerWaalsContact CB-C 3.47Å; A335-F794 HydrophobicContact CB-CB 3.67Å; A335-V798 HydrophobicContact CB-CG2 4.08Å
336	T	81.6	Confident	79	Confident	3 Å²	3	14.5 Å²	14.5	2%	0.018	7%	0.073	C	C	.	.	H	α-helix	trans	-64.2	-43.4	-179.7	-53	0	0	0	0	111.3	S75 D79 R332 M333 Q334 Q338 L339 T340	S75-T336 WeakPolarHBondContact O-CG2 3.1Å; D79-T336 HydrophobicContact CB-CG2 3.89Å; R332-T336 PolarHBondContact O-N 2.95Å; R332-T336 PolarHBondContact O-OG1 3.43Å; M333-T336 PolarHBondContact O-N 2.62Å; Q334-T336 PolarHBondContact O-N 3.4Å; T336-Q338 PolarHBondContact O-N 3.44Å; T336-L339 PolarHBondContact O-N 3.34Å; T336-T340 HydrophobicContact CG2-CG2 4.19Å; T336-T340 VanDerWaalsContact O-CG2 3.25Å; T336-T340 WeakPolarHBondContact O-CG2 3.47Å; T336-T340 PolarHBondContact O-N 3.41Å; T336-T340 PolarHBondContact O-OG1 2.95Å
337	R	85.4	Confident	78.8	Confident	11 Å²	11	13.8 Å²	13.8	4%	0.042	7%	0.07	C	C	.	.	H	α-helix	trans	-65.3	-36.8	179.3	-69.5	-179.9	175.8	-147.5	-6.9	112.8	D79 M333 Q334 A335 T340 G341 S342 G343 N344 E695	D79-R337 IonicContact OD2-NE 2.64Å; M333-R337 WeakPolarHBondContact O-CB 3.42Å; M333-R337 VanDerWaalsContact O-CG 3.25Å; M333-R337 WeakPolarHBondContact O-CG 3.07Å; M333-R337 PolarHBondContact O-N 3.2Å; Q334-R337 PolarHBondContact O-N 2.98Å; A335-R337 PolarHBondContact O-N 3.49Å; R337-T340 PolarHBondContact O-N 3.13Å; R337-T340 PolarHBondContact O-OG1 2.85Å; R337-G341 PolarHBondContact O-N 3.34Å; R337-S342 PolarHBondContact O-N 2.84Å; R337-G343 WeakPolarHBondContact CB-O 3.29Å; R337-N344 PolarHBondContact NH1-O 3.19Å; R337-E695 IonicContact NH2-OE1 2.66Å; R337-E695 IonicContact NH2-OE2 3.69Å
338	Q	81	Confident	78.4	Confident	71 Å²	71	16.9 Å²	16.9	33%	0.332	8%	0.08	S	C	.	.	H	α-helix	trans	-64.4	-39.5	173.1	-75.7	177.4	-1.4	0	0	112.1	Q334 A335 T336	Q334-Q338 WeakPolarHBondContact O-CB 3.46Å; Q334-Q338 VanDerWaalsContact O-CG 3.29Å; Q334-Q338 WeakPolarHBondContact O-CG 3.23Å; Q334-Q338 PolarHBondContact O-N 3.1Å; A335-Q338 PolarHBondContact O-N 2.81Å; T336-Q338 PolarHBondContact O-N 3.44Å
339	L	77.8	Confident	77.8	Confident	52 Å²	52	18.2 Å²	18.2	27%	0.272	9%	0.094	S	C	.	.	H	α-helix	trans	-69.3	-34.9	176.8	-65.8	166.8	0	0	0	112.6	A335 T336 M721 F794	A335-L339 VanDerWaalsContact O-CG 3.3Å; A335-L339 WeakPolarHBondContact O-CG 3.37Å; A335-L339 PolarHBondContact O-N 3.08Å; A335-L339 VanDerWaalsContact O-N 3.11Å; T336-L339 PolarHBondContact O-N 3.34Å; L339-M721 VanDerWaalsContact O-CB 3.27Å; L339-M721 WeakPolarHBondContact O-CB 3.42Å; L339-M721 WeakPolarHBondContact O-CE 3.2Å; L339-M721 WeakPolarHBondContact O-CG 3.21Å; L339-F794 HydrophobicContact CD1-CB 4.07Å; L339-F794 HydrophobicContact CD1-CD1 4.28Å; L339-F794 HydrophobicContact CD1-CD2 3.25Å; L339-F794 HydrophobicContact CD1-CE2 3.61Å; L339-F794 HydrophobicContact CD1-CG 3.63Å; L339-F794 HydrophobicContact CD1-CZ 4.27Å; L339-F794 HydrophobicContact CD2-CD1 3.96Å; L339-F794 HydrophobicContact CD2-CD2 4.09Å; L339-F794 HydrophobicContact CD2-CE1 3.68Å; L339-F794 HydrophobicContact CD2-CE2 3.79Å; L339-F794 HydrophobicContact CD2-CG 4.17Å; L339-F794 HydrophobicContact CD2-CZ 3.58Å; L339-F794 HydrophobicContact CG-CD1 4.46Å; L339-F794 HydrophobicContact CG-CD2 4.2Å; L339-F794 HydrophobicContact CG-CE2 4.33Å; L339-F794 HydrophobicContact CG-CG 4.26Å
340	T	82.3	Confident	77.4	Confident	5 Å²	5	18.5 Å²	18.5	3%	0.031	10%	0.095	C	C	.	.	H	α-helix	trans	-92.2	-1.3	-175.1	66.7	0	0	0	0	113.3	I76 T336 R337 S342 T725 K729	I76-T340 HydrophobicContact CD1-CG2 4.32Å; I76-T340 HydrophobicContact CG1-CG2 3.73Å; T336-T340 HydrophobicContact CG2-CG2 4.19Å; T336-T340 VanDerWaalsContact O-CG2 3.25Å; T336-T340 WeakPolarHBondContact O-CG2 3.47Å; T336-T340 PolarHBondContact O-N 3.41Å; T336-T340 PolarHBondContact O-OG1 2.95Å; R337-T340 PolarHBondContact O-N 3.13Å; R337-T340 PolarHBondContact O-OG1 2.85Å; T340-S342 PolarHBondContact OG1-OG 3.32Å; T340-T725 HydrophobicContact CG2-CG2 3.93Å; T340-T725 PolarHBondContact O-OG1 3.26Å; T340-K729 WeakPolarHBondContact O-CE 3.46Å; T340-K729 PolarHBondContact O-NZ 3.2Å
341	G	77.4	Confident	76.6	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	34	-175.2	0	0	0	0	0	114.1	R337	R337-G341 PolarHBondContact O-N 3.34Å
342	S	76.9	Confident	75.9	Confident	17 Å²	17	22.4 Å²	22.4	12%	0.119	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-96.9	-1.3	179	-58.3	0	0	0	0	113.4	R337 T340 K347 K729	R337-S342 PolarHBondContact O-N 2.84Å; T340-S342 PolarHBondContact OG1-OG 3.32Å; S342-K347 PolarHBondContact O-NZ 2.92Å; S342-K347 VanDerWaalsContact O-NZ 3.12Å; S342-K729 WeakPolarHBondContact OG-CE 3.48Å; S342-K729 PolarHBondContact OG-NZ 3.43Å
343	G	76.2	Confident	75.2	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.01	14%	0.135	C	C	.	.			trans	74	-150.6	-178.5	0	0	0	0	0	114.3	R337 S700 A701	R337-G343 WeakPolarHBondContact CB-O 3.29Å; G343-S700 WeakPolarHBondContact CA-O 3.46Å; G343-S700 PolarHBondContact N-O 3.07Å; G343-A701 VanDerWaalsContact CA-O 3.32Å; G343-A701 WeakPolarHBondContact CA-O 3.39Å
344	N	79.5	Confident	74.4	Confident	18 Å²	18	29.9 Å²	29.9	10%	0.096	14%	0.142	C	C	.	.			trans	-83.8	160	-176.5	-67.1	-21.6	0	0	0	113.6	R337 I346 K347 G703 V705	R337-N344 PolarHBondContact NH1-O 3.19Å; N344-I346 WeakPolarHBondContact CB-O 3.41Å; N344-K347 WeakPolarHBondContact O-CE 3.05Å; N344-G703 PolarHBondContact ND2-O 3.16Å; N344-V705 WeakPolarHBondContact ND2-CG2 3.4Å
345	V	72.7	Confident	73.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.144	C	C	.	.	S	Bend	trans	-70.9	-46.6	174.6	178.2	0	0	0	0	110.6	Y330 M333 Q334 V684	Y330-V345 HydrophobicContact CD2-CB 4.07Å; Y330-V345 HydrophobicContact CD2-CG1 3.96Å; Y330-V345 HydrophobicContact CD2-CG2 4.48Å; Y330-V345 HydrophobicContact CE2-CB 3.74Å; Y330-V345 HydrophobicContact CE2-CG1 4.07Å; Y330-V345 HydrophobicContact CE2-CG2 4.35Å; M333-V345 HydrophobicContact CB-CG2 3.7Å; M333-V345 HydrophobicContact CE-CG1 4.37Å; Q334-V345 HydrophobicContact CB-CG2 3.9Å; V345-V684 HydrophobicContact CG1-CG2 3.93Å
346	I	71	Confident	72.4	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.015	16%	0.162	C	C	.	.	S	Bend	trans	-90.9	123.3	174.1	-61.3	163.1	0	0	0	107.8	M318 Y330 N344 V351 L680 V683	M318-I346 HydrophobicContact CE-CG2 3.55Å; M318-I346 HydrophobicContact SD-CG2 3.6Å; M318-I346 VanDerWaalsContact SD-CG2 3.6Å; Y330-I346 HydrophobicContact CE2-CD1 3.71Å; Y330-I346 HydrophobicContact CE2-CG1 3.96Å; N344-I346 WeakPolarHBondContact CB-O 3.41Å; I346-V351 HydrophobicContact CG2-CG2 4.47Å; I346-L680 HydrophobicContact CD1-CD1 3.81Å; I346-V683 HydrophobicContact CB-CG1 4.28Å; I346-V683 HydrophobicContact CG1-CG1 3.97Å; I346-V683 HydrophobicContact CG2-CG1 4.15Å
347	K	71.2	Confident	71.3	Confident	39 Å²	39	40 Å²	40	17%	0.17	19%	0.193	C	C	.	.			trans	-125.3	137.9	175.8	-60.7	-172.9	-178.5	-172.8	0	108.8	S342 N344 A349 K350 V351 S700	S342-K347 PolarHBondContact O-NZ 2.92Å; S342-K347 VanDerWaalsContact O-NZ 3.12Å; N344-K347 WeakPolarHBondContact O-CE 3.05Å; K347-A349 VanDerWaalsContact C-N 3.31Å; K347-A349 PolarHBondContact O-N 3.43Å; K347-K350 HydrophobicContact CB-CB 4.23Å; K347-K350 WeakPolarHBondContact O-CB 3.36Å; K347-K350 PolarHBondContact O-N 3.43Å; K347-V351 PolarHBondContact O-N 3.31Å; K347-S700 PolarHBondContact NZ-OG 3.35Å
348	K	66.4	Low	69.7	Low	89 Å²	89	42.1 Å²	42.1	39%	0.387	21%	0.205	S	C	.	.	H	α-helix	trans	-52	-49.7	177.9	-175.5	176.8	178.7	177.3	0	111.3	E311 K350 V351 E352	E311-K348 IonicContact OE1-NZ 3.81Å; K348-K350 PolarHBondContact O-N 3.42Å; K348-V351 PolarHBondContact O-N 3.02Å; K348-V351 VanDerWaalsContact O-N 3.1Å; K348-E352 PolarHBondContact O-N 2.79Å
349	A	60.7	Low	68.2	Low	40 Å²	40	43.4 Å²	43.4	33%	0.331	21%	0.214	S	C	.	.	H	α-helix	trans	-63	-15	178.6	0	0	0	0	0	115.2	K347 R353	K347-A349 VanDerWaalsContact C-N 3.31Å; K347-A349 PolarHBondContact O-N 3.43Å; A349-R353 PolarHBondContact O-NE 2.82Å
350	K	69.2	Low	66.6	Low	7 Å²	7	47.7 Å²	47.7	3%	0.03	24%	0.238	C	C	.	.	H	α-helix	trans	-87.5	-40.5	175	-171.5	174.2	-178.8	177.4	0	111	K347 K348 R354 V683 V684 G685 E691	K347-K350 HydrophobicContact CB-CB 4.23Å; K347-K350 WeakPolarHBondContact O-CB 3.36Å; K347-K350 PolarHBondContact O-N 3.43Å; K348-K350 PolarHBondContact O-N 3.42Å; K350-R354 PolarHBondContact O-N 3.45Å; K350-V683 WeakPolarHBondContact CD-O 3.32Å; K350-V683 WeakPolarHBondContact CE-O 3.33Å; K350-V683 PolarHBondContact NZ-O 3.16Å; K350-V684 PolarHBondContact NZ-O 2.78Å; K350-G685 WeakPolarHBondContact CE-O 2.88Å; K350-G685 PolarHBondContact NZ-O 2.98Å; K350-E691 WeakPolarHBondContact CE-OE1 3.47Å; K350-E691 IonicContact NZ-OE1 2.93Å
351	V	67.4	Low	64.9	Low	4 Å²	4	57.2 Å²	57.2	2%	0.024	27%	0.273	C	S	.	.	H	α-helix	trans	-65.5	-47.7	175.3	176.7	0	0	0	0	110.6	Q317 M318 I346 K347 K348 R353 R354 M355 V683	Q317-V351 HydrophobicContact CG-CG1 4.43Å; M318-V351 HydrophobicContact CG-CB 4.37Å; M318-V351 HydrophobicContact CG-CG1 4.28Å; M318-V351 HydrophobicContact CG-CG2 4.35Å; M318-V351 HydrophobicContact SD-CB 3.91Å; M318-V351 HydrophobicContact SD-CG1 4.37Å; M318-V351 HydrophobicContact SD-CG2 3.39Å; M318-V351 WeakPolarHBondContact SD-CG2 3.5Å; I346-V351 HydrophobicContact CG2-CG2 4.47Å; K347-V351 PolarHBondContact O-N 3.31Å; K348-V351 PolarHBondContact O-N 3.02Å; K348-V351 VanDerWaalsContact O-N 3.1Å; V351-R353 PolarHBondContact O-N 2.61Å; V351-R354 PolarHBondContact O-N 2.64Å; V351-R354 VanDerWaalsContact O-N 3.13Å; V351-M355 HydrophobicContact CG1-CE 4.33Å; V351-M355 PolarHBondContact O-N 2.73Å; V351-V683 HydrophobicContact CG2-CG1 3.99Å; V351-V683 HydrophobicContact CG2-CG2 4Å
352	E	68.4	Low	63.2	Low	91 Å²	91	64.2 Å²	64.2	43%	0.425	31%	0.31	S	S	.	.	H	α-helix	trans	-54.2	-49.3	176.1	-179.8	-173.3	174.2	0	0	112.2	K348 R354 M355 S356	K348-E352 PolarHBondContact O-N 2.79Å; E352-R354 VanDerWaalsContact C-N 3.33Å; E352-R354 PolarHBondContact O-N 3.06Å; E352-M355 PolarHBondContact O-N 3.26Å; E352-S356 PolarHBondContact O-N 3.04Å; E352-S356 VanDerWaalsContact O-N 3.16Å
353	R	66.4	Low	61.5	Low	119 Å²	119	68.9 Å²	68.9	45%	0.449	34%	0.337	S	S	.	.	H	α-helix	trans	-58.8	-43.3	178.1	-93.5	-175.9	-76.5	170.6	-7.9	111.9	A349 V351 S356 F357	A349-R353 PolarHBondContact O-NE 2.82Å; V351-R353 PolarHBondContact O-N 2.61Å; R353-S356 PolarHBondContact O-N 2.95Å; R353-S356 PolarHBondContact O-OG 3.16Å; R353-F357 VanDerWaalsContact O-CD2 3.25Å; R353-F357 WeakPolarHBondContact O-CD2 3.32Å
354	R	65.9	Low	59.6	Low	43 Å²	43	74.1 Å²	74.1	16%	0.162	37%	0.369	C	S	.	.	H	α-helix	trans	-69.9	-39.7	-179.4	-76.5	-159.5	-176.9	-138.3	3.8	112.6	K350 V351 E352 S356 F357 L682 G685 D739	K350-R354 PolarHBondContact O-N 3.45Å; V351-R354 PolarHBondContact O-N 2.64Å; V351-R354 VanDerWaalsContact O-N 3.13Å; E352-R354 VanDerWaalsContact C-N 3.33Å; E352-R354 PolarHBondContact O-N 3.06Å; R354-S356 PolarHBondContact O-N 3.27Å; R354-F357 PolarHBondContact O-N 3.11Å; R354-L682 WeakPolarHBondContact CD-O 3.48Å; R354-L682 PolarHBondContact NE-O 3.02Å; R354-L682 PolarHBondContact NH1-O 3.47Å; R354-L682 PolarHBondContact NH2-O 2.99Å; R354-G685 PolarHBondContact NH2-O 2.77Å; R354-D739 IonicContact CZ-OD2 2.7Å; R354-D739 IonicContact NH1-OD2 2.92Å; R354-D739 IonicContact NH2-OD1 3.76Å; R354-D739 PolarHBondContact NH2-OD1 2.61Å; R354-D739 IonicContact NH2-OD2 3.73Å; R354-D739 PolarHBondContact NH2-OD2 2.88Å
355	M	62.3	Low	57.7	Low	21 Å²	21	83 Å²	83	10%	0.103	41%	0.41	C	S	.	.	H	α-helix	trans	-57.5	-37.8	174.2	-75.1	-166.9	170.8	0	0	112.4	E313 E314 Q317 V351 E352 F357 L674	E313-M355 WeakPolarHBondContact O-CE 3.46Å; E314-M355 HydrophobicContact CB-SD 4.11Å; E314-M355 HydrophobicContact CG-CE 4.28Å; E314-M355 HydrophobicContact CG-SD 3.27Å; E314-M355 WeakPolarHBondContact CG-SD 3.28Å; Q317-M355 HydrophobicContact CB-CE 3.51Å; Q317-M355 HydrophobicContact CG-CE 4.13Å; V351-M355 HydrophobicContact CG1-CE 4.33Å; V351-M355 PolarHBondContact O-N 2.73Å; E352-M355 PolarHBondContact O-N 3.26Å; M355-F357 VanDerWaalsContact C-N 3.28Å; M355-F357 PolarHBondContact O-N 3.05Å; M355-L674 HydrophobicContact CE-CD2 4.01Å
356	S	60	Low	56.8	Low	54 Å²	54	88.2 Å²	88.2	38%	0.378	44%	0.443	S	S	.	.	H	α-helix	trans	-66.9	-23.6	177.7	75.9	0	0	0	0	114.7	E352 R353 R354	E352-S356 PolarHBondContact O-N 3.04Å; E352-S356 VanDerWaalsContact O-N 3.16Å; R353-S356 PolarHBondContact O-N 2.95Å; R353-S356 PolarHBondContact O-OG 3.16Å; R354-S356 PolarHBondContact O-N 3.27Å
357	F	58.3	Low	56.4	Low	155 Å²	155	95.4 Å²	95.4	68%	0.68	47%	0.471	S	S	*	.	H	α-helix	trans	-80.5	-31.9	-179.2	-89.2	-79.6	0	0	0	113.3	R353 R354 M355	R353-F357 VanDerWaalsContact O-CD2 3.25Å; R353-F357 WeakPolarHBondContact O-CD2 3.32Å; R354-F357 PolarHBondContact O-N 3.11Å; M355-F357 VanDerWaalsContact C-N 3.28Å; M355-F357 PolarHBondContact O-N 3.05Å
358	D	51.8	Low	56.4	Low	55 Å²	55	96.6 Å²	96.6	29%	0.294	48%	0.482	S	S	.	.	H	α-helix	trans	-82.4	-25.7	-175.6	-84.9	-28.5	0	0	0	113.9	N360 R361	D358-N360 PolarHBondContact O-N 3.48Å; D358-R361 PolarHBondContact O-N 2.87Å; D358-R361 VanDerWaalsContact O-N 3.1Å
359	D	49.9	Very low	56.7	Low	98 Å²	98	98.2 Å²	98.2	52%	0.524	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-61	-28.5	177.9	-155	39.1	0	0	0	112.4	R361 R673	D359-R361 VanDerWaalsContact C-N 3.26Å; D359-R361 PolarHBondContact O-N 2.9Å; D359-R673 IonicContact OD1-NH1 3.4Å
360	N	44.9	Very low	57.4	Low	143 Å²	143	100.5 Å²	100.5	77%	0.765	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-72.5	-8.7	177.9	-90.3	4.6	0	0	0	114.9	D358	D358-N360 PolarHBondContact O-N 3.48Å
361	R	46.8	Very low	58.2	Low	205 Å²	205	101.2 Å²	101.2	77%	0.774	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-94.4	-17.5	-174.7	-87	179.6	160.5	155.2	-5.9	115.6	D358 D359	D358-R361 PolarHBondContact O-N 2.87Å; D358-R361 VanDerWaalsContact O-N 3.1Å; D359-R361 VanDerWaalsContact C-N 3.26Å; D359-R361 PolarHBondContact O-N 2.9Å
362	L	42	Very low	59.1	Low	147 Å²	147	101 Å²	101	77%	0.77	51%	0.509	S	S	*	.	S	Bend	trans	-106.1	-0.5	-165.8	-78.1	159.7	0	0	0	116.2
363	T	41.4	Very low	60	Low	114 Å²	114	100 Å²	100	70%	0.699	50%	0.501	S	S	*	.			trans	-97.6	26.5	-171.1	50.8	0	0	0	0	116.3
364	T	34.9	Very low	61.3	Low	111 Å²	111	94.3 Å²	94.3	68%	0.681	48%	0.48	S	S	*	.			trans	-131.8	81.3	-176.9	-47.7	0	0	0	0	113.8	T366	T364-T366 WeakPolarHBondContact CG2-OG1 3.46Å
365	E	39.9	Very low	62.3	Low	204 Å²	204	94 Å²	94	95%	0.953	48%	0.48	S	S	*	.			trans	-105.9	74.8	152.5	-75	-167.5	174	0	0	109
366	T	53.1	Low	63.5	Low	111 Å²	111	93.1 Å²	93.1	68%	0.681	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-97.3	119.6	179.5	-40.3	0	0	0	0	109	T364	T364-T366 WeakPolarHBondContact CG2-OG1 3.46Å
367	Y	63.3	Low	64.4	Low	154 Å²	154	94.8 Å²	94.8	60%	0.604	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-50	142.5	165.2	-76.1	-87.5	0	0	0	109.7
368	P	72.1	Confident	65	Low	63 Å²	63	90.6 Å²	90.6	41%	0.409	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-54.9	140.1	179.4	-24	32.7	0	0	0	111.4	H370 V371	P368-H370 WeakPolarHBondContact CB-CE1 3.44Å; P368-H370 WeakPolarHBondContact CB-ND1 3.38Å; P368-H370 PolarHBondContact O-N 3.12Å; P368-V371 HydrophobicContact CB-CG2 4.42Å; P368-V371 PolarHBondContact O-N 3.33Å
369	P	71.7	Confident	66	Low	123 Å²	123	89 Å²	89	80%	0.799	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-8.7	-169.7	23.2	-33.8	0	0	0	115.2
370	H	76.6	Confident	67.1	Low	88 Å²	88	89 Å²	89	41%	0.407	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-5.5	-177.7	59.7	-87.9	0	0	0	114.5	P368	P368-H370 WeakPolarHBondContact CB-CE1 3.44Å; P368-H370 WeakPolarHBondContact CB-ND1 3.38Å; P368-H370 PolarHBondContact O-N 3.12Å
371	V	84.4	Confident	68.7	Low	22 Å²	22	83.5 Å²	83.5	13%	0.133	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	128.8	-177.1	179.9	0	0	0	0	110.6	P368 R373 G398 G399 V475	P368-V371 HydrophobicContact CB-CG2 4.42Å; P368-V371 PolarHBondContact O-N 3.33Å; V371-R373 HydrophobicContact CG1-CG 4.28Å; V371-G398 CarbonylContact O-C 3.51Å; V371-G399 PolarHBondContact O-N 3.39Å; V371-G399 VanDerWaalsContact O-N 3.1Å; V371-V475 HydrophobicContact CG1-CB 4.37Å; V371-V475 HydrophobicContact CG1-CG2 4.01Å
372	Q	86.7	Confident	70.2	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.3	171.3	-78.1	-168.7	-13.5	0	0	110.8	F374 G398 D400 I472 E473 P474 V475	Q372-F374 HydrophobicContact CB-CE2 3.97Å; Q372-G398 WeakPolarHBondContact CG-O 3.34Å; Q372-D400 PolarHBondContact NE2-O 2.9Å; Q372-I472 HydrophobicContact CB-CG2 3.98Å; Q372-I472 HydrophobicContact CG-CG2 3.48Å; Q372-I472 VanDerWaalsContact CG-CG2 3.48Å; Q372-E473 PolarHBondContact N-O 3.46Å; Q372-P474 CarbonylContact O-C 3.52Å; Q372-P474 WeakPolarHBondContact O-CA 3.34Å; Q372-V475 PolarHBondContact O-N 2.96Å
373	R	88.6	Confident	72	Confident	70 Å²	70	70.9 Å²	70.9	26%	0.264	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.9	-175.4	-58.2	179.4	-67.5	147.6	-2.4	110.3	V371 R396 V397 V475 V477	V371-R373 HydrophobicContact CG1-CG 4.28Å; R373-R396 CarbonylContact O-C 3.55Å; R373-R396 VanDerWaalsContact O-CA 3.3Å; R373-R396 WeakPolarHBondContact O-CA 3.08Å; R373-V397 WeakPolarHBondContact CB-O 3.42Å; R373-V397 PolarHBondContact N-O 2.76Å; R373-V397 PolarHBondContact O-N 2.95Å; R373-V475 WeakPolarHBondContact CA-O 3.48Å; R373-V477 HydrophobicContact CB-CB 4.47Å; R373-V477 HydrophobicContact CB-CG2 3.68Å; R373-V477 HydrophobicContact CG-CG2 3.69Å
374	F	91.9	Very high	73.7	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129.6	176.1	-66.3	-99	0	0	0	109.9	Q372 T395 R396 V405 F431 L463 P474 V475 L476 V477	Q372-F374 HydrophobicContact CB-CE2 3.97Å; F374-T395 WeakPolarHBondContact CA-O 3.49Å; F374-R396 HydrophobicContact CD1-CB 4.04Å; F374-R396 HydrophobicContact CD1-CG 4.26Å; F374-R396 HydrophobicContact CE1-CB 3.79Å; F374-R396 VanDerWaalsContact CE1-CD 3.48Å; F374-R396 HydrophobicContact CE1-CG 3.68Å; F374-R396 HydrophobicContact CE2-CG 4.27Å; F374-R396 HydrophobicContact CZ-CB 4.31Å; F374-R396 HydrophobicContact CZ-CG 3.67Å; F374-V405 HydrophobicContact CE1-CB 4.25Å; F374-V405 HydrophobicContact CE1-CG1 4.2Å; F374-V405 HydrophobicContact CE2-CB 4.35Å; F374-V405 HydrophobicContact CE2-CG1 3.93Å; F374-V405 HydrophobicContact CE2-CG2 4.44Å; F374-V405 HydrophobicContact CZ-CB 3.6Å; F374-V405 HydrophobicContact CZ-CG1 3.56Å; F374-V405 HydrophobicContact CZ-CG2 3.93Å; F374-F431 HydrophobicContact CD1-CD2 4.39Å; F374-F431 HydrophobicContact CD1-CE2 4.22Å; F374-F431 AromaticContact CE1-CD2 3.9Å; F374-F431 HydrophobicContact CE1-CD2 3.9Å; F374-F431 HydrophobicContact CE1-CE2 4.19Å; F374-F431 HydrophobicContact CE1-CG 4.09Å; F374-L463 HydrophobicContact CB-CD1 4.44Å; F374-L463 HydrophobicContact CB-CD2 4.09Å; F374-L463 HydrophobicContact CD1-CD2 4.09Å; F374-L463 HydrophobicContact CD2-CD1 4.15Å; F374-L463 HydrophobicContact CD2-CD2 3.51Å; F374-L463 HydrophobicContact CE1-CD2 4.39Å; F374-L463 HydrophobicContact CE2-CD2 3.87Å; F374-L463 HydrophobicContact CG-CD2 3.64Å; F374-L463 HydrophobicContact CZ-CD2 4.3Å; F374-P474 HydrophobicContact CD2-CB 4.35Å; F374-P474 HydrophobicContact CE2-CB 3.9Å; F374-V475 PolarHBondContact N-O 3.37Å; F374-L476 HydrophobicContact CB-CD2 4.22Å; F374-L476 WeakPolarHBondContact O-CA 3.33Å; F374-V477 PolarHBondContact O-N 3.48Å
375	F	88.1	Confident	75.7	Confident	37 Å²	37	63 Å²	63	16%	0.162	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	159.5	-175.7	58.9	-83.5	0	0	0	110.9	N377 T395 V397 V477	F375-N377 HydrophobicContact CD2-CB 4.45Å; F375-N377 HydrophobicContact CE2-CB 4.13Å; F375-T395 HydrophobicContact CE1-CG2 4.5Å; F375-T395 HydrophobicContact CZ-CG2 4.07Å; F375-T395 PolarHBondContact N-O 2.81Å; F375-T395 VanDerWaalsContact N-O 3.14Å; F375-T395 PolarHBondContact O-N 3.26Å; F375-V397 HydrophobicContact CE1-CB 4.32Å; F375-V397 HydrophobicContact CE1-CG2 3.84Å; F375-V397 HydrophobicContact CZ-CG2 3.96Å; F375-V477 VanDerWaalsContact CB-O 3.24Å; F375-V477 WeakPolarHBondContact CB-O 3.3Å
376	F	87.2	Confident	77.5	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.009	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	141.9	171.5	-73.5	-72.8	0	0	0	111.7	P378 V392 T393 V394 I440 V458 L460 P479 M480 V481 A482	F376-P378 CarbonylContact C-O 3.59Å; F376-P378 WeakPolarHBondContact CB-O 3.44Å; F376-V392 HydrophobicContact CD1-CG1 3.71Å; F376-V392 HydrophobicContact CE1-CG1 3.58Å; F376-T393 WeakPolarHBondContact CA-O 3.43Å; F376-V394 HydrophobicContact CD1-CG2 3.76Å; F376-V394 HydrophobicContact CE1-CG2 3.56Å; F376-V394 HydrophobicContact CZ-CG2 4.4Å; F376-I440 HydrophobicContact CE1-CD1 4.24Å; F376-V458 HydrophobicContact CE1-CG1 4.21Å; F376-V458 WeakPolarHBondContact CE2-O 3.49Å; F376-V458 HydrophobicContact CZ-CB 4.06Å; F376-V458 HydrophobicContact CZ-CG1 3.76Å; F376-V458 WeakPolarHBondContact CZ-O 3.22Å; F376-L460 HydrophobicContact CD2-CD1 4.05Å; F376-L460 HydrophobicContact CD2-CG 4.2Å; F376-L460 HydrophobicContact CE1-CD1 4.42Å; F376-L460 HydrophobicContact CE1-CD2 4.21Å; F376-L460 HydrophobicContact CE1-CG 4.23Å; F376-L460 HydrophobicContact CE2-CB 4.47Å; F376-L460 HydrophobicContact CE2-CD1 3.87Å; F376-L460 HydrophobicContact CE2-CD2 4.27Å; F376-L460 HydrophobicContact CE2-CG 3.51Å; F376-L460 HydrophobicContact CG-CD1 4.43Å; F376-L460 HydrophobicContact CZ-CD1 4.05Å; F376-L460 HydrophobicContact CZ-CD2 3.74Å; F376-L460 HydrophobicContact CZ-CG 3.51Å; F376-P479 HydrophobicContact CB-CG 4.19Å; F376-P479 PolarHBondContact N-O 2.89Å; F376-P479 WeakPolarHBondContact O-CG 3.29Å; F376-M480 VanDerWaalsContact CE2-O 3.29Å; F376-M480 WeakPolarHBondContact CE2-O 3.44Å; F376-V481 VanDerWaalsContact CD2-C 3.44Å; F376-A482 HydrophobicContact CB-CB 4.13Å; F376-A482 HydrophobicContact CD1-CB 3.75Å; F376-A482 HydrophobicContact CD2-CB 3.71Å; F376-A482 VanDerWaalsContact CD2-N 3.27Å; F376-A482 HydrophobicContact CE1-CB 3.98Å; F376-A482 HydrophobicContact CE2-CB 3.9Å; F376-A482 VanDerWaalsContact CE2-N 3.3Å; F376-A482 HydrophobicContact CG-CB 3.61Å; F376-A482 HydrophobicContact CZ-CB 4.05Å
377	N	79.7	Confident	79	Confident	89 Å²	89	54.7 Å²	54.7	48%	0.476	29%	0.29	S	S	.	.	S	Bend	trans	-141	103.5	176.5	-171.7	9.9	0	0	0	110.9	F375 Y381 T393 T395	F375-N377 HydrophobicContact CD2-CB 4.45Å; F375-N377 HydrophobicContact CE2-CB 4.13Å; N377-Y381 PolarHBondContact O-OH 2.84Å; N377-T393 PolarHBondContact N-O 3.49Å; N377-T393 WeakPolarHBondContact O-CB 3.43Å; N377-T395 VanDerWaalsContact CB-OG1 3.27Å; N377-T395 WeakPolarHBondContact CB-OG1 3.35Å
378	P	69.2	Low	80.1	Confident	67 Å²	67	48.9 Å²	48.9	44%	0.435	28%	0.277	S	S	.	.	S	Bend	cis	-72.1	169.7	-5.1	31.1	-37.8	0	0	0	113.6	F376 H380 Y381	F376-P378 CarbonylContact C-O 3.59Å; F376-P378 WeakPolarHBondContact CB-O 3.44Å; P378-H380 WeakPolarHBondContact CG-O 3.17Å; P378-Y381 WeakPolarHBondContact CD-OH 3.42Å; P378-Y381 HydrophobicContact CG-CD1 4.42Å; P378-Y381 HydrophobicContact CG-CE1 3.93Å; P378-Y381 HydrophobicContact CG-CE2 4.24Å; P378-Y381 WeakPolarHBondContact O-CE2 3.44Å; P378-Y381 PolarHBondContact O-OH 2.93Å
379	G	73.6	Confident	80.9	Confident	22 Å²	22	49.2 Å²	49.2	23%	0.227	28%	0.278	C	S	.	.	S	Bend	trans	-87.5	-1.5	172	0	0	0	0	0	114.7	A482 T483	G379-A482 VanDerWaalsContact O-CA 3.3Å; G379-A482 WeakPolarHBondContact O-CA 3.2Å; G379-T483 PolarHBondContact O-N 3.48Å
380	H	72.7	Confident	81.7	Confident	96 Å²	96	44 Å²	44	44%	0.444	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	132.5	178.3	-169.9	-79	0	0	0	108.9	P378 T382 T483	P378-H380 WeakPolarHBondContact CG-O 3.17Å; H380-T382 PolarHBondContact CE1-OG1 2.89Å; H380-T483 CarbonylContact C-O 3.54Å; H380-T483 WeakPolarHBondContact CA-O 3.34Å
381	Y	79.1	Confident	82.4	Confident	28 Å²	28	42.3 Å²	42.3	11%	0.11	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.9	176.5	-66.9	-93.9	0	0	0	108.3	N377 P378 F390 V392 T393 A482 T483 I484 M485	N377-Y381 PolarHBondContact O-OH 2.84Å; P378-Y381 WeakPolarHBondContact CD-OH 3.42Å; P378-Y381 HydrophobicContact CG-CD1 4.42Å; P378-Y381 HydrophobicContact CG-CE1 3.93Å; P378-Y381 HydrophobicContact CG-CE2 4.24Å; P378-Y381 WeakPolarHBondContact O-CE2 3.44Å; P378-Y381 PolarHBondContact O-OH 2.93Å; Y381-F390 HydrophobicContact CD1-CE2 4.43Å; Y381-F390 HydrophobicContact CG-CE2 4.45Å; Y381-V392 HydrophobicContact CD2-CG1 4.41Å; Y381-V392 HydrophobicContact CD2-CG2 4.26Å; Y381-V392 HydrophobicContact CE2-CB 4.31Å; Y381-V392 HydrophobicContact CE2-CG1 3.71Å; Y381-V392 HydrophobicContact CE2-CG2 4.2Å; Y381-V392 HydrophobicContact CG-CG2 4.5Å; Y381-T393 PolarHBondContact OH-N 3.08Å; Y381-A482 HydrophobicContact CD2-CB 4.2Å; Y381-A482 HydrophobicContact CE2-CB 4.07Å; Y381-T483 PolarHBondContact N-O 3.08Å; Y381-I484 CarbonylContact O-C 3.55Å; Y381-I484 WeakPolarHBondContact O-CA 3.41Å; Y381-M485 PolarHBondContact O-N 3.3Å
382	T	77.7	Confident	82.8	Confident	72 Å²	72	41.2 Å²	41.2	44%	0.442	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.2	172.3	-52.8	0	0	0	0	106.7	H380 M485 L487	H380-T382 PolarHBondContact CE1-OG1 2.89Å; T382-M485 CarbonylContact C-O 3.52Å; T382-M485 WeakPolarHBondContact CA-O 3.01Å; T382-M485 HydrophobicContact CG2-CB 4.48Å; T382-M485 HydrophobicContact CG2-CE 3.6Å; T382-L487 HydrophobicContact CG2-CD1 3.37Å; T382-L487 HydrophobicContact CG2-CD2 4.2Å; T382-L487 HydrophobicContact CG2-CG 3.6Å
383	V	79.6	Confident	83	Confident	15 Å²	15	42.4 Å²	42.4	9%	0.091	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	147.1	-177.2	-62.9	0	0	0	0	109.8	V387 F390 I444 I484 M485 V486 L487	V383-V387 HydrophobicContact CB-CB 4.34Å; V383-V387 HydrophobicContact CB-CG1 3.97Å; V383-V387 HydrophobicContact CG2-CG1 4.28Å; V383-F390 HydrophobicContact CG1-CD1 3.95Å; V383-F390 HydrophobicContact CG1-CD2 3.86Å; V383-F390 HydrophobicContact CG1-CE1 4.06Å; V383-F390 HydrophobicContact CG1-CE2 3.94Å; V383-F390 HydrophobicContact CG1-CG 3.87Å; V383-F390 HydrophobicContact CG1-CZ 4.06Å; V383-F390 HydrophobicContact CG2-CD1 4.49Å; V383-F390 HydrophobicContact CG2-CE1 4.08Å; V383-F390 HydrophobicContact CG2-CZ 4.38Å; V383-I444 HydrophobicContact CG2-CD1 4.38Å; V383-I444 HydrophobicContact CG2-CG1 4.09Å; V383-I484 HydrophobicContact CG2-CG2 3.88Å; V383-M485 PolarHBondContact N-O 3.18Å; V383-V486 HydrophobicContact CG2-CG2 4.29Å; V383-V486 CarbonylContact O-C 3.5Å; V383-V486 WeakPolarHBondContact O-CA 3.46Å; V383-L487 PolarHBondContact O-N 3.27Å
384	M	76.9	Confident	83.2	Confident	45 Å²	45	39.1 Å²	39.1	22%	0.222	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	150.4	169.7	-59.9	-63.6	-73.1	0	0	108.9	N386 V387 L487 D489 C521	M384-N386 VanDerWaalsContact C-N 3.25Å; M384-N386 VanDerWaalsContact CB-OD1 3.3Å; M384-N386 WeakPolarHBondContact CB-OD1 3.4Å; M384-N386 PolarHBondContact O-N 3.21Å; M384-V387 WeakPolarHBondContact O-CB 3.47Å; M384-V387 VanDerWaalsContact O-CG1 3.25Å; M384-V387 WeakPolarHBondContact O-CG1 3.41Å; M384-V387 PolarHBondContact O-N 3.45Å; M384-L487 HydrophobicContact SD-CB 4.12Å; M384-L487 HydrophobicContact SD-CD1 4.39Å; M384-D489 HydrophobicContact CE-CB 3.32Å; M384-C521 WeakPolarHBondContact CE-SG 3.26Å
385	E	77.8	Confident	83.1	Confident	15 Å²	15	40 Å²	40	7%	0.07	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-52	-46	174	-157.8	-171.9	156	0	0	111.9	V387 I444 I445 D446 D447 V486 L487	E385-V387 PolarHBondContact O-N 3.46Å; E385-I444 HydrophobicContact CG-CG2 4.44Å; E385-I444 VanDerWaalsContact O-CG2 3.3Å; E385-I444 WeakPolarHBondContact O-CG2 3.23Å; E385-I445 WeakPolarHBondContact CG-O 3.27Å; E385-D446 WeakPolarHBondContact OE1-CA 3.4Å; E385-D447 PolarHBondContact OE1-N 3.13Å; E385-V486 HydrophobicContact CB-CG1 4.31Å; E385-V486 HydrophobicContact CG-CG1 4.37Å; E385-L487 PolarHBondContact N-O 3.02Å
386	N	78.7	Confident	83.2	Confident	83 Å²	83	38.3 Å²	38.3	44%	0.444	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-69.2	4.6	177.7	72.2	18.4	0	0	0	116.7	M384 G388 D446 D489	M384-N386 VanDerWaalsContact C-N 3.25Å; M384-N386 VanDerWaalsContact CB-OD1 3.3Å; M384-N386 WeakPolarHBondContact CB-OD1 3.4Å; M384-N386 PolarHBondContact O-N 3.21Å; N386-G388 PolarHBondContact O-N 2.85Å; N386-D446 WeakPolarHBondContact CA-OD1 3.48Å; N386-D446 WeakPolarHBondContact CB-OD1 3.34Å; N386-D446 PolarHBondContact N-OD1 3.4Å; N386-D489 PolarHBondContact ND2-OD2 2.87Å
387	V	84.1	Confident	83.2	Confident	57 Å²	57	40.7 Å²	40.7	35%	0.345	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-64	-24.1	-176.8	75.9	0	0	0	0	112.7	V383 M384 E385 T389 F390 I444	V383-V387 HydrophobicContact CB-CB 4.34Å; V383-V387 HydrophobicContact CB-CG1 3.97Å; V383-V387 HydrophobicContact CG2-CG1 4.28Å; M384-V387 WeakPolarHBondContact O-CB 3.47Å; M384-V387 VanDerWaalsContact O-CG1 3.25Å; M384-V387 WeakPolarHBondContact O-CG1 3.41Å; M384-V387 PolarHBondContact O-N 3.45Å; E385-V387 PolarHBondContact O-N 3.46Å; V387-T389 PolarHBondContact O-N 3.28Å; V387-F390 HydrophobicContact CG1-CD1 4.02Å; V387-F390 HydrophobicContact CG2-CB 4.24Å; V387-I444 HydrophobicContact CG1-CB 3.98Å; V387-I444 HydrophobicContact CG1-CG1 3.69Å
388	G	85.5	Confident	83.3	Confident	32 Å²	32	37.9 Å²	37.9	33%	0.33	23%	0.233	S	C	.	.			trans	70.6	-77.5	-177.3	0	0	0	0	0	113.2	N386 S443 I444	N386-G388 PolarHBondContact O-N 2.85Å; G388-S443 CarbonylContact O-C 3.02Å; G388-S443 WeakPolarHBondContact O-CA 3.27Å; G388-I444 PolarHBondContact O-N 3.22Å
389	T	89.4	Confident	83.7	Confident	71 Å²	71	36.1 Å²	36.1	44%	0.436	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	130.5	-180	-55.9	0	0	0	0	111.7	V387 M441 I442 S443	V387-T389 PolarHBondContact O-N 3.28Å; T389-M441 HydrophobicContact CG2-CB 4.28Å; T389-M441 HydrophobicContact CG2-CE 3.94Å; T389-I442 CarbonylContact C-O 3.51Å; T389-I442 VanDerWaalsContact CA-O 3.32Å; T389-I442 WeakPolarHBondContact CA-O 3.36Å; T389-I442 WeakPolarHBondContact CG2-O 3.37Å; T389-S443 WeakPolarHBondContact CG2-OG 3.47Å; T389-S443 PolarHBondContact OG1-OG 2.86Å
390	F	89.1	Confident	84.1	Confident	14 Å²	14	36.6 Å²	36.6	6%	0.061	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	156.8	-175.5	74.3	-80.5	0	0	0	113.4	Y381 V383 V387 V392 I442 I444 F456 I484	Y381-F390 HydrophobicContact CD1-CE2 4.43Å; Y381-F390 HydrophobicContact CG-CE2 4.45Å; V383-F390 HydrophobicContact CG1-CD1 3.95Å; V383-F390 HydrophobicContact CG1-CD2 3.86Å; V383-F390 HydrophobicContact CG1-CE1 4.06Å; V383-F390 HydrophobicContact CG1-CE2 3.94Å; V383-F390 HydrophobicContact CG1-CG 3.87Å; V383-F390 HydrophobicContact CG1-CZ 4.06Å; V383-F390 HydrophobicContact CG2-CD1 4.49Å; V383-F390 HydrophobicContact CG2-CE1 4.08Å; V383-F390 HydrophobicContact CG2-CZ 4.38Å; V387-F390 HydrophobicContact CG1-CD1 4.02Å; V387-F390 HydrophobicContact CG2-CB 4.24Å; F390-V392 HydrophobicContact CD2-CG2 4.3Å; F390-V392 HydrophobicContact CE2-CG2 3.57Å; F390-V392 HydrophobicContact CZ-CG2 4.25Å; F390-I442 WeakPolarHBondContact CD1-O 3.13Å; F390-I442 HydrophobicContact CE1-CB 4.04Å; F390-I442 HydrophobicContact CE1-CG2 4.27Å; F390-I442 HydrophobicContact CZ-CB 4.18Å; F390-I442 PolarHBondContact N-O 3.39Å; F390-I442 PolarHBondContact O-N 3.07Å; F390-I444 HydrophobicContact CD1-CG1 4.15Å; F390-I444 HydrophobicContact CE1-CD1 3.87Å; F390-I444 HydrophobicContact CE1-CG1 3.79Å; F390-F456 HydrophobicContact CZ-CZ 4.45Å; F390-I484 HydrophobicContact CE1-CG2 4.34Å; F390-I484 HydrophobicContact CE2-CG1 4.25Å; F390-I484 HydrophobicContact CE2-CG2 4.37Å; F390-I484 HydrophobicContact CZ-CB 4.43Å; F390-I484 HydrophobicContact CZ-CG1 3.87Å; F390-I484 HydrophobicContact CZ-CG2 3.62Å
391	P	90.9	Very high	84.5	Confident	51 Å²	51	34.6 Å²	34.6	33%	0.331	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	128.9	-179.1	33.4	-32.1	0	0	0	114.3	Q439 I440 M441	P391-Q439 HydrophobicContact CB-CB 4.13Å; P391-Q439 HydrophobicContact CB-CG 4.18Å; P391-I440 CarbonylContact C-O 3.42Å; P391-I440 WeakPolarHBondContact CA-O 3.24Å; P391-M441 HydrophobicContact CB-SD 3.82Å
392	V	91.9	Very high	84.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	128.2	168.3	173.7	0	0	0	0	110.2	F376 Y381 F390 Q439 I440 I442 A482 I484	F376-V392 HydrophobicContact CD1-CG1 3.71Å; F376-V392 HydrophobicContact CE1-CG1 3.58Å; Y381-V392 HydrophobicContact CD2-CG1 4.41Å; Y381-V392 HydrophobicContact CD2-CG2 4.26Å; Y381-V392 HydrophobicContact CE2-CB 4.31Å; Y381-V392 HydrophobicContact CE2-CG1 3.71Å; Y381-V392 HydrophobicContact CE2-CG2 4.2Å; Y381-V392 HydrophobicContact CG-CG2 4.5Å; F390-V392 HydrophobicContact CD2-CG2 4.3Å; F390-V392 HydrophobicContact CE2-CG2 3.57Å; F390-V392 HydrophobicContact CZ-CG2 4.25Å; V392-Q439 CarbonylContact O-C 3.47Å; V392-Q439 VanDerWaalsContact O-CA 3.26Å; V392-Q439 WeakPolarHBondContact O-CA 3.41Å; V392-I440 HydrophobicContact CB-CB 4.35Å; V392-I440 PolarHBondContact N-O 3.44Å; V392-I440 PolarHBondContact O-N 2.86Å; V392-I442 HydrophobicContact CB-CD1 4.44Å; V392-I442 HydrophobicContact CG2-CD1 3.71Å; V392-I442 HydrophobicContact CG2-CG1 4.43Å; V392-A482 HydrophobicContact CG1-CB 4.15Å; V392-I484 HydrophobicContact CG2-CG1 4.45Å
393	T	90.5	Very high	85	Confident	25 Å²	25	36.5 Å²	36.5	15%	0.153	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.7	-168.7	-58	0	0	0	0	113.1	F376 N377 Y381 H437 K438	F376-T393 WeakPolarHBondContact CA-O 3.43Å; N377-T393 PolarHBondContact N-O 3.49Å; N377-T393 WeakPolarHBondContact O-CB 3.43Å; Y381-T393 PolarHBondContact OH-N 3.08Å; T393-H437 HydrophobicContact CG2-CB 3.94Å; T393-K438 CarbonylContact C-O 3.55Å; T393-K438 WeakPolarHBondContact CA-O 3.21Å
394	V	93.3	Very high	85.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.5	173.8	-177.8	0	0	0	0	109.1	F376 L429 F431 H437 K438 I440 L460	F376-V394 HydrophobicContact CD1-CG2 3.76Å; F376-V394 HydrophobicContact CE1-CG2 3.56Å; F376-V394 HydrophobicContact CZ-CG2 4.4Å; V394-L429 HydrophobicContact CB-CD1 4.04Å; V394-L429 HydrophobicContact CG2-CD1 3.68Å; V394-F431 HydrophobicContact CB-CZ 4.1Å; V394-F431 HydrophobicContact CG1-CE2 4.21Å; V394-F431 HydrophobicContact CG1-CZ 3.87Å; V394-H437 CarbonylContact O-C 3.6Å; V394-H437 WeakPolarHBondContact O-CA 3.37Å; V394-K438 PolarHBondContact N-O 2.83Å; V394-K438 PolarHBondContact O-N 3.11Å; V394-I440 HydrophobicContact CG2-CD1 4.11Å; V394-L460 HydrophobicContact CG1-CD1 3.65Å; V394-L460 HydrophobicContact CG1-CD2 4.34Å; V394-L460 HydrophobicContact CG2-CD1 4.08Å; V394-L460 HydrophobicContact CG2-CD2 3.79Å; V394-L460 HydrophobicContact CG2-CG 4.48Å
395	T	90.6	Very high	86.2	Confident	19 Å²	19	35.2 Å²	35.2	12%	0.117	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	145.1	-175.8	-56.3	0	0	0	0	112.1	F374 F375 N377 V397 T436	F374-T395 WeakPolarHBondContact CA-O 3.49Å; F375-T395 HydrophobicContact CE1-CG2 4.5Å; F375-T395 HydrophobicContact CZ-CG2 4.07Å; F375-T395 PolarHBondContact N-O 2.81Å; F375-T395 VanDerWaalsContact N-O 3.14Å; F375-T395 PolarHBondContact O-N 3.26Å; N377-T395 VanDerWaalsContact CB-OG1 3.27Å; N377-T395 WeakPolarHBondContact CB-OG1 3.35Å; T395-V397 HydrophobicContact CG2-CG2 3.87Å; T395-T436 CarbonylContact C-O 3.54Å; T395-T436 WeakPolarHBondContact CA-O 2.76Å
396	R	90	Very high	86.8	Confident	1 Å²	1	34.6 Å²	34.6	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124	175.5	178.1	175.2	66	170.3	0.2	110.9	R373 F374 M401 A403 F431 S432 E435 T436	R373-R396 CarbonylContact O-C 3.55Å; R373-R396 VanDerWaalsContact O-CA 3.3Å; R373-R396 WeakPolarHBondContact O-CA 3.08Å; F374-R396 HydrophobicContact CD1-CB 4.04Å; F374-R396 HydrophobicContact CD1-CG 4.26Å; F374-R396 HydrophobicContact CE1-CB 3.79Å; F374-R396 VanDerWaalsContact CE1-CD 3.48Å; F374-R396 HydrophobicContact CE1-CG 3.68Å; F374-R396 HydrophobicContact CE2-CG 4.27Å; F374-R396 HydrophobicContact CZ-CB 4.31Å; F374-R396 HydrophobicContact CZ-CG 3.67Å; R396-M401 HydrophobicContact CG-SD 3.94Å; R396-M401 PolarHBondContact NE-SD 2.76Å; R396-M401 PolarHBondContact NH2-O 3.21Å; R396-M401 WeakPolarHBondContact O-CE 3.46Å; R396-A403 PolarHBondContact NH1-O 3.32Å; R396-F431 HydrophobicContact CB-CD1 4.24Å; R396-F431 HydrophobicContact CB-CE1 4.21Å; R396-S432 PolarHBondContact NH2-O 2.91Å; R396-E435 PolarHBondContact NE-O 3.47Å; R396-E435 VanDerWaalsContact NH2-N 3.17Å; R396-E435 PolarHBondContact NH2-O 3.29Å; R396-T436 PolarHBondContact N-O 3.43Å
397	V	85.9	Confident	87.6	Confident	52 Å²	52	30.6 Å²	30.6	32%	0.315	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	140.5	-179.9	-171.8	0	0	0	0	112.6	R373 F375 T395	R373-V397 WeakPolarHBondContact CB-O 3.42Å; R373-V397 PolarHBondContact N-O 2.76Å; R373-V397 PolarHBondContact O-N 2.95Å; F375-V397 HydrophobicContact CE1-CB 4.32Å; F375-V397 HydrophobicContact CE1-CG2 3.84Å; F375-V397 HydrophobicContact CZ-CG2 3.96Å; T395-V397 HydrophobicContact CG2-CG2 3.87Å
398	G	82.7	Confident	88.1	Confident	30 Å²	30	30 Å²	30	31%	0.309	19%	0.185	S	C	.	.	S	Bend	trans	87.1	174.9	177.8	0	0	0	0	0	112.9	V371 Q372	V371-G398 CarbonylContact O-C 3.51Å; Q372-G398 WeakPolarHBondContact CG-O 3.34Å
399	G	78.6	Confident	88.6	Confident	30 Å²	30	30.3 Å²	30.3	31%	0.309	18%	0.176	S	C	.	.	S	Bend	trans	58.3	-157.3	-178.8	0	0	0	0	0	114.8	V371 M401	V371-G399 PolarHBondContact O-N 3.39Å; V371-G399 VanDerWaalsContact O-N 3.1Å; G399-M401 PolarHBondContact O-N 3.37Å
400	D	80.5	Confident	88.8	Confident	33 Å²	33	29.1 Å²	29.1	18%	0.176	17%	0.165	C	C	.	.			trans	-87.5	94.9	-175.2	176	12.9	0	0	0	113.2	Q372 H402 A403 S469 T470 I472	Q372-D400 PolarHBondContact NE2-O 2.9Å; D400-H402 PolarHBondContact O-N 3.43Å; D400-H402 WeakPolarHBondContact OD1-CB 3.42Å; D400-H402 IonicContact OD1-CD2 3.53Å; D400-H402 PolarHBondContact OD1-CD2 2.74Å; D400-H402 IonicContact OD1-CG 2.87Å; D400-H402 PolarHBondContact OD1-N 2.96Å; D400-H402 VanDerWaalsContact OD1-N 3.08Å; D400-A403 PolarHBondContact O-N 3.29Å; D400-S469 PolarHBondContact OD2-OG 3.23Å; D400-T470 WeakPolarHBondContact CB-OG1 3.26Å; D400-T470 PolarHBondContact OD2-OG1 2.96Å; D400-I472 HydrophobicContact CB-CD1 3.8Å; D400-I472 HydrophobicContact CB-CG1 4.26Å
401	M	82.7	Confident	89	Confident	54 Å²	54	29.3 Å²	29.3	27%	0.266	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-6.1	-176.4	-150	66.6	96.7	0	0	114.5	R396 G399 G434 T436	R396-M401 HydrophobicContact CG-SD 3.94Å; R396-M401 PolarHBondContact NE-SD 2.76Å; R396-M401 PolarHBondContact NH2-O 3.21Å; R396-M401 WeakPolarHBondContact O-CE 3.46Å; G399-M401 PolarHBondContact O-N 3.37Å; M401-G434 PolarHBondContact O-N 3.18Å; M401-T436 HydrophobicContact CE-CG2 3.95Å
402	H	82.4	Confident	89	Confident	139 Å²	139	30.6 Å²	30.6	64%	0.644	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-13.2	173.3	-63.2	-68.9	0	0	0	114.2	D400 A433	D400-H402 PolarHBondContact O-N 3.43Å; D400-H402 WeakPolarHBondContact OD1-CB 3.42Å; D400-H402 IonicContact OD1-CD2 3.53Å; D400-H402 PolarHBondContact OD1-CD2 2.74Å; D400-H402 IonicContact OD1-CG 2.87Å; D400-H402 PolarHBondContact OD1-N 2.96Å; D400-H402 VanDerWaalsContact OD1-N 3.08Å; H402-A433 WeakPolarHBondContact O-CB 3.33Å
403	A	84.4	Confident	88.7	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.008	19%	0.193	C	C	.	.	S	Bend	trans	-71.8	148	178	0	0	0	0	0	113	R396 D400 V405 H467 I472	R396-A403 PolarHBondContact NH1-O 3.32Å; D400-A403 PolarHBondContact O-N 3.29Å; A403-V405 HydrophobicContact CB-CG2 4.49Å; A403-H467 CarbonylContact C-O 3.34Å; A403-H467 WeakPolarHBondContact CA-O 3.34Å; A403-I472 HydrophobicContact CB-CD1 3.16Å
404	V	89.3	Confident	88.2	Confident	33 Å²	33	35.6 Å²	35.6	20%	0.2	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	116.3	174.2	-175.6	0	0	0	0	108.4	L430 F431 K466 H467	V404-L430 HydrophobicContact CG1-CD1 3.58Å; V404-L430 HydrophobicContact CG1-CG 4.13Å; V404-F431 VanDerWaalsContact CA-O 3.29Å; V404-F431 WeakPolarHBondContact CA-O 3.42Å; V404-F431 WeakPolarHBondContact CG1-O 3.4Å; V404-K466 HydrophobicContact CB-CB 4.39Å; V404-K466 HydrophobicContact CG1-CB 4.07Å; V404-K466 PolarHBondContact O-N 2.71Å; V404-H467 HydrophobicContact CB-CB 4.04Å; V404-H467 HydrophobicContact CG2-CB 4.15Å; V404-H467 PolarHBondContact N-O 2.93Å; V404-H467 PolarHBondContact O-N 2.96Å
405	V	91.6	Very high	87.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	135.9	-177.5	-176.5	0	0	0	0	108.6	F374 A403 F431 L463 E464 V465 P474	F374-V405 HydrophobicContact CE1-CB 4.25Å; F374-V405 HydrophobicContact CE1-CG1 4.2Å; F374-V405 HydrophobicContact CE2-CB 4.35Å; F374-V405 HydrophobicContact CE2-CG1 3.93Å; F374-V405 HydrophobicContact CE2-CG2 4.44Å; F374-V405 HydrophobicContact CZ-CB 3.6Å; F374-V405 HydrophobicContact CZ-CG1 3.56Å; F374-V405 HydrophobicContact CZ-CG2 3.93Å; A403-V405 HydrophobicContact CB-CG2 4.49Å; V405-F431 PolarHBondContact N-O 3.09Å; V405-F431 WeakPolarHBondContact O-CB 3.34Å; V405-F431 PolarHBondContact O-N 2.68Å; V405-L463 HydrophobicContact CG1-CD2 3.76Å; V405-E464 WeakPolarHBondContact CA-O 3.23Å; V405-V465 HydrophobicContact CG2-CG2 4.4Å; V405-P474 HydrophobicContact CG1-CB 4.37Å
406	S	91.6	Very high	87.2	Confident	1 Å²	1	38 Å²	38	1%	0.007	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	142.7	172.8	63.6	0	0	0	0	111.4	L429 L463 E464 K466	S406-L429 CarbonylContact C-O 3.59Å; S406-L429 WeakPolarHBondContact CA-O 3.31Å; S406-L463 WeakPolarHBondContact O-CA 3.26Å; S406-E464 PolarHBondContact N-O 2.99Å; S406-E464 PolarHBondContact O-N 2.93Å; S406-E464 PolarHBondContact OG-O 3.17Å; S406-K466 WeakPolarHBondContact OG-CE 3.09Å
407	V	94.5	Very high	87	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	132.7	174.3	62.2	0	0	0	0	109.3	L429 F431 L460 L463 L476	V407-L429 HydrophobicContact CG1-CB 3.8Å; V407-L429 HydrophobicContact CG1-CD1 4.27Å; V407-L429 PolarHBondContact N-O 3.29Å; V407-L429 PolarHBondContact O-N 3.08Å; V407-F431 HydrophobicContact CG1-CD2 4.42Å; V407-F431 HydrophobicContact CG1-CE2 3.9Å; V407-L460 HydrophobicContact CG1-CD2 4.34Å; V407-L460 HydrophobicContact CG2-CB 3.87Å; V407-L460 HydrophobicContact CG2-CD2 3.97Å; V407-L460 HydrophobicContact CG2-CG 4.35Å; V407-L463 HydrophobicContact CB-CD2 4.01Å; V407-L463 HydrophobicContact CG2-CD2 4.23Å; V407-L463 HydrophobicContact CG2-CG 4.39Å; V407-L476 HydrophobicContact CG2-CD2 4.46Å
408	E	94.2	Very high	87.2	Confident	45 Å²	45	39.9 Å²	39.9	21%	0.21	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	142.6	174.9	-68.9	176.5	-146.4	0	0	110	G427 L428 L460 R461 N462	E408-G427 WeakPolarHBondContact CA-O 3.23Å; E408-L428 HydrophobicContact CB-CD1 4.46Å; E408-L428 HydrophobicContact CG-CD1 3.51Å; E408-L460 WeakPolarHBondContact O-CA 3.21Å; E408-R461 HydrophobicContact CB-CG 4.08Å; E408-R461 WeakPolarHBondContact CB-O 3.2Å; E408-R461 PolarHBondContact N-O 2.92Å; E408-R461 PolarHBondContact O-N 3.46Å; E408-R461 IonicContact OE2-CZ 2.74Å; E408-R461 IonicContact OE2-NH1 3.75Å; E408-R461 PolarHBondContact OE2-NH1 2.72Å; E408-R461 IonicContact OE2-NH2 3.19Å; E408-R461 PolarHBondContact OE2-NH2 3.09Å; E408-N462 HydrophobicContact CG-CB 4.37Å; E408-N462 PolarHBondContact OE1-ND2 3.44Å
409	Y	95.6	Very high	87.3	Confident	37 Å²	37	41 Å²	41	15%	0.145	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	149.6	174.5	70.6	-85.4	0	0	0	111.5	V425 K426 G427 L429 I440 H459	Y409-V425 HydrophobicContact CE2-CB 4.5Å; Y409-V425 HydrophobicContact CE2-CG1 3.73Å; Y409-K426 WeakPolarHBondContact O-CA 3.35Å; Y409-G427 VanDerWaalsContact CD1-C 3.5Å; Y409-G427 WeakPolarHBondContact CD1-O 3.3Å; Y409-G427 PolarHBondContact N-O 3.47Å; Y409-G427 PolarHBondContact O-N 3.02Å; Y409-L429 HydrophobicContact CD1-CD1 4.27Å; Y409-L429 HydrophobicContact CD1-CD2 4.26Å; Y409-L429 HydrophobicContact CD1-CG 3.65Å; Y409-L429 HydrophobicContact CE1-CD2 3.86Å; Y409-L429 HydrophobicContact CE1-CG 3.75Å; Y409-I440 HydrophobicContact CD1-CD1 4.09Å; Y409-I440 HydrophobicContact CD1-CG1 4.19Å; Y409-I440 HydrophobicContact CD2-CB 4.43Å; Y409-I440 HydrophobicContact CD2-CD1 3.57Å; Y409-I440 HydrophobicContact CD2-CG1 3.86Å; Y409-I440 HydrophobicContact CD2-CG2 3.69Å; Y409-I440 HydrophobicContact CE1-CG1 4.2Å; Y409-I440 HydrophobicContact CE2-CB 4.21Å; Y409-I440 HydrophobicContact CE2-CD1 4.15Å; Y409-I440 HydrophobicContact CE2-CG1 3.9Å; Y409-I440 HydrophobicContact CE2-CG2 3.3Å; Y409-I440 HydrophobicContact CG-CD1 3.52Å; Y409-I440 HydrophobicContact CG-CG1 3.99Å; Y409-H459 VanDerWaalsContact CA-O 3.25Å; Y409-H459 WeakPolarHBondContact CA-O 3.43Å
410	F	93.6	Very high	87.6	Confident	47 Å²	47	46 Å²	46	21%	0.206	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	152.6	177	63.5	-72.2	0	0	0	110.1	L412 V425 K426 V458 H459 R461	F410-L412 HydrophobicContact CD2-CD2 4.08Å; F410-L412 HydrophobicContact CD2-CG 3.93Å; F410-L412 HydrophobicContact CE2-CD1 3.73Å; F410-L412 HydrophobicContact CE2-CD2 3.85Å; F410-L412 HydrophobicContact CE2-CG 3.58Å; F410-L412 HydrophobicContact CZ-CD1 4.44Å; F410-V425 WeakPolarHBondContact CA-O 3.03Å; F410-K426 HydrophobicContact CB-CB 4.09Å; F410-V458 WeakPolarHBondContact O-CA 3.45Å; F410-H459 HydrophobicContact CD1-CB 4.15Å; F410-H459 HydrophobicContact CE1-CB 3.51Å; F410-H459 HydrophobicContact CE2-CB 4.25Å; F410-H459 HydrophobicContact CZ-CB 3.58Å; F410-H459 PolarHBondContact N-O 2.71Å; F410-H459 PolarHBondContact O-N 2.78Å; F410-R461 HydrophobicContact CD1-CG 4.12Å; F410-R461 HydrophobicContact CE1-CB 4.37Å; F410-R461 HydrophobicContact CE1-CG 3.69Å; F410-R461 VanDerWaalsContact CE1-NE 3.34Å
411	T	94.2	Very high	87.9	Confident	17 Å²	17	45.4 Å²	45.4	10%	0.104	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	148.8	173.4	40.7	0	0	0	0	110.6	Y422 P424 V425 I442 F456 T457 V458	T411-Y422 HydrophobicContact CG2-CE2 3.98Å; T411-P424 WeakPolarHBondContact OG1-CA 3.28Å; T411-V425 PolarHBondContact N-O 3.36Å; T411-V425 PolarHBondContact OG1-N 3.24Å; T411-V425 PolarHBondContact OG1-O 3.41Å; T411-I442 HydrophobicContact CG2-CD1 4.33Å; T411-F456 HydrophobicContact CG2-CD2 4.25Å; T411-F456 HydrophobicContact CG2-CE2 4.14Å; T411-T457 CarbonylContact C-O 3.54Å; T411-T457 VanDerWaalsContact CA-O 3.31Å; T411-T457 WeakPolarHBondContact CA-O 3.3Å; T411-V458 HydrophobicContact CG2-CG2 3.91Å
412	L	90.3	Very high	88.4	Confident	78 Å²	78	42.9 Å²	42.9	41%	0.408	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133.7	171	-74	-179.7	0	0	0	109.2	F410 F456 T457	F410-L412 HydrophobicContact CD2-CD2 4.08Å; F410-L412 HydrophobicContact CD2-CG 3.93Å; F410-L412 HydrophobicContact CE2-CD1 3.73Å; F410-L412 HydrophobicContact CE2-CD2 3.85Å; F410-L412 HydrophobicContact CE2-CG 3.58Å; F410-L412 HydrophobicContact CZ-CD1 4.44Å; L412-F456 WeakPolarHBondContact O-CB 3.39Å; L412-T457 PolarHBondContact N-O 3.37Å; L412-T457 PolarHBondContact O-N 2.72Å; L412-T457 PolarHBondContact O-OG1 3.27Å
413	D	85.8	Confident	88.8	Confident	89 Å²	89	41.7 Å²	41.7	48%	0.476	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	140	174	-56.3	-15.3	0	0	0	110.6	A416 A418 Y422	D413-A416 WeakPolarHBondContact CA-O 3.02Å; D413-A416 WeakPolarHBondContact CB-O 3.27Å; D413-A418 VanDerWaalsContact OD1-CB 3.27Å; D413-A418 WeakPolarHBondContact OD1-CB 3.25Å; D413-A418 PolarHBondContact OD1-N 2.88Å; D413-Y422 PolarHBondContact N-OH 3.41Å; D413-Y422 PolarHBondContact OD1-OH 3.39Å
414	G	81.6	Confident	89.2	Confident	41 Å²	41	45.6 Å²	45.6	42%	0.423	27%	0.267	S	S	.	.	S	Bend	trans	-113.2	-109.7	169.4	0	0	0	0	0	109	A416 H455	G414-A416 PolarHBondContact N-O 3.41Å; G414-H455 CarbonylContact C-O 3.59Å; G414-H455 WeakPolarHBondContact CA-O 3.49Å; G414-H455 PolarHBondContact N-O 3.01Å
415	T	78.1	Confident	89.4	Confident	69 Å²	69	45.8 Å²	45.8	42%	0.423	27%	0.268	S	S	.	.	S	Bend	trans	-81.1	-32.4	160.7	50	0	0	0	0	111.3	E454 H455	T415-E454 VanDerWaalsContact OG1-CA 3.23Å; T415-E454 WeakPolarHBondContact OG1-CA 3.48Å; T415-E454 WeakPolarHBondContact OG1-CB 3.37Å; T415-H455 PolarHBondContact N-O 3.33Å; T415-H455 PolarHBondContact OG1-N 3.49Å; T415-H455 PolarHBondContact OG1-ND1 2.87Å
416	A	84.8	Confident	89.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-75	130.4	173	0	0	0	0	0	111.6	D413 G414 D421 Y422 E454 H455 F456	D413-A416 WeakPolarHBondContact CA-O 3.02Å; D413-A416 WeakPolarHBondContact CB-O 3.27Å; G414-A416 PolarHBondContact N-O 3.41Å; A416-D421 WeakPolarHBondContact CA-OD2 3.3Å; A416-D421 HydrophobicContact CB-CB 4.03Å; A416-Y422 HydrophobicContact CB-CD1 4.35Å; A416-E454 WeakPolarHBondContact CA-OE2 3.48Å; A416-E454 HydrophobicContact CB-CB 3.82Å; A416-H455 PolarHBondContact N-O 3.44Å; A416-F456 HydrophobicContact CB-CB 4.29Å; A416-F456 HydrophobicContact CB-CD1 4.2Å
417	V	85.7	Confident	89.6	Confident	59 Å²	59	55.8 Å²	55.8	36%	0.358	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-98.7	128.9	-175.5	-178.2	0	0	0	0	111	G419 E420 D421	V417-G419 PolarHBondContact O-N 3.14Å; V417-E420 HydrophobicContact CB-CB 4.37Å; V417-E420 PolarHBondContact O-N 3.43Å; V417-D421 WeakPolarHBondContact CA-OD2 3.2Å; V417-D421 PolarHBondContact N-OD2 3.02Å; V417-D421 PolarHBondContact O-N 3.07Å
418	A	88.7	Confident	89.5	Confident	35 Å²	35	60.1 Å²	60.1	29%	0.289	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-60.8	124.4	175.9	0	0	0	0	0	112.7	D413 Y422 P424	D413-A418 VanDerWaalsContact OD1-CB 3.27Å; D413-A418 WeakPolarHBondContact OD1-CB 3.25Å; D413-A418 PolarHBondContact OD1-N 2.88Å; A418-Y422 HydrophobicContact CB-CE1 4.03Å; A418-Y422 HydrophobicContact CB-CE2 4.5Å; A418-P424 HydrophobicContact CB-CB 3.91Å; A418-P424 HydrophobicContact CB-CG 3.89Å
419	G	85.2	Confident	89.5	Confident	53 Å²	53	58.6 Å²	58.6	55%	0.546	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	93	-12.9	178.6	0	0	0	0	0	114.9	V417 Y422 I445	V417-G419 PolarHBondContact O-N 3.14Å; G419-Y422 PolarHBondContact N-O 2.83Å; G419-I445 WeakPolarHBondContact O-CD1 3.22Å
420	E	85	Confident	89.4	Confident	134 Å²	134	60.5 Å²	60.5	63%	0.626	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-53.7	168.5	-66.4	-179.9	170.2	0	0	108.2	V417 I445	V417-E420 HydrophobicContact CB-CB 4.37Å; V417-E420 PolarHBondContact O-N 3.43Å; E420-I445 VanDerWaalsContact O-CB 3.28Å; E420-I445 WeakPolarHBondContact O-CB 3.12Å; E420-I445 WeakPolarHBondContact O-CD1 3.38Å; E420-I445 WeakPolarHBondContact O-CG2 3.39Å
421	D	86.2	Confident	89.3	Confident	21 Å²	21	58.2 Å²	58.2	11%	0.112	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-26.9	-172.9	-39.3	-55.6	0	0	0	113.3	A416 V417 I444 I445	A416-D421 WeakPolarHBondContact CA-OD2 3.3Å; A416-D421 HydrophobicContact CB-CB 4.03Å; V417-D421 WeakPolarHBondContact CA-OD2 3.2Å; V417-D421 PolarHBondContact N-OD2 3.02Å; V417-D421 PolarHBondContact O-N 3.07Å; D421-I444 WeakPolarHBondContact O-CG2 3.3Å; D421-I445 PolarHBondContact O-N 2.74Å
422	Y	92.9	Very high	89.1	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.008	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-150.1	156.1	179.8	79.4	-79	0	0	0	113.6	T411 D413 A416 A418 G419 P424 S443 F456	T411-Y422 HydrophobicContact CG2-CE2 3.98Å; D413-Y422 PolarHBondContact N-OH 3.41Å; D413-Y422 PolarHBondContact OD1-OH 3.39Å; A416-Y422 HydrophobicContact CB-CD1 4.35Å; A418-Y422 HydrophobicContact CB-CE1 4.03Å; A418-Y422 HydrophobicContact CB-CE2 4.5Å; G419-Y422 PolarHBondContact N-O 2.83Å; Y422-P424 HydrophobicContact CE2-CB 4.28Å; Y422-P424 WeakPolarHBondContact O-CD 3.18Å; Y422-S443 WeakPolarHBondContact CA-O 3.28Å; Y422-F456 HydrophobicContact CD1-CB 4.27Å; Y422-F456 AromaticContact CD1-CD1 3.84Å; Y422-F456 HydrophobicContact CD1-CD1 3.84Å; Y422-F456 HydrophobicContact CD1-CE1 4.31Å; Y422-F456 AromaticContact CD1-CG 3.96Å; Y422-F456 HydrophobicContact CD1-CG 3.96Å; Y422-F456 HydrophobicContact CD2-CD1 4.44Å; Y422-F456 HydrophobicContact CD2-CD2 4.07Å; Y422-F456 HydrophobicContact CD2-CE1 4.37Å; Y422-F456 AromaticContact CD2-CE2 4Å; Y422-F456 HydrophobicContact CD2-CE2 4Å; Y422-F456 HydrophobicContact CD2-CG 4.3Å; Y422-F456 HydrophobicContact CD2-CZ 4.15Å; Y422-F456 HydrophobicContact CE1-CB 3.79Å; Y422-F456 HydrophobicContact CE1-CD1 4.22Å; Y422-F456 HydrophobicContact CE1-CD2 4.37Å; Y422-F456 AromaticContact CE1-CG 3.88Å; Y422-F456 HydrophobicContact CE1-CG 3.88Å; Y422-F456 AromaticContact CE2-CD2 3.88Å; Y422-F456 HydrophobicContact CE2-CD2 3.88Å; Y422-F456 HydrophobicContact CE2-CE2 4.18Å; Y422-F456 HydrophobicContact CE2-CG 4.21Å; Y422-F456 AromaticContact CG-CD1 3.97Å; Y422-F456 HydrophobicContact CG-CD1 3.97Å; Y422-F456 HydrophobicContact CG-CD2 4.39Å; Y422-F456 AromaticContact CG-CE1 3.98Å; Y422-F456 HydrophobicContact CG-CE1 3.98Å; Y422-F456 HydrophobicContact CG-CE2 4.41Å; Y422-F456 HydrophobicContact CG-CG 4.18Å; Y422-F456 HydrophobicContact CG-CZ 4.21Å
423	E	91.5	Very high	88.9	Confident	113 Å²	113	58.6 Å²	58.6	53%	0.528	35%	0.351	S	S	.	.			trans	-84	119.8	173.2	-65.4	-169.2	169.6	0	0	111.4	V425 S443	E423-V425 PolarHBondContact O-N 3.36Å; E423-S443 PolarHBondContact N-O 3.5Å
424	P	92.9	Very high	88.8	Confident	83 Å²	83	56.6 Å²	56.6	54%	0.539	35%	0.351	S	S	.	.			trans	-71.3	124.1	-177.4	28.3	-35.7	0	0	0	112.7	T411 A418 Y422	T411-P424 WeakPolarHBondContact OG1-CA 3.28Å; A418-P424 HydrophobicContact CB-CB 3.91Å; A418-P424 HydrophobicContact CB-CG 3.89Å; Y422-P424 HydrophobicContact CE2-CB 4.28Å; Y422-P424 WeakPolarHBondContact O-CD 3.18Å
425	V	93.7	Very high	89.1	Confident	37 Å²	37	57.4 Å²	57.4	22%	0.224	34%	0.344	C	S	.	.			trans	-110.8	137.7	178.4	-166.9	0	0	0	0	111.6	Y409 F410 T411 E423	Y409-V425 HydrophobicContact CE2-CB 4.5Å; Y409-V425 HydrophobicContact CE2-CG1 3.73Å; F410-V425 WeakPolarHBondContact CA-O 3.03Å; T411-V425 PolarHBondContact N-O 3.36Å; T411-V425 PolarHBondContact OG1-N 3.24Å; T411-V425 PolarHBondContact OG1-O 3.41Å; E423-V425 PolarHBondContact O-N 3.36Å
426	K	94.2	Very high	89.6	Confident	183 Å²	183	57.3 Å²	57.3	80%	0.796	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.5	138.8	168.5	67.1	-175	178.9	-171.9	0	110.9	Y409 F410	Y409-K426 WeakPolarHBondContact O-CA 3.35Å; F410-K426 HydrophobicContact CB-CB 4.09Å
427	G	92.8	Very high	89.9	Confident	28 Å²	28	62.2 Å²	62.2	29%	0.289	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	-173.1	-176.8	0	0	0	0	0	115.3	E408 Y409	E408-G427 WeakPolarHBondContact CA-O 3.23Å; Y409-G427 VanDerWaalsContact CD1-C 3.5Å; Y409-G427 WeakPolarHBondContact CD1-O 3.3Å; Y409-G427 PolarHBondContact N-O 3.47Å; Y409-G427 PolarHBondContact O-N 3.02Å
428	L	93.8	Very high	90.3	Very high	92 Å²	92	62.3 Å²	62.3	48%	0.482	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	121.2	177.6	-175.3	81	0	0	0	109.4	E408	E408-L428 HydrophobicContact CB-CD1 4.46Å; E408-L428 HydrophobicContact CG-CD1 3.51Å
429	L	93.3	Very high	90.5	Very high	12 Å²	12	65.8 Å²	65.8	6%	0.063	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	115.2	170.5	-67	177.9	0	0	0	109.6	V394 S406 V407 Y409 F431 K438 I440	V394-L429 HydrophobicContact CB-CD1 4.04Å; V394-L429 HydrophobicContact CG2-CD1 3.68Å; S406-L429 CarbonylContact C-O 3.59Å; S406-L429 WeakPolarHBondContact CA-O 3.31Å; V407-L429 HydrophobicContact CG1-CB 3.8Å; V407-L429 HydrophobicContact CG1-CD1 4.27Å; V407-L429 PolarHBondContact N-O 3.29Å; V407-L429 PolarHBondContact O-N 3.08Å; Y409-L429 HydrophobicContact CD1-CD1 4.27Å; Y409-L429 HydrophobicContact CD1-CD2 4.26Å; Y409-L429 HydrophobicContact CD1-CG 3.65Å; Y409-L429 HydrophobicContact CE1-CD2 3.86Å; Y409-L429 HydrophobicContact CE1-CG 3.75Å; L429-F431 HydrophobicContact CB-CE2 4.15Å; L429-K438 HydrophobicContact CD1-CB 4.19Å; L429-K438 HydrophobicContact CD2-CB 4.09Å; L429-K438 HydrophobicContact CD2-CD 4.2Å; L429-I440 HydrophobicContact CD1-CD1 4Å; L429-I440 HydrophobicContact CD1-CG1 3.9Å; L429-I440 HydrophobicContact CD2-CG1 4.2Å; L429-I440 HydrophobicContact CG-CG1 4.34Å
430	L	92.9	Very high	90.9	Very high	77 Å²	77	63.3 Å²	63.3	40%	0.403	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	111.4	173	-176.5	70.8	0	0	0	109.8	V404 K438 K466	V404-L430 HydrophobicContact CG1-CD1 3.58Å; V404-L430 HydrophobicContact CG1-CG 4.13Å; L430-K438 WeakPolarHBondContact O-CE 3.39Å; L430-K438 PolarHBondContact O-NZ 3.31Å; L430-K466 HydrophobicContact CD1-CG 4.05Å
431	F	92.6	Very high	91.3	Very high	0 Å²	0	62 Å²	62	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	111.7	172.9	-74.6	-99.6	0	0	0	110.3	F374 V394 R396 V404 V405 V407 L429 E435 K438	F374-F431 HydrophobicContact CD1-CD2 4.39Å; F374-F431 HydrophobicContact CD1-CE2 4.22Å; F374-F431 AromaticContact CE1-CD2 3.9Å; F374-F431 HydrophobicContact CE1-CD2 3.9Å; F374-F431 HydrophobicContact CE1-CE2 4.19Å; F374-F431 HydrophobicContact CE1-CG 4.09Å; V394-F431 HydrophobicContact CB-CZ 4.1Å; V394-F431 HydrophobicContact CG1-CE2 4.21Å; V394-F431 HydrophobicContact CG1-CZ 3.87Å; R396-F431 HydrophobicContact CB-CD1 4.24Å; R396-F431 HydrophobicContact CB-CE1 4.21Å; V404-F431 VanDerWaalsContact CA-O 3.29Å; V404-F431 WeakPolarHBondContact CA-O 3.42Å; V404-F431 WeakPolarHBondContact CG1-O 3.4Å; V405-F431 PolarHBondContact N-O 3.09Å; V405-F431 WeakPolarHBondContact O-CB 3.34Å; V405-F431 PolarHBondContact O-N 2.68Å; V407-F431 HydrophobicContact CG1-CD2 4.42Å; V407-F431 HydrophobicContact CG1-CE2 3.9Å; L429-F431 HydrophobicContact CB-CE2 4.15Å; F431-E435 WeakPolarHBondContact CA-OE2 3.25Å; F431-E435 HydrophobicContact CD1-CB 4.29Å; F431-K438 HydrophobicContact CD1-CG 4.29Å; F431-K438 HydrophobicContact CE1-CB 4.17Å; F431-K438 HydrophobicContact CE1-CG 4.02Å; F431-K438 HydrophobicContact CE2-CB 4.39Å; F431-K438 HydrophobicContact CE2-CG 4.48Å; F431-K438 HydrophobicContact CZ-CB 3.88Å; F431-K438 HydrophobicContact CZ-CG 4.11Å
432	S	89.7	Confident	91.7	Very high	44 Å²	44	61 Å²	61	31%	0.308	34%	0.336	S	S	.	.			trans	-74.5	169.5	174.7	-43.2	0	0	0	0	111.5	R396 G434 E435	R396-S432 PolarHBondContact NH2-O 2.91Å; S432-G434 PolarHBondContact O-N 3.41Å; S432-E435 VanDerWaalsContact CB-CD 3.44Å; S432-E435 VanDerWaalsContact CB-OE1 3.28Å; S432-E435 WeakPolarHBondContact CB-OE1 3.35Å; S432-E435 VanDerWaalsContact N-CD 3.34Å; S432-E435 PolarHBondContact N-OE2 3.2Å; S432-E435 PolarHBondContact O-N 3.46Å; S432-E435 VanDerWaalsContact O-N 3.15Å; S432-E435 PolarHBondContact OG-OE1 2.99Å; S432-E435 PolarHBondContact OG-OE2 2.99Å
433	A	86	Confident	91.7	Very high	58 Å²	58	62.2 Å²	62.2	48%	0.479	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	125.3	173.4	0	0	0	0	0	111	H402 E435	H402-A433 WeakPolarHBondContact O-CB 3.33Å; A433-E435 VanDerWaalsContact C-N 3.35Å; A433-E435 PolarHBondContact O-N 2.84Å
434	G	83.2	Confident	91.6	Very high	47 Å²	47	57.4 Å²	57.4	49%	0.485	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	-8.9	179.2	0	0	0	0	0	116.2	M401 S432 T436	M401-G434 PolarHBondContact O-N 3.18Å; S432-G434 PolarHBondContact O-N 3.41Å; G434-T436 PolarHBondContact O-N 3.26Å
435	E	88.9	Confident	91.4	Very high	59 Å²	59	56.5 Å²	56.5	28%	0.276	31%	0.313	S	S	.	.			trans	-73.8	118.1	178.2	-69.6	177.7	-178.8	0	0	111.1	R396 F431 S432 A433 K438	R396-E435 PolarHBondContact NE-O 3.47Å; R396-E435 VanDerWaalsContact NH2-N 3.17Å; R396-E435 PolarHBondContact NH2-O 3.29Å; F431-E435 WeakPolarHBondContact CA-OE2 3.25Å; F431-E435 HydrophobicContact CD1-CB 4.29Å; S432-E435 VanDerWaalsContact CB-CD 3.44Å; S432-E435 VanDerWaalsContact CB-OE1 3.28Å; S432-E435 WeakPolarHBondContact CB-OE1 3.35Å; S432-E435 VanDerWaalsContact N-CD 3.34Å; S432-E435 PolarHBondContact N-OE2 3.2Å; S432-E435 PolarHBondContact O-N 3.46Å; S432-E435 VanDerWaalsContact O-N 3.15Å; S432-E435 PolarHBondContact OG-OE1 2.99Å; S432-E435 PolarHBondContact OG-OE2 2.99Å; A433-E435 VanDerWaalsContact C-N 3.35Å; A433-E435 PolarHBondContact O-N 2.84Å; E435-K438 IonicContact OE1-NZ 3.71Å; E435-K438 WeakPolarHBondContact OE2-CE 3.48Å; E435-K438 IonicContact OE2-NZ 3.95Å; E435-K438 PolarHBondContact OE2-NZ 2.97Å
436	T	87.7	Confident	90.8	Very high	67 Å²	67	59 Å²	59	41%	0.411	33%	0.325	S	S	.	.			trans	-93	-18.2	-178.6	59.1	0	0	0	0	113.2	T395 R396 M401 G434	T395-T436 CarbonylContact C-O 3.54Å; T395-T436 WeakPolarHBondContact CA-O 2.76Å; R396-T436 PolarHBondContact N-O 3.43Å; M401-T436 HydrophobicContact CE-CG2 3.95Å; G434-T436 PolarHBondContact O-N 3.26Å
437	H	91.4	Very high	90	Very high	103 Å²	103	53.4 Å²	53.4	48%	0.477	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	155	-179.9	59.7	-78.8	0	0	0	112.1	T393 V394	T393-H437 HydrophobicContact CG2-CB 3.94Å; V394-H437 CarbonylContact O-C 3.6Å; V394-H437 WeakPolarHBondContact O-CA 3.37Å
438	K	93.3	Very high	89.1	Confident	60 Å²	60	59.3 Å²	59.3	26%	0.261	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	154.4	169.1	-78.6	-143.6	169.5	-170.1	0	111.4	T393 V394 L429 L430 F431 E435	T393-K438 CarbonylContact C-O 3.55Å; T393-K438 WeakPolarHBondContact CA-O 3.21Å; V394-K438 PolarHBondContact N-O 2.83Å; V394-K438 PolarHBondContact O-N 3.11Å; L429-K438 HydrophobicContact CD1-CB 4.19Å; L429-K438 HydrophobicContact CD2-CB 4.09Å; L429-K438 HydrophobicContact CD2-CD 4.2Å; L430-K438 WeakPolarHBondContact O-CE 3.39Å; L430-K438 PolarHBondContact O-NZ 3.31Å; F431-K438 HydrophobicContact CD1-CG 4.29Å; F431-K438 HydrophobicContact CE1-CB 4.17Å; F431-K438 HydrophobicContact CE1-CG 4.02Å; F431-K438 HydrophobicContact CE2-CB 4.39Å; F431-K438 HydrophobicContact CE2-CG 4.48Å; F431-K438 HydrophobicContact CZ-CB 3.88Å; F431-K438 HydrophobicContact CZ-CG 4.11Å; E435-K438 IonicContact OE1-NZ 3.71Å; E435-K438 WeakPolarHBondContact OE2-CE 3.48Å; E435-K438 IonicContact OE2-NZ 3.95Å; E435-K438 PolarHBondContact OE2-NZ 2.97Å
439	Q	93	Very high	88.1	Confident	108 Å²	108	60.1 Å²	60.1	51%	0.505	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.8	-178	-68.3	177.2	-19.3	0	0	111.6	P391 V392	P391-Q439 HydrophobicContact CB-CB 4.13Å; P391-Q439 HydrophobicContact CB-CG 4.18Å; V392-Q439 CarbonylContact O-C 3.47Å; V392-Q439 VanDerWaalsContact O-CA 3.26Å; V392-Q439 WeakPolarHBondContact O-CA 3.41Å
440	I	94	Very high	86.7	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	120	172	-60.2	161.5	0	0	0	106.5	F376 P391 V392 V394 Y409 L429 I442 V458	F376-I440 HydrophobicContact CE1-CD1 4.24Å; P391-I440 CarbonylContact C-O 3.42Å; P391-I440 WeakPolarHBondContact CA-O 3.24Å; V392-I440 HydrophobicContact CB-CB 4.35Å; V392-I440 PolarHBondContact N-O 3.44Å; V392-I440 PolarHBondContact O-N 2.86Å; V394-I440 HydrophobicContact CG2-CD1 4.11Å; Y409-I440 HydrophobicContact CD1-CD1 4.09Å; Y409-I440 HydrophobicContact CD1-CG1 4.19Å; Y409-I440 HydrophobicContact CD2-CB 4.43Å; Y409-I440 HydrophobicContact CD2-CD1 3.57Å; Y409-I440 HydrophobicContact CD2-CG1 3.86Å; Y409-I440 HydrophobicContact CD2-CG2 3.69Å; Y409-I440 HydrophobicContact CE1-CG1 4.2Å; Y409-I440 HydrophobicContact CE2-CB 4.21Å; Y409-I440 HydrophobicContact CE2-CD1 4.15Å; Y409-I440 HydrophobicContact CE2-CG1 3.9Å; Y409-I440 HydrophobicContact CE2-CG2 3.3Å; Y409-I440 HydrophobicContact CG-CD1 3.52Å; Y409-I440 HydrophobicContact CG-CG1 3.99Å; L429-I440 HydrophobicContact CD1-CD1 4Å; L429-I440 HydrophobicContact CD1-CG1 3.9Å; L429-I440 HydrophobicContact CD2-CG1 4.2Å; L429-I440 HydrophobicContact CG-CG1 4.34Å; I440-I442 HydrophobicContact CG2-CD1 4.41Å; I440-I442 HydrophobicContact CG2-CG1 4.03Å; I440-V458 HydrophobicContact CD1-CG1 4.11Å
441	M	93.9	Very high	85.6	Confident	106 Å²	106	63.6 Å²	63.6	52%	0.522	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	126.7	176.8	-58.5	-59	-72.2	0	0	109.4	T389 P391	T389-M441 HydrophobicContact CG2-CB 4.28Å; T389-M441 HydrophobicContact CG2-CE 3.94Å; P391-M441 HydrophobicContact CB-SD 3.82Å
442	I	94	Very high	84.5	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	136.5	178.4	-53.8	179.6	0	0	0	108.5	T389 F390 V392 T411 I440 F456 V458	T389-I442 CarbonylContact C-O 3.51Å; T389-I442 VanDerWaalsContact CA-O 3.32Å; T389-I442 WeakPolarHBondContact CA-O 3.36Å; T389-I442 WeakPolarHBondContact CG2-O 3.37Å; F390-I442 WeakPolarHBondContact CD1-O 3.13Å; F390-I442 HydrophobicContact CE1-CB 4.04Å; F390-I442 HydrophobicContact CE1-CG2 4.27Å; F390-I442 HydrophobicContact CZ-CB 4.18Å; F390-I442 PolarHBondContact N-O 3.39Å; F390-I442 PolarHBondContact O-N 3.07Å; V392-I442 HydrophobicContact CB-CD1 4.44Å; V392-I442 HydrophobicContact CG2-CD1 3.71Å; V392-I442 HydrophobicContact CG2-CG1 4.43Å; T411-I442 HydrophobicContact CG2-CD1 4.33Å; I440-I442 HydrophobicContact CG2-CD1 4.41Å; I440-I442 HydrophobicContact CG2-CG1 4.03Å; I442-F456 HydrophobicContact CD1-CE2 4.12Å; I442-F456 HydrophobicContact CG2-CE2 4Å; I442-F456 HydrophobicContact CG2-CZ 3.76Å; I442-V458 HydrophobicContact CD1-CG2 3.38Å
443	S	92.2	Very high	83.8	Confident	28 Å²	28	71.7 Å²	71.7	20%	0.196	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.3	-179.6	-58.6	0	0	0	0	110.9	G388 T389 Y422 E423	G388-S443 CarbonylContact O-C 3.02Å; G388-S443 WeakPolarHBondContact O-CA 3.27Å; T389-S443 WeakPolarHBondContact CG2-OG 3.47Å; T389-S443 PolarHBondContact OG1-OG 2.86Å; Y422-S443 WeakPolarHBondContact CA-O 3.28Å; E423-S443 PolarHBondContact N-O 3.5Å
444	I	90.9	Very high	83.6	Confident	12 Å²	12	70.8 Å²	70.8	6%	0.062	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-104.6	143	176.5	-56	-57.7	0	0	0	108.2	V383 E385 V387 G388 F390 D421 F456 V486	V383-I444 HydrophobicContact CG2-CD1 4.38Å; V383-I444 HydrophobicContact CG2-CG1 4.09Å; E385-I444 HydrophobicContact CG-CG2 4.44Å; E385-I444 VanDerWaalsContact O-CG2 3.3Å; E385-I444 WeakPolarHBondContact O-CG2 3.23Å; V387-I444 HydrophobicContact CG1-CB 3.98Å; V387-I444 HydrophobicContact CG1-CG1 3.69Å; G388-I444 PolarHBondContact O-N 3.22Å; F390-I444 HydrophobicContact CD1-CG1 4.15Å; F390-I444 HydrophobicContact CE1-CD1 3.87Å; F390-I444 HydrophobicContact CE1-CG1 3.79Å; D421-I444 WeakPolarHBondContact O-CG2 3.3Å; I444-F456 HydrophobicContact CD1-CE1 3.67Å; I444-F456 HydrophobicContact CD1-CZ 3.97Å; I444-V486 HydrophobicContact CD1-CG2 4.04Å; I444-V486 HydrophobicContact CG2-CG1 4.04Å
445	I	87.5	Confident	83.6	Confident	63 Å²	63	71.9 Å²	71.9	32%	0.323	36%	0.358	S	S	.	.			trans	-96.9	139.3	178.1	-59.5	169.7	0	0	0	107.4	E385 G419 E420 D421	E385-I445 WeakPolarHBondContact CG-O 3.27Å; G419-I445 WeakPolarHBondContact O-CD1 3.22Å; E420-I445 VanDerWaalsContact O-CB 3.28Å; E420-I445 WeakPolarHBondContact O-CB 3.12Å; E420-I445 WeakPolarHBondContact O-CD1 3.38Å; E420-I445 WeakPolarHBondContact O-CG2 3.39Å; D421-I445 PolarHBondContact O-N 2.74Å
446	D	81.3	Confident	83.5	Confident	91 Å²	91	69.1 Å²	69.1	49%	0.487	35%	0.345	S	S	.	.			trans	-121.2	126	-170.5	-175.1	49.3	0	0	0	110	E385 N386	E385-D446 WeakPolarHBondContact OE1-CA 3.4Å; N386-D446 WeakPolarHBondContact CA-OD1 3.48Å; N386-D446 WeakPolarHBondContact CB-OD1 3.34Å; N386-D446 PolarHBondContact N-OD1 3.4Å
447	D	77.8	Confident	83.4	Confident	65 Å²	65	67 Å²	67	35%	0.348	33%	0.332	S	S	.	.			trans	-126	-163.8	173.3	85.2	38.3	0	0	0	114.7	E385 I449	E385-D447 PolarHBondContact OE1-N 3.13Å; D447-I449 WeakPolarHBondContact OD1-CB 3.38Å; D447-I449 PolarHBondContact OD1-N 3.23Å
448	D	73.3	Confident	83.5	Confident	152 Å²	152	62.1 Å²	62.1	81%	0.813	31%	0.31	S	S	*	.	S	Bend	trans	-126.8	22.3	-174	-71.7	-57.1	0	0	0	110.9	D490	D448-D490 WeakPolarHBondContact CA-OD2 3.33Å
449	I	72.5	Confident	83.4	Confident	109 Å²	109	61.5 Å²	61.5	56%	0.559	31%	0.307	S	S	*	.	S	Bend	trans	-113.4	127.3	-178.1	-58.9	176.2	0	0	0	108.3	D447 E451 D490	D447-I449 WeakPolarHBondContact OD1-CB 3.38Å; D447-I449 PolarHBondContact OD1-N 3.23Å; I449-E451 WeakPolarHBondContact O-CG 2.98Å; I449-E451 PolarHBondContact O-N 3.28Å; I449-E451 VanDerWaalsContact O-N 3.14Å; I449-D490 PolarHBondContact N-OD2 2.97Å; I449-D490 VanDerWaalsContact N-OD2 3.15Å
450	F	65.7	Low	83.3	Confident	102 Å²	102	56.8 Å²	56.8	45%	0.447	29%	0.286	S	S	.	.			trans	-61.4	116.8	172.7	174.5	-103.4	0	0	0	112.1	D488 D490 H491	F450-D488 WeakPolarHBondContact CA-OD1 3.32Å; F450-D488 WeakPolarHBondContact CD2-OD2 3.47Å; F450-D490 HydrophobicContact CB-CB 4.36Å; F450-H491 HydrophobicContact CD2-CB 3.6Å; F450-H491 HydrophobicContact CE2-CB 3.5Å; F450-H491 HydrophobicContact CZ-CB 4.42Å
451	E	69.8	Low	83.2	Confident	60 Å²	60	62.2 Å²	62.2	28%	0.28	31%	0.306	S	S	.	.			trans	-115.9	168.2	175.5	-60.2	-166.4	175.7	0	0	111.9	I449 D488	I449-E451 WeakPolarHBondContact O-CG 2.98Å; I449-E451 PolarHBondContact O-N 3.28Å; I449-E451 VanDerWaalsContact O-N 3.14Å; E451-D488 PolarHBondContact N-OD1 2.88Å
452	E	69.3	Low	82.8	Confident	160 Å²	160	61.3 Å²	61.3	75%	0.748	30%	0.303	S	S	*	.			trans	-80.5	150.4	172.4	-67.8	-172.6	168.3	0	0	109.4	E454	E452-E454 WeakPolarHBondContact O-CG 3.43Å; E452-E454 PolarHBondContact O-N 3.49Å
453	D	75.2	Confident	82.6	Confident	53 Å²	53	63.1 Å²	63.1	28%	0.283	31%	0.313	S	S	.	.			trans	-57.1	124.4	176.7	-63.1	-33.5	0	0	0	110.6	L487 D488	D453-L487 HydrophobicContact CB-CD2 4.14Å; D453-D488 PolarHBondContact OD1-N 2.65Å
454	E	81.8	Confident	82.3	Confident	40 Å²	40	65.8 Å²	65.8	19%	0.187	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	166.6	-173.4	-52.7	-154.9	129.9	0	0	113.1	T415 A416 E452 M485 V486	T415-E454 VanDerWaalsContact OG1-CA 3.23Å; T415-E454 WeakPolarHBondContact OG1-CA 3.48Å; T415-E454 WeakPolarHBondContact OG1-CB 3.37Å; A416-E454 WeakPolarHBondContact CA-OE2 3.48Å; A416-E454 HydrophobicContact CB-CB 3.82Å; E452-E454 WeakPolarHBondContact O-CG 3.43Å; E452-E454 PolarHBondContact O-N 3.49Å; E454-M485 CarbonylContact O-C 3.57Å; E454-M485 WeakPolarHBondContact O-CA 3.19Å; E454-V486 PolarHBondContact N-O 3.15Å; E454-V486 PolarHBondContact O-N 3.32Å
455	H	81.6	Confident	82.1	Confident	70 Å²	70	67.8 Å²	67.8	32%	0.324	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	152	177.2	71.1	-69.6	0	0	0	112.9	G414 T415 A416 T483 I484	G414-H455 CarbonylContact C-O 3.59Å; G414-H455 WeakPolarHBondContact CA-O 3.49Å; G414-H455 PolarHBondContact N-O 3.01Å; T415-H455 PolarHBondContact N-O 3.33Å; T415-H455 PolarHBondContact OG1-N 3.49Å; T415-H455 PolarHBondContact OG1-ND1 2.87Å; A416-H455 PolarHBondContact N-O 3.44Å; H455-T483 HydrophobicContact CB-CG2 4.35Å; H455-I484 CarbonylContact C-O 3.55Å; H455-I484 WeakPolarHBondContact CA-O 3.43Å; H455-I484 VanDerWaalsContact CB-O 3.27Å; H455-I484 WeakPolarHBondContact CB-O 3.13Å
456	F	87.4	Confident	82	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	170.3	166.8	67.3	-85.8	0	0	0	109.7	F390 T411 L412 A416 Y422 I442 I444 V458 I484 V486	F390-F456 HydrophobicContact CZ-CZ 4.45Å; T411-F456 HydrophobicContact CG2-CD2 4.25Å; T411-F456 HydrophobicContact CG2-CE2 4.14Å; L412-F456 WeakPolarHBondContact O-CB 3.39Å; A416-F456 HydrophobicContact CB-CB 4.29Å; A416-F456 HydrophobicContact CB-CD1 4.2Å; Y422-F456 HydrophobicContact CD1-CB 4.27Å; Y422-F456 AromaticContact CD1-CD1 3.84Å; Y422-F456 HydrophobicContact CD1-CD1 3.84Å; Y422-F456 HydrophobicContact CD1-CE1 4.31Å; Y422-F456 AromaticContact CD1-CG 3.96Å; Y422-F456 HydrophobicContact CD1-CG 3.96Å; Y422-F456 HydrophobicContact CD2-CD1 4.44Å; Y422-F456 HydrophobicContact CD2-CD2 4.07Å; Y422-F456 HydrophobicContact CD2-CE1 4.37Å; Y422-F456 AromaticContact CD2-CE2 4Å; Y422-F456 HydrophobicContact CD2-CE2 4Å; Y422-F456 HydrophobicContact CD2-CG 4.3Å; Y422-F456 HydrophobicContact CD2-CZ 4.15Å; Y422-F456 HydrophobicContact CE1-CB 3.79Å; Y422-F456 HydrophobicContact CE1-CD1 4.22Å; Y422-F456 HydrophobicContact CE1-CD2 4.37Å; Y422-F456 AromaticContact CE1-CG 3.88Å; Y422-F456 HydrophobicContact CE1-CG 3.88Å; Y422-F456 AromaticContact CE2-CD2 3.88Å; Y422-F456 HydrophobicContact CE2-CD2 3.88Å; Y422-F456 HydrophobicContact CE2-CE2 4.18Å; Y422-F456 HydrophobicContact CE2-CG 4.21Å; Y422-F456 AromaticContact CG-CD1 3.97Å; Y422-F456 HydrophobicContact CG-CD1 3.97Å; Y422-F456 HydrophobicContact CG-CD2 4.39Å; Y422-F456 AromaticContact CG-CE1 3.98Å; Y422-F456 HydrophobicContact CG-CE1 3.98Å; Y422-F456 HydrophobicContact CG-CE2 4.41Å; Y422-F456 HydrophobicContact CG-CG 4.18Å; Y422-F456 HydrophobicContact CG-CZ 4.21Å; I442-F456 HydrophobicContact CD1-CE2 4.12Å; I442-F456 HydrophobicContact CG2-CE2 4Å; I442-F456 HydrophobicContact CG2-CZ 3.76Å; I444-F456 HydrophobicContact CD1-CE1 3.67Å; I444-F456 HydrophobicContact CD1-CZ 3.97Å; F456-V458 HydrophobicContact CE2-CG2 4.32Å; F456-I484 HydrophobicContact CD1-CB 4.17Å; F456-I484 HydrophobicContact CD1-CG2 4.32Å; F456-I484 HydrophobicContact CD2-CB 4.39Å; F456-I484 HydrophobicContact CD2-CD1 4.43Å; F456-I484 HydrophobicContact CE1-CB 3.73Å; F456-I484 HydrophobicContact CE1-CG1 4.42Å; F456-I484 HydrophobicContact CE1-CG2 3.53Å; F456-I484 HydrophobicContact CE2-CB 3.97Å; F456-I484 HydrophobicContact CE2-CD1 4.01Å; F456-I484 HydrophobicContact CE2-CG1 3.86Å; F456-I484 HydrophobicContact CE2-CG2 4.44Å; F456-I484 HydrophobicContact CG-CB 4.48Å; F456-I484 HydrophobicContact CZ-CB 3.61Å; F456-I484 HydrophobicContact CZ-CD1 4.44Å; F456-I484 HydrophobicContact CZ-CG1 3.79Å; F456-I484 HydrophobicContact CZ-CG2 3.6Å; F456-I484 PolarHBondContact N-O 3.36Å; F456-I484 PolarHBondContact O-N 3.28Å; F456-V486 HydrophobicContact CD1-CG2 4.28Å; F456-V486 HydrophobicContact CE1-CG2 3.99Å
457	T	86.4	Confident	81.9	Confident	24 Å²	24	71.5 Å²	71.5	15%	0.147	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.3	-174.7	56.2	0	0	0	0	112.9	T411 L412 H459 V481 A482 T483	T411-T457 CarbonylContact C-O 3.54Å; T411-T457 VanDerWaalsContact CA-O 3.31Å; T411-T457 WeakPolarHBondContact CA-O 3.3Å; L412-T457 PolarHBondContact N-O 3.37Å; L412-T457 PolarHBondContact O-N 2.72Å; L412-T457 PolarHBondContact O-OG1 3.27Å; T457-H459 WeakPolarHBondContact CB-NE2 3.45Å; T457-H459 PolarHBondContact OG1-CD2 2.81Å; T457-H459 PolarHBondContact OG1-NE2 3.34Å; T457-V481 HydrophobicContact CG2-CG1 4.07Å; T457-A482 CarbonylContact C-O 3.14Å; T457-A482 WeakPolarHBondContact CA-O 3.4Å; T457-T483 HydrophobicContact CG2-CG2 4.44Å
458	V	92	Very high	82	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.6	172.9	-173.5	0	0	0	0	108.5	F376 F410 T411 I440 I442 F456 V481 A482 I484	F376-V458 HydrophobicContact CE1-CG1 4.21Å; F376-V458 WeakPolarHBondContact CE2-O 3.49Å; F376-V458 HydrophobicContact CZ-CB 4.06Å; F376-V458 HydrophobicContact CZ-CG1 3.76Å; F376-V458 WeakPolarHBondContact CZ-O 3.22Å; F410-V458 WeakPolarHBondContact O-CA 3.45Å; T411-V458 HydrophobicContact CG2-CG2 3.91Å; I440-V458 HydrophobicContact CD1-CG1 4.11Å; I442-V458 HydrophobicContact CD1-CG2 3.38Å; F456-V458 HydrophobicContact CE2-CG2 4.32Å; V458-V481 WeakPolarHBondContact O-CA 3.38Å; V458-A482 HydrophobicContact CB-CB 4.41Å; V458-A482 PolarHBondContact N-O 3.23Å; V458-A482 PolarHBondContact O-N 3.14Å; V458-I484 HydrophobicContact CB-CD1 4.29Å; V458-I484 HydrophobicContact CG2-CD1 3.49Å; V458-I484 VanDerWaalsContact CG2-CD1 3.49Å
459	H	92	Very high	82.1	Confident	46 Å²	46	68 Å²	68	21%	0.213	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	137.9	-173.7	-70.9	-109.7	0	0	0	110.9	Y409 F410 T457 V481	Y409-H459 VanDerWaalsContact CA-O 3.25Å; Y409-H459 WeakPolarHBondContact CA-O 3.43Å; F410-H459 HydrophobicContact CD1-CB 4.15Å; F410-H459 HydrophobicContact CE1-CB 3.51Å; F410-H459 HydrophobicContact CE2-CB 4.25Å; F410-H459 HydrophobicContact CZ-CB 3.58Å; F410-H459 PolarHBondContact N-O 2.71Å; F410-H459 PolarHBondContact O-N 2.78Å; T457-H459 WeakPolarHBondContact CB-NE2 3.45Å; T457-H459 PolarHBondContact OG1-CD2 2.81Å; T457-H459 PolarHBondContact OG1-NE2 3.34Å; H459-V481 WeakPolarHBondContact ND1-CG2 3.48Å
460	L	90.7	Very high	82.2	Confident	9 Å²	9	66.3 Å²	66.3	5%	0.047	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	132.4	166.2	-61.5	174.6	0	0	0	109.9	F376 V394 V407 E408 L476 M480	F376-L460 HydrophobicContact CD2-CD1 4.05Å; F376-L460 HydrophobicContact CD2-CG 4.2Å; F376-L460 HydrophobicContact CE1-CD1 4.42Å; F376-L460 HydrophobicContact CE1-CD2 4.21Å; F376-L460 HydrophobicContact CE1-CG 4.23Å; F376-L460 HydrophobicContact CE2-CB 4.47Å; F376-L460 HydrophobicContact CE2-CD1 3.87Å; F376-L460 HydrophobicContact CE2-CD2 4.27Å; F376-L460 HydrophobicContact CE2-CG 3.51Å; F376-L460 HydrophobicContact CG-CD1 4.43Å; F376-L460 HydrophobicContact CZ-CD1 4.05Å; F376-L460 HydrophobicContact CZ-CD2 3.74Å; F376-L460 HydrophobicContact CZ-CG 3.51Å; V394-L460 HydrophobicContact CG1-CD1 3.65Å; V394-L460 HydrophobicContact CG1-CD2 4.34Å; V394-L460 HydrophobicContact CG2-CD1 4.08Å; V394-L460 HydrophobicContact CG2-CD2 3.79Å; V394-L460 HydrophobicContact CG2-CG 4.48Å; V407-L460 HydrophobicContact CG1-CD2 4.34Å; V407-L460 HydrophobicContact CG2-CB 3.87Å; V407-L460 HydrophobicContact CG2-CD2 3.97Å; V407-L460 HydrophobicContact CG2-CG 4.35Å; E408-L460 WeakPolarHBondContact O-CA 3.21Å; L460-L476 HydrophobicContact CB-CD1 4.48Å; L460-L476 HydrophobicContact CB-CD2 3.75Å; L460-L476 HydrophobicContact CD1-CD2 4.21Å; L460-L476 WeakPolarHBondContact O-CD1 3.31Å; L460-M480 PolarHBondContact N-O 2.9Å; L460-M480 VanDerWaalsContact N-O 3.15Å
461	R	91.4	Very high	82.6	Confident	117 Å²	117	70 Å²	70	44%	0.442	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	165.4	173.4	66.3	177.1	176.9	77.4	16.4	111.8	E408 F410	E408-R461 HydrophobicContact CB-CG 4.08Å; E408-R461 WeakPolarHBondContact CB-O 3.2Å; E408-R461 PolarHBondContact N-O 2.92Å; E408-R461 PolarHBondContact O-N 3.46Å; E408-R461 IonicContact OE2-CZ 2.74Å; E408-R461 IonicContact OE2-NH1 3.75Å; E408-R461 PolarHBondContact OE2-NH1 2.72Å; E408-R461 IonicContact OE2-NH2 3.19Å; E408-R461 PolarHBondContact OE2-NH2 3.09Å; F410-R461 HydrophobicContact CD1-CG 4.12Å; F410-R461 HydrophobicContact CE1-CB 4.37Å; F410-R461 HydrophobicContact CE1-CG 3.69Å; F410-R461 VanDerWaalsContact CE1-NE 3.34Å
462	N	86.5	Confident	83.1	Confident	87 Å²	87	68.1 Å²	68.1	47%	0.465	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.6	67.1	170.5	-159.5	30	0	0	0	113.7	E408 E464	E408-N462 HydrophobicContact CG-CB 4.37Å; E408-N462 PolarHBondContact OE1-ND2 3.44Å; N462-E464 PolarHBondContact O-N 3.42Å
463	L	89.3	Confident	83.7	Confident	37 Å²	37	64.9 Å²	64.9	19%	0.194	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	120	169	-81.6	161.9	0	0	0	109.7	F374 V405 S406 V407 P474 L476	F374-L463 HydrophobicContact CB-CD1 4.44Å; F374-L463 HydrophobicContact CB-CD2 4.09Å; F374-L463 HydrophobicContact CD1-CD2 4.09Å; F374-L463 HydrophobicContact CD2-CD1 4.15Å; F374-L463 HydrophobicContact CD2-CD2 3.51Å; F374-L463 HydrophobicContact CE1-CD2 4.39Å; F374-L463 HydrophobicContact CE2-CD2 3.87Å; F374-L463 HydrophobicContact CG-CD2 3.64Å; F374-L463 HydrophobicContact CZ-CD2 4.3Å; V405-L463 HydrophobicContact CG1-CD2 3.76Å; S406-L463 WeakPolarHBondContact O-CA 3.26Å; V407-L463 HydrophobicContact CB-CD2 4.01Å; V407-L463 HydrophobicContact CG2-CD2 4.23Å; V407-L463 HydrophobicContact CG2-CG 4.39Å; L463-P474 HydrophobicContact CB-CB 4.41Å; L463-P474 HydrophobicContact CB-CG 4.44Å; L463-P474 HydrophobicContact CD1-CB 4.3Å; L463-P474 HydrophobicContact CD2-CB 4.43Å; L463-L476 HydrophobicContact CD1-CB 4.3Å; L463-L476 HydrophobicContact CD1-CD2 3.79Å; L463-L476 HydrophobicContact CD1-CG 3.53Å; L463-L476 HydrophobicContact CG-CD2 4.15Å; L463-L476 HydrophobicContact CG-CG 4.17Å
464	E	86.1	Confident	84.3	Confident	85 Å²	85	64 Å²	64	40%	0.397	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123.8	178	-164.5	-169.1	148.8	0	0	110.2	V405 S406 N462 K466	V405-E464 WeakPolarHBondContact CA-O 3.23Å; S406-E464 PolarHBondContact N-O 2.99Å; S406-E464 PolarHBondContact O-N 2.93Å; S406-E464 PolarHBondContact OG-O 3.17Å; N462-E464 PolarHBondContact O-N 3.42Å; E464-K466 PolarHBondContact O-N 3.49Å; E464-K466 IonicContact OE1-NZ 3.04Å; E464-K466 PolarHBondContact OE1-NZ 2.93Å; E464-K466 WeakPolarHBondContact OE2-CE 3.3Å; E464-K466 IonicContact OE2-NZ 3.73Å; E464-K466 PolarHBondContact OE2-NZ 2.9Å
465	V	86.4	Confident	84.6	Confident	53 Å²	53	65 Å²	65	32%	0.321	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	112.9	173.3	-174	0	0	0	0	108.5	V405 P474	V405-V465 HydrophobicContact CG2-CG2 4.4Å; V465-P474 HydrophobicContact CG2-CG 3.6Å
466	K	84.7	Confident	84.9	Confident	100 Å²	100	64.2 Å²	64.2	44%	0.435	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-37.8	178.4	-62.7	-66.7	174.9	-174.2	0	111.9	V404 S406 L430 E464	V404-K466 HydrophobicContact CB-CB 4.39Å; V404-K466 HydrophobicContact CG1-CB 4.07Å; V404-K466 PolarHBondContact O-N 2.71Å; S406-K466 WeakPolarHBondContact OG-CE 3.09Å; L430-K466 HydrophobicContact CD1-CG 4.05Å; E464-K466 PolarHBondContact O-N 3.49Å; E464-K466 IonicContact OE1-NZ 3.04Å; E464-K466 PolarHBondContact OE1-NZ 2.93Å; E464-K466 WeakPolarHBondContact OE2-CE 3.3Å; E464-K466 IonicContact OE2-NZ 3.73Å; E464-K466 PolarHBondContact OE2-NZ 2.9Å
467	H	81	Confident	84.7	Confident	133 Å²	133	66 Å²	66	62%	0.616	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.5	128.2	178.3	-168.9	70	0	0	0	110.9	A403 V404	A403-H467 CarbonylContact C-O 3.34Å; A403-H467 WeakPolarHBondContact CA-O 3.34Å; V404-H467 HydrophobicContact CB-CB 4.04Å; V404-H467 HydrophobicContact CG2-CB 4.15Å; V404-H467 PolarHBondContact N-O 2.93Å; V404-H467 PolarHBondContact O-N 2.96Å
468	S	78.6	Confident	84	Confident	39 Å²	39	70.7 Å²	70.7	27%	0.273	36%	0.364	S	S	.	.			trans	-147.7	140.8	174.3	179.1	0	0	0	0	110.8	T470 I472	S468-T470 PolarHBondContact OG-N 2.97Å; S468-T470 VanDerWaalsContact OG-N 3.1Å; S468-T470 PolarHBondContact OG-O 3.47Å; S468-I472 WeakPolarHBondContact OG-CD1 3.46Å; S468-I472 WeakPolarHBondContact OG-CG1 3.04Å
469	S	75.2	Confident	82.9	Confident	103 Å²	103	72.8 Å²	72.8	72%	0.72	38%	0.378	S	S	*	.	S	Bend	trans	-85.2	-20.1	171	56.9	0	0	0	0	112.5	D400	D400-S469 PolarHBondContact OD2-OG 3.23Å
470	T	74.4	Confident	82.5	Confident	74 Å²	74	74.9 Å²	74.9	45%	0.454	39%	0.389	S	S	.	.	S	Bend	trans	-121.1	160.4	-175.3	57.8	0	0	0	0	111.4	D400 S468 I472	D400-T470 WeakPolarHBondContact CB-OG1 3.26Å; D400-T470 PolarHBondContact OD2-OG1 2.96Å; S468-T470 PolarHBondContact OG-N 2.97Å; S468-T470 VanDerWaalsContact OG-N 3.1Å; S468-T470 PolarHBondContact OG-O 3.47Å; T470-I472 PolarHBondContact O-N 2.66Å; T470-I472 WeakPolarHBondContact OG1-CG1 3.4Å
471	K	75.7	Confident	82.2	Confident	181 Å²	181	76.3 Å²	76.3	79%	0.787	40%	0.398	S	S	*	.			trans	-73.8	111.3	170.3	-171.7	-174.8	178.3	-164.8	0	107.6
472	I	79.7	Confident	81.9	Confident	20 Å²	20	70.8 Å²	70.8	10%	0.103	38%	0.377	C	S	.	.			trans	-118.1	141.8	-178.4	-51.4	171.8	0	0	0	108.4	Q372 D400 A403 S468 T470 P474	Q372-I472 HydrophobicContact CB-CG2 3.98Å; Q372-I472 HydrophobicContact CG-CG2 3.48Å; Q372-I472 VanDerWaalsContact CG-CG2 3.48Å; D400-I472 HydrophobicContact CB-CD1 3.8Å; D400-I472 HydrophobicContact CB-CG1 4.26Å; A403-I472 HydrophobicContact CB-CD1 3.16Å; S468-I472 WeakPolarHBondContact OG-CD1 3.46Å; S468-I472 WeakPolarHBondContact OG-CG1 3.04Å; T470-I472 PolarHBondContact O-N 2.66Å; T470-I472 WeakPolarHBondContact OG1-CG1 3.4Å; I472-P474 WeakPolarHBondContact O-CD 3.22Å
473	E	82.7	Confident	81.6	Confident	92 Å²	92	68.7 Å²	68.7	43%	0.43	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	99	168.8	-69.2	-177.6	-178	0	0	108.5	Q372	Q372-E473 PolarHBondContact N-O 3.46Å
474	P	86.3	Confident	81.4	Confident	33 Å²	33	66.9 Å²	66.9	21%	0.214	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	129.9	171.1	33.5	-35.6	0	0	0	109.6	Q372 F374 V405 L463 V465 I472	Q372-P474 CarbonylContact O-C 3.52Å; Q372-P474 WeakPolarHBondContact O-CA 3.34Å; F374-P474 HydrophobicContact CD2-CB 4.35Å; F374-P474 HydrophobicContact CE2-CB 3.9Å; V405-P474 HydrophobicContact CG1-CB 4.37Å; L463-P474 HydrophobicContact CB-CB 4.41Å; L463-P474 HydrophobicContact CB-CG 4.44Å; L463-P474 HydrophobicContact CD1-CB 4.3Å; L463-P474 HydrophobicContact CD2-CB 4.43Å; V465-P474 HydrophobicContact CG2-CG 3.6Å; I472-P474 WeakPolarHBondContact O-CD 3.22Å
475	V	89	Confident	81.1	Confident	63 Å²	63	65.7 Å²	65.7	38%	0.382	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.5	-177.4	-179.6	0	0	0	0	109	V371 Q372 R373 F374 V477	V371-V475 HydrophobicContact CG1-CB 4.37Å; V371-V475 HydrophobicContact CG1-CG2 4.01Å; Q372-V475 PolarHBondContact O-N 2.96Å; R373-V475 WeakPolarHBondContact CA-O 3.48Å; F374-V475 PolarHBondContact N-O 3.37Å; V475-V477 HydrophobicContact CG1-CG2 4.32Å
476	L	87.4	Confident	80.8	Confident	53 Å²	53	63.7 Å²	63.7	28%	0.277	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	125.2	165.3	-73	172.8	0	0	0	107.7	F374 V407 L460 L463 M480	F374-L476 HydrophobicContact CB-CD2 4.22Å; F374-L476 WeakPolarHBondContact O-CA 3.33Å; V407-L476 HydrophobicContact CG2-CD2 4.46Å; L460-L476 HydrophobicContact CB-CD1 4.48Å; L460-L476 HydrophobicContact CB-CD2 3.75Å; L460-L476 HydrophobicContact CD1-CD2 4.21Å; L460-L476 WeakPolarHBondContact O-CD1 3.31Å; L463-L476 HydrophobicContact CD1-CB 4.3Å; L463-L476 HydrophobicContact CD1-CD2 3.79Å; L463-L476 HydrophobicContact CD1-CG 3.53Å; L463-L476 HydrophobicContact CG-CD2 4.15Å; L463-L476 HydrophobicContact CG-CG 4.17Å; L476-M480 HydrophobicContact CB-CB 4.33Å
477	V	84	Confident	80.1	Confident	36 Å²	36	60.2 Å²	60.2	22%	0.218	33%	0.327	C	S	.	.			trans	-114.2	152.2	176.7	-175.5	0	0	0	0	107.8	R373 F374 F375 V475 P479 M480	R373-V477 HydrophobicContact CB-CB 4.47Å; R373-V477 HydrophobicContact CB-CG2 3.68Å; R373-V477 HydrophobicContact CG-CG2 3.69Å; F374-V477 PolarHBondContact O-N 3.48Å; F375-V477 VanDerWaalsContact CB-O 3.24Å; F375-V477 WeakPolarHBondContact CB-O 3.3Å; V475-V477 HydrophobicContact CG1-CG2 4.32Å; V477-P479 CarbonylContact O-C 3.56Å; V477-M480 PolarHBondContact O-N 3.38Å
478	D	72	Confident	79.8	Confident	124 Å²	124	54.2 Å²	54.2	66%	0.663	30%	0.299	S	S	*	.	S	Bend	trans	-62.1	136.2	174.1	-68	-48.8	0	0	0	110.9
479	P	68.5	Low	79.2	Confident	44 Å²	44	53.9 Å²	53.9	29%	0.286	30%	0.295	S	S	.	.			cis	-85.1	118.9	1.7	32.2	-33.3	0	0	0	113	F376 V477	F376-P479 HydrophobicContact CB-CG 4.19Å; F376-P479 PolarHBondContact N-O 2.89Å; F376-P479 WeakPolarHBondContact O-CG 3.29Å; V477-P479 CarbonylContact O-C 3.56Å
480	M	84.1	Confident	78.7	Confident	89 Å²	89	50.8 Å²	50.8	44%	0.438	27%	0.27	S	S	.	.			trans	-86.6	-10.7	174.5	63.1	175.5	170.7	0	0	113.8	F376 L460 L476 V477	F376-M480 VanDerWaalsContact CE2-O 3.29Å; F376-M480 WeakPolarHBondContact CE2-O 3.44Å; L460-M480 PolarHBondContact N-O 2.9Å; L460-M480 VanDerWaalsContact N-O 3.15Å; L476-M480 HydrophobicContact CB-CB 4.33Å; V477-M480 PolarHBondContact O-N 3.38Å
481	V	84.1	Confident	78.7	Confident	40 Å²	40	48.5 Å²	48.5	24%	0.242	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133.1	174.3	-176.4	0	0	0	0	107.6	F376 T457 V458 H459	F376-V481 VanDerWaalsContact CD2-C 3.44Å; T457-V481 HydrophobicContact CG2-CG1 4.07Å; V458-V481 WeakPolarHBondContact O-CA 3.38Å; H459-V481 WeakPolarHBondContact ND1-CG2 3.48Å
482	A	83.7	Confident	78.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	125.4	167.2	0	0	0	0	0	109	F376 G379 Y381 V392 T457 V458 I484	F376-A482 HydrophobicContact CB-CB 4.13Å; F376-A482 HydrophobicContact CD1-CB 3.75Å; F376-A482 HydrophobicContact CD2-CB 3.71Å; F376-A482 VanDerWaalsContact CD2-N 3.27Å; F376-A482 HydrophobicContact CE1-CB 3.98Å; F376-A482 HydrophobicContact CE2-CB 3.9Å; F376-A482 VanDerWaalsContact CE2-N 3.3Å; F376-A482 HydrophobicContact CG-CB 3.61Å; F376-A482 HydrophobicContact CZ-CB 4.05Å; G379-A482 VanDerWaalsContact O-CA 3.3Å; G379-A482 WeakPolarHBondContact O-CA 3.2Å; Y381-A482 HydrophobicContact CD2-CB 4.2Å; Y381-A482 HydrophobicContact CE2-CB 4.07Å; V392-A482 HydrophobicContact CG1-CB 4.15Å; T457-A482 CarbonylContact C-O 3.14Å; T457-A482 WeakPolarHBondContact CA-O 3.4Å; V458-A482 HydrophobicContact CB-CB 4.41Å; V458-A482 PolarHBondContact N-O 3.23Å; V458-A482 PolarHBondContact O-N 3.14Å; A482-I484 HydrophobicContact CB-CD1 4.31Å; A482-I484 WeakPolarHBondContact O-CD1 3.41Å
483	T	80.4	Confident	78.4	Confident	43 Å²	43	39.5 Å²	39.5	26%	0.264	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	129.3	171.5	-56.3	0	0	0	0	109	G379 H380 Y381 H455 T457	G379-T483 PolarHBondContact O-N 3.48Å; H380-T483 CarbonylContact C-O 3.54Å; H380-T483 WeakPolarHBondContact CA-O 3.34Å; Y381-T483 PolarHBondContact N-O 3.08Å; H455-T483 HydrophobicContact CB-CG2 4.35Å; T457-T483 HydrophobicContact CG2-CG2 4.44Å
484	I	85.5	Confident	78.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.2	175.5	-61	65.9	0	0	0	106.2	Y381 V383 F390 V392 H455 F456 V458 A482	Y381-I484 CarbonylContact O-C 3.55Å; Y381-I484 WeakPolarHBondContact O-CA 3.41Å; V383-I484 HydrophobicContact CG2-CG2 3.88Å; F390-I484 HydrophobicContact CE1-CG2 4.34Å; F390-I484 HydrophobicContact CE2-CG1 4.25Å; F390-I484 HydrophobicContact CE2-CG2 4.37Å; F390-I484 HydrophobicContact CZ-CB 4.43Å; F390-I484 HydrophobicContact CZ-CG1 3.87Å; F390-I484 HydrophobicContact CZ-CG2 3.62Å; V392-I484 HydrophobicContact CG2-CG1 4.45Å; H455-I484 CarbonylContact C-O 3.55Å; H455-I484 WeakPolarHBondContact CA-O 3.43Å; H455-I484 VanDerWaalsContact CB-O 3.27Å; H455-I484 WeakPolarHBondContact CB-O 3.13Å; F456-I484 HydrophobicContact CD1-CB 4.17Å; F456-I484 HydrophobicContact CD1-CG2 4.32Å; F456-I484 HydrophobicContact CD2-CB 4.39Å; F456-I484 HydrophobicContact CD2-CD1 4.43Å; F456-I484 HydrophobicContact CE1-CB 3.73Å; F456-I484 HydrophobicContact CE1-CG1 4.42Å; F456-I484 HydrophobicContact CE1-CG2 3.53Å; F456-I484 HydrophobicContact CE2-CB 3.97Å; F456-I484 HydrophobicContact CE2-CD1 4.01Å; F456-I484 HydrophobicContact CE2-CG1 3.86Å; F456-I484 HydrophobicContact CE2-CG2 4.44Å; F456-I484 HydrophobicContact CG-CB 4.48Å; F456-I484 HydrophobicContact CZ-CB 3.61Å; F456-I484 HydrophobicContact CZ-CD1 4.44Å; F456-I484 HydrophobicContact CZ-CG1 3.79Å; F456-I484 HydrophobicContact CZ-CG2 3.6Å; F456-I484 PolarHBondContact N-O 3.36Å; F456-I484 PolarHBondContact O-N 3.28Å; V458-I484 HydrophobicContact CB-CD1 4.29Å; V458-I484 HydrophobicContact CG2-CD1 3.49Å; V458-I484 VanDerWaalsContact CG2-CD1 3.49Å; A482-I484 HydrophobicContact CB-CD1 4.31Å; A482-I484 WeakPolarHBondContact O-CD1 3.41Å
485	M	80.8	Confident	78.5	Confident	60 Å²	60	35.1 Å²	35.1	30%	0.296	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122.8	172.2	-173.1	166.2	68.1	0	0	108.7	Y381 T382 V383 E454 L487	Y381-M485 PolarHBondContact O-N 3.3Å; T382-M485 CarbonylContact C-O 3.52Å; T382-M485 WeakPolarHBondContact CA-O 3.01Å; T382-M485 HydrophobicContact CG2-CB 4.48Å; T382-M485 HydrophobicContact CG2-CE 3.6Å; V383-M485 PolarHBondContact N-O 3.18Å; E454-M485 CarbonylContact O-C 3.57Å; E454-M485 WeakPolarHBondContact O-CA 3.19Å; M485-L487 HydrophobicContact CE-CD2 4.08Å; M485-L487 HydrophobicContact CG-CD2 4.14Å; M485-L487 HydrophobicContact SD-CD2 4.43Å
486	V	78.4	Confident	78.6	Confident	11 Å²	11	33.8 Å²	33.8	7%	0.067	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.7	174.9	-174.1	0	0	0	0	107.2	V383 E385 I444 E454 F456	V383-V486 HydrophobicContact CG2-CG2 4.29Å; V383-V486 CarbonylContact O-C 3.5Å; V383-V486 WeakPolarHBondContact O-CA 3.46Å; E385-V486 HydrophobicContact CB-CG1 4.31Å; E385-V486 HydrophobicContact CG-CG1 4.37Å; I444-V486 HydrophobicContact CD1-CG2 4.04Å; I444-V486 HydrophobicContact CG2-CG1 4.04Å; E454-V486 PolarHBondContact N-O 3.15Å; E454-V486 PolarHBondContact O-N 3.32Å; F456-V486 HydrophobicContact CD1-CG2 4.28Å; F456-V486 HydrophobicContact CE1-CG2 3.99Å
487	L	71.7	Confident	78.8	Confident	26 Å²	26	31.3 Å²	31.3	14%	0.136	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	125.2	178.8	-63.1	-177.5	0	0	0	109.7	T382 V383 M384 E385 D453 M485	T382-L487 HydrophobicContact CG2-CD1 3.37Å; T382-L487 HydrophobicContact CG2-CD2 4.2Å; T382-L487 HydrophobicContact CG2-CG 3.6Å; V383-L487 PolarHBondContact O-N 3.27Å; M384-L487 HydrophobicContact SD-CB 4.12Å; M384-L487 HydrophobicContact SD-CD1 4.39Å; E385-L487 PolarHBondContact N-O 3.02Å; D453-L487 HydrophobicContact CB-CD2 4.14Å; M485-L487 HydrophobicContact CE-CD2 4.08Å; M485-L487 HydrophobicContact CG-CD2 4.14Å; M485-L487 HydrophobicContact SD-CD2 4.43Å
488	D	72.9	Confident	78.9	Confident	7 Å²	7	33 Å²	33	4%	0.037	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-65.8	136.4	169.8	172.1	102.1	0	0	0	110	F450 E451 D453 D490 G520	F450-D488 WeakPolarHBondContact CA-OD1 3.32Å; F450-D488 WeakPolarHBondContact CD2-OD2 3.47Å; E451-D488 PolarHBondContact N-OD1 2.88Å; D453-D488 PolarHBondContact OD1-N 2.65Å; D488-D490 PolarHBondContact OD2-N 3.23Å; D488-G520 PolarHBondContact O-N 3.33Å
489	D	66.8	Low	79.7	Confident	33 Å²	33	29.8 Å²	29.8	18%	0.176	16%	0.164	C	C	.	.			trans	-108.5	8.2	-176.6	81.8	-6.9	0	0	0	114.9	M384 N386	M384-D489 HydrophobicContact CE-CB 3.32Å; N386-D489 PolarHBondContact ND2-OD2 2.87Å
490	D	65.4	Low	80.6	Confident	38 Å²	38	31.5 Å²	31.5	20%	0.203	17%	0.174	C	C	.	.	S	Bend	trans	-94.6	-15.2	-165.6	-100.2	-26.6	0	0	0	116	D448 I449 F450 D488	D448-D490 WeakPolarHBondContact CA-OD2 3.33Å; I449-D490 PolarHBondContact N-OD2 2.97Å; I449-D490 VanDerWaalsContact N-OD2 3.15Å; F450-D490 HydrophobicContact CB-CB 4.36Å; D488-D490 PolarHBondContact OD2-N 3.23Å
491	H	73.6	Confident	80.7	Confident	25 Å²	25	31.7 Å²	31.7	12%	0.116	18%	0.176	C	C	.	.	S	Bend	trans	-98.9	162.9	176.2	-176.8	79.3	0	0	0	114.1	F450 G493 S519 G520 C521 R522 T646	F450-H491 HydrophobicContact CD2-CB 3.6Å; F450-H491 HydrophobicContact CE2-CB 3.5Å; F450-H491 HydrophobicContact CZ-CB 4.42Å; H491-G493 VanDerWaalsContact C-N 3.26Å; H491-G493 PolarHBondContact CD2-N 3.23Å; H491-G493 PolarHBondContact O-N 3.37Å; H491-S519 WeakPolarHBondContact CB-O 3.25Å; H491-S519 PolarHBondContact CD2-O 2.6Å; H491-S519 VanDerWaalsContact CG-O 3.31Å; H491-G520 CarbonylContact O-C 3.55Å; H491-G520 WeakPolarHBondContact O-CA 3.38Å; H491-C521 PolarHBondContact O-N 3.41Å; H491-R522 WeakPolarHBondContact O-CB 3.31Å; H491-R522 PolarHBondContact O-N 2.95Å; H491-T646 PolarHBondContact CE1-O 2.78Å; H491-T646 PolarHBondContact ND1-O 2.71Å
492	S	69.6	Low	81	Confident	13 Å²	13	31.9 Å²	31.9	9%	0.091	18%	0.176	C	C	.	.			trans	-80.8	0.3	177.2	-79.7	0	0	0	0	114.8	R517 R522 G647	S492-R517 VanDerWaalsContact O-CZ 3.3Å; S492-R517 PolarHBondContact O-NE 3.33Å; S492-R517 PolarHBondContact O-NH2 2.82Å; S492-R522 VanDerWaalsContact CA-O 3.28Å; S492-R522 WeakPolarHBondContact CA-O 3.37Å; S492-R522 WeakPolarHBondContact CB-O 3.27Å; S492-R522 PolarHBondContact OG-O 3.25Å; S492-G647 WeakPolarHBondContact CB-O 3.37Å; S492-G647 PolarHBondContact OG-O 2.91Å; S492-G647 VanDerWaalsContact OG-O 3.09Å
493	G	79.4	Confident	81.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.202	C	C	.	.			trans	93.5	140.2	172.8	0	0	0	0	0	116.5	H491 F495 S519 G520 P649 R650	H491-G493 VanDerWaalsContact C-N 3.26Å; H491-G493 PolarHBondContact CD2-N 3.23Å; H491-G493 PolarHBondContact O-N 3.37Å; G493-F495 WeakPolarHBondContact O-CE2 3.03Å; G493-S519 WeakPolarHBondContact CA-O 3.16Å; G493-S519 PolarHBondContact N-O 2.97Å; G493-G520 WeakPolarHBondContact CA-O 3.26Å; G493-G520 PolarHBondContact N-O 2.89Å; G493-P649 VanDerWaalsContact O-CA 3.31Å; G493-P649 WeakPolarHBondContact O-CA 3.42Å; G493-R650 PolarHBondContact O-N 3.27Å
494	V	83.1	Confident	81.4	Confident	32 Å²	32	34.8 Å²	34.8	19%	0.194	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.9	171	178.3	0	0	0	0	108.8	R517 V518 R650	V494-R517 CarbonylContact O-C 3.5Å; V494-R517 WeakPolarHBondContact O-CA 3.49Å; V494-V518 HydrophobicContact CB-CG2 3.93Å; V494-V518 WeakPolarHBondContact CB-O 3.5Å; V494-V518 HydrophobicContact CG1-CG2 4.27Å; V494-V518 PolarHBondContact N-O 3.26Å; V494-V518 WeakPolarHBondContact O-CG2 3.11Å; V494-V518 PolarHBondContact O-N 3.36Å; V494-R650 CarbonylContact C-O 3.49Å; V494-R650 WeakPolarHBondContact CA-O 3.28Å
495	F	89.2	Confident	81.3	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.4	-172.3	-64.8	-92.5	0	0	0	111.8	G493 Q516 R517 V525 L527 F552 P584 P649 R650 G652	G493-F495 WeakPolarHBondContact O-CE2 3.03Å; F495-Q516 WeakPolarHBondContact CA-O 3.02Å; F495-R517 HydrophobicContact CD1-CB 4.01Å; F495-R517 HydrophobicContact CD1-CG 4.21Å; F495-R517 HydrophobicContact CE1-CB 3.7Å; F495-R517 HydrophobicContact CE1-CG 3.61Å; F495-R517 HydrophobicContact CE2-CG 4.16Å; F495-R517 HydrophobicContact CZ-CB 4.22Å; F495-R517 HydrophobicContact CZ-CG 3.59Å; F495-V525 HydrophobicContact CD2-CG1 4.49Å; F495-V525 HydrophobicContact CE1-CB 4.42Å; F495-V525 HydrophobicContact CE1-CG1 4.32Å; F495-V525 HydrophobicContact CE2-CB 4.14Å; F495-V525 HydrophobicContact CE2-CG1 3.66Å; F495-V525 HydrophobicContact CE2-CG2 4.16Å; F495-V525 HydrophobicContact CZ-CB 3.6Å; F495-V525 HydrophobicContact CZ-CG1 3.54Å; F495-V525 HydrophobicContact CZ-CG2 3.86Å; F495-L527 HydrophobicContact CB-CD1 3.95Å; F495-L527 HydrophobicContact CB-CD2 3.91Å; F495-L527 HydrophobicContact CD1-CD2 3.95Å; F495-L527 HydrophobicContact CG-CD1 4.25Å; F495-L527 HydrophobicContact CG-CD2 4.19Å; F495-F552 HydrophobicContact CD1-CD2 4Å; F495-F552 HydrophobicContact CD1-CE1 4.48Å; F495-F552 AromaticContact CD1-CE2 3.71Å; F495-F552 HydrophobicContact CD1-CE2 3.71Å; F495-F552 AromaticContact CD1-CZ 3.98Å; F495-F552 HydrophobicContact CD1-CZ 3.98Å; F495-F552 HydrophobicContact CE1-CB 4.19Å; F495-F552 AromaticContact CE1-CD1 4Å; F495-F552 HydrophobicContact CE1-CD1 4Å; F495-F552 AromaticContact CE1-CD2 3.44Å; F495-F552 HydrophobicContact CE1-CD2 3.44Å; F495-F552 VanDerWaalsContact CE1-CD2 3.44Å; F495-F552 HydrophobicContact CE1-CE1 4.16Å; F495-F552 AromaticContact CE1-CE2 3.63Å; F495-F552 HydrophobicContact CE1-CE2 3.63Å; F495-F552 AromaticContact CE1-CG 3.63Å; F495-F552 HydrophobicContact CE1-CG 3.63Å; F495-F552 HydrophobicContact CE1-CZ 4Å; F495-F552 HydrophobicContact CZ-CD2 4.46Å; F495-F552 HydrophobicContact CZ-CG 4.47Å; F495-P584 HydrophobicContact CD2-CB 3.85Å; F495-P584 HydrophobicContact CD2-CG 4.05Å; F495-P584 HydrophobicContact CE2-CB 4.15Å; F495-P649 HydrophobicContact CD2-CB 4.24Å; F495-P649 HydrophobicContact CE2-CB 3.64Å; F495-R650 PolarHBondContact N-O 3.4Å; F495-G652 PolarHBondContact O-N 3.03Å
496	Q	89.3	Confident	81.3	Confident	36 Å²	36	34.5 Å²	34.5	17%	0.168	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	164.5	178	65.4	-175.8	18	0	0	112.1	V515 Q516 Q654	Q496-V515 CarbonylContact O-C 3.52Å; Q496-V515 WeakPolarHBondContact O-CA 3.48Å; Q496-V515 WeakPolarHBondContact O-CG1 3.43Å; Q496-Q516 PolarHBondContact N-O 3.08Å; Q496-Q516 PolarHBondContact O-N 3.27Å; Q496-Q654 HydrophobicContact CB-CB 4.26Å
497	F	92.5	Very high	81.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	147.6	168.6	-67.4	-65.6	0	0	0	111.3	V499 I513 V515 I561 V579 L581 Q654 T655 I657	F497-V499 VanDerWaalsContact C-N 3.32Å; F497-V499 PolarHBondContact O-N 3.47Å; F497-I513 HydrophobicContact CD1-CG2 3.52Å; F497-I513 HydrophobicContact CE1-CG2 3.46Å; F497-I513 VanDerWaalsContact CE1-CG2 3.46Å; F497-V515 HydrophobicContact CD1-CG2 3.89Å; F497-V515 HydrophobicContact CE1-CG2 3.74Å; F497-I561 HydrophobicContact CE1-CD1 4.24Å; F497-V579 HydrophobicContact CE1-CG1 4.41Å; F497-V579 WeakPolarHBondContact CE2-O 3.24Å; F497-V579 HydrophobicContact CZ-CB 4.13Å; F497-V579 HydrophobicContact CZ-CG1 3.88Å; F497-L581 HydrophobicContact CD2-CD1 4.16Å; F497-L581 HydrophobicContact CD2-CG 4.24Å; F497-L581 HydrophobicContact CE1-CD1 4.41Å; F497-L581 HydrophobicContact CE1-CD2 3.9Å; F497-L581 HydrophobicContact CE1-CG 4.13Å; F497-L581 HydrophobicContact CE2-CD1 4Å; F497-L581 HydrophobicContact CE2-CD2 4.17Å; F497-L581 HydrophobicContact CE2-CG 3.57Å; F497-L581 HydrophobicContact CG-CD1 4.46Å; F497-L581 HydrophobicContact CZ-CD1 4.12Å; F497-L581 HydrophobicContact CZ-CD2 3.55Å; F497-L581 HydrophobicContact CZ-CG 3.5Å; F497-L581 VanDerWaalsContact CZ-CG 3.5Å; F497-Q654 WeakPolarHBondContact CD2-O 3.23Å; F497-Q654 PolarHBondContact N-O 3.09Å; F497-Q654 PolarHBondContact O-OE1 3.2Å; F497-Q654 VanDerWaalsContact O-OE1 3.13Å; F497-T655 WeakPolarHBondContact CE2-O 3.38Å; F497-I657 HydrophobicContact CB-CB 4.2Å; F497-I657 HydrophobicContact CB-CD1 4.44Å; F497-I657 HydrophobicContact CD1-CB 4.22Å; F497-I657 HydrophobicContact CD1-CG2 3.88Å; F497-I657 HydrophobicContact CD2-CB 3.69Å; F497-I657 HydrophobicContact CD2-CG2 3.82Å; F497-I657 HydrophobicContact CE1-CG2 3.77Å; F497-I657 HydrophobicContact CE2-CB 4.04Å; F497-I657 HydrophobicContact CE2-CG2 3.68Å; F497-I657 HydrophobicContact CG-CB 3.78Å; F497-I657 HydrophobicContact CG-CG2 3.91Å; F497-I657 HydrophobicContact CZ-CB 4.47Å; F497-I657 HydrophobicContact CZ-CG2 3.67Å
498	D	86	Confident	81.6	Confident	72 Å²	72	37.6 Å²	37.6	39%	0.385	22%	0.218	S	C	.	.	S	Bend	trans	-64.2	-35.4	176.4	-179.1	33.9	0	0	0	112.4	K514 Q516	D498-K514 HydrophobicContact CB-CB 4.15Å; D498-K514 PolarHBondContact N-O 3.12Å; D498-Q516 HydrophobicContact CB-CG 4.23Å; D498-Q516 PolarHBondContact OD1-NE2 3.16Å
499	V	88	Confident	82.1	Confident	57 Å²	57	43.1 Å²	43.1	35%	0.345	24%	0.243	S	C	.	.			trans	-136.8	154.5	-178.2	-61.1	0	0	0	0	111.8	F497 L502 I657	F497-V499 VanDerWaalsContact C-N 3.32Å; F497-V499 PolarHBondContact O-N 3.47Å; V499-L502 HydrophobicContact CG2-CB 4.27Å; V499-I657 HydrophobicContact CG2-CD1 3.87Å; V499-I657 WeakPolarHBondContact O-CD1 3.22Å; V499-I657 WeakPolarHBondContact O-CG1 3.41Å
500	V	87.2	Confident	83.2	Confident	80 Å²	80	46.4 Å²	46.4	49%	0.485	25%	0.254	S	S	.	.	S	Bend	trans	-77.8	-36.4	176.6	-67.7	0	0	0	0	113.2	Q654 I657 K658	V500-Q654 HydrophobicContact CG1-CG 4Å; V500-Q654 VanDerWaalsContact CG1-NE2 3.3Å; V500-I657 WeakPolarHBondContact O-CA 3.38Å; V500-K658 PolarHBondContact O-N 2.71Å
501	D	87	Confident	84.3	Confident	93 Å²	93	44.6 Å²	44.6	50%	0.497	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.3	-176.4	-72.4	-20.2	0	0	0	108.2	K658	D501-K658 CarbonylContact C-O 3.59Å; D501-K658 VanDerWaalsContact CA-O 3.32Å; D501-K658 WeakPolarHBondContact CA-O 3.27Å; D501-K658 VanDerWaalsContact OD1-CB 3.24Å; D501-K658 WeakPolarHBondContact OD1-CB 3.13Å
502	L	90.6	Very high	85.2	Confident	43 Å²	43	48.2 Å²	48.2	23%	0.225	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.1	173.5	-178.6	65.9	0	0	0	108.7	V499 V504 I513 I657 K658 I659 T660	V499-L502 HydrophobicContact CG2-CB 4.27Å; L502-V504 HydrophobicContact CD2-CG1 3.89Å; L502-V504 HydrophobicContact CG-CG1 3.86Å; L502-I513 HydrophobicContact CD2-CG1 4.06Å; L502-I657 HydrophobicContact CB-CD1 3.91Å; L502-I657 HydrophobicContact CB-CG1 4.48Å; L502-K658 PolarHBondContact N-O 3.27Å; L502-I659 HydrophobicContact CB-CG1 4.37Å; L502-I659 CarbonylContact O-C 3.58Å; L502-I659 VanDerWaalsContact O-CA 3.31Å; L502-I659 WeakPolarHBondContact O-CA 3.28Å; L502-T660 PolarHBondContact O-N 2.7Å
503	T	85.8	Confident	86.3	Confident	89 Å²	89	47.6 Å²	47.6	55%	0.546	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.6	173.9	-59.9	0	0	0	0	108.9	T660 T662	T503-T660 WeakPolarHBondContact CA-O 3.33Å; T503-T662 HydrophobicContact CG2-CG2 3.35Å; T503-T662 WeakPolarHBondContact CG2-OG1 3.42Å
504	V	87.5	Confident	86.8	Confident	16 Å²	16	52 Å²	52	10%	0.097	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	148.7	179.1	-61.6	0	0	0	0	110.3	L502 A511 I659 T660 I661 T662	L502-V504 HydrophobicContact CD2-CG1 3.89Å; L502-V504 HydrophobicContact CG-CG1 3.86Å; V504-A511 HydrophobicContact CG1-CB 4.14Å; V504-A511 HydrophobicContact CG2-CB 4.49Å; V504-I659 HydrophobicContact CG1-CG2 4.32Å; V504-I659 HydrophobicContact CG2-CG2 3.72Å; V504-T660 PolarHBondContact N-O 3.28Å; V504-I661 HydrophobicContact CG2-CG1 4.26Å; V504-T662 PolarHBondContact O-N 3.32Å; V504-T662 PolarHBondContact O-OG1 3.11Å
505	S	82.2	Confident	87.3	Confident	24 Å²	24	50.5 Å²	50.5	17%	0.168	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	140.4	169.7	176.8	0	0	0	0	109.1	S507 C508 T662 S664	S505-S507 PolarHBondContact O-N 3.41Å; S505-S507 VanDerWaalsContact O-N 3.17Å; S505-S507 PolarHBondContact OG-N 3.39Å; S505-S507 VanDerWaalsContact OG-N 3.13Å; S505-S507 PolarHBondContact OG-OG 3.11Å; S505-C508 WeakPolarHBondContact O-CB 3.15Å; S505-C508 PolarHBondContact O-N 3.5Å; S505-C508 PolarHBondContact O-SG 2.86Å; S505-T662 CarbonylContact C-O 3.59Å; S505-T662 WeakPolarHBondContact CA-O 3.44Å; S505-S664 VanDerWaalsContact OG-CA 3.26Å; S505-S664 WeakPolarHBondContact OG-CA 3.25Å
506	E	80.7	Confident	87.2	Confident	29 Å²	29	53.4 Å²	53.4	14%	0.136	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-31.1	168	-174.5	-176.7	178.7	0	0	112.4	C508 D567 D568 N569 I661 T662	E506-C508 PolarHBondContact O-N 3.31Å; E506-D567 HydrophobicContact CG-CB 4.13Å; E506-D567 WeakPolarHBondContact OE1-CA 3.48Å; E506-D568 PolarHBondContact OE1-N 2.9Å; E506-D568 VanDerWaalsContact OE1-OD1 3.07Å; E506-N569 PolarHBondContact OE1-N 3.23Å; E506-I661 HydrophobicContact CB-CG2 3.92Å; E506-I661 HydrophobicContact CG-CG2 4.42Å; E506-T662 PolarHBondContact N-O 3.48Å
507	S	75.8	Confident	87.1	Confident	70 Å²	70	52 Å²	52	49%	0.49	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-4	176.6	71.6	0	0	0	0	114.3	S505 E509	S505-S507 PolarHBondContact O-N 3.41Å; S505-S507 VanDerWaalsContact O-N 3.17Å; S505-S507 PolarHBondContact OG-N 3.39Å; S505-S507 VanDerWaalsContact OG-N 3.13Å; S505-S507 PolarHBondContact OG-OG 3.11Å; S507-E509 PolarHBondContact O-N 2.88Å
508	C	80.5	Confident	86.6	Confident	32 Å²	32	53.4 Å²	53.4	22%	0.216	28%	0.283	C	S	.	.			trans	-76.4	119.3	172	80.4	0	0	0	0	108	S505 E506 Y510	S505-C508 WeakPolarHBondContact O-CB 3.15Å; S505-C508 PolarHBondContact O-N 3.5Å; S505-C508 PolarHBondContact O-SG 2.86Å; E506-C508 PolarHBondContact O-N 3.31Å; C508-Y510 PolarHBondContact O-N 3.23Å
509	E	83.1	Confident	86.2	Confident	123 Å²	123	51.6 Å²	51.6	58%	0.575	28%	0.276	S	S	*	.	S	Bend	trans	-62.4	-30.9	178.2	-168.7	179.9	-171.5	0	0	111.3	S507 R564 V565	S507-E509 PolarHBondContact O-N 2.88Å; E509-R564 WeakPolarHBondContact O-CA 3.43Å; E509-R564 WeakPolarHBondContact O-CG 3.25Å; E509-V565 PolarHBondContact O-N 3.33Å; E509-V565 VanDerWaalsContact O-N 3.15Å
510	Y	89.7	Confident	85.3	Confident	102 Å²	102	49.1 Å²	49.1	40%	0.4	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	129.2	178.2	-63.3	-83.5	0	0	0	111	C508 E512 R562 I563 R564	C508-Y510 PolarHBondContact O-N 3.23Å; Y510-E512 PolarHBondContact O-N 3.06Å; Y510-R562 HydrophobicContact CD1-CB 4.21Å; Y510-I563 CarbonylContact C-O 3.56Å; Y510-I563 WeakPolarHBondContact CA-O 3.48Å; Y510-R564 HydrophobicContact CD1-CB 4.07Å; Y510-R564 HydrophobicContact CD1-CG 4.34Å; Y510-R564 HydrophobicContact CE1-CB 3.87Å; Y510-R564 HydrophobicContact CE1-CG 3.97Å
511	A	90.2	Very high	84.9	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.008	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	109.9	161.7	0	0	0	0	0	108.5	V504 I513 I563 V565	V504-A511 HydrophobicContact CG1-CB 4.14Å; V504-A511 HydrophobicContact CG2-CB 4.49Å; A511-I513 HydrophobicContact CB-CD1 4.34Å; A511-I513 PolarHBondContact O-N 2.89Å; A511-I563 PolarHBondContact N-O 2.84Å; A511-I563 PolarHBondContact O-N 3Å; A511-I563 VanDerWaalsContact O-N 3.09Å; A511-V565 HydrophobicContact CB-CG2 3.79Å
512	E	91	Very high	84.2	Confident	100 Å²	100	48.1 Å²	48.1	47%	0.467	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	105.3	174.2	-62.4	-158.8	139.8	0	0	109.8	Y510 T560 R562	Y510-E512 PolarHBondContact O-N 3.06Å; E512-T560 HydrophobicContact CB-CG2 3.83Å; E512-T560 HydrophobicContact CG-CG2 4.32Å; E512-R562 HydrophobicContact CG-CG 4.32Å; E512-R562 IonicContact OE1-CZ 3.98Å; E512-R562 IonicContact OE1-NE 3.44Å; E512-R562 PolarHBondContact OE1-NE 3.38Å; E512-R562 IonicContact OE1-NH2 3.07Å; E512-R562 PolarHBondContact OE1-NH2 3.19Å
513	I	92.5	Very high	83.6	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	113.6	-179.7	-59.1	124.8	0	0	0	108.6	F497 L502 A511 T560 I561 I563 V579 I657 I659	F497-I513 HydrophobicContact CD1-CG2 3.52Å; F497-I513 HydrophobicContact CE1-CG2 3.46Å; F497-I513 VanDerWaalsContact CE1-CG2 3.46Å; L502-I513 HydrophobicContact CD2-CG1 4.06Å; A511-I513 HydrophobicContact CB-CD1 4.34Å; A511-I513 PolarHBondContact O-N 2.89Å; I513-T560 WeakPolarHBondContact O-CA 3.39Å; I513-I561 HydrophobicContact CB-CB 4.3Å; I513-I561 HydrophobicContact CD1-CG2 4.42Å; I513-I561 PolarHBondContact N-O 3.41Å; I513-I561 PolarHBondContact O-N 3.34Å; I513-I563 HydrophobicContact CD1-CB 4.36Å; I513-I563 HydrophobicContact CD1-CD1 3.56Å; I513-I563 HydrophobicContact CD1-CG1 3.95Å; I513-V579 HydrophobicContact CD1-CG2 4.11Å; I513-I657 HydrophobicContact CG2-CD1 3.96Å; I513-I657 HydrophobicContact CG2-CG2 4.01Å; I513-I659 HydrophobicContact CD1-CD1 3.54Å; I513-I659 HydrophobicContact CG1-CD1 3.74Å; I513-I659 HydrophobicContact CG1-CG1 4.3Å
514	K	91.8	Very high	83.6	Confident	93 Å²	93	43.6 Å²	43.6	40%	0.404	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	129.4	176.7	-67.4	-168	169.7	-147.4	0	111.3	D498 E558	D498-K514 HydrophobicContact CB-CB 4.15Å; D498-K514 PolarHBondContact N-O 3.12Å; K514-E558 IonicContact NZ-OE2 3.37Å; K514-E558 PolarHBondContact NZ-OE2 3.2Å
515	V	92.2	Very high	83.5	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.9	169.7	-176.5	0	0	0	0	107.2	Q496 F497 L527 F552 G559 I561 L581	Q496-V515 CarbonylContact O-C 3.52Å; Q496-V515 WeakPolarHBondContact O-CA 3.48Å; Q496-V515 WeakPolarHBondContact O-CG1 3.43Å; F497-V515 HydrophobicContact CD1-CG2 3.89Å; F497-V515 HydrophobicContact CE1-CG2 3.74Å; V515-L527 HydrophobicContact CG1-CD2 3.61Å; V515-F552 HydrophobicContact CB-CZ 4.14Å; V515-F552 HydrophobicContact CG1-CE2 4.36Å; V515-F552 HydrophobicContact CG1-CZ 3.98Å; V515-G559 PolarHBondContact N-O 3.4Å; V515-G559 PolarHBondContact O-N 3.03Å; V515-I561 HydrophobicContact CG2-CD1 3.65Å; V515-I561 HydrophobicContact CG2-CG1 4.11Å; V515-L581 HydrophobicContact CG1-CD1 4.08Å; V515-L581 HydrophobicContact CG1-CD2 4.48Å; V515-L581 HydrophobicContact CG2-CD2 4.11Å
516	Q	88.3	Confident	83.9	Confident	61 Å²	61	44.5 Å²	44.5	29%	0.285	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	141.7	176.1	-72.1	176.4	-16.9	0	0	110.3	F495 Q496 D498 V518	F495-Q516 WeakPolarHBondContact CA-O 3.02Å; Q496-Q516 PolarHBondContact N-O 3.08Å; Q496-Q516 PolarHBondContact O-N 3.27Å; D498-Q516 HydrophobicContact CB-CG 4.23Å; D498-Q516 PolarHBondContact OD1-NE2 3.16Å; Q516-V518 HydrophobicContact CB-CG1 4.07Å
517	R	87.2	Confident	84.4	Confident	6 Å²	6	43.1 Å²	43.1	2%	0.023	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	105.3	164.6	-178.8	-170.1	-166.3	173.7	0.9	106.3	S492 V494 F495 C521 R522 G523 F552 Q553 Q556 T557	S492-R517 VanDerWaalsContact O-CZ 3.3Å; S492-R517 PolarHBondContact O-NE 3.33Å; S492-R517 PolarHBondContact O-NH2 2.82Å; V494-R517 CarbonylContact O-C 3.5Å; V494-R517 WeakPolarHBondContact O-CA 3.49Å; F495-R517 HydrophobicContact CD1-CB 4.01Å; F495-R517 HydrophobicContact CD1-CG 4.21Å; F495-R517 HydrophobicContact CE1-CB 3.7Å; F495-R517 HydrophobicContact CE1-CG 3.61Å; F495-R517 HydrophobicContact CE2-CG 4.16Å; F495-R517 HydrophobicContact CZ-CB 4.22Å; F495-R517 HydrophobicContact CZ-CG 3.59Å; R517-C521 VanDerWaalsContact CZ-O 3.29Å; R517-C521 PolarHBondContact NH1-O 3.18Å; R517-C521 VanDerWaalsContact NH1-O 3.12Å; R517-C521 PolarHBondContact NH2-O 3.39Å; R517-R522 VanDerWaalsContact NH2-C 3.29Å; R517-R522 PolarHBondContact NH2-O 2.87Å; R517-G523 PolarHBondContact NH1-O 3.16Å; R517-G523 VanDerWaalsContact NH1-O 3.16Å; R517-G523 PolarHBondContact NH2-O 2.76Å; R517-F552 HydrophobicContact CB-CD1 4.2Å; R517-F552 HydrophobicContact CB-CE1 4.01Å; R517-Q553 PolarHBondContact NH1-O 3.45Å; R517-Q553 VanDerWaalsContact NH1-O 3.12Å; R517-Q556 WeakPolarHBondContact CD-O 3.29Å; R517-Q556 PolarHBondContact NH1-O 3.23Å; R517-T557 WeakPolarHBondContact CB-O 3.33Å; R517-T557 PolarHBondContact N-O 3.49Å
518	V	81.2	Confident	85.2	Confident	31 Å²	31	41.4 Å²	41.4	19%	0.188	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	162.8	-177.6	-61.8	0	0	0	0	110.8	V494 Q516	V494-V518 HydrophobicContact CB-CG2 3.93Å; V494-V518 WeakPolarHBondContact CB-O 3.5Å; V494-V518 HydrophobicContact CG1-CG2 4.27Å; V494-V518 PolarHBondContact N-O 3.26Å; V494-V518 WeakPolarHBondContact O-CG2 3.11Å; V494-V518 PolarHBondContact O-N 3.36Å; Q516-V518 HydrophobicContact CB-CG1 4.07Å
519	S	76.9	Confident	85.8	Confident	33 Å²	33	41 Å²	41	23%	0.231	19%	0.193	C	C	.	.	S	Bend	trans	54.4	66.2	-175.4	-51.4	0	0	0	0	110.6	H491 G493	H491-S519 WeakPolarHBondContact CB-O 3.25Å; H491-S519 PolarHBondContact CD2-O 2.6Å; H491-S519 VanDerWaalsContact CG-O 3.31Å; G493-S519 WeakPolarHBondContact CA-O 3.16Å; G493-S519 PolarHBondContact N-O 2.97Å
520	G	70.7	Confident	86.3	Confident	5 Å²	5	38.6 Å²	38.6	5%	0.052	18%	0.182	C	C	.	.			trans	93.6	148.9	175.2	0	0	0	0	0	117.7	D488 H491 G493	D488-G520 PolarHBondContact O-N 3.33Å; H491-G520 CarbonylContact O-C 3.55Å; H491-G520 WeakPolarHBondContact O-CA 3.38Å; G493-G520 WeakPolarHBondContact CA-O 3.26Å; G493-G520 PolarHBondContact N-O 2.89Å
521	C	77.2	Confident	86.5	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.007	17%	0.167	C	C	.	.			trans	-129	16.4	-172.7	57.9	0	0	0	0	114.7	M384 H491 R517 D555 T557	M384-C521 WeakPolarHBondContact CE-SG 3.26Å; H491-C521 PolarHBondContact O-N 3.41Å; R517-C521 VanDerWaalsContact CZ-O 3.29Å; R517-C521 PolarHBondContact NH1-O 3.18Å; R517-C521 VanDerWaalsContact NH1-O 3.12Å; R517-C521 PolarHBondContact NH2-O 3.39Å; C521-D555 PolarHBondContact O-N 3.37Å; C521-T557 HydrophobicContact CB-CG2 4.02Å
522	R	74	Confident	86.6	Confident	151 Å²	151	36.8 Å²	36.8	57%	0.57	18%	0.181	S	C	*	.			trans	-78.7	125.6	-172.3	-168.2	174.4	-178.1	149.1	3.2	113.7	H491 S492 R517	H491-R522 WeakPolarHBondContact O-CB 3.31Å; H491-R522 PolarHBondContact O-N 2.95Å; S492-R522 VanDerWaalsContact CA-O 3.28Å; S492-R522 WeakPolarHBondContact CA-O 3.37Å; S492-R522 WeakPolarHBondContact CB-O 3.27Å; S492-R522 PolarHBondContact OG-O 3.25Å; R517-R522 VanDerWaalsContact NH2-C 3.29Å; R517-R522 PolarHBondContact NH2-O 2.87Å
523	G	77.4	Confident	86.6	Confident	19 Å²	19	36.2 Å²	36.2	20%	0.196	18%	0.178	C	C	.	.	S	Bend	trans	90.6	165.8	176.3	0	0	0	0	0	114.3	R517 N554	R517-G523 PolarHBondContact NH1-O 3.16Å; R517-G523 VanDerWaalsContact NH1-O 3.16Å; R517-G523 PolarHBondContact NH2-O 2.76Å; G523-N554 WeakPolarHBondContact CA-OD1 3.2Å; G523-N554 PolarHBondContact N-OD1 2.87Å
524	V	84.7	Confident	86.4	Confident	18 Å²	18	37.3 Å²	37.3	11%	0.109	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	125.9	177.7	179.2	0	0	0	0	109.2	E551 F552 I587	V524-E551 HydrophobicContact CG1-CG 3.96Å; V524-F552 CarbonylContact C-O 3.56Å; V524-F552 VanDerWaalsContact CA-O 3.27Å; V524-F552 WeakPolarHBondContact CA-O 3.47Å; V524-F552 WeakPolarHBondContact CG1-O 3.49Å; V524-I587 HydrophobicContact CB-CB 4.41Å; V524-I587 HydrophobicContact CG1-CB 4.32Å; V524-I587 HydrophobicContact CG1-CD1 4.33Å; V524-I587 PolarHBondContact O-N 3.47Å
525	V	86.8	Confident	86.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130.8	-175.8	-178.7	0	0	0	0	110.6	F495 E551 F552 P584 V585 L586 P649	F495-V525 HydrophobicContact CD2-CG1 4.49Å; F495-V525 HydrophobicContact CE1-CB 4.42Å; F495-V525 HydrophobicContact CE1-CG1 4.32Å; F495-V525 HydrophobicContact CE2-CB 4.14Å; F495-V525 HydrophobicContact CE2-CG1 3.66Å; F495-V525 HydrophobicContact CE2-CG2 4.16Å; F495-V525 HydrophobicContact CZ-CB 3.6Å; F495-V525 HydrophobicContact CZ-CG1 3.54Å; F495-V525 HydrophobicContact CZ-CG2 3.86Å; V525-E551 WeakPolarHBondContact O-CA 3.45Å; V525-F552 PolarHBondContact N-O 3.13Å; V525-F552 PolarHBondContact O-N 3.43Å; V525-P584 HydrophobicContact CG1-CB 3.63Å; V525-V585 WeakPolarHBondContact CA-O 3.36Å; V525-L586 HydrophobicContact CG2-CD1 3.86Å; V525-P649 HydrophobicContact CG1-CB 4.07Å; V525-P649 HydrophobicContact CG1-CG 4.17Å; V525-P649 HydrophobicContact CG2-CB 4.04Å; V525-P649 HydrophobicContact CG2-CG 4.14Å
526	R	89.6	Confident	86	Confident	59 Å²	59	35.8 Å²	35.8	22%	0.223	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	126.4	166.9	-85.8	-179.1	-164.2	166.7	2.6	110.6	Y549 I550 E551 V585 I587	R526-Y549 HydrophobicContact CB-CD2 4.39Å; R526-Y549 HydrophobicContact CG-CD2 3.73Å; R526-Y549 HydrophobicContact CG-CE2 4.06Å; R526-I550 WeakPolarHBondContact CA-O 3.47Å; R526-E551 HydrophobicContact CG-CB 4.14Å; R526-E551 HydrophobicContact CG-CG 4.05Å; R526-E551 IonicContact CZ-OE2 3.32Å; R526-E551 IonicContact NE-OE2 2.81Å; R526-E551 PolarHBondContact NE-OE2 3.22Å; R526-E551 IonicContact NH2-OE2 2.93Å; R526-E551 PolarHBondContact NH2-OE2 3.35Å; R526-V585 PolarHBondContact N-O 3.31Å; R526-V585 PolarHBondContact O-N 3.39Å; R526-I587 HydrophobicContact CB-CD1 4.16Å; R526-I587 HydrophobicContact CG-CD1 3.52Å; R526-I587 VanDerWaalsContact NE-CD1 3.34Å
527	L	91.8	Very high	86	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	109.1	-179.9	180	74.6	0	0	0	109.9	F495 V515 Y549 I550 F552 L581 G582 P584 L651	F495-L527 HydrophobicContact CB-CD1 3.95Å; F495-L527 HydrophobicContact CB-CD2 3.91Å; F495-L527 HydrophobicContact CD1-CD2 3.95Å; F495-L527 HydrophobicContact CG-CD1 4.25Å; F495-L527 HydrophobicContact CG-CD2 4.19Å; V515-L527 HydrophobicContact CG1-CD2 3.61Å; L527-Y549 CarbonylContact O-C 3.56Å; L527-Y549 WeakPolarHBondContact O-CA 3.39Å; L527-I550 HydrophobicContact CB-CG2 3.72Å; L527-I550 HydrophobicContact CD2-CG2 3.96Å; L527-I550 HydrophobicContact CG-CG2 4.25Å; L527-I550 PolarHBondContact N-O 3.11Å; L527-I550 PolarHBondContact O-N 3.07Å; L527-F552 HydrophobicContact CB-CE2 4.5Å; L527-F552 HydrophobicContact CD2-CE2 4.13Å; L527-L581 HydrophobicContact CD1-CB 4.5Å; L527-L581 HydrophobicContact CD2-CD1 4.16Å; L527-L581 HydrophobicContact CD2-CD2 3.78Å; L527-L581 HydrophobicContact CD2-CG 4.42Å; L527-L581 HydrophobicContact CG-CD2 4.25Å; L527-G582 VanDerWaalsContact CD1-O 3.24Å; L527-G582 WeakPolarHBondContact CD1-O 2.96Å; L527-P584 HydrophobicContact CD1-CB 3.91Å; L527-L651 HydrophobicContact CD1-CD2 3.93Å
528	P	92.3	Very high	86	Confident	34 Å²	34	37 Å²	37	22%	0.221	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	148	177.2	28.1	-30.9	0	0	0	111.7	G548 G582 E583	P528-G548 CarbonylContact C-O 3.59Å; P528-G548 WeakPolarHBondContact CA-O 3.29Å; P528-G582 PolarHBondContact O-N 2.9Å; P528-E583 WeakPolarHBondContact CD-O 3.19Å; P528-E583 WeakPolarHBondContact CG-O 3.41Å
529	Y	93.8	Very high	86.1	Confident	23 Å²	23	38.9 Å²	38.9	9%	0.09	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	156.6	175.1	66.7	-93.2	0	0	0	112.2	M546 G548 I550 I561 Q580	Y529-M546 HydrophobicContact CE2-CB 4.5Å; Y529-M546 HydrophobicContact CE2-CG 3.97Å; Y529-M546 HydrophobicContact CE2-SD 3.82Å; Y529-M546 WeakPolarHBondContact OH-CE 3.44Å; Y529-M546 PolarHBondContact OH-SD 3.11Å; Y529-M546 VanDerWaalsContact OH-SD 3.38Å; Y529-G548 PolarHBondContact N-O 2.89Å; Y529-G548 PolarHBondContact O-N 3.28Å; Y529-I550 HydrophobicContact CE1-CB 4.46Å; Y529-I561 HydrophobicContact CD1-CD1 3.74Å; Y529-I561 HydrophobicContact CD1-CG1 3.98Å; Y529-I561 HydrophobicContact CD2-CD1 4.04Å; Y529-I561 HydrophobicContact CD2-CG1 4.47Å; Y529-I561 HydrophobicContact CD2-CG2 3.91Å; Y529-I561 HydrophobicContact CE1-CD1 4.29Å; Y529-I561 HydrophobicContact CE1-CG1 4.02Å; Y529-I561 HydrophobicContact CE1-CG2 4.41Å; Y529-I561 HydrophobicContact CE2-CG2 3.56Å; Y529-I561 HydrophobicContact CG-CD1 3.6Å; Y529-I561 HydrophobicContact CG-CG1 4.22Å; Y529-I561 HydrophobicContact CG-CG2 4.48Å; Y529-Q580 CarbonylContact C-O 3.44Å; Y529-Q580 VanDerWaalsContact CA-O 3.27Å; Y529-Q580 WeakPolarHBondContact CA-O 3.33Å
530	Q	92.6	Very high	86.4	Confident	74 Å²	74	38.7 Å²	38.7	35%	0.346	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	149.4	176.2	65.8	-178.1	8.5	0	0	112.6	M546 V547 V579 Q580	Q530-M546 WeakPolarHBondContact CA-O 3.35Å; Q530-V547 HydrophobicContact CB-CG2 4.13Å; Q530-V579 WeakPolarHBondContact O-CA 3.33Å; Q530-Q580 HydrophobicContact CG-CB 4.31Å; Q530-Q580 PolarHBondContact N-O 3.27Å; Q530-Q580 PolarHBondContact O-N 2.83Å
531	T	93.5	Very high	87.1	Confident	16 Å²	16	43.5 Å²	43.5	10%	0.098	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	145.8	169	56.1	0	0	0	0	111.8	F543 D545 M546 I563 Y578 V579	T531-F543 HydrophobicContact CG2-CE2 4.31Å; T531-D545 WeakPolarHBondContact OG1-CA 3.45Å; T531-D545 PolarHBondContact OG1-OD1 2.93Å; T531-M546 HydrophobicContact CG2-CB 4.12Å; T531-M546 PolarHBondContact N-O 3.04Å; T531-M546 PolarHBondContact OG1-N 3.46Å; T531-M546 PolarHBondContact OG1-O 3.26Å; T531-I563 HydrophobicContact CG2-CD1 3.48Å; T531-I563 VanDerWaalsContact CG2-CD1 3.48Å; T531-I563 HydrophobicContact CG2-CG1 4.23Å; T531-Y578 CarbonylContact C-O 3.46Å; T531-Y578 WeakPolarHBondContact CA-O 3.19Å; T531-V579 HydrophobicContact CG2-CG2 4.41Å
532	V	92.7	Very high	87.5	Confident	48 Å²	48	43.8 Å²	43.8	29%	0.291	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	125.6	176.6	-178.4	0	0	0	0	109.1	Y578	V532-Y578 PolarHBondContact N-O 3.28Å; V532-Y578 PolarHBondContact O-N 2.8Å
533	E	91.5	Very high	88.3	Confident	89 Å²	89	36.6 Å²	36.6	42%	0.416	22%	0.217	S	C	.	.			trans	-58.7	143.5	178.2	-62.1	-164.4	158	0	0	112.6	K537 G538 F543	E533-K537 IonicContact OE2-NZ 3.86Å; E533-K537 PolarHBondContact OE2-NZ 2.88Å; E533-G538 PolarHBondContact OE1-N 3.27Å; E533-F543 HydrophobicContact CG-CZ 4.36Å
534	G	89.3	Confident	88.9	Confident	23 Å²	23	39.5 Å²	39.5	24%	0.237	23%	0.226	C	C	.	.	S	Bend	trans	-119	-122	169.8	0	0	0	0	0	110.3	A536 Y576	G534-A536 PolarHBondContact N-O 2.95Å; G534-Y576 CarbonylContact C-O 3.58Å; G534-Y576 VanDerWaalsContact CA-O 3.22Å; G534-Y576 WeakPolarHBondContact CA-O 3.47Å
535	T	87.5	Confident	89.1	Confident	61 Å²	61	42.6 Å²	42.6	37%	0.374	24%	0.242	S	C	.	.	S	Bend	trans	-75.3	-36.9	164.4	59.4	0	0	0	0	110.6	E575 Y576	T535-E575 WeakPolarHBondContact OG1-CA 3.44Å; T535-Y576 HydrophobicContact CG2-CD1 4.24Å; T535-Y576 HydrophobicContact CG2-CE1 3.61Å; T535-Y576 PolarHBondContact N-O 3.23Å; T535-Y576 PolarHBondContact OG1-N 3.05Å
536	A	87.6	Confident	89.2	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-69.8	140.5	170.2	0	0	0	0	0	110.4	G534 D542 F543 E575 Y576 F577 I661	G534-A536 PolarHBondContact N-O 2.95Å; A536-D542 HydrophobicContact CB-CB 4.04Å; A536-F543 HydrophobicContact CB-CD1 4.24Å; A536-F543 HydrophobicContact CB-CE1 4.24Å; A536-E575 HydrophobicContact CB-CB 3.94Å; A536-Y576 PolarHBondContact N-O 3.17Å; A536-F577 HydrophobicContact CB-CB 4.25Å; A536-F577 HydrophobicContact CB-CD1 4.47Å; A536-I661 HydrophobicContact CB-CD1 4.32Å
537	K	88.3	Confident	89.3	Confident	85 Å²	85	47 Å²	47	37%	0.37	27%	0.271	S	S	.	.			trans	-103.7	138.3	-174.8	-65.7	-74.1	155.3	-139	0	111.6	E533 K541 D542 F543	E533-K537 IonicContact OE2-NZ 3.86Å; E533-K537 PolarHBondContact OE2-NZ 2.88Å; K537-K541 HydrophobicContact CB-CB 4.33Å; K537-K541 HydrophobicContact CB-CD 4.04Å; K537-K541 HydrophobicContact CG-CD 4.46Å; K537-D542 WeakPolarHBondContact CA-OD2 3.36Å; K537-D542 WeakPolarHBondContact CB-OD2 3.24Å; K537-D542 PolarHBondContact N-OD2 3.14Å; K537-D542 PolarHBondContact O-N 3.29Å; K537-D542 VanDerWaalsContact O-N 3.11Å; K537-F543 VanDerWaalsContact C-CE1 3.49Å; K537-F543 PolarHBondContact O-N 2.88Å
538	G	87.4	Confident	89.2	Confident	8 Å²	8	48 Å²	48	8%	0.082	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-163.1	175.6	0	0	0	0	0	112.6	E533 G540 K541 F543 D545	E533-G538 PolarHBondContact OE1-N 3.27Å; G538-G540 VanDerWaalsContact C-N 3.32Å; G538-G540 PolarHBondContact O-N 3.2Å; G538-K541 PolarHBondContact O-N 3.47Å; G538-F543 CarbonylContact C-O 3.48Å; G538-D545 WeakPolarHBondContact CA-OD2 3.45Å
539	G	83.7	Confident	89.1	Confident	69 Å²	69	51.6 Å²	51.6	71%	0.711	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	16.6	177	0	0	0	0	0	115.3	D545	G539-D545 PolarHBondContact N-OD2 2.56Å
540	G	82.7	Confident	89	Confident	29 Å²	29	51.5 Å²	51.5	30%	0.299	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	17.7	-177	0	0	0	0	0	113.7	G538 F543	G538-G540 VanDerWaalsContact C-N 3.32Å; G538-G540 PolarHBondContact O-N 3.2Å; G540-F543 WeakPolarHBondContact CA-O 3.38Å; G540-F543 PolarHBondContact N-O 2.83Å
541	K	84.1	Confident	88.8	Confident	106 Å²	106	51.1 Å²	51.1	46%	0.461	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-65.5	171.2	-169.3	-175.4	158.4	-74.6	0	110.3	K537 G538	K537-K541 HydrophobicContact CB-CB 4.33Å; K537-K541 HydrophobicContact CB-CD 4.04Å; K537-K541 HydrophobicContact CG-CD 4.46Å; G538-K541 PolarHBondContact O-N 3.47Å
542	D	85.8	Confident	88.6	Confident	7 Å²	7	50.4 Å²	50.4	4%	0.037	29%	0.286	C	S	.	.	S	Bend	trans	-108.6	-30.5	179.1	-45.8	-36.2	0	0	0	110.2	A536 K537 M566	A536-D542 HydrophobicContact CB-CB 4.04Å; K537-D542 WeakPolarHBondContact CA-OD2 3.36Å; K537-D542 WeakPolarHBondContact CB-OD2 3.24Å; K537-D542 PolarHBondContact N-OD2 3.14Å; K537-D542 PolarHBondContact O-N 3.29Å; K537-D542 VanDerWaalsContact O-N 3.11Å; D542-M566 PolarHBondContact O-N 3.38Å
543	F	91	Very high	88.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-149	161.6	170	66.6	-82.5	0	0	0	111.8	T531 E533 A536 K537 G538 G540 D545 I563 R564 F577	T531-F543 HydrophobicContact CG2-CE2 4.31Å; E533-F543 HydrophobicContact CG-CZ 4.36Å; A536-F543 HydrophobicContact CB-CD1 4.24Å; A536-F543 HydrophobicContact CB-CE1 4.24Å; K537-F543 VanDerWaalsContact C-CE1 3.49Å; K537-F543 PolarHBondContact O-N 2.88Å; G538-F543 CarbonylContact C-O 3.48Å; G540-F543 WeakPolarHBondContact CA-O 3.38Å; G540-F543 PolarHBondContact N-O 2.83Å; F543-D545 WeakPolarHBondContact CE2-OD1 3.23Å; F543-I563 HydrophobicContact CB-CG2 4.39Å; F543-I563 HydrophobicContact CD2-CG2 4.34Å; F543-R564 WeakPolarHBondContact CA-O 3.36Å; F543-F577 HydrophobicContact CB-CE1 4.33Å; F543-F577 HydrophobicContact CB-CZ 4.47Å; F543-F577 HydrophobicContact CD1-CB 3.99Å; F543-F577 AromaticContact CD1-CD1 3.81Å; F543-F577 HydrophobicContact CD1-CD1 3.81Å; F543-F577 HydrophobicContact CD1-CD2 4.33Å; F543-F577 HydrophobicContact CD1-CE1 4.34Å; F543-F577 AromaticContact CD1-CG 3.8Å; F543-F577 HydrophobicContact CD1-CG 3.8Å; F543-F577 HydrophobicContact CD2-CD2 4.19Å; F543-F577 HydrophobicContact CD2-CE2 4.3Å; F543-F577 HydrophobicContact CD2-CG 4.47Å; F543-F577 HydrophobicContact CE1-CB 3.46Å; F543-F577 VanDerWaalsContact CE1-CB 3.46Å; F543-F577 HydrophobicContact CE1-CD1 4.19Å; F543-F577 HydrophobicContact CE1-CD2 4.26Å; F543-F577 AromaticContact CE1-CG 3.74Å; F543-F577 HydrophobicContact CE1-CG 3.74Å; F543-F577 HydrophobicContact CE2-CD2 4.14Å; F543-F577 HydrophobicContact CE2-CG 4.43Å; F543-F577 HydrophobicContact CG-CD1 4.17Å; F543-F577 HydrophobicContact CG-CD2 4.31Å; F543-F577 HydrophobicContact CG-CE1 4.29Å; F543-F577 HydrophobicContact CG-CE2 4.42Å; F543-F577 HydrophobicContact CG-CG 4.18Å; F543-F577 HydrophobicContact CG-CZ 4.41Å; F543-F577 HydrophobicContact CZ-CB 3.83Å; F543-F577 HydrophobicContact CZ-CD2 4.18Å; F543-F577 HydrophobicContact CZ-CG 4.09Å
544	E	90.4	Very high	87.8	Confident	80 Å²	80	51.7 Å²	51.7	37%	0.374	29%	0.291	S	S	.	.			trans	-83.9	124.1	170.8	-72.8	-177.5	-179.8	0	0	111	M546 R564 M566	E544-M546 PolarHBondContact O-N 3.26Å; E544-R564 HydrophobicContact CB-CB 4.29Å; E544-R564 VanDerWaalsContact CD-CD 3.45Å; E544-R564 HydrophobicContact CG-CB 4.28Å; E544-R564 PolarHBondContact N-O 3.36Å; E544-R564 VanDerWaalsContact N-O 3.09Å; E544-R564 VanDerWaalsContact OE1-CD 3.29Å; E544-R564 WeakPolarHBondContact OE1-CD 3.17Å; E544-R564 IonicContact OE1-CZ 2.64Å; E544-R564 IonicContact OE1-NE 2.98Å; E544-R564 IonicContact OE1-NH1 3.59Å; E544-R564 PolarHBondContact OE1-NH1 3.4Å; E544-M566 HydrophobicContact CG-SD 4.45Å
545	D	89.4	Confident	87.3	Confident	84 Å²	84	55.2 Å²	55.2	45%	0.449	31%	0.305	S	S	.	.			trans	-63.4	132.9	174.9	-70.4	-58.4	0	0	0	111.4	T531 G538 G539 F543	T531-D545 WeakPolarHBondContact OG1-CA 3.45Å; T531-D545 PolarHBondContact OG1-OD1 2.93Å; G538-D545 WeakPolarHBondContact CA-OD2 3.45Å; G539-D545 PolarHBondContact N-OD2 2.56Å; F543-D545 WeakPolarHBondContact CE2-OD1 3.23Å
546	M	88.5	Confident	87	Confident	71 Å²	71	55.2 Å²	55.2	35%	0.35	30%	0.301	S	S	.	.			trans	-133.2	131.6	-177.1	-162.3	178	-164.2	0	0	111.2	Y529 Q530 T531 E544	Y529-M546 HydrophobicContact CE2-CB 4.5Å; Y529-M546 HydrophobicContact CE2-CG 3.97Å; Y529-M546 HydrophobicContact CE2-SD 3.82Å; Y529-M546 WeakPolarHBondContact OH-CE 3.44Å; Y529-M546 PolarHBondContact OH-SD 3.11Å; Y529-M546 VanDerWaalsContact OH-SD 3.38Å; Q530-M546 WeakPolarHBondContact CA-O 3.35Å; T531-M546 HydrophobicContact CG2-CB 4.12Å; T531-M546 PolarHBondContact N-O 3.04Å; T531-M546 PolarHBondContact OG1-N 3.46Å; T531-M546 PolarHBondContact OG1-O 3.26Å; E544-M546 PolarHBondContact O-N 3.26Å
547	V	91.4	Very high	86.8	Confident	80 Å²	80	57.7 Å²	57.7	49%	0.485	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.1	170.2	-178.1	0	0	0	0	107.6	Q530	Q530-V547 HydrophobicContact CB-CG2 4.13Å
548	G	90.4	Very high	86.8	Confident	22 Å²	22	58.2 Å²	58.2	23%	0.227	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	-167	-172.5	0	0	0	0	0	113.1	P528 Y529	P528-G548 CarbonylContact C-O 3.59Å; P528-G548 WeakPolarHBondContact CA-O 3.29Å; Y529-G548 PolarHBondContact N-O 2.89Å; Y529-G548 PolarHBondContact O-N 3.28Å
549	Y	89.1	Confident	86.9	Confident	108 Å²	108	58 Å²	58	42%	0.424	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.7	169.6	60.9	-92.3	0	0	0	109.6	R526 L527	R526-Y549 HydrophobicContact CB-CD2 4.39Å; R526-Y549 HydrophobicContact CG-CD2 3.73Å; R526-Y549 HydrophobicContact CG-CE2 4.06Å; L527-Y549 CarbonylContact O-C 3.56Å; L527-Y549 WeakPolarHBondContact O-CA 3.39Å
550	I	91.5	Very high	87.3	Confident	22 Å²	22	57.5 Å²	57.5	11%	0.113	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135.5	169.3	-169.2	162.6	0	0	0	108.4	R526 L527 Y529 F552 G559 I561	R526-I550 WeakPolarHBondContact CA-O 3.47Å; L527-I550 HydrophobicContact CB-CG2 3.72Å; L527-I550 HydrophobicContact CD2-CG2 3.96Å; L527-I550 HydrophobicContact CG-CG2 4.25Å; L527-I550 PolarHBondContact N-O 3.11Å; L527-I550 PolarHBondContact O-N 3.07Å; Y529-I550 HydrophobicContact CE1-CB 4.46Å; I550-F552 HydrophobicContact CD1-CE2 4.48Å; I550-F552 HydrophobicContact CG1-CE2 4.31Å; I550-F552 HydrophobicContact CG2-CD2 4.09Å; I550-F552 HydrophobicContact CG2-CE2 3.56Å; I550-G559 VanDerWaalsContact CD1-C 3.48Å; I550-I561 HydrophobicContact CD1-CG1 4.4Å
551	E	89.5	Confident	87.8	Confident	66 Å²	66	56.2 Å²	56.2	31%	0.308	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116.7	178.8	-171.2	174.3	111	0	0	108.8	V524 V525 R526 Q553	V524-E551 HydrophobicContact CG1-CG 3.96Å; V525-E551 WeakPolarHBondContact O-CA 3.45Å; R526-E551 HydrophobicContact CG-CB 4.14Å; R526-E551 HydrophobicContact CG-CG 4.05Å; R526-E551 IonicContact CZ-OE2 3.32Å; R526-E551 IonicContact NE-OE2 2.81Å; R526-E551 PolarHBondContact NE-OE2 3.22Å; R526-E551 IonicContact NH2-OE2 2.93Å; R526-E551 PolarHBondContact NH2-OE2 3.35Å; E551-Q553 PolarHBondContact OE1-NE2 3.13Å
552	F	88.9	Confident	88.1	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	121.6	171.9	-74.1	-102.7	0	0	0	108.5	F495 V515 R517 V524 V525 L527 I550 Q556	F495-F552 HydrophobicContact CD1-CD2 4Å; F495-F552 HydrophobicContact CD1-CE1 4.48Å; F495-F552 AromaticContact CD1-CE2 3.71Å; F495-F552 HydrophobicContact CD1-CE2 3.71Å; F495-F552 AromaticContact CD1-CZ 3.98Å; F495-F552 HydrophobicContact CD1-CZ 3.98Å; F495-F552 HydrophobicContact CE1-CB 4.19Å; F495-F552 AromaticContact CE1-CD1 4Å; F495-F552 HydrophobicContact CE1-CD1 4Å; F495-F552 AromaticContact CE1-CD2 3.44Å; F495-F552 HydrophobicContact CE1-CD2 3.44Å; F495-F552 VanDerWaalsContact CE1-CD2 3.44Å; F495-F552 HydrophobicContact CE1-CE1 4.16Å; F495-F552 AromaticContact CE1-CE2 3.63Å; F495-F552 HydrophobicContact CE1-CE2 3.63Å; F495-F552 AromaticContact CE1-CG 3.63Å; F495-F552 HydrophobicContact CE1-CG 3.63Å; F495-F552 HydrophobicContact CE1-CZ 4Å; F495-F552 HydrophobicContact CZ-CD2 4.46Å; F495-F552 HydrophobicContact CZ-CG 4.47Å; V515-F552 HydrophobicContact CB-CZ 4.14Å; V515-F552 HydrophobicContact CG1-CE2 4.36Å; V515-F552 HydrophobicContact CG1-CZ 3.98Å; R517-F552 HydrophobicContact CB-CD1 4.2Å; R517-F552 HydrophobicContact CB-CE1 4.01Å; V524-F552 CarbonylContact C-O 3.56Å; V524-F552 VanDerWaalsContact CA-O 3.27Å; V524-F552 WeakPolarHBondContact CA-O 3.47Å; V524-F552 WeakPolarHBondContact CG1-O 3.49Å; V525-F552 PolarHBondContact N-O 3.13Å; V525-F552 PolarHBondContact O-N 3.43Å; L527-F552 HydrophobicContact CB-CE2 4.5Å; L527-F552 HydrophobicContact CD2-CE2 4.13Å; I550-F552 HydrophobicContact CD1-CE2 4.48Å; I550-F552 HydrophobicContact CG1-CE2 4.31Å; I550-F552 HydrophobicContact CG2-CD2 4.09Å; I550-F552 HydrophobicContact CG2-CE2 3.56Å; F552-Q556 HydrophobicContact CD1-CB 4.4Å; F552-Q556 HydrophobicContact CD1-CG 4.06Å
553	Q	86.9	Confident	88.4	Confident	90 Å²	90	58 Å²	58	42%	0.421	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-71.1	170.6	172.1	-60.9	-57.3	-39.5	0	0	111.2	R517 E551 D555 Q556	R517-Q553 PolarHBondContact NH1-O 3.45Å; R517-Q553 VanDerWaalsContact NH1-O 3.12Å; E551-Q553 PolarHBondContact OE1-NE2 3.13Å; Q553-D555 PolarHBondContact O-N 3.27Å; Q553-Q556 HydrophobicContact CB-CB 4.31Å; Q553-Q556 WeakPolarHBondContact O-CB 3.28Å; Q553-Q556 PolarHBondContact O-N 2.89Å
554	N	80.6	Confident	88.4	Confident	74 Å²	74	62.3 Å²	62.3	40%	0.396	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	136.4	168.6	-161.6	75.9	0	0	0	109.2	G523 Q556	G523-N554 WeakPolarHBondContact CA-OD1 3.2Å; G523-N554 PolarHBondContact N-OD1 2.87Å; N554-Q556 PolarHBondContact O-N 3.07Å
555	D	78	Confident	88.3	Confident	98 Å²	98	58.8 Å²	58.8	52%	0.524	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	13.6	179.8	-41.3	-40.2	0	0	0	114.7	C521 Q553	C521-D555 PolarHBondContact O-N 3.37Å; Q553-D555 PolarHBondContact O-N 3.27Å
556	Q	82.7	Confident	88.1	Confident	61 Å²	61	57.5 Å²	57.5	29%	0.285	28%	0.282	S	S	.	.			trans	-90.7	117.4	173.2	-170.9	179.4	-10.1	0	0	110.3	R517 F552 Q553 N554 E558	R517-Q556 WeakPolarHBondContact CD-O 3.29Å; R517-Q556 PolarHBondContact NH1-O 3.23Å; F552-Q556 HydrophobicContact CD1-CB 4.4Å; F552-Q556 HydrophobicContact CD1-CG 4.06Å; Q553-Q556 HydrophobicContact CB-CB 4.31Å; Q553-Q556 WeakPolarHBondContact O-CB 3.28Å; Q553-Q556 PolarHBondContact O-N 2.89Å; N554-Q556 PolarHBondContact O-N 3.07Å; Q556-E558 WeakPolarHBondContact CG-O 3.35Å; Q556-E558 PolarHBondContact NE2-O 3.36Å
557	T	83.1	Confident	87.5	Confident	51 Å²	51	57.7 Å²	57.7	31%	0.313	29%	0.285	S	S	.	.			trans	-98	-19.6	-178.2	53.6	0	0	0	0	114.1	R517 C521	R517-T557 WeakPolarHBondContact CB-O 3.33Å; R517-T557 PolarHBondContact N-O 3.49Å; C521-T557 HydrophobicContact CB-CG2 4.02Å
558	E	88.6	Confident	86.5	Confident	97 Å²	97	56.5 Å²	56.5	45%	0.453	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.3	178	65.2	170.8	178	0	0	112.9	K514 Q556	K514-E558 IonicContact NZ-OE2 3.37Å; K514-E558 PolarHBondContact NZ-OE2 3.2Å; Q556-E558 WeakPolarHBondContact CG-O 3.35Å; Q556-E558 PolarHBondContact NE2-O 3.36Å
559	G	89.6	Confident	85.1	Confident	4 Å²	4	58.7 Å²	58.7	4%	0.041	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	146	173.8	0	0	0	0	0	109.9	V515 I550	V515-G559 PolarHBondContact N-O 3.4Å; V515-G559 PolarHBondContact O-N 3.03Å; I550-G559 VanDerWaalsContact CD1-C 3.48Å
560	T	91.5	Very high	83.5	Confident	57 Å²	57	56.2 Å²	56.2	35%	0.35	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.1	-179.9	-56.8	0	0	0	0	110.6	E512 I513 R562	E512-T560 HydrophobicContact CB-CG2 3.83Å; E512-T560 HydrophobicContact CG-CG2 4.32Å; I513-T560 WeakPolarHBondContact O-CA 3.39Å; T560-R562 HydrophobicContact CG2-CG 4.28Å
561	I	92.4	Very high	82	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.9	167.8	-61.6	168.1	0	0	0	107.3	F497 I513 V515 Y529 I550 I563 V579 L581	F497-I561 HydrophobicContact CE1-CD1 4.24Å; I513-I561 HydrophobicContact CB-CB 4.3Å; I513-I561 HydrophobicContact CD1-CG2 4.42Å; I513-I561 PolarHBondContact N-O 3.41Å; I513-I561 PolarHBondContact O-N 3.34Å; V515-I561 HydrophobicContact CG2-CD1 3.65Å; V515-I561 HydrophobicContact CG2-CG1 4.11Å; Y529-I561 HydrophobicContact CD1-CD1 3.74Å; Y529-I561 HydrophobicContact CD1-CG1 3.98Å; Y529-I561 HydrophobicContact CD2-CD1 4.04Å; Y529-I561 HydrophobicContact CD2-CG1 4.47Å; Y529-I561 HydrophobicContact CD2-CG2 3.91Å; Y529-I561 HydrophobicContact CE1-CD1 4.29Å; Y529-I561 HydrophobicContact CE1-CG1 4.02Å; Y529-I561 HydrophobicContact CE1-CG2 4.41Å; Y529-I561 HydrophobicContact CE2-CG2 3.56Å; Y529-I561 HydrophobicContact CG-CD1 3.6Å; Y529-I561 HydrophobicContact CG-CG1 4.22Å; Y529-I561 HydrophobicContact CG-CG2 4.48Å; I550-I561 HydrophobicContact CD1-CG1 4.4Å; I561-I563 HydrophobicContact CG2-CD1 4.38Å; I561-I563 HydrophobicContact CG2-CG1 4.05Å; I561-V579 HydrophobicContact CD1-CG1 4.46Å; I561-L581 HydrophobicContact CD1-CD2 4.19Å
562	R	91.8	Very high	80.3	Confident	149 Å²	149	60.5 Å²	60.5	56%	0.562	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	113.6	175.9	-69.9	-175.3	168.8	168.6	-1.5	109.5	Y510 E512 T560	Y510-R562 HydrophobicContact CD1-CB 4.21Å; E512-R562 HydrophobicContact CG-CG 4.32Å; E512-R562 IonicContact OE1-CZ 3.98Å; E512-R562 IonicContact OE1-NE 3.44Å; E512-R562 PolarHBondContact OE1-NE 3.38Å; E512-R562 IonicContact OE1-NH2 3.07Å; E512-R562 PolarHBondContact OE1-NH2 3.19Å; T560-R562 HydrophobicContact CG2-CG 4.28Å
563	I	91.9	Very high	79.2	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	128.8	173.2	-63.1	171.6	0	0	0	107.9	Y510 A511 I513 T531 F543 I561 V565 F577 V579	Y510-I563 CarbonylContact C-O 3.56Å; Y510-I563 WeakPolarHBondContact CA-O 3.48Å; A511-I563 PolarHBondContact N-O 2.84Å; A511-I563 PolarHBondContact O-N 3Å; A511-I563 VanDerWaalsContact O-N 3.09Å; I513-I563 HydrophobicContact CD1-CB 4.36Å; I513-I563 HydrophobicContact CD1-CD1 3.56Å; I513-I563 HydrophobicContact CD1-CG1 3.95Å; T531-I563 HydrophobicContact CG2-CD1 3.48Å; T531-I563 VanDerWaalsContact CG2-CD1 3.48Å; T531-I563 HydrophobicContact CG2-CG1 4.23Å; F543-I563 HydrophobicContact CB-CG2 4.39Å; F543-I563 HydrophobicContact CD2-CG2 4.34Å; I561-I563 HydrophobicContact CG2-CD1 4.38Å; I561-I563 HydrophobicContact CG2-CG1 4.05Å; I563-V565 PolarHBondContact O-N 3.44Å; I563-F577 HydrophobicContact CD1-CE2 3.88Å; I563-F577 HydrophobicContact CD1-CZ 4.49Å; I563-F577 HydrophobicContact CG2-CE2 4.22Å; I563-F577 HydrophobicContact CG2-CZ 4.17Å; I563-V579 HydrophobicContact CD1-CB 4.45Å; I563-V579 HydrophobicContact CD1-CG1 4.37Å; I563-V579 HydrophobicContact CD1-CG2 3.22Å
564	R	90.5	Very high	78.7	Confident	91 Å²	91	68.9 Å²	68.9	34%	0.343	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	123.8	177.6	-163.2	-173.7	-174	-173.2	-1.3	110	E509 Y510 F543 E544	E509-R564 WeakPolarHBondContact O-CA 3.43Å; E509-R564 WeakPolarHBondContact O-CG 3.25Å; Y510-R564 HydrophobicContact CD1-CB 4.07Å; Y510-R564 HydrophobicContact CD1-CG 4.34Å; Y510-R564 HydrophobicContact CE1-CB 3.87Å; Y510-R564 HydrophobicContact CE1-CG 3.97Å; F543-R564 WeakPolarHBondContact CA-O 3.36Å; E544-R564 HydrophobicContact CB-CB 4.29Å; E544-R564 VanDerWaalsContact CD-CD 3.45Å; E544-R564 HydrophobicContact CG-CB 4.28Å; E544-R564 PolarHBondContact N-O 3.36Å; E544-R564 VanDerWaalsContact N-O 3.09Å; E544-R564 VanDerWaalsContact OE1-CD 3.29Å; E544-R564 WeakPolarHBondContact OE1-CD 3.17Å; E544-R564 IonicContact OE1-CZ 2.64Å; E544-R564 IonicContact OE1-NE 2.98Å; E544-R564 IonicContact OE1-NH1 3.59Å; E544-R564 PolarHBondContact OE1-NH1 3.4Å
565	V	88.8	Confident	79	Confident	6 Å²	6	67.1 Å²	67.1	4%	0.036	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-97.4	136.3	173.9	179	0	0	0	0	107.5	E509 A511 I563 I661	E509-V565 PolarHBondContact O-N 3.33Å; E509-V565 VanDerWaalsContact O-N 3.15Å; A511-V565 HydrophobicContact CB-CG2 3.79Å; I563-V565 PolarHBondContact O-N 3.44Å; V565-I661 HydrophobicContact CG1-CD1 4.05Å; V565-I661 HydrophobicContact CG1-CG1 4.38Å; V565-I661 HydrophobicContact CG1-CG2 4.42Å
566	M	83.9	Confident	79.6	Confident	57 Å²	57	65.7 Å²	65.7	28%	0.281	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-97	120.4	-178.1	-62	-61.7	-64.9	0	0	108.8	D542 E544 D568	D542-M566 PolarHBondContact O-N 3.38Å; E544-M566 HydrophobicContact CG-SD 4.45Å; M566-D568 PolarHBondContact O-N 3.23Å
567	D	77.1	Confident	80.2	Confident	76 Å²	76	62.8 Å²	62.8	41%	0.406	30%	0.301	S	S	.	.			trans	-81.2	99.3	172	-176.6	-4.6	0	0	0	109	E506 N569	E506-D567 HydrophobicContact CG-CB 4.13Å; E506-D567 WeakPolarHBondContact OE1-CA 3.48Å; D567-N569 VanDerWaalsContact C-N 3.33Å; D567-N569 VanDerWaalsContact OD1-CG 3.25Å; D567-N569 PolarHBondContact OD1-N 2.91Å; D567-N569 PolarHBondContact OD1-ND2 3.28Å; D567-N569 PolarHBondContact OD2-ND2 3.11Å
568	D	69.4	Low	80.7	Confident	54 Å²	54	62.7 Å²	62.7	29%	0.289	30%	0.295	S	S	.	.			trans	-90.3	-2.1	177.6	87	-9.3	0	0	0	112.3	E506 M566 N570	E506-D568 PolarHBondContact OE1-N 2.9Å; E506-D568 VanDerWaalsContact OE1-OD1 3.07Å; M566-D568 PolarHBondContact O-N 3.23Å; D568-N570 PolarHBondContact O-N 3.39Å; D568-N570 VanDerWaalsContact O-N 3.08Å; D568-N570 VanDerWaalsContact OD1-CB 3.22Å; D568-N570 WeakPolarHBondContact OD1-CB 3.14Å; D568-N570 PolarHBondContact OD1-N 2.98Å; D568-N570 PolarHBondContact OD2-ND2 2.93Å
569	N	61.1	Low	80.9	Confident	69 Å²	69	58 Å²	58	37%	0.369	27%	0.274	S	S	.	.			trans	50.5	25.9	-178.1	-81.2	-94.1	0	0	0	112.8	R301 E506 D567	R301-N569 PolarHBondContact NH1-OD1 2.96Å; E506-N569 PolarHBondContact OE1-N 3.23Å; D567-N569 VanDerWaalsContact C-N 3.33Å; D567-N569 VanDerWaalsContact OD1-CG 3.25Å; D567-N569 PolarHBondContact OD1-N 2.91Å; D567-N569 PolarHBondContact OD1-ND2 3.28Å; D567-N569 PolarHBondContact OD2-ND2 3.11Å
570	N	56.4	Low	81.1	Confident	55 Å²	55	61.3 Å²	61.3	29%	0.294	29%	0.288	S	S	.	.			trans	-93	122.2	175.2	-67.4	-44.6	0	0	0	110.3	K298 D568 E572	K298-N570 VanDerWaalsContact CE-OD1 3.26Å; K298-N570 WeakPolarHBondContact CE-OD1 3.13Å; K298-N570 PolarHBondContact NZ-OD1 3.41Å; D568-N570 PolarHBondContact O-N 3.39Å; D568-N570 VanDerWaalsContact O-N 3.08Å; D568-N570 VanDerWaalsContact OD1-CB 3.22Å; D568-N570 WeakPolarHBondContact OD1-CB 3.14Å; D568-N570 PolarHBondContact OD1-N 2.98Å; D568-N570 PolarHBondContact OD2-ND2 2.93Å; N570-E572 VanDerWaalsContact C-N 3.29Å; N570-E572 HydrophobicContact CB-CG 4.19Å; N570-E572 PolarHBondContact O-N 3.46Å
571	Y	58.9	Low	81.2	Confident	76 Å²	76	58.9 Å²	58.9	30%	0.298	27%	0.273	S	S	.	.			trans	-68.3	89	167.6	-169.1	-94.7	0	0	0	110.1	M291 V294 E663 F667	M291-Y571 HydrophobicContact CE-CE1 3.45Å; M291-Y571 VanDerWaalsContact CE-CE1 3.45Å; M291-Y571 VanDerWaalsContact CE-OH 3.27Å; M291-Y571 WeakPolarHBondContact CE-OH 3.45Å; M291-Y571 HydrophobicContact SD-CD1 3.93Å; M291-Y571 HydrophobicContact SD-CE1 3.28Å; M291-Y571 WeakPolarHBondContact SD-CE1 3.36Å; V294-Y571 HydrophobicContact CB-CD2 4.27Å; V294-Y571 HydrophobicContact CB-CG 4.48Å; V294-Y571 VanDerWaalsContact CG1-CB 3.43Å; V294-Y571 HydrophobicContact CG1-CD1 4.05Å; V294-Y571 HydrophobicContact CG1-CD2 3.35Å; V294-Y571 HydrophobicContact CG1-CE2 4.07Å; V294-Y571 HydrophobicContact CG1-CG 3.33Å; V294-Y571 HydrophobicContact CG2-CD2 3.94Å; V294-Y571 HydrophobicContact CG2-CE2 3.84Å; Y571-E663 VanDerWaalsContact CE2-CD 3.4Å; Y571-E663 HydrophobicContact CE2-CG 4.42Å; Y571-E663 WeakPolarHBondContact CE2-OE1 2.96Å; Y571-E663 PolarHBondContact OH-OE1 3.41Å; Y571-F667 HydrophobicContact CD2-CE1 4.39Å
572	E	53.5	Low	81	Confident	102 Å²	102	60 Å²	60	48%	0.477	29%	0.285	S	S	.	.			trans	-117.4	167.7	171.6	-64.2	-162.3	175.7	0	0	111	N570	N570-E572 VanDerWaalsContact C-N 3.29Å; N570-E572 HydrophobicContact CB-CG 4.19Å; N570-E572 PolarHBondContact O-N 3.46Å
573	K	65.9	Low	80.8	Confident	192 Å²	192	59.1 Å²	59.1	84%	0.835	29%	0.287	S	S	*	.	S	Bend	trans	-58	147.8	172.7	-66.2	175.7	179.3	175.4	0	108.6	E575	K573-E575 WeakPolarHBondContact O-CG 2.98Å; K573-E575 PolarHBondContact O-N 3.34Å; K573-E575 VanDerWaalsContact O-N 3.08Å
574	S	78.3	Confident	80.6	Confident	74 Å²	74	59.7 Å²	59.7	52%	0.517	29%	0.291	S	S	.	.			trans	-46.7	120.9	174.2	-50.5	0	0	0	0	111	I661	S574-I661 WeakPolarHBondContact CA-O 3.33Å
575	E	86.7	Confident	80.3	Confident	38 Å²	38	59 Å²	59	18%	0.178	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	160.1	-179.5	-56.2	-157.9	130.5	0	0	110.3	T535 A536 K573 T660 I661	T535-E575 WeakPolarHBondContact OG1-CA 3.44Å; A536-E575 HydrophobicContact CB-CB 3.94Å; K573-E575 WeakPolarHBondContact O-CG 2.98Å; K573-E575 PolarHBondContact O-N 3.34Å; K573-E575 VanDerWaalsContact O-N 3.08Å; E575-T660 CarbonylContact O-C 3.59Å; E575-T660 VanDerWaalsContact O-CA 3.32Å; E575-T660 WeakPolarHBondContact O-CA 3.19Å; E575-I661 PolarHBondContact N-O 3.01Å; E575-I661 PolarHBondContact O-N 3.19Å
576	Y	90.6	Very high	79.8	Confident	68 Å²	68	62.8 Å²	62.8	27%	0.267	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	151.8	177.2	65.3	-91.6	0	0	0	113.2	G534 T535 A536 Y578 K658 I659	G534-Y576 CarbonylContact C-O 3.58Å; G534-Y576 VanDerWaalsContact CA-O 3.22Å; G534-Y576 WeakPolarHBondContact CA-O 3.47Å; T535-Y576 HydrophobicContact CG2-CD1 4.24Å; T535-Y576 HydrophobicContact CG2-CE1 3.61Å; T535-Y576 PolarHBondContact N-O 3.23Å; T535-Y576 PolarHBondContact OG1-N 3.05Å; A536-Y576 PolarHBondContact N-O 3.17Å; Y576-Y578 HydrophobicContact CD2-CD2 4.42Å; Y576-Y578 AromaticContact CD2-CE2 3.72Å; Y576-Y578 HydrophobicContact CD2-CE2 3.72Å; Y576-Y578 AromaticContact CD2-CZ 3.84Å; Y576-Y578 AromaticContact CE2-CE2 3.5Å; Y576-Y578 HydrophobicContact CE2-CE2 3.5Å; Y576-Y578 VanDerWaalsContact CE2-CE2 3.5Å; Y576-Y578 AromaticContact CE2-CZ 3.63Å; Y576-Y578 VanDerWaalsContact CE2-OH 3.3Å; Y576-Y578 WeakPolarHBondContact CE2-OH 3.43Å; Y576-K658 HydrophobicContact CD2-CD 4.22Å; Y576-K658 HydrophobicContact CD2-CG 3.98Å; Y576-K658 HydrophobicContact CG-CD 4.29Å; Y576-K658 HydrophobicContact CG-CG 4.19Å; Y576-I659 CarbonylContact C-O 3.59Å; Y576-I659 WeakPolarHBondContact CA-O 3.29Å; Y576-I659 VanDerWaalsContact CB-O 3.27Å; Y576-I659 WeakPolarHBondContact CB-O 3.47Å
577	F	93.5	Very high	79.6	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	176.8	167.9	69.1	-82.6	0	0	0	109.9	A536 F543 I563 V579 I659 I661	A536-F577 HydrophobicContact CB-CB 4.25Å; A536-F577 HydrophobicContact CB-CD1 4.47Å; F543-F577 HydrophobicContact CB-CE1 4.33Å; F543-F577 HydrophobicContact CB-CZ 4.47Å; F543-F577 HydrophobicContact CD1-CB 3.99Å; F543-F577 AromaticContact CD1-CD1 3.81Å; F543-F577 HydrophobicContact CD1-CD1 3.81Å; F543-F577 HydrophobicContact CD1-CD2 4.33Å; F543-F577 HydrophobicContact CD1-CE1 4.34Å; F543-F577 AromaticContact CD1-CG 3.8Å; F543-F577 HydrophobicContact CD1-CG 3.8Å; F543-F577 HydrophobicContact CD2-CD2 4.19Å; F543-F577 HydrophobicContact CD2-CE2 4.3Å; F543-F577 HydrophobicContact CD2-CG 4.47Å; F543-F577 HydrophobicContact CE1-CB 3.46Å; F543-F577 VanDerWaalsContact CE1-CB 3.46Å; F543-F577 HydrophobicContact CE1-CD1 4.19Å; F543-F577 HydrophobicContact CE1-CD2 4.26Å; F543-F577 AromaticContact CE1-CG 3.74Å; F543-F577 HydrophobicContact CE1-CG 3.74Å; F543-F577 HydrophobicContact CE2-CD2 4.14Å; F543-F577 HydrophobicContact CE2-CG 4.43Å; F543-F577 HydrophobicContact CG-CD1 4.17Å; F543-F577 HydrophobicContact CG-CD2 4.31Å; F543-F577 HydrophobicContact CG-CE1 4.29Å; F543-F577 HydrophobicContact CG-CE2 4.42Å; F543-F577 HydrophobicContact CG-CG 4.18Å; F543-F577 HydrophobicContact CG-CZ 4.41Å; F543-F577 HydrophobicContact CZ-CB 3.83Å; F543-F577 HydrophobicContact CZ-CD2 4.18Å; F543-F577 HydrophobicContact CZ-CG 4.09Å; I563-F577 HydrophobicContact CD1-CE2 3.88Å; I563-F577 HydrophobicContact CD1-CZ 4.49Å; I563-F577 HydrophobicContact CG2-CE2 4.22Å; I563-F577 HydrophobicContact CG2-CZ 4.17Å; F577-V579 HydrophobicContact CD2-CG2 4.4Å; F577-V579 HydrophobicContact CE2-CG2 3.95Å; F577-I659 HydrophobicContact CD1-CB 4.13Å; F577-I659 HydrophobicContact CD1-CG2 4.27Å; F577-I659 HydrophobicContact CD2-CD1 4.13Å; F577-I659 HydrophobicContact CE1-CB 3.73Å; F577-I659 HydrophobicContact CE1-CD1 4.29Å; F577-I659 HydrophobicContact CE1-CG2 3.5Å; F577-I659 VanDerWaalsContact CE1-CG2 3.5Å; F577-I659 HydrophobicContact CE2-CB 4.19Å; F577-I659 HydrophobicContact CE2-CD1 3.35Å; F577-I659 HydrophobicContact CE2-CG1 4.4Å; F577-I659 HydrophobicContact CZ-CB 3.77Å; F577-I659 HydrophobicContact CZ-CD1 3.45Å; F577-I659 VanDerWaalsContact CZ-CD1 3.45Å; F577-I659 HydrophobicContact CZ-CG1 4.24Å; F577-I659 HydrophobicContact CZ-CG2 3.69Å; F577-I659 PolarHBondContact N-O 3.12Å; F577-I659 PolarHBondContact O-N 3.45Å; F577-I661 HydrophobicContact CD1-CD1 4.15Å; F577-I661 HydrophobicContact CD1-CG1 4.4Å; F577-I661 HydrophobicContact CE1-CD1 4.09Å; F577-I661 HydrophobicContact CE1-CG1 4.19Å
578	Y	94.1	Very high	79	Confident	48 Å²	48	63.8 Å²	63.8	19%	0.188	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	154.2	-179.6	-59.1	-92.2	0	0	0	112.3	T531 V532 Y576 R656 I657 K658	T531-Y578 CarbonylContact C-O 3.46Å; T531-Y578 WeakPolarHBondContact CA-O 3.19Å; V532-Y578 PolarHBondContact N-O 3.28Å; V532-Y578 PolarHBondContact O-N 2.8Å; Y576-Y578 HydrophobicContact CD2-CD2 4.42Å; Y576-Y578 AromaticContact CD2-CE2 3.72Å; Y576-Y578 HydrophobicContact CD2-CE2 3.72Å; Y576-Y578 AromaticContact CD2-CZ 3.84Å; Y576-Y578 AromaticContact CE2-CE2 3.5Å; Y576-Y578 HydrophobicContact CE2-CE2 3.5Å; Y576-Y578 VanDerWaalsContact CE2-CE2 3.5Å; Y576-Y578 AromaticContact CE2-CZ 3.63Å; Y576-Y578 VanDerWaalsContact CE2-OH 3.3Å; Y576-Y578 WeakPolarHBondContact CE2-OH 3.43Å; Y578-R656 HydrophobicContact CD1-CG 4.07Å; Y578-I657 VanDerWaalsContact CA-O 3.23Å; Y578-I657 WeakPolarHBondContact CA-O 3.31Å; Y578-K658 HydrophobicContact CD1-CB 3.75Å; Y578-K658 HydrophobicContact CD1-CG 4.1Å; Y578-K658 HydrophobicContact CE1-CB 3.6Å; Y578-K658 HydrophobicContact CE1-CD 4.21Å; Y578-K658 HydrophobicContact CE1-CG 3.68Å
579	V	93.7	Very high	78.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.6	168.8	-174.3	0	0	0	0	108.1	F497 I513 Q530 T531 I561 I563 F577 R656 I657 I659	F497-V579 HydrophobicContact CE1-CG1 4.41Å; F497-V579 WeakPolarHBondContact CE2-O 3.24Å; F497-V579 HydrophobicContact CZ-CB 4.13Å; F497-V579 HydrophobicContact CZ-CG1 3.88Å; I513-V579 HydrophobicContact CD1-CG2 4.11Å; Q530-V579 WeakPolarHBondContact O-CA 3.33Å; T531-V579 HydrophobicContact CG2-CG2 4.41Å; I561-V579 HydrophobicContact CD1-CG1 4.46Å; I563-V579 HydrophobicContact CD1-CB 4.45Å; I563-V579 HydrophobicContact CD1-CG1 4.37Å; I563-V579 HydrophobicContact CD1-CG2 3.22Å; F577-V579 HydrophobicContact CD2-CG2 4.4Å; F577-V579 HydrophobicContact CE2-CG2 3.95Å; V579-R656 WeakPolarHBondContact O-CA 3.45Å; V579-I657 HydrophobicContact CB-CG2 3.75Å; V579-I657 HydrophobicContact CG2-CG2 4.42Å; V579-I657 PolarHBondContact N-O 3.34Å; V579-I657 PolarHBondContact O-N 3.38Å; V579-I659 HydrophobicContact CB-CD1 4.42Å; V579-I659 HydrophobicContact CG2-CD1 3.4Å
580	Q	93.4	Very high	77.7	Confident	72 Å²	72	72.8 Å²	72.8	34%	0.336	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.7	-175.5	-173.4	175.9	0.6	0	0	110.6	Y529 Q530 T655	Y529-Q580 CarbonylContact C-O 3.44Å; Y529-Q580 VanDerWaalsContact CA-O 3.27Å; Y529-Q580 WeakPolarHBondContact CA-O 3.33Å; Q530-Q580 HydrophobicContact CG-CB 4.31Å; Q530-Q580 PolarHBondContact N-O 3.27Å; Q530-Q580 PolarHBondContact O-N 2.83Å; Q580-T655 WeakPolarHBondContact CA-O 3.35Å
581	L	92.8	Very high	77.3	Confident	6 Å²	6	72.7 Å²	72.7	3%	0.031	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	143.2	171.9	-57.7	175.7	0	0	0	110.3	F497 V515 L527 I561 L651 T655	F497-L581 HydrophobicContact CD2-CD1 4.16Å; F497-L581 HydrophobicContact CD2-CG 4.24Å; F497-L581 HydrophobicContact CE1-CD1 4.41Å; F497-L581 HydrophobicContact CE1-CD2 3.9Å; F497-L581 HydrophobicContact CE1-CG 4.13Å; F497-L581 HydrophobicContact CE2-CD1 4Å; F497-L581 HydrophobicContact CE2-CD2 4.17Å; F497-L581 HydrophobicContact CE2-CG 3.57Å; F497-L581 HydrophobicContact CG-CD1 4.46Å; F497-L581 HydrophobicContact CZ-CD1 4.12Å; F497-L581 HydrophobicContact CZ-CD2 3.55Å; F497-L581 HydrophobicContact CZ-CG 3.5Å; F497-L581 VanDerWaalsContact CZ-CG 3.5Å; V515-L581 HydrophobicContact CG1-CD1 4.08Å; V515-L581 HydrophobicContact CG1-CD2 4.48Å; V515-L581 HydrophobicContact CG2-CD2 4.11Å; L527-L581 HydrophobicContact CD1-CB 4.5Å; L527-L581 HydrophobicContact CD2-CD1 4.16Å; L527-L581 HydrophobicContact CD2-CD2 3.78Å; L527-L581 HydrophobicContact CD2-CG 4.42Å; L527-L581 HydrophobicContact CG-CD2 4.25Å; I561-L581 HydrophobicContact CD1-CD2 4.19Å; L581-L651 HydrophobicContact CB-CD2 3.88Å; L581-T655 PolarHBondContact N-O 3.27Å
582	G	89.6	Confident	76.5	Confident	26 Å²	26	73.4 Å²	73.4	27%	0.268	38%	0.378	S	S	.	.			trans	-105.7	176.8	167.9	0	0	0	0	0	111.7	L527 P528 L651	L527-G582 VanDerWaalsContact CD1-O 3.24Å; L527-G582 WeakPolarHBondContact CD1-O 2.96Å; P528-G582 PolarHBondContact O-N 2.9Å; G582-L651 WeakPolarHBondContact O-CD2 3.28Å
583	E	87	Confident	75.8	Confident	130 Å²	130	76.4 Å²	76.4	61%	0.607	40%	0.397	S	S	*	.			trans	-57.6	129.1	-174	-65.4	-66	164	0	0	113.2	P528	P528-E583 WeakPolarHBondContact CD-O 3.19Å; P528-E583 WeakPolarHBondContact CG-O 3.41Å
584	P	88.1	Confident	74.6	Confident	14 Å²	14	75.6 Å²	75.6	9%	0.091	40%	0.396	C	S	.	.			trans	-70.6	145.2	176.8	28.4	-34.5	0	0	0	111.9	F495 V525 L527 P649	F495-P584 HydrophobicContact CD2-CB 3.85Å; F495-P584 HydrophobicContact CD2-CG 4.05Å; F495-P584 HydrophobicContact CE2-CB 4.15Å; V525-P584 HydrophobicContact CG1-CB 3.63Å; L527-P584 HydrophobicContact CD1-CB 3.91Å; P584-P649 HydrophobicContact CB-CB 3.96Å; P584-P649 HydrophobicContact CB-CG 4.24Å; P584-P649 HydrophobicContact CG-CB 3.96Å; P584-P649 HydrophobicContact CG-CG 4.39Å
585	V	83.9	Confident	72.8	Confident	77 Å²	77	78.3 Å²	78.3	47%	0.467	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	118.7	-179.7	-176.4	0	0	0	0	109.8	V525 R526	V525-V585 WeakPolarHBondContact CA-O 3.36Å; R526-V585 PolarHBondContact N-O 3.31Å; R526-V585 PolarHBondContact O-N 3.39Å
586	L	78.5	Confident	70.6	Confident	85 Å²	85	85.1 Å²	85.1	45%	0.445	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	130.1	173.2	-168.6	74.9	0	0	0	110.2	V525 P649	V525-L586 HydrophobicContact CG2-CD1 3.86Å; L586-P649 HydrophobicContact CB-CG 4.04Å
587	I	78.9	Confident	68.2	Low	45 Å²	45	87.9 Å²	87.9	23%	0.231	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	121.1	178.4	-59.5	-179.1	0	0	0	109.3	V524 R526	V524-I587 HydrophobicContact CB-CB 4.41Å; V524-I587 HydrophobicContact CG1-CB 4.32Å; V524-I587 HydrophobicContact CG1-CD1 4.33Å; V524-I587 PolarHBondContact O-N 3.47Å; R526-I587 HydrophobicContact CB-CD1 4.16Å; R526-I587 HydrophobicContact CG-CD1 3.52Å; R526-I587 VanDerWaalsContact NE-CD1 3.34Å
588	D	64.5	Low	65.8	Low	108 Å²	108	90.7 Å²	90.7	58%	0.578	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-84.9	132.7	168.8	-163.7	-11.7	0	0	0	110.1	D590 A591	D588-D590 PolarHBondContact O-N 2.89Å; D588-D590 VanDerWaalsContact O-N 3.11Å; D588-A591 PolarHBondContact O-N 3.48Å; D588-A591 VanDerWaalsContact O-N 3.1Å
589	K	54	Low	63.2	Low	158 Å²	158	91.7 Å²	91.7	69%	0.687	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-61.8	-19.7	-177.6	-76.1	-177.4	176.9	175	0	112.5	I592	K589-I592 HydrophobicContact CB-CD1 4.48Å; K589-I592 VanDerWaalsContact O-CD1 3.32Å; K589-I592 WeakPolarHBondContact O-CD1 3.26Å; K589-I592 WeakPolarHBondContact O-CG1 3.44Å
590	D	50.1	Low	61.1	Low	154 Å²	154	95.9 Å²	95.9	82%	0.824	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-82.9	-9.8	178.5	-71.2	-24.1	0	0	0	114.4	D588	D588-D590 PolarHBondContact O-N 2.89Å; D588-D590 VanDerWaalsContact O-N 3.11Å
591	A	47	Very low	58.8	Low	54 Å²	54	98.1 Å²	98.1	45%	0.446	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-98.7	8	-177.7	0	0	0	0	0	114.8	D588 N593	D588-A591 PolarHBondContact O-N 3.48Å; D588-A591 VanDerWaalsContact O-N 3.1Å; A591-N593 PolarHBondContact O-N 3.33Å
592	I	42	Very low	56.5	Low	90 Å²	90	101.2 Å²	101.2	46%	0.462	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.8	-167.6	-65.6	174.5	0	0	0	114	K589	K589-I592 HydrophobicContact CB-CD1 4.48Å; K589-I592 VanDerWaalsContact O-CD1 3.32Å; K589-I592 WeakPolarHBondContact O-CD1 3.26Å; K589-I592 WeakPolarHBondContact O-CG1 3.44Å
593	N	39.6	Very low	54.3	Low	166 Å²	166	102.6 Å²	102.6	89%	0.888	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-4.5	-176.5	-74.4	-16.1	0	0	0	117	A591	A591-N593 PolarHBondContact O-N 3.33Å
594	E	41.1	Very low	52.3	Low	174 Å²	174	98.3 Å²	98.3	81%	0.813	52%	0.52	S	S	*	.	S	Bend	trans	-111.5	-8	178.5	-73.3	-167.9	170.3	0	0	115.3
595	W	39.4	Very low	49.9	Very low	132 Å²	132	106.2 Å²	106.2	50%	0.5	55%	0.547	S	S	.	.	S	Bend	trans	-105.4	-7	-171.3	-127.2	-73.9	0	0	0	116.5	T597 I598 F603	W595-T597 PolarHBondContact O-N 3.1Å; W595-I598 HydrophobicContact CD2-CD1 4.35Å; W595-I598 HydrophobicContact CG-CD1 4.3Å; W595-I598 HydrophobicContact CZ2-CD1 4.43Å; W595-F603 AromaticContact NE1-CZ 3.79Å
596	E	41.7	Very low	47.9	Very low	181 Å²	181	106.9 Å²	106.9	85%	0.846	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-7.6	178.2	-77.4	-166.7	155.6	0	0	114.1
597	T	39.4	Very low	46	Very low	126 Å²	126	105.1 Å²	105.1	77%	0.773	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	23.2	-173.8	-19.2	0	0	0	0	114.7	W595 P599	W595-T597 PolarHBondContact O-N 3.1Å; T597-P599 WeakPolarHBondContact O-CD 3.49Å
598	I	42.8	Very low	44	Very low	59 Å²	59	109.6 Å²	109.6	30%	0.303	57%	0.565	S	S	.	*			trans	-98.9	107.5	173	-50.9	-171.3	0	0	0	109.7	W595 L602 F603	W595-I598 HydrophobicContact CD2-CD1 4.35Å; W595-I598 HydrophobicContact CG-CD1 4.3Å; W595-I598 HydrophobicContact CZ2-CD1 4.43Å; I598-L602 HydrophobicContact CG2-CB 3.63Å; I598-L602 HydrophobicContact CG2-CD1 4.31Å; I598-F603 HydrophobicContact CB-CE2 4.45Å; I598-F603 HydrophobicContact CG2-CD2 4.38Å; I598-F603 HydrophobicContact CG2-CE2 4.19Å
599	P	40.7	Very low	42.4	Very low	68 Å²	68	113 Å²	113	44%	0.442	57%	0.57	S	S	.	*			trans	-69.8	146.7	177.7	-11.3	27.2	0	0	0	110.8	T597 H601 L602	T597-P599 WeakPolarHBondContact O-CD 3.49Å; P599-H601 PolarHBondContact O-N 2.73Å; P599-L602 PolarHBondContact O-N 3.08Å
600	S	49.1	Very low	41.5	Very low	89 Å²	89	108.8 Å²	108.8	62%	0.622	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-44.6	-30.5	-174	50.8	0	0	0	0	116.3	L602 F603	S600-L602 VanDerWaalsContact C-N 3.31Å; S600-L602 PolarHBondContact O-N 3.36Å; S600-F603 PolarHBondContact O-N 2.71Å
601	H	45.3	Very low	40.5	Very low	119 Å²	119	108 Å²	108	55%	0.551	56%	0.556	S	S	*	*	H	α-helix	trans	-68.5	-21.8	179.4	69.1	-87.5	0	0	0	114.8	P599	P599-H601 PolarHBondContact O-N 2.73Å
602	L	43.3	Very low	39.8	Very low	71 Å²	71	108.9 Å²	108.9	37%	0.372	56%	0.559	S	S	.	*	H	α-helix	trans	-76.9	-26.4	178.1	-107.3	147.9	0	0	0	112.4	I598 P599 S600 R605 I606	I598-L602 HydrophobicContact CG2-CB 3.63Å; I598-L602 HydrophobicContact CG2-CD1 4.31Å; P599-L602 PolarHBondContact O-N 3.08Å; S600-L602 VanDerWaalsContact C-N 3.31Å; S600-L602 PolarHBondContact O-N 3.36Å; L602-R605 WeakPolarHBondContact O-CB 3.09Å; L602-R605 PolarHBondContact O-N 3.27Å; L602-I606 PolarHBondContact O-N 3.32Å; L602-I606 VanDerWaalsContact O-N 3.13Å
603	F	44.9	Very low	39.2	Very low	55 Å²	55	111.4 Å²	111.4	24%	0.241	57%	0.573	C	S	.	*	H	α-helix	trans	-65.9	-38	173	-83	-84.5	0	0	0	112	W595 I598 S600 R605 I606 A607	W595-F603 AromaticContact NE1-CZ 3.79Å; I598-F603 HydrophobicContact CB-CE2 4.45Å; I598-F603 HydrophobicContact CG2-CD2 4.38Å; I598-F603 HydrophobicContact CG2-CE2 4.19Å; S600-F603 PolarHBondContact O-N 2.71Å; F603-R605 PolarHBondContact O-N 3.44Å; F603-I606 PolarHBondContact O-N 3.21Å; F603-A607 PolarHBondContact O-N 3.26Å
604	A	44.4	Very low	38.8	Very low	40 Å²	40	111.2 Å²	111.2	33%	0.331	57%	0.57	S	S	.	*	H	α-helix	trans	-59.5	-35.3	173.1	0	0	0	0	0	112.2	Q608	A604-Q608 WeakPolarHBondContact O-CG 3.43Å; A604-Q608 PolarHBondContact O-N 3.31Å
605	R	37.8	Very low	38.2	Very low	179 Å²	179	108.1 Å²	108.1	68%	0.675	57%	0.567	S	S	*	*	H	α-helix	trans	-72.5	-30.5	174.5	-93.3	-176	177.7	169.5	1.3	113.7	L602 F603 R609	L602-R605 WeakPolarHBondContact O-CB 3.09Å; L602-R605 PolarHBondContact O-N 3.27Å; F603-R605 PolarHBondContact O-N 3.44Å; R605-R609 WeakPolarHBondContact O-CB 3.23Å; R605-R609 PolarHBondContact O-N 2.99Å; R605-R609 VanDerWaalsContact O-N 3.16Å
606	I	40.9	Very low	37.5	Very low	92 Å²	92	105.1 Å²	105.1	47%	0.472	58%	0.578	S	S	.	*	H	α-helix	trans	-73.7	-40.2	175.3	-65.7	168.8	0	0	0	109.8	L602 F603 R609 S610	L602-I606 PolarHBondContact O-N 3.32Å; L602-I606 VanDerWaalsContact O-N 3.13Å; F603-I606 PolarHBondContact O-N 3.21Å; I606-R609 WeakPolarHBondContact O-CB 3.47Å; I606-R609 PolarHBondContact O-N 3.12Å; I606-R609 VanDerWaalsContact O-N 3.09Å; I606-S610 PolarHBondContact O-N 3.47Å
607	A	39.8	Very low	36.6	Very low	48 Å²	48	104.9 Å²	104.9	40%	0.397	58%	0.582	S	S	.	*	H	α-helix	trans	-60.8	-46.6	172.5	0	0	0	0	0	111.7	F603 R609 S610	F603-A607 PolarHBondContact O-N 3.26Å; A607-R609 PolarHBondContact O-N 3.15Å; A607-S610 PolarHBondContact O-N 3.47Å; A607-S610 VanDerWaalsContact O-N 3.13Å; A607-S610 PolarHBondContact O-OG 3.01Å
608	Q	36.8	Very low	36	Very low	138 Å²	138	104.3 Å²	104.3	65%	0.645	58%	0.583	S	S	*	*	H	α-helix	trans	-64.2	-20.3	173.8	-75.6	-176.2	-20.9	0	0	114	A604 S610 S612	A604-Q608 WeakPolarHBondContact O-CG 3.43Å; A604-Q608 PolarHBondContact O-N 3.31Å; Q608-S610 VanDerWaalsContact C-N 3.32Å; Q608-S612 PolarHBondContact O-OG 3.41Å
609	R	29.6	Very low	35.1	Very low	179 Å²	179	107.3 Å²	107.3	68%	0.675	61%	0.609	S	S	*	*	H	α-helix	trans	-75.7	-23.2	177.2	-141.8	174	-172.6	174.6	1.1	112.4	R605 I606 A607 S612 L613	R605-R609 WeakPolarHBondContact O-CB 3.23Å; R605-R609 PolarHBondContact O-N 2.99Å; R605-R609 VanDerWaalsContact O-N 3.16Å; I606-R609 WeakPolarHBondContact O-CB 3.47Å; I606-R609 PolarHBondContact O-N 3.12Å; I606-R609 VanDerWaalsContact O-N 3.09Å; A607-R609 PolarHBondContact O-N 3.15Å; R609-S612 PolarHBondContact O-N 3.31Å; R609-S612 PolarHBondContact O-OG 3.31Å; R609-L613 PolarHBondContact O-N 2.99Å
610	S	35.7	Very low	34.4	Very low	70 Å²	70	113.3 Å²	113.3	49%	0.49	63%	0.634	S	S	.	*	H	α-helix	trans	-70.3	-35.4	174.1	69	0	0	0	0	112.2	I606 A607 Q608 S612 L613	I606-S610 PolarHBondContact O-N 3.47Å; A607-S610 PolarHBondContact O-N 3.47Å; A607-S610 VanDerWaalsContact O-N 3.13Å; A607-S610 PolarHBondContact O-OG 3.01Å; Q608-S610 VanDerWaalsContact C-N 3.32Å; S610-S612 VanDerWaalsContact C-N 3.3Å; S610-S612 PolarHBondContact O-N 2.89Å; S610-L613 PolarHBondContact O-N 3.3Å
611	D	30.4	Very low	33.1	Very low	138 Å²	138	118.7 Å²	118.7	74%	0.738	65%	0.646	S	S	*	*	H	α-helix	trans	-69.9	-23.5	175.7	-80.3	-24.4	0	0	0	113.8
612	S	30.5	Very low	32.1	Very low	72 Å²	72	124.8 Å²	124.8	50%	0.503	66%	0.664	S	S	.	*	H	α-helix	trans	-93.4	-7.5	180	47.5	0	0	0	0	114.5	Q608 R609 S610 I614	Q608-S612 PolarHBondContact O-OG 3.41Å; R609-S612 PolarHBondContact O-N 3.31Å; R609-S612 PolarHBondContact O-OG 3.31Å; S610-S612 VanDerWaalsContact C-N 3.3Å; S610-S612 PolarHBondContact O-N 2.89Å; S612-I614 VanDerWaalsContact C-N 3.31Å; S612-I614 PolarHBondContact O-N 3.2Å
613	L	30.9	Very low	31.1	Very low	143 Å²	143	133 Å²	133	75%	0.749	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-2.6	177.8	-82.3	161.9	0	0	0	114.2	R609 S610 S615	R609-L613 PolarHBondContact O-N 2.99Å; S610-L613 PolarHBondContact O-N 3.3Å; L613-S615 VanDerWaalsContact C-N 3.33Å
614	I	31.4	Very low	30	Very low	162 Å²	162	138 Å²	138	83%	0.831	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-5.1	171.1	-61.9	178.1	0	0	0	112.2	S612	S612-I614 VanDerWaalsContact C-N 3.31Å; S612-I614 PolarHBondContact O-N 3.2Å
615	S	28	Very low	29.2	Very low	109 Å²	109	141.8 Å²	141.8	76%	0.762	74%	0.744	S	S	*	*	S	Bend	trans	-143.1	90.3	177.9	178.8	0	0	0	0	113.3	L613	L613-S615 VanDerWaalsContact C-N 3.33Å
616	G	24.6	Very low	28.4	Very low	69 Å²	69	145.1 Å²	145.1	71%	0.711	76%	0.756	S	S	*	*			trans	160.5	92.9	162.4	0	0	0	0	0	116.3	S618	G616-S618 PolarHBondContact O-N 3.28Å
617	N	23.3	Very low	27.6	Very low	176 Å²	176	147.2 Å²	147.2	94%	0.941	77%	0.773	S	S	*	*			trans	-51.3	115.3	157.2	-92.3	-14.3	0	0	0	110.7
618	S	26.3	Very low	26.9	Very low	114 Å²	114	151.1 Å²	151.1	80%	0.797	80%	0.795	S	S	*	*			trans	-164.2	132.3	140	57.6	0	0	0	0	112.5	G616	G616-S618 PolarHBondContact O-N 3.28Å
619	S	23.8	Very low	26.2	Very low	122 Å²	122	149.7 Å²	149.7	85%	0.853	80%	0.8	S	S	*	*			trans	-52.3	131.8	172.3	54.1	0	0	0	0	113.4
620	M	25.2	Very low	26	Very low	194 Å²	194	147.8 Å²	147.8	96%	0.956	81%	0.808	S	S	*	*			trans	-138.4	139.1	156	-155.4	161	165	0	0	112.3
621	K	23.1	Very low	25.4	Very low	203 Å²	203	153.8 Å²	153.8	88%	0.883	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-71.4	137.4	-154.8	-72	167.2	170.4	170.7	0	114.3	R623	K621-R623 PolarHBondContact O-N 2.8Å
622	R	23.5	Very low	25.4	Very low	247 Å²	247	155.2 Å²	155.2	93%	0.932	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-53.8	123.7	164.8	-77.5	178.3	157.9	176.2	-6.6	111.4
623	R	22.4	Very low	25.2	Very low	243 Å²	243	155 Å²	155	92%	0.917	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-101.1	116.9	165	-164.5	172.6	-179.1	168.6	-1.6	108.3	K621	K621-R623 PolarHBondContact O-N 2.8Å
624	N	21.1	Very low	25	Very low	161 Å²	161	155.9 Å²	155.9	86%	0.861	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-64.9	128.4	173	-82.1	-17.5	0	0	0	110.9
625	S	27.6	Very low	24.9	Very low	119 Å²	119	155.8 Å²	155.8	83%	0.832	85%	0.849	S	S	*	*			trans	-131.9	135.6	151.6	48.9	0	0	0	0	109.1
626	R	22.6	Very low	24.9	Very low	249 Å²	249	157.7 Å²	157.7	94%	0.94	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-73	137.8	-160	-69.8	167.1	166.1	164.8	-6.9	113.3
627	T	22.8	Very low	25.5	Very low	135 Å²	135	159.7 Å²	159.7	83%	0.828	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-81.4	139.2	160.7	46.5	0	0	0	0	111.6
628	P	25.3	Very low	25.8	Very low	130 Å²	130	162.9 Å²	162.9	84%	0.844	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-88.1	143.2	155.5	9.6	9	0	0	0	111.3
629	S	22	Very low	26.1	Very low	109 Å²	109	167 Å²	167	76%	0.762	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-83.4	144.1	-176.4	52.4	0	0	0	0	114.2
630	T	25.7	Very low	26.5	Very low	138 Å²	138	165.4 Å²	165.4	85%	0.847	84%	0.842	S	S	*	*			trans	-173.5	99.1	141.5	20.2	0	0	0	0	106.3
631	K	23.9	Very low	27	Very low	196 Å²	196	163.9 Å²	163.9	85%	0.852	84%	0.837	S	S	*	*				44.5	94.9	97.9	-74.8	-168.4	178.7	-177.2	0	113.9
632	D	28.6	Very low	27.3	Very low	169 Å²	169	157 Å²	157	90%	0.904	82%	0.824	S	S	*	*				-172	146.6	123.2	-89.5	-25.3	0	0	0	111.5
633	G	27.5	Very low	27.8	Very low	68 Å²	68	153.3 Å²	153.3	70%	0.701	82%	0.815	S	S	*	*			trans	81.4	78.7	148.2	0	0	0	0	0	119.4	L635	G633-L635 PolarHBondContact O-N 3.15Å
634	N	26.1	Very low	28.5	Very low	161 Å²	161	147.6 Å²	147.6	86%	0.861	81%	0.807	S	S	*	*			trans	-2.6	86.9	145.5	-154.2	36.6	0	0	0	118.3
635	L	29.6	Very low	29.6	Very low	160 Å²	160	147.4 Å²	147.4	84%	0.838	80%	0.801	S	S	*	*			trans	-132.7	126.6	152.3	-97	98	0	0	0	109.5	G633 P637	G633-L635 PolarHBondContact O-N 3.15Å; L635-P637 WeakPolarHBondContact O-CD 3.32Å
636	N	28.4	Very low	30.7	Very low	148 Å²	148	146 Å²	146	79%	0.791	79%	0.788	S	S	*	*			trans	-53.5	116.4	178.3	-77.5	-40.4	0	0	0	111	R638	N636-R638 PolarHBondContact O-N 3.39Å
637	P	37.4	Very low	32.4	Very low	112 Å²	112	135.8 Å²	135.8	73%	0.727	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	40.2	-169.8	35.1	-36.1	0	0	0	112.9	L635	L635-P637 WeakPolarHBondContact O-CD 3.32Å
638	R	28.9	Very low	34.8	Very low	242 Å²	242	135.2 Å²	135.2	91%	0.913	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	3.6	178.2	-88.6	-170.9	165.9	129.1	-1.6	115.2	N636	N636-R638 PolarHBondContact O-N 3.39Å
639	K	32.1	Very low	37.4	Very low	201 Å²	201	129.7 Å²	129.7	87%	0.874	71%	0.711	S	S	*	*	S	Bend	trans	-122.4	-3.5	175.3	-77.6	-168.2	174.5	-171.7	0	116.3
640	S	32.3	Very low	40.4	Very low	89 Å²	89	133 Å²	133	62%	0.622	71%	0.707	S	S	*	*	S	Bend	trans	-101.3	5.2	179	61.8	0	0	0	0	115.4
641	L	35.8	Very low	43.3	Very low	161 Å²	161	128.5 Å²	128.5	84%	0.843	68%	0.678	S	S	*	*	S	Bend	trans	-90.7	-1.9	173.9	-133.8	91.9	0	0	0	113.8
642	G	30.2	Very low	46.1	Very low	60 Å²	60	120 Å²	120	62%	0.619	65%	0.645	S	S	*	*	S	Bend	trans	-106.7	-6.2	-176.6	0	0	0	0	0	115.7
643	F	34.1	Very low	48.7	Very low	169 Å²	169	121 Å²	121	74%	0.741	65%	0.645	S	S	*	*	S	Bend	trans	-105.5	-0.1	-174.6	-157.9	-98.4	0	0	0	114.1	T646	F643-T646 PolarHBondContact O-OG1 3.47Å
644	V	37.2	Very low	51.4	Low	123 Å²	123	120.6 Å²	120.6	75%	0.745	63%	0.625	S	S	*	*	S	Bend	trans	-108.8	0.2	-179.9	-170	0	0	0	0	112.4
645	E	43.5	Very low	54.4	Low	156 Å²	156	115 Å²	115	73%	0.729	60%	0.596	S	S	*	*	S	Bend	trans	-88.1	-3.9	172.6	-79.2	-175.4	166.5	0	0	113.6
646	T	50.4	Low	57.4	Low	91 Å²	91	112.8 Å²	112.8	56%	0.558	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-6	-174.4	49.2	0	0	0	0	115	H491 F643	H491-T646 PolarHBondContact CE1-O 2.78Å; H491-T646 PolarHBondContact ND1-O 2.71Å; F643-T646 PolarHBondContact O-OG1 3.47Å
647	G	59.3	Low	60.4	Low	34 Å²	34	105.9 Å²	105.9	35%	0.351	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	17.8	-176.4	0	0	0	0	0	115.5	S492	S492-G647 WeakPolarHBondContact CB-O 3.37Å; S492-G647 PolarHBondContact OG-O 2.91Å; S492-G647 VanDerWaalsContact OG-O 3.09Å
648	Q	73	Confident	63	Low	123 Å²	123	103.2 Å²	103.2	58%	0.575	52%	0.517	S	S	*	.	S	Bend	trans	-84.7	141.5	174.1	-70.3	-173.8	8.5	0	0	110.6	R650	Q648-R650 WeakPolarHBondContact O-CG 3.38Å
649	P	80.6	Confident	66	Low	13 Å²	13	91.7 Å²	91.7	8%	0.084	47%	0.473	C	S	.	.			trans	-63.6	141.5	174.6	29.8	-36	0	0	0	110.1	G493 F495 V525 P584 L586	G493-P649 VanDerWaalsContact O-CA 3.31Å; G493-P649 WeakPolarHBondContact O-CA 3.42Å; F495-P649 HydrophobicContact CD2-CB 4.24Å; F495-P649 HydrophobicContact CE2-CB 3.64Å; V525-P649 HydrophobicContact CG1-CB 4.07Å; V525-P649 HydrophobicContact CG1-CG 4.17Å; V525-P649 HydrophobicContact CG2-CB 4.04Å; V525-P649 HydrophobicContact CG2-CG 4.14Å; P584-P649 HydrophobicContact CB-CB 3.96Å; P584-P649 HydrophobicContact CB-CG 4.24Å; P584-P649 HydrophobicContact CG-CB 3.96Å; P584-P649 HydrophobicContact CG-CG 4.39Å; L586-P649 HydrophobicContact CB-CG 4.04Å
650	R	83.1	Confident	68.8	Low	180 Å²	180	83.1 Å²	83.1	68%	0.679	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	162.2	179.6	-54.3	-173.7	97.6	-179.7	7.6	111.3	G493 V494 F495 Q648	G493-R650 PolarHBondContact O-N 3.27Å; V494-R650 CarbonylContact C-O 3.49Å; V494-R650 WeakPolarHBondContact CA-O 3.28Å; F495-R650 PolarHBondContact N-O 3.4Å; Q648-R650 WeakPolarHBondContact O-CG 3.38Å
651	L	86.9	Confident	71.3	Confident	42 Å²	42	79.7 Å²	79.7	22%	0.22	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	138.2	169.2	-72.5	175.5	0	0	0	110.8	L527 L581 G582 T655	L527-L651 HydrophobicContact CD1-CD2 3.93Å; L581-L651 HydrophobicContact CB-CD2 3.88Å; G582-L651 WeakPolarHBondContact O-CD2 3.28Å; L651-T655 HydrophobicContact CB-CG2 3.81Å; L651-T655 HydrophobicContact CD1-CG2 4.01Å; L651-T655 HydrophobicContact CD2-CG2 4.34Å; L651-T655 HydrophobicContact CG-CG2 4.27Å
652	G	83.4	Confident	73.3	Confident	17 Å²	17	73.7 Å²	73.7	18%	0.175	38%	0.383	C	S	.	.			trans	-80.3	-164.6	172.9	0	0	0	0	0	112.9	F495 T655	F495-G652 PolarHBondContact O-N 3.03Å; G652-T655 WeakPolarHBondContact O-CG2 3.42Å
653	Q	82.3	Confident	75.3	Confident	190 Å²	190	73.3 Å²	73.3	89%	0.888	37%	0.365	S	S	*	.	S	Bend	trans	-72.2	-34.6	-176.5	-62.7	-176.6	10.9	0	0	112.2	T655	Q653-T655 PolarHBondContact O-N 3.44Å
654	Q	86.1	Confident	76.9	Confident	60 Å²	60	66.3 Å²	66.3	28%	0.28	34%	0.337	S	S	.	.			trans	-100.5	80.4	-175.2	-69.4	158.4	-32.4	0	0	111	Q496 F497 V500	Q496-Q654 HydrophobicContact CB-CB 4.26Å; F497-Q654 WeakPolarHBondContact CD2-O 3.23Å; F497-Q654 PolarHBondContact N-O 3.09Å; F497-Q654 PolarHBondContact O-OE1 3.2Å; F497-Q654 VanDerWaalsContact O-OE1 3.13Å; V500-Q654 HydrophobicContact CG1-CG 4Å; V500-Q654 VanDerWaalsContact CG1-NE2 3.3Å
655	T	88.4	Confident	78.2	Confident	44 Å²	44	64.9 Å²	64.9	27%	0.27	33%	0.329	S	S	.	.			trans	-88.5	-7.6	178.4	60.1	0	0	0	0	113.7	F497 Q580 L581 L651 G652 Q653	F497-T655 WeakPolarHBondContact CE2-O 3.38Å; Q580-T655 WeakPolarHBondContact CA-O 3.35Å; L581-T655 PolarHBondContact N-O 3.27Å; L651-T655 HydrophobicContact CB-CG2 3.81Å; L651-T655 HydrophobicContact CD1-CG2 4.01Å; L651-T655 HydrophobicContact CD2-CG2 4.34Å; L651-T655 HydrophobicContact CG-CG2 4.27Å; G652-T655 WeakPolarHBondContact O-CG2 3.42Å; Q653-T655 PolarHBondContact O-N 3.44Å
656	R	91.4	Very high	79.2	Confident	113 Å²	113	64.2 Å²	64.2	43%	0.426	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	133.1	-179.7	-175.5	-179.9	-179.6	175.1	3.5	110	Y578 V579	Y578-R656 HydrophobicContact CD1-CG 4.07Å; V579-R656 WeakPolarHBondContact O-CA 3.45Å
657	I	92.1	Very high	80	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.015	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	141.2	173.6	-173.3	172.6	0	0	0	109.6	F497 V499 V500 L502 I513 Y578 V579	F497-I657 HydrophobicContact CB-CB 4.2Å; F497-I657 HydrophobicContact CB-CD1 4.44Å; F497-I657 HydrophobicContact CD1-CB 4.22Å; F497-I657 HydrophobicContact CD1-CG2 3.88Å; F497-I657 HydrophobicContact CD2-CB 3.69Å; F497-I657 HydrophobicContact CD2-CG2 3.82Å; F497-I657 HydrophobicContact CE1-CG2 3.77Å; F497-I657 HydrophobicContact CE2-CB 4.04Å; F497-I657 HydrophobicContact CE2-CG2 3.68Å; F497-I657 HydrophobicContact CG-CB 3.78Å; F497-I657 HydrophobicContact CG-CG2 3.91Å; F497-I657 HydrophobicContact CZ-CB 4.47Å; F497-I657 HydrophobicContact CZ-CG2 3.67Å; V499-I657 HydrophobicContact CG2-CD1 3.87Å; V499-I657 WeakPolarHBondContact O-CD1 3.22Å; V499-I657 WeakPolarHBondContact O-CG1 3.41Å; V500-I657 WeakPolarHBondContact O-CA 3.38Å; L502-I657 HydrophobicContact CB-CD1 3.91Å; L502-I657 HydrophobicContact CB-CG1 4.48Å; I513-I657 HydrophobicContact CG2-CD1 3.96Å; I513-I657 HydrophobicContact CG2-CG2 4.01Å; Y578-I657 VanDerWaalsContact CA-O 3.23Å; Y578-I657 WeakPolarHBondContact CA-O 3.31Å; V579-I657 HydrophobicContact CB-CG2 3.75Å; V579-I657 HydrophobicContact CG2-CG2 4.42Å; V579-I657 PolarHBondContact N-O 3.34Å; V579-I657 PolarHBondContact O-N 3.38Å
658	K	92.7	Very high	80.3	Confident	56 Å²	56	64.5 Å²	64.5	24%	0.243	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126.5	170.1	-175.9	-171.9	174.2	-167.9	0	108.9	V500 D501 L502 Y576 Y578	V500-K658 PolarHBondContact O-N 2.71Å; D501-K658 CarbonylContact C-O 3.59Å; D501-K658 VanDerWaalsContact CA-O 3.32Å; D501-K658 WeakPolarHBondContact CA-O 3.27Å; D501-K658 VanDerWaalsContact OD1-CB 3.24Å; D501-K658 WeakPolarHBondContact OD1-CB 3.13Å; L502-K658 PolarHBondContact N-O 3.27Å; Y576-K658 HydrophobicContact CD2-CD 4.22Å; Y576-K658 HydrophobicContact CD2-CG 3.98Å; Y576-K658 HydrophobicContact CG-CD 4.29Å; Y576-K658 HydrophobicContact CG-CG 4.19Å; Y578-K658 HydrophobicContact CD1-CB 3.75Å; Y578-K658 HydrophobicContact CD1-CG 4.1Å; Y578-K658 HydrophobicContact CE1-CB 3.6Å; Y578-K658 HydrophobicContact CE1-CD 4.21Å; Y578-K658 HydrophobicContact CE1-CG 3.68Å
659	I	92.2	Very high	80	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	114.5	176.4	-61.9	151.1	0	0	0	106.9	L502 V504 I513 Y576 F577 V579	L502-I659 HydrophobicContact CB-CG1 4.37Å; L502-I659 CarbonylContact O-C 3.58Å; L502-I659 VanDerWaalsContact O-CA 3.31Å; L502-I659 WeakPolarHBondContact O-CA 3.28Å; V504-I659 HydrophobicContact CG1-CG2 4.32Å; V504-I659 HydrophobicContact CG2-CG2 3.72Å; I513-I659 HydrophobicContact CD1-CD1 3.54Å; I513-I659 HydrophobicContact CG1-CD1 3.74Å; I513-I659 HydrophobicContact CG1-CG1 4.3Å; Y576-I659 CarbonylContact C-O 3.59Å; Y576-I659 WeakPolarHBondContact CA-O 3.29Å; Y576-I659 VanDerWaalsContact CB-O 3.27Å; Y576-I659 WeakPolarHBondContact CB-O 3.47Å; F577-I659 HydrophobicContact CD1-CB 4.13Å; F577-I659 HydrophobicContact CD1-CG2 4.27Å; F577-I659 HydrophobicContact CD2-CD1 4.13Å; F577-I659 HydrophobicContact CE1-CB 3.73Å; F577-I659 HydrophobicContact CE1-CD1 4.29Å; F577-I659 HydrophobicContact CE1-CG2 3.5Å; F577-I659 VanDerWaalsContact CE1-CG2 3.5Å; F577-I659 HydrophobicContact CE2-CB 4.19Å; F577-I659 HydrophobicContact CE2-CD1 3.35Å; F577-I659 HydrophobicContact CE2-CG1 4.4Å; F577-I659 HydrophobicContact CZ-CB 3.77Å; F577-I659 HydrophobicContact CZ-CD1 3.45Å; F577-I659 VanDerWaalsContact CZ-CD1 3.45Å; F577-I659 HydrophobicContact CZ-CG1 4.24Å; F577-I659 HydrophobicContact CZ-CG2 3.69Å; F577-I659 PolarHBondContact N-O 3.12Å; F577-I659 PolarHBondContact O-N 3.45Å; V579-I659 HydrophobicContact CB-CD1 4.42Å; V579-I659 HydrophobicContact CG2-CD1 3.4Å
660	T	89.2	Confident	79.3	Confident	21 Å²	21	63.5 Å²	63.5	13%	0.129	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	115.8	176.5	-52.9	0	0	0	0	108.3	L502 T503 V504 E575 T662	L502-T660 PolarHBondContact O-N 2.7Å; T503-T660 WeakPolarHBondContact CA-O 3.33Å; V504-T660 PolarHBondContact N-O 3.28Å; E575-T660 CarbonylContact O-C 3.59Å; E575-T660 VanDerWaalsContact O-CA 3.32Å; E575-T660 WeakPolarHBondContact O-CA 3.19Å; T660-T662 HydrophobicContact CG2-CG2 4.11Å
661	I	85.2	Confident	78.6	Confident	17 Å²	17	55 Å²	55	9%	0.087	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	121.9	171.8	-55.3	171.4	0	0	0	106.8	V504 E506 A536 V565 S574 E575 F577	V504-I661 HydrophobicContact CG2-CG1 4.26Å; E506-I661 HydrophobicContact CB-CG2 3.92Å; E506-I661 HydrophobicContact CG-CG2 4.42Å; A536-I661 HydrophobicContact CB-CD1 4.32Å; V565-I661 HydrophobicContact CG1-CD1 4.05Å; V565-I661 HydrophobicContact CG1-CG1 4.38Å; V565-I661 HydrophobicContact CG1-CG2 4.42Å; S574-I661 WeakPolarHBondContact CA-O 3.33Å; E575-I661 PolarHBondContact N-O 3.01Å; E575-I661 PolarHBondContact O-N 3.19Å; F577-I661 HydrophobicContact CD1-CD1 4.15Å; F577-I661 HydrophobicContact CD1-CG1 4.4Å; F577-I661 HydrophobicContact CE1-CD1 4.09Å; F577-I661 HydrophobicContact CE1-CG1 4.19Å
662	T	79	Confident	77.6	Confident	36 Å²	36	55 Å²	55	22%	0.221	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	158.8	177.9	52.1	0	0	0	0	110.3	T503 V504 S505 E506 T660	T503-T662 HydrophobicContact CG2-CG2 3.35Å; T503-T662 WeakPolarHBondContact CG2-OG1 3.42Å; V504-T662 PolarHBondContact O-N 3.32Å; V504-T662 PolarHBondContact O-OG1 3.11Å; S505-T662 CarbonylContact C-O 3.59Å; S505-T662 WeakPolarHBondContact CA-O 3.44Å; E506-T662 PolarHBondContact N-O 3.48Å; T660-T662 HydrophobicContact CG2-CG2 4.11Å
663	E	70.8	Confident	76.7	Confident	51 Å²	51	58.1 Å²	58.1	24%	0.238	28%	0.282	C	S	.	.			trans	-53.5	149.7	175	-61.3	169.8	-159.3	0	0	111.3	Y571 T665	Y571-E663 VanDerWaalsContact CE2-CD 3.4Å; Y571-E663 HydrophobicContact CE2-CG 4.42Å; Y571-E663 WeakPolarHBondContact CE2-OE1 2.96Å; Y571-E663 PolarHBondContact OH-OE1 3.41Å; E663-T665 PolarHBondContact O-N 2.92Å
664	S	67.5	Low	75.9	Confident	22 Å²	22	49 Å²	49	15%	0.154	24%	0.24	C	C	.	.			trans	-54.9	125.2	170.2	170.7	0	0	0	0	110.9	S505 E666 F667 K668	S505-S664 VanDerWaalsContact OG-CA 3.26Å; S505-S664 WeakPolarHBondContact OG-CA 3.25Å; S664-E666 PolarHBondContact O-N 2.73Å; S664-E666 PolarHBondContact OG-N 3.33Å; S664-F667 WeakPolarHBondContact O-CB 3.46Å; S664-F667 PolarHBondContact O-N 3.29Å; S664-F667 VanDerWaalsContact O-N 3.12Å; S664-F667 PolarHBondContact OG-N 3.08Å; S664-K668 PolarHBondContact O-N 3.03Å
665	T	65.6	Low	74.9	Confident	94 Å²	94	47.3 Å²	47.3	58%	0.577	23%	0.234	S	C	*	.	H	α-helix	trans	-60.6	-34.6	176.3	50.9	0	0	0	0	111.4	E663 N669	E663-T665 PolarHBondContact O-N 2.92Å; T665-N669 VanDerWaalsContact O-CB 3.26Å; T665-N669 WeakPolarHBondContact O-CB 3.48Å; T665-N669 PolarHBondContact O-N 2.85Å; T665-N669 PolarHBondContact O-ND2 3.41Å; T665-N669 VanDerWaalsContact O-ND2 3.16Å
666	E	64.8	Low	73.6	Confident	142 Å²	142	53.7 Å²	53.7	66%	0.664	26%	0.258	S	S	*	.	H	α-helix	trans	-63.1	-48.2	172.6	-65.7	-172.1	160.7	0	0	111.1	S664 N669 T670	S664-E666 PolarHBondContact O-N 2.73Å; S664-E666 PolarHBondContact OG-N 3.33Å; E666-N669 PolarHBondContact O-N 3.41Å; E666-T670 WeakPolarHBondContact O-CB 3.38Å; E666-T670 PolarHBondContact O-N 3.15Å; E666-T670 PolarHBondContact O-OG1 3.48Å
667	F	67.4	Low	72	Confident	31 Å²	31	50.2 Å²	50.2	14%	0.136	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-47	178.2	179.3	-104.1	0	0	0	111.9	V294 I297 Y571 S664 N669 T670 V671	V294-F667 HydrophobicContact CB-CZ 4.38Å; V294-F667 HydrophobicContact CG1-CE1 4.41Å; V294-F667 HydrophobicContact CG1-CZ 4.25Å; V294-F667 HydrophobicContact CG2-CE1 3.99Å; V294-F667 HydrophobicContact CG2-CZ 4.04Å; I297-F667 HydrophobicContact CB-CE2 3.93Å; I297-F667 HydrophobicContact CB-CZ 4.41Å; I297-F667 HydrophobicContact CD1-CD2 4.39Å; I297-F667 HydrophobicContact CD1-CE2 3.56Å; I297-F667 HydrophobicContact CD1-CZ 4.13Å; I297-F667 HydrophobicContact CG1-CE2 4.33Å; I297-F667 HydrophobicContact CG2-CD2 4.38Å; I297-F667 HydrophobicContact CG2-CE2 3.53Å; I297-F667 HydrophobicContact CG2-CZ 4.4Å; Y571-F667 HydrophobicContact CD2-CE1 4.39Å; S664-F667 WeakPolarHBondContact O-CB 3.46Å; S664-F667 PolarHBondContact O-N 3.29Å; S664-F667 VanDerWaalsContact O-N 3.12Å; S664-F667 PolarHBondContact OG-N 3.08Å; F667-N669 PolarHBondContact O-N 2.86Å; F667-T670 WeakPolarHBondContact O-CB 3.48Å; F667-T670 PolarHBondContact O-N 2.83Å; F667-V671 HydrophobicContact CD1-CG2 4.29Å; F667-V671 HydrophobicContact CE1-CG2 3.89Å; F667-V671 HydrophobicContact CE2-CG2 4.1Å; F667-V671 HydrophobicContact CZ-CG2 3.79Å; F667-V671 WeakPolarHBondContact O-CG2 3.48Å; F667-V671 PolarHBondContact O-N 3.38Å
668	K	65.2	Low	70.1	Confident	100 Å²	100	51.1 Å²	51.1	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-59.2	-47.4	176.6	-179.6	178.7	175.8	178.8	0	111.6	S664 T670 V671 D672	S664-K668 PolarHBondContact O-N 3.03Å; K668-T670 VanDerWaalsContact C-N 3.3Å; K668-T670 PolarHBondContact O-N 3.07Å; K668-V671 PolarHBondContact O-N 3.02Å; K668-D672 WeakPolarHBondContact O-CB 3.32Å; K668-D672 PolarHBondContact O-N 3.2Å; K668-D672 VanDerWaalsContact O-OD1 3.11Å
669	N	65.5	Low	68.3	Low	103 Å²	103	50 Å²	50	55%	0.551	25%	0.254	S	S	*	.	H	α-helix	trans	-62.8	-37.8	177.6	-73.2	-21.9	0	0	0	111.9	T665 E666 F667 D672 R673	T665-N669 VanDerWaalsContact O-CB 3.26Å; T665-N669 WeakPolarHBondContact O-CB 3.48Å; T665-N669 PolarHBondContact O-N 2.85Å; T665-N669 PolarHBondContact O-ND2 3.41Å; T665-N669 VanDerWaalsContact O-ND2 3.16Å; E666-N669 PolarHBondContact O-N 3.41Å; F667-N669 PolarHBondContact O-N 2.86Å; N669-D672 PolarHBondContact O-N 3.44Å; N669-R673 VanDerWaalsContact O-CB 3.29Å; N669-R673 WeakPolarHBondContact O-CB 3.45Å; N669-R673 PolarHBondContact O-N 2.93Å
670	T	67.6	Low	66.4	Low	12 Å²	12	50.8 Å²	50.8	7%	0.074	26%	0.258	C	S	.	.	H	α-helix	trans	-63.9	-46.5	173.4	-79	0	0	0	0	112.1	M309 E313 E666 F667 K668 D672 R673 L674	M309-T670 HydrophobicContact CE-CG2 3.67Å; M309-T670 WeakPolarHBondContact CE-OG1 3.21Å; E313-T670 HydrophobicContact CG-CG2 3.52Å; E313-T670 WeakPolarHBondContact OE1-CB 3.34Å; E313-T670 WeakPolarHBondContact OE1-CG2 3.44Å; E313-T670 PolarHBondContact OE1-OG1 3.39Å; E666-T670 WeakPolarHBondContact O-CB 3.38Å; E666-T670 PolarHBondContact O-N 3.15Å; E666-T670 PolarHBondContact O-OG1 3.48Å; F667-T670 WeakPolarHBondContact O-CB 3.48Å; F667-T670 PolarHBondContact O-N 2.83Å; K668-T670 VanDerWaalsContact C-N 3.3Å; K668-T670 PolarHBondContact O-N 3.07Å; T670-D672 PolarHBondContact O-N 2.98Å; T670-R673 WeakPolarHBondContact O-CB 3.31Å; T670-R673 PolarHBondContact O-N 2.64Å; T670-L674 HydrophobicContact CG2-CD1 3.97Å; T670-L674 HydrophobicContact CG2-CG 4.37Å; T670-L674 WeakPolarHBondContact O-CB 3.49Å; T670-L674 WeakPolarHBondContact O-CG 3.39Å; T670-L674 PolarHBondContact O-N 3.01Å
671	V	68.4	Low	64.6	Low	2 Å²	2	50.4 Å²	50.4	1%	0.012	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-44.5	176.5	173	0	0	0	0	110.4	R290 V294 I297 F667 K668 R673 L674 V675	R290-V671 HydrophobicContact CB-CG1 4.4Å; V294-V671 HydrophobicContact CG2-CG1 4.14Å; V294-V671 HydrophobicContact CG2-CG2 3.99Å; I297-V671 HydrophobicContact CD1-CG2 3.93Å; F667-V671 HydrophobicContact CD1-CG2 4.29Å; F667-V671 HydrophobicContact CE1-CG2 3.89Å; F667-V671 HydrophobicContact CE2-CG2 4.1Å; F667-V671 HydrophobicContact CZ-CG2 3.79Å; F667-V671 WeakPolarHBondContact O-CG2 3.48Å; F667-V671 PolarHBondContact O-N 3.38Å; K668-V671 PolarHBondContact O-N 3.02Å; V671-R673 VanDerWaalsContact C-N 3.27Å; V671-R673 PolarHBondContact O-N 3.05Å; V671-L674 PolarHBondContact O-N 3.4Å; V671-V675 HydrophobicContact CG1-CG2 4.16Å; V671-V675 WeakPolarHBondContact O-CB 3.38Å; V671-V675 WeakPolarHBondContact O-CG2 3.37Å; V671-V675 PolarHBondContact O-N 3.19Å
672	D	64.9	Low	63.2	Low	42 Å²	42	53 Å²	53	23%	0.225	27%	0.271	C	S	.	.	H	α-helix	trans	-58.8	-40.3	176.3	-71.4	7.8	0	0	0	111.8	R290 K668 N669 T670 K676	R290-D672 IonicContact CZ-OD1 2.74Å; R290-D672 IonicContact NH1-OD1 2.99Å; R290-D672 PolarHBondContact NH1-OD1 3.39Å; R290-D672 IonicContact NH2-OD1 2.7Å; R290-D672 PolarHBondContact NH2-OD1 3.35Å; K668-D672 WeakPolarHBondContact O-CB 3.32Å; K668-D672 PolarHBondContact O-N 3.2Å; K668-D672 VanDerWaalsContact O-OD1 3.11Å; N669-D672 PolarHBondContact O-N 3.44Å; T670-D672 PolarHBondContact O-N 2.98Å; D672-K676 WeakPolarHBondContact O-CG 3.41Å; D672-K676 PolarHBondContact O-N 3.08Å
673	R	65.2	Low	62.3	Low	81 Å²	81	51.5 Å²	51.5	31%	0.306	26%	0.262	S	S	.	.	H	α-helix	trans	-65.6	-48.8	174.8	177.4	170.4	66.3	174.1	-4.4	111.5	E313 D359 N669 T670 V671 V675 K676 Q677	E313-R673 IonicContact OE1-CZ 3.47Å; E313-R673 IonicContact OE1-NH2 2.71Å; E313-R673 PolarHBondContact OE1-NH2 3.22Å; E313-R673 IonicContact OE2-CZ 3.17Å; E313-R673 IonicContact OE2-NH2 2.8Å; E313-R673 PolarHBondContact OE2-NH2 2.9Å; D359-R673 IonicContact OD1-NH1 3.4Å; N669-R673 VanDerWaalsContact O-CB 3.29Å; N669-R673 WeakPolarHBondContact O-CB 3.45Å; N669-R673 PolarHBondContact O-N 2.93Å; T670-R673 WeakPolarHBondContact O-CB 3.31Å; T670-R673 PolarHBondContact O-N 2.64Å; V671-R673 VanDerWaalsContact C-N 3.27Å; V671-R673 PolarHBondContact O-N 3.05Å; R673-V675 PolarHBondContact O-N 3.46Å; R673-K676 PolarHBondContact O-N 3.39Å; R673-Q677 HydrophobicContact CG-CG 4.43Å; R673-Q677 WeakPolarHBondContact O-CB 3.22Å; R673-Q677 VanDerWaalsContact O-CG 3.29Å; R673-Q677 WeakPolarHBondContact O-CG 3.29Å; R673-Q677 PolarHBondContact O-N 3.37Å
674	L	65.8	Low	62	Low	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-40.5	-179.1	-74.7	176.2	0	0	0	112.3	Y293 I297 E313 A316 Q317 M355 T670 V671 K676 Q677 G678	Y293-L674 HydrophobicContact CD1-CB 3.79Å; Y293-L674 HydrophobicContact CD1-CD1 3.95Å; Y293-L674 HydrophobicContact CD1-CG 4.44Å; Y293-L674 HydrophobicContact CE1-CB 3.77Å; Y293-L674 HydrophobicContact CE1-CD1 4.36Å; Y293-L674 HydrophobicContact CE1-CG 4.49Å; Y293-L674 HydrophobicContact CG-CB 4.3Å; I297-L674 HydrophobicContact CD1-CD1 4.18Å; E313-L674 HydrophobicContact CB-CD1 4.5Å; E313-L674 HydrophobicContact CB-CD2 4.18Å; E313-L674 HydrophobicContact CG-CD1 4.26Å; A316-L674 HydrophobicContact CB-CD1 4.29Å; Q317-L674 HydrophobicContact CB-CD2 4.29Å; M355-L674 HydrophobicContact CE-CD2 4.01Å; T670-L674 HydrophobicContact CG2-CD1 3.97Å; T670-L674 HydrophobicContact CG2-CG 4.37Å; T670-L674 WeakPolarHBondContact O-CB 3.49Å; T670-L674 WeakPolarHBondContact O-CG 3.39Å; T670-L674 PolarHBondContact O-N 3.01Å; V671-L674 PolarHBondContact O-N 3.4Å; L674-K676 VanDerWaalsContact C-N 3.29Å; L674-K676 PolarHBondContact O-N 2.83Å; L674-Q677 PolarHBondContact O-N 3.14Å; L674-Q677 VanDerWaalsContact O-N 3.1Å; L674-G678 PolarHBondContact O-N 3.37Å
675	V	64.7	Low	61.9	Low	24 Å²	24	48.1 Å²	48.1	15%	0.145	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-36.7	176.7	172.8	0	0	0	0	111.2	F286 R290 Y293 V671 R673 Q677	F286-V675 HydrophobicContact CD2-CG1 3.9Å; F286-V675 HydrophobicContact CE2-CG1 3.4Å; F286-V675 HydrophobicContact CZ-CG1 4.05Å; R290-V675 HydrophobicContact CB-CG2 4.4Å; R290-V675 HydrophobicContact CG-CG1 4.48Å; R290-V675 HydrophobicContact CG-CG2 3.91Å; Y293-V675 HydrophobicContact CD2-CG2 3.56Å; Y293-V675 HydrophobicContact CE2-CG2 4.05Å; Y293-V675 HydrophobicContact CG-CG2 4.36Å; V671-V675 HydrophobicContact CG1-CG2 4.16Å; V671-V675 WeakPolarHBondContact O-CB 3.38Å; V671-V675 WeakPolarHBondContact O-CG2 3.37Å; V671-V675 PolarHBondContact O-N 3.19Å; R673-V675 PolarHBondContact O-N 3.46Å; V675-Q677 VanDerWaalsContact C-N 3.34Å
676	K	59.7	Low	62.5	Low	178 Å²	178	43.7 Å²	43.7	77%	0.774	22%	0.217	S	C	*	.	H	α-helix	trans	-71.9	-25.8	173.9	-72	175.3	-178.9	178.7	0	113.3	D672 R673 L674	D672-K676 WeakPolarHBondContact O-CG 3.41Å; D672-K676 PolarHBondContact O-N 3.08Å; R673-K676 PolarHBondContact O-N 3.39Å; L674-K676 VanDerWaalsContact C-N 3.29Å; L674-K676 PolarHBondContact O-N 2.83Å
677	Q	57.5	Low	63.1	Low	39 Å²	39	39.2 Å²	39.2	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-93.5	-13.8	-176.9	-72.5	175.4	-20.4	0	0	113.9	Q317 R673 L674 V675 T679	Q317-Q677 PolarHBondContact NE2-O 3.1Å; R673-Q677 HydrophobicContact CG-CG 4.43Å; R673-Q677 WeakPolarHBondContact O-CB 3.22Å; R673-Q677 VanDerWaalsContact O-CG 3.29Å; R673-Q677 WeakPolarHBondContact O-CG 3.29Å; R673-Q677 PolarHBondContact O-N 3.37Å; L674-Q677 PolarHBondContact O-N 3.14Å; L674-Q677 VanDerWaalsContact O-N 3.1Å; V675-Q677 VanDerWaalsContact C-N 3.34Å; Q677-T679 PolarHBondContact O-N 2.98Å
678	G	52.5	Low	64	Low	22 Å²	22	39.7 Å²	39.7	23%	0.227	21%	0.208	C	C	.	.			trans	-89	86.1	-164.1	0	0	0	0	0	116.4	Y293 L674	Y293-G678 VanDerWaalsContact OH-CA 3.26Å; Y293-G678 WeakPolarHBondContact OH-CA 3.34Å; L674-G678 PolarHBondContact O-N 3.37Å
679	T	55.4	Low	65.2	Low	32 Å²	32	40.8 Å²	40.8	20%	0.196	21%	0.209	C	C	.	.			trans	-138.3	131.7	164.5	-43.5	0	0	0	0	112.8	E92 Q677 A681 L682	E92-T679 PolarHBondContact OE1-OG1 2.9Å; Q677-T679 PolarHBondContact O-N 2.98Å; T679-A681 HydrophobicContact CG2-CB 4Å; T679-A681 PolarHBondContact O-N 2.91Å; T679-A681 VanDerWaalsContact O-N 3.08Å; T679-L682 VanDerWaalsContact O-CB 3.24Å; T679-L682 WeakPolarHBondContact O-CB 3.47Å; T679-L682 PolarHBondContact O-N 3.31Å
680	L	52.2	Low	66.2	Low	18 Å²	18	43.4 Å²	43.4	9%	0.094	22%	0.216	C	C	.	.	H	α-helix	trans	-46.6	-38.1	176.2	-167.1	81.7	0	0	0	113	L321 Y330 I346 L682 V683 V684	L321-L680 HydrophobicContact CD2-CB 4.4Å; Y330-L680 HydrophobicContact CD2-CD1 4.47Å; Y330-L680 HydrophobicContact CD2-CD2 4.46Å; I346-L680 HydrophobicContact CD1-CD1 3.81Å; L680-L682 VanDerWaalsContact C-N 3.28Å; L680-L682 PolarHBondContact O-N 3.35Å; L680-V683 PolarHBondContact O-N 3.26Å; L680-V684 HydrophobicContact CG-CG2 4.5Å; L680-V684 WeakPolarHBondContact O-CG2 3.25Å; L680-V684 PolarHBondContact O-N 3.5Å
681	A	52.1	Low	67	Low	13 Å²	13	43.4 Å²	43.4	11%	0.107	22%	0.215	C	C	.	.	H	α-helix	trans	-53.9	-41.3	176.1	0	0	0	0	0	114.2	S90 T679 V683 V684 G685	S90-A681 WeakPolarHBondContact OG-CB 3.17Å; T679-A681 HydrophobicContact CG2-CB 4Å; T679-A681 PolarHBondContact O-N 2.91Å; T679-A681 VanDerWaalsContact O-N 3.08Å; A681-V683 PolarHBondContact O-N 3.07Å; A681-V684 PolarHBondContact O-N 2.91Å; A681-G685 PolarHBondContact O-N 3.22Å
682	L	55.2	Low	68	Low	71 Å²	71	43.3 Å²	43.3	37%	0.372	21%	0.214	S	C	.	.	H	α-helix	trans	-63.8	-32.3	178.9	-148.7	95.7	0	0	0	110.3	R354 T679 L680	R354-L682 WeakPolarHBondContact CD-O 3.48Å; R354-L682 PolarHBondContact NE-O 3.02Å; R354-L682 PolarHBondContact NH1-O 3.47Å; R354-L682 PolarHBondContact NH2-O 2.99Å; T679-L682 VanDerWaalsContact O-CB 3.24Å; T679-L682 WeakPolarHBondContact O-CB 3.47Å; T679-L682 PolarHBondContact O-N 3.31Å; L680-L682 VanDerWaalsContact C-N 3.28Å; L680-L682 PolarHBondContact O-N 3.35Å
683	V	61.3	Low	69.2	Low	4 Å²	4	44 Å²	44	2%	0.024	22%	0.216	C	C	.	.	H	α-helix	trans	-87.3	-27.8	-178.5	-176.1	0	0	0	0	112.5	L321 I346 K350 V351 L680 A681	L321-V683 HydrophobicContact CD1-CG2 3.65Å; I346-V683 HydrophobicContact CB-CG1 4.28Å; I346-V683 HydrophobicContact CG1-CG1 3.97Å; I346-V683 HydrophobicContact CG2-CG1 4.15Å; K350-V683 WeakPolarHBondContact CD-O 3.32Å; K350-V683 WeakPolarHBondContact CE-O 3.33Å; K350-V683 PolarHBondContact NZ-O 3.16Å; V351-V683 HydrophobicContact CG2-CG1 3.99Å; V351-V683 HydrophobicContact CG2-CG2 4Å; L680-V683 PolarHBondContact O-N 3.26Å; A681-V683 PolarHBondContact O-N 3.07Å
684	V	62.8	Low	70.3	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-67.7	-42.9	176.4	167.8	0	0	0	0	111.3	A83 E86 M333 V345 K350 L680 A681	A83-V684 HydrophobicContact CB-CG1 4.18Å; E86-V684 HydrophobicContact CB-CG1 4.14Å; E86-V684 HydrophobicContact CG-CB 4.3Å; E86-V684 HydrophobicContact CG-CG1 4.08Å; E86-V684 HydrophobicContact CG-CG2 4.32Å; M333-V684 HydrophobicContact CE-CB 4.15Å; M333-V684 HydrophobicContact CE-CG1 3.19Å; M333-V684 HydrophobicContact CE-CG2 3.83Å; M333-V684 HydrophobicContact SD-CG1 3.51Å; M333-V684 VanDerWaalsContact SD-CG1 3.51Å; V345-V684 HydrophobicContact CG1-CG2 3.93Å; K350-V684 PolarHBondContact NZ-O 2.78Å; L680-V684 HydrophobicContact CG-CG2 4.5Å; L680-V684 WeakPolarHBondContact O-CG2 3.25Å; L680-V684 PolarHBondContact O-N 3.5Å; A681-V684 PolarHBondContact O-N 2.91Å
685	G	66.3	Low	71.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.225	C	C	.	.	S	Bend	trans	-64.2	149.7	-174.7	0	0	0	0	0	114.9	K350 R354 A681 T738	K350-G685 WeakPolarHBondContact CE-O 2.88Å; K350-G685 PolarHBondContact NZ-O 2.98Å; R354-G685 PolarHBondContact NH2-O 2.77Å; A681-G685 PolarHBondContact O-N 3.22Å; G685-T738 WeakPolarHBondContact CA-OG1 3.49Å
686	T	78	Confident	72.1	Confident	2 Å²	2	44 Å²	44	1%	0.012	22%	0.22	C	C	.	.			trans	-98.7	136.5	167.2	46.7	0	0	0	0	110.6	R80 Q692 P737 T738 D739	R80-T686 PolarHBondContact NH1-OG1 3.16Å; T686-Q692 HydrophobicContact CG2-CG 4.06Å; T686-Q692 PolarHBondContact OG1-NE2 3.3Å; T686-P737 VanDerWaalsContact O-CB 3.23Å; T686-P737 WeakPolarHBondContact O-CB 3.26Å; T686-T738 PolarHBondContact N-OG1 3.32Å; T686-T738 PolarHBondContact O-N 3.05Å; T686-T738 VanDerWaalsContact O-N 3.15Å; T686-T738 PolarHBondContact O-OG1 2.96Å; T686-D739 PolarHBondContact O-N 2.68Å
687	S	77.6	Confident	73.5	Confident	48 Å²	48	40.7 Å²	40.7	34%	0.336	21%	0.21	S	C	.	.			trans	-95.8	-29.9	-172.6	62.8	0	0	0	0	113.5	E691 D739	S687-E691 PolarHBondContact N-OE2 3.2Å; S687-E691 PolarHBondContact OG-OE2 2.95Å; S687-D739 WeakPolarHBondContact CA-OD2 3.32Å; S687-D739 VanDerWaalsContact CB-OD2 3.28Å; S687-D739 WeakPolarHBondContact CB-OD2 3.27Å
688	S	85.6	Confident	74.8	Confident	41 Å²	41	41.5 Å²	41.5	29%	0.287	22%	0.218	S	C	.	.			trans	-147.1	152.3	-173.1	64.6	0	0	0	0	112.5	K690 E691 Q692	S688-K690 PolarHBondContact O-N 3.38Å; S688-E691 WeakPolarHBondContact O-CB 3.47Å; S688-E691 PolarHBondContact O-N 3.04Å; S688-E691 VanDerWaalsContact O-N 3.13Å; S688-E691 WeakPolarHBondContact OG-CB 3.02Å; S688-E691 PolarHBondContact OG-N 3.28Å; S688-Q692 PolarHBondContact O-N 2.84Å
689	W	89.9	Confident	76.2	Confident	122 Å²	122	42.2 Å²	42.2	46%	0.462	22%	0.217	S	C	.	.	H	α-helix	trans	-58.3	-37.4	171.8	-74.8	-57	0	0	0	112	E691 Q692 F693 P737	W689-E691 VanDerWaalsContact C-N 3.25Å; W689-E691 PolarHBondContact O-N 3.13Å; W689-Q692 WeakPolarHBondContact O-CB 3.39Å; W689-Q692 PolarHBondContact O-N 2.75Å; W689-F693 HydrophobicContact CB-CD2 4.38Å; W689-F693 HydrophobicContact CB-CE2 4.41Å; W689-F693 VanDerWaalsContact O-CD2 3.25Å; W689-F693 WeakPolarHBondContact O-CD2 3.34Å; W689-F693 PolarHBondContact O-N 2.78Å; W689-P737 HydrophobicContact CG-CG 4.35Å
690	K	87.1	Confident	77.1	Confident	159 Å²	159	41.8 Å²	41.8	69%	0.691	22%	0.216	S	C	*	.	H	α-helix	trans	-54.1	-45.5	175.8	-178.3	-178.9	177.2	-176.6	0	111	S688 I694	S688-K690 PolarHBondContact O-N 3.38Å; K690-I694 HydrophobicContact CG-CD1 3.87Å; K690-I694 WeakPolarHBondContact O-CD1 3.2Å; K690-I694 WeakPolarHBondContact O-CG1 3.31Å; K690-I694 PolarHBondContact O-N 3.05Å; K690-I694 VanDerWaalsContact O-N 3.07Å
691	E	84.3	Confident	77.7	Confident	11 Å²	11	41.9 Å²	41.9	5%	0.051	22%	0.219	C	C	.	.	H	α-helix	trans	-61	-45.4	175.7	-173.2	-177.9	-175.8	0	0	111.4	K350 S687 S688 W689 F693 I694 E695	K350-E691 WeakPolarHBondContact CE-OE1 3.47Å; K350-E691 IonicContact NZ-OE1 2.93Å; S687-E691 PolarHBondContact N-OE2 3.2Å; S687-E691 PolarHBondContact OG-OE2 2.95Å; S688-E691 WeakPolarHBondContact O-CB 3.47Å; S688-E691 PolarHBondContact O-N 3.04Å; S688-E691 VanDerWaalsContact O-N 3.13Å; S688-E691 WeakPolarHBondContact OG-CB 3.02Å; S688-E691 PolarHBondContact OG-N 3.28Å; W689-E691 VanDerWaalsContact C-N 3.25Å; W689-E691 PolarHBondContact O-N 3.13Å; E691-F693 PolarHBondContact O-N 3.1Å; E691-I694 PolarHBondContact O-N 3.2Å; E691-E695 WeakPolarHBondContact O-CB 3.48Å; E691-E695 WeakPolarHBondContact O-CG 3.48Å; E691-E695 PolarHBondContact O-N 2.89Å
692	Q	89.1	Confident	78	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63	-41.9	179.9	-63.5	178.7	-40.5	0	0	113.1	T686 S688 W689 E695 A696 A733 V735	T686-Q692 HydrophobicContact CG2-CG 4.06Å; T686-Q692 PolarHBondContact OG1-NE2 3.3Å; S688-Q692 PolarHBondContact O-N 2.84Å; W689-Q692 WeakPolarHBondContact O-CB 3.39Å; W689-Q692 PolarHBondContact O-N 2.75Å; Q692-E695 PolarHBondContact O-N 2.95Å; Q692-A696 VanDerWaalsContact O-CB 3.29Å; Q692-A696 WeakPolarHBondContact O-CB 3.43Å; Q692-A696 PolarHBondContact O-N 3.41Å; Q692-A733 HydrophobicContact CB-CB 4.27Å; Q692-A733 PolarHBondContact OE1-O 3.42Å; Q692-A733 VanDerWaalsContact OE1-O 3.1Å; Q692-V735 PolarHBondContact NE2-O 3.21Å; Q692-V735 VanDerWaalsContact NE2-O 3.12Å; Q692-V735 PolarHBondContact OE1-O 3.1Å
693	F	91.3	Very high	77.9	Confident	58 Å²	58	40.4 Å²	40.4	25%	0.254	22%	0.222	S	C	.	.	H	α-helix	trans	-68	-38.5	176.6	-81.4	-75.7	0	0	0	112.2	W689 E691 A696 I697 V730 A733 F734	W689-F693 HydrophobicContact CB-CD2 4.38Å; W689-F693 HydrophobicContact CB-CE2 4.41Å; W689-F693 VanDerWaalsContact O-CD2 3.25Å; W689-F693 WeakPolarHBondContact O-CD2 3.34Å; W689-F693 PolarHBondContact O-N 2.78Å; E691-F693 PolarHBondContact O-N 3.1Å; F693-A696 PolarHBondContact O-N 3.19Å; F693-I697 WeakPolarHBondContact O-CD1 3.21Å; F693-I697 WeakPolarHBondContact O-CG1 3.41Å; F693-I697 PolarHBondContact O-N 3.47Å; F693-I697 VanDerWaalsContact O-N 3.14Å; F693-V730 HydrophobicContact CE1-CG1 4.4Å; F693-A733 HydrophobicContact CD1-CB 3.87Å; F693-A733 HydrophobicContact CD2-CB 4.39Å; F693-A733 HydrophobicContact CE1-CB 3.86Å; F693-A733 HydrophobicContact CE2-CB 4.36Å; F693-A733 HydrophobicContact CG-CB 4.14Å; F693-A733 HydrophobicContact CZ-CB 4.1Å; F693-F734 HydrophobicContact CE1-CD2 4.48Å; F693-F734 HydrophobicContact CE1-CE2 4.05Å; F693-F734 HydrophobicContact CE1-CZ 4.21Å; F693-F734 HydrophobicContact CZ-CD1 4.14Å; F693-F734 HydrophobicContact CZ-CD2 4.07Å; F693-F734 AromaticContact CZ-CE1 3.92Å; F693-F734 HydrophobicContact CZ-CE1 3.92Å; F693-F734 AromaticContact CZ-CE2 3.85Å; F693-F734 HydrophobicContact CZ-CE2 3.85Å; F693-F734 HydrophobicContact CZ-CG 4.22Å; F693-F734 AromaticContact CZ-CZ 3.78Å; F693-F734 HydrophobicContact CZ-CZ 3.78Å
694	I	87.4	Confident	77.3	Confident	76 Å²	76	45.4 Å²	45.4	39%	0.39	25%	0.249	S	C	.	.	H	α-helix	trans	-64.6	-47.9	175	-68.3	167.1	0	0	0	110.2	K690 E691 A696 I697 T698	K690-I694 HydrophobicContact CG-CD1 3.87Å; K690-I694 WeakPolarHBondContact O-CD1 3.2Å; K690-I694 WeakPolarHBondContact O-CG1 3.31Å; K690-I694 PolarHBondContact O-N 3.05Å; K690-I694 VanDerWaalsContact O-N 3.07Å; E691-I694 PolarHBondContact O-N 3.2Å; I694-A696 VanDerWaalsContact C-N 3.26Å; I694-A696 PolarHBondContact O-N 3.12Å; I694-I697 PolarHBondContact O-N 3.41Å; I694-T698 HydrophobicContact CG2-CG2 3.98Å; I694-T698 VanDerWaalsContact O-CB 3.31Å; I694-T698 WeakPolarHBondContact O-CB 3.25Å; I694-T698 VanDerWaalsContact O-CG2 3.22Å; I694-T698 WeakPolarHBondContact O-CG2 3.21Å; I694-T698 PolarHBondContact O-N 2.9Å; I694-T698 PolarHBondContact O-OG1 3.17Å
695	E	83.3	Confident	76.6	Confident	23 Å²	23	48.3 Å²	48.3	11%	0.107	27%	0.266	C	S	.	.	H	α-helix	trans	-58.5	-35.9	173.9	-73.9	-175.6	153.4	0	0	112.9	R80 R337 E691 Q692	R80-E695 IonicContact CZ-OE2 3.77Å; R80-E695 IonicContact NH1-OE2 3.65Å; R80-E695 IonicContact NH2-OE2 3.28Å; R80-E695 PolarHBondContact NH2-OE2 2.86Å; R80-E695 VanDerWaalsContact NH2-OE2 3.07Å; R337-E695 IonicContact NH2-OE1 2.66Å; R337-E695 IonicContact NH2-OE2 3.69Å; E691-E695 WeakPolarHBondContact O-CB 3.48Å; E691-E695 WeakPolarHBondContact O-CG 3.48Å; E691-E695 PolarHBondContact O-N 2.89Å; Q692-E695 PolarHBondContact O-N 2.95Å
696	A	86.6	Confident	75.6	Confident	5 Å²	5	54.4 Å²	54.4	4%	0.041	30%	0.299	C	S	.	.	H	α-helix	trans	-69.3	-35.6	-179.6	0	0	0	0	0	113.3	Q692 F693 I694 H722 K729 A733	Q692-A696 VanDerWaalsContact O-CB 3.29Å; Q692-A696 WeakPolarHBondContact O-CB 3.43Å; Q692-A696 PolarHBondContact O-N 3.41Å; F693-A696 PolarHBondContact O-N 3.19Å; I694-A696 VanDerWaalsContact C-N 3.26Å; I694-A696 PolarHBondContact O-N 3.12Å; A696-H722 PolarHBondContact O-CE1 2.81Å; A696-K729 HydrophobicContact CB-CB 3.93Å; A696-A733 HydrophobicContact CB-CB 4.18Å
697	I	87.5	Confident	73.8	Confident	108 Å²	108	58.2 Å²	58.2	55%	0.554	32%	0.32	S	S	*	.	H	α-helix	trans	-94.4	-23.8	-174.7	-60.8	165.4	0	0	0	111.5	F693 I694 H722 V730	F693-I697 WeakPolarHBondContact O-CD1 3.21Å; F693-I697 WeakPolarHBondContact O-CG1 3.41Å; F693-I697 PolarHBondContact O-N 3.47Å; F693-I697 VanDerWaalsContact O-N 3.14Å; I694-I697 PolarHBondContact O-N 3.41Å; I697-H722 PolarHBondContact O-CE1 2.88Å; I697-H722 PolarHBondContact O-NE2 3.25Å; I697-V730 HydrophobicContact CG1-CG2 4.41Å
698	T	84.5	Confident	72.1	Confident	57 Å²	57	62.1 Å²	62.1	35%	0.35	34%	0.337	S	S	.	.			trans	-81.8	139.6	179.5	52.2	0	0	0	0	112	I694 H722	I694-T698 HydrophobicContact CG2-CG2 3.98Å; I694-T698 VanDerWaalsContact O-CB 3.31Å; I694-T698 WeakPolarHBondContact O-CB 3.25Å; I694-T698 VanDerWaalsContact O-CG2 3.22Å; I694-T698 WeakPolarHBondContact O-CG2 3.21Å; I694-T698 PolarHBondContact O-N 2.9Å; I694-T698 PolarHBondContact O-OG1 3.17Å; T698-H722 PolarHBondContact O-CE1 3.32Å
699	V	82.9	Confident	69.8	Low	36 Å²	36	67.8 Å²	67.8	22%	0.218	36%	0.359	C	S	.	.			trans	-95.8	131.5	166.9	-172	0	0	0	0	107.3	P714 D718 Y719 H722	V699-P714 HydrophobicContact CG1-CB 3.71Å; V699-P714 HydrophobicContact CG1-CG 4.18Å; V699-D718 HydrophobicContact CG1-CB 4.28Å; V699-Y719 HydrophobicContact CB-CD1 4.45Å; V699-Y719 HydrophobicContact CB-CE1 4.17Å; V699-Y719 HydrophobicContact CG1-CD1 4.3Å; V699-Y719 HydrophobicContact CG1-CE1 4.26Å; V699-Y719 HydrophobicContact CG2-CD1 3.97Å; V699-Y719 HydrophobicContact CG2-CE1 4.02Å; V699-H722 HydrophobicContact CG2-CB 3.86Å; V699-H722 VanDerWaalsContact CG2-CG 3.47Å
700	S	73.6	Confident	67.8	Low	24 Å²	24	65.2 Å²	65.2	17%	0.168	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-129.8	142	173	-57.1	0	0	0	0	108.2	G343 K347	G343-S700 WeakPolarHBondContact CA-O 3.46Å; G343-S700 PolarHBondContact N-O 3.07Å; K347-S700 PolarHBondContact NZ-OG 3.35Å
701	A	66.5	Low	66.2	Low	19 Å²	19	64.9 Å²	64.9	16%	0.157	37%	0.371	C	S	.	.			trans	-67.3	144.1	173.3	0	0	0	0	0	110.9	G343 K712 P714	G343-A701 VanDerWaalsContact CA-O 3.32Å; G343-A701 WeakPolarHBondContact CA-O 3.39Å; A701-K712 HydrophobicContact CB-CB 4.06Å; A701-K712 WeakPolarHBondContact CB-O 3.29Å; A701-P714 HydrophobicContact CB-CB 4.45Å
702	G	56.7	Low	65	Low	33 Å²	33	69.2 Å²	69.2	34%	0.34	39%	0.39	S	S	.	.			trans	-87.8	133.3	161.6	0	0	0	0	0	109.6
703	G	54.5	Low	64.2	Low	21 Å²	21	76.8 Å²	76.8	22%	0.216	43%	0.429	C	S	.	.			trans	-173.4	152	175.2	0	0	0	0	0	110.1	N344 V705	N344-G703 PolarHBondContact ND2-O 3.16Å; G703-V705 PolarHBondContact O-N 3.49Å
704	D	48.2	Very low	63.5	Low	108 Å²	108	75.3 Å²	75.3	58%	0.578	43%	0.425	S	S	*	.			trans	-58.8	130.7	174.4	-65.8	-38.8	0	0	0	109.1	D706	D704-D706 HydrophobicContact CB-CB 4.44Å; D704-D706 PolarHBondContact O-N 3.31Å
705	V	47.6	Very low	63.1	Low	63 Å²	63	75.3 Å²	75.3	38%	0.382	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-5.1	176.2	-171.6	0	0	0	0	110.5	M318 N344 G703 D707	M318-V705 HydrophobicContact CE-CG1 4.32Å; N344-V705 WeakPolarHBondContact ND2-CG2 3.4Å; G703-V705 PolarHBondContact O-N 3.49Å; V705-D707 PolarHBondContact O-N 3.4Å
706	D	44.9	Very low	63.2	Low	128 Å²	128	79.4 Å²	79.4	68%	0.684	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-12.3	179.6	-61.8	-16.4	0	0	0	112.9	D704 D708	D704-D706 HydrophobicContact CB-CB 4.44Å; D704-D706 PolarHBondContact O-N 3.31Å; D706-D708 PolarHBondContact O-N 3.27Å
707	D	41	Very low	63	Low	83 Å²	83	85.6 Å²	85.6	44%	0.444	49%	0.489	S	S	.	.	S	Bend	trans	-85	110.1	166.8	-65.4	-32.2	0	0	0	108	V705 E709 K712	V705-D707 PolarHBondContact O-N 3.4Å; D707-E709 PolarHBondContact O-N 3.42Å; D707-K712 WeakPolarHBondContact OD2-CE 3.46Å; D707-K712 IonicContact OD2-NZ 2.77Å; D707-K712 PolarHBondContact OD2-NZ 2.74Å
708	D	41.7	Very low	62.8	Low	130 Å²	130	81.5 Å²	81.5	70%	0.695	47%	0.468	S	S	*	.	S	Bend	trans	-54.8	0.3	168.9	-79.3	-38.2	0	0	0	113.5	R303 D706	R303-D708 IonicContact CZ-OD2 3.74Å; R303-D708 IonicContact NH1-OD1 3.93Å; R303-D708 IonicContact NH1-OD2 2.81Å; R303-D708 PolarHBondContact NH1-OD2 2.72Å; D706-D708 PolarHBondContact O-N 3.27Å
709	E	37.1	Very low	63	Low	160 Å²	160	84.8 Å²	84.8	75%	0.748	48%	0.475	S	S	*	.	S	Bend	trans	-86.3	116.6	172.5	-63.2	-171.2	176.5	0	0	109.1	D707	D707-E709 PolarHBondContact O-N 3.42Å
710	G	47.4	Very low	63.2	Low	68 Å²	68	86.9 Å²	86.9	70%	0.701	49%	0.488	S	S	*	.			trans	-46	164.4	-173	0	0	0	0	0	116.1	K712	G710-K712 PolarHBondContact O-N 2.81Å
711	E	53.5	Low	63.8	Low	152 Å²	152	88.3 Å²	88.3	71%	0.71	49%	0.492	S	S	*	.	S	Bend	trans	-28.3	104.8	-174	-65.1	-171.2	166.2	0	0	113.1	L713	E711-L713 PolarHBondContact O-N 3.33Å
712	K	60.9	Low	64.9	Low	102 Å²	102	88.3 Å²	88.3	44%	0.443	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-50.5	141	176	-75	176.3	179.8	164.1	0	109	A701 D707 G710	A701-K712 HydrophobicContact CB-CB 4.06Å; A701-K712 WeakPolarHBondContact CB-O 3.29Å; D707-K712 WeakPolarHBondContact OD2-CE 3.46Å; D707-K712 IonicContact OD2-NZ 2.77Å; D707-K712 PolarHBondContact OD2-NZ 2.74Å; G710-K712 PolarHBondContact O-N 2.81Å
713	L	71.4	Confident	66.4	Low	159 Å²	159	94.5 Å²	94.5	83%	0.832	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-67.9	139.5	174.8	-72.8	163.8	0	0	0	109.7	E711	E711-L713 PolarHBondContact O-N 3.33Å
714	P	75.6	Confident	68.1	Low	27 Å²	27	97.5 Å²	97.5	18%	0.175	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-61.6	139.6	180	22.9	-32.8	0	0	0	111.6	V699 A701 D718 Y719	V699-P714 HydrophobicContact CG1-CB 3.71Å; V699-P714 HydrophobicContact CG1-CG 4.18Å; A701-P714 HydrophobicContact CB-CB 4.45Å; P714-D718 HydrophobicContact CB-CB 4.19Å; P714-Y719 HydrophobicContact CB-CD2 4.49Å; P714-Y719 HydrophobicContact CB-CE2 3.95Å; P714-Y719 HydrophobicContact CG-CE2 3.65Å; P714-Y719 WeakPolarHBondContact CG-OH 2.97Å
715	T	80.9	Confident	70.2	Confident	76 Å²	76	92.3 Å²	92.3	47%	0.466	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-75.5	160.6	179	69.9	0	0	0	0	111	M717 D718 Y719	T715-M717 PolarHBondContact O-N 3.17Å; T715-D718 WeakPolarHBondContact CB-OD2 3.35Å; T715-D718 PolarHBondContact N-OD2 3.28Å; T715-D718 WeakPolarHBondContact O-CB 3.27Å; T715-D718 PolarHBondContact O-N 3.03Å; T715-D718 PolarHBondContact OG1-N 2.99Å; T715-D718 PolarHBondContact OG1-OD2 3.4Å; T715-Y719 WeakPolarHBondContact O-CD2 3.26Å; T715-Y719 PolarHBondContact O-N 3.28Å
716	C	84.6	Confident	72.3	Confident	109 Å²	109	91.4 Å²	91.4	74%	0.736	48%	0.484	S	S	*	.	H	α-helix	trans	-56.1	-33.7	174.8	-61.4	0	0	0	0	112.6	D718 Y719 V720	C716-D718 VanDerWaalsContact C-N 3.34Å; C716-Y719 PolarHBondContact O-N 3.2Å; C716-V720 WeakPolarHBondContact O-CG2 3.01Å; C716-V720 PolarHBondContact O-N 3.31Å
717	M	82.3	Confident	74.7	Confident	134 Å²	134	90.8 Å²	90.8	66%	0.66	48%	0.475	S	S	*	.	H	α-helix	trans	-68.4	-34.1	177.3	-68.2	-63.8	-82.7	0	0	111.8	T715 Y719 V720 M721	T715-M717 PolarHBondContact O-N 3.17Å; M717-Y719 VanDerWaalsContact C-N 3.34Å; M717-Y719 PolarHBondContact O-N 3.46Å; M717-V720 PolarHBondContact O-N 3.48Å; M717-M721 WeakPolarHBondContact O-CB 3.47Å; M717-M721 WeakPolarHBondContact O-CG 3.42Å; M717-M721 PolarHBondContact O-N 3.49Å
718	D	83.9	Confident	77.2	Confident	22 Å²	22	87.7 Å²	87.7	12%	0.118	46%	0.458	C	S	.	.	H	α-helix	trans	-64.1	-40.7	176	-60.4	-43.3	0	0	0	111.2	V699 P714 T715 C716 H722	V699-D718 HydrophobicContact CG1-CB 4.28Å; P714-D718 HydrophobicContact CB-CB 4.19Å; T715-D718 WeakPolarHBondContact CB-OD2 3.35Å; T715-D718 PolarHBondContact N-OD2 3.28Å; T715-D718 WeakPolarHBondContact O-CB 3.27Å; T715-D718 PolarHBondContact O-N 3.03Å; T715-D718 PolarHBondContact OG1-N 2.99Å; T715-D718 PolarHBondContact OG1-OD2 3.4Å; C716-D718 VanDerWaalsContact C-N 3.34Å; D718-H722 WeakPolarHBondContact O-CB 3.43Å; D718-H722 PolarHBondContact O-N 3.43Å
719	Y	87	Confident	79.6	Confident	127 Å²	127	82.1 Å²	82.1	50%	0.498	43%	0.427	S	S	.	.	H	α-helix	trans	-64.7	-42.4	175.1	-75.5	-74.6	0	0	0	112.7	V699 P714 T715 C716 M717 H722 F723	V699-Y719 HydrophobicContact CB-CD1 4.45Å; V699-Y719 HydrophobicContact CB-CE1 4.17Å; V699-Y719 HydrophobicContact CG1-CD1 4.3Å; V699-Y719 HydrophobicContact CG1-CE1 4.26Å; V699-Y719 HydrophobicContact CG2-CD1 3.97Å; V699-Y719 HydrophobicContact CG2-CE1 4.02Å; P714-Y719 HydrophobicContact CB-CD2 4.49Å; P714-Y719 HydrophobicContact CB-CE2 3.95Å; P714-Y719 HydrophobicContact CG-CE2 3.65Å; P714-Y719 WeakPolarHBondContact CG-OH 2.97Å; T715-Y719 WeakPolarHBondContact O-CD2 3.26Å; T715-Y719 PolarHBondContact O-N 3.28Å; C716-Y719 PolarHBondContact O-N 3.2Å; M717-Y719 VanDerWaalsContact C-N 3.34Å; M717-Y719 PolarHBondContact O-N 3.46Å; Y719-H722 PolarHBondContact O-N 3.46Å; Y719-F723 WeakPolarHBondContact O-CB 3.28Å; Y719-F723 PolarHBondContact O-N 3.36Å
720	V	88.4	Confident	82.3	Confident	80 Å²	80	76.9 Å²	76.9	49%	0.485	41%	0.406	S	S	.	.	H	α-helix	trans	-63.7	-47.9	177.5	173.5	0	0	0	0	110.5	C716 M717 H722 F723 L724	C716-V720 WeakPolarHBondContact O-CG2 3.01Å; C716-V720 PolarHBondContact O-N 3.31Å; M717-V720 PolarHBondContact O-N 3.48Å; V720-H722 VanDerWaalsContact C-N 3.33Å; V720-H722 PolarHBondContact O-N 2.96Å; V720-F723 PolarHBondContact O-N 2.92Å; V720-L724 HydrophobicContact CG1-CD1 4.32Å; V720-L724 WeakPolarHBondContact O-CG 3.45Å; V720-L724 PolarHBondContact O-N 3.32Å
721	M	85.9	Confident	84.6	Confident	54 Å²	54	77.4 Å²	77.4	27%	0.266	39%	0.392	S	S	.	.	H	α-helix	trans	-64.9	-38.5	177.7	-70.2	-54.8	-65.9	0	0	111.8	L72 L339 M717 L724 T725	L72-M721 HydrophobicContact CD1-CE 4.39Å; L339-M721 VanDerWaalsContact O-CB 3.27Å; L339-M721 WeakPolarHBondContact O-CB 3.42Å; L339-M721 WeakPolarHBondContact O-CE 3.2Å; L339-M721 WeakPolarHBondContact O-CG 3.21Å; M717-M721 WeakPolarHBondContact O-CB 3.47Å; M717-M721 WeakPolarHBondContact O-CG 3.42Å; M717-M721 PolarHBondContact O-N 3.49Å; M721-L724 PolarHBondContact O-N 3.44Å; M721-L724 HydrophobicContact SD-CD1 4.47Å; M721-T725 WeakPolarHBondContact O-CB 3.37Å; M721-T725 WeakPolarHBondContact O-CG2 3.49Å; M721-T725 PolarHBondContact O-N 3.03Å; M721-T725 PolarHBondContact O-OG1 2.7Å
722	H	88.5	Confident	86.5	Confident	19 Å²	19	70.4 Å²	70.4	9%	0.088	36%	0.36	C	S	.	.	H	α-helix	trans	-61.6	-46.7	173.8	-176.1	99.6	0	0	0	111.2	A696 I697 T698 V699 D718 Y719 V720 L724 T725 V726 K729	A696-H722 PolarHBondContact O-CE1 2.81Å; I697-H722 PolarHBondContact O-CE1 2.88Å; I697-H722 PolarHBondContact O-NE2 3.25Å; T698-H722 PolarHBondContact O-CE1 3.32Å; V699-H722 HydrophobicContact CG2-CB 3.86Å; V699-H722 VanDerWaalsContact CG2-CG 3.47Å; D718-H722 WeakPolarHBondContact O-CB 3.43Å; D718-H722 PolarHBondContact O-N 3.43Å; Y719-H722 PolarHBondContact O-N 3.46Å; V720-H722 VanDerWaalsContact C-N 3.33Å; V720-H722 PolarHBondContact O-N 2.96Å; H722-L724 VanDerWaalsContact C-N 3.33Å; H722-L724 PolarHBondContact O-N 3.12Å; H722-T725 WeakPolarHBondContact CA-OG1 3.28Å; H722-T725 CarbonylContact O-C 3.53Å; H722-T725 PolarHBondContact O-N 2.96Å; H722-T725 VanDerWaalsContact O-N 3.11Å; H722-T725 PolarHBondContact O-OG1 2.73Å; H722-T725 VanDerWaalsContact O-OG1 3.12Å; H722-V726 WeakPolarHBondContact O-CA 3.47Å; H722-V726 WeakPolarHBondContact O-CB 3.24Å; H722-V726 PolarHBondContact O-N 3.33Å; H722-K729 PolarHBondContact ND1-NZ 3.3Å; H722-K729 VanDerWaalsContact ND1-NZ 3.13Å
723	F	90	Very high	88	Confident	162 Å²	162	65.6 Å²	65.6	71%	0.711	34%	0.339	S	S	*	.	H	α-helix	trans	-60.6	-40.5	178.5	-178.8	-97.5	0	0	0	112.6	Y719 V720 T725 V726	Y719-F723 WeakPolarHBondContact O-CB 3.28Å; Y719-F723 PolarHBondContact O-N 3.36Å; V720-F723 PolarHBondContact O-N 2.92Å; F723-T725 VanDerWaalsContact C-N 3.32Å; F723-T725 PolarHBondContact O-N 2.98Å; F723-V726 WeakPolarHBondContact O-CG1 3.32Å
724	L	89.9	Confident	89.1	Confident	84 Å²	84	64.5 Å²	64.5	44%	0.44	33%	0.328	S	S	.	.	H	α-helix	trans	-68	-32.1	176	-68	175.4	0	0	0	112.7	Y69 L72 V720 M721 H722	Y69-L724 WeakPolarHBondContact CE2-O 3.08Å; L72-L724 HydrophobicContact CD2-CB 4.39Å; V720-L724 HydrophobicContact CG1-CD1 4.32Å; V720-L724 WeakPolarHBondContact O-CG 3.45Å; V720-L724 PolarHBondContact O-N 3.32Å; M721-L724 PolarHBondContact O-N 3.44Å; M721-L724 HydrophobicContact SD-CD1 4.47Å; H722-L724 VanDerWaalsContact C-N 3.33Å; H722-L724 PolarHBondContact O-N 3.12Å
725	T	91.1	Very high	90	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-94.9	-14.8	-174.6	56.2	0	0	0	0	114	L72 I76 T340 M721 H722 F723 F727 W728 K729	L72-T725 HydrophobicContact CD1-CG2 3.61Å; L72-T725 HydrophobicContact CD2-CG2 3.52Å; L72-T725 HydrophobicContact CG-CG2 3.66Å; I76-T725 HydrophobicContact CD1-CG2 3.92Å; T340-T725 HydrophobicContact CG2-CG2 3.93Å; T340-T725 PolarHBondContact O-OG1 3.26Å; M721-T725 WeakPolarHBondContact O-CB 3.37Å; M721-T725 WeakPolarHBondContact O-CG2 3.49Å; M721-T725 PolarHBondContact O-N 3.03Å; M721-T725 PolarHBondContact O-OG1 2.7Å; H722-T725 WeakPolarHBondContact CA-OG1 3.28Å; H722-T725 CarbonylContact O-C 3.53Å; H722-T725 PolarHBondContact O-N 2.96Å; H722-T725 VanDerWaalsContact O-N 3.11Å; H722-T725 PolarHBondContact O-OG1 2.73Å; H722-T725 VanDerWaalsContact O-OG1 3.12Å; F723-T725 VanDerWaalsContact C-N 3.32Å; F723-T725 PolarHBondContact O-N 2.98Å; T725-F727 VanDerWaalsContact C-N 3.28Å; T725-F727 PolarHBondContact O-N 2.86Å; T725-W728 WeakPolarHBondContact O-CB 3.35Å; T725-W728 PolarHBondContact O-N 2.89Å; T725-K729 WeakPolarHBondContact O-CG 3.44Å; T725-K729 PolarHBondContact O-N 3.26Å; T725-K729 WeakPolarHBondContact OG1-CE 3.38Å
726	V	92.3	Very high	90.6	Very high	44 Å²	44	61.1 Å²	61.1	27%	0.267	31%	0.307	S	S	.	.	H	α-helix	trans	-57.6	-39.3	-170	71.8	0	0	0	0	112.5	H722 F723 W728 K729 V730	H722-V726 WeakPolarHBondContact O-CA 3.47Å; H722-V726 WeakPolarHBondContact O-CB 3.24Å; H722-V726 PolarHBondContact O-N 3.33Å; F723-V726 WeakPolarHBondContact O-CG1 3.32Å; V726-W728 PolarHBondContact O-N 3.03Å; V726-K729 PolarHBondContact O-N 3.13Å; V726-V730 HydrophobicContact CG2-CG2 4.21Å; V726-V730 WeakPolarHBondContact O-CB 3.3Å; V726-V730 WeakPolarHBondContact O-CG2 3.22Å; V726-V730 PolarHBondContact O-N 3.07Å
727	F	94.5	Very high	91	Very high	114 Å²	114	56 Å²	56	50%	0.5	27%	0.272	S	S	.	.	H	α-helix	trans	-55.7	-51.5	175.9	169.1	-100.6	0	0	0	111.3	Y69 T725 L731	Y69-F727 HydrophobicContact CE1-CD1 4.29Å; Y69-F727 WeakPolarHBondContact OH-CB 3.5Å; Y69-F727 VanDerWaalsContact OH-CD1 3.26Å; Y69-F727 WeakPolarHBondContact OH-CD1 3.26Å; T725-F727 VanDerWaalsContact C-N 3.28Å; T725-F727 PolarHBondContact O-N 2.86Å; F727-L731 WeakPolarHBondContact O-CB 3.36Å; F727-L731 PolarHBondContact O-N 3.47Å
728	W	94.8	Very high	91.3	Very high	18 Å²	18	49.6 Å²	49.6	7%	0.068	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-40.9	178.2	-67.8	120.5	0	0	0	112.1	Y69 L70 I76 T725 V726 V730 L731 F732 L757	Y69-W728 AromaticContact CD1-CZ2 3.88Å; Y69-W728 HydrophobicContact CD1-CZ2 3.88Å; Y69-W728 AromaticContact CD1-NE1 3.6Å; Y69-W728 AromaticContact CE1-CE2 3.6Å; Y69-W728 AromaticContact CE1-CZ2 3.7Å; Y69-W728 HydrophobicContact CE1-CZ2 3.7Å; Y69-W728 AromaticContact CE1-NE1 3.2Å; Y69-W728 AromaticContact CE2-NE1 3.66Å; Y69-W728 AromaticContact CG-NE1 3.99Å; Y69-W728 AromaticContact CZ-CD1 3.79Å; Y69-W728 AromaticContact CZ-NE1 3.24Å; Y69-W728 PolarHBondContact O-NE1 2.74Å; L70-W728 HydrophobicContact CD2-CH2 4.12Å; L70-W728 HydrophobicContact CD2-CZ2 4.14Å; I76-W728 HydrophobicContact CD1-CB 3.49Å; I76-W728 VanDerWaalsContact CD1-CB 3.49Å; I76-W728 HydrophobicContact CD1-CG 4.23Å; T725-W728 WeakPolarHBondContact O-CB 3.35Å; T725-W728 PolarHBondContact O-N 2.89Å; V726-W728 PolarHBondContact O-N 3.03Å; W728-V730 PolarHBondContact O-N 3.3Å; W728-L731 HydrophobicContact CE3-CD2 3.89Å; W728-L731 HydrophobicContact CZ3-CD2 3.86Å; W728-L731 PolarHBondContact O-N 2.88Å; W728-F732 HydrophobicContact CB-CD2 4.29Å; W728-F732 HydrophobicContact CB-CE2 3.87Å; W728-F732 HydrophobicContact CD2-CE2 4.32Å; W728-F732 HydrophobicContact CD2-CZ 4.26Å; W728-F732 HydrophobicContact CE3-CE1 4.14Å; W728-F732 AromaticContact CE3-CE2 3.83Å; W728-F732 HydrophobicContact CE3-CE2 3.83Å; W728-F732 AromaticContact CE3-CZ 3.37Å; W728-F732 HydrophobicContact CE3-CZ 3.37Å; W728-F732 HydrophobicContact CG-CE2 4.4Å; W728-F732 HydrophobicContact CZ3-CE1 4.49Å; W728-F732 AromaticContact CZ3-CZ 3.9Å; W728-F732 HydrophobicContact CZ3-CZ 3.9Å; W728-F732 WeakPolarHBondContact O-CB 3.22Å; W728-F732 WeakPolarHBondContact O-CD2 3.48Å; W728-F732 VanDerWaalsContact O-CG 3.28Å; W728-F732 WeakPolarHBondContact O-CG 3.2Å; W728-F732 PolarHBondContact O-N 3.14Å; W728-L757 HydrophobicContact CH2-CD2 3.64Å; W728-L757 HydrophobicContact CZ3-CD2 3.67Å
729	K	92	Very high	91.3	Very high	13 Å²	13	51.6 Å²	51.6	6%	0.057	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-45.9	177.9	-70.4	-176.1	-177.2	179.8	0	112.1	I76 T340 S342 A696 H722 T725 V726 F732 A733	I76-K729 HydrophobicContact CD1-CG 4.47Å; I76-K729 HydrophobicContact CG2-CG 4.29Å; T340-K729 WeakPolarHBondContact O-CE 3.46Å; T340-K729 PolarHBondContact O-NZ 3.2Å; S342-K729 WeakPolarHBondContact OG-CE 3.48Å; S342-K729 PolarHBondContact OG-NZ 3.43Å; A696-K729 HydrophobicContact CB-CB 3.93Å; H722-K729 PolarHBondContact ND1-NZ 3.3Å; H722-K729 VanDerWaalsContact ND1-NZ 3.13Å; T725-K729 WeakPolarHBondContact O-CG 3.44Å; T725-K729 PolarHBondContact O-N 3.26Å; T725-K729 WeakPolarHBondContact OG1-CE 3.38Å; V726-K729 PolarHBondContact O-N 3.13Å; K729-F732 PolarHBondContact O-N 3.33Å; K729-A733 WeakPolarHBondContact O-CB 3.42Å; K729-A733 PolarHBondContact O-N 3.39Å
730	V	93.8	Very high	91.3	Very high	50 Å²	50	50.7 Å²	50.7	30%	0.303	25%	0.248	S	C	.	.	H	α-helix	trans	-67.2	-41.1	178.1	173.8	0	0	0	0	110.5	F693 I697 V726 W728 F732 A733 F734	F693-V730 HydrophobicContact CE1-CG1 4.4Å; I697-V730 HydrophobicContact CG1-CG2 4.41Å; V726-V730 HydrophobicContact CG2-CG2 4.21Å; V726-V730 WeakPolarHBondContact O-CB 3.3Å; V726-V730 WeakPolarHBondContact O-CG2 3.22Å; V726-V730 PolarHBondContact O-N 3.07Å; W728-V730 PolarHBondContact O-N 3.3Å; V730-F732 PolarHBondContact O-N 2.66Å; V730-A733 WeakPolarHBondContact O-CB 3.43Å; V730-A733 PolarHBondContact O-N 2.93Å; V730-F734 WeakPolarHBondContact O-CD2 3.45Å
731	L	94.9	Very high	91.1	Very high	80 Å²	80	49 Å²	49	42%	0.419	25%	0.246	S	C	.	.	H	α-helix	trans	-60.9	-43.7	176.5	-175.9	65.8	0	0	0	112	F727 W728 A733 F734	F727-L731 WeakPolarHBondContact O-CB 3.36Å; F727-L731 PolarHBondContact O-N 3.47Å; W728-L731 HydrophobicContact CE3-CD2 3.89Å; W728-L731 HydrophobicContact CZ3-CD2 3.86Å; W728-L731 PolarHBondContact O-N 2.88Å; L731-A733 VanDerWaalsContact C-N 3.34Å; L731-F734 WeakPolarHBondContact O-CD2 3.15Å
732	F	94.7	Very high	91.1	Very high	5 Å²	5	47.6 Å²	47.6	2%	0.022	25%	0.246	C	C	.	.	H	α-helix	trans	-83.8	-7.3	-179.2	-54.5	-36.9	0	0	0	113.9	G73 I76 I77 W728 K729 V730 F734 V735 V753 L757	G73-F732 VanDerWaalsContact O-CE2 3.23Å; G73-F732 WeakPolarHBondContact O-CE2 3.42Å; I76-F732 HydrophobicContact CB-CD2 4.05Å; I76-F732 HydrophobicContact CB-CE2 4.16Å; I76-F732 HydrophobicContact CG2-CD2 3.76Å; I76-F732 HydrophobicContact CG2-CE2 4.37Å; I77-F732 HydrophobicContact CB-CD1 4.41Å; I77-F732 HydrophobicContact CB-CD2 3.94Å; I77-F732 HydrophobicContact CB-CE1 4.32Å; I77-F732 HydrophobicContact CB-CE2 3.84Å; I77-F732 HydrophobicContact CB-CG 4.24Å; I77-F732 HydrophobicContact CB-CZ 4.04Å; I77-F732 HydrophobicContact CD1-CB 4.2Å; I77-F732 HydrophobicContact CD1-CD1 3.97Å; I77-F732 HydrophobicContact CD1-CD2 4.48Å; I77-F732 HydrophobicContact CD1-CG 3.96Å; I77-F732 HydrophobicContact CG2-CE2 4.42Å; I77-F732 HydrophobicContact CG2-CZ 4.43Å; W728-F732 HydrophobicContact CB-CD2 4.29Å; W728-F732 HydrophobicContact CB-CE2 3.87Å; W728-F732 HydrophobicContact CD2-CE2 4.32Å; W728-F732 HydrophobicContact CD2-CZ 4.26Å; W728-F732 HydrophobicContact CE3-CE1 4.14Å; W728-F732 AromaticContact CE3-CE2 3.83Å; W728-F732 HydrophobicContact CE3-CE2 3.83Å; W728-F732 AromaticContact CE3-CZ 3.37Å; W728-F732 HydrophobicContact CE3-CZ 3.37Å; W728-F732 HydrophobicContact CG-CE2 4.4Å; W728-F732 HydrophobicContact CZ3-CE1 4.49Å; W728-F732 AromaticContact CZ3-CZ 3.9Å; W728-F732 HydrophobicContact CZ3-CZ 3.9Å; W728-F732 WeakPolarHBondContact O-CB 3.22Å; W728-F732 WeakPolarHBondContact O-CD2 3.48Å; W728-F732 VanDerWaalsContact O-CG 3.28Å; W728-F732 WeakPolarHBondContact O-CG 3.2Å; W728-F732 PolarHBondContact O-N 3.14Å; K729-F732 PolarHBondContact O-N 3.33Å; V730-F732 PolarHBondContact O-N 2.66Å; F732-F734 PolarHBondContact O-N 3.48Å; F732-V735 HydrophobicContact CB-CG2 4.45Å; F732-V735 VanDerWaalsContact O-CB 3.31Å; F732-V735 WeakPolarHBondContact O-CB 3.37Å; F732-V735 WeakPolarHBondContact O-CG2 3.37Å; F732-V735 PolarHBondContact O-N 3.46Å; F732-V735 VanDerWaalsContact O-N 3.15Å; F732-V753 HydrophobicContact CD1-CG1 4Å; F732-V753 HydrophobicContact CE1-CG1 3.53Å; F732-V753 HydrophobicContact CZ-CG1 4.38Å; F732-L757 HydrophobicContact CE1-CD1 4.11Å; F732-L757 HydrophobicContact CZ-CD1 3.63Å
733	A	91.7	Very high	91.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.4	168.6	0	0	0	0	0	112.9	Q692 F693 A696 K729 V730 L731 V735	Q692-A733 HydrophobicContact CB-CB 4.27Å; Q692-A733 PolarHBondContact OE1-O 3.42Å; Q692-A733 VanDerWaalsContact OE1-O 3.1Å; F693-A733 HydrophobicContact CD1-CB 3.87Å; F693-A733 HydrophobicContact CD2-CB 4.39Å; F693-A733 HydrophobicContact CE1-CB 3.86Å; F693-A733 HydrophobicContact CE2-CB 4.36Å; F693-A733 HydrophobicContact CG-CB 4.14Å; F693-A733 HydrophobicContact CZ-CB 4.1Å; A696-A733 HydrophobicContact CB-CB 4.18Å; K729-A733 WeakPolarHBondContact O-CB 3.42Å; K729-A733 PolarHBondContact O-N 3.39Å; V730-A733 WeakPolarHBondContact O-CB 3.43Å; V730-A733 PolarHBondContact O-N 2.93Å; L731-A733 VanDerWaalsContact C-N 3.34Å; A733-V735 VanDerWaalsContact C-N 3.3Å
734	F	93.7	Very high	91.2	Very high	137 Å²	137	44.4 Å²	44.4	60%	0.601	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-14.8	171.4	-72.1	-86	0	0	0	113.5	F693 V730 L731 F732	F693-F734 HydrophobicContact CE1-CD2 4.48Å; F693-F734 HydrophobicContact CE1-CE2 4.05Å; F693-F734 HydrophobicContact CE1-CZ 4.21Å; F693-F734 HydrophobicContact CZ-CD1 4.14Å; F693-F734 HydrophobicContact CZ-CD2 4.07Å; F693-F734 AromaticContact CZ-CE1 3.92Å; F693-F734 HydrophobicContact CZ-CE1 3.92Å; F693-F734 AromaticContact CZ-CE2 3.85Å; F693-F734 HydrophobicContact CZ-CE2 3.85Å; F693-F734 HydrophobicContact CZ-CG 4.22Å; F693-F734 AromaticContact CZ-CZ 3.78Å; F693-F734 HydrophobicContact CZ-CZ 3.78Å; V730-F734 WeakPolarHBondContact O-CD2 3.45Å; L731-F734 WeakPolarHBondContact O-CD2 3.15Å; F732-F734 PolarHBondContact O-N 3.48Å
735	V	94.5	Very high	91.4	Very high	6 Å²	6	46.5 Å²	46.5	4%	0.036	23%	0.234	C	C	.	.	S	Bend	trans	-63.3	134.6	176.1	177	0	0	0	0	109	I77 Q692 F732 A733 V749	I77-V735 HydrophobicContact CD1-CG2 3.93Å; Q692-V735 PolarHBondContact NE2-O 3.21Å; Q692-V735 VanDerWaalsContact NE2-O 3.12Å; Q692-V735 PolarHBondContact OE1-O 3.1Å; F732-V735 HydrophobicContact CB-CG2 4.45Å; F732-V735 VanDerWaalsContact O-CB 3.31Å; F732-V735 WeakPolarHBondContact O-CB 3.37Å; F732-V735 WeakPolarHBondContact O-CG2 3.37Å; F732-V735 PolarHBondContact O-N 3.46Å; F732-V735 VanDerWaalsContact O-N 3.15Å; A733-V735 VanDerWaalsContact C-N 3.3Å; V735-V749 HydrophobicContact CG1-CB 4.42Å; V735-V749 HydrophobicContact CG1-CG1 4.22Å; V735-V749 HydrophobicContact CG2-CG1 4.26Å
736	P	94.4	Very high	91.5	Very high	26 Å²	26	46.5 Å²	46.5	17%	0.169	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-49.9	141.4	-179.5	-28.7	34.7	0	0	0	113.2	F745 C746 V749	P736-F745 HydrophobicContact CB-CB 4.29Å; P736-C746 WeakPolarHBondContact O-CB 3.26Å; P736-C746 PolarHBondContact O-SG 3.25Å; P736-C746 VanDerWaalsContact O-SG 3.41Å; P736-V749 HydrophobicContact CG-CG2 4.05Å
737	P	92.2	Very high	91.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-57.5	148.8	172.8	-21.8	33.1	0	0	0	111.6	T686 W689 D739 Y740	T686-P737 VanDerWaalsContact O-CB 3.23Å; T686-P737 WeakPolarHBondContact O-CB 3.26Å; W689-P737 HydrophobicContact CG-CG 4.35Å; P737-D739 PolarHBondContact O-N 2.94Å; P737-Y740 HydrophobicContact CB-CD2 3.96Å; P737-Y740 HydrophobicContact CB-CE2 4.22Å; P737-Y740 HydrophobicContact CG-CD2 4.19Å; P737-Y740 HydrophobicContact CG-CE2 4.08Å; P737-Y740 WeakPolarHBondContact O-CB 3.1Å; P737-Y740 PolarHBondContact O-N 3.21Å
738	T	88.6	Confident	91.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.7	-176.2	53.8	0	0	0	0	112.7	A83 A84 G685 T686 Y740 G743 C746	A83-T738 HydrophobicContact CB-CG2 4.11Å; A84-T738 HydrophobicContact CB-CG2 4.36Å; G685-T738 WeakPolarHBondContact CA-OG1 3.49Å; T686-T738 PolarHBondContact N-OG1 3.32Å; T686-T738 PolarHBondContact O-N 3.05Å; T686-T738 VanDerWaalsContact O-N 3.15Å; T686-T738 PolarHBondContact O-OG1 2.96Å; T738-Y740 PolarHBondContact O-N 2.85Å; T738-G743 WeakPolarHBondContact O-CA 3.48Å; T738-G743 PolarHBondContact O-N 3.03Å; T738-C746 HydrophobicContact CG2-CB 4.36Å
739	D	84.4	Confident	91.7	Very high	64 Å²	64	45 Å²	45	34%	0.342	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-17.4	179	-66.2	4	0	0	0	111.5	R354 T686 S687 P737 G741	R354-D739 IonicContact CZ-OD2 2.7Å; R354-D739 IonicContact NH1-OD2 2.92Å; R354-D739 IonicContact NH2-OD1 3.76Å; R354-D739 PolarHBondContact NH2-OD1 2.61Å; R354-D739 IonicContact NH2-OD2 3.73Å; R354-D739 PolarHBondContact NH2-OD2 2.88Å; T686-D739 PolarHBondContact O-N 2.68Å; S687-D739 WeakPolarHBondContact CA-OD2 3.32Å; S687-D739 VanDerWaalsContact CB-OD2 3.28Å; S687-D739 WeakPolarHBondContact CB-OD2 3.27Å; P737-D739 PolarHBondContact O-N 2.94Å; D739-G741 PolarHBondContact O-N 3.25Å
740	Y	86.2	Confident	91.8	Very high	109 Å²	109	44.4 Å²	44.4	43%	0.427	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-77.5	123	-179.9	-75.8	-136.1	0	0	0	109.8	P737 T738 G742 G743	P737-Y740 HydrophobicContact CB-CD2 3.96Å; P737-Y740 HydrophobicContact CB-CE2 4.22Å; P737-Y740 HydrophobicContact CG-CD2 4.19Å; P737-Y740 HydrophobicContact CG-CE2 4.08Å; P737-Y740 WeakPolarHBondContact O-CB 3.1Å; P737-Y740 PolarHBondContact O-N 3.21Å; T738-Y740 PolarHBondContact O-N 2.85Å; Y740-G742 PolarHBondContact O-N 3.49Å; Y740-G743 PolarHBondContact O-N 3.35Å
741	G	85.9	Confident	91.8	Very high	44 Å²	44	44.1 Å²	44.1	45%	0.454	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	61.6	27.3	179.5	0	0	0	0	0	113.6	D739 G743 W744	D739-G741 PolarHBondContact O-N 3.25Å; G741-G743 PolarHBondContact O-N 2.91Å; G741-W744 PolarHBondContact O-N 3.5Å
742	G	85.3	Confident	91.9	Very high	25 Å²	25	45.9 Å²	45.9	26%	0.258	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	61.8	29.7	-179.2	0	0	0	0	0	114	I88 Q91 Y740	I88-G742 WeakPolarHBondContact CG1-O 3.31Å; Q91-G742 PolarHBondContact NE2-O 2.85Å; Y740-G742 PolarHBondContact O-N 3.49Å
743	G	87.3	Confident	91.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	98.3	-17.8	178.4	0	0	0	0	0	114.9	T738 Y740 G741 F745 C746 F747	T738-G743 WeakPolarHBondContact O-CA 3.48Å; T738-G743 PolarHBondContact O-N 3.03Å; Y740-G743 PolarHBondContact O-N 3.35Å; G741-G743 PolarHBondContact O-N 2.91Å; G743-F745 PolarHBondContact O-N 2.9Å; G743-C746 PolarHBondContact O-N 3.5Å; G743-F747 WeakPolarHBondContact O-CB 3.23Å; G743-F747 PolarHBondContact O-N 2.85Å
744	W	92.4	Very high	92.1	Very high	114 Å²	114	47.5 Å²	47.5	43%	0.432	25%	0.248	S	C	.	.	H	α-helix	trans	-67.1	-34.8	-172.4	-75.5	104.5	0	0	0	114.7	I88 G741 F747 T748	I88-W744 HydrophobicContact CD1-CD2 3.9Å; I88-W744 HydrophobicContact CD1-CE3 4.06Å; I88-W744 HydrophobicContact CD1-CG 4.27Å; I88-W744 HydrophobicContact CD1-CZ3 4.43Å; I88-W744 HydrophobicContact CG1-CD2 4.33Å; I88-W744 HydrophobicContact CG1-CG 4.43Å; I88-W744 HydrophobicContact CG2-CH2 4.33Å; I88-W744 HydrophobicContact CG2-CZ2 3.68Å; G741-W744 PolarHBondContact O-N 3.5Å; W744-F747 HydrophobicContact CE3-CD1 4.02Å; W744-F747 HydrophobicContact CE3-CE1 4.49Å; W744-F747 HydrophobicContact CE3-CG 4.48Å; W744-F747 HydrophobicContact CZ3-CD1 4.08Å; W744-F747 HydrophobicContact CZ3-CE1 4.09Å; W744-F747 PolarHBondContact O-N 3.28Å; W744-T748 WeakPolarHBondContact O-CB 3.34Å; W744-T748 PolarHBondContact O-N 3.32Å; W744-T748 PolarHBondContact O-OG1 2.96Å
745	F	94.5	Very high	92.1	Very high	128 Å²	128	41.5 Å²	41.5	56%	0.561	23%	0.225	S	C	*	.	H	α-helix	trans	-66.4	-45.3	175.8	-67.5	-54.5	0	0	0	111.4	P736 G743 T748 V749	P736-F745 HydrophobicContact CB-CB 4.29Å; G743-F745 PolarHBondContact O-N 2.9Å; F745-T748 PolarHBondContact O-N 2.93Å; F745-V749 WeakPolarHBondContact O-CG2 3.49Å; F745-V749 PolarHBondContact O-N 2.94Å; F745-V749 VanDerWaalsContact O-N 3.11Å
746	C	93.7	Very high	92.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.6	-46.6	175	-176.4	0	0	0	0	111.1	A84 P736 T738 G743 T748 V749 C750	A84-C746 HydrophobicContact CB-CB 3.94Å; P736-C746 WeakPolarHBondContact O-CB 3.26Å; P736-C746 PolarHBondContact O-SG 3.25Å; P736-C746 VanDerWaalsContact O-SG 3.41Å; T738-C746 HydrophobicContact CG2-CB 4.36Å; G743-C746 PolarHBondContact O-N 3.5Å; C746-T748 VanDerWaalsContact C-N 3.34Å; C746-T748 PolarHBondContact O-N 3.47Å; C746-V749 PolarHBondContact O-N 3.29Å; C746-C750 VanDerWaalsContact O-CB 3.24Å; C746-C750 WeakPolarHBondContact O-CB 3.4Å; C746-C750 PolarHBondContact O-N 3.45Å; C746-C750 PolarHBondContact O-SG 3.36Å
747	F	94	Very high	92.2	Very high	20 Å²	20	44.9 Å²	44.9	9%	0.088	24%	0.244	C	C	.	.	H	α-helix	trans	-53.5	-48.5	176.5	177.3	-90.6	0	0	0	112.3	F81 A84 I85 I88 L121 L124 G743 W744 C750 I751	F81-F747 HydrophobicContact CD2-CD2 4.08Å; F81-F747 HydrophobicContact CD2-CE2 4.47Å; F81-F747 AromaticContact CE2-CD2 3.33Å; F81-F747 HydrophobicContact CE2-CD2 3.33Å; F81-F747 AromaticContact CE2-CE2 3.37Å; F81-F747 HydrophobicContact CE2-CE2 3.37Å; F81-F747 HydrophobicContact CE2-CG 4.03Å; F81-F747 HydrophobicContact CE2-CZ 4.12Å; F81-F747 HydrophobicContact CZ-CD2 4.1Å; F81-F747 AromaticContact CZ-CE2 3.67Å; F81-F747 HydrophobicContact CZ-CE2 3.67Å; F81-F747 HydrophobicContact CZ-CZ 4.27Å; A84-F747 HydrophobicContact CB-CB 4.13Å; I85-F747 HydrophobicContact CD1-CE2 4.37Å; I85-F747 HydrophobicContact CG1-CD2 3.84Å; I85-F747 HydrophobicContact CG1-CE2 3.89Å; I88-F747 HydrophobicContact CD1-CB 3.76Å; I88-F747 HydrophobicContact CD1-CD2 4Å; I88-F747 HydrophobicContact CD1-CG 3.98Å; L121-F747 HydrophobicContact CD2-CE2 4.1Å; L121-F747 HydrophobicContact CD2-CZ 4.1Å; L124-F747 HydrophobicContact CD2-CZ 4.16Å; G743-F747 WeakPolarHBondContact O-CB 3.23Å; G743-F747 PolarHBondContact O-N 2.85Å; W744-F747 HydrophobicContact CE3-CD1 4.02Å; W744-F747 HydrophobicContact CE3-CE1 4.49Å; W744-F747 HydrophobicContact CE3-CG 4.48Å; W744-F747 HydrophobicContact CZ3-CD1 4.08Å; W744-F747 HydrophobicContact CZ3-CE1 4.09Å; W744-F747 PolarHBondContact O-N 3.28Å; F747-C750 PolarHBondContact O-N 3.27Å; F747-I751 HydrophobicContact CD1-CD1 3.89Å; F747-I751 HydrophobicContact CE1-CD1 3.3Å; F747-I751 HydrophobicContact CE2-CD1 4.13Å; F747-I751 HydrophobicContact CZ-CD1 3.45Å; F747-I751 VanDerWaalsContact CZ-CD1 3.45Å; F747-I751 WeakPolarHBondContact O-CG1 3.41Å; F747-I751 PolarHBondContact O-N 3.2Å; F747-I751 VanDerWaalsContact O-N 3.08Å
748	T	94.9	Very high	92.2	Very high	73 Å²	73	45 Å²	45	45%	0.448	25%	0.245	S	C	.	.	H	α-helix	trans	-66.5	-47.1	-177.5	-54.1	0	0	0	0	111.9	W744 F745 C746 C750 I751 L752	W744-T748 WeakPolarHBondContact O-CB 3.34Å; W744-T748 PolarHBondContact O-N 3.32Å; W744-T748 PolarHBondContact O-OG1 2.96Å; F745-T748 PolarHBondContact O-N 2.93Å; C746-T748 VanDerWaalsContact C-N 3.34Å; C746-T748 PolarHBondContact O-N 3.47Å; T748-C750 PolarHBondContact O-N 3.41Å; T748-I751 PolarHBondContact O-N 3.28Å; T748-L752 WeakPolarHBondContact O-CG 3.4Å; T748-L752 PolarHBondContact O-N 2.91Å
749	V	95.9	Very high	92.4	Very high	51 Å²	51	45.3 Å²	45.3	31%	0.309	25%	0.247	S	C	.	.	H	α-helix	trans	-64.9	-40.8	178.6	175.2	0	0	0	0	110.9	V735 P736 F745 C746 I751 L752 V753	V735-V749 HydrophobicContact CG1-CB 4.42Å; V735-V749 HydrophobicContact CG1-CG1 4.22Å; V735-V749 HydrophobicContact CG2-CG1 4.26Å; P736-V749 HydrophobicContact CG-CG2 4.05Å; F745-V749 WeakPolarHBondContact O-CG2 3.49Å; F745-V749 PolarHBondContact O-N 2.94Å; F745-V749 VanDerWaalsContact O-N 3.11Å; C746-V749 PolarHBondContact O-N 3.29Å; V749-I751 PolarHBondContact O-N 3.49Å; V749-L752 PolarHBondContact O-N 3.28Å; V749-V753 HydrophobicContact CG1-CG2 4.31Å; V749-V753 WeakPolarHBondContact O-CG2 3.46Å; V749-V753 PolarHBondContact O-N 2.82Å
750	C	95.5	Very high	92.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.2	-45.6	175.4	-78.3	0	0	0	0	112.3	F81 C746 F747 T748 L752 V753 I754	F81-C750 HydrophobicContact CB-CB 3.9Å; F81-C750 HydrophobicContact CD2-CB 3.64Å; F81-C750 HydrophobicContact CG-CB 4.12Å; C746-C750 VanDerWaalsContact O-CB 3.24Å; C746-C750 WeakPolarHBondContact O-CB 3.4Å; C746-C750 PolarHBondContact O-N 3.45Å; C746-C750 PolarHBondContact O-SG 3.36Å; F747-C750 PolarHBondContact O-N 3.27Å; T748-C750 PolarHBondContact O-N 3.41Å; C750-L752 VanDerWaalsContact C-N 3.32Å; C750-L752 PolarHBondContact O-N 2.63Å; C750-V753 PolarHBondContact O-N 3.08Å; C750-I754 WeakPolarHBondContact O-CB 3.37Å; C750-I754 WeakPolarHBondContact O-CG1 3.46Å; C750-I754 PolarHBondContact O-N 3.37Å
751	I	94.3	Very high	93.3	Very high	45 Å²	45	38.5 Å²	38.5	23%	0.231	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-42.7	177.9	-73.2	175.7	0	0	0	111.4	F81 L132 F747 T748 V749 G755	F81-I751 HydrophobicContact CD2-CG1 4.32Å; F81-I751 HydrophobicContact CE2-CD1 3.86Å; F81-I751 HydrophobicContact CE2-CG1 3.45Å; F81-I751 VanDerWaalsContact CE2-CG1 3.45Å; F81-I751 HydrophobicContact CZ-CD1 3.94Å; F81-I751 HydrophobicContact CZ-CG1 3.65Å; L132-I751 HydrophobicContact CD1-CG2 4.41Å; L132-I751 HydrophobicContact CD2-CG2 4.3Å; F747-I751 HydrophobicContact CD1-CD1 3.89Å; F747-I751 HydrophobicContact CE1-CD1 3.3Å; F747-I751 HydrophobicContact CE2-CD1 4.13Å; F747-I751 HydrophobicContact CZ-CD1 3.45Å; F747-I751 VanDerWaalsContact CZ-CD1 3.45Å; F747-I751 WeakPolarHBondContact O-CG1 3.41Å; F747-I751 PolarHBondContact O-N 3.2Å; F747-I751 VanDerWaalsContact O-N 3.08Å; T748-I751 PolarHBondContact O-N 3.28Å; V749-I751 PolarHBondContact O-N 3.49Å; I751-G755 PolarHBondContact O-N 2.86Å
752	L	95.3	Very high	93.6	Very high	116 Å²	116	36.7 Å²	36.7	61%	0.607	20%	0.201	S	C	*	.	H	α-helix	trans	-63.5	-45.5	177.8	-66.4	175.7	0	0	0	111.6	T748 V749 C750 G755 V756	T748-L752 WeakPolarHBondContact O-CG 3.4Å; T748-L752 PolarHBondContact O-N 2.91Å; V749-L752 PolarHBondContact O-N 3.28Å; C750-L752 VanDerWaalsContact C-N 3.32Å; C750-L752 PolarHBondContact O-N 2.63Å; L752-G755 PolarHBondContact O-N 3.26Å; L752-V756 WeakPolarHBondContact O-CG2 3.32Å; L752-V756 PolarHBondContact O-N 3.34Å
753	V	95.9	Very high	93.9	Very high	39 Å²	39	36 Å²	36	24%	0.236	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-43.9	178.8	174.3	0	0	0	0	111.3	I77 F732 V749 C750 G755 V756 L757	I77-V753 HydrophobicContact CD1-CB 4.36Å; I77-V753 HydrophobicContact CD1-CG1 4.1Å; I77-V753 HydrophobicContact CG1-CB 4.23Å; I77-V753 HydrophobicContact CG1-CG1 3.89Å; F732-V753 HydrophobicContact CD1-CG1 4Å; F732-V753 HydrophobicContact CE1-CG1 3.53Å; F732-V753 HydrophobicContact CZ-CG1 4.38Å; V749-V753 HydrophobicContact CG1-CG2 4.31Å; V749-V753 WeakPolarHBondContact O-CG2 3.46Å; V749-V753 PolarHBondContact O-N 2.82Å; C750-V753 PolarHBondContact O-N 3.08Å; V753-G755 VanDerWaalsContact C-N 3.3Å; V753-G755 PolarHBondContact O-N 3.1Å; V753-V756 PolarHBondContact O-N 3.06Å; V753-L757 HydrophobicContact CG1-CD1 4Å; V753-L757 WeakPolarHBondContact O-CG 3.45Å; V753-L757 PolarHBondContact O-N 3.28Å
754	I	95.1	Very high	94.2	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-59.2	-45.2	174.3	-67.5	165.7	0	0	0	109.4	I77 F81 A128 P129 L132 C750 V756 L757 T758	I77-I754 HydrophobicContact CB-CG1 4.4Å; I77-I754 HydrophobicContact CG1-CG1 3.94Å; I77-I754 HydrophobicContact CG2-CD1 4.46Å; I77-I754 HydrophobicContact CG2-CG1 3.6Å; F81-I754 HydrophobicContact CB-CD1 3.95Å; F81-I754 HydrophobicContact CD1-CD1 3.82Å; F81-I754 HydrophobicContact CE1-CD1 4.46Å; F81-I754 HydrophobicContact CG-CD1 3.89Å; A128-I754 HydrophobicContact CB-CD1 4.49Å; A128-I754 HydrophobicContact CB-CG2 4.49Å; P129-I754 HydrophobicContact CG-CG2 4.35Å; L132-I754 HydrophobicContact CD1-CB 3.97Å; L132-I754 HydrophobicContact CD1-CG2 3.55Å; C750-I754 WeakPolarHBondContact O-CB 3.37Å; C750-I754 WeakPolarHBondContact O-CG1 3.46Å; C750-I754 PolarHBondContact O-N 3.37Å; I754-V756 PolarHBondContact O-N 2.67Å; I754-L757 PolarHBondContact O-N 3.16Å; I754-T758 HydrophobicContact CG2-CG2 3.84Å; I754-T758 WeakPolarHBondContact O-CB 3.4Å; I754-T758 WeakPolarHBondContact O-CG2 3.42Å; I754-T758 PolarHBondContact O-N 3.39Å; I754-T758 PolarHBondContact O-OG1 3.13Å; I754-T758 VanDerWaalsContact O-OG1 3.06Å
755	G	94.2	Very high	94.3	Very high	11 Å²	11	31 Å²	31	11%	0.113	17%	0.173	C	C	.	.	H	α-helix	trans	-58.7	-43.6	178	0	0	0	0	0	113.2	I136 I751 L752 V753 T758 A759	I136-G755 WeakPolarHBondContact CD1-O 3.24Å; I751-G755 PolarHBondContact O-N 2.86Å; L752-G755 PolarHBondContact O-N 3.26Å; V753-G755 VanDerWaalsContact C-N 3.3Å; V753-G755 PolarHBondContact O-N 3.1Å; G755-T758 WeakPolarHBondContact CA-OG1 3.46Å; G755-T758 PolarHBondContact O-OG1 3.24Å; G755-A759 WeakPolarHBondContact O-CB 3.46Å; G755-A759 PolarHBondContact O-N 3.19Å
756	V	94.9	Very high	94	Very high	88 Å²	88	25.8 Å²	25.8	53%	0.533	15%	0.152	S	C	.	.	H	α-helix	trans	-64.2	-44.3	175.6	173.4	0	0	0	0	111.1	L752 V753 I754 A759 V760	L752-V756 WeakPolarHBondContact O-CG2 3.32Å; L752-V756 PolarHBondContact O-N 3.34Å; V753-V756 PolarHBondContact O-N 3.06Å; I754-V756 PolarHBondContact O-N 2.67Å; V756-A759 PolarHBondContact O-N 3.03Å; V756-V760 WeakPolarHBondContact O-CG2 3.36Å; V756-V760 PolarHBondContact O-N 3.01Å; V756-V760 VanDerWaalsContact O-N 3.17Å
757	L	95.1	Very high	93.8	Very high	15 Å²	15	26 Å²	26	8%	0.079	15%	0.154	C	C	.	.	H	α-helix	trans	-66.8	-39.5	179.1	-71.5	167.5	0	0	0	112.5	L70 V74 I77 W728 F732 V753 I754 V760 I761	L70-L757 HydrophobicContact CD2-CD2 4.33Å; V74-L757 HydrophobicContact CG2-CB 3.81Å; V74-L757 HydrophobicContact CG2-CD1 4.32Å; I77-L757 HydrophobicContact CG2-CD1 3.94Å; W728-L757 HydrophobicContact CH2-CD2 3.64Å; W728-L757 HydrophobicContact CZ3-CD2 3.67Å; F732-L757 HydrophobicContact CE1-CD1 4.11Å; F732-L757 HydrophobicContact CZ-CD1 3.63Å; V753-L757 HydrophobicContact CG1-CD1 4Å; V753-L757 WeakPolarHBondContact O-CG 3.45Å; V753-L757 PolarHBondContact O-N 3.28Å; I754-L757 PolarHBondContact O-N 3.16Å; L757-V760 PolarHBondContact O-N 3.37Å; L757-I761 WeakPolarHBondContact O-CB 3.33Å; L757-I761 VanDerWaalsContact O-CG1 3.29Å; L757-I761 WeakPolarHBondContact O-CG1 3.42Å; L757-I761 PolarHBondContact O-N 3.16Å
758	T	93.2	Very high	93.7	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.018	15%	0.151	C	C	.	.	H	α-helix	trans	-69.9	-34.8	179.2	57.1	0	0	0	0	111.6	P129 I754 G755 I761 G762	P129-T758 HydrophobicContact CB-CG2 3.86Å; I754-T758 HydrophobicContact CG2-CG2 3.84Å; I754-T758 WeakPolarHBondContact O-CB 3.4Å; I754-T758 WeakPolarHBondContact O-CG2 3.42Å; I754-T758 PolarHBondContact O-N 3.39Å; I754-T758 PolarHBondContact O-OG1 3.13Å; I754-T758 VanDerWaalsContact O-OG1 3.06Å; G755-T758 WeakPolarHBondContact CA-OG1 3.46Å; G755-T758 PolarHBondContact O-OG1 3.24Å; T758-I761 PolarHBondContact O-N 2.93Å; T758-G762 PolarHBondContact O-N 3.36Å
759	A	93.1	Very high	93.4	Very high	6 Å²	6	21.9 Å²	21.9	5%	0.05	13%	0.13	C	C	.	.	H	α-helix	trans	-58.9	-48.4	170.3	0	0	0	0	0	111.4	I41 I136 G755 V756 I761 G762 D763	I41-A759 HydrophobicContact CD1-CB 3.5Å; I41-A759 VanDerWaalsContact CD1-CB 3.5Å; I41-A759 HydrophobicContact CG1-CB 4.34Å; I136-A759 HydrophobicContact CD1-CB 4.33Å; I136-A759 HydrophobicContact CG2-CB 3.9Å; G755-A759 WeakPolarHBondContact O-CB 3.46Å; G755-A759 PolarHBondContact O-N 3.19Å; V756-A759 PolarHBondContact O-N 3.03Å; A759-I761 PolarHBondContact O-N 3.48Å; A759-G762 PolarHBondContact O-N 3.35Å; A759-D763 PolarHBondContact O-N 3.34Å; A759-D763 VanDerWaalsContact O-N 3.1Å
760	V	94.8	Very high	92.9	Very high	27 Å²	27	20.6 Å²	20.6	16%	0.164	12%	0.123	C	C	.	.	H	α-helix	trans	-63.1	-40.9	176.5	174.9	0	0	0	0	111.5	I41 V42 L70 V756 L757 G762 D763 V764	I41-V760 HydrophobicContact CB-CG2 4.43Å; I41-V760 HydrophobicContact CD1-CG2 4.12Å; I41-V760 HydrophobicContact CG2-CG2 4.13Å; V42-V760 HydrophobicContact CG2-CG1 3.94Å; V42-V760 HydrophobicContact CG2-CG2 4.42Å; L70-V760 HydrophobicContact CD1-CG1 3.78Å; L70-V760 HydrophobicContact CD2-CG1 4Å; V756-V760 WeakPolarHBondContact O-CG2 3.36Å; V756-V760 PolarHBondContact O-N 3.01Å; V756-V760 VanDerWaalsContact O-N 3.17Å; L757-V760 PolarHBondContact O-N 3.37Å; V760-G762 VanDerWaalsContact C-N 3.31Å; V760-G762 PolarHBondContact O-N 2.99Å; V760-D763 PolarHBondContact O-N 2.74Å; V760-V764 HydrophobicContact CG1-CG2 4.27Å; V760-V764 WeakPolarHBondContact O-CB 3.33Å; V760-V764 VanDerWaalsContact O-CG2 3.28Å; V760-V764 WeakPolarHBondContact O-CG2 3.41Å; V760-V764 PolarHBondContact O-N 2.64Å
761	I	94.4	Very high	92.4	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-60	-43	174.3	-76	166.9	0	0	0	110.7	L67 L70 F71 V74 L757 T758 A759 D763 V764 A765 V784	L67-I761 HydrophobicContact CD1-CG2 3.93Å; L70-I761 HydrophobicContact CB-CD1 4.07Å; L70-I761 HydrophobicContact CB-CG1 3.6Å; L70-I761 HydrophobicContact CD1-CG1 4.11Å; L70-I761 HydrophobicContact CG-CG1 4.39Å; F71-I761 HydrophobicContact CD1-CD1 3.98Å; F71-I761 HydrophobicContact CE1-CD1 4.11Å; F71-I761 HydrophobicContact CE1-CG2 3.73Å; F71-I761 HydrophobicContact CZ-CG2 4.18Å; V74-I761 HydrophobicContact CB-CD1 4.35Å; V74-I761 HydrophobicContact CG2-CD1 3.35Å; L757-I761 WeakPolarHBondContact O-CB 3.33Å; L757-I761 VanDerWaalsContact O-CG1 3.29Å; L757-I761 WeakPolarHBondContact O-CG1 3.42Å; L757-I761 PolarHBondContact O-N 3.16Å; T758-I761 PolarHBondContact O-N 2.93Å; A759-I761 PolarHBondContact O-N 3.48Å; I761-D763 PolarHBondContact O-N 3.21Å; I761-V764 PolarHBondContact O-N 3.06Å; I761-A765 WeakPolarHBondContact O-CB 3.33Å; I761-A765 PolarHBondContact O-N 3.36Å; I761-V784 HydrophobicContact CG2-CG1 4.27Å
762	G	91.9	Very high	92	Very high	7 Å²	7	24 Å²	24	7%	0.072	14%	0.143	C	C	.	.	H	α-helix	trans	-58.7	-48.1	178.1	0	0	0	0	0	112	T758 A759 V760 A765 S766	T758-G762 PolarHBondContact O-N 3.36Å; A759-G762 PolarHBondContact O-N 3.35Å; V760-G762 VanDerWaalsContact C-N 3.31Å; V760-G762 PolarHBondContact O-N 2.99Å; G762-A765 PolarHBondContact O-N 3.37Å; G762-S766 PolarHBondContact O-N 3.3Å
763	D	92.4	Very high	91.4	Very high	10 Å²	10	20 Å²	20	5%	0.053	13%	0.13	C	C	.	.	H	α-helix	trans	-64.7	-45.4	179	-65.9	-18.1	0	0	0	112.7	G39 I40 I41 V42 A759 V760 I761 A765 S766 S767	G39-D763 VanDerWaalsContact CA-OD1 3.22Å; G39-D763 WeakPolarHBondContact CA-OD1 3.22Å; I40-D763 PolarHBondContact N-OD1 2.01Å; I40-D763 PolarHBondContact N-OD2 2.9Å; I40-D763 VanDerWaalsContact N-OD2 3.1Å; I41-D763 WeakPolarHBondContact CA-OD2 3.4Å; I41-D763 PolarHBondContact N-OD2 3.42Å; V42-D763 HydrophobicContact CB-CB 4Å; V42-D763 HydrophobicContact CG2-CB 4.42Å; V42-D763 PolarHBondContact N-OD2 2.73Å; A759-D763 PolarHBondContact O-N 3.34Å; A759-D763 VanDerWaalsContact O-N 3.1Å; V760-D763 PolarHBondContact O-N 2.74Å; I761-D763 PolarHBondContact O-N 3.21Å; D763-A765 VanDerWaalsContact C-N 3.34Å; D763-S766 PolarHBondContact O-N 2.9Å; D763-S767 WeakPolarHBondContact O-CB 3.49Å; D763-S767 PolarHBondContact O-N 2.88Å; D763-S767 PolarHBondContact O-OG 3.12Å
764	V	93.4	Very high	91	Very high	9 Å²	9	19.7 Å²	19.7	6%	0.055	13%	0.127	C	C	.	.	H	α-helix	trans	-66.2	-38.7	178.8	170.2	0	0	0	0	110.7	Y63 A66 L67 L70 V760 I761 S767 F768	Y63-V764 HydrophobicContact CD1-CG1 4.18Å; A66-V764 HydrophobicContact CB-CG1 4.32Å; L67-V764 HydrophobicContact CB-CG1 4.07Å; L67-V764 HydrophobicContact CD1-CG1 4.25Å; L70-V764 HydrophobicContact CD1-CB 4.28Å; L70-V764 HydrophobicContact CD1-CG1 4.43Å; L70-V764 HydrophobicContact CD1-CG2 4.01Å; V760-V764 HydrophobicContact CG1-CG2 4.27Å; V760-V764 WeakPolarHBondContact O-CB 3.33Å; V760-V764 VanDerWaalsContact O-CG2 3.28Å; V760-V764 WeakPolarHBondContact O-CG2 3.41Å; V760-V764 PolarHBondContact O-N 2.64Å; I761-V764 PolarHBondContact O-N 3.06Å; V764-S767 PolarHBondContact O-N 3.26Å; V764-F768 VanDerWaalsContact O-CB 3.27Å; V764-F768 WeakPolarHBondContact O-CB 3.36Å; V764-F768 PolarHBondContact O-N 3.34Å
765	A	92.9	Very high	90.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.2	-46.7	176.9	0	0	0	0	0	111.7	L67 I761 G762 D763 S767 F768 G769 T779 V784	L67-A765 HydrophobicContact CD1-CB 4.12Å; I761-A765 WeakPolarHBondContact O-CB 3.33Å; I761-A765 PolarHBondContact O-N 3.36Å; G762-A765 PolarHBondContact O-N 3.37Å; D763-A765 VanDerWaalsContact C-N 3.34Å; A765-S767 VanDerWaalsContact C-N 3.32Å; A765-S767 PolarHBondContact O-N 2.86Å; A765-F768 WeakPolarHBondContact O-CB 3.41Å; A765-F768 PolarHBondContact O-N 2.87Å; A765-G769 PolarHBondContact O-N 3.49Å; A765-T779 HydrophobicContact CB-CG2 4.33Å; A765-T779 WeakPolarHBondContact O-CG2 3.48Å; A765-V784 HydrophobicContact CB-CG2 3.46Å; A765-V784 VanDerWaalsContact CB-CG2 3.46Å
766	S	89.7	Confident	90.3	Very high	18 Å²	18	20.1 Å²	20.1	13%	0.126	13%	0.127	C	C	.	.	H	α-helix	trans	-62.5	-40.5	176	-173.7	0	0	0	0	111.4	G762 D763 F768 G769 C770 D776	G762-S766 PolarHBondContact O-N 3.3Å; D763-S766 PolarHBondContact O-N 2.9Å; S766-F768 PolarHBondContact O-N 2.85Å; S766-G769 PolarHBondContact O-N 2.92Å; S766-C770 WeakPolarHBondContact O-CB 2.98Å; S766-C770 PolarHBondContact O-N 3.49Å; S766-D776 WeakPolarHBondContact CB-OD1 3.49Å; S766-D776 PolarHBondContact OG-OD1 3.49Å
767	S	89.8	Confident	90	Very high	6 Å²	6	16.2 Å²	16.2	4%	0.042	10%	0.103	C	C	.	.	H	α-helix	trans	-64.2	-39.1	174.9	-61.3	0	0	0	0	113.1	D763 V764 A765 S771	D763-S767 WeakPolarHBondContact O-CB 3.49Å; D763-S767 PolarHBondContact O-N 2.88Å; D763-S767 PolarHBondContact O-OG 3.12Å; V764-S767 PolarHBondContact O-N 3.26Å; A765-S767 VanDerWaalsContact C-N 3.32Å; A765-S767 PolarHBondContact O-N 2.86Å; S767-S771 WeakPolarHBondContact O-CB 3.44Å; S767-S771 PolarHBondContact O-N 3Å; S767-S771 PolarHBondContact O-OG 3.39Å
768	F	91.2	Very high	89.8	Confident	6 Å²	6	16.2 Å²	16.2	3%	0.026	10%	0.104	C	C	.	.	H	α-helix	trans	-63.4	-50.8	173.8	171.2	-109	0	0	0	111.2	A60 F64 V764 A765 S766 C770 S771 I772 T779 F783	A60-F768 HydrophobicContact CB-CE2 4.39Å; A60-F768 WeakPolarHBondContact O-CD2 3.41Å; F64-F768 HydrophobicContact CB-CD2 4.08Å; F64-F768 HydrophobicContact CB-CE2 3.64Å; F64-F768 HydrophobicContact CB-CZ 4.31Å; F64-F768 HydrophobicContact CD2-CE1 4.49Å; F64-F768 HydrophobicContact CD2-CE2 4.02Å; F64-F768 AromaticContact CD2-CZ 3.81Å; F64-F768 HydrophobicContact CD2-CZ 3.81Å; F64-F768 HydrophobicContact CG-CE2 4.26Å; F64-F768 HydrophobicContact CG-CZ 4.47Å; V764-F768 VanDerWaalsContact O-CB 3.27Å; V764-F768 WeakPolarHBondContact O-CB 3.36Å; V764-F768 PolarHBondContact O-N 3.34Å; A765-F768 WeakPolarHBondContact O-CB 3.41Å; A765-F768 PolarHBondContact O-N 2.87Å; S766-F768 PolarHBondContact O-N 2.85Å; F768-C770 VanDerWaalsContact C-N 3.29Å; F768-C770 PolarHBondContact O-N 2.7Å; F768-S771 WeakPolarHBondContact O-CB 3.46Å; F768-S771 PolarHBondContact O-N 3.12Å; F768-S771 VanDerWaalsContact O-N 3.1Å; F768-I772 HydrophobicContact CD2-CD1 4.09Å; F768-I772 HydrophobicContact CE1-CD1 3.96Å; F768-I772 HydrophobicContact CE2-CD1 3.27Å; F768-I772 HydrophobicContact CE2-CG1 4.17Å; F768-I772 HydrophobicContact CZ-CD1 3.21Å; F768-I772 HydrophobicContact CZ-CG1 4.41Å; F768-I772 PolarHBondContact O-N 3.03Å; F768-T779 HydrophobicContact CD1-CG2 4.24Å; F768-F783 HydrophobicContact CD1-CD2 4.5Å; F768-F783 HydrophobicContact CE1-CD1 4.35Å; F768-F783 AromaticContact CE1-CD2 3.7Å; F768-F783 HydrophobicContact CE1-CD2 3.7Å; F768-F783 HydrophobicContact CE1-CE1 4.41Å; F768-F783 AromaticContact CE1-CE2 3.77Å; F768-F783 HydrophobicContact CE1-CE2 3.77Å; F768-F783 HydrophobicContact CE1-CG 4Å; F768-F783 HydrophobicContact CE1-CZ 4.13Å; F768-F783 HydrophobicContact CZ-CE2 4.36Å; F768-F783 HydrophobicContact CZ-CZ 4.31Å
769	G	89	Confident	89.8	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-54.9	-48.4	177	0	0	0	0	0	110.7	A765 S766 S771 I772 G773 L774 T779	A765-G769 PolarHBondContact O-N 3.49Å; S766-G769 PolarHBondContact O-N 2.92Å; G769-S771 VanDerWaalsContact C-N 3.33Å; G769-S771 PolarHBondContact O-N 2.96Å; G769-I772 PolarHBondContact O-N 3.42Å; G769-G773 PolarHBondContact O-N 2.89Å; G769-L774 CarbonylContact C-O 3.47Å; G769-L774 PolarHBondContact O-N 3.35Å; G769-T779 WeakPolarHBondContact CA-OG1 3.39Å
770	C	85.3	Confident	89.8	Confident	24 Å²	24	15.8 Å²	15.8	16%	0.162	10%	0.101	C	C	.	.	H	α-helix	trans	-62.1	-37.6	177.7	-160.5	0	0	0	0	113.5	T34 C36 S766 F768 I772 G773	T34-C770 PolarHBondContact O-SG 2.97Å; C36-C770 WeakPolarHBondContact CA-SG 3.34Å; C36-C770 HydrophobicContact CB-CB 3.86Å; C36-C770 WeakPolarHBondContact CB-SG 3.43Å; C36-C770 PolarHBondContact N-SG 3.08Å; C36-C770 VanDerWaalsContact N-SG 3.35Å; C36-C770 WeakPolarHBondContact SG-CB 3.45Å; C36-C770 CovalentContact SG-SG 2.01Å; C36-C770 PolarHBondContact SG-SG 2.88Å; S766-C770 WeakPolarHBondContact O-CB 2.98Å; S766-C770 PolarHBondContact O-N 3.49Å; F768-C770 VanDerWaalsContact C-N 3.29Å; F768-C770 PolarHBondContact O-N 2.7Å; C770-I772 VanDerWaalsContact C-N 3.3Å; C770-I772 PolarHBondContact O-N 2.75Å; C770-G773 PolarHBondContact O-N 3.28Å
771	S	85.3	Confident	89.7	Confident	26 Å²	26	15 Å²	15	18%	0.182	10%	0.095	C	C	.	.	H	α-helix	trans	-64.6	-33.8	179.4	-62.5	0	0	0	0	112.8	S767 F768 G769	S767-S771 WeakPolarHBondContact O-CB 3.44Å; S767-S771 PolarHBondContact O-N 3Å; S767-S771 PolarHBondContact O-OG 3.39Å; F768-S771 WeakPolarHBondContact O-CB 3.46Å; F768-S771 PolarHBondContact O-N 3.12Å; F768-S771 VanDerWaalsContact O-N 3.1Å; G769-S771 VanDerWaalsContact C-N 3.33Å; G769-S771 PolarHBondContact O-N 2.96Å
772	I	86.2	Confident	89.6	Confident	90 Å²	90	16 Å²	16	46%	0.462	10%	0.102	S	C	.	.	H	α-helix	trans	-89.3	-24.1	178	-62.6	-175.8	0	0	0	112	A60 F768 G769 C770 L774	A60-I772 HydrophobicContact CB-CD1 4.12Å; A60-I772 HydrophobicContact CB-CG1 3.72Å; F768-I772 HydrophobicContact CD2-CD1 4.09Å; F768-I772 HydrophobicContact CE1-CD1 3.96Å; F768-I772 HydrophobicContact CE2-CD1 3.27Å; F768-I772 HydrophobicContact CE2-CG1 4.17Å; F768-I772 HydrophobicContact CZ-CD1 3.21Å; F768-I772 HydrophobicContact CZ-CG1 4.41Å; F768-I772 PolarHBondContact O-N 3.03Å; G769-I772 PolarHBondContact O-N 3.42Å; C770-I772 VanDerWaalsContact C-N 3.3Å; C770-I772 PolarHBondContact O-N 2.75Å; I772-L774 HydrophobicContact CB-CG 4.3Å; I772-L774 HydrophobicContact CG2-CD1 4.33Å; I772-L774 HydrophobicContact CG2-CG 3.97Å
773	G	82.5	Confident	89.7	Confident	33 Å²	33	18.7 Å²	18.7	34%	0.34	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	26.5	-171.7	0	0	0	0	0	113.5	G769 C770 Y910	G769-G773 PolarHBondContact O-N 2.89Å; C770-G773 PolarHBondContact O-N 3.28Å; G773-Y910 PolarHBondContact O-OH 2.93Å; G773-Y910 VanDerWaalsContact O-OH 3.09Å
774	L	87.4	Confident	89.8	Confident	32 Å²	32	18.2 Å²	18.2	17%	0.168	11%	0.109	C	C	.	.			trans	-87	143.4	169.7	-59.1	178.8	0	0	0	110.3	G769 I772 V778 T779 F783 Y910	G769-L774 CarbonylContact C-O 3.47Å; G769-L774 PolarHBondContact O-N 3.35Å; I772-L774 HydrophobicContact CB-CG 4.3Å; I772-L774 HydrophobicContact CG2-CD1 4.33Å; I772-L774 HydrophobicContact CG2-CG 3.97Å; L774-V778 HydrophobicContact CD2-CG1 4.3Å; L774-T779 WeakPolarHBondContact CB-OG1 3.45Å; L774-F783 HydrophobicContact CD1-CD2 4.35Å; L774-F783 HydrophobicContact CD1-CE2 3.74Å; L774-Y910 WeakPolarHBondContact CA-OH 3.27Å; L774-Y910 WeakPolarHBondContact CD2-OH 3.41Å
775	T	86.4	Confident	89.8	Confident	4 Å²	4	17.8 Å²	17.8	3%	0.025	11%	0.107	C	C	.	.			trans	-71.3	156.9	169.3	63.9	0	0	0	0	110	T34 A777 V778 T779 Y910	T34-T775 HydrophobicContact CG2-CG2 4.18Å; T775-A777 PolarHBondContact O-N 2.98Å; T775-V778 PolarHBondContact O-N 2.78Å; T775-V778 WeakPolarHBondContact OG1-CG2 3.38Å; T775-V778 PolarHBondContact OG1-N 2.97Å; T775-T779 WeakPolarHBondContact O-CB 3.43Å; T775-T779 PolarHBondContact O-N 3.2Å; T775-T779 PolarHBondContact O-OG1 3.08Å; T775-Y910 HydrophobicContact CG2-CE1 4.48Å
776	D	88.2	Confident	89.8	Confident	17 Å²	17	20.7 Å²	20.7	9%	0.091	12%	0.122	C	C	.	.	H	α-helix	trans	-56.6	-40.8	175.5	-75.9	-16.6	0	0	0	111.2	D147 L148 S766 V778 T779 A780	D147-D776 HydrophobicContact CB-CB 4.42Å; L148-D776 HydrophobicContact CD1-CB 4.27Å; S766-D776 WeakPolarHBondContact CB-OD1 3.49Å; S766-D776 PolarHBondContact OG-OD1 3.49Å; D776-V778 PolarHBondContact O-N 2.7Å; D776-T779 PolarHBondContact O-N 3.4Å; D776-A780 WeakPolarHBondContact O-CB 3.47Å; D776-A780 PolarHBondContact O-N 3.37Å
777	A	88.6	Confident	89.9	Confident	5 Å²	5	20 Å²	20	4%	0.041	12%	0.117	C	C	.	.	H	α-helix	trans	-59.5	-47.5	177.5	0	0	0	0	0	112.9	D147 T775 A780 I781	D147-A777 HydrophobicContact CB-CB 4.31Å; T775-A777 PolarHBondContact O-N 2.98Å; A777-A780 PolarHBondContact O-N 3.38Å; A777-I781 WeakPolarHBondContact O-CD1 3.48Å; A777-I781 VanDerWaalsContact O-CG1 3.26Å; A777-I781 WeakPolarHBondContact O-CG1 3.48Å; A777-I781 PolarHBondContact O-N 2.87Å
778	V	91.2	Very high	89.9	Confident	16 Å²	16	20 Å²	20	10%	0.097	12%	0.117	C	C	.	.	H	α-helix	trans	-68.5	-40.7	179.2	174.8	0	0	0	0	110.5	L774 T775 D776 A780 I781 T782 N909 Y910	L774-V778 HydrophobicContact CD2-CG1 4.3Å; T775-V778 PolarHBondContact O-N 2.78Å; T775-V778 WeakPolarHBondContact OG1-CG2 3.38Å; T775-V778 PolarHBondContact OG1-N 2.97Å; D776-V778 PolarHBondContact O-N 2.7Å; V778-A780 VanDerWaalsContact C-N 3.31Å; V778-A780 PolarHBondContact O-N 3.39Å; V778-I781 PolarHBondContact O-N 2.93Å; V778-T782 HydrophobicContact CG1-CG2 4.35Å; V778-T782 WeakPolarHBondContact O-CB 3.39Å; V778-T782 WeakPolarHBondContact O-CG2 3.48Å; V778-T782 PolarHBondContact O-N 3.26Å; V778-T782 VanDerWaalsContact O-N 3.09Å; V778-T782 PolarHBondContact O-OG1 2.92Å; V778-N909 HydrophobicContact CG2-CB 3.7Å; V778-Y910 HydrophobicContact CG2-CE2 4.45Å
779	T	91.5	Very high	89.9	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.2	-41.8	176.7	-53.9	0	0	0	0	111.4	A765 F768 G769 L774 T775 D776 F783 V784	A765-T779 HydrophobicContact CB-CG2 4.33Å; A765-T779 WeakPolarHBondContact O-CG2 3.48Å; F768-T779 HydrophobicContact CD1-CG2 4.24Å; G769-T779 WeakPolarHBondContact CA-OG1 3.39Å; L774-T779 WeakPolarHBondContact CB-OG1 3.45Å; T775-T779 WeakPolarHBondContact O-CB 3.43Å; T775-T779 PolarHBondContact O-N 3.2Å; T775-T779 PolarHBondContact O-OG1 3.08Å; D776-T779 PolarHBondContact O-N 3.4Å; T779-F783 PolarHBondContact O-N 3.03Å; T779-V784 PolarHBondContact O-N 2.96Å
780	A	93.1	Very high	89.9	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.128	C	C	.	.	I	π-helix	trans	-63.5	-49.3	177.3	0	0	0	0	0	112.5	L148 D776 A777 V778 T782 A785	L148-A780 HydrophobicContact CD1-CB 3.91Å; L148-A780 HydrophobicContact CG-CB 4.37Å; L148-A780 VanDerWaalsContact O-CB 3.31Å; L148-A780 WeakPolarHBondContact O-CB 3.14Å; D776-A780 WeakPolarHBondContact O-CB 3.47Å; D776-A780 PolarHBondContact O-N 3.37Å; A777-A780 PolarHBondContact O-N 3.38Å; V778-A780 VanDerWaalsContact C-N 3.31Å; V778-A780 PolarHBondContact O-N 3.39Å; A780-T782 VanDerWaalsContact C-N 3.29Å; A780-T782 PolarHBondContact O-N 3.2Å; A780-A785 WeakPolarHBondContact O-CB 3.36Å; A780-A785 PolarHBondContact O-N 2.75Å
781	I	93.7	Very high	89.9	Confident	9 Å²	9	21.1 Å²	21.1	5%	0.046	12%	0.122	C	C	.	.	I	π-helix	trans	-68.5	-28.8	-176.3	-67.9	165.3	0	0	0	112.1	G151 A777 V778 Y901 I902 A905	G151-I781 VanDerWaalsContact O-CG1 3.31Å; G151-I781 WeakPolarHBondContact O-CG1 3.2Å; A777-I781 WeakPolarHBondContact O-CD1 3.48Å; A777-I781 VanDerWaalsContact O-CG1 3.26Å; A777-I781 WeakPolarHBondContact O-CG1 3.48Å; A777-I781 PolarHBondContact O-N 2.87Å; V778-I781 PolarHBondContact O-N 2.93Å; I781-Y901 HydrophobicContact CG2-CE1 3.56Å; I781-I902 HydrophobicContact CG2-CG1 4.45Å; I781-A905 HydrophobicContact CD1-CB 4.4Å
782	T	92.5	Very high	90	Very high	24 Å²	24	20.2 Å²	20.2	15%	0.147	12%	0.115	C	C	.	.	I	π-helix	trans	-99.3	-57.9	-173.7	55.8	0	0	0	0	113.3	V778 A780 L786 I902	V778-T782 HydrophobicContact CG1-CG2 4.35Å; V778-T782 WeakPolarHBondContact O-CB 3.39Å; V778-T782 WeakPolarHBondContact O-CG2 3.48Å; V778-T782 PolarHBondContact O-N 3.26Å; V778-T782 VanDerWaalsContact O-N 3.09Å; V778-T782 PolarHBondContact O-OG1 2.92Å; A780-T782 VanDerWaalsContact C-N 3.29Å; A780-T782 PolarHBondContact O-N 3.2Å; T782-L786 WeakPolarHBondContact O-CB 3.3Å; T782-I902 HydrophobicContact CG2-CD1 4.23Å; T782-I902 HydrophobicContact CG2-CG1 4.34Å; T782-I902 HydrophobicContact CG2-CG2 3.65Å
783	F	92.8	Very high	90.2	Very high	63 Å²	63	16.6 Å²	16.6	28%	0.276	10%	0.097	S	C	.	.	I	π-helix	trans	-95	-44.3	-170.5	-65.7	-75.4	0	0	0	112.6	F64 L67 F768 L774 T779 G787	F64-F783 HydrophobicContact CE2-CD1 4.08Å; F64-F783 HydrophobicContact CE2-CE1 4.07Å; L67-F783 HydrophobicContact CD2-CB 4.36Å; F768-F783 HydrophobicContact CD1-CD2 4.5Å; F768-F783 HydrophobicContact CE1-CD1 4.35Å; F768-F783 AromaticContact CE1-CD2 3.7Å; F768-F783 HydrophobicContact CE1-CD2 3.7Å; F768-F783 HydrophobicContact CE1-CE1 4.41Å; F768-F783 AromaticContact CE1-CE2 3.77Å; F768-F783 HydrophobicContact CE1-CE2 3.77Å; F768-F783 HydrophobicContact CE1-CG 4Å; F768-F783 HydrophobicContact CE1-CZ 4.13Å; F768-F783 HydrophobicContact CZ-CE2 4.36Å; F768-F783 HydrophobicContact CZ-CZ 4.31Å; L774-F783 HydrophobicContact CD1-CD2 4.35Å; L774-F783 HydrophobicContact CD1-CE2 3.74Å; T779-F783 PolarHBondContact O-N 3.03Å; F783-G787 PolarHBondContact O-N 3.13Å
784	V	94.5	Very high	90.4	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	I	π-helix	trans	-70.2	-50	-178.1	-172.1	0	0	0	0	110.8	L133 T152 I761 A765 T779 L786 G787 T788	L133-V784 HydrophobicContact CD2-CG1 3.91Å; T152-V784 HydrophobicContact CG2-CB 4.43Å; T152-V784 HydrophobicContact CG2-CG1 3.87Å; T152-V784 WeakPolarHBondContact OG1-CG1 3.29Å; I761-V784 HydrophobicContact CG2-CG1 4.27Å; A765-V784 HydrophobicContact CB-CG2 3.46Å; A765-V784 VanDerWaalsContact CB-CG2 3.46Å; T779-V784 PolarHBondContact O-N 2.96Å; V784-L786 VanDerWaalsContact C-N 3.29Å; V784-L786 PolarHBondContact O-N 2.9Å; V784-G787 PolarHBondContact O-N 2.79Å; V784-G787 VanDerWaalsContact O-N 3.13Å; V784-T788 HydrophobicContact CG1-CG2 4.34Å; V784-T788 PolarHBondContact O-N 2.87Å; V784-T788 PolarHBondContact O-OG1 3.17Å
785	A	93.9	Very high	90.3	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.008	9%	0.089	C	C	.	.	H	α-helix	trans	-57.1	-41.9	176.7	0	0	0	0	0	113	G155 S156 A780 T788 S789	G155-A785 VanDerWaalsContact C-CB 3.43Å; S156-A785 VanDerWaalsContact N-CB 3.31Å; S156-A785 WeakPolarHBondContact OG-CA 3.2Å; S156-A785 PolarHBondContact OG-O 2.92Å; A780-A785 WeakPolarHBondContact O-CB 3.36Å; A780-A785 PolarHBondContact O-N 2.75Å; A785-T788 PolarHBondContact O-OG1 3.42Å; A785-S789 WeakPolarHBondContact O-CB 3.49Å; A785-S789 PolarHBondContact O-N 2.91Å; A785-S789 VanDerWaalsContact O-N 3.16Å; A785-S789 PolarHBondContact O-OG 2.99Å
786	L	92.6	Very high	90.5	Very high	61 Å²	61	16.8 Å²	16.8	32%	0.319	9%	0.089	S	C	.	.	H	α-helix	trans	-60	-52.6	174.7	174.7	68.1	0	0	0	110.4	F159 T782 V784 T788 S789 L790	F159-L786 HydrophobicContact CD2-CD1 4.04Å; F159-L786 HydrophobicContact CE1-CD1 4.26Å; F159-L786 HydrophobicContact CE2-CD1 3.25Å; F159-L786 HydrophobicContact CZ-CD1 3.39Å; T782-L786 WeakPolarHBondContact O-CB 3.3Å; V784-L786 VanDerWaalsContact C-N 3.29Å; V784-L786 PolarHBondContact O-N 2.9Å; L786-T788 PolarHBondContact O-N 3.5Å; L786-S789 PolarHBondContact O-N 2.82Å; L786-L790 WeakPolarHBondContact O-CG 3.41Å; L786-L790 PolarHBondContact O-N 2.9Å; L786-L790 VanDerWaalsContact O-N 3.11Å
787	G	92.3	Very high	90.6	Very high	3 Å²	3	20.1 Å²	20.1	3%	0.031	10%	0.102	C	C	.	.	H	α-helix	trans	-61.5	-44.2	-175.6	0	0	0	0	0	114	F783 V784 S789	F783-G787 PolarHBondContact O-N 3.13Å; V784-G787 PolarHBondContact O-N 2.79Å; V784-G787 VanDerWaalsContact O-N 3.13Å; G787-S789 VanDerWaalsContact C-N 3.32Å
788	T	90.8	Very high	90.4	Very high	5 Å²	5	21 Å²	21	3%	0.031	11%	0.107	C	C	.	.	H	α-helix	trans	-71.7	-27.7	178.7	63	0	0	0	0	112.7	F71 P129 E130 S156 V784 A785 L786 P791	F71-T788 HydrophobicContact CE1-CG2 4.16Å; P129-T788 HydrophobicContact CB-CG2 3.8Å; E130-T788 WeakPolarHBondContact OE1-CB 3.15Å; E130-T788 PolarHBondContact OE1-OG1 3.29Å; S156-T788 PolarHBondContact OG-OG1 2.8Å; V784-T788 HydrophobicContact CG1-CG2 4.34Å; V784-T788 PolarHBondContact O-N 2.87Å; V784-T788 PolarHBondContact O-OG1 3.17Å; A785-T788 PolarHBondContact O-OG1 3.42Å; L786-T788 PolarHBondContact O-N 3.5Å; T788-P791 WeakPolarHBondContact O-CD 3.27Å
789	S	91	Very high	90.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-88.9	-4.3	179.7	-52.7	0	0	0	0	114.2	S156 F159 N160 A785 L786 G787 D792 T793	S156-S789 WeakPolarHBondContact CB-OG 3.44Å; S156-S789 PolarHBondContact OG-OG 3.49Å; F159-S789 VanDerWaalsContact CD1-CB 3.43Å; N160-S789 WeakPolarHBondContact OD1-CB 3.31Å; N160-S789 PolarHBondContact OD1-OG 2.78Å; A785-S789 WeakPolarHBondContact O-CB 3.49Å; A785-S789 PolarHBondContact O-N 2.91Å; A785-S789 VanDerWaalsContact O-N 3.16Å; A785-S789 PolarHBondContact O-OG 2.99Å; L786-S789 PolarHBondContact O-N 2.82Å; G787-S789 VanDerWaalsContact C-N 3.32Å; S789-D792 PolarHBondContact O-N 2.85Å; S789-T793 PolarHBondContact O-N 2.8Å; S789-T793 PolarHBondContact O-OG1 2.97Å
790	L	88.3	Confident	90	Very high	50 Å²	50	20.3 Å²	20.3	26%	0.262	10%	0.103	S	C	.	.	H	α-helix	trans	-58	-49.7	177.4	-80	176.1	0	0	0	112.7	L786 D792 T793 F794	L786-L790 WeakPolarHBondContact O-CG 3.41Å; L786-L790 PolarHBondContact O-N 2.9Å; L786-L790 VanDerWaalsContact O-N 3.11Å; L790-D792 PolarHBondContact O-N 3.47Å; L790-T793 VanDerWaalsContact O-CB 3.28Å; L790-T793 WeakPolarHBondContact O-CB 3.3Å; L790-T793 PolarHBondContact O-N 3.01Å; L790-T793 VanDerWaalsContact O-N 3.08Å; L790-F794 HydrophobicContact CD2-CE2 4.46Å; L790-F794 WeakPolarHBondContact O-CD2 3.35Å; L790-F794 PolarHBondContact O-N 2.99Å
791	P	85	Confident	89.8	Confident	4 Å²	4	23.2 Å²	23.2	3%	0.026	12%	0.121	C	C	.	.	H	α-helix	trans	-55.2	-38.9	176.6	-26.3	36	0	0	0	112.8	S75 T788 T793 F794 A795	S75-P791 WeakPolarHBondContact OG-CG 3.21Å; T788-P791 WeakPolarHBondContact O-CD 3.27Å; P791-T793 VanDerWaalsContact C-N 3.32Å; P791-T793 PolarHBondContact O-N 2.88Å; P791-F794 PolarHBondContact O-N 3.3Å; P791-A795 VanDerWaalsContact O-CB 3.3Å; P791-A795 WeakPolarHBondContact O-CB 3.4Å; P791-A795 PolarHBondContact O-N 3.44Å
792	D	88.4	Confident	89.2	Confident	7 Å²	7	25.1 Å²	25.1	4%	0.037	14%	0.143	C	C	.	.	H	α-helix	trans	-71.5	-30.3	-178.4	-70.8	8	0	0	0	111.8	S126 I164 R332 S789 L790 S796	S126-D792 WeakPolarHBondContact CB-OD2 3.4Å; S126-D792 PolarHBondContact OG-OD1 3.22Å; S126-D792 VanDerWaalsContact OG-OD1 3.06Å; S126-D792 PolarHBondContact OG-OD2 3.4Å; I164-D792 HydrophobicContact CD1-CB 3.99Å; R332-D792 IonicContact CZ-OD1 3.07Å; R332-D792 VanDerWaalsContact CZ-OD1 3.28Å; R332-D792 IonicContact NE-OD1 2.61Å; R332-D792 PolarHBondContact NE-OD1 3.05Å; R332-D792 IonicContact NH2-OD1 2.68Å; R332-D792 PolarHBondContact NH2-OD1 3.29Å; S789-D792 PolarHBondContact O-N 2.85Å; L790-D792 PolarHBondContact O-N 3.47Å; D792-S796 VanDerWaalsContact O-CB 3.28Å; D792-S796 WeakPolarHBondContact O-CB 3.41Å; D792-S796 PolarHBondContact O-N 2.98Å; D792-S796 PolarHBondContact O-OG 3.23Å
793	T	89.6	Confident	88.7	Confident	15 Å²	15	25.3 Å²	25.3	9%	0.092	14%	0.143	C	C	.	.	H	α-helix	trans	-62.8	-49.8	173.3	-53.7	0	0	0	0	110.8	F159 I164 V167 S789 L790 P791 K797	F159-T793 VanDerWaalsContact CE1-OG1 3.29Å; F159-T793 WeakPolarHBondContact CE1-OG1 3.16Å; I164-T793 HydrophobicContact CG1-CG2 4.35Å; I164-T793 WeakPolarHBondContact CG1-OG1 3.47Å; V167-T793 HydrophobicContact CG2-CG2 4.47Å; S789-T793 PolarHBondContact O-N 2.8Å; S789-T793 PolarHBondContact O-OG1 2.97Å; L790-T793 VanDerWaalsContact O-CB 3.28Å; L790-T793 WeakPolarHBondContact O-CB 3.3Å; L790-T793 PolarHBondContact O-N 3.01Å; L790-T793 VanDerWaalsContact O-N 3.08Å; P791-T793 VanDerWaalsContact C-N 3.32Å; P791-T793 PolarHBondContact O-N 2.88Å; T793-K797 VanDerWaalsContact O-CB 3.31Å; T793-K797 WeakPolarHBondContact O-CB 3.2Å; T793-K797 PolarHBondContact O-N 2.92Å
794	F	87.5	Confident	88.3	Confident	62 Å²	62	29.1 Å²	29.1	27%	0.272	16%	0.161	S	C	.	.	H	α-helix	trans	-71.5	-39.4	-179	-67.4	-75.1	0	0	0	111.5	A335 L339 L790 P791 S796 K797 V798	A335-F794 VanDerWaalsContact CB-C 3.47Å; A335-F794 HydrophobicContact CB-CB 3.67Å; L339-F794 HydrophobicContact CD1-CB 4.07Å; L339-F794 HydrophobicContact CD1-CD1 4.28Å; L339-F794 HydrophobicContact CD1-CD2 3.25Å; L339-F794 HydrophobicContact CD1-CE2 3.61Å; L339-F794 HydrophobicContact CD1-CG 3.63Å; L339-F794 HydrophobicContact CD1-CZ 4.27Å; L339-F794 HydrophobicContact CD2-CD1 3.96Å; L339-F794 HydrophobicContact CD2-CD2 4.09Å; L339-F794 HydrophobicContact CD2-CE1 3.68Å; L339-F794 HydrophobicContact CD2-CE2 3.79Å; L339-F794 HydrophobicContact CD2-CG 4.17Å; L339-F794 HydrophobicContact CD2-CZ 3.58Å; L339-F794 HydrophobicContact CG-CD1 4.46Å; L339-F794 HydrophobicContact CG-CD2 4.2Å; L339-F794 HydrophobicContact CG-CE2 4.33Å; L339-F794 HydrophobicContact CG-CG 4.26Å; L790-F794 HydrophobicContact CD2-CE2 4.46Å; L790-F794 WeakPolarHBondContact O-CD2 3.35Å; L790-F794 PolarHBondContact O-N 2.99Å; P791-F794 PolarHBondContact O-N 3.3Å; F794-S796 PolarHBondContact O-N 3.1Å; F794-K797 WeakPolarHBondContact O-CB 3.46Å; F794-K797 PolarHBondContact O-N 2.72Å; F794-V798 WeakPolarHBondContact O-CG2 3.42Å; F794-V798 PolarHBondContact O-N 3.49Å
795	A	85.1	Confident	87.9	Confident	7 Å²	7	34.2 Å²	34.2	6%	0.058	18%	0.181	C	C	.	.	H	α-helix	trans	-57.4	-49.2	174.5	0	0	0	0	0	111.7	R332 P791 K797 V798 A799	R332-A795 HydrophobicContact CB-CB 3.8Å; R332-A795 HydrophobicContact CG-CB 4Å; P791-A795 VanDerWaalsContact O-CB 3.3Å; P791-A795 WeakPolarHBondContact O-CB 3.4Å; P791-A795 PolarHBondContact O-N 3.44Å; A795-K797 VanDerWaalsContact C-N 3.34Å; A795-K797 PolarHBondContact O-N 2.98Å; A795-V798 PolarHBondContact O-N 3.11Å; A795-A799 WeakPolarHBondContact O-CB 3.1Å; A795-A799 PolarHBondContact O-N 2.8Å
796	S	89.8	Confident	87.6	Confident	4 Å²	4	34.2 Å²	34.2	3%	0.028	18%	0.181	C	C	.	.	H	α-helix	trans	-68.2	-34.5	179.9	-54	0	0	0	0	112	I164 C168 D792 F794 A800	I164-S796 VanDerWaalsContact CG2-CB 3.4Å; C168-S796 VanDerWaalsContact SG-CB 3.59Å; C168-S796 PolarHBondContact SG-O 2.74Å; D792-S796 VanDerWaalsContact O-CB 3.28Å; D792-S796 WeakPolarHBondContact O-CB 3.41Å; D792-S796 PolarHBondContact O-N 2.98Å; D792-S796 PolarHBondContact O-OG 3.23Å; F794-S796 PolarHBondContact O-N 3.1Å; S796-A800 VanDerWaalsContact O-CB 3.3Å; S796-A800 WeakPolarHBondContact O-CB 3.39Å; S796-A800 PolarHBondContact O-N 2.94Å
797	K	90.2	Very high	87.3	Confident	86 Å²	86	33 Å²	33	37%	0.374	18%	0.175	S	C	.	.	H	α-helix	trans	-61.3	-51.5	172.1	167.2	-178	177.2	-159.4	0	111.6	V167 V171 T793 F794 A795 A799 A800 V801	V167-K797 HydrophobicContact CG1-CB 4.37Å; V171-K797 HydrophobicContact CB-CG 4.19Å; V171-K797 HydrophobicContact CG1-CD 4.08Å; V171-K797 HydrophobicContact CG1-CG 3.93Å; V171-K797 HydrophobicContact CG2-CG 4.08Å; T793-K797 VanDerWaalsContact O-CB 3.31Å; T793-K797 WeakPolarHBondContact O-CB 3.2Å; T793-K797 PolarHBondContact O-N 2.92Å; F794-K797 WeakPolarHBondContact O-CB 3.46Å; F794-K797 PolarHBondContact O-N 2.72Å; A795-K797 VanDerWaalsContact C-N 3.34Å; A795-K797 PolarHBondContact O-N 2.98Å; K797-A799 VanDerWaalsContact C-N 3.31Å; K797-A799 PolarHBondContact O-N 2.88Å; K797-A800 PolarHBondContact O-N 3.17Å; K797-V801 WeakPolarHBondContact O-CG2 3.43Å; K797-V801 PolarHBondContact O-N 3Å; K797-V801 VanDerWaalsContact O-N 3.1Å
798	V	85.9	Confident	86.8	Confident	24 Å²	24	34.3 Å²	34.3	15%	0.145	18%	0.184	C	C	.	.	H	α-helix	trans	-63.6	-41.1	-179.1	179.9	0	0	0	0	109.9	Y331 A335 F794 A795 V801 G802	Y331-V798 HydrophobicContact CD1-CB 4.39Å; Y331-V798 HydrophobicContact CD1-CG1 3.73Å; Y331-V798 HydrophobicContact CE1-CG1 4.35Å; A335-V798 HydrophobicContact CB-CG2 4.08Å; F794-V798 WeakPolarHBondContact O-CG2 3.42Å; F794-V798 PolarHBondContact O-N 3.49Å; A795-V798 PolarHBondContact O-N 3.11Å; V798-V801 PolarHBondContact O-N 3.42Å; V798-G802 PolarHBondContact O-N 2.97Å
799	A	85.9	Confident	86.5	Confident	1 Å²	1	34 Å²	34	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-44.8	173.4	0	0	0	0	0	112.3	Y331 A795 K797 V801 G802 D803	Y331-A799 HydrophobicContact CD1-CB 4.44Å; Y331-A799 HydrophobicContact CD2-CB 3.94Å; Y331-A799 HydrophobicContact CE2-CB 4.38Å; Y331-A799 HydrophobicContact CG-CB 3.96Å; A795-A799 WeakPolarHBondContact O-CB 3.1Å; A795-A799 PolarHBondContact O-N 2.8Å; K797-A799 VanDerWaalsContact C-N 3.31Å; K797-A799 PolarHBondContact O-N 2.88Å; A799-V801 VanDerWaalsContact C-N 3.28Å; A799-V801 PolarHBondContact O-N 3.49Å; A799-G802 PolarHBondContact O-N 3.28Å; A799-D803 WeakPolarHBondContact O-CB 3.23Å; A799-D803 PolarHBondContact O-N 2.96Å
800	A	88.2	Confident	86.4	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.3	-32	179.4	0	0	0	0	0	113.5	C168 V171 V172 R178 S796 K797 L880	C168-A800 HydrophobicContact CB-CB 4.03Å; V171-A800 HydrophobicContact CG2-CB 4.06Å; V172-A800 HydrophobicContact CG2-CB 4.38Å; R178-A800 PolarHBondContact NE-O 3.21Å; S796-A800 VanDerWaalsContact O-CB 3.3Å; S796-A800 WeakPolarHBondContact O-CB 3.39Å; S796-A800 PolarHBondContact O-N 2.94Å; K797-A800 PolarHBondContact O-N 3.17Å; A800-L880 HydrophobicContact CB-CD1 4.13Å
801	V	87.4	Confident	86	Confident	62 Å²	62	32.9 Å²	32.9	38%	0.376	18%	0.182	S	C	.	.	H	α-helix	trans	-76.7	-50.6	175.7	175.3	0	0	0	0	110.6	V171 R178 K797 V798 A799	V171-V801 HydrophobicContact CB-CG2 4.17Å; V171-V801 HydrophobicContact CG2-CG2 4.15Å; R178-V801 PolarHBondContact NH2-O 3.43Å; R178-V801 VanDerWaalsContact NH2-O 3.08Å; K797-V801 WeakPolarHBondContact O-CG2 3.43Å; K797-V801 PolarHBondContact O-N 3Å; K797-V801 VanDerWaalsContact O-N 3.1Å; V798-V801 PolarHBondContact O-N 3.42Å; A799-V801 VanDerWaalsContact C-N 3.28Å; A799-V801 PolarHBondContact O-N 3.49Å
802	G	81.1	Confident	85.4	Confident	49 Å²	49	33.4 Å²	33.4	51%	0.505	19%	0.185	S	C	.	.	H	α-helix	trans	-80	-30.9	-170	0	0	0	0	0	115.6	V798 A799	V798-G802 PolarHBondContact O-N 2.97Å; A799-G802 PolarHBondContact O-N 3.28Å
803	D	83.1	Confident	85.2	Confident	27 Å²	27	33.3 Å²	33.3	14%	0.144	18%	0.184	C	C	.	.			trans	-88.3	149.7	-179	-83.7	-33.2	0	0	0	112.8	R178 Y331 A799 Y805 S808	R178-D803 WeakPolarHBondContact CD-O 3.49Å; R178-D803 VanDerWaalsContact CZ-O 3.25Å; R178-D803 PolarHBondContact NE-O 3.13Å; Y331-D803 WeakPolarHBondContact CE2-OD2 3.5Å; Y331-D803 VanDerWaalsContact OH-CG 3.29Å; Y331-D803 PolarHBondContact OH-OD1 3.27Å; A799-D803 WeakPolarHBondContact O-CB 3.23Å; A799-D803 PolarHBondContact O-N 2.96Å; D803-Y805 VanDerWaalsContact C-N 3.33Å; D803-S808 WeakPolarHBondContact OD2-CB 3.45Å; D803-S808 PolarHBondContact OD2-OG 3.44Å
804	Q	83.1	Confident	85.1	Confident	143 Å²	143	32.7 Å²	32.7	67%	0.668	18%	0.181	S	C	*	.	S	Bend	trans	-74.8	-23.8	172.7	-61.5	-178	5.5	0	0	113	R178	R178-Q804 VanDerWaalsContact CD-O 3.25Å; R178-Q804 WeakPolarHBondContact CD-O 3.47Å
805	Y	87.7	Confident	85	Confident	108 Å²	108	29.8 Å²	29.8	42%	0.424	17%	0.168	S	C	.	.	B	Isolated β-bridge	trans	-114.6	163.3	-176.5	-57.4	-75.5	0	0	0	111.7	R179 K181 D803 D807	R179-Y805 CarbonylContact O-C 3.59Å; R179-Y805 VanDerWaalsContact O-CA 3.32Å; R179-Y805 WeakPolarHBondContact O-CA 3.45Å; R179-Y805 WeakPolarHBondContact O-CB 3.32Å; K181-Y805 HydrophobicContact CB-CD1 3.92Å; K181-Y805 HydrophobicContact CB-CE1 4.29Å; K181-Y805 HydrophobicContact CB-CG 4.18Å; K181-Y805 HydrophobicContact CD-CD2 4.42Å; K181-Y805 HydrophobicContact CD-CE1 4.43Å; K181-Y805 HydrophobicContact CD-CE2 4.25Å; D803-Y805 VanDerWaalsContact C-N 3.33Å; Y805-D807 WeakPolarHBondContact CB-OD2 3.47Å
806	A	87.9	Confident	85.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-93.1	-1.6	-178.6	0	0	0	0	0	113.7	R178 R179 I180 S808 S809 I810 L880	R178-A806 HydrophobicContact CB-CB 3.97Å; R179-A806 PolarHBondContact O-N 3.34Å; I180-A806 HydrophobicContact CG1-CB 3.92Å; A806-S808 PolarHBondContact O-N 3.45Å; A806-S809 PolarHBondContact O-N 2.91Å; A806-S809 PolarHBondContact O-OG 3.02Å; A806-S809 VanDerWaalsContact O-OG 3.08Å; A806-I810 HydrophobicContact CB-CD1 3.89Å; A806-I810 HydrophobicContact CB-CG1 4.2Å; A806-I810 PolarHBondContact O-N 3.4Å; A806-L880 HydrophobicContact CB-CD1 3.86Å; A806-L880 HydrophobicContact CB-CG 4.09Å
807	D	84.6	Confident	85.3	Confident	35 Å²	35	29.4 Å²	29.4	19%	0.187	17%	0.165	C	C	.	.	I	π-helix	trans	-59.4	-47	-174.9	-58.1	-110.3	0	0	0	111.6	I180 K181 H182 Y805 S809 G811	I180-D807 WeakPolarHBondContact CA-OD2 3.46Å; I180-D807 WeakPolarHBondContact CG2-OD1 3.38Å; K181-D807 PolarHBondContact N-OD1 2.99Å; K181-D807 PolarHBondContact N-OD2 3.09Å; H182-D807 IonicContact CD2-OD1 3.08Å; H182-D807 PolarHBondContact N-OD1 2.87Å; Y805-D807 WeakPolarHBondContact CB-OD2 3.47Å; D807-S809 VanDerWaalsContact C-N 3.26Å; D807-S809 PolarHBondContact O-N 2.8Å; D807-G811 WeakPolarHBondContact O-CA 3.4Å; D807-G811 PolarHBondContact O-N 3.43Å
808	S	81.4	Confident	85.4	Confident	31 Å²	31	25.3 Å²	25.3	22%	0.217	15%	0.147	C	C	.	.	I	π-helix	trans	-68.8	-16	179.3	-48.2	0	0	0	0	114.5	D803 A806 N812	D803-S808 WeakPolarHBondContact OD2-CB 3.45Å; D803-S808 PolarHBondContact OD2-OG 3.44Å; A806-S808 PolarHBondContact O-N 3.45Å; S808-N812 PolarHBondContact O-ND2 3.44Å
809	S	86.5	Confident	85.7	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.141	C	C	.	.	I	π-helix	trans	-100.2	-48.8	177.8	42.2	0	0	0	0	111	A806 D807 L880	A806-S809 PolarHBondContact O-N 2.91Å; A806-S809 PolarHBondContact O-OG 3.02Å; A806-S809 VanDerWaalsContact O-OG 3.08Å; D807-S809 VanDerWaalsContact C-N 3.26Å; D807-S809 PolarHBondContact O-N 2.8Å; S809-L880 WeakPolarHBondContact OG-CD1 3.33Å
810	I	88.4	Confident	86	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.14	C	C	.	.	I	π-helix	trans	-84.4	-41.6	-176.1	-51.5	-176.5	0	0	0	112	I165 I180 F186 A806 N812 V813 T814 I868 E879 L880	I165-I810 HydrophobicContact CD1-CB 4.32Å; I165-I810 HydrophobicContact CD1-CG1 4.07Å; I165-I810 HydrophobicContact CD1-CG2 4.23Å; I180-I810 HydrophobicContact CD1-CB 4.45Å; I180-I810 HydrophobicContact CD1-CD1 4.09Å; I180-I810 HydrophobicContact CD1-CG2 4.36Å; I180-I810 HydrophobicContact CG1-CD1 4.3Å; F186-I810 HydrophobicContact CD2-CG2 4.34Å; F186-I810 HydrophobicContact CE2-CG2 3.57Å; F186-I810 HydrophobicContact CZ-CG2 4.24Å; A806-I810 HydrophobicContact CB-CD1 3.89Å; A806-I810 HydrophobicContact CB-CG1 4.2Å; A806-I810 PolarHBondContact O-N 3.4Å; I810-N812 VanDerWaalsContact C-N 3.27Å; I810-N812 PolarHBondContact O-N 3.01Å; I810-V813 PolarHBondContact O-N 2.95Å; I810-T814 HydrophobicContact CG2-CG2 4.49Å; I810-T814 PolarHBondContact O-N 2.75Å; I810-T814 VanDerWaalsContact O-N 3.07Å; I810-T814 PolarHBondContact O-OG1 3.36Å; I810-T814 VanDerWaalsContact O-OG1 3.05Å; I810-I868 HydrophobicContact CD1-CG2 4.18Å; I810-E879 HydrophobicContact CD1-CB 3.87Å; I810-L880 HydrophobicContact CD1-CD1 4.44Å; I810-L880 HydrophobicContact CD1-CD2 3.94Å; I810-L880 HydrophobicContact CD1-CG 4.06Å; I810-L880 HydrophobicContact CG1-CD1 4.34Å; I810-L880 HydrophobicContact CG1-CD2 4.25Å; I810-L880 HydrophobicContact CG1-CG 4.43Å
811	G	79.9	Confident	86.4	Confident	25 Å²	25	24.2 Å²	24.2	26%	0.258	14%	0.14	S	C	.	.	I	π-helix	trans	-61.3	-38.5	179.5	0	0	0	0	0	111.8	D807 T814 G815	D807-G811 WeakPolarHBondContact O-CA 3.4Å; D807-G811 PolarHBondContact O-N 3.43Å; G811-T814 PolarHBondContact O-N 3.43Å; G811-T814 PolarHBondContact O-OG1 3.42Å; G811-G815 PolarHBondContact O-N 3.48Å
812	N	71.8	Confident	86.7	Confident	16 Å²	16	21.3 Å²	21.3	9%	0.086	12%	0.122	C	C	.	.	H	α-helix	trans	-60.8	-48.3	176.8	-70.6	6.4	0	0	0	112.2	R328 S808 I810 S816	R328-N812 WeakPolarHBondContact CD-ND2 3.46Å; R328-N812 WeakPolarHBondContact CD-OD1 3.29Å; R328-N812 WeakPolarHBondContact CG-ND2 3.36Å; R328-N812 PolarHBondContact NE-ND2 2.89Å; S808-N812 PolarHBondContact O-ND2 3.44Å; I810-N812 VanDerWaalsContact C-N 3.27Å; I810-N812 PolarHBondContact O-N 3.01Å; N812-S816 WeakPolarHBondContact O-CB 3.43Å; N812-S816 PolarHBondContact O-N 2.61Å; N812-S816 VanDerWaalsContact O-N 3.1Å; N812-S816 PolarHBondContact O-OG 2.66Å
813	V	85.1	Confident	87.4	Confident	5 Å²	5	20 Å²	20	3%	0.03	10%	0.104	C	C	.	.	H	α-helix	trans	-61.7	-50.1	178.7	158.8	0	0	0	0	111.1	N160 I164 I165 I810 S816 N817	N160-V813 HydrophobicContact CB-CG1 3.96Å; N160-V813 VanDerWaalsContact O-CG1 3.31Å; N160-V813 WeakPolarHBondContact O-CG1 3.27Å; I164-V813 HydrophobicContact CB-CG2 4.39Å; I164-V813 HydrophobicContact CG2-CG2 3.97Å; I165-V813 HydrophobicContact CD1-CB 4.21Å; I165-V813 HydrophobicContact CD1-CG1 4.16Å; I165-V813 HydrophobicContact CD1-CG2 4.13Å; I165-V813 HydrophobicContact CG1-CG1 4.32Å; I810-V813 PolarHBondContact O-N 2.95Å; V813-S816 PolarHBondContact O-N 3.23Å; V813-N817 VanDerWaalsContact O-CG 3.24Å; V813-N817 PolarHBondContact O-N 2.74Å; V813-N817 VanDerWaalsContact O-N 3.12Å; V813-N817 PolarHBondContact O-OD1 2.93Å
814	T	86.6	Confident	87.8	Confident	2 Å²	2	18.7 Å²	18.7	1%	0.012	10%	0.097	C	C	.	.	H	α-helix	trans	-69.2	-40.8	-175.6	51.2	0	0	0	0	113	F186 S193 I810 G811 N817 A818	F186-T814 HydrophobicContact CE2-CG2 4.01Å; S193-T814 WeakPolarHBondContact CB-O 3.42Å; I810-T814 HydrophobicContact CG2-CG2 4.49Å; I810-T814 PolarHBondContact O-N 2.75Å; I810-T814 VanDerWaalsContact O-N 3.07Å; I810-T814 PolarHBondContact O-OG1 3.36Å; I810-T814 VanDerWaalsContact O-OG1 3.05Å; G811-T814 PolarHBondContact O-N 3.43Å; G811-T814 PolarHBondContact O-OG1 3.42Å; T814-N817 PolarHBondContact O-N 3.42Å; T814-A818 PolarHBondContact O-N 2.7Å
815	G	85.7	Confident	88.3	Confident	1 Å²	1	12 Å²	12	1%	0.01	7%	0.066	C	C	.	.	H	α-helix	trans	-61.5	-46.9	174.7	0	0	0	0	0	112.1	G811 N817 A818 V819	G811-G815 PolarHBondContact O-N 3.48Å; G815-N817 VanDerWaalsContact C-N 3.33Å; G815-N817 PolarHBondContact O-N 3.2Å; G815-A818 PolarHBondContact O-N 2.77Å; G815-V819 WeakPolarHBondContact O-CG2 3.03Å; G815-V819 PolarHBondContact O-N 3.35Å
816	S	88.5	Confident	88.6	Confident	1 Å²	1	6.9 Å²	6.9	1%	0.007	5%	0.046	C	C	.	.	H	α-helix	trans	-63.2	-38.4	-179	-49.7	0	0	0	0	112.1	R328 N812 V813 A818 V819 N820	R328-S816 PolarHBondContact NH2-OG 3.1Å; N812-S816 WeakPolarHBondContact O-CB 3.43Å; N812-S816 PolarHBondContact O-N 2.61Å; N812-S816 VanDerWaalsContact O-N 3.1Å; N812-S816 PolarHBondContact O-OG 2.66Å; V813-S816 PolarHBondContact O-N 3.23Å; S816-A818 VanDerWaalsContact C-N 3.29Å; S816-A818 PolarHBondContact O-N 2.79Å; S816-V819 PolarHBondContact O-N 2.88Å; S816-V819 VanDerWaalsContact O-N 3.16Å; S816-N820 VanDerWaalsContact O-CG 3.28Å; S816-N820 PolarHBondContact O-N 2.9Å; S816-N820 PolarHBondContact O-OD1 2.92Å; S816-N820 VanDerWaalsContact O-OD1 3.14Å
817	N	91.8	Very high	88.9	Confident	1 Å²	1	9.5 Å²	9.5	1%	0.005	6%	0.059	C	C	.	.	H	α-helix	trans	-59.7	-37.1	176.5	-73.1	1	0	0	0	113.2	A157 N160 Y197 V813 T814 G815 Y857	A157-N817 PolarHBondContact O-ND2 3.36Å; N160-N817 PolarHBondContact ND2-OD1 2.79Å; Y197-N817 HydrophobicContact CE2-CB 4.18Å; Y197-N817 VanDerWaalsContact CE2-O 3.29Å; Y197-N817 WeakPolarHBondContact CE2-O 3.32Å; Y197-N817 PolarHBondContact OH-O 2.83Å; V813-N817 VanDerWaalsContact O-CG 3.24Å; V813-N817 PolarHBondContact O-N 2.74Å; V813-N817 VanDerWaalsContact O-N 3.12Å; V813-N817 PolarHBondContact O-OD1 2.93Å; T814-N817 PolarHBondContact O-N 3.42Å; G815-N817 VanDerWaalsContact C-N 3.33Å; G815-N817 PolarHBondContact O-N 3.2Å; N817-Y857 PolarHBondContact ND2-OH 2.9Å
818	A	92.3	Very high	89.4	Confident	0 Å²	0	7.9 Å²	7.9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-70.2	-43	175.8	0	0	0	0	0	111.5	I227 T814 G815 S816 N820 V821 F822	I227-A818 HydrophobicContact CD1-CB 3.85Å; T814-A818 PolarHBondContact O-N 2.7Å; G815-A818 PolarHBondContact O-N 2.77Å; S816-A818 VanDerWaalsContact C-N 3.29Å; S816-A818 PolarHBondContact O-N 2.79Å; A818-N820 VanDerWaalsContact C-N 3.32Å; A818-N820 PolarHBondContact O-N 2.88Å; A818-V821 PolarHBondContact O-N 2.93Å; A818-F822 HydrophobicContact CB-CD2 4.26Å; A818-F822 HydrophobicContact CB-CE2 4.16Å; A818-F822 WeakPolarHBondContact O-CD2 3.43Å; A818-F822 PolarHBondContact O-N 3.15Å
819	V	92.8	Very high	90	Very high	3 Å²	3	6.6 Å²	6.6	2%	0.018	4%	0.041	C	C	.	.	H	α-helix	trans	-63.2	-37.5	180	177.9	0	0	0	0	111.4	L119 A123 I131 F224 G815 S816 V821 F822 L823 G824	L119-V819 WeakPolarHBondContact O-CG2 3.11Å; A123-V819 HydrophobicContact CB-CB 4.31Å; A123-V819 HydrophobicContact CB-CG2 3.76Å; I131-V819 HydrophobicContact CD1-CG1 4.11Å; F224-V819 HydrophobicContact CD2-CG1 4.48Å; F224-V819 HydrophobicContact CD2-CG2 4.13Å; F224-V819 HydrophobicContact CE2-CB 4.49Å; F224-V819 HydrophobicContact CE2-CG1 4.08Å; F224-V819 HydrophobicContact CE2-CG2 3.74Å; G815-V819 WeakPolarHBondContact O-CG2 3.03Å; G815-V819 PolarHBondContact O-N 3.35Å; S816-V819 PolarHBondContact O-N 2.88Å; S816-V819 VanDerWaalsContact O-N 3.16Å; V819-V821 VanDerWaalsContact C-N 3.26Å; V819-V821 PolarHBondContact O-N 3.37Å; V819-F822 PolarHBondContact O-N 3.3Å; V819-L823 HydrophobicContact CG1-CB 3.89Å; V819-L823 HydrophobicContact CG1-CD2 3.96Å; V819-L823 WeakPolarHBondContact O-CA 3.34Å; V819-L823 WeakPolarHBondContact O-CB 3.48Å; V819-L823 PolarHBondContact O-N 2.87Å; V819-G824 PolarHBondContact O-N 2.8Å
820	N	93	Very high	90.5	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.043	C	C	.	.	I	π-helix	trans	-55.4	-42.1	177.5	-69.6	-1.6	0	0	0	112.8	S127 I153 S816 A818 G824 I825	S127-N820 WeakPolarHBondContact CB-OD1 3.29Å; S127-N820 PolarHBondContact OG-OD1 2.93Å; I153-N820 WeakPolarHBondContact CD1-O 3.36Å; I153-N820 HydrophobicContact CG1-CB 4.33Å; I153-N820 HydrophobicContact CG2-CB 3.82Å; S816-N820 VanDerWaalsContact O-CG 3.28Å; S816-N820 PolarHBondContact O-N 2.9Å; S816-N820 PolarHBondContact O-OD1 2.92Å; S816-N820 VanDerWaalsContact O-OD1 3.14Å; A818-N820 VanDerWaalsContact C-N 3.32Å; A818-N820 PolarHBondContact O-N 2.88Å; N820-G824 WeakPolarHBondContact O-CA 3.2Å; N820-G824 PolarHBondContact O-N 2.57Å; N820-I825 PolarHBondContact O-N 3.21Å; N820-I825 VanDerWaalsContact O-N 3.16Å
821	V	95	Very high	90.8	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.058	C	C	.	.	I	π-helix	trans	-80.7	-53.9	179.8	179.3	0	0	0	0	110.8	I153 A196 Y197 M200 A818 V819 L823 I825 G826	I153-V821 HydrophobicContact CG2-CG2 4.09Å; A196-V821 HydrophobicContact CB-CB 3.81Å; A196-V821 HydrophobicContact CB-CG1 4.06Å; A196-V821 HydrophobicContact CB-CG2 4.21Å; Y197-V821 HydrophobicContact CD1-CG2 3.95Å; Y197-V821 HydrophobicContact CD2-CG2 4.22Å; Y197-V821 HydrophobicContact CE1-CG2 3.55Å; Y197-V821 HydrophobicContact CE2-CG2 3.83Å; Y197-V821 HydrophobicContact CG-CG2 4.24Å; Y197-V821 VanDerWaalsContact CZ-CG2 3.43Å; M200-V821 HydrophobicContact CB-CG1 4.24Å; A818-V821 PolarHBondContact O-N 2.93Å; V819-V821 VanDerWaalsContact C-N 3.26Å; V819-V821 PolarHBondContact O-N 3.37Å; V821-L823 PolarHBondContact O-N 3.14Å; V821-I825 WeakPolarHBondContact O-CB 3.42Å; V821-I825 PolarHBondContact O-N 3.42Å; V821-G826 PolarHBondContact O-N 3.44Å
822	F	95.3	Very high	91.5	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.046	C	C	.	.	I	π-helix	trans	-66.1	-39.2	-174.3	-61.8	-41	0	0	0	112.7	W192 F195 A196 T220 F221 F223 F224 I227 A818 V819 G826	W192-F822 AromaticContact CE3-CE2 3.91Å; W192-F822 HydrophobicContact CE3-CE2 3.91Å; W192-F822 AromaticContact CE3-CZ 3.77Å; W192-F822 HydrophobicContact CE3-CZ 3.77Å; W192-F822 HydrophobicContact CZ3-CZ 4.27Å; F195-F822 HydrophobicContact CD1-CZ 4.14Å; A196-F822 HydrophobicContact CB-CD1 4.18Å; A196-F822 HydrophobicContact CB-CD2 4.36Å; A196-F822 HydrophobicContact CB-CE1 3.57Å; A196-F822 HydrophobicContact CB-CE2 3.79Å; A196-F822 HydrophobicContact CB-CZ 3.34Å; T220-F822 HydrophobicContact CG2-CD1 4.33Å; T220-F822 WeakPolarHBondContact O-CA 3.22Å; F221-F822 WeakPolarHBondContact CA-O 3.3Å; F223-F822 HydrophobicContact CB-CD1 3.5Å; F223-F822 VanDerWaalsContact CB-CD1 3.5Å; F223-F822 HydrophobicContact CB-CD2 4.25Å; F223-F822 HydrophobicContact CB-CE1 3.57Å; F223-F822 HydrophobicContact CB-CE2 4.31Å; F223-F822 HydrophobicContact CB-CG 3.87Å; F223-F822 HydrophobicContact CB-CZ 4Å; F223-F822 HydrophobicContact CD2-CD1 4.19Å; F223-F822 AromaticContact CD2-CE1 3.82Å; F223-F822 HydrophobicContact CD2-CE1 3.82Å; F223-F822 HydrophobicContact CG-CD1 4.33Å; F223-F822 HydrophobicContact CG-CE1 4.06Å; F224-F822 HydrophobicContact CB-CB 3.87Å; I227-F822 HydrophobicContact CG2-CD2 4.32Å; A818-F822 HydrophobicContact CB-CD2 4.26Å; A818-F822 HydrophobicContact CB-CE2 4.16Å; A818-F822 WeakPolarHBondContact O-CD2 3.43Å; A818-F822 PolarHBondContact O-N 3.15Å; V819-F822 PolarHBondContact O-N 3.3Å; F822-G826 WeakPolarHBondContact O-CA 3.4Å
823	L	94.2	Very high	92.6	Very high	22 Å²	22	7.9 Å²	7.9	12%	0.115	4%	0.043	C	C	.	.	I	π-helix	trans	-91.9	-48.8	178.2	-173.4	57.9	0	0	0	112	L124 I131 F221 F224 V819 V821 L827	L124-L823 HydrophobicContact CD1-CD2 3.77Å; I131-L823 HydrophobicContact CD1-CD2 4.18Å; I131-L823 HydrophobicContact CD1-CG 4.4Å; F221-L823 HydrophobicContact CD2-CD1 4.14Å; F221-L823 HydrophobicContact CE2-CD1 3.56Å; F224-L823 HydrophobicContact CZ-CD2 4.43Å; V819-L823 HydrophobicContact CG1-CB 3.89Å; V819-L823 HydrophobicContact CG1-CD2 3.96Å; V819-L823 WeakPolarHBondContact O-CA 3.34Å; V819-L823 WeakPolarHBondContact O-CB 3.48Å; V819-L823 PolarHBondContact O-N 2.87Å; V821-L823 PolarHBondContact O-N 3.14Å; L823-L827 WeakPolarHBondContact O-CB 3.34Å; L823-L827 PolarHBondContact O-N 2.84Å
824	G	91.8	Very high	93.1	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.058	C	C	.	.	I	π-helix	trans	-67.4	-65.1	-176.7	0	0	0	0	0	113.2	V819 N820 G828	V819-G824 PolarHBondContact O-N 2.8Å; N820-G824 WeakPolarHBondContact O-CA 3.2Å; N820-G824 PolarHBondContact O-N 2.57Å; G824-G828 PolarHBondContact O-N 2.92Å; G824-G828 VanDerWaalsContact O-N 3.16Å
825	I	93.7	Very high	93.6	Very high	2 Å²	2	14 Å²	14	1%	0.01	7%	0.07	C	C	.	.	I	π-helix	trans	-64.2	-46.5	176.1	-65.8	-59.1	0	0	0	110.9	P150 I153 M200 N820 V821 L827 G828 W829	P150-I825 HydrophobicContact CB-CD1 3.98Å; P150-I825 HydrophobicContact CG-CD1 3.88Å; I153-I825 HydrophobicContact CD1-CD1 3.72Å; I153-I825 HydrophobicContact CD1-CG1 3.68Å; I153-I825 HydrophobicContact CG2-CG1 4.48Å; M200-I825 HydrophobicContact SD-CG1 4.2Å; N820-I825 PolarHBondContact O-N 3.21Å; N820-I825 VanDerWaalsContact O-N 3.16Å; V821-I825 WeakPolarHBondContact O-CB 3.42Å; V821-I825 PolarHBondContact O-N 3.42Å; I825-L827 PolarHBondContact O-N 3.45Å; I825-G828 PolarHBondContact O-N 2.83Å; I825-W829 HydrophobicContact CD1-CZ2 4.26Å; I825-W829 HydrophobicContact CG2-CD2 3.29Å; I825-W829 VanDerWaalsContact CG2-CE2 3.42Å; I825-W829 HydrophobicContact CG2-CE3 3.44Å; I825-W829 VanDerWaalsContact CG2-CE3 3.44Å; I825-W829 HydrophobicContact CG2-CG 3.88Å; I825-W829 HydrophobicContact CG2-CH2 3.8Å; I825-W829 HydrophobicContact CG2-CZ2 3.66Å; I825-W829 HydrophobicContact CG2-CZ3 3.72Å; I825-W829 VanDerWaalsContact O-CB 3.29Å; I825-W829 WeakPolarHBondContact O-CB 3.43Å; I825-W829 PolarHBondContact O-N 2.88Å
826	G	94.9	Very high	94	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-57.7	-45.1	-178.3	0	0	0	0	0	113.3	V821 F822 S830	V821-G826 PolarHBondContact O-N 3.44Å; F822-G826 WeakPolarHBondContact O-CA 3.4Å; G826-S830 WeakPolarHBondContact O-CB 3.44Å; G826-S830 PolarHBondContact O-N 2.99Å; G826-S830 PolarHBondContact O-OG 2.82Å
827	L	94.6	Very high	94.3	Very high	56 Å²	56	17.6 Å²	17.6	29%	0.293	10%	0.096	S	C	.	.	H	α-helix	trans	-68.2	-50.1	177.4	-178.6	61.6	0	0	0	111.6	V135 L823 I825 W829 S830 I831	V135-L827 HydrophobicContact CG2-CD2 4.13Å; V135-L827 HydrophobicContact CG2-CG 4.31Å; L823-L827 WeakPolarHBondContact O-CB 3.34Å; L823-L827 PolarHBondContact O-N 2.84Å; I825-L827 PolarHBondContact O-N 3.45Å; L827-W829 PolarHBondContact O-N 3.32Å; L827-S830 PolarHBondContact O-N 3.3Å; L827-I831 HydrophobicContact CD1-CD1 4.08Å; L827-I831 HydrophobicContact CD1-CG1 4.47Å; L827-I831 HydrophobicContact CG-CD1 4.06Å; L827-I831 WeakPolarHBondContact O-CG1 3.45Å; L827-I831 PolarHBondContact O-N 3.07Å; L827-I831 VanDerWaalsContact O-N 3.07Å
828	G	93.8	Very high	94.4	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-59.2	-49.2	-178.5	0	0	0	0	0	112.4	I138 G824 I825 S830 I831 A832	I138-G828 WeakPolarHBondContact CD1-O 3.25Å; G824-G828 PolarHBondContact O-N 2.92Å; G824-G828 VanDerWaalsContact O-N 3.16Å; I825-G828 PolarHBondContact O-N 2.83Å; G828-S830 VanDerWaalsContact C-N 3.35Å; G828-S830 PolarHBondContact O-N 2.93Å; G828-I831 PolarHBondContact O-N 3.04Å; G828-A832 PolarHBondContact O-N 2.91Å; G828-A832 VanDerWaalsContact O-N 3.08Å
829	W	95.3	Very high	94.5	Very high	3 Å²	3	30.2 Å²	30.2	1%	0.011	16%	0.156	C	C	.	.	H	α-helix	trans	-69.8	-31.2	179	-68	3.1	0	0	0	112.3	M200 I203 I204 V212 A217 I825 L827 A832 A833 F843 V845 L850	M200-W829 HydrophobicContact CG-CH2 4.06Å; M200-W829 HydrophobicContact CG-CZ3 4.47Å; M200-W829 HydrophobicContact SD-CH2 4.45Å; I203-W829 HydrophobicContact CD1-CE3 3.93Å; I203-W829 HydrophobicContact CD1-CZ3 3.44Å; I203-W829 VanDerWaalsContact CD1-CZ3 3.44Å; I203-W829 HydrophobicContact CG1-CZ3 3.99Å; I204-W829 HydrophobicContact CG2-CH2 3.63Å; I204-W829 HydrophobicContact CG2-CZ3 3.91Å; V212-W829 HydrophobicContact CG1-CE3 4.04Å; V212-W829 HydrophobicContact CG2-CE3 3.92Å; V212-W829 HydrophobicContact CG2-CZ3 3.96Å; A217-W829 HydrophobicContact CB-CB 4.06Å; I825-W829 HydrophobicContact CD1-CZ2 4.26Å; I825-W829 HydrophobicContact CG2-CD2 3.29Å; I825-W829 VanDerWaalsContact CG2-CE2 3.42Å; I825-W829 HydrophobicContact CG2-CE3 3.44Å; I825-W829 VanDerWaalsContact CG2-CE3 3.44Å; I825-W829 HydrophobicContact CG2-CG 3.88Å; I825-W829 HydrophobicContact CG2-CH2 3.8Å; I825-W829 HydrophobicContact CG2-CZ2 3.66Å; I825-W829 HydrophobicContact CG2-CZ3 3.72Å; I825-W829 VanDerWaalsContact O-CB 3.29Å; I825-W829 WeakPolarHBondContact O-CB 3.43Å; I825-W829 PolarHBondContact O-N 2.88Å; L827-W829 PolarHBondContact O-N 3.32Å; W829-A832 PolarHBondContact O-N 3.41Å; W829-A833 WeakPolarHBondContact O-CB 3.13Å; W829-A833 PolarHBondContact O-N 2.95Å; W829-F843 HydrophobicContact CB-CE1 3.95Å; W829-F843 AromaticContact CD1-CE1 3.78Å; W829-F843 AromaticContact CD1-CZ 3.84Å; W829-F843 HydrophobicContact CD2-CE1 4.28Å; W829-F843 AromaticContact CG-CE1 3.75Å; W829-F843 HydrophobicContact CG-CE1 3.75Å; W829-F843 HydrophobicContact CG-CZ 4.27Å; W829-V845 HydrophobicContact CH2-CG1 4.11Å; W829-V845 HydrophobicContact CZ2-CG1 3.9Å; W829-L850 HydrophobicContact CZ2-CD2 4.5Å
830	S	95.8	Very high	94.4	Very high	6 Å²	6	33.5 Å²	33.5	4%	0.042	19%	0.19	C	C	.	.	H	α-helix	trans	-63.4	-45.2	174.4	-68	0	0	0	0	111	A217 L218 G826 L827 G828 I834	A217-S830 PolarHBondContact O-OG 3.01Å; A217-S830 VanDerWaalsContact O-OG 3.1Å; L218-S830 PolarHBondContact N-OG 2.88Å; G826-S830 WeakPolarHBondContact O-CB 3.44Å; G826-S830 PolarHBondContact O-N 2.99Å; G826-S830 PolarHBondContact O-OG 2.82Å; L827-S830 PolarHBondContact O-N 3.3Å; G828-S830 VanDerWaalsContact C-N 3.35Å; G828-S830 PolarHBondContact O-N 2.93Å; S830-I834 WeakPolarHBondContact O-CB 3.27Å; S830-I834 WeakPolarHBondContact O-CD1 3.16Å; S830-I834 WeakPolarHBondContact O-CG1 3.49Å; S830-I834 PolarHBondContact O-N 2.79Å
831	I	94.9	Very high	94.4	Very high	61 Å²	61	37 Å²	37	31%	0.313	21%	0.211	S	C	.	.	H	α-helix	trans	-61	-47.4	177.6	-66.6	166.3	0	0	0	110.2	F143 L827 G828 Y835	F143-I831 HydrophobicContact CD1-CG2 4.01Å; F143-I831 HydrophobicContact CE1-CG2 3.61Å; L827-I831 HydrophobicContact CD1-CD1 4.08Å; L827-I831 HydrophobicContact CD1-CG1 4.47Å; L827-I831 HydrophobicContact CG-CD1 4.06Å; L827-I831 WeakPolarHBondContact O-CG1 3.45Å; L827-I831 PolarHBondContact O-N 3.07Å; L827-I831 VanDerWaalsContact O-N 3.07Å; G828-I831 PolarHBondContact O-N 3.04Å; I831-Y835 WeakPolarHBondContact O-CB 3.39Å; I831-Y835 PolarHBondContact O-N 3.49Å
832	A	95	Very high	94.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-48.7	179.6	0	0	0	0	0	112.8	I138 F143 G828 W829 I834 Y835 H836 F843	I138-A832 HydrophobicContact CG2-CB 3.71Å; F143-A832 HydrophobicContact CB-CB 4.4Å; G828-A832 PolarHBondContact O-N 2.91Å; G828-A832 VanDerWaalsContact O-N 3.08Å; W829-A832 PolarHBondContact O-N 3.41Å; A832-I834 VanDerWaalsContact C-N 3.33Å; A832-I834 PolarHBondContact O-N 2.78Å; A832-Y835 WeakPolarHBondContact O-CB 3.48Å; A832-Y835 PolarHBondContact O-N 2.77Å; A832-H836 PolarHBondContact O-CD2 2.85Å; A832-H836 VanDerWaalsContact O-CD2 3.27Å; A832-H836 PolarHBondContact O-N 3.36Å; A832-F843 HydrophobicContact CB-CD1 4.14Å; A832-F843 HydrophobicContact CB-CD2 3.68Å; A832-F843 HydrophobicContact CB-CE1 3.99Å; A832-F843 HydrophobicContact CB-CE2 3.47Å; A832-F843 VanDerWaalsContact CB-CE2 3.47Å; A832-F843 HydrophobicContact CB-CG 4.03Å; A832-F843 HydrophobicContact CB-CZ 3.66Å
833	A	95.3	Very high	94.2	Very high	2 Å²	2	43.6 Å²	43.6	2%	0.017	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-40.9	-178.8	0	0	0	0	0	111.5	V214 A217 W829 A837 F843	V214-A833 HydrophobicContact CG2-CB 4.09Å; A217-A833 HydrophobicContact CB-CB 4.17Å; W829-A833 WeakPolarHBondContact O-CB 3.13Å; W829-A833 PolarHBondContact O-N 2.95Å; A833-A837 WeakPolarHBondContact O-CB 3.45Å; A833-A837 PolarHBondContact O-N 3Å; A833-F843 HydrophobicContact CB-CD1 4.41Å
834	I	95.8	Very high	94	Very high	70 Å²	70	47.1 Å²	47.1	36%	0.359	26%	0.261	S	S	.	.	H	α-helix	trans	-64	-44.8	175	-68.2	167	0	0	0	110.7	V214 L218 S830 A832 H836 A837 I838	V214-I834 HydrophobicContact CG1-CG1 4.02Å; L218-I834 HydrophobicContact CD2-CD1 4.37Å; S830-I834 WeakPolarHBondContact O-CB 3.27Å; S830-I834 WeakPolarHBondContact O-CD1 3.16Å; S830-I834 WeakPolarHBondContact O-CG1 3.49Å; S830-I834 PolarHBondContact O-N 2.79Å; A832-I834 VanDerWaalsContact C-N 3.33Å; A832-I834 PolarHBondContact O-N 2.78Å; I834-H836 PolarHBondContact O-N 2.83Å; I834-A837 PolarHBondContact O-N 2.83Å; I834-I838 HydrophobicContact CG2-CD1 3.85Å; I834-I838 HydrophobicContact CG2-CG1 4.47Å; I834-I838 VanDerWaalsContact O-CG1 3.3Å; I834-I838 WeakPolarHBondContact O-CG1 3.27Å; I834-I838 PolarHBondContact O-N 3.15Å
835	Y	95.9	Very high	93.9	Very high	64 Å²	64	47.4 Å²	47.4	25%	0.251	26%	0.263	S	S	.	.	H	α-helix	trans	-59.6	-47.9	178.1	176.3	-95.4	0	0	0	112.3	F143 I831 A832 I838 K839	F143-Y835 HydrophobicContact CB-CD1 3.5Å; F143-Y835 VanDerWaalsContact CB-CD1 3.5Å; F143-Y835 HydrophobicContact CB-CE1 3.89Å; F143-Y835 HydrophobicContact CB-CG 4.05Å; F143-Y835 HydrophobicContact CD1-CD1 4.36Å; F143-Y835 HydrophobicContact CD1-CD2 4.46Å; F143-Y835 HydrophobicContact CD1-CG 4.04Å; F143-Y835 AromaticContact CD2-CD1 3.48Å; F143-Y835 HydrophobicContact CD2-CD1 3.48Å; F143-Y835 VanDerWaalsContact CD2-CD1 3.48Å; F143-Y835 AromaticContact CD2-CD2 3.68Å; F143-Y835 HydrophobicContact CD2-CD2 3.68Å; F143-Y835 AromaticContact CD2-CE1 3.35Å; F143-Y835 HydrophobicContact CD2-CE1 3.35Å; F143-Y835 AromaticContact CD2-CE2 3.55Å; F143-Y835 HydrophobicContact CD2-CE2 3.55Å; F143-Y835 AromaticContact CD2-CG 3.61Å; F143-Y835 HydrophobicContact CD2-CG 3.61Å; F143-Y835 AromaticContact CD2-CZ 3.33Å; F143-Y835 HydrophobicContact CE1-CD2 4.42Å; F143-Y835 HydrophobicContact CE1-CG 4.42Å; F143-Y835 HydrophobicContact CE2-CD1 4.31Å; F143-Y835 AromaticContact CE2-CD2 3.64Å; F143-Y835 HydrophobicContact CE2-CD2 3.64Å; F143-Y835 HydrophobicContact CE2-CE1 4.15Å; F143-Y835 AromaticContact CE2-CE2 3.44Å; F143-Y835 HydrophobicContact CE2-CE2 3.44Å; F143-Y835 VanDerWaalsContact CE2-CE2 3.44Å; F143-Y835 HydrophobicContact CE2-CG 4.03Å; F143-Y835 AromaticContact CE2-CZ 3.67Å; F143-Y835 AromaticContact CG-CD1 3.51Å; F143-Y835 HydrophobicContact CG-CD1 3.51Å; F143-Y835 HydrophobicContact CG-CD2 4.11Å; F143-Y835 AromaticContact CG-CE1 3.85Å; F143-Y835 HydrophobicContact CG-CE1 3.85Å; F143-Y835 HydrophobicContact CG-CE2 4.4Å; F143-Y835 AromaticContact CG-CG 3.61Å; F143-Y835 HydrophobicContact CG-CG 3.61Å; F143-Y835 HydrophobicContact CZ-CD2 4.02Å; F143-Y835 HydrophobicContact CZ-CE2 4.21Å; F143-Y835 HydrophobicContact CZ-CG 4.41Å; I831-Y835 WeakPolarHBondContact O-CB 3.39Å; I831-Y835 PolarHBondContact O-N 3.49Å; A832-Y835 WeakPolarHBondContact O-CB 3.48Å; A832-Y835 PolarHBondContact O-N 2.77Å; Y835-I838 PolarHBondContact O-N 2.83Å; Y835-K839 HydrophobicContact CD1-CD 4.29Å; Y835-K839 HydrophobicContact CE1-CD 3.62Å; Y835-K839 HydrophobicContact CE2-CD 4.44Å; Y835-K839 PolarHBondContact O-N 2.81Å; Y835-K839 VanDerWaalsContact O-N 3.08Å; Y835-K839 WeakPolarHBondContact OH-CE 3.13Å; Y835-K839 PolarHBondContact OH-NZ 2.85Å
836	H	95.1	Very high	93.4	Very high	23 Å²	23	52.6 Å²	52.6	11%	0.106	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-40.8	177.2	-83.2	-74.6	0	0	0	111.8	F143 A832 I834 I838 K839 G840 T841 F843	F143-H836 PolarHBondContact O-NE2 3.09Å; F143-H836 VanDerWaalsContact O-NE2 3.09Å; A832-H836 PolarHBondContact O-CD2 2.85Å; A832-H836 VanDerWaalsContact O-CD2 3.27Å; A832-H836 PolarHBondContact O-N 3.36Å; I834-H836 PolarHBondContact O-N 2.83Å; H836-I838 PolarHBondContact O-N 3.38Å; H836-K839 CarbonylContact O-C 3.57Å; H836-K839 PolarHBondContact O-N 2.8Å; H836-K839 VanDerWaalsContact O-N 3.12Å; H836-G840 PolarHBondContact O-N 3.04Å; H836-T841 CarbonylContact C-O 3.53Å; H836-T841 WeakPolarHBondContact CB-O 3.39Å; H836-T841 PolarHBondContact ND1-OG1 3.13Å; H836-T841 PolarHBondContact O-N 2.67Å; H836-F843 HydrophobicContact CB-CB 4.17Å; H836-F843 AromaticContact CD2-CD2 3.71Å
837	A	93.5	Very high	92.8	Very high	55 Å²	55	53.7 Å²	53.7	46%	0.455	29%	0.294	S	S	.	.	H	α-helix	trans	-60.7	-41.5	174.9	0	0	0	0	0	112.6	V214 A833 I834 K839 G840	V214-A837 HydrophobicContact CG2-CB 3.7Å; A833-A837 WeakPolarHBondContact O-CB 3.45Å; A833-A837 PolarHBondContact O-N 3Å; I834-A837 PolarHBondContact O-N 2.83Å; A837-K839 VanDerWaalsContact C-N 3.31Å; A837-K839 PolarHBondContact O-N 2.79Å; A837-G840 PolarHBondContact O-N 3.39Å
838	I	95.1	Very high	92.1	Very high	139 Å²	139	52.2 Å²	52.2	71%	0.713	29%	0.292	S	S	*	.	H	α-helix	trans	-64.5	-36.7	175.4	-68.2	166.3	0	0	0	111.1	I834 Y835 H836 G840	I834-I838 HydrophobicContact CG2-CD1 3.85Å; I834-I838 HydrophobicContact CG2-CG1 4.47Å; I834-I838 VanDerWaalsContact O-CG1 3.3Å; I834-I838 WeakPolarHBondContact O-CG1 3.27Å; I834-I838 PolarHBondContact O-N 3.15Å; Y835-I838 PolarHBondContact O-N 2.83Å; H836-I838 PolarHBondContact O-N 3.38Å; I838-G840 VanDerWaalsContact C-N 3.31Å
839	K	93.1	Very high	91.6	Very high	127 Å²	127	52.8 Å²	52.8	55%	0.552	30%	0.296	S	S	*	.	H	α-helix	trans	-80.3	-6.7	177	-77.1	-168.9	165.7	-172	0	114.6	Y835 H836 A837 T841	Y835-K839 HydrophobicContact CD1-CD 4.29Å; Y835-K839 HydrophobicContact CE1-CD 3.62Å; Y835-K839 HydrophobicContact CE2-CD 4.44Å; Y835-K839 PolarHBondContact O-N 2.81Å; Y835-K839 VanDerWaalsContact O-N 3.08Å; Y835-K839 WeakPolarHBondContact OH-CE 3.13Å; Y835-K839 PolarHBondContact OH-NZ 2.85Å; H836-K839 CarbonylContact O-C 3.57Å; H836-K839 PolarHBondContact O-N 2.8Å; H836-K839 VanDerWaalsContact O-N 3.12Å; A837-K839 VanDerWaalsContact C-N 3.31Å; A837-K839 PolarHBondContact O-N 2.79Å; K839-T841 VanDerWaalsContact C-N 3.25Å; K839-T841 PolarHBondContact O-N 2.97Å
840	G	91.8	Very high	91.3	Very high	72 Å²	72	53.4 Å²	53.4	74%	0.742	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	21.4	-173.8	0	0	0	0	0	114.2	H836 A837 I838	H836-G840 PolarHBondContact O-N 3.04Å; A837-G840 PolarHBondContact O-N 3.39Å; I838-G840 VanDerWaalsContact C-N 3.31Å
841	T	93	Very high	91	Very high	73 Å²	73	53.1 Å²	53.1	45%	0.448	30%	0.297	S	S	.	.			trans	-106.8	166.4	172.5	52.2	0	0	0	0	109.9	H836 K839	H836-T841 CarbonylContact C-O 3.53Å; H836-T841 WeakPolarHBondContact CB-O 3.39Å; H836-T841 PolarHBondContact ND1-OG1 3.13Å; H836-T841 PolarHBondContact O-N 2.67Å; K839-T841 VanDerWaalsContact C-N 3.25Å; K839-T841 PolarHBondContact O-N 2.97Å
842	Q	91.5	Very high	90.8	Very high	135 Å²	135	51.7 Å²	51.7	63%	0.631	29%	0.289	S	S	*	.			trans	-100.8	141.6	177.6	-70	-179.8	-13.5	0	0	110	V211 L844	V211-Q842 HydrophobicContact CG1-CB 3.98Å; V211-Q842 HydrophobicContact CG1-CG 4.37Å; Q842-L844 HydrophobicContact CB-CD2 4.36Å; Q842-L844 PolarHBondContact O-N 3.45Å
843	F	93.9	Very high	90.6	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.018	29%	0.29	C	S	.	.			trans	-82.5	107.5	174.7	178.4	-127.9	0	0	0	109.4	F143 A145 V212 W829 A832 A833 H836 V845	F143-F843 WeakPolarHBondContact O-CD2 3.48Å; F143-F843 WeakPolarHBondContact O-CE2 3.32Å; A145-F843 HydrophobicContact CB-CE2 3.84Å; A145-F843 HydrophobicContact CB-CZ 3.9Å; V212-F843 HydrophobicContact CB-CD1 3.83Å; V212-F843 HydrophobicContact CB-CE1 4.25Å; V212-F843 HydrophobicContact CG1-CD1 4.32Å; V212-F843 PolarHBondContact N-O 3.42Å; W829-F843 HydrophobicContact CB-CE1 3.95Å; W829-F843 AromaticContact CD1-CE1 3.78Å; W829-F843 AromaticContact CD1-CZ 3.84Å; W829-F843 HydrophobicContact CD2-CE1 4.28Å; W829-F843 AromaticContact CG-CE1 3.75Å; W829-F843 HydrophobicContact CG-CE1 3.75Å; W829-F843 HydrophobicContact CG-CZ 4.27Å; A832-F843 HydrophobicContact CB-CD1 4.14Å; A832-F843 HydrophobicContact CB-CD2 3.68Å; A832-F843 HydrophobicContact CB-CE1 3.99Å; A832-F843 HydrophobicContact CB-CE2 3.47Å; A832-F843 VanDerWaalsContact CB-CE2 3.47Å; A832-F843 HydrophobicContact CB-CG 4.03Å; A832-F843 HydrophobicContact CB-CZ 3.66Å; A833-F843 HydrophobicContact CB-CD1 4.41Å; H836-F843 HydrophobicContact CB-CB 4.17Å; H836-F843 AromaticContact CD2-CD2 3.71Å; F843-V845 HydrophobicContact CD1-CG2 3.93Å; F843-V845 HydrophobicContact CE1-CG2 3.37Å; F843-V845 HydrophobicContact CE2-CG2 4.27Å; F843-V845 HydrophobicContact CZ-CG2 3.57Å
844	L	90.6	Very high	90.5	Very high	97 Å²	97	51.7 Å²	51.7	51%	0.508	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-92.5	120.2	-173.6	-59.7	177.2	0	0	0	110.5	A145 G210 V211 Q842	A145-L844 VanDerWaalsContact CB-O 3.31Å; A145-L844 WeakPolarHBondContact CB-O 3.01Å; G210-L844 WeakPolarHBondContact O-CA 3.45Å; V211-L844 HydrophobicContact CG2-CD2 3.83Å; Q842-L844 HydrophobicContact CB-CD2 4.36Å; Q842-L844 PolarHBondContact O-N 3.45Å
845	V	89.5	Confident	90.4	Very high	6 Å²	6	49.4 Å²	49.4	4%	0.036	28%	0.278	C	S	.	.			trans	-127.3	104.4	175.4	-175.2	0	0	0	0	107.9	A145 I204 G210 V212 W829 F843	A145-V845 HydrophobicContact CB-CB 4.4Å; A145-V845 HydrophobicContact CB-CG1 4.49Å; A145-V845 HydrophobicContact CB-CG2 3.83Å; I204-V845 HydrophobicContact CG2-CG1 4.11Å; G210-V845 CarbonylContact C-O 3.58Å; G210-V845 VanDerWaalsContact CA-O 3.24Å; G210-V845 WeakPolarHBondContact CA-O 3.38Å; G210-V845 PolarHBondContact O-N 3.46Å; V212-V845 HydrophobicContact CB-CG2 4.32Å; V212-V845 HydrophobicContact CG2-CB 3.96Å; V212-V845 HydrophobicContact CG2-CG2 3.66Å; W829-V845 HydrophobicContact CH2-CG1 4.11Å; W829-V845 HydrophobicContact CZ2-CG1 3.9Å; F843-V845 HydrophobicContact CD1-CG2 3.93Å; F843-V845 HydrophobicContact CE1-CG2 3.37Å; F843-V845 HydrophobicContact CE2-CG2 4.27Å; F843-V845 HydrophobicContact CZ-CG2 3.57Å
846	Q	82.9	Confident	90.3	Very high	111 Å²	111	47 Å²	47	52%	0.519	27%	0.27	S	S	.	.			trans	-71.2	129.3	-177.5	-64.8	-64.3	-16.5	0	0	110.6
847	P	81.3	Confident	90.3	Very high	22 Å²	22	45.9 Å²	45.9	14%	0.143	27%	0.265	C	S	.	.			trans	-63.8	-56.4	179.3	22.4	-30.9	0	0	0	111.3	I204 A205 S849 L850 G851	I204-P847 HydrophobicContact CB-CB 4.39Å; I204-P847 HydrophobicContact CG1-CB 4.2Å; A205-P847 HydrophobicContact CB-CB 4.31Å; P847-S849 PolarHBondContact O-N 3.28Å; P847-L850 CarbonylContact O-C 3.59Å; P847-L850 WeakPolarHBondContact O-CB 3.45Å; P847-L850 PolarHBondContact O-N 3.19Å; P847-G851 PolarHBondContact O-N 3.01Å
848	G	81.2	Confident	90.3	Very high	25 Å²	25	44.2 Å²	44.2	26%	0.258	25%	0.25	S	C	.	.	H	α-helix	trans	28	-122.7	175	0	0	0	0	0	115.4	L850 G851 F852	G848-L850 VanDerWaalsContact C-N 3.35Å; G848-L850 PolarHBondContact O-N 3.09Å; G848-G851 PolarHBondContact O-N 2.92Å; G848-F852 PolarHBondContact O-N 3.49Å
849	S	83.7	Confident	90.3	Very high	13 Å²	13	42 Å²	42	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-71.3	-26.2	-177.8	62.3	0	0	0	0	114.4	P847 S853 E908 N909	P847-S849 PolarHBondContact O-N 3.28Å; S849-S853 WeakPolarHBondContact O-CB 3.21Å; S849-S853 PolarHBondContact O-N 3.34Å; S849-E908 VanDerWaalsContact CA-OE2 3.24Å; S849-E908 WeakPolarHBondContact CA-OE2 3.4Å; S849-E908 WeakPolarHBondContact CB-OE2 3.36Å; S849-N909 WeakPolarHBondContact CB-OD1 3.46Å; S849-N909 PolarHBondContact OG-OD1 3.47Å
850	L	87.7	Confident	90.4	Very high	16 Å²	16	37.4 Å²	37.4	8%	0.084	22%	0.218	C	C	.	.	H	α-helix	trans	-65.8	-49.3	175.4	179.8	62.2	0	0	0	110.4	P150 V154 I204 W829 P847 G848 F852 S853 V854	P150-L850 HydrophobicContact CB-CD1 3.78Å; P150-L850 HydrophobicContact CB-CD2 3.81Å; P150-L850 HydrophobicContact CB-CG 4.47Å; V154-L850 HydrophobicContact CG2-CD1 4.03Å; I204-L850 HydrophobicContact CD1-CD2 4.29Å; I204-L850 HydrophobicContact CD1-CG 4.21Å; W829-L850 HydrophobicContact CZ2-CD2 4.5Å; P847-L850 CarbonylContact O-C 3.59Å; P847-L850 WeakPolarHBondContact O-CB 3.45Å; P847-L850 PolarHBondContact O-N 3.19Å; G848-L850 VanDerWaalsContact C-N 3.35Å; G848-L850 PolarHBondContact O-N 3.09Å; L850-F852 VanDerWaalsContact C-N 3.3Å; L850-F852 PolarHBondContact O-N 3.2Å; L850-S853 PolarHBondContact O-N 2.79Å; L850-V854 HydrophobicContact CD1-CG2 4.11Å; L850-V854 HydrophobicContact CG-CG2 4.42Å; L850-V854 WeakPolarHBondContact O-CB 3.32Å; L850-V854 WeakPolarHBondContact O-CG2 3.14Å; L850-V854 PolarHBondContact O-N 3.16Å
851	G	89.3	Confident	90.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59	-41.7	176.6	0	0	0	0	0	112.1	P847 G848 T855 F916	P847-G851 PolarHBondContact O-N 3.01Å; G848-G851 PolarHBondContact O-N 2.92Å; G851-T855 WeakPolarHBondContact O-CB 3.4Å; G851-T855 PolarHBondContact O-N 3.29Å; G851-T855 PolarHBondContact O-OG1 3.21Å; G851-F916 WeakPolarHBondContact O-CE2 3.4Å
852	F	90.8	Very high	90.6	Very high	32 Å²	32	35.3 Å²	35.3	14%	0.14	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-48.2	176.8	-177.8	-94.4	0	0	0	112.2	G848 L850 V854 T855 T856 L904 E908 F916	G848-F852 PolarHBondContact O-N 3.49Å; L850-F852 VanDerWaalsContact C-N 3.3Å; L850-F852 PolarHBondContact O-N 3.2Å; F852-V854 PolarHBondContact O-N 3.22Å; F852-T855 PolarHBondContact O-N 3.4Å; F852-T856 WeakPolarHBondContact O-CB 2.91Å; F852-T856 PolarHBondContact O-N 2.81Å; F852-T856 PolarHBondContact O-OG1 2.86Å; F852-L904 HydrophobicContact CE1-CB 4.13Å; F852-L904 WeakPolarHBondContact CE1-O 3.36Å; F852-L904 HydrophobicContact CZ-CB 4.36Å; F852-E908 HydrophobicContact CB-CG 4Å; F852-E908 HydrophobicContact CD1-CB 3.54Å; F852-E908 HydrophobicContact CD1-CG 3.66Å; F852-E908 HydrophobicContact CD2-CB 4.45Å; F852-E908 HydrophobicContact CD2-CG 3.93Å; F852-E908 HydrophobicContact CE1-CB 3.58Å; F852-E908 HydrophobicContact CE1-CG 4.1Å; F852-E908 HydrophobicContact CE2-CB 4.46Å; F852-E908 HydrophobicContact CE2-CG 4.32Å; F852-E908 HydrophobicContact CG-CB 4.01Å; F852-E908 HydrophobicContact CG-CG 3.57Å; F852-E908 HydrophobicContact CZ-CB 4.06Å; F852-E908 HydrophobicContact CZ-CG 4.4Å; F852-F916 HydrophobicContact CB-CD2 4.1Å; F852-F916 HydrophobicContact CB-CE2 4.32Å
853	S	91.5	Very high	90.7	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.014	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-46.7	177.4	171.4	0	0	0	0	111.5	V154 S849 L850 T855 T856 Y857 Y901	V154-S853 WeakPolarHBondContact CG1-OG 3.4Å; S849-S853 WeakPolarHBondContact O-CB 3.21Å; S849-S853 PolarHBondContact O-N 3.34Å; L850-S853 PolarHBondContact O-N 2.79Å; S853-T855 PolarHBondContact O-N 3.08Å; S853-T856 PolarHBondContact O-N 3.42Å; S853-Y857 WeakPolarHBondContact O-CB 3.47Å; S853-Y857 PolarHBondContact O-N 2.78Å; S853-Y901 PolarHBondContact OG-OH 2.82Å
854	V	93.7	Very high	90.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.6	-43.5	179.4	172.3	0	0	0	0	112	V154 Y197 M200 L850 F852 Y857 C858	V154-V854 HydrophobicContact CG1-CG2 4.17Å; V154-V854 HydrophobicContact CG2-CG2 3.62Å; Y197-V854 WeakPolarHBondContact O-CG1 3.27Å; M200-V854 HydrophobicContact CE-CB 4.26Å; M200-V854 HydrophobicContact CE-CG1 3.96Å; M200-V854 HydrophobicContact CE-CG2 3.22Å; M200-V854 HydrophobicContact SD-CG2 4.46Å; L850-V854 HydrophobicContact CD1-CG2 4.11Å; L850-V854 HydrophobicContact CG-CG2 4.42Å; L850-V854 WeakPolarHBondContact O-CB 3.32Å; L850-V854 WeakPolarHBondContact O-CG2 3.14Å; L850-V854 PolarHBondContact O-N 3.16Å; F852-V854 PolarHBondContact O-N 3.22Å; V854-Y857 PolarHBondContact O-N 2.75Å; V854-C858 PolarHBondContact O-N 3Å; V854-C858 PolarHBondContact O-SG 2.81Å
855	T	92.4	Very high	90.8	Very high	22 Å²	22	27.6 Å²	27.6	14%	0.135	15%	0.152	C	C	.	.	H	α-helix	trans	-64	-46.8	178.3	-57.4	0	0	0	0	110.8	Y201 G851 F852 S853 Y857 C858 I859	Y201-T855 WeakPolarHBondContact CD2-OG1 3.21Å; G851-T855 WeakPolarHBondContact O-CB 3.4Å; G851-T855 PolarHBondContact O-N 3.29Å; G851-T855 PolarHBondContact O-OG1 3.21Å; F852-T855 PolarHBondContact O-N 3.4Å; S853-T855 PolarHBondContact O-N 3.08Å; T855-Y857 VanDerWaalsContact C-N 3.34Å; T855-Y857 PolarHBondContact O-N 2.88Å; T855-C858 PolarHBondContact O-N 2.62Å; T855-I859 HydrophobicContact CG2-CD1 4.26Å; T855-I859 WeakPolarHBondContact O-CG1 3.33Å; T855-I859 PolarHBondContact O-N 2.91Å; T855-I859 VanDerWaalsContact O-N 3.12Å
856	T	93.5	Very high	90.9	Very high	13 Å²	13	34 Å²	34	8%	0.08	18%	0.18	C	C	.	.	H	α-helix	trans	-60.7	-44.9	177.4	-55.7	0	0	0	0	111	F852 S853 C858 I859 F860 Y901 L904	F852-T856 WeakPolarHBondContact O-CB 2.91Å; F852-T856 PolarHBondContact O-N 2.81Å; F852-T856 PolarHBondContact O-OG1 2.86Å; S853-T856 PolarHBondContact O-N 3.42Å; T856-C858 PolarHBondContact O-N 2.91Å; T856-I859 PolarHBondContact O-N 3.03Å; T856-F860 HydrophobicContact CG2-CD2 4.33Å; T856-F860 HydrophobicContact CG2-CE2 3.97Å; T856-F860 HydrophobicContact CG2-CZ 4.2Å; T856-F860 PolarHBondContact O-N 2.92Å; T856-F860 VanDerWaalsContact O-N 3.12Å; T856-Y901 HydrophobicContact CG2-CD2 4.02Å; T856-L904 HydrophobicContact CG2-CB 4.46Å; T856-L904 HydrophobicContact CG2-CD1 4Å
857	Y	95.2	Very high	91.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.5	-49.3	174.3	168.5	-103	0	0	0	111.7	A157 A158 L161 F162 Y197 N817 S853 V854 T855 I859 F860 A861	A157-Y857 HydrophobicContact CB-CE1 4.36Å; A157-Y857 HydrophobicContact CB-CE2 4.04Å; A157-Y857 WeakPolarHBondContact O-CE2 3.35Å; A158-Y857 HydrophobicContact CB-CD2 3.84Å; A158-Y857 HydrophobicContact CB-CE2 4.24Å; L161-Y857 HydrophobicContact CD2-CE2 4.34Å; F162-Y857 HydrophobicContact CE2-CD2 4.22Å; F162-Y857 HydrophobicContact CZ-CD2 4.07Å; F162-Y857 HydrophobicContact CZ-CE2 4.24Å; Y197-Y857 AromaticContact CD1-CD1 3.9Å; Y197-Y857 HydrophobicContact CD1-CD1 3.9Å; Y197-Y857 AromaticContact CD1-CE1 3.91Å; Y197-Y857 HydrophobicContact CD1-CE1 3.91Å; Y197-Y857 HydrophobicContact CD2-CD1 4.18Å; Y197-Y857 AromaticContact CD2-CE1 3.45Å; Y197-Y857 HydrophobicContact CD2-CE1 3.45Å; Y197-Y857 VanDerWaalsContact CD2-CE1 3.45Å; Y197-Y857 HydrophobicContact CE1-CE1 4.28Å; Y197-Y857 AromaticContact CE2-CE1 3.89Å; Y197-Y857 HydrophobicContact CE2-CE1 3.89Å; Y197-Y857 AromaticContact CG-CD1 3.76Å; Y197-Y857 HydrophobicContact CG-CD1 3.76Å; Y197-Y857 AromaticContact CG-CE1 3.52Å; Y197-Y857 HydrophobicContact CG-CE1 3.52Å; N817-Y857 PolarHBondContact ND2-OH 2.9Å; S853-Y857 WeakPolarHBondContact O-CB 3.47Å; S853-Y857 PolarHBondContact O-N 2.78Å; V854-Y857 PolarHBondContact O-N 2.75Å; T855-Y857 VanDerWaalsContact C-N 3.34Å; T855-Y857 PolarHBondContact O-N 2.88Å; Y857-I859 VanDerWaalsContact C-N 3.31Å; Y857-I859 PolarHBondContact O-N 2.68Å; Y857-F860 PolarHBondContact O-N 2.95Å; Y857-A861 HydrophobicContact CE1-CB 4.2Å; Y857-A861 HydrophobicContact CE2-CB 4.16Å; Y857-A861 WeakPolarHBondContact O-CB 3.31Å; Y857-A861 PolarHBondContact O-N 3.24Å
858	C	94.4	Very high	91.7	Very high	20 Å²	20	29.1 Å²	29.1	14%	0.135	16%	0.156	C	C	.	.	H	α-helix	trans	-59.2	-41.6	-178.4	-71.1	0	0	0	0	112.4	Y197 V854 T855 T856 A861 L862	Y197-C858 VanDerWaalsContact CB-SG 3.59Å; V854-C858 PolarHBondContact O-N 3Å; V854-C858 PolarHBondContact O-SG 2.81Å; T855-C858 PolarHBondContact O-N 2.62Å; T856-C858 PolarHBondContact O-N 2.91Å; C858-A861 PolarHBondContact O-N 2.81Å; C858-L862 WeakPolarHBondContact O-CG 3.49Å; C858-L862 PolarHBondContact O-N 3.26Å; C858-L862 VanDerWaalsContact O-N 3.08Å
859	I	94.6	Very high	92.1	Very high	91 Å²	91	30.4 Å²	30.4	47%	0.467	16%	0.157	S	C	.	.	H	α-helix	trans	-62	-50.2	177.2	-65.2	167.1	0	0	0	110.2	T855 T856 Y857 A861 L862 V863	T855-I859 HydrophobicContact CG2-CD1 4.26Å; T855-I859 WeakPolarHBondContact O-CG1 3.33Å; T855-I859 PolarHBondContact O-N 2.91Å; T855-I859 VanDerWaalsContact O-N 3.12Å; T856-I859 PolarHBondContact O-N 3.03Å; Y857-I859 VanDerWaalsContact C-N 3.31Å; Y857-I859 PolarHBondContact O-N 2.68Å; I859-A861 VanDerWaalsContact C-N 3.35Å; I859-A861 PolarHBondContact O-N 3.43Å; I859-L862 PolarHBondContact O-N 3.25Å; I859-V863 WeakPolarHBondContact O-CG2 3.24Å; I859-V863 PolarHBondContact O-N 2.97Å
860	F	96.2	Very high	92.4	Very high	31 Å²	31	35.3 Å²	35.3	14%	0.136	17%	0.174	C	C	.	.	H	α-helix	trans	-70.9	-31.1	-179.2	-68.4	-4.7	0	0	0	112.8	F162 T856 Y857 V863 A864 L897 V900 L904	F162-F860 HydrophobicContact CE1-CB 4.12Å; F162-F860 HydrophobicContact CE2-CB 4.2Å; F162-F860 HydrophobicContact CZ-CB 3.52Å; T856-F860 HydrophobicContact CG2-CD2 4.33Å; T856-F860 HydrophobicContact CG2-CE2 3.97Å; T856-F860 HydrophobicContact CG2-CZ 4.2Å; T856-F860 PolarHBondContact O-N 2.92Å; T856-F860 VanDerWaalsContact O-N 3.12Å; Y857-F860 PolarHBondContact O-N 2.95Å; F860-V863 PolarHBondContact O-N 2.82Å; F860-A864 WeakPolarHBondContact O-CB 3.17Å; F860-A864 PolarHBondContact O-N 2.93Å; F860-L897 HydrophobicContact CD1-CD2 4.2Å; F860-L897 HydrophobicContact CD2-CB 4.45Å; F860-L897 HydrophobicContact CD2-CD2 4.32Å; F860-L897 HydrophobicContact CG-CD2 4.13Å; F860-V900 HydrophobicContact CE2-CB 4.17Å; F860-V900 HydrophobicContact CE2-CG1 3.84Å; F860-V900 HydrophobicContact CZ-CB 4.47Å; F860-V900 HydrophobicContact CZ-CG1 3.72Å; F860-L904 HydrophobicContact CE2-CD1 4.44Å; F860-L904 HydrophobicContact CZ-CD1 4.01Å
861	A	94.3	Very high	92.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.9	-41.5	175.1	0	0	0	0	0	111.5	L161 L194 Y857 C858 I859 V863 A864 I865	L161-A861 HydrophobicContact CD2-CB 3.44Å; L161-A861 VanDerWaalsContact CD2-CB 3.44Å; L194-A861 HydrophobicContact CD2-CB 3.51Å; Y857-A861 HydrophobicContact CE1-CB 4.2Å; Y857-A861 HydrophobicContact CE2-CB 4.16Å; Y857-A861 WeakPolarHBondContact O-CB 3.31Å; Y857-A861 PolarHBondContact O-N 3.24Å; C858-A861 PolarHBondContact O-N 2.81Å; I859-A861 VanDerWaalsContact C-N 3.35Å; I859-A861 PolarHBondContact O-N 3.43Å; A861-V863 VanDerWaalsContact C-N 3.35Å; A861-V863 PolarHBondContact O-N 3.45Å; A861-A864 PolarHBondContact O-N 2.91Å; A861-I865 WeakPolarHBondContact O-CB 3.16Å; A861-I865 WeakPolarHBondContact O-CD1 3.33Å; A861-I865 VanDerWaalsContact O-CG1 3.29Å; A861-I865 WeakPolarHBondContact O-CG1 3.47Å; A861-I865 PolarHBondContact O-N 3.05Å
862	L	93.9	Very high	92.5	Very high	101 Å²	101	39.4 Å²	39.4	53%	0.529	19%	0.189	S	C	.	.	H	α-helix	trans	-60.9	-43.3	172.8	-75.8	170	0	0	0	112	L194 C858 I859 F866	L194-L862 HydrophobicContact CD1-CD2 3.55Å; L194-L862 HydrophobicContact CD1-CG 4.29Å; L194-L862 HydrophobicContact CD2-CG 4.49Å; C858-L862 WeakPolarHBondContact O-CG 3.49Å; C858-L862 PolarHBondContact O-N 3.26Å; C858-L862 VanDerWaalsContact O-N 3.08Å; I859-L862 PolarHBondContact O-N 3.25Å; L862-F866 VanDerWaalsContact O-CB 3.3Å; L862-F866 WeakPolarHBondContact O-CB 3.22Å; L862-F866 PolarHBondContact O-N 2.65Å
863	V	94.8	Very high	92.3	Very high	58 Å²	58	43.8 Å²	43.8	35%	0.352	21%	0.208	S	C	.	.	H	α-helix	trans	-63.2	-43.6	176.2	175.9	0	0	0	0	111	I859 F860 A861 F866 L867 F893 L897	I859-V863 WeakPolarHBondContact O-CG2 3.24Å; I859-V863 PolarHBondContact O-N 2.97Å; F860-V863 PolarHBondContact O-N 2.82Å; A861-V863 VanDerWaalsContact C-N 3.35Å; A861-V863 PolarHBondContact O-N 3.45Å; V863-F866 PolarHBondContact O-N 2.77Å; V863-L867 WeakPolarHBondContact O-CB 3.48Å; V863-L867 PolarHBondContact O-N 2.88Å; V863-F893 HydrophobicContact CG1-CE1 3.8Å; V863-F893 HydrophobicContact CG1-CZ 3.82Å; V863-L897 HydrophobicContact CG1-CD1 4.17Å
864	A	93.8	Very high	91.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-65.4	-45.4	178.5	0	0	0	0	0	112.2	L161 F162 F860 A861 F866 L867 I868 L894	L161-A864 HydrophobicContact CD2-CB 4.37Å; L161-A864 HydrophobicContact CG-CB 4.29Å; F162-A864 HydrophobicContact CD1-CB 3.86Å; F162-A864 HydrophobicContact CE1-CB 3.73Å; F860-A864 WeakPolarHBondContact O-CB 3.17Å; F860-A864 PolarHBondContact O-N 2.93Å; A861-A864 PolarHBondContact O-N 2.91Å; A864-F866 VanDerWaalsContact C-N 3.33Å; A864-F866 PolarHBondContact O-N 2.84Å; A864-L867 WeakPolarHBondContact O-CB 2.98Å; A864-L867 PolarHBondContact O-N 2.83Å; A864-I868 VanDerWaalsContact O-CG1 3.29Å; A864-I868 WeakPolarHBondContact O-CG1 3.36Å; A864-I868 PolarHBondContact O-N 3.47Å; A864-L894 HydrophobicContact CB-CD2 3.73Å
865	I	91.3	Very high	90.9	Very high	16 Å²	16	58.3 Å²	58.3	8%	0.082	28%	0.283	C	S	.	.	H	α-helix	trans	-62.9	-42.3	176.2	-70.3	160.5	0	0	0	110.4	S190 L194 A861 L867 I868 L869	S190-I865 WeakPolarHBondContact OG-CD1 3.38Å; L194-I865 HydrophobicContact CD1-CD1 3.54Å; L194-I865 HydrophobicContact CD2-CD1 3.97Å; L194-I865 HydrophobicContact CG-CD1 3.73Å; A861-I865 WeakPolarHBondContact O-CB 3.16Å; A861-I865 WeakPolarHBondContact O-CD1 3.33Å; A861-I865 VanDerWaalsContact O-CG1 3.29Å; A861-I865 WeakPolarHBondContact O-CG1 3.47Å; A861-I865 PolarHBondContact O-N 3.05Å; I865-L867 VanDerWaalsContact C-N 3.33Å; I865-L867 PolarHBondContact O-N 3.05Å; I865-I868 PolarHBondContact O-N 3.18Å; I865-L869 HydrophobicContact CG2-CD1 4.05Å; I865-L869 HydrophobicContact CG2-CG 4.47Å; I865-L869 WeakPolarHBondContact O-CB 2.87Å; I865-L869 VanDerWaalsContact O-CG 3.31Å; I865-L869 WeakPolarHBondContact O-CG 3.42Å; I865-L869 PolarHBondContact O-N 3.04Å
866	F	91.6	Very high	90.4	Very high	140 Å²	140	58.4 Å²	58.4	61%	0.614	28%	0.282	S	S	*	.	H	α-helix	trans	-60.3	-42.3	173.9	179.7	-96.5	0	0	0	111.8	L862 V863 A864 L869 Y870	L862-F866 VanDerWaalsContact O-CB 3.3Å; L862-F866 WeakPolarHBondContact O-CB 3.22Å; L862-F866 PolarHBondContact O-N 2.65Å; V863-F866 PolarHBondContact O-N 2.77Å; A864-F866 VanDerWaalsContact C-N 3.33Å; A864-F866 PolarHBondContact O-N 2.84Å; F866-L869 PolarHBondContact O-N 3.14Å; F866-Y870 WeakPolarHBondContact O-CB 3.49Å; F866-Y870 PolarHBondContact O-N 2.74Å
867	L	92.7	Very high	89.8	Confident	28 Å²	28	58.3 Å²	58.3	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-46.5	176	179.5	68.1	0	0	0	111.9	V863 A864 I865 L869 Y870 R871 F893 L894	V863-L867 WeakPolarHBondContact O-CB 3.48Å; V863-L867 PolarHBondContact O-N 2.88Å; A864-L867 WeakPolarHBondContact O-CB 2.98Å; A864-L867 PolarHBondContact O-N 2.83Å; I865-L867 VanDerWaalsContact C-N 3.33Å; I865-L867 PolarHBondContact O-N 3.05Å; L867-L869 VanDerWaalsContact C-N 3.32Å; L867-L869 PolarHBondContact O-N 3.48Å; L867-Y870 PolarHBondContact O-N 2.87Å; L867-R871 VanDerWaalsContact O-CG 3.3Å; L867-R871 WeakPolarHBondContact O-CG 3.28Å; L867-R871 PolarHBondContact O-N 3.5Å; L867-F893 HydrophobicContact CD2-CD1 3.68Å; L867-F893 HydrophobicContact CD2-CE1 4.24Å; L867-L894 HydrophobicContact CD2-CD2 4.07Å; L867-L894 HydrophobicContact CD2-CG 4.06Å
868	I	90.2	Very high	89.3	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.015	29%	0.285	C	S	.	.	H	α-helix	trans	-58.1	-47.2	177.5	-66.3	163.4	0	0	0	109.8	L161 I165 I810 A864 I865 R871 E879	L161-I868 HydrophobicContact CD1-CD1 4.49Å; I165-I868 HydrophobicContact CG2-CD1 3.97Å; I165-I868 HydrophobicContact CG2-CG1 4.2Å; I810-I868 HydrophobicContact CD1-CG2 4.18Å; A864-I868 VanDerWaalsContact O-CG1 3.29Å; A864-I868 WeakPolarHBondContact O-CG1 3.36Å; A864-I868 PolarHBondContact O-N 3.47Å; I865-I868 PolarHBondContact O-N 3.18Å; I868-R871 PolarHBondContact O-N 3.05Å; I868-E879 HydrophobicContact CG2-CB 4.1Å; I868-E879 HydrophobicContact CG2-CG 3.89Å
869	L	88.6	Confident	89	Confident	53 Å²	53	57.4 Å²	57.4	28%	0.277	28%	0.278	S	S	.	.	H	α-helix	trans	-66.9	-37	177.6	-68.1	175.8	0	0	0	112.7	F186 F187 I865 F866 L867 R871 R872	F186-L869 HydrophobicContact CE1-CD2 4.11Å; F187-L869 HydrophobicContact CE1-CD1 3.98Å; F187-L869 HydrophobicContact CE1-CD2 4.08Å; F187-L869 HydrophobicContact CZ-CD2 4.06Å; I865-L869 HydrophobicContact CG2-CD1 4.05Å; I865-L869 HydrophobicContact CG2-CG 4.47Å; I865-L869 WeakPolarHBondContact O-CB 2.87Å; I865-L869 VanDerWaalsContact O-CG 3.31Å; I865-L869 WeakPolarHBondContact O-CG 3.42Å; I865-L869 PolarHBondContact O-N 3.04Å; F866-L869 PolarHBondContact O-N 3.14Å; L867-L869 VanDerWaalsContact C-N 3.32Å; L867-L869 PolarHBondContact O-N 3.48Å; L869-R871 VanDerWaalsContact C-N 3.33Å; L869-R871 PolarHBondContact O-N 2.84Å; L869-R872 WeakPolarHBondContact O-CB 3.26Å; L869-R872 PolarHBondContact O-N 2.77Å
870	Y	90.2	Very high	88.8	Confident	116 Å²	116	53.1 Å²	53.1	46%	0.455	26%	0.256	S	S	.	.	H	α-helix	trans	-64.4	-38.4	177.3	178.3	-100.3	0	0	0	111.7	F866 L867 R872 K873 I876	F866-Y870 WeakPolarHBondContact O-CB 3.49Å; F866-Y870 PolarHBondContact O-N 2.74Å; L867-Y870 PolarHBondContact O-N 2.87Å; Y870-R872 PolarHBondContact O-N 3.38Å; Y870-R872 VanDerWaalsContact O-N 3.16Å; Y870-K873 HydrophobicContact CE2-CD 4.43Å; Y870-K873 VanDerWaalsContact O-CB 3.24Å; Y870-K873 WeakPolarHBondContact O-CB 3.48Å; Y870-K873 PolarHBondContact O-N 2.91Å; Y870-I876 HydrophobicContact CE1-CD1 4.47Å
871	R	92.2	Very high	88.6	Confident	1 Å²	1	51.6 Å²	51.6	0%	0.004	25%	0.25	C	C	.	.	H	α-helix	trans	-61.9	-19.9	176.6	-73.2	175.6	60.1	81.7	9.2	113.7	L867 I868 L869 K873 I876 G878 E879 G881 A886 S890	L867-R871 VanDerWaalsContact O-CG 3.3Å; L867-R871 WeakPolarHBondContact O-CG 3.28Å; L867-R871 PolarHBondContact O-N 3.5Å; I868-R871 PolarHBondContact O-N 3.05Å; L869-R871 VanDerWaalsContact C-N 3.33Å; L869-R871 PolarHBondContact O-N 2.84Å; R871-K873 PolarHBondContact O-N 2.83Å; R871-I876 HydrophobicContact CB-CD1 4.44Å; R871-I876 HydrophobicContact CB-CG2 4.13Å; R871-I876 HydrophobicContact CG-CD1 4.05Å; R871-I876 HydrophobicContact CG-CG2 4.36Å; R871-I876 WeakPolarHBondContact O-CB 3.41Å; R871-G878 PolarHBondContact O-N 3.02Å; R871-E879 PolarHBondContact NE-O 3.09Å; R871-G881 PolarHBondContact NH2-O 2.92Å; R871-A886 PolarHBondContact NH1-O 2.74Å; R871-S890 PolarHBondContact NH1-OG 2.81Å
872	R	87.1	Confident	88.4	Confident	100 Å²	100	52.1 Å²	52.1	38%	0.377	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-17.5	172.9	-160.3	178	-179.6	-149.2	-14	113.9	L869 Y870 E879	L869-R872 WeakPolarHBondContact O-CB 3.26Å; L869-R872 PolarHBondContact O-N 2.77Å; Y870-R872 PolarHBondContact O-N 3.38Å; Y870-R872 VanDerWaalsContact O-N 3.16Å; R872-E879 WeakPolarHBondContact CD-OE1 3.48Å; R872-E879 WeakPolarHBondContact CG-OE1 3.32Å; R872-E879 IonicContact NE-OE1 2.79Å
873	K	85.9	Confident	88.2	Confident	125 Å²	125	50.3 Å²	50.3	54%	0.543	25%	0.249	S	C	.	.	S	Bend	trans	-56.7	147.1	178.1	-172	176.1	179.5	-179.4	0	111	Y870 R871 S875 I876 G877	Y870-K873 HydrophobicContact CE2-CD 4.43Å; Y870-K873 VanDerWaalsContact O-CB 3.24Å; Y870-K873 WeakPolarHBondContact O-CB 3.48Å; Y870-K873 PolarHBondContact O-N 2.91Å; R871-K873 PolarHBondContact O-N 2.83Å; K873-S875 PolarHBondContact O-N 3.07Å; K873-I876 PolarHBondContact O-N 3.13Å; K873-G877 PolarHBondContact O-N 3.37Å
874	K	77.8	Confident	87.9	Confident	206 Å²	206	53.3 Å²	53.3	90%	0.896	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-27.3	-178.9	-72.8	-171.5	177.8	-175.7	0	115.1
875	S	78.1	Confident	87.7	Confident	100 Å²	100	58.4 Å²	58.4	70%	0.699	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-35.9	179	-173.4	0	0	0	0	113.6	K873	K873-S875 PolarHBondContact O-N 3.07Å
876	I	82.4	Confident	87.6	Confident	24 Å²	24	58.8 Å²	58.8	12%	0.123	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-32.7	-178.1	-64.1	169.6	0	0	0	110.2	Y870 R871 K873 G878 P883 A886	Y870-I876 HydrophobicContact CE1-CD1 4.47Å; R871-I876 HydrophobicContact CB-CD1 4.44Å; R871-I876 HydrophobicContact CB-CG2 4.13Å; R871-I876 HydrophobicContact CG-CD1 4.05Å; R871-I876 HydrophobicContact CG-CG2 4.36Å; R871-I876 WeakPolarHBondContact O-CB 3.41Å; K873-I876 PolarHBondContact O-N 3.13Å; I876-G878 PolarHBondContact O-N 3.35Å; I876-P883 WeakPolarHBondContact O-CD 3.39Å; I876-A886 HydrophobicContact CD1-CB 4.38Å; I876-A886 HydrophobicContact CG1-CB 4.13Å
877	G	80.5	Confident	87.6	Confident	12 Å²	12	52.5 Å²	52.5	12%	0.124	27%	0.266	C	S	.	.			trans	90.7	-17.7	167.3	0	0	0	0	0	114.8	R179 K873	R179-G877 PolarHBondContact NE-O 2.81Å; R179-G877 PolarHBondContact NH2-O 2.85Å; K873-G877 PolarHBondContact O-N 3.37Å
878	G	84.9	Confident	87.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.284	C	S	.	.	S	Bend	trans	-172.6	164.1	177.9	0	0	0	0	0	113.5	R871 I876	R871-G878 PolarHBondContact O-N 3.02Å; I876-G878 PolarHBondContact O-N 3.35Å
879	E	88.2	Confident	87.9	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.005	31%	0.31	C	S	.	.	S	Bend	trans	-62.7	-45.2	-179.8	-68.8	82.5	167.6	0	0	110.7	R178 R179 I180 I810 I868 R871 R872	R178-E879 PolarHBondContact O-N 2.99Å; R179-E879 VanDerWaalsContact CA-OE2 3.28Å; R179-E879 WeakPolarHBondContact CA-OE2 3.49Å; I180-E879 HydrophobicContact CD1-CG 4.27Å; I180-E879 HydrophobicContact CG1-CG 4.3Å; I810-E879 HydrophobicContact CD1-CB 3.87Å; I868-E879 HydrophobicContact CG2-CB 4.1Å; I868-E879 HydrophobicContact CG2-CG 3.89Å; R871-E879 PolarHBondContact NE-O 3.09Å; R872-E879 WeakPolarHBondContact CD-OE1 3.48Å; R872-E879 WeakPolarHBondContact CG-OE1 3.32Å; R872-E879 IonicContact NE-OE1 2.79Å
880	L	91.1	Very high	88.1	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	151	175.5	-48.5	176.5	0	0	0	111.9	C168 I169 V172 V177 R178 A800 A806 S809 I810	C168-L880 HydrophobicContact CB-CD1 4.11Å; C168-L880 HydrophobicContact CB-CD2 3.91Å; I169-L880 HydrophobicContact CG1-CD2 3.71Å; V172-L880 HydrophobicContact CG2-CB 3.85Å; V177-L880 WeakPolarHBondContact CA-O 3.46Å; R178-L880 HydrophobicContact CB-CB 4.06Å; R178-L880 HydrophobicContact CB-CD1 4.33Å; R178-L880 HydrophobicContact CG-CB 4.38Å; R178-L880 PolarHBondContact N-O 2.91Å; R178-L880 VanDerWaalsContact N-O 3.09Å; R178-L880 PolarHBondContact O-N 3.23Å; A800-L880 HydrophobicContact CB-CD1 4.13Å; A806-L880 HydrophobicContact CB-CD1 3.86Å; A806-L880 HydrophobicContact CB-CG 4.09Å; S809-L880 WeakPolarHBondContact OG-CD1 3.33Å; I810-L880 HydrophobicContact CD1-CD1 4.44Å; I810-L880 HydrophobicContact CD1-CD2 3.94Å; I810-L880 HydrophobicContact CD1-CG 4.06Å; I810-L880 HydrophobicContact CG1-CD1 4.34Å; I810-L880 HydrophobicContact CG1-CD2 4.25Å; I810-L880 HydrophobicContact CG1-CG 4.43Å
881	G	91.1	Very high	88.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.5	-138	180	0	0	0	0	0	113.9	R871	R871-G881 PolarHBondContact NH2-O 2.92Å
882	G	89.1	Confident	88.5	Confident	10 Å²	10	58.8 Å²	58.8	10%	0.103	31%	0.305	C	S	.	.			trans	84.1	-164	179.7	0	0	0	0	0	114.2	Q176 K884	Q176-G882 PolarHBondContact O-N 2.71Å; Q176-G882 VanDerWaalsContact O-N 3.09Å; G882-K884 PolarHBondContact O-N 3.49Å
883	P	90.4	Very high	89	Confident	64 Å²	64	57.9 Å²	57.9	42%	0.416	30%	0.304	S	S	.	.	S	Bend	trans	-56.8	136.8	-174.1	-24.8	33.1	0	0	0	112.6	I876 V885 A886 K887	I876-P883 WeakPolarHBondContact O-CD 3.39Å; P883-V885 VanDerWaalsContact C-N 3.29Å; P883-V885 PolarHBondContact O-N 3.44Å; P883-V885 VanDerWaalsContact O-N 3.14Å; P883-A886 HydrophobicContact CB-CB 4.32Å; P883-A886 PolarHBondContact O-N 2.8Å; P883-K887 WeakPolarHBondContact O-CB 3.28Å; P883-K887 PolarHBondContact O-N 2.88Å
884	K	88.3	Confident	89.5	Confident	121 Å²	121	51.9 Å²	51.9	53%	0.526	28%	0.278	S	S	.	.	H	α-helix	trans	-48	-48.5	-174.6	-62.8	-167.4	-177.7	-149.9	0	113	D174 G882 K887 Y888	D174-K884 WeakPolarHBondContact OD2-CE 3.27Å; D174-K884 IonicContact OD2-NZ 2.73Å; D174-K884 PolarHBondContact OD2-NZ 3.34Å; G882-K884 PolarHBondContact O-N 3.49Å; K884-K887 WeakPolarHBondContact O-CB 3.46Å; K884-K887 PolarHBondContact O-N 3.48Å; K884-Y888 WeakPolarHBondContact O-CD2 3.45Å; K884-Y888 PolarHBondContact O-N 2.99Å
885	V	90.2	Very high	90.4	Very high	107 Å²	107	46 Å²	46	65%	0.648	25%	0.253	S	S	*	.	H	α-helix	trans	-63.7	-48.6	-179.3	177.9	0	0	0	0	111.3	P883 K887 Y888 I889	P883-V885 VanDerWaalsContact C-N 3.29Å; P883-V885 PolarHBondContact O-N 3.44Å; P883-V885 VanDerWaalsContact O-N 3.14Å; V885-K887 VanDerWaalsContact C-N 3.3Å; V885-K887 PolarHBondContact O-N 3.15Å; V885-Y888 PolarHBondContact O-N 2.78Å; V885-I889 HydrophobicContact CG1-CD1 3.56Å; V885-I889 HydrophobicContact CG1-CG1 4.32Å; V885-I889 WeakPolarHBondContact O-CB 3.45Å; V885-I889 VanDerWaalsContact O-CG1 3.23Å; V885-I889 WeakPolarHBondContact O-CG1 3.3Å; V885-I889 PolarHBondContact O-N 2.92Å
886	A	89.8	Confident	91.3	Very high	23 Å²	23	46.8 Å²	46.8	19%	0.19	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-36.6	179.8	0	0	0	0	0	112.3	R871 I876 P883 S890	R871-A886 PolarHBondContact NH1-O 2.74Å; I876-A886 HydrophobicContact CD1-CB 4.38Å; I876-A886 HydrophobicContact CG1-CB 4.13Å; P883-A886 HydrophobicContact CB-CB 4.32Å; P883-A886 PolarHBondContact O-N 2.8Å; A886-S890 WeakPolarHBondContact O-CB 3.35Å; A886-S890 PolarHBondContact O-N 2.92Å; A886-S890 PolarHBondContact O-OG 2.91Å
887	K	91.3	Very high	92	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.035	24%	0.241	C	C	.	.	H	α-helix	trans	-59	-55.9	175.2	176.6	178.8	171.4	-178.1	0	111.2	I169 V170 V172 D174 P883 K884 V885 S890 A891	I169-K887 HydrophobicContact CG2-CB 4.33Å; I169-K887 HydrophobicContact CG2-CG 3.88Å; I169-K887 WeakPolarHBondContact CG2-O 3.46Å; I169-K887 WeakPolarHBondContact O-CE 3.3Å; I169-K887 VanDerWaalsContact O-CG 3.32Å; I169-K887 WeakPolarHBondContact O-CG 3.34Å; V170-K887 WeakPolarHBondContact O-CE 3.25Å; V170-K887 PolarHBondContact O-NZ 3.33Å; V172-K887 PolarHBondContact O-NZ 3.22Å; D174-K887 IonicContact OD1-NZ 3.59Å; D174-K887 PolarHBondContact OD1-NZ 3.36Å; P883-K887 WeakPolarHBondContact O-CB 3.28Å; P883-K887 PolarHBondContact O-N 2.88Å; K884-K887 WeakPolarHBondContact O-CB 3.46Å; K884-K887 PolarHBondContact O-N 3.48Å; V885-K887 VanDerWaalsContact C-N 3.3Å; V885-K887 PolarHBondContact O-N 3.15Å; K887-S890 PolarHBondContact O-N 2.99Å; K887-A891 WeakPolarHBondContact O-CB 3.34Å; K887-A891 PolarHBondContact O-N 2.85Å
888	Y	93.3	Very high	92.8	Very high	134 Å²	134	48.1 Å²	48.1	53%	0.525	24%	0.244	S	C	.	.	H	α-helix	trans	-67	-39.7	179.3	-71.7	-65.1	0	0	0	113.4	V170 K884 V885 S892	V170-Y888 HydrophobicContact CG1-CE1 3.93Å; V170-Y888 HydrophobicContact CG2-CD1 4.45Å; K884-Y888 WeakPolarHBondContact O-CD2 3.45Å; K884-Y888 PolarHBondContact O-N 2.99Å; V885-Y888 PolarHBondContact O-N 2.78Å; Y888-S892 WeakPolarHBondContact O-CB 3.22Å; Y888-S892 PolarHBondContact O-N 3.33Å
889	I	94.3	Very high	93.3	Very high	109 Å²	109	54 Å²	54	56%	0.559	27%	0.27	S	S	*	.	H	α-helix	trans	-61.2	-47.8	177.6	-70.6	172.2	0	0	0	110.9	V885 F893	V885-I889 HydrophobicContact CG1-CD1 3.56Å; V885-I889 HydrophobicContact CG1-CG1 4.32Å; V885-I889 WeakPolarHBondContact O-CB 3.45Å; V885-I889 VanDerWaalsContact O-CG1 3.23Å; V885-I889 WeakPolarHBondContact O-CG1 3.3Å; V885-I889 PolarHBondContact O-N 2.92Å; I889-F893 WeakPolarHBondContact O-CB 3.13Å; I889-F893 PolarHBondContact O-N 2.83Å
890	S	94	Very high	93.7	Very high	9 Å²	9	55.4 Å²	55.4	6%	0.063	28%	0.278	C	S	.	.	H	α-helix	trans	-68.7	-40.8	-177.5	-58.4	0	0	0	0	111.9	R871 A886 K887 F893 L894	R871-S890 PolarHBondContact NH1-OG 2.81Å; A886-S890 WeakPolarHBondContact O-CB 3.35Å; A886-S890 PolarHBondContact O-N 2.92Å; A886-S890 PolarHBondContact O-OG 2.91Å; K887-S890 PolarHBondContact O-N 2.99Å; S890-F893 PolarHBondContact O-N 2.81Å; S890-L894 WeakPolarHBondContact O-CG 3.39Å; S890-L894 PolarHBondContact O-N 3.05Å; S890-L894 VanDerWaalsContact O-N 3.08Å
891	A	95.2	Very high	93.9	Very high	3 Å²	3	55.4 Å²	55.4	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-63.7	-49.9	175.7	0	0	0	0	0	111.2	G166 I169 V170 K887 F893 L894 F895	G166-A891 WeakPolarHBondContact O-CB 3.21Å; I169-A891 HydrophobicContact CG2-CB 4.4Å; V170-A891 HydrophobicContact CG2-CB 3.31Å; K887-A891 WeakPolarHBondContact O-CB 3.34Å; K887-A891 PolarHBondContact O-N 2.85Å; A891-F893 PolarHBondContact O-N 3.07Å; A891-L894 PolarHBondContact O-N 3.15Å; A891-F895 VanDerWaalsContact O-CD2 3.27Å; A891-F895 WeakPolarHBondContact O-CD2 3.35Å; A891-F895 PolarHBondContact O-N 2.99Å
892	S	96.3	Very high	94	Very high	79 Å²	79	57 Å²	57	55%	0.552	29%	0.287	S	S	*	.	H	α-helix	trans	-56.6	-39.5	177.3	178.2	0	0	0	0	112	Y888 F895 F896	Y888-S892 WeakPolarHBondContact O-CB 3.22Å; Y888-S892 PolarHBondContact O-N 3.33Å; S892-F895 PolarHBondContact O-N 3.18Å; S892-F896 VanDerWaalsContact O-CB 3.31Å; S892-F896 WeakPolarHBondContact O-CB 3.28Å; S892-F896 PolarHBondContact O-N 2.83Å
893	F	97.2	Very high	94.2	Very high	80 Å²	80	60.4 Å²	60.4	35%	0.351	30%	0.302	S	S	.	.	H	α-helix	trans	-64.1	-40.9	174.7	-179.9	-98.6	0	0	0	113	V863 L867 I889 S890 A891 F896 L897	V863-F893 HydrophobicContact CG1-CE1 3.8Å; V863-F893 HydrophobicContact CG1-CZ 3.82Å; L867-F893 HydrophobicContact CD2-CD1 3.68Å; L867-F893 HydrophobicContact CD2-CE1 4.24Å; I889-F893 WeakPolarHBondContact O-CB 3.13Å; I889-F893 PolarHBondContact O-N 2.83Å; S890-F893 PolarHBondContact O-N 2.81Å; A891-F893 PolarHBondContact O-N 3.07Å; F893-F896 WeakPolarHBondContact O-CB 3.36Å; F893-F896 PolarHBondContact O-N 2.83Å; F893-L897 HydrophobicContact CD1-CD1 4.1Å; F893-L897 HydrophobicContact CD1-CG 4.36Å; F893-L897 HydrophobicContact CE1-CD1 3.57Å; F893-L897 HydrophobicContact CE1-CD2 4.45Å; F893-L897 HydrophobicContact CE1-CG 4Å; F893-L897 HydrophobicContact CZ-CD1 4.07Å; F893-L897 HydrophobicContact CZ-CD2 4.13Å; F893-L897 HydrophobicContact CZ-CG 4.14Å; F893-L897 WeakPolarHBondContact O-CG 3.12Å; F893-L897 PolarHBondContact O-N 3.2Å
894	L	96.6	Very high	94.3	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-43.1	175.4	-69.9	173.8	0	0	0	112.3	F162 I165 I169 A864 L867 S890 A891 F896 L897 W898	F162-L894 WeakPolarHBondContact O-CB 3.42Å; I165-L894 HydrophobicContact CB-CD1 4.28Å; I165-L894 HydrophobicContact CG2-CD1 3.98Å; I169-L894 HydrophobicContact CD1-CD1 3.81Å; A864-L894 HydrophobicContact CB-CD2 3.73Å; L867-L894 HydrophobicContact CD2-CD2 4.07Å; L867-L894 HydrophobicContact CD2-CG 4.06Å; S890-L894 WeakPolarHBondContact O-CG 3.39Å; S890-L894 PolarHBondContact O-N 3.05Å; S890-L894 VanDerWaalsContact O-N 3.08Å; A891-L894 PolarHBondContact O-N 3.15Å; L894-F896 VanDerWaalsContact C-N 3.27Å; L894-F896 PolarHBondContact O-N 2.96Å; L894-L897 HydrophobicContact CD2-CD1 4.48Å; L894-L897 PolarHBondContact O-N 2.85Å; L894-W898 PolarHBondContact O-N 3.41Å; L894-W898 VanDerWaalsContact O-N 3.09Å
895	F	96.5	Very high	94.4	Very high	83 Å²	83	54 Å²	54	36%	0.364	27%	0.27	S	S	.	.	H	α-helix	trans	-60.2	-39.6	172.9	-84.2	-82.6	0	0	0	111.9	V163 V167 A891 S892 W898 F899	V163-F895 HydrophobicContact CB-CE1 4.34Å; V163-F895 HydrophobicContact CG1-CD1 4.4Å; V163-F895 HydrophobicContact CG1-CE1 3.59Å; V163-F895 HydrophobicContact CG1-CZ 3.91Å; V163-F895 HydrophobicContact CG2-CD1 4.24Å; V163-F895 HydrophobicContact CG2-CE1 4.23Å; V167-F895 HydrophobicContact CG2-CE2 4.42Å; V167-F895 HydrophobicContact CG2-CZ 3.82Å; A891-F895 VanDerWaalsContact O-CD2 3.27Å; A891-F895 WeakPolarHBondContact O-CD2 3.35Å; A891-F895 PolarHBondContact O-N 2.99Å; S892-F895 PolarHBondContact O-N 3.18Å; F895-W898 PolarHBondContact O-N 3.21Å; F895-F899 PolarHBondContact O-N 2.92Å
896	F	97	Very high	94.4	Very high	116 Å²	116	49.5 Å²	49.5	51%	0.509	25%	0.245	S	C	.	.	H	α-helix	trans	-62.8	-45.1	175.2	174.3	-101.9	0	0	0	111.8	S892 F893 L894 W898 F899 V900	S892-F896 VanDerWaalsContact O-CB 3.31Å; S892-F896 WeakPolarHBondContact O-CB 3.28Å; S892-F896 PolarHBondContact O-N 2.83Å; F893-F896 WeakPolarHBondContact O-CB 3.36Å; F893-F896 PolarHBondContact O-N 2.83Å; L894-F896 VanDerWaalsContact C-N 3.27Å; L894-F896 PolarHBondContact O-N 2.96Å; F896-W898 VanDerWaalsContact C-N 3.29Å; F896-W898 PolarHBondContact O-N 2.75Å; F896-F899 PolarHBondContact O-N 3.33Å; F896-V900 HydrophobicContact CD1-CG2 4.19Å; F896-V900 HydrophobicContact CD2-CG2 4.12Å; F896-V900 HydrophobicContact CE1-CG2 3.75Å; F896-V900 HydrophobicContact CE2-CG2 3.67Å; F896-V900 HydrophobicContact CG-CG2 4.37Å; F896-V900 HydrophobicContact CZ-CG2 3.47Å; F896-V900 VanDerWaalsContact CZ-CG2 3.47Å; F896-V900 VanDerWaalsContact O-CG2 3.32Å; F896-V900 WeakPolarHBondContact O-CG2 3.33Å; F896-V900 PolarHBondContact O-N 2.9Å
897	L	96.9	Very high	94.3	Very high	11 Å²	11	50.8 Å²	50.8	6%	0.058	25%	0.249	C	C	.	.	H	α-helix	trans	-58.1	-41.4	175.2	-72.9	-179.7	0	0	0	112.1	F860 V863 F893 L894 V900 Y901	F860-L897 HydrophobicContact CD1-CD2 4.2Å; F860-L897 HydrophobicContact CD2-CB 4.45Å; F860-L897 HydrophobicContact CD2-CD2 4.32Å; F860-L897 HydrophobicContact CG-CD2 4.13Å; V863-L897 HydrophobicContact CG1-CD1 4.17Å; F893-L897 HydrophobicContact CD1-CD1 4.1Å; F893-L897 HydrophobicContact CD1-CG 4.36Å; F893-L897 HydrophobicContact CE1-CD1 3.57Å; F893-L897 HydrophobicContact CE1-CD2 4.45Å; F893-L897 HydrophobicContact CE1-CG 4Å; F893-L897 HydrophobicContact CZ-CD1 4.07Å; F893-L897 HydrophobicContact CZ-CD2 4.13Å; F893-L897 HydrophobicContact CZ-CG 4.14Å; F893-L897 WeakPolarHBondContact O-CG 3.12Å; F893-L897 PolarHBondContact O-N 3.2Å; L894-L897 HydrophobicContact CD2-CD1 4.48Å; L894-L897 PolarHBondContact O-N 2.85Å; L897-V900 PolarHBondContact O-N 2.97Å; L897-Y901 VanDerWaalsContact O-CB 3.27Å; L897-Y901 WeakPolarHBondContact O-CB 3.16Å; L897-Y901 PolarHBondContact O-N 3.02Å
898	W	96.4	Very high	94.1	Very high	52 Å²	52	51.2 Å²	51.2	20%	0.197	25%	0.251	C	S	.	.	H	α-helix	trans	-64.6	-44.1	176.4	178.8	77.2	0	0	0	112.6	F159 F162 V163 L894 F895 F896 Y901 I902	F159-W898 AromaticContact CD2-CE2 3.8Å; F159-W898 AromaticContact CD2-CZ2 3.86Å; F159-W898 HydrophobicContact CD2-CZ2 3.86Å; F159-W898 AromaticContact CD2-NE1 3.69Å; F159-W898 HydrophobicContact CE2-CZ2 4.25Å; F162-W898 HydrophobicContact CB-CB 3.86Å; F162-W898 HydrophobicContact CD2-CB 4Å; F162-W898 HydrophobicContact CG-CB 4.38Å; V163-W898 HydrophobicContact CG2-CB 3.91Å; V163-W898 HydrophobicContact CG2-CD2 3.6Å; V163-W898 HydrophobicContact CG2-CE3 4.08Å; V163-W898 HydrophobicContact CG2-CG 3.52Å; L894-W898 PolarHBondContact O-N 3.41Å; L894-W898 VanDerWaalsContact O-N 3.09Å; F895-W898 PolarHBondContact O-N 3.21Å; F896-W898 VanDerWaalsContact C-N 3.29Å; F896-W898 PolarHBondContact O-N 2.75Å; W898-Y901 WeakPolarHBondContact O-CB 3.49Å; W898-Y901 PolarHBondContact O-N 3.4Å; W898-I902 HydrophobicContact CD2-CD1 3.81Å; W898-I902 HydrophobicContact CE3-CD1 4.13Å; W898-I902 HydrophobicContact CH2-CD1 3.56Å; W898-I902 HydrophobicContact CZ2-CD1 3.17Å; W898-I902 HydrophobicContact CZ3-CD1 4.01Å; W898-I902 PolarHBondContact O-N 3.16Å
899	F	96.1	Very high	93.7	Very high	124 Å²	124	45.1 Å²	45.1	54%	0.544	23%	0.227	S	C	.	.	H	α-helix	trans	-62.6	-45.1	176.3	179.4	-96.2	0	0	0	111.9	F895 F896 Y901 I902 L903	F895-F899 PolarHBondContact O-N 2.92Å; F896-F899 PolarHBondContact O-N 3.33Å; F899-Y901 VanDerWaalsContact C-N 3.3Å; F899-Y901 PolarHBondContact O-N 3.12Å; F899-I902 PolarHBondContact O-N 3.12Å; F899-L903 HydrophobicContact CE1-CD2 4.5Å; F899-L903 WeakPolarHBondContact O-CB 3.42Å; F899-L903 PolarHBondContact O-N 3.45Å
900	V	95.8	Very high	93.2	Very high	30 Å²	30	43.9 Å²	43.9	18%	0.182	22%	0.217	C	C	.	.	H	α-helix	trans	-62.6	-39.5	176.1	174.2	0	0	0	0	110.8	F860 F896 L897 L903 L904	F860-V900 HydrophobicContact CE2-CB 4.17Å; F860-V900 HydrophobicContact CE2-CG1 3.84Å; F860-V900 HydrophobicContact CZ-CB 4.47Å; F860-V900 HydrophobicContact CZ-CG1 3.72Å; F896-V900 HydrophobicContact CD1-CG2 4.19Å; F896-V900 HydrophobicContact CD2-CG2 4.12Å; F896-V900 HydrophobicContact CE1-CG2 3.75Å; F896-V900 HydrophobicContact CE2-CG2 3.67Å; F896-V900 HydrophobicContact CG-CG2 4.37Å; F896-V900 HydrophobicContact CZ-CG2 3.47Å; F896-V900 VanDerWaalsContact CZ-CG2 3.47Å; F896-V900 VanDerWaalsContact O-CG2 3.32Å; F896-V900 WeakPolarHBondContact O-CG2 3.33Å; F896-V900 PolarHBondContact O-N 2.9Å; L897-V900 PolarHBondContact O-N 2.97Å; V900-L903 PolarHBondContact O-N 3.09Å; V900-L904 HydrophobicContact CG1-CD1 3.83Å; V900-L904 HydrophobicContact CG1-CG 4.14Å; V900-L904 WeakPolarHBondContact O-CB 3.43Å; V900-L904 VanDerWaalsContact O-CG 3.29Å; V900-L904 WeakPolarHBondContact O-CG 3.47Å; V900-L904 PolarHBondContact O-N 2.93Å
901	Y	96	Very high	92.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.5	-49.6	175.6	162.4	-102.7	0	0	0	111.8	V154 A158 I781 S853 T856 L897 W898 F899 L903 L904 A905	V154-Y901 WeakPolarHBondContact CG1-OH 3.09Å; A158-Y901 HydrophobicContact CB-CD1 3.69Å; A158-Y901 HydrophobicContact CB-CE1 3.43Å; A158-Y901 VanDerWaalsContact CB-CE1 3.43Å; A158-Y901 HydrophobicContact CB-CG 4.37Å; I781-Y901 HydrophobicContact CG2-CE1 3.56Å; S853-Y901 PolarHBondContact OG-OH 2.82Å; T856-Y901 HydrophobicContact CG2-CD2 4.02Å; L897-Y901 VanDerWaalsContact O-CB 3.27Å; L897-Y901 WeakPolarHBondContact O-CB 3.16Å; L897-Y901 PolarHBondContact O-N 3.02Å; W898-Y901 WeakPolarHBondContact O-CB 3.49Å; W898-Y901 PolarHBondContact O-N 3.4Å; F899-Y901 VanDerWaalsContact C-N 3.3Å; F899-Y901 PolarHBondContact O-N 3.12Å; Y901-L903 VanDerWaalsContact C-N 3.32Å; Y901-L903 PolarHBondContact O-N 2.82Å; Y901-L904 PolarHBondContact O-N 2.82Å; Y901-A905 VanDerWaalsContact O-CB 3.29Å; Y901-A905 WeakPolarHBondContact O-CB 3.16Å; Y901-A905 PolarHBondContact O-N 2.87Å
902	I	93.7	Very high	91.8	Very high	34 Å²	34	51 Å²	51	17%	0.174	26%	0.255	C	S	.	.	H	α-helix	trans	-60.8	-43.9	176.5	-72.4	174.5	0	0	0	110.9	I781 T782 W898 F899 G906	I781-I902 HydrophobicContact CG2-CG1 4.45Å; T782-I902 HydrophobicContact CG2-CD1 4.23Å; T782-I902 HydrophobicContact CG2-CG1 4.34Å; T782-I902 HydrophobicContact CG2-CG2 3.65Å; W898-I902 HydrophobicContact CD2-CD1 3.81Å; W898-I902 HydrophobicContact CE3-CD1 4.13Å; W898-I902 HydrophobicContact CH2-CD1 3.56Å; W898-I902 HydrophobicContact CZ2-CD1 3.17Å; W898-I902 HydrophobicContact CZ3-CD1 4.01Å; W898-I902 PolarHBondContact O-N 3.16Å; F899-I902 PolarHBondContact O-N 3.12Å; I902-G906 PolarHBondContact O-N 3.45Å
903	L	93	Very high	91	Very high	82 Å²	82	49.8 Å²	49.8	43%	0.429	24%	0.242	S	C	.	.	H	α-helix	trans	-60.6	-50.2	179.5	-178.8	65.9	0	0	0	111	F899 V900 Y901 G906 L907	F899-L903 HydrophobicContact CE1-CD2 4.5Å; F899-L903 WeakPolarHBondContact O-CB 3.42Å; F899-L903 PolarHBondContact O-N 3.45Å; V900-L903 PolarHBondContact O-N 3.09Å; Y901-L903 VanDerWaalsContact C-N 3.32Å; Y901-L903 PolarHBondContact O-N 2.82Å; L903-G906 PolarHBondContact O-N 2.79Å; L903-L907 HydrophobicContact CD1-CD1 4.09Å; L903-L907 HydrophobicContact CD1-CG 4.18Å; L903-L907 HydrophobicContact CG-CD1 3.95Å; L903-L907 HydrophobicContact CG-CG 4.39Å; L903-L907 WeakPolarHBondContact O-CB 3.49Å; L903-L907 WeakPolarHBondContact O-CG 3.34Å; L903-L907 PolarHBondContact O-N 3.28Å
904	L	93.4	Very high	89.6	Confident	47 Å²	47	53.5 Å²	53.5	25%	0.246	26%	0.26	C	S	.	.	H	α-helix	trans	-63.5	-47.5	179.9	-69.6	176.1	0	0	0	111.6	F852 T856 F860 V900 Y901 G906 L907 E908 I913	F852-L904 HydrophobicContact CE1-CB 4.13Å; F852-L904 WeakPolarHBondContact CE1-O 3.36Å; F852-L904 HydrophobicContact CZ-CB 4.36Å; T856-L904 HydrophobicContact CG2-CB 4.46Å; T856-L904 HydrophobicContact CG2-CD1 4Å; F860-L904 HydrophobicContact CE2-CD1 4.44Å; F860-L904 HydrophobicContact CZ-CD1 4.01Å; V900-L904 HydrophobicContact CG1-CD1 3.83Å; V900-L904 HydrophobicContact CG1-CG 4.14Å; V900-L904 WeakPolarHBondContact O-CB 3.43Å; V900-L904 VanDerWaalsContact O-CG 3.29Å; V900-L904 WeakPolarHBondContact O-CG 3.47Å; V900-L904 PolarHBondContact O-N 2.93Å; Y901-L904 PolarHBondContact O-N 2.82Å; L904-G906 VanDerWaalsContact C-N 3.27Å; L904-G906 PolarHBondContact O-N 2.91Å; L904-L907 PolarHBondContact O-N 2.89Å; L904-E908 PolarHBondContact O-N 3.19Å; L904-I913 HydrophobicContact CD2-CD1 3.8Å
905	A	90.3	Very high	88.2	Confident	2 Å²	2	54.5 Å²	54.5	2%	0.017	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-36	177.8	0	0	0	0	0	111.9	I781 Y901 N909	I781-A905 HydrophobicContact CD1-CB 4.4Å; Y901-A905 VanDerWaalsContact O-CB 3.29Å; Y901-A905 WeakPolarHBondContact O-CB 3.16Å; Y901-A905 PolarHBondContact O-N 2.87Å; A905-N909 WeakPolarHBondContact O-CB 3.47Å; A905-N909 PolarHBondContact O-N 3.43Å; A905-N909 VanDerWaalsContact O-N 3.16Å; A905-N909 PolarHBondContact O-ND2 2.89Å
906	G	88.6	Confident	86.4	Confident	13 Å²	13	53.2 Å²	53.2	13%	0.134	27%	0.265	C	S	.	.	H	α-helix	trans	-67.7	-48.9	174	0	0	0	0	0	112.3	I902 L903 L904 E908 N909 Y910	I902-G906 PolarHBondContact O-N 3.45Å; L903-G906 PolarHBondContact O-N 2.79Å; L904-G906 VanDerWaalsContact C-N 3.27Å; L904-G906 PolarHBondContact O-N 2.91Å; G906-E908 VanDerWaalsContact C-N 3.34Å; G906-E908 PolarHBondContact O-N 2.73Å; G906-N909 PolarHBondContact O-N 2.92Å; G906-Y910 WeakPolarHBondContact O-CD2 3.36Å; G906-Y910 PolarHBondContact O-N 2.83Å
907	L	88.6	Confident	85.8	Confident	50 Å²	50	50.1 Å²	50.1	26%	0.262	25%	0.253	S	S	.	.	H	α-helix	trans	-62.8	-38.8	-178.8	-70.8	175.9	0	0	0	112.6	L903 L904 Y910 C911 I912 I913	L903-L907 HydrophobicContact CD1-CD1 4.09Å; L903-L907 HydrophobicContact CD1-CG 4.18Å; L903-L907 HydrophobicContact CG-CD1 3.95Å; L903-L907 HydrophobicContact CG-CG 4.39Å; L903-L907 WeakPolarHBondContact O-CB 3.49Å; L903-L907 WeakPolarHBondContact O-CG 3.34Å; L903-L907 PolarHBondContact O-N 3.28Å; L904-L907 PolarHBondContact O-N 2.89Å; L907-Y910 PolarHBondContact O-N 2.85Å; L907-C911 PolarHBondContact O-N 2.81Å; L907-I912 HydrophobicContact CB-CB 4.32Å; L907-I912 HydrophobicContact CD2-CB 4.14Å; L907-I912 HydrophobicContact CD2-CD1 3.56Å; L907-I912 HydrophobicContact CD2-CG1 4.44Å; L907-I912 HydrophobicContact CD2-CG2 4.05Å; L907-I912 WeakPolarHBondContact O-CB 3.36Å; L907-I912 PolarHBondContact O-N 3.11Å; L907-I913 HydrophobicContact CB-CD1 3.67Å; L907-I913 HydrophobicContact CB-CG1 3.94Å; L907-I913 HydrophobicContact CD1-CD1 3.8Å; L907-I913 HydrophobicContact CD1-CG1 4.46Å; L907-I913 HydrophobicContact CG-CD1 4.41Å; L907-I913 PolarHBondContact O-N 2.97Å
908	E	87.2	Confident	85.3	Confident	17 Å²	17	52.2 Å²	52.2	8%	0.079	26%	0.263	C	S	.	.	H	α-helix	trans	-67	-43.3	174.2	-176.2	-84.7	171.3	0	0	111.5	S849 F852 L904 G906 Y910 C911	S849-E908 VanDerWaalsContact CA-OE2 3.24Å; S849-E908 WeakPolarHBondContact CA-OE2 3.4Å; S849-E908 WeakPolarHBondContact CB-OE2 3.36Å; F852-E908 HydrophobicContact CB-CG 4Å; F852-E908 HydrophobicContact CD1-CB 3.54Å; F852-E908 HydrophobicContact CD1-CG 3.66Å; F852-E908 HydrophobicContact CD2-CB 4.45Å; F852-E908 HydrophobicContact CD2-CG 3.93Å; F852-E908 HydrophobicContact CE1-CB 3.58Å; F852-E908 HydrophobicContact CE1-CG 4.1Å; F852-E908 HydrophobicContact CE2-CB 4.46Å; F852-E908 HydrophobicContact CE2-CG 4.32Å; F852-E908 HydrophobicContact CG-CB 4.01Å; F852-E908 HydrophobicContact CG-CG 3.57Å; F852-E908 HydrophobicContact CZ-CB 4.06Å; F852-E908 HydrophobicContact CZ-CG 4.4Å; L904-E908 PolarHBondContact O-N 3.19Å; G906-E908 VanDerWaalsContact C-N 3.34Å; G906-E908 PolarHBondContact O-N 2.73Å; E908-Y910 PolarHBondContact O-N 2.9Å; E908-C911 PolarHBondContact O-N 3.18Å
909	N	84.7	Confident	84.6	Confident	6 Å²	6	52.2 Å²	52.2	3%	0.032	27%	0.267	C	S	.	.	H	α-helix	trans	-59.3	-21.9	176.6	-93.2	-69.1	0	0	0	113.2	S30 V778 S849 A905 G906	S30-N909 VanDerWaalsContact CB-O 3.28Å; S30-N909 WeakPolarHBondContact CB-O 3.49Å; S30-N909 PolarHBondContact OG-O 2.75Å; V778-N909 HydrophobicContact CG2-CB 3.7Å; S849-N909 WeakPolarHBondContact CB-OD1 3.46Å; S849-N909 PolarHBondContact OG-OD1 3.47Å; A905-N909 WeakPolarHBondContact O-CB 3.47Å; A905-N909 PolarHBondContact O-N 3.43Å; A905-N909 VanDerWaalsContact O-N 3.16Å; A905-N909 PolarHBondContact O-ND2 2.89Å; G906-N909 PolarHBondContact O-N 2.92Å
910	Y	83.7	Confident	84	Confident	84 Å²	84	47.9 Å²	47.9	33%	0.329	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	14.2	175.1	-68	-70.1	0	0	0	113.7	C28 G773 L774 T775 V778 G906 L907 E908 I912	C28-Y910 VanDerWaalsContact SG-C 3.54Å; G773-Y910 PolarHBondContact O-OH 2.93Å; G773-Y910 VanDerWaalsContact O-OH 3.09Å; L774-Y910 WeakPolarHBondContact CA-OH 3.27Å; L774-Y910 WeakPolarHBondContact CD2-OH 3.41Å; T775-Y910 HydrophobicContact CG2-CE1 4.48Å; V778-Y910 HydrophobicContact CG2-CE2 4.45Å; G906-Y910 WeakPolarHBondContact O-CD2 3.36Å; G906-Y910 PolarHBondContact O-N 2.83Å; L907-Y910 PolarHBondContact O-N 2.85Å; E908-Y910 PolarHBondContact O-N 2.9Å; Y910-I912 PolarHBondContact O-N 3.1Å; Y910-I912 VanDerWaalsContact O-N 3.16Å
911	C	79.9	Confident	83.2	Confident	43 Å²	43	49.1 Å²	49.1	29%	0.291	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	27.8	-175.8	-58.6	0	0	0	0	114.3	C28 L907 E908	C28-C911 VanDerWaalsContact CA-SG 3.57Å; C28-C911 HydrophobicContact CB-CB 3.57Å; C28-C911 WeakPolarHBondContact CB-SG 3.32Å; C28-C911 WeakPolarHBondContact SG-CB 3.49Å; C28-C911 PolarHBondContact SG-N 3.05Å; C28-C911 VanDerWaalsContact SG-N 3.38Å; C28-C911 CovalentContact SG-SG 2.01Å; C28-C911 PolarHBondContact SG-SG 3.06Å; L907-C911 PolarHBondContact O-N 2.81Å; E908-C911 PolarHBondContact O-N 3.18Å
912	I	79.2	Confident	82.4	Confident	118 Å²	118	52.3 Å²	52.3	61%	0.605	27%	0.272	S	S	*	.	S	Bend	trans	-77.5	-36.4	171.9	-62	167.8	0	0	0	109.1	L907 Y910	L907-I912 HydrophobicContact CB-CB 4.32Å; L907-I912 HydrophobicContact CD2-CB 4.14Å; L907-I912 HydrophobicContact CD2-CD1 3.56Å; L907-I912 HydrophobicContact CD2-CG1 4.44Å; L907-I912 HydrophobicContact CD2-CG2 4.05Å; L907-I912 WeakPolarHBondContact O-CB 3.36Å; L907-I912 PolarHBondContact O-N 3.11Å; Y910-I912 PolarHBondContact O-N 3.1Å; Y910-I912 VanDerWaalsContact O-N 3.16Å
913	I	80	Confident	81.6	Confident	54 Å²	54	53.6 Å²	53.6	28%	0.277	28%	0.279	S	S	.	.	S	Bend	trans	-107.8	137.4	169.5	-61.6	174.1	0	0	0	107.4	L904 L907 G915	L904-I913 HydrophobicContact CD2-CD1 3.8Å; L907-I913 HydrophobicContact CB-CD1 3.67Å; L907-I913 HydrophobicContact CB-CG1 3.94Å; L907-I913 HydrophobicContact CD1-CD1 3.8Å; L907-I913 HydrophobicContact CD1-CG1 4.46Å; L907-I913 HydrophobicContact CG-CD1 4.41Å; L907-I913 PolarHBondContact O-N 2.97Å; I913-G915 PolarHBondContact O-N 3.04Å
914	E	69	Low	80.7	Confident	157 Å²	157	51.5 Å²	51.5	73%	0.734	27%	0.267	S	S	*	.			trans	-75.7	118.5	171.1	-69.5	-178	175.7	0	0	109.2
915	G	67.1	Low	79.6	Confident	21 Å²	21	51.8 Å²	51.8	22%	0.216	27%	0.269	C	S	.	.			trans	-93.2	-131.5	175.4	0	0	0	0	0	112.4	I913	I913-G915 PolarHBondContact O-N 3.04Å
916	F	57.5	Low	78.7	Confident	57 Å²	57	56.4 Å²	56.4	25%	0.25	29%	0.292	C	S	.	.			trans	-88.2	0	175	-71.1	-75.4	0	0	0	113.4	Y201 G851 F852	Y201-F916 HydrophobicContact CD2-CZ 4.39Å; Y201-F916 AromaticContact CE2-CE1 3.86Å; Y201-F916 HydrophobicContact CE2-CE1 3.86Å; Y201-F916 HydrophobicContact CE2-CE2 4.05Å; Y201-F916 AromaticContact CE2-CZ 3.41Å; Y201-F916 HydrophobicContact CE2-CZ 3.41Å; Y201-F916 VanDerWaalsContact CE2-CZ 3.41Å; G851-F916 WeakPolarHBondContact O-CE2 3.4Å; F852-F916 HydrophobicContact CB-CD2 4.1Å; F852-F916 HydrophobicContact CB-CE2 4.32Å

Retrieved 916 of 916 residues in 797.8 ms (Link to these results)

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